*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 4 1a6d_c00 THERMOSOME user 1 4 # 1 A 63 ASP A 21 ASP~? 10.21 CL CL A 205 A 96 THR A 56 THR^? 8.72 CL CL A 205 A 97 THR A 9 THR^? 12.15 CL CL A 204 A 390 ASP A 25 ASP~? 15.40 CL CL A 205 coo 16.18 44.42 -24.56 14.59 45.14 -25.79 17.65 20.12 5.81 16.27 21.08 7.00 coo 9.05 49.19 -22.25 9.14 47.35 -23.29 15.57 10.73 4.16 14.47 11.95 5.56 coo 10.51 49.37 -18.77 12.36 48.66 -18.03 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 17.04 49.84 -29.27 15.57 48.57 -28.45 20.32 22.02 0.83 20.02 22.72 2.82 ULMN 4 1a6d_c00 THERMOSOME user 2 4 # 2 A 63 ASP A 22 ASP~? 13.54 MG MG A 201 A 96 THR A 9 THR^? 12.15 CL CL A 204 A 97 THR A 56 THR^? 8.72 CL CL A 205 A 390 ASP A 25 ASP~? 15.40 CL CL A 205 coo 16.18 44.42 -24.56 14.59 45.14 -25.79 20.90 16.89 3.17 22.62 16.55 2.02 coo 9.05 49.19 -22.25 9.14 47.35 -23.29 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 10.51 49.37 -18.77 12.36 48.66 -18.03 15.57 10.73 4.16 14.47 11.95 5.56 coo 17.04 49.84 -29.27 15.57 48.57 -28.45 20.32 22.02 0.83 20.02 22.72 2.82 ULMN 4 1a6d_c00 THERMOSOME user 3 4 # 3 A 63 ASP A 22 ASP~? 13.54 MG MG A 201 A 96 THR A 56 THR^? 8.72 CL CL A 205 A 97 THR A 9 THR^? 12.15 CL CL A 204 A 390 ASP A 21 ASP~? 10.21 CL CL A 205 coo 16.18 44.42 -24.56 14.59 45.14 -25.79 20.90 16.89 3.17 22.62 16.55 2.02 coo 9.05 49.19 -22.25 9.14 47.35 -23.29 15.57 10.73 4.16 14.47 11.95 5.56 coo 10.51 49.37 -18.77 12.36 48.66 -18.03 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 17.04 49.84 -29.27 15.57 48.57 -28.45 17.65 20.12 5.81 16.27 21.08 7.00 ULMN 4 1a6d_c00 THERMOSOME user 4 4 # 4 A 63 ASP A 22 ASP~? 13.54 MG MG A 201 A 96 THR A 56 THR^? 8.72 CL CL A 205 A 97 THR A 9 THR^? 12.15 CL CL A 204 A 390 ASP A 25 ASP~? 15.40 CL CL A 205 coo 16.18 44.42 -24.56 14.59 45.14 -25.79 20.90 16.89 3.17 22.62 16.55 2.02 coo 9.05 49.19 -22.25 9.14 47.35 -23.29 15.57 10.73 4.16 14.47 11.95 5.56 coo 10.51 49.37 -18.77 12.36 48.66 -18.03 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 17.04 49.84 -29.27 15.57 48.57 -28.45 20.32 22.02 0.83 20.02 22.72 2.82 1a6d_c00 source 1a6d THERMOSOME : 4 hits 1a6d_c00 naa= 4 ULMN 4 1a6d_c01 THERMOSOME user 1 4 # 1 B 62 ASP A 21 ASP~? 10.21 CL CL A 205 B 95 THR A 9 THR^? 12.15 CL CL A 204 B 96 THR A 56 THR^? 8.72 CL CL A 205 B 391 ASP A 25 ASP~? 15.40 CL CL A 205 coo 43.28 19.55 -23.92 42.88 20.98 -25.36 17.65 20.12 5.81 16.27 21.08 7.00 coo 41.59 28.72 -22.17 40.06 27.69 -23.27 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 42.85 27.27 -18.86 43.84 25.46 -18.26 15.57 10.73 4.16 14.47 11.95 5.56 coo 48.74 21.71 -27.93 47.43 22.77 -26.72 20.32 22.02 0.83 20.02 22.72 2.82 ULMN 4 1a6d_c01 THERMOSOME user 2 4 # 2 B 62 ASP A 22 ASP~? 13.54 MG MG A 201 B 95 THR A 9 THR^? 12.15 CL CL A 204 B 96 THR A 56 THR^? 8.72 CL CL A 205 B 391 ASP A 25 ASP~? 15.40 CL CL A 205 coo 43.28 19.55 -23.92 42.88 20.98 -25.36 20.90 16.89 3.17 22.62 16.55 2.02 coo 41.59 28.72 -22.17 40.06 27.69 -23.27 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 42.85 27.27 -18.86 43.84 25.46 -18.26 15.57 10.73 4.16 14.47 11.95 5.56 coo 48.74 21.71 -27.93 47.43 22.77 -26.72 20.32 22.02 0.83 20.02 22.72 2.82 ULMN 4 1a6d_c01 THERMOSOME user 3 4 # 3 B 62 ASP A 22 ASP~? 13.54 MG MG A 201 B 95 THR A 56 THR^? 8.72 CL CL A 205 B 96 THR A 9 THR^? 12.15 CL CL A 204 B 391 ASP A 21 ASP~? 10.21 CL CL A 205 coo 43.28 19.55 -23.92 42.88 20.98 -25.36 20.90 16.89 3.17 22.62 16.55 2.02 coo 41.59 28.72 -22.17 40.06 27.69 -23.27 15.57 10.73 4.16 14.47 11.95 5.56 coo 42.85 27.27 -18.86 43.84 25.46 -18.26 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 48.74 21.71 -27.93 47.43 22.77 -26.72 17.65 20.12 5.81 16.27 21.08 7.00 ULMN 4 1a6d_c01 THERMOSOME user 4 4 # 4 B 62 ASP A 22 ASP~? 13.54 MG MG A 201 B 95 THR A 56 THR^? 8.72 CL CL A 205 B 96 THR A 9 THR^? 12.15 CL CL A 204 B 391 ASP A 25 ASP~? 15.40 CL CL A 205 coo 43.28 19.55 -23.92 42.88 20.98 -25.36 20.90 16.89 3.17 22.62 16.55 2.02 coo 41.59 28.72 -22.17 40.06 27.69 -23.27 15.57 10.73 4.16 14.47 11.95 5.56 coo 42.85 27.27 -18.86 43.84 25.46 -18.26 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 48.74 21.71 -27.93 47.43 22.77 -26.72 20.32 22.02 0.83 20.02 22.72 2.82 1a6d_c01 source 1a6d THERMOSOME : 4 hits 1a6d_c01 naa= 4 ULMN 4 1h7o_c00 5-AMINOLAEVULINIC ACID DEHYDRATASE user 1 4 # 1 A 131 ASP A 32 ASP.? 15.72 O2' RBF A 200 A 179 SER A 67 SER.? 16.25 NA NA A 203 A 210 LYS A 4 LYS^? 8.98 NA NA A 203 A 263 LYS A 5 LYS^? 4.39 MG MG A 202 coo 15.28 27.01 21.57 16.48 25.33 21.25 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 16.21 20.65 20.59 17.61 22.54 21.18 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 18.09 17.00 14.23 20.70 20.73 18.57 7.12 18.69 -11.16 11.60 17.54 -15.41 coo 17.39 20.36 11.09 19.81 23.46 16.09 8.77 16.47 -8.53 3.81 14.84 -4.92 ULMN 4 1h7o_c00 5-AMINOLAEVULINIC ACID DEHYDRATASE user 2 4 # 2 A 131 ASP A 65 ASP.? 14.44 O4' RBF A 200 A 179 SER A 67 SER.? 16.25 NA NA A 203 A 210 LYS A 4 LYS^? 8.98 NA NA A 203 A 263 LYS A 5 LYS^? 4.39 MG MG A 202 coo 15.28 27.01 21.57 16.48 25.33 21.25 6.12 28.97 -15.23 4.74 30.16 -16.32 coo 16.21 20.65 20.59 17.61 22.54 21.18 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 18.09 17.00 14.23 20.70 20.73 18.57 7.12 18.69 -11.16 11.60 17.54 -15.41 coo 17.39 20.36 11.09 19.81 23.46 16.09 8.77 16.47 -8.53 3.81 14.84 -4.92 1h7o_c00 source 1h7o 5-AMINOLAEVULINIC ACID DEHYDRATASE : 2 hits 1h7o_c00 naa= 4 ULMN 4 1q3q_c00 THERMOSOME ALPHA SUBUNIT user 1 4 # 1 A 64 ASP A 22 ASP~? 13.54 MG MG A 201 A 97 THR A 9 THR^? 12.15 CL CL A 204 A 98 THR A 56 THR^? 8.72 CL CL A 205 A 393 ASP A 25 ASP~? 15.40 CL CL A 205 coo 59.86 10.34 27.30 60.35 12.00 28.50 20.90 16.89 3.17 22.62 16.55 2.02 coo 58.74 18.44 26.67 59.40 16.69 27.77 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 57.84 17.57 23.09 57.09 15.82 22.10 15.57 10.73 4.16 14.47 11.95 5.56 coo 54.80 12.16 32.55 56.65 12.25 31.53 20.32 22.02 0.83 20.02 22.72 2.82 1q3q_c00 source 1q3q THERMOSOME ALPHA SUBUNIT : 1 hits 1q3q_c00 naa= 4 ULMN 4 1q3q_c01 THERMOSOME ALPHA SUBUNIT user 1 4 # 1 B 64 ASP A 22 ASP~? 13.54 MG MG A 201 B 97 THR A 9 THR^? 12.15 CL CL A 204 B 98 THR A 56 THR^? 8.72 CL CL A 205 B 393 ASP A 25 ASP~? 15.40 CL CL A 205 coo 65.73 -24.45 27.34 64.91 -22.86 28.45 20.90 16.89 3.17 22.62 16.55 2.02 coo 59.15 -19.67 26.64 60.83 -20.49 27.71 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 59.06 -20.82 23.02 59.87 -22.53 21.97 15.57 10.73 4.16 14.47 11.95 5.56 coo 60.77 -26.95 32.48 62.05 -25.69 31.35 20.32 22.02 0.83 20.02 22.72 2.82 1q3q_c01 source 1q3q THERMOSOME ALPHA SUBUNIT : 1 hits 1q3q_c01 naa= 4 ULMN 4 1q3q_c02 THERMOSOME ALPHA SUBUNIT user 1 4 # 1 C 64 ASP A 22 ASP~? 13.54 MG MG A 201 C 97 THR A 9 THR^? 12.15 CL CL A 204 C 98 THR A 56 THR^? 8.72 CL CL A 205 C 393 ASP A 25 ASP~? 15.40 CL CL A 205 coo 78.19 37.47 -17.60 76.77 36.40 -18.75 20.90 16.89 3.17 22.62 16.55 2.02 coo 70.28 35.53 -16.93 72.19 35.63 -17.95 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 70.77 36.63 -13.33 72.12 37.96 -12.27 15.57 10.73 4.16 14.47 11.95 5.56 coo 74.68 41.54 -22.78 75.15 39.79 -21.68 20.32 22.02 0.83 20.02 22.72 2.82 1q3q_c02 source 1q3q THERMOSOME ALPHA SUBUNIT : 1 hits 1q3q_c02 naa= 4 ULMN 4 1q3q_c03 THERMOSOME ALPHA SUBUNIT user 1 4 # 1 D 64 ASP A 22 ASP~? 13.54 MG MG A 201 D 97 THR A 9 THR^? 12.15 CL CL A 204 D 98 THR A 56 THR^? 8.72 CL CL A 205 D 393 ASP A 25 ASP~? 15.40 CL CL A 205 coo 59.28 7.65 -17.60 59.05 5.92 -18.77 20.90 16.89 3.17 22.62 16.55 2.02 coo 55.19 0.63 -16.84 56.48 2.01 -17.90 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 54.63 1.67 -13.23 54.72 3.56 -12.17 15.57 10.73 4.16 14.47 11.95 5.56 coo 53.92 8.02 -22.70 55.50 7.17 -21.57 20.32 22.02 0.83 20.02 22.72 2.82 1q3q_c03 source 1q3q THERMOSOME ALPHA SUBUNIT : 1 hits 1q3q_c03 naa= 4 ULMN 4 1rk2_c00 RIBOKINASE user 1 4 # 1 A 252 ALA A 19 ALA~? 9.25 CL CL A 205 A 253 ALA A 20 ALA~? 9.02 CL CL A 205 A 254 GLY A 10 GLY^? 13.65 CL CL A 205 A 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 19.22 5.40 78.99 19.00 6.90 79.25 18.80 14.56 5.96 18.67 12.96 6.09 coo 22.30 4.08 77.15 23.28 3.04 77.64 15.47 15.90 4.49 14.13 16.06 5.24 coo 20.04 2.01 74.92 19.93 2.78 75.17 19.39 13.48 1.48 19.22 12.65 1.65 coo 16.76 5.52 75.75 15.62 4.24 76.95 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c00 RIBOKINASE user 2 4 # 2 A 252 ALA A 20 ALA~? 9.02 CL CL A 205 A 253 ALA A 19 ALA~? 9.25 CL CL A 205 A 254 GLY A 10 GLY^? 13.65 CL CL A 205 A 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 19.22 5.40 78.99 19.00 6.90 79.25 15.47 15.90 4.49 14.13 16.06 5.24 coo 22.30 4.08 77.15 23.28 3.04 77.64 18.80 14.56 5.96 18.67 12.96 6.09 coo 20.04 2.01 74.92 19.93 2.78 75.17 19.39 13.48 1.48 19.22 12.65 1.65 coo 16.76 5.52 75.75 15.62 4.24 76.95 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c00 RIBOKINASE user 3 4 # 3 A 252 ALA A 20 ALA~? 9.02 CL CL A 205 A 253 ALA A 23 ALA~? 13.29 NA NA A 203 A 254 GLY A 10 GLY^? 13.65 CL CL A 205 A 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 19.22 5.40 78.99 19.00 6.90 79.25 15.47 15.90 4.49 14.13 16.06 5.24 coo 22.30 4.08 77.15 23.28 3.04 77.64 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 20.04 2.01 74.92 19.93 2.78 75.17 19.39 13.48 1.48 19.22 12.65 1.65 coo 16.76 5.52 75.75 15.62 4.24 76.95 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c00 RIBOKINASE user 4 4 # 4 A 252 ALA A 23 ALA~? 13.29 NA NA A 203 A 253 ALA A 20 ALA~? 9.02 CL CL A 205 A 254 GLY A 10 GLY^? 13.65 CL CL A 205 A 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 19.22 5.40 78.99 19.00 6.90 79.25 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 22.30 4.08 77.15 23.28 3.04 77.64 15.47 15.90 4.49 14.13 16.06 5.24 coo 20.04 2.01 74.92 19.93 2.78 75.17 19.39 13.48 1.48 19.22 12.65 1.65 coo 16.76 5.52 75.75 15.62 4.24 76.95 20.90 16.89 3.17 22.62 16.55 2.02 1rk2_c00 source 1rk2 RIBOKINASE : 4 hits 1rk2_c00 naa= 4 ULMN 4 1rk2_c01 RIBOKINASE user 1 4 # 1 B 252 ALA A 19 ALA~? 9.25 CL CL A 205 B 253 ALA A 20 ALA~? 9.02 CL CL A 205 B 254 GLY A 10 GLY^? 13.65 CL CL A 205 B 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 5.65 0.71 109.93 4.85 1.99 109.63 18.80 14.56 5.96 18.67 12.96 6.09 coo 4.16 -2.29 111.77 4.09 -3.72 111.27 15.47 15.90 4.49 14.13 16.06 5.24 coo 7.20 -2.36 114.01 6.78 -1.70 113.77 19.39 13.48 1.48 19.22 12.65 1.65 coo 7.39 2.43 113.17 9.13 2.23 112.02 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c01 RIBOKINASE user 2 4 # 2 B 252 ALA A 20 ALA~? 9.02 CL CL A 205 B 253 ALA A 19 ALA~? 9.25 CL CL A 205 B 254 GLY A 10 GLY^? 13.65 CL CL A 205 B 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 5.65 0.71 109.93 4.85 1.99 109.63 15.47 15.90 4.49 14.13 16.06 5.24 coo 4.16 -2.29 111.77 4.09 -3.72 111.27 18.80 14.56 5.96 18.67 12.96 6.09 coo 7.20 -2.36 114.01 6.78 -1.70 113.77 19.39 13.48 1.48 19.22 12.65 1.65 coo 7.39 2.43 113.17 9.13 2.23 112.02 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c01 RIBOKINASE user 3 4 # 3 B 252 ALA A 20 ALA~? 9.02 CL CL A 205 B 253 ALA A 23 ALA~? 13.29 NA NA A 203 B 254 GLY A 10 GLY^? 13.65 CL CL A 205 B 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 5.65 0.71 109.93 4.85 1.99 109.63 15.47 15.90 4.49 14.13 16.06 5.24 coo 4.16 -2.29 111.77 4.09 -3.72 111.27 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 7.20 -2.36 114.01 6.78 -1.70 113.77 19.39 13.48 1.48 19.22 12.65 1.65 coo 7.39 2.43 113.17 9.13 2.23 112.02 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c01 RIBOKINASE user 4 4 # 4 B 252 ALA A 23 ALA~? 13.29 NA NA A 203 B 253 ALA A 20 ALA~? 9.02 CL CL A 205 B 254 GLY A 10 GLY^? 13.65 CL CL A 205 B 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 5.65 0.71 109.93 4.85 1.99 109.63 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 4.16 -2.29 111.77 4.09 -3.72 111.27 15.47 15.90 4.49 14.13 16.06 5.24 coo 7.20 -2.36 114.01 6.78 -1.70 113.77 19.39 13.48 1.48 19.22 12.65 1.65 coo 7.39 2.43 113.17 9.13 2.23 112.02 20.90 16.89 3.17 22.62 16.55 2.02 1rk2_c01 source 1rk2 RIBOKINASE : 4 hits 1rk2_c01 naa= 4 ULMN 4 1rk2_c02 RIBOKINASE user 1 4 # 1 C 252 ALA A 19 ALA~? 9.25 CL CL A 205 C 253 ALA A 20 ALA~? 9.02 CL CL A 205 C 254 GLY A 10 GLY^? 13.65 CL CL A 205 C 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 11.35 5.28 194.49 12.50 6.27 194.18 18.80 14.56 5.96 18.67 12.96 6.09 coo 8.26 6.36 196.43 6.81 6.31 195.96 15.47 15.90 4.49 14.13 16.06 5.24 coo 8.52 3.23 198.55 9.13 3.73 198.31 19.39 13.48 1.48 19.22 12.65 1.65 coo 13.27 3.50 197.59 13.27 1.76 196.39 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c02 RIBOKINASE user 2 4 # 2 C 252 ALA A 20 ALA~? 9.02 CL CL A 205 C 253 ALA A 19 ALA~? 9.25 CL CL A 205 C 254 GLY A 10 GLY^? 13.65 CL CL A 205 C 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 11.35 5.28 194.49 12.50 6.27 194.18 15.47 15.90 4.49 14.13 16.06 5.24 coo 8.26 6.36 196.43 6.81 6.31 195.96 18.80 14.56 5.96 18.67 12.96 6.09 coo 8.52 3.23 198.55 9.13 3.73 198.31 19.39 13.48 1.48 19.22 12.65 1.65 coo 13.27 3.50 197.59 13.27 1.76 196.39 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c02 RIBOKINASE user 3 4 # 3 C 252 ALA A 20 ALA~? 9.02 CL CL A 205 C 253 ALA A 23 ALA~? 13.29 NA NA A 203 C 254 GLY A 10 GLY^? 13.65 CL CL A 205 C 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 11.35 5.28 194.49 12.50 6.27 194.18 15.47 15.90 4.49 14.13 16.06 5.24 coo 8.26 6.36 196.43 6.81 6.31 195.96 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 8.52 3.23 198.55 9.13 3.73 198.31 19.39 13.48 1.48 19.22 12.65 1.65 coo 13.27 3.50 197.59 13.27 1.76 196.39 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c02 RIBOKINASE user 4 4 # 4 C 252 ALA A 23 ALA~? 13.29 NA NA A 203 C 253 ALA A 20 ALA~? 9.02 CL CL A 205 C 254 GLY A 10 GLY^? 13.65 CL CL A 205 C 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 11.35 5.28 194.49 12.50 6.27 194.18 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 8.26 6.36 196.43 6.81 6.31 195.96 15.47 15.90 4.49 14.13 16.06 5.24 coo 8.52 3.23 198.55 9.13 3.73 198.31 19.39 13.48 1.48 19.22 12.65 1.65 coo 13.27 3.50 197.59 13.27 1.76 196.39 20.90 16.89 3.17 22.62 16.55 2.02 1rk2_c02 source 1rk2 RIBOKINASE : 4 hits 1rk2_c02 naa= 4 ULMN 4 1rk2_c03 RIBOKINASE user 1 4 # 1 D 252 ALA A 19 ALA~? 9.25 CL CL A 205 D 253 ALA A 20 ALA~? 9.02 CL CL A 205 D 254 GLY A 10 GLY^? 13.65 CL CL A 205 D 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 15.44 -6.06 163.02 16.93 -5.92 163.28 18.80 14.56 5.96 18.67 12.96 6.09 coo 13.90 -8.94 161.04 12.81 -9.89 161.50 15.47 15.90 4.49 14.13 16.06 5.24 coo 11.98 -6.40 159.00 12.77 -6.36 159.23 19.39 13.48 1.48 19.22 12.65 1.65 coo 15.72 -3.40 159.93 14.56 -2.20 161.19 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c03 RIBOKINASE user 2 4 # 2 D 252 ALA A 20 ALA~? 9.02 CL CL A 205 D 253 ALA A 19 ALA~? 9.25 CL CL A 205 D 254 GLY A 10 GLY^? 13.65 CL CL A 205 D 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 15.44 -6.06 163.02 16.93 -5.92 163.28 15.47 15.90 4.49 14.13 16.06 5.24 coo 13.90 -8.94 161.04 12.81 -9.89 161.50 18.80 14.56 5.96 18.67 12.96 6.09 coo 11.98 -6.40 159.00 12.77 -6.36 159.23 19.39 13.48 1.48 19.22 12.65 1.65 coo 15.72 -3.40 159.93 14.56 -2.20 161.19 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c03 RIBOKINASE user 3 4 # 3 D 252 ALA A 20 ALA~? 9.02 CL CL A 205 D 253 ALA A 23 ALA~? 13.29 NA NA A 203 D 254 GLY A 10 GLY^? 13.65 CL CL A 205 D 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 15.44 -6.06 163.02 16.93 -5.92 163.28 15.47 15.90 4.49 14.13 16.06 5.24 coo 13.90 -8.94 161.04 12.81 -9.89 161.50 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 11.98 -6.40 159.00 12.77 -6.36 159.23 19.39 13.48 1.48 19.22 12.65 1.65 coo 15.72 -3.40 159.93 14.56 -2.20 161.19 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 4 1rk2_c03 RIBOKINASE user 4 4 # 4 D 252 ALA A 23 ALA~? 13.29 NA NA A 203 D 253 ALA A 20 ALA~? 9.02 CL CL A 205 D 254 GLY A 10 GLY^? 13.65 CL CL A 205 D 255 ASP A 22 ASP~? 13.54 MG MG A 201 coo 15.44 -6.06 163.02 16.93 -5.92 163.28 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 13.90 -8.94 161.04 12.81 -9.89 161.50 15.47 15.90 4.49 14.13 16.06 5.24 coo 11.98 -6.40 159.00 12.77 -6.36 159.23 19.39 13.48 1.48 19.22 12.65 1.65 coo 15.72 -3.40 159.93 14.56 -2.20 161.19 20.90 16.89 3.17 22.62 16.55 2.02 1rk2_c03 source 1rk2 RIBOKINASE : 4 hits 1rk2_c03 naa= 4 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 # 1 A 49 GLU A 13 GLU.? 5.58 MG MG A 201 A 60 ASP A 21 ASP~? 10.21 CL CL A 205 A 175 TYR A 54 TYR^? 8.76 CL CL A 205 coo 46.10 28.27 19.27 45.48 26.99 20.84 27.41 11.93 9.21 29.53 12.06 9.35 coo 56.42 28.06 12.93 55.01 27.92 14.50 17.65 20.12 5.81 16.27 21.08 7.00 coo 45.02 22.04 15.38 46.16 24.00 13.76 20.41 9.57 10.83 21.60 8.70 13.20 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 2 3 # 2 A 49 GLU A 14 GLU.? -2.64 MG MG A 201s A 60 ASP A 21 ASP~? 10.21 CL CL A 205 A 175 TYR A 54 TYR^? 8.76 CL CL A 205 coo 46.10 28.27 19.27 45.48 26.99 20.84 24.27 16.08 12.66 25.65 15.19 14.03 coo 56.42 28.06 12.93 55.01 27.92 14.50 17.65 20.12 5.81 16.27 21.08 7.00 coo 45.02 22.04 15.38 46.16 24.00 13.76 20.41 9.57 10.83 21.60 8.70 13.20 1a50_c03 source 1a50 TRYPTOPHAN SYNTHASE : 2 hits 1a50_c03 naa= 3 ULMN 3 1am5_c04 PEPSIN user 1 3 # 1 32 ASP A 32 ASP.? 15.72 O2' RBF A 200 35 SER A 67 SER.? 16.25 NA NA A 203 215 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo -7.18 8.92 145.10 -8.77 8.81 143.59 13.55 28.60 -10.29 14.56 30.41 -9.94 coo -12.30 10.35 145.24 -10.75 8.55 145.88 12.95 24.38 -14.30 14.27 25.84 -12.79 coo -8.20 12.64 138.30 -8.86 10.97 139.38 6.12 28.97 -15.23 4.74 30.16 -16.32 1am5_c04 source 1am5 PEPSIN : 1 hits 1am5_c04 naa= 3 ULMN 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 29 ASP~? 19.34 O2' RBF A 200 204 GLU A 28 GLU~? 11.92 O2' RBF A 200 289 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo -0.62 65.95 29.97 0.31 67.47 31.05 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 4.34 62.44 32.05 4.22 64.48 32.53 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 9.42 68.07 30.27 7.35 68.27 30.10 13.55 28.60 -10.29 14.56 30.41 -9.94 ULMN 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 65 ASP.? 14.44 O4' RBF A 200 204 GLU A 63 GLU^? 6.60 O4' RBF A 200 289 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo -0.62 65.95 29.97 0.31 67.47 31.05 6.12 28.97 -15.23 4.74 30.16 -16.32 coo 4.34 62.44 32.05 4.22 64.48 32.53 4.67 26.70 -10.13 3.12 27.66 -9.01 coo 9.42 68.07 30.27 7.35 68.27 30.10 13.55 28.60 -10.29 14.56 30.41 -9.94 1amy_c05 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 2 hits 1amy_c05 naa= 3 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 3 # 1 E 33 ASP A 32 ASP.? 15.72 O2' RBF A 200 E 36 SER A 67 SER.? 16.25 NA NA A 203 E 213 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 26.30 12.96 16.78 25.46 12.99 18.72 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 28.33 15.15 21.27 28.70 13.12 19.97 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 20.15 16.04 19.79 21.65 14.49 19.86 6.12 28.97 -15.23 4.74 30.16 -16.32 1apt_c04 source 1apt ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET (LYSTA IS : 1 hits 1apt_c04 naa= 3 ULMN 3 1avf_c04 GASTRICSIN user 1 3 # 1 A 32 ASP A 32 ASP.? 15.72 O2' RBF A 200 A 35 SER A 67 SER.? 16.25 NA NA A 203 A 217 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo -10.06 2.54 49.69 -8.83 3.73 50.96 13.55 28.60 -10.29 14.56 30.41 -9.94 coo -11.96 5.74 52.90 -10.55 6.74 51.22 12.95 24.38 -14.30 14.27 25.84 -12.79 coo -5.22 1.43 56.08 -5.36 2.84 54.49 6.12 28.97 -15.23 4.74 30.16 -16.32 1avf_c04 source 1avf GASTRICSIN : 1 hits 1avf_c04 naa= 3 ULMN 3 1avf_c05 GASTRICSIN user 1 3 # 1 J 32 ASP A 32 ASP.? 15.72 O2' RBF A 200 J 35 SER A 67 SER.? 16.25 NA NA A 203 J 217 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 13.55 28.60 -10.29 14.56 30.41 -9.94 coo -40.93 -20.91 21.81 -38.85 -21.36 20.65 12.95 24.38 -14.30 14.27 25.84 -12.79 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 6.12 28.97 -15.23 4.74 30.16 -16.32 1avf_c05 source 1avf GASTRICSIN : 1 hits 1avf_c05 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 16 PHE~? 6.49 CL CL A 205 A 223 ASP A 41 ASP^? -12.41 CL CL A 204s A 265 LYS A 5 LYS^? 4.39 MG MG A 202 coo 39.74 52.86 65.74 41.15 55.14 66.52 15.31 10.14 10.32 15.93 7.43 10.75 coo 30.70 47.50 67.53 29.83 49.47 67.39 12.01 5.97 1.89 11.89 3.91 2.21 coo 19.99 54.53 64.11 20.55 58.78 68.33 8.77 16.47 -8.53 3.81 14.84 -4.92 1ax4_c04 source 1ax4 TRYPTOPHANASE : 1 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 16 PHE~? 6.49 CL CL A 205 B 223 ASP A 41 ASP^? -12.41 CL CL A 204s B 265 LYS A 5 LYS^? 4.39 MG MG A 202 coo 7.48 54.94 99.62 7.67 52.27 100.42 15.31 10.14 10.32 15.93 7.43 10.75 coo 10.43 61.66 91.81 9.80 60.04 90.61 12.01 5.97 1.89 11.89 3.91 2.21 coo 5.43 58.06 80.08 8.57 53.00 79.37 8.77 16.47 -8.53 3.81 14.84 -4.92 1ax4_c05 source 1ax4 TRYPTOPHANASE : 1 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 16 PHE~? 6.49 CL CL A 205 C 223 ASP A 41 ASP^? -12.41 CL CL A 204s C 265 LYS A 5 LYS^? 4.39 MG MG A 202 coo -6.55 73.45 23.60 -6.77 71.48 21.66 15.31 10.14 10.32 15.93 7.43 10.75 coo -9.52 75.74 33.62 -8.85 73.74 33.93 12.01 5.97 1.89 11.89 3.91 2.21 coo -4.44 67.20 42.32 -7.50 62.41 40.49 8.77 16.47 -8.53 3.81 14.84 -4.92 1ax4_c06 source 1ax4 TRYPTOPHANASE : 1 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 16 PHE~? 6.49 CL CL A 205 D 223 ASP A 41 ASP^? -12.41 CL CL A 204s D 265 LYS A 5 LYS^? 4.39 MG MG A 202 coo -38.60 55.38 52.70 -40.06 57.72 53.04 15.31 10.14 10.32 15.93 7.43 10.75 coo -29.46 51.67 48.51 -28.63 53.31 49.56 12.01 5.97 1.89 11.89 3.91 2.21 coo -18.87 56.53 54.79 -19.47 62.22 53.03 8.77 16.47 -8.53 3.81 14.84 -4.92 1ax4_c07 source 1ax4 TRYPTOPHANASE : 1 hits 1ax4_c07 naa= 3 ULMN 3 1bbs_c06 RENIN user 1 3 # 1 32 ASP A 32 ASP.? 15.72 O2' RBF A 200 35 SER A 67 SER.? 16.25 NA NA A 203 215 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 61.19 45.85 78.73 62.86 45.48 77.48 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 66.00 46.17 80.29 64.31 47.92 79.91 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 63.61 40.10 74.06 64.05 42.07 74.70 6.12 28.97 -15.23 4.74 30.16 -16.32 1bbs_c06 source 1bbs RENIN : 1 hits 1bbs_c06 naa= 3 ULMN 3 1bbs_c07 RENIN user 1 3 # 1 32 ASP A 32 ASP.? 15.72 O2' RBF A 200 35 SER A 67 SER.? 16.25 NA NA A 203 215 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 61.19 45.85 78.73 62.86 45.48 77.48 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 66.00 46.17 80.29 64.31 47.92 79.91 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 63.61 40.10 74.06 64.05 42.07 74.70 6.12 28.97 -15.23 4.74 30.16 -16.32 1bbs_c07 source 1bbs RENIN : 1 hits 1bbs_c07 naa= 3 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 D 137 ARG A 26 ARG~? 15.79 NA NA A 203 D 141 THR A 9 THR^? 12.15 CL CL A 204 D 235 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo -8.33 92.80 100.06 -7.71 95.33 98.44 22.68 19.36 -4.97 23.34 18.85 -7.96 coo -9.24 93.49 108.77 -7.37 94.21 109.61 17.67 11.10 -0.93 17.74 8.97 -0.57 coo -14.64 87.74 89.51 -12.89 87.43 90.65 13.55 28.60 -10.29 14.56 30.41 -9.94 1bd3_c01 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 1 hits 1bd3_c01 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG A 26 ARG~? 15.79 NA NA A 203 C 141 THR A 9 THR^? 12.15 CL CL A 204 C 235 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo -5.79 67.26 36.83 -4.57 64.58 37.74 22.68 19.36 -4.97 23.34 18.85 -7.96 coo -6.81 68.31 28.28 -4.82 68.47 27.57 17.67 11.10 -0.93 17.74 8.97 -0.57 coo -13.01 70.96 47.58 -11.44 71.65 46.34 13.55 28.60 -10.29 14.56 30.41 -9.94 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 1 hits 1bd3_c02 naa= 3 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 B 137 ARG A 26 ARG~? 15.79 NA NA A 203 B 141 THR A 9 THR^? 12.15 CL CL A 204 B 235 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 8.13 67.41 100.27 7.18 68.35 97.45 22.68 19.36 -4.97 23.34 18.85 -7.96 coo 8.28 67.78 108.81 6.22 67.65 109.43 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 14.55 73.52 89.47 12.81 73.95 90.56 13.55 28.60 -10.29 14.56 30.41 -9.94 1bd3_c03 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 1 hits 1bd3_c03 naa= 3 ULMN 3 1bf2_c00 ISOAMYLASE user 1 3 # 1 375 ASP A 29 ASP~? 19.34 O2' RBF A 200 435 GLU A 28 GLU~? 11.92 O2' RBF A 200 510 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 88.62 69.90 41.16 89.05 70.67 43.04 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 89.52 76.11 40.17 89.01 75.16 41.97 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 84.89 77.60 46.67 85.63 75.79 46.03 13.55 28.60 -10.29 14.56 30.41 -9.94 ULMN 3 1bf2_c00 ISOAMYLASE user 2 3 # 2 375 ASP A 65 ASP.? 14.44 O4' RBF A 200 435 GLU A 63 GLU^? 6.60 O4' RBF A 200 510 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 88.62 69.90 41.16 89.05 70.67 43.04 6.12 28.97 -15.23 4.74 30.16 -16.32 coo 89.52 76.11 40.17 89.01 75.16 41.97 4.67 26.70 -10.13 3.12 27.66 -9.01 coo 84.89 77.60 46.67 85.63 75.79 46.03 13.55 28.60 -10.29 14.56 30.41 -9.94 1bf2_c00 source 1bf2 ISOAMYLASE : 2 hits 1bf2_c00 naa= 3 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 # 1 A 461 GLU A 45 GLU^? -16.49 MG MG A 201s A 503 TYR A 54 TYR^? 8.76 CL CL A 205 A 537 GLU A 13 GLU.? 5.58 MG MG A 201 coo 24.06 146.21 11.09 22.89 146.18 9.36 25.48 3.77 4.90 25.28 1.94 3.90 coo 15.91 140.69 8.32 15.71 143.39 9.13 20.41 9.57 10.83 21.60 8.70 13.20 coo 16.65 144.44 13.24 18.34 145.22 12.33 27.41 11.93 9.21 29.53 12.06 9.35 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 2 3 # 2 A 461 GLU A 51 GLU.? -3.73 MG MG A 201s A 503 TYR A 54 TYR^? 8.76 CL CL A 205 A 537 GLU A 14 GLU.? -2.64 MG MG A 201s coo 24.06 146.21 11.09 22.89 146.18 9.36 29.85 9.06 13.15 28.87 10.87 13.64 coo 15.91 140.69 8.32 15.71 143.39 9.13 20.41 9.57 10.83 21.60 8.70 13.20 coo 16.65 144.44 13.24 18.34 145.22 12.33 24.27 16.08 12.66 25.65 15.19 14.03 1bgl_c08 source 1bgl BETA-GALACTOSIDASE : 2 hits 1bgl_c08 naa= 3 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 1 3 # 1 A 451 GLU A 14 GLU.? -2.64 MG MG A 201s A 504 TYR A 54 TYR^? 8.76 CL CL A 205 A 540 GLU A 13 GLU.? 5.58 MG MG A 201 coo 81.34 87.29 87.22 82.36 86.09 88.61 24.27 16.08 12.66 25.65 15.19 14.03 coo 80.85 81.34 94.77 81.70 80.16 92.41 20.41 9.57 10.83 21.60 8.70 13.20 coo 79.94 80.46 88.84 81.11 81.36 87.27 27.41 11.93 9.21 29.53 12.06 9.35 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 2 3 # 2 A 451 GLU A 51 GLU.? -3.73 MG MG A 201s A 504 TYR A 54 TYR^? 8.76 CL CL A 205 A 540 GLU A 13 GLU.? 5.58 MG MG A 201 coo 81.34 87.29 87.22 82.36 86.09 88.61 29.85 9.06 13.15 28.87 10.87 13.64 coo 80.85 81.34 94.77 81.70 80.16 92.41 20.41 9.57 10.83 21.60 8.70 13.20 coo 79.94 80.46 88.84 81.11 81.36 87.27 27.41 11.93 9.21 29.53 12.06 9.35 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 3 3 # 3 A 451 GLU A 51 GLU.? -3.73 MG MG A 201s A 504 TYR A 54 TYR^? 8.76 CL CL A 205 A 540 GLU A 14 GLU.? -2.64 MG MG A 201s coo 81.34 87.29 87.22 82.36 86.09 88.61 29.85 9.06 13.15 28.87 10.87 13.64 coo 80.85 81.34 94.77 81.70 80.16 92.41 20.41 9.57 10.83 21.60 8.70 13.20 coo 79.94 80.46 88.84 81.11 81.36 87.27 24.27 16.08 12.66 25.65 15.19 14.03 1bhg_c02 source 1bhg BETA-GLUCURONIDASE : 3 hits 1bhg_c02 naa= 3 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 1 3 # 1 B 451 GLU A 13 GLU.? 5.58 MG MG A 201 B 504 TYR A 54 TYR^? 8.76 CL CL A 205 B 540 GLU A 14 GLU.? -2.64 MG MG A 201s coo 86.52 35.28 112.74 87.08 36.38 110.99 27.41 11.93 9.21 29.53 12.06 9.35 coo 84.93 40.21 105.31 85.72 41.45 107.72 20.41 9.57 10.83 21.60 8.70 13.20 coo 83.38 41.19 112.55 85.47 40.59 112.72 24.27 16.08 12.66 25.65 15.19 14.03 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 2 3 # 2 B 451 GLU A 14 GLU.? -2.64 MG MG A 201s B 504 TYR A 54 TYR^? 8.76 CL CL A 205 B 540 GLU A 13 GLU.? 5.58 MG MG A 201 coo 86.52 35.28 112.74 87.08 36.38 110.99 24.27 16.08 12.66 25.65 15.19 14.03 coo 84.93 40.21 105.31 85.72 41.45 107.72 20.41 9.57 10.83 21.60 8.70 13.20 coo 83.38 41.19 112.55 85.47 40.59 112.72 27.41 11.93 9.21 29.53 12.06 9.35 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 3 3 # 3 B 451 GLU A 51 GLU.? -3.73 MG MG A 201s B 504 TYR A 54 TYR^? 8.76 CL CL A 205 B 540 GLU A 13 GLU.? 5.58 MG MG A 201 coo 86.52 35.28 112.74 87.08 36.38 110.99 29.85 9.06 13.15 28.87 10.87 13.64 coo 84.93 40.21 105.31 85.72 41.45 107.72 20.41 9.57 10.83 21.60 8.70 13.20 coo 83.38 41.19 112.55 85.47 40.59 112.72 27.41 11.93 9.21 29.53 12.06 9.35 1bhg_c03 source 1bhg BETA-GLUCURONIDASE : 3 hits 1bhg_c03 naa= 3 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 1 3 # 1 A 382 ARG A 52 ARG.? 12.69 MG MG A 201 A 451 GLU A 13 GLU.? 5.58 MG MG A 201 A 540 GLU A 51 GLU.? -3.73 MG MG A 201s coo 79.04 80.20 80.81 79.58 81.40 83.63 23.84 4.53 13.86 23.42 2.96 16.45 coo 81.34 87.29 87.22 82.36 86.09 88.61 27.41 11.93 9.21 29.53 12.06 9.35 coo 79.94 80.46 88.84 81.11 81.36 87.27 29.85 9.06 13.15 28.87 10.87 13.64 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 2 3 # 2 A 382 ARG A 52 ARG.? 12.69 MG MG A 201 A 451 GLU A 14 GLU.? -2.64 MG MG A 201s A 540 GLU A 13 GLU.? 5.58 MG MG A 201 coo 79.04 80.20 80.81 79.58 81.40 83.63 23.84 4.53 13.86 23.42 2.96 16.45 coo 81.34 87.29 87.22 82.36 86.09 88.61 24.27 16.08 12.66 25.65 15.19 14.03 coo 79.94 80.46 88.84 81.11 81.36 87.27 27.41 11.93 9.21 29.53 12.06 9.35 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 3 3 # 3 A 382 ARG A 52 ARG.? 12.69 MG MG A 201 A 451 GLU A 14 GLU.? -2.64 MG MG A 201s A 540 GLU A 51 GLU.? -3.73 MG MG A 201s coo 79.04 80.20 80.81 79.58 81.40 83.63 23.84 4.53 13.86 23.42 2.96 16.45 coo 81.34 87.29 87.22 82.36 86.09 88.61 24.27 16.08 12.66 25.65 15.19 14.03 coo 79.94 80.46 88.84 81.11 81.36 87.27 29.85 9.06 13.15 28.87 10.87 13.64 1bhg_c04 source 1bhg BETA-GLUCURONIDASE : 3 hits 1bhg_c04 naa= 3 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 # 1 B 382 ARG A 52 ARG.? 12.69 MG MG A 201 B 451 GLU A 13 GLU.? 5.58 MG MG A 201 B 540 GLU A 51 GLU.? -3.73 MG MG A 201s coo 82.21 41.07 119.14 83.95 40.66 116.59 23.84 4.53 13.86 23.42 2.96 16.45 coo 86.52 35.28 112.74 87.08 36.38 110.99 27.41 11.93 9.21 29.53 12.06 9.35 coo 83.38 41.19 112.55 85.47 40.59 112.72 29.85 9.06 13.15 28.87 10.87 13.64 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 1 hits 1bhg_c05 naa= 3 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 59 GLN^? -3.80 CL CL A 204s A 91 LEU A 7 LEU^? 4.62 CL CL A 204 A 133 GLU A 38 GLU^? 3.96 MG MG A 202 coo 43.58 43.67 66.73 42.32 42.78 68.15 8.27 12.08 -4.13 8.87 11.53 -6.17 coo 38.58 45.09 70.44 38.28 45.21 72.59 12.55 10.73 -6.54 11.83 9.17 -5.24 coo 44.05 36.87 70.65 43.15 38.64 69.97 4.92 15.48 -0.56 3.38 14.79 -1.87 1bs4_c00 source 1bs4 PEPTIDE DEFORMYLASE : 1 hits 1bs4_c00 naa= 3 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 # 1 B 550 GLN A 59 GLN^? -3.80 CL CL A 204s B 591 LEU A 7 LEU^? 4.62 CL CL A 204 B 633 GLU A 38 GLU^? 3.96 MG MG A 202 coo 88.06 44.34 57.19 89.06 45.53 55.74 8.27 12.08 -4.13 8.87 11.53 -6.17 coo 86.70 48.66 52.61 87.15 48.69 50.51 12.55 10.73 -6.54 11.83 9.17 -5.24 coo 95.42 44.52 54.43 93.46 45.31 54.70 4.92 15.48 -0.56 3.38 14.79 -1.87 1bs4_c01 source 1bs4 PEPTIDE DEFORMYLASE : 1 hits 1bs4_c01 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 59 GLN^? -3.80 CL CL A 204s C1091 LEU A 7 LEU^? 4.62 CL CL A 204 C1133 GLU A 38 GLU^? 3.96 MG MG A 202 coo 68.29 34.44 43.03 66.67 34.74 44.37 8.27 12.08 -4.13 8.87 11.53 -6.17 coo 65.83 38.95 47.05 65.46 38.90 49.20 12.55 10.73 -6.54 11.83 9.17 -5.24 coo 63.14 29.39 46.25 63.84 31.31 45.74 4.92 15.48 -0.56 3.38 14.79 -1.87 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 # 2 C1050 GLN A 59 GLN^? -3.80 CL CL A 204s C1091 LEU A 8 LEU^? 9.83 NA NA A 203 C1133 GLU A 38 GLU^? 3.96 MG MG A 202 coo 68.29 34.44 43.03 66.67 34.74 44.37 8.27 12.08 -4.13 8.87 11.53 -6.17 coo 65.83 38.95 47.05 65.46 38.90 49.20 16.37 14.37 -3.73 16.99 15.71 -5.36 coo 63.14 29.39 46.25 63.84 31.31 45.74 4.92 15.48 -0.56 3.38 14.79 -1.87 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c02 naa= 3 ULMN 3 1bvz_c08 ALPHA-AMYLASE II user 1 3 # 1 A 325 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 354 GLU A 28 GLU~? 11.92 O2' RBF A 200 A 421 ASP A 21 ASP~? 10.21 CL CL A 205 coo 31.05 49.37 64.51 31.97 51.11 63.85 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 29.07 50.42 58.36 29.02 52.18 59.49 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 30.82 59.76 58.47 31.12 59.02 60.40 17.65 20.12 5.81 16.27 21.08 7.00 ULMN 3 1bvz_c08 ALPHA-AMYLASE II user 2 3 # 2 A 325 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 354 GLU A 28 GLU~? 11.92 O2' RBF A 200 A 421 ASP A 22 ASP~? 13.54 MG MG A 201 coo 31.05 49.37 64.51 31.97 51.11 63.85 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 29.07 50.42 58.36 29.02 52.18 59.49 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 30.82 59.76 58.47 31.12 59.02 60.40 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1bvz_c08 ALPHA-AMYLASE II user 3 3 # 3 A 325 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 354 GLU A 28 GLU~? 11.92 O2' RBF A 200 A 421 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 31.05 49.37 64.51 31.97 51.11 63.85 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 29.07 50.42 58.36 29.02 52.18 59.49 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 30.82 59.76 58.47 31.12 59.02 60.40 13.55 28.60 -10.29 14.56 30.41 -9.94 1bvz_c08 source 1bvz ALPHA-AMYLASE II : 3 hits 1bvz_c08 naa= 3 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 # 1 B 325 ASP A 29 ASP~? 19.34 O2' RBF A 200 B 354 GLU A 28 GLU~? 11.92 O2' RBF A 200 B 421 ASP A 21 ASP~? 10.21 CL CL A 205 coo 25.90 8.19 53.87 25.36 6.97 52.29 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 27.87 10.66 47.95 27.82 8.60 48.27 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 26.02 1.87 43.38 25.90 1.97 45.49 17.65 20.12 5.81 16.27 21.08 7.00 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 2 3 # 2 B 325 ASP A 29 ASP~? 19.34 O2' RBF A 200 B 354 GLU A 28 GLU~? 11.92 O2' RBF A 200 B 421 ASP A 22 ASP~? 13.54 MG MG A 201 coo 25.90 8.19 53.87 25.36 6.97 52.29 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 27.87 10.66 47.95 27.82 8.60 48.27 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 26.02 1.87 43.38 25.90 1.97 45.49 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 3 3 # 3 B 325 ASP A 29 ASP~? 19.34 O2' RBF A 200 B 354 GLU A 28 GLU~? 11.92 O2' RBF A 200 B 421 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 25.90 8.19 53.87 25.36 6.97 52.29 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 27.87 10.66 47.95 27.82 8.60 48.27 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 26.02 1.87 43.38 25.90 1.97 45.49 13.55 28.60 -10.29 14.56 30.41 -9.94 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 4 3 # 4 B 325 ASP A 41 ASP^? -12.41 CL CL A 204s B 354 GLU A 57 GLU^? 8.10 CL CL A 204 B 421 ASP A 22 ASP~? 13.54 MG MG A 201 coo 25.90 8.19 53.87 25.36 6.97 52.29 12.01 5.97 1.89 11.89 3.91 2.21 coo 27.87 10.66 47.95 27.82 8.60 48.27 13.53 9.08 -1.40 13.32 7.21 -2.26 coo 26.02 1.87 43.38 25.90 1.97 45.49 20.90 16.89 3.17 22.62 16.55 2.02 1bvz_c09 source 1bvz ALPHA-AMYLASE II : 4 hits 1bvz_c09 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 29 ASP~? 19.34 O2' RBF A 200 264 GLU A 13 GLU.? 5.58 MG MG A 201 328 ASP A 21 ASP~? 10.21 CL CL A 205 coo 45.62 80.42 43.69 45.65 82.01 45.07 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 59.69 92.71 39.85 58.53 92.03 41.47 27.41 11.93 9.21 29.53 12.06 9.35 coo 45.39 90.72 40.63 45.07 89.14 41.90 17.65 20.12 5.81 16.27 21.08 7.00 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP A 29 ASP~? 19.34 O2' RBF A 200 264 GLU A 38 GLU^? 3.96 MG MG A 202 328 ASP A 21 ASP~? 10.21 CL CL A 205 coo 45.62 80.42 43.69 45.65 82.01 45.07 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 59.69 92.71 39.85 58.53 92.03 41.47 4.92 15.48 -0.56 3.38 14.79 -1.87 coo 45.39 90.72 40.63 45.07 89.14 41.90 17.65 20.12 5.81 16.27 21.08 7.00 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 # 3 229 ASP A 29 ASP~? 19.34 O2' RBF A 200 264 GLU A 38 GLU^? 3.96 MG MG A 202 328 ASP A 22 ASP~? 13.54 MG MG A 201 coo 45.62 80.42 43.69 45.65 82.01 45.07 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 59.69 92.71 39.85 58.53 92.03 41.47 4.92 15.48 -0.56 3.38 14.79 -1.87 coo 45.39 90.72 40.63 45.07 89.14 41.90 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 # 4 229 ASP A 29 ASP~? 19.34 O2' RBF A 200 264 GLU A 57 GLU^? 8.10 CL CL A 204 328 ASP A 21 ASP~? 10.21 CL CL A 205 coo 45.62 80.42 43.69 45.65 82.01 45.07 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 59.69 92.71 39.85 58.53 92.03 41.47 13.53 9.08 -1.40 13.32 7.21 -2.26 coo 45.39 90.72 40.63 45.07 89.14 41.90 17.65 20.12 5.81 16.27 21.08 7.00 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 4 hits 1cdg_c00 naa= 3 ULMN 3 1cms_c04 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 1 3 # 1 34 ASP A 32 ASP.? 15.72 O2' RBF A 200 37 SER A 67 SER.? 16.25 NA NA A 203 216 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 16.90 26.20 29.49 16.22 24.50 28.41 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 12.23 24.31 30.40 14.55 23.96 31.03 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 13.93 25.52 22.10 14.75 24.44 23.75 6.12 28.97 -15.23 4.74 30.16 -16.32 1cms_c04 source 1cms CHYMOSIN B (FORMERLY KNOWN AS RENNIN) (E.C.3.4: 1 hits 1cms_c04 naa= 3 ULMN 3 1cns_c00 CHITINASE user 1 3 # 1 A 67 GLU A 45 GLU^? -16.49 MG MG A 201s A 89 GLU A 51 GLU.? -3.73 MG MG A 201s A 120 SER A 12 SER^? 7.69 MG MG A 201 coo -24.35 9.53 67.64 -25.07 11.29 68.60 25.48 3.77 4.90 25.28 1.94 3.90 coo -31.18 6.91 75.60 -32.39 8.51 74.91 29.85 9.06 13.15 28.87 10.87 13.64 coo -34.73 8.57 68.21 -33.63 9.08 70.28 23.04 13.54 7.46 22.27 14.97 9.31 ULMN 3 1cns_c00 CHITINASE user 2 3 # 2 A 67 GLU A 51 GLU.? -3.73 MG MG A 201s A 89 GLU A 45 GLU^? -16.49 MG MG A 201s A 120 SER A 12 SER^? 7.69 MG MG A 201 coo -24.35 9.53 67.64 -25.07 11.29 68.60 29.85 9.06 13.15 28.87 10.87 13.64 coo -31.18 6.91 75.60 -32.39 8.51 74.91 25.48 3.77 4.90 25.28 1.94 3.90 coo -34.73 8.57 68.21 -33.63 9.08 70.28 23.04 13.54 7.46 22.27 14.97 9.31 1cns_c00 source 1cns CHITINASE : 2 hits 1cns_c00 naa= 3 ULMN 3 1cns_c01 CHITINASE user 1 3 # 1 B 67 GLU A 28 GLU~? 11.92 O2' RBF A 200 B 89 GLU A 63 GLU^? 6.60 O4' RBF A 200 B 120 SER A 67 SER.? 16.25 NA NA A 203 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 4.67 26.70 -10.13 3.12 27.66 -9.01 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 12.95 24.38 -14.30 14.27 25.84 -12.79 ULMN 3 1cns_c01 CHITINASE user 2 3 # 2 B 67 GLU A 45 GLU^? -16.49 MG MG A 201s B 89 GLU A 51 GLU.? -3.73 MG MG A 201s B 120 SER A 12 SER^? 7.69 MG MG A 201 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 25.48 3.77 4.90 25.28 1.94 3.90 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 29.85 9.06 13.15 28.87 10.87 13.64 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 23.04 13.54 7.46 22.27 14.97 9.31 ULMN 3 1cns_c01 CHITINASE user 3 3 # 3 B 67 GLU A 51 GLU.? -3.73 MG MG A 201s B 89 GLU A 45 GLU^? -16.49 MG MG A 201s B 120 SER A 12 SER^? 7.69 MG MG A 201 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 29.85 9.06 13.15 28.87 10.87 13.64 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 25.48 3.77 4.90 25.28 1.94 3.90 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 23.04 13.54 7.46 22.27 14.97 9.31 1cns_c01 source 1cns CHITINASE : 3 hits 1cns_c01 naa= 3 ULMN 3 1cwy_c00 AMYLOMALTASE user 1 3 # 1 A 293 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 340 GLU A 28 GLU~? 11.92 O2' RBF A 200 A 395 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo -48.00 -26.48 6.86 -46.51 -25.94 5.49 21.96 24.02 -5.30 22.79 24.22 -3.38 coo -43.58 -29.03 7.13 -42.45 -27.34 7.75 15.68 25.16 -2.25 15.40 26.11 -0.40 coo -42.28 -26.47 -1.32 -44.06 -25.60 -0.58 13.55 28.60 -10.29 14.56 30.41 -9.94 ULMN 3 1cwy_c00 AMYLOMALTASE user 2 3 # 2 A 293 ASP A 65 ASP.? 14.44 O4' RBF A 200 A 340 GLU A 63 GLU^? 6.60 O4' RBF A 200 A 395 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo -48.00 -26.48 6.86 -46.51 -25.94 5.49 6.12 28.97 -15.23 4.74 30.16 -16.32 coo -43.58 -29.03 7.13 -42.45 -27.34 7.75 4.67 26.70 -10.13 3.12 27.66 -9.01 coo -42.28 -26.47 -1.32 -44.06 -25.60 -0.58 13.55 28.60 -10.29 14.56 30.41 -9.94 1cwy_c00 source 1cwy AMYLOMALTASE : 2 hits 1cwy_c00 naa= 3 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 A 145 LYS A 5 LYS^? 4.39 MG MG A 202 A 177 GLU A 57 GLU^? 8.10 CL CL A 204 A 201 LEU A 7 LEU^? 4.62 CL CL A 204 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 8.77 16.47 -8.53 3.81 14.84 -4.92 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 13.53 9.08 -1.40 13.32 7.21 -2.26 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 12.55 10.73 -6.54 11.83 9.17 -5.24 1daa_c00 source 1daa D-AMINO ACID AMINOTRANSFERASE : 1 hits 1daa_c00 naa= 3 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 B 145 LYS A 5 LYS^? 4.39 MG MG A 202 B 177 GLU A 57 GLU^? 8.10 CL CL A 204 B 201 LEU A 7 LEU^? 4.62 CL CL A 204 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 8.77 16.47 -8.53 3.81 14.84 -4.92 coo 27.00 6.35 51.01 26.30 4.53 50.18 13.53 9.08 -1.40 13.32 7.21 -2.26 coo 23.74 1.68 49.50 22.87 -0.24 49.97 12.55 10.73 -6.54 11.83 9.17 -5.24 1daa_c01 source 1daa D-AMINO ACID AMINOTRANSFERASE : 1 hits 1daa_c01 naa= 3 ULMN 3 1dhp_c02 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 A 44 THR A 9 THR^? 12.15 CL CL A 204 A 45 THR A 56 THR^? 8.72 CL CL A 205 A 161 LYS A 5 LYS^? 4.39 MG MG A 202 coo 26.16 88.25 79.16 25.22 89.47 80.71 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 27.73 89.90 76.08 29.24 91.46 75.95 15.57 10.73 4.16 14.47 11.95 5.56 coo 33.83 91.15 88.62 31.07 91.06 83.02 8.77 16.47 -8.53 3.81 14.84 -4.92 1dhp_c02 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 1 hits 1dhp_c02 naa= 3 ULMN 3 1dhp_c03 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 B 44 THR A 9 THR^? 12.15 CL CL A 204 B 45 THR A 56 THR^? 8.72 CL CL A 205 B 161 LYS A 5 LYS^? 4.39 MG MG A 202 coo 7.39 128.28 94.56 8.34 126.36 94.79 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 5.75 129.25 91.25 4.29 128.16 90.07 15.57 10.73 4.16 14.47 11.95 5.56 coo -0.17 119.75 99.65 2.51 123.83 95.70 8.77 16.47 -8.53 3.81 14.84 -4.92 1dhp_c03 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 1 hits 1dhp_c03 naa= 3 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 # 1 A 32 ASP A 32 ASP.? 15.72 O2' RBF A 200 A 35 SER A 67 SER.? 16.25 NA NA A 203 A 218 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 47.22 22.34 8.57 45.16 22.02 9.13 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 43.58 20.85 5.15 44.62 23.01 5.76 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 44.05 16.99 12.67 44.05 18.89 11.74 6.12 28.97 -15.23 4.74 30.16 -16.32 1eag_c04 source 1eag PEPTIDE INHIBITOR : 1 hits 1eag_c04 naa= 3 ULMN 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 1 3 # 1 P 32 ASP A 32 ASP.? 15.72 O2' RBF A 200 P 35 SER A 67 SER.? 16.25 NA NA A 203 P 215 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 10.15 33.41 11.98 7.98 33.66 12.07 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 7.57 37.60 10.00 8.86 37.02 12.03 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 4.04 29.97 8.82 4.78 31.15 10.46 6.12 28.97 -15.23 4.74 30.16 -16.32 1eed_c04 source 1eed ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLEX WITH TH: 1 hits 1eed_c04 naa= 3 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 # 1 A 229 ALA A 18 ALA~? 8.00 CL CL A 205 A 257 ALA A 19 ALA~? 9.25 CL CL A 205 A 328 ASP A 25 ASP~? 15.40 CL CL A 205 coo 39.84 24.12 8.44 38.50 24.23 9.11 18.64 17.24 8.70 19.89 17.15 9.58 coo 43.22 26.73 5.37 41.81 27.09 5.79 18.80 14.56 5.96 18.67 12.96 6.09 coo 38.17 34.10 6.67 37.72 32.06 6.84 20.32 22.02 0.83 20.02 22.72 2.82 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 # 2 A 229 ALA A 18 ALA~? 8.00 CL CL A 205 A 257 ALA A 20 ALA~? 9.02 CL CL A 205 A 328 ASP A 25 ASP~? 15.40 CL CL A 205 coo 39.84 24.12 8.44 38.50 24.23 9.11 18.64 17.24 8.70 19.89 17.15 9.58 coo 43.22 26.73 5.37 41.81 27.09 5.79 15.47 15.90 4.49 14.13 16.06 5.24 coo 38.17 34.10 6.67 37.72 32.06 6.84 20.32 22.02 0.83 20.02 22.72 2.82 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 # 3 A 229 ALA A 19 ALA~? 9.25 CL CL A 205 A 257 ALA A 18 ALA~? 8.00 CL CL A 205 A 328 ASP A 25 ASP~? 15.40 CL CL A 205 coo 39.84 24.12 8.44 38.50 24.23 9.11 18.80 14.56 5.96 18.67 12.96 6.09 coo 43.22 26.73 5.37 41.81 27.09 5.79 18.64 17.24 8.70 19.89 17.15 9.58 coo 38.17 34.10 6.67 37.72 32.06 6.84 20.32 22.02 0.83 20.02 22.72 2.82 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 # 4 A 229 ALA A 19 ALA~? 9.25 CL CL A 205 A 257 ALA A 20 ALA~? 9.02 CL CL A 205 A 328 ASP A 25 ASP~? 15.40 CL CL A 205 coo 39.84 24.12 8.44 38.50 24.23 9.11 18.80 14.56 5.96 18.67 12.96 6.09 coo 43.22 26.73 5.37 41.81 27.09 5.79 15.47 15.90 4.49 14.13 16.06 5.24 coo 38.17 34.10 6.67 37.72 32.06 6.84 20.32 22.02 0.83 20.02 22.72 2.82 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 5 3 # 5 A 229 ALA A 19 ALA~? 9.25 CL CL A 205 A 257 ALA A 20 ALA~? 9.02 CL CL A 205 A 328 ASP A 41 ASP^? -12.41 CL CL A 204s coo 39.84 24.12 8.44 38.50 24.23 9.11 18.80 14.56 5.96 18.67 12.96 6.09 coo 43.22 26.73 5.37 41.81 27.09 5.79 15.47 15.90 4.49 14.13 16.06 5.24 coo 38.17 34.10 6.67 37.72 32.06 6.84 12.01 5.97 1.89 11.89 3.91 2.21 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 6 3 # 6 A 229 ALA A 20 ALA~? 9.02 CL CL A 205 A 257 ALA A 18 ALA~? 8.00 CL CL A 205 A 328 ASP A 25 ASP~? 15.40 CL CL A 205 coo 39.84 24.12 8.44 38.50 24.23 9.11 15.47 15.90 4.49 14.13 16.06 5.24 coo 43.22 26.73 5.37 41.81 27.09 5.79 18.64 17.24 8.70 19.89 17.15 9.58 coo 38.17 34.10 6.67 37.72 32.06 6.84 20.32 22.02 0.83 20.02 22.72 2.82 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 7 3 # 7 A 229 ALA A 20 ALA~? 9.02 CL CL A 205 A 257 ALA A 19 ALA~? 9.25 CL CL A 205 A 328 ASP A 25 ASP~? 15.40 CL CL A 205 coo 39.84 24.12 8.44 38.50 24.23 9.11 15.47 15.90 4.49 14.13 16.06 5.24 coo 43.22 26.73 5.37 41.81 27.09 5.79 18.80 14.56 5.96 18.67 12.96 6.09 coo 38.17 34.10 6.67 37.72 32.06 6.84 20.32 22.02 0.83 20.02 22.72 2.82 1eo7_c00 source 1eo7 CYCLODEXTRIN GLYCOSYLTRANSFERASE : 7 hits 1eo7_c00 naa= 3 ULMN 3 1euu_c00 SIALIDASE user 1 3 # 1 92 ASP A 21 ASP~? 10.21 CL CL A 205 260 GLU A 14 GLU.? -2.64 MG MG A 201s 370 TYR A 54 TYR^? 8.76 CL CL A 205 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 17.65 20.12 5.81 16.27 21.08 7.00 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 24.27 16.08 12.66 25.65 15.19 14.03 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 20.41 9.57 10.83 21.60 8.70 13.20 ULMN 3 1euu_c00 SIALIDASE user 2 3 # 2 92 ASP A 22 ASP~? 13.54 MG MG A 201 260 GLU A 13 GLU.? 5.58 MG MG A 201 370 TYR A 54 TYR^? 8.76 CL CL A 205 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 20.90 16.89 3.17 22.62 16.55 2.02 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 27.41 11.93 9.21 29.53 12.06 9.35 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 20.41 9.57 10.83 21.60 8.70 13.20 ULMN 3 1euu_c00 SIALIDASE user 3 3 # 3 92 ASP A 22 ASP~? 13.54 MG MG A 201 260 GLU A 14 GLU.? -2.64 MG MG A 201s 370 TYR A 54 TYR^? 8.76 CL CL A 205 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 20.90 16.89 3.17 22.62 16.55 2.02 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 24.27 16.08 12.66 25.65 15.19 14.03 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 20.41 9.57 10.83 21.60 8.70 13.20 1euu_c00 source 1euu SIALIDASE : 3 hits 1euu_c00 naa= 3 ULMN 3 1eyi_c00 FRUCTOSE-1,6-BISPHOSPHATASE user 1 3 # 1 A 68 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 74 ASP A 25 ASP~? 15.40 CL CL A 205 A 98 GLU A 28 GLU~? 11.92 O2' RBF A 200 coo 17.19 9.05 25.28 15.77 9.98 26.53 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 15.99 8.54 17.36 14.96 7.80 19.05 20.32 22.02 0.83 20.02 22.72 2.82 coo 16.31 12.85 18.11 16.71 11.79 19.90 15.68 25.16 -2.25 15.40 26.11 -0.40 ULMN 3 1eyi_c00 FRUCTOSE-1,6-BISPHOSPHATASE user 2 3 # 2 A 68 ASP A 32 ASP.? 15.72 O2' RBF A 200 A 74 ASP A 65 ASP.? 14.44 O4' RBF A 200 A 98 GLU A 63 GLU^? 6.60 O4' RBF A 200 coo 17.19 9.05 25.28 15.77 9.98 26.53 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 15.99 8.54 17.36 14.96 7.80 19.05 6.12 28.97 -15.23 4.74 30.16 -16.32 coo 16.31 12.85 18.11 16.71 11.79 19.90 4.67 26.70 -10.13 3.12 27.66 -9.01 1eyi_c00 source 1eyi FRUCTOSE-1,6-BISPHOSPHATASE : 2 hits 1eyi_c00 naa= 3 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 A 36 GLU A 13 GLU.? 5.58 MG MG A 201 A 47 ASP A 21 ASP~? 10.21 CL CL A 205 A 161 TYR A 54 TYR^? 8.76 CL CL A 205 coo 37.12 18.35 73.76 37.09 16.69 72.44 27.41 11.93 9.21 29.53 12.06 9.35 coo 29.81 8.06 73.13 30.21 10.11 72.95 17.65 20.12 5.81 16.27 21.08 7.00 coo 37.29 15.56 67.90 37.37 13.79 70.08 20.41 9.57 10.83 21.60 8.70 13.20 1geq_c02 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 1 hits 1geq_c02 naa= 3 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 B 36 GLU A 13 GLU.? 5.58 MG MG A 201 B 47 ASP A 21 ASP~? 10.21 CL CL A 205 B 161 TYR A 54 TYR^? 8.76 CL CL A 205 coo 53.87 35.49 53.22 55.44 35.72 54.61 27.41 11.93 9.21 29.53 12.06 9.35 coo 63.47 43.65 53.95 61.45 43.07 54.06 17.65 20.12 5.81 16.27 21.08 7.00 coo 56.38 35.81 59.19 58.25 35.77 57.10 20.41 9.57 10.83 21.60 8.70 13.20 1geq_c03 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 1 hits 1geq_c03 naa= 3 ULMN 3 1ig8_c00 HEXOKINASE PII user 1 3 # 1 A 158 SER A 12 SER^? 7.69 MG MG A 201 A 173 ARG A 52 ARG.? 12.69 MG MG A 201 A 211 ASP A 22 ASP~? 13.54 MG MG A 201 coo 22.72 76.24 0.23 24.60 76.86 -1.25 23.04 13.54 7.46 22.27 14.97 9.31 coo 18.77 77.82 11.69 20.55 80.22 10.73 23.84 4.53 13.86 23.42 2.96 16.45 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 20.90 16.89 3.17 22.62 16.55 2.02 1ig8_c00 source 1ig8 HEXOKINASE PII : 1 hits 1ig8_c00 naa= 3 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 1 3 # 1 54 ASP A 22 ASP~? 13.54 MG MG A 201 158 THR A 17 THR~? -4.58 CL CL A 205s 317 ASP A 41 ASP^? -12.41 CL CL A 204s coo -2.63 8.40 35.07 -3.66 9.81 36.17 20.90 16.89 3.17 22.62 16.55 2.02 coo -5.30 12.75 41.86 -4.34 13.05 39.99 15.13 16.09 9.66 14.08 17.47 11.01 coo -12.63 17.64 33.66 -10.65 17.90 34.40 12.01 5.97 1.89 11.89 3.91 2.21 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 2 3 # 2 54 ASP A 32 ASP.? 15.72 O2' RBF A 200 158 THR A 30 THR~? 15.21 NA NA A 203 317 ASP A 25 ASP~? 15.40 CL CL A 205 coo -2.63 8.40 35.07 -3.66 9.81 36.17 13.55 28.60 -10.29 14.56 30.41 -9.94 coo -5.30 12.75 41.86 -4.34 13.05 39.99 19.61 23.74 -9.00 20.23 21.65 -8.55 coo -12.63 17.64 33.66 -10.65 17.90 34.40 20.32 22.02 0.83 20.02 22.72 2.82 1inp_c02 source 1inp INOSITOL POLYPHOSPHATE 1-PHOSPHATASE (1-PTASE): 2 hits 1inp_c02 naa= 3 ULMN 3 1j7g_c00 D-TYROSYL-TRNA(TYR) DEACYLASE user 1 3 # 1 A 78 GLN A 55 GLN^? -15.59 CL CL A 205s A 79 PHE A 16 PHE~? 6.49 CL CL A 205 A 80 THR A 56 THR^? 8.72 CL CL A 205 coo 18.18 6.97 -1.14 17.20 5.70 -2.56 20.72 7.77 4.02 21.27 6.43 2.50 coo 24.87 4.39 -2.11 26.74 2.89 -0.67 15.31 10.14 10.32 15.93 7.43 10.75 coo 21.26 8.65 -4.24 19.54 7.67 -5.04 15.57 10.73 4.16 14.47 11.95 5.56 1j7g_c00 source 1j7g D-TYROSYL-TRNA(TYR) DEACYLASE : 1 hits 1j7g_c00 naa= 3 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 # 1 A 55 ASP A 21 ASP~? 10.21 CL CL A 205 A 58 ASP A 22 ASP~? 13.54 MG MG A 201 A 424 GLU A 14 GLU.? -2.64 MG MG A 201s coo 58.42 47.76 20.67 58.01 49.10 19.12 17.65 20.12 5.81 16.27 21.08 7.00 coo 58.59 41.80 18.81 58.94 43.89 18.94 20.90 16.89 3.17 22.62 16.55 2.02 coo 52.85 46.34 13.34 54.09 44.97 14.42 24.27 16.08 12.66 25.65 15.19 14.03 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 2 3 # 2 A 55 ASP A 22 ASP~? 13.54 MG MG A 201 A 58 ASP A 21 ASP~? 10.21 CL CL A 205 A 424 GLU A 14 GLU.? -2.64 MG MG A 201s coo 58.42 47.76 20.67 58.01 49.10 19.12 20.90 16.89 3.17 22.62 16.55 2.02 coo 58.59 41.80 18.81 58.94 43.89 18.94 17.65 20.12 5.81 16.27 21.08 7.00 coo 52.85 46.34 13.34 54.09 44.97 14.42 24.27 16.08 12.66 25.65 15.19 14.03 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 3 3 # 3 A 55 ASP A 22 ASP~? 13.54 MG MG A 201 A 58 ASP A 21 ASP~? 10.21 CL CL A 205 A 424 GLU A 28 GLU~? 11.92 O2' RBF A 200 coo 58.42 47.76 20.67 58.01 49.10 19.12 20.90 16.89 3.17 22.62 16.55 2.02 coo 58.59 41.80 18.81 58.94 43.89 18.94 17.65 20.12 5.81 16.27 21.08 7.00 coo 52.85 46.34 13.34 54.09 44.97 14.42 15.68 25.16 -2.25 15.40 26.11 -0.40 1js4_c00 source 1js4 ENDO-EXOCELLULASE E4 : 3 hits 1js4_c00 naa= 3 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 # 1 B 55 ASP A 21 ASP~? 10.21 CL CL A 205 B 58 ASP A 22 ASP~? 13.54 MG MG A 201 B 424 GLU A 14 GLU.? -2.64 MG MG A 201s coo 112.10 61.46 19.99 111.82 60.65 18.07 17.65 20.12 5.81 16.27 21.08 7.00 coo 117.85 63.62 21.08 115.96 63.25 20.18 20.90 16.89 3.17 22.62 16.55 2.02 coo 118.47 57.23 15.57 119.32 58.77 16.73 24.27 16.08 12.66 25.65 15.19 14.03 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 2 3 # 2 B 55 ASP A 22 ASP~? 13.54 MG MG A 201 B 58 ASP A 21 ASP~? 10.21 CL CL A 205 B 424 GLU A 14 GLU.? -2.64 MG MG A 201s coo 112.10 61.46 19.99 111.82 60.65 18.07 20.90 16.89 3.17 22.62 16.55 2.02 coo 117.85 63.62 21.08 115.96 63.25 20.18 17.65 20.12 5.81 16.27 21.08 7.00 coo 118.47 57.23 15.57 119.32 58.77 16.73 24.27 16.08 12.66 25.65 15.19 14.03 1js4_c01 source 1js4 ENDO-EXOCELLULASE E4 : 2 hits 1js4_c01 naa= 3 ULMN 3 1lij_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 19 ALA~? 9.25 CL CL A 205 A 317 GLY A 10 GLY^? 13.65 CL CL A 205 A 318 ASP A 22 ASP~? 13.54 MG MG A 201 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 18.80 14.56 5.96 18.67 12.96 6.09 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 19.39 13.48 1.48 19.22 12.65 1.65 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1lij_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA A 20 ALA~? 9.02 CL CL A 205 A 317 GLY A 10 GLY^? 13.65 CL CL A 205 A 318 ASP A 22 ASP~? 13.54 MG MG A 201 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 15.47 15.90 4.49 14.13 16.06 5.24 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 19.39 13.48 1.48 19.22 12.65 1.65 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1lij_c01 ADENOSINE KINASE user 3 3 # 3 A 316 ALA A 23 ALA~? 13.29 NA NA A 203 A 317 GLY A 10 GLY^? 13.65 CL CL A 205 A 318 ASP A 22 ASP~? 13.54 MG MG A 201 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 19.39 13.48 1.48 19.22 12.65 1.65 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 20.90 16.89 3.17 22.62 16.55 2.02 1lij_c01 source 1lij ADENOSINE KINASE : 3 hits 1lij_c01 naa= 3 ULMN 3 1lio_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 19 ALA~? 9.25 CL CL A 205 A 317 GLY A 10 GLY^? 13.65 CL CL A 205 A 318 ASP A 22 ASP~? 13.54 MG MG A 201 coo 27.04 23.54 41.85 25.72 24.19 42.18 18.80 14.56 5.96 18.67 12.96 6.09 coo 27.87 23.16 38.17 28.43 22.97 38.87 19.39 13.48 1.48 19.22 12.65 1.65 coo 32.11 22.71 40.58 33.42 24.22 39.78 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1lio_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA A 20 ALA~? 9.02 CL CL A 205 A 317 GLY A 10 GLY^? 13.65 CL CL A 205 A 318 ASP A 22 ASP~? 13.54 MG MG A 201 coo 27.04 23.54 41.85 25.72 24.19 42.18 15.47 15.90 4.49 14.13 16.06 5.24 coo 27.87 23.16 38.17 28.43 22.97 38.87 19.39 13.48 1.48 19.22 12.65 1.65 coo 32.11 22.71 40.58 33.42 24.22 39.78 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1lio_c01 ADENOSINE KINASE user 3 3 # 3 A 316 ALA A 23 ALA~? 13.29 NA NA A 203 A 317 GLY A 10 GLY^? 13.65 CL CL A 205 A 318 ASP A 22 ASP~? 13.54 MG MG A 201 coo 27.04 23.54 41.85 25.72 24.19 42.18 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 27.87 23.16 38.17 28.43 22.97 38.87 19.39 13.48 1.48 19.22 12.65 1.65 coo 32.11 22.71 40.58 33.42 24.22 39.78 20.90 16.89 3.17 22.62 16.55 2.02 1lio_c01 source 1lio ADENOSINE KINASE : 3 hits 1lio_c01 naa= 3 ULMN 3 1m53_c03 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 295 GLU A 28 GLU~? 11.92 O2' RBF A 200 A 369 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 11.74 38.14 80.19 10.63 36.40 80.65 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 16.11 33.72 80.99 14.10 33.54 81.63 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 12.19 31.08 87.29 11.13 32.66 86.38 13.55 28.60 -10.29 14.56 30.41 -9.94 ULMN 3 1m53_c03 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 65 ASP.? 14.44 O4' RBF A 200 A 295 GLU A 63 GLU^? 6.60 O4' RBF A 200 A 369 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 11.74 38.14 80.19 10.63 36.40 80.65 6.12 28.97 -15.23 4.74 30.16 -16.32 coo 16.11 33.72 80.99 14.10 33.54 81.63 4.67 26.70 -10.13 3.12 27.66 -9.01 coo 12.19 31.08 87.29 11.13 32.66 86.38 13.55 28.60 -10.29 14.56 30.41 -9.94 1m53_c03 source 1m53 ISOMALTULOSE SYNTHASE : 2 hits 1m53_c03 naa= 3 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 22 ASP~? 13.54 MG MG A 201 A 265 GLU A 38 GLU^? 3.96 MG MG A 202 A 369 ASP A 29 ASP~? 19.34 O2' RBF A 200 coo 11.74 38.14 80.19 10.63 36.40 80.65 20.90 16.89 3.17 22.62 16.55 2.02 coo 17.36 23.57 72.04 18.68 21.92 71.98 4.92 15.48 -0.56 3.38 14.79 -1.87 coo 12.19 31.08 87.29 11.13 32.66 86.38 21.96 24.02 -5.30 22.79 24.22 -3.38 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 32 ASP.? 15.72 O2' RBF A 200 A 265 GLU A 38 GLU^? 3.96 MG MG A 202 A 369 ASP A 29 ASP~? 19.34 O2' RBF A 200 coo 11.74 38.14 80.19 10.63 36.40 80.65 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 17.36 23.57 72.04 18.68 21.92 71.98 4.92 15.48 -0.56 3.38 14.79 -1.87 coo 12.19 31.08 87.29 11.13 32.66 86.38 21.96 24.02 -5.30 22.79 24.22 -3.38 1m53_c05 source 1m53 ISOMALTULOSE SYNTHASE : 2 hits 1m53_c05 naa= 3 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 279 GLU A 13 GLU.? 5.58 MG MG A 201 A 369 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 11.74 38.14 80.19 10.63 36.40 80.65 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 16.54 46.37 63.94 14.77 45.79 62.95 27.41 11.93 9.21 29.53 12.06 9.35 coo 12.19 31.08 87.29 11.13 32.66 86.38 13.55 28.60 -10.29 14.56 30.41 -9.94 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 279 GLU A 14 GLU.? -2.64 MG MG A 201s A 369 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 11.74 38.14 80.19 10.63 36.40 80.65 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 16.54 46.37 63.94 14.77 45.79 62.95 24.27 16.08 12.66 25.65 15.19 14.03 coo 12.19 31.08 87.29 11.13 32.66 86.38 13.55 28.60 -10.29 14.56 30.41 -9.94 1m53_c06 source 1m53 ISOMALTULOSE SYNTHASE : 2 hits 1m53_c06 naa= 3 ULMN 3 1mpp_c04 PEPSIN (RENIN) (E.C.3.4.23.23) user 1 3 # 1 32 ASP A 32 ASP.? 15.72 O2' RBF A 200 35 SER A 67 SER.? 16.25 NA NA A 203 215 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 20.97 14.47 32.28 19.66 15.96 31.62 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 16.04 14.72 33.82 17.27 13.71 31.95 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 20.65 22.00 33.80 20.06 20.56 32.39 6.12 28.97 -15.23 4.74 30.16 -16.32 1mpp_c04 source 1mpp PEPSIN (RENIN) (E.C.3.4.23.23) : 1 hits 1mpp_c04 naa= 3 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 26 ARG~? 15.79 NA NA A 203 A 101 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 132 ASP A 25 ASP~? 15.40 CL CL A 205 coo 11.61 22.83 17.30 14.06 21.71 15.78 22.68 19.36 -4.97 23.34 18.85 -7.96 coo 11.37 24.94 11.48 12.48 24.45 13.28 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 16.14 18.17 13.37 15.92 19.81 14.71 20.32 22.02 0.83 20.02 22.72 2.82 1nu3_c00 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nu3_c00 naa= 3 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 26 ARG~? 15.79 NA NA A 203 B 101 ASP A 29 ASP~? 19.34 O2' RBF A 200 B 132 ASP A 25 ASP~? 15.40 CL CL A 205 coo 11.61 3.43 18.38 9.11 4.29 16.86 22.68 19.36 -4.97 23.34 18.85 -7.96 coo 11.74 0.51 12.98 10.75 1.32 14.67 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 6.93 7.52 14.08 7.18 6.08 15.65 20.32 22.02 0.83 20.02 22.72 2.82 1nu3_c01 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nu3_c01 naa= 3 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 26 ARG~? 15.79 NA NA A 203 A 101 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 132 ASP A 25 ASP~? 15.40 CL CL A 205 coo 11.50 22.77 17.24 14.00 21.62 15.86 22.68 19.36 -4.97 23.34 18.85 -7.96 coo 11.19 25.00 11.76 12.16 24.45 13.59 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 16.04 18.11 13.43 15.88 19.70 14.83 20.32 22.02 0.83 20.02 22.72 2.82 1nww_c02 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nww_c02 naa= 3 ULMN 3 1oyg_c00 LEVANSUCRASE user 1 3 # 1 A 86 ASP A 32 ASP.? 15.72 O2' RBF A 200 A 247 ASP A 65 ASP.? 14.44 O4' RBF A 200 A 342 GLU A 63 GLU^? 6.60 O4' RBF A 200 coo 44.36 35.68 9.71 43.29 36.20 11.51 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 41.40 28.81 12.91 40.82 30.90 12.97 6.12 28.97 -15.23 4.74 30.16 -16.32 coo 40.37 33.11 18.06 39.99 34.93 17.06 4.67 26.70 -10.13 3.12 27.66 -9.01 1oyg_c00 source 1oyg LEVANSUCRASE : 1 hits 1oyg_c00 naa= 3 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 A 70 ALA A 23 ALA~? 13.29 NA NA A 203 A 126 LEU A 8 LEU^? 9.83 NA NA A 203 A 158 GLU A 57 GLU^? 8.10 CL CL A 204 coo -2.29 37.66 144.73 -1.46 37.12 145.87 17.96 16.97 -0.19 16.88 15.78 -0.14 coo -4.62 32.83 147.14 -5.50 32.85 149.12 16.37 14.37 -3.73 16.99 15.71 -5.36 coo -0.83 29.57 149.77 -0.39 31.47 148.95 13.53 9.08 -1.40 13.32 7.21 -2.26 1pjh_c00 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 1 hits 1pjh_c00 naa= 3 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 B 70 ALA A 23 ALA~? 13.29 NA NA A 203 B 126 LEU A 8 LEU^? 9.83 NA NA A 203 B 158 GLU A 57 GLU^? 8.10 CL CL A 204 coo -39.79 4.61 147.27 -39.61 5.56 148.47 17.96 16.97 -0.19 16.88 15.78 -0.14 coo -34.22 5.06 149.25 -33.65 4.24 151.15 16.37 14.37 -3.73 16.99 15.71 -5.36 coo -33.03 9.93 151.71 -34.98 9.38 151.11 13.53 9.08 -1.40 13.32 7.21 -2.26 1pjh_c01 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 1 hits 1pjh_c01 naa= 3 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 C 70 ALA A 23 ALA~? 13.29 NA NA A 203 C 126 LEU A 8 LEU^? 9.83 NA NA A 203 C 158 GLU A 57 GLU^? 8.10 CL CL A 204 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 16.37 14.37 -3.73 16.99 15.71 -5.36 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 13.53 9.08 -1.40 13.32 7.21 -2.26 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 1 hits 1pjh_c02 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 22 ASP~? 13.54 MG MG A 201 A 68 ALA A 23 ALA~? 13.29 NA NA A 203 A 72 LEU A 8 LEU^? 9.83 NA NA A 203 coo 46.76 7.59 18.65 45.27 6.01 18.52 20.90 16.89 3.17 22.62 16.55 2.02 coo 48.88 4.35 16.59 48.73 5.09 15.20 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 53.89 6.25 15.09 52.88 7.92 14.14 16.37 14.37 -3.73 16.99 15.71 -5.36 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP A 25 ASP~? 15.40 CL CL A 205 A 68 ALA A 23 ALA~? 13.29 NA NA A 203 A 72 LEU A 8 LEU^? 9.83 NA NA A 203 coo 46.76 7.59 18.65 45.27 6.01 18.52 20.32 22.02 0.83 20.02 22.72 2.82 coo 48.88 4.35 16.59 48.73 5.09 15.20 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 53.89 6.25 15.09 52.88 7.92 14.14 16.37 14.37 -3.73 16.99 15.71 -5.36 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 # 3 A 67 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 68 ALA A 27 ALA~? 12.91 NA NA A 203 A 72 LEU A 31 LEU~? 13.01 NA NA A 203 coo 46.76 7.59 18.65 45.27 6.01 18.52 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 48.88 4.35 16.59 48.73 5.09 15.20 17.07 21.00 -5.01 15.64 20.51 -4.51 coo 53.89 6.25 15.09 52.88 7.92 14.14 15.01 23.35 -8.96 14.86 21.43 -9.84 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 3 hits 1q6l_c05 naa= 3 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 # 1 A 49 ASP A 21 ASP~? 10.21 CL CL A 205 A 147 THR A 17 THR~? -4.58 CL CL A 205s A 294 ASP A 41 ASP^? -12.41 CL CL A 204s coo 1.13 15.67 -24.51 2.35 14.34 -25.71 17.65 20.12 5.81 16.27 21.08 7.00 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 15.13 16.09 9.66 14.08 17.47 11.01 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 12.01 5.97 1.89 11.89 3.91 2.21 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 2 3 # 2 A 49 ASP A 22 ASP~? 13.54 MG MG A 201 A 147 THR A 17 THR~? -4.58 CL CL A 205s A 294 ASP A 41 ASP^? -12.41 CL CL A 204s coo 1.13 15.67 -24.51 2.35 14.34 -25.71 20.90 16.89 3.17 22.62 16.55 2.02 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 15.13 16.09 9.66 14.08 17.47 11.01 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 12.01 5.97 1.89 11.89 3.91 2.21 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 3 3 # 3 A 49 ASP A 32 ASP.? 15.72 O2' RBF A 200 A 147 THR A 30 THR~? 15.21 NA NA A 203 A 294 ASP A 25 ASP~? 15.40 CL CL A 205 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 19.61 23.74 -9.00 20.23 21.65 -8.55 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 20.32 22.02 0.83 20.02 22.72 2.82 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 4 3 # 4 A 49 ASP A 41 ASP^? -12.41 CL CL A 204s A 147 THR A 9 THR^? 12.15 CL CL A 204 A 294 ASP A 21 ASP~? 10.21 CL CL A 205 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 12.01 5.97 1.89 11.89 3.91 2.21 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 17.67 11.10 -0.93 17.74 8.97 -0.57 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 17.65 20.12 5.81 16.27 21.08 7.00 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 5 3 # 5 A 49 ASP A 41 ASP^? -12.41 CL CL A 204s A 147 THR A 56 THR^? 8.72 CL CL A 205 A 294 ASP A 21 ASP~? 10.21 CL CL A 205 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 12.01 5.97 1.89 11.89 3.91 2.21 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 15.57 10.73 4.16 14.47 11.95 5.56 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 17.65 20.12 5.81 16.27 21.08 7.00 1qgx_c02 source 1qgx 3',5'-ADENOSINE BISPHOSPHATASE : 5 hits 1qgx_c02 naa= 3 ULMN 3 1qho_c04 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 29 ASP~? 19.34 O2' RBF A 200 A 256 GLU A 28 GLU~? 11.92 O2' RBF A 200 A 329 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 28.46 69.88 26.74 30.40 70.70 26.53 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 30.54 71.65 32.58 31.73 72.26 30.92 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 37.87 70.12 31.80 36.61 69.74 30.15 13.55 28.60 -10.29 14.56 30.41 -9.94 ULMN 3 1qho_c04 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 65 ASP.? 14.44 O4' RBF A 200 A 256 GLU A 63 GLU^? 6.60 O4' RBF A 200 A 329 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 28.46 69.88 26.74 30.40 70.70 26.53 6.12 28.97 -15.23 4.74 30.16 -16.32 coo 30.54 71.65 32.58 31.73 72.26 30.92 4.67 26.70 -10.13 3.12 27.66 -9.01 coo 37.87 70.12 31.80 36.61 69.74 30.15 13.55 28.60 -10.29 14.56 30.41 -9.94 1qho_c04 source 1qho ALPHA-AMYLASE : 2 hits 1qho_c04 naa= 3 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 1 3 # 1 A 10 ASP A 65 ASP.? 14.44 O4' RBF A 200 A 186 ASN A 33 ASN.? 11.91 O4' RBF A 200 A 260 ALA A 61 ALA^? 6.76 N5 RBF A 200 coo 11.81 33.10 11.71 13.07 31.45 11.40 6.12 28.97 -15.23 4.74 30.16 -16.32 coo 11.43 26.53 7.41 13.01 27.56 8.43 9.42 27.88 -8.48 9.79 29.49 -9.82 coo 21.53 26.33 6.96 20.26 25.69 7.52 8.07 19.67 -5.80 6.64 19.69 -5.30 1r4f_c00 source 1r4f IAG-NUCLEOSIDE HYDROLASE : 1 hits 1r4f_c00 naa= 3 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 # 1 32 ASP A 22 ASP~? 13.54 MG MG A 201 35 SER A 12 SER^? 7.69 MG MG A 201 215 ASP A 21 ASP~? 10.21 CL CL A 205 coo 11.85 17.24 72.81 11.09 15.37 72.36 20.90 16.89 3.17 22.62 16.55 2.02 coo 12.20 12.71 75.45 13.69 13.84 74.03 23.04 13.54 7.46 22.27 14.97 9.31 coo 5.22 15.03 71.43 7.19 14.88 70.83 17.65 20.12 5.81 16.27 21.08 7.00 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 3 # 2 32 ASP A 32 ASP.? 15.72 O2' RBF A 200 35 SER A 67 SER.? 16.25 NA NA A 203 215 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 11.85 17.24 72.81 11.09 15.37 72.36 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 12.20 12.71 75.45 13.69 13.84 74.03 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 5.22 15.03 71.43 7.19 14.88 70.83 6.12 28.97 -15.23 4.74 30.16 -16.32 1rne_c04 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 2 hits 1rne_c04 naa= 3 ULMN 3 1sll_c00 SIALIDASE L user 1 3 # 1 318 ASP A 21 ASP~? 10.21 CL CL A 205 595 GLU A 14 GLU.? -2.64 MG MG A 201s 713 TYR A 54 TYR^? 8.76 CL CL A 205 coo 5.64 2.82 38.49 4.59 4.19 37.25 17.65 20.12 5.81 16.27 21.08 7.00 coo 4.35 13.73 37.63 3.39 12.18 36.55 24.27 16.08 12.66 25.65 15.19 14.03 coo 3.76 10.25 31.38 3.16 9.87 34.10 20.41 9.57 10.83 21.60 8.70 13.20 ULMN 3 1sll_c00 SIALIDASE L user 2 3 # 2 318 ASP A 22 ASP~? 13.54 MG MG A 201 595 GLU A 13 GLU.? 5.58 MG MG A 201 713 TYR A 54 TYR^? 8.76 CL CL A 205 coo 5.64 2.82 38.49 4.59 4.19 37.25 20.90 16.89 3.17 22.62 16.55 2.02 coo 4.35 13.73 37.63 3.39 12.18 36.55 27.41 11.93 9.21 29.53 12.06 9.35 coo 3.76 10.25 31.38 3.16 9.87 34.10 20.41 9.57 10.83 21.60 8.70 13.20 ULMN 3 1sll_c00 SIALIDASE L user 3 3 # 3 318 ASP A 22 ASP~? 13.54 MG MG A 201 595 GLU A 14 GLU.? -2.64 MG MG A 201s 713 TYR A 54 TYR^? 8.76 CL CL A 205 coo 5.64 2.82 38.49 4.59 4.19 37.25 20.90 16.89 3.17 22.62 16.55 2.02 coo 4.35 13.73 37.63 3.39 12.18 36.55 24.27 16.08 12.66 25.65 15.19 14.03 coo 3.76 10.25 31.38 3.16 9.87 34.10 20.41 9.57 10.83 21.60 8.70 13.20 1sll_c00 source 1sll SIALIDASE L : 3 hits 1sll_c00 naa= 3 ULMN 3 1sme_c04 PLASMEPSIN II user 1 3 # 1 A 34 ASP A 32 ASP.? 15.72 O2' RBF A 200 A 37 SER A 67 SER.? 16.25 NA NA A 203 A 214 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 51.75 60.57 19.10 52.05 60.90 21.19 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 51.10 65.11 20.73 52.62 63.74 19.42 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 48.59 58.89 25.78 50.13 59.74 24.61 6.12 28.97 -15.23 4.74 30.16 -16.32 1sme_c04 source 1sme PLASMEPSIN II : 1 hits 1sme_c04 naa= 3 ULMN 3 1sme_c05 PLASMEPSIN II user 1 3 # 1 B 34 ASP A 32 ASP.? 15.72 O2' RBF A 200 B 37 SER A 67 SER.? 16.25 NA NA A 203 B 214 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 17.69 97.58 52.73 17.33 97.19 54.77 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 20.67 100.44 55.84 20.21 98.51 54.45 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 12.41 98.71 58.47 14.37 98.17 58.05 6.12 28.97 -15.23 4.74 30.16 -16.32 1sme_c05 source 1sme PLASMEPSIN II : 1 hits 1sme_c05 naa= 3 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 # 1 A 250 ALA A 19 ALA~? 9.25 CL CL A 205 A 251 GLY A 10 GLY^? 13.65 CL CL A 205 A 252 ASP A 22 ASP~? 13.54 MG MG A 201 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 18.80 14.56 5.96 18.67 12.96 6.09 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 19.39 13.48 1.48 19.22 12.65 1.65 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 # 2 A 250 ALA A 20 ALA~? 9.02 CL CL A 205 A 251 GLY A 10 GLY^? 13.65 CL CL A 205 A 252 ASP A 22 ASP~? 13.54 MG MG A 201 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 15.47 15.90 4.49 14.13 16.06 5.24 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 19.39 13.48 1.48 19.22 12.65 1.65 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 3 3 # 3 A 250 ALA A 23 ALA~? 13.29 NA NA A 203 A 251 GLY A 10 GLY^? 13.65 CL CL A 205 A 252 ASP A 22 ASP~? 13.54 MG MG A 201 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 19.39 13.48 1.48 19.22 12.65 1.65 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 20.90 16.89 3.17 22.62 16.55 2.02 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 19 ALA~? 9.25 CL CL A 205 B 251 GLY A 10 GLY^? 13.65 CL CL A 205 B 252 ASP A 22 ASP~? 13.54 MG MG A 201 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 18.80 14.56 5.96 18.67 12.96 6.09 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 19.39 13.48 1.48 19.22 12.65 1.65 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 # 2 B 250 ALA A 20 ALA~? 9.02 CL CL A 205 B 251 GLY A 10 GLY^? 13.65 CL CL A 205 B 252 ASP A 22 ASP~? 13.54 MG MG A 201 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 15.47 15.90 4.49 14.13 16.06 5.24 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 19.39 13.48 1.48 19.22 12.65 1.65 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 20.90 16.89 3.17 22.62 16.55 2.02 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 3 3 # 3 B 250 ALA A 23 ALA~? 13.29 NA NA A 203 B 251 GLY A 10 GLY^? 13.65 CL CL A 205 B 252 ASP A 22 ASP~? 13.54 MG MG A 201 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 19.39 13.48 1.48 19.22 12.65 1.65 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 20.90 16.89 3.17 22.62 16.55 2.02 1tz3_c03 source 1tz3 PUTATIVE SUGAR KINASE : 3 hits 1tz3_c03 naa= 3 ULMN 3 1uf7_c00 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 1 3 # 1 A 46 GLU A 38 GLU^? 3.96 MG MG A 202 A 126 LYS A 5 LYS^? 4.39 MG MG A 202 A 171 ALA A 37 ALA^? -6.75 C7M RBF A 200s coo 52.87 81.38 -9.32 53.05 81.09 -7.22 4.92 15.48 -0.56 3.38 14.79 -1.87 coo 51.43 89.29 -7.19 53.08 83.69 -4.74 8.77 16.47 -8.53 3.81 14.84 -4.92 coo 48.80 81.73 -5.45 50.30 81.43 -5.45 8.75 18.19 -0.14 10.15 18.18 0.45 1uf7_c00 source 1uf7 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLASE : 1 hits 1uf7_c00 naa= 3 ULMN 3 1uf7_c01 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 1 3 # 1 B 46 GLU A 38 GLU^? 3.96 MG MG A 202 B 126 LYS A 5 LYS^? 4.39 MG MG A 202 B 171 ALA A 37 ALA^? -6.75 C7M RBF A 200s coo 20.47 87.42 16.54 20.16 87.17 14.45 4.92 15.48 -0.56 3.38 14.79 -1.87 coo 24.73 94.37 14.59 21.08 89.84 11.98 8.77 16.47 -8.53 3.81 14.84 -4.92 coo 24.38 86.32 12.71 22.88 86.54 12.71 8.75 18.19 -0.14 10.15 18.18 0.45 1uf7_c01 source 1uf7 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLASE : 1 hits 1uf7_c01 naa= 3 ULMN 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 29 ASP~? 19.34 O2' RBF A 200 255 GLU A 28 GLU~? 11.92 O2' RBF A 200 329 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 49.16 35.16 15.19 51.08 34.43 15.65 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 52.57 37.12 10.17 53.37 35.95 11.75 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 59.16 37.82 13.95 57.63 37.03 15.12 13.55 28.60 -10.29 14.56 30.41 -9.94 ULMN 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 65 ASP.? 14.44 O4' RBF A 200 255 GLU A 63 GLU^? 6.60 O4' RBF A 200 329 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 49.16 35.16 15.19 51.08 34.43 15.65 6.12 28.97 -15.23 4.74 30.16 -16.32 coo 52.57 37.12 10.17 53.37 35.95 11.75 4.67 26.70 -10.13 3.12 27.66 -9.01 coo 59.16 37.82 13.95 57.63 37.03 15.12 13.55 28.60 -10.29 14.56 30.41 -9.94 1uok_c03 source 1uok OLIGO-1,6-GLUCOSIDASE : 2 hits 1uok_c03 naa= 3 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 29 ASP~? 19.34 O2' RBF A 200 242 GLU A 13 GLU.? 5.58 MG MG A 201 329 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 49.16 35.16 15.19 51.08 34.43 15.65 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 30.42 34.74 5.00 29.09 35.09 3.38 27.41 11.93 9.21 29.53 12.06 9.35 coo 59.16 37.82 13.95 57.63 37.03 15.12 13.55 28.60 -10.29 14.56 30.41 -9.94 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 29 ASP~? 19.34 O2' RBF A 200 242 GLU A 45 GLU^? -16.49 MG MG A 201s 329 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 49.16 35.16 15.19 51.08 34.43 15.65 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 30.42 34.74 5.00 29.09 35.09 3.38 25.48 3.77 4.90 25.28 1.94 3.90 coo 59.16 37.82 13.95 57.63 37.03 15.12 13.55 28.60 -10.29 14.56 30.41 -9.94 1uok_c05 source 1uok OLIGO-1,6-GLUCOSIDASE : 2 hits 1uok_c05 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 23 ALA~? 13.29 NA NA A 203 B 126 ARG A 26 ARG~? 15.79 NA NA A 203 B 138 GLU A 57 GLU^? 8.10 CL CL A 204 coo 2.11 4.00 19.31 3.14 4.86 19.99 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 2.45 5.53 11.28 3.59 7.56 13.29 22.68 19.36 -4.97 23.34 18.85 -7.96 coo 6.10 2.00 25.24 6.12 1.84 23.13 13.53 9.08 -1.40 13.32 7.21 -2.26 1xs1_c07 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 1 hits 1xs1_c07 naa= 3 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 C 124 ALA A 23 ALA~? 13.29 NA NA A 203 C 126 ARG A 26 ARG~? 15.79 NA NA A 203 C 138 GLU A 57 GLU^? 8.10 CL CL A 204 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 17.96 16.97 -0.19 16.88 15.78 -0.14 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 22.68 19.36 -4.97 23.34 18.85 -7.96 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 13.53 9.08 -1.40 13.32 7.21 -2.26 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 1 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 23 ALA~? 13.29 NA NA A 203 D 126 ARG A 26 ARG~? 15.79 NA NA A 203 D 138 GLU A 57 GLU^? 8.10 CL CL A 204 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 17.96 16.97 -0.19 16.88 15.78 -0.14 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 22.68 19.36 -4.97 23.34 18.85 -7.96 coo 6.23 0.50 57.10 5.93 0.72 59.19 13.53 9.08 -1.40 13.32 7.21 -2.26 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 1 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 23 ALA~? 13.29 NA NA A 203 E 126 ARG A 26 ARG~? 15.79 NA NA A 203 E 138 GLU A 57 GLU^? 8.10 CL CL A 204 coo -4.56 10.03 62.36 -4.38 11.31 61.55 17.96 16.97 -0.19 16.88 15.78 -0.14 coo -3.02 12.00 70.07 -1.94 13.84 67.82 22.68 19.36 -4.97 23.34 18.85 -7.96 coo -8.67 12.22 56.54 -8.68 12.09 58.65 13.53 9.08 -1.40 13.32 7.21 -2.26 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 1 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 23 ALA~? 13.29 NA NA A 203 F 126 ARG A 26 ARG~? 15.79 NA NA A 203 F 138 GLU A 57 GLU^? 8.10 CL CL A 204 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 17.96 16.97 -0.19 16.88 15.78 -0.14 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 22.68 19.36 -4.97 23.34 18.85 -7.96 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 13.53 9.08 -1.40 13.32 7.21 -2.26 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 1 hits 1xs1_c11 naa= 3 ULMN 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP A 29 ASP~? 19.34 O2' RBF A 200 219 GLU A 28 GLU~? 11.92 O2' RBF A 200 294 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 27.89 102.52 14.98 29.35 101.92 13.57 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 25.84 105.87 9.06 27.86 105.55 8.74 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 33.16 106.80 7.72 33.34 104.87 6.92 13.55 28.60 -10.29 14.56 30.41 -9.94 ULMN 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 # 2 193 ASP A 32 ASP.? 15.72 O2' RBF A 200 219 GLU A 28 GLU~? 11.92 O2' RBF A 200 294 ASP A 29 ASP~? 19.34 O2' RBF A 200 coo 27.89 102.52 14.98 29.35 101.92 13.57 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 25.84 105.87 9.06 27.86 105.55 8.74 15.68 25.16 -2.25 15.40 26.11 -0.40 coo 33.16 106.80 7.72 33.34 104.87 6.92 21.96 24.02 -5.30 22.79 24.22 -3.38 ULMN 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 # 3 193 ASP A 32 ASP.? 15.72 O2' RBF A 200 219 GLU A 63 GLU^? 6.60 O4' RBF A 200 294 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 27.89 102.52 14.98 29.35 101.92 13.57 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 25.84 105.87 9.06 27.86 105.55 8.74 4.67 26.70 -10.13 3.12 27.66 -9.01 coo 33.16 106.80 7.72 33.34 104.87 6.92 6.12 28.97 -15.23 4.74 30.16 -16.32 ULMN 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 4 3 # 4 193 ASP A 65 ASP.? 14.44 O4' RBF A 200 219 GLU A 63 GLU^? 6.60 O4' RBF A 200 294 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 27.89 102.52 14.98 29.35 101.92 13.57 6.12 28.97 -15.23 4.74 30.16 -16.32 coo 25.84 105.87 9.06 27.86 105.55 8.74 4.67 26.70 -10.13 3.12 27.66 -9.01 coo 33.16 106.80 7.72 33.34 104.87 6.92 13.55 28.60 -10.29 14.56 30.41 -9.94 2amg_c02 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 4 hits 2amg_c02 naa= 3 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP A 29 ASP~? 19.34 O2' RBF A 200 231 ASP A 41 ASP^? -12.41 CL CL A 204s 294 ASP A 32 ASP.? 15.72 O2' RBF A 200 coo 27.89 102.52 14.98 29.35 101.92 13.57 21.96 24.02 -5.30 22.79 24.22 -3.38 coo 14.74 93.05 -1.00 14.30 94.22 0.73 12.01 5.97 1.89 11.89 3.91 2.21 coo 33.16 106.80 7.72 33.34 104.87 6.92 13.55 28.60 -10.29 14.56 30.41 -9.94 2amg_c06 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 1 hits 2amg_c06 naa= 3 ULMN 3 2apr_c04 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 1 3 # 1 35 ASP A 32 ASP.? 15.72 O2' RBF A 200 38 SER A 67 SER.? 16.25 NA NA A 203 218 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo 41.14 58.72 105.19 42.39 59.85 103.92 13.55 28.60 -10.29 14.56 30.41 -9.94 coo 46.04 57.35 103.96 44.97 58.52 105.78 12.95 24.38 -14.30 14.27 25.84 -12.79 coo 41.33 60.20 97.63 42.00 60.96 99.49 6.12 28.97 -15.23 4.74 30.16 -16.32 2apr_c04 source 2apr ACID PROTEINASE (RHIZOPUSPEPSIN) (E.C.3.4.23.6: 1 hits 2apr_c04 naa= 3 ULMN 3 2jxr_c04 LIGAND CP-081282 user 1 3 # 1 A 32 ASP A 32 ASP.? 15.72 O2' RBF A 200 A 35 SER A 67 SER.? 16.25 NA NA A 203 A 215 ASP A 65 ASP.? 14.44 O4' RBF A 200 coo -14.00 61.45 43.99 -14.19 63.14 42.84 13.55 28.60 -10.29 14.56 30.41 -9.94 coo -13.21 66.21 45.84 -15.49 65.90 45.84 12.95 24.38 -14.30 14.27 25.84 -12.79 coo -10.72 64.19 37.77 -12.20 64.43 39.15 6.12 28.97 -15.23 4.74 30.16 -16.32 2jxr_c04 source 2jxr LIGAND CP-081282 : 1 hits 2jxr_c04 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP A 41 ASP^? -12.41 CL CL A 204s 166 GLY A 47 GLY.? 16.67 MG MG A 201 169 GLU A 50 GLU.? 11.66 MG MG A 201 coo 8.28 6.87 1.62 10.08 5.77 1.34 12.01 5.97 1.89 11.89 3.91 2.21 coo -8.58 13.22 3.21 -8.90 13.15 4.05 28.13 -0.82 7.64 27.64 -0.18 7.17 coo -16.67 7.89 2.78 -17.65 6.56 1.49 34.72 6.27 8.90 36.17 7.84 8.91 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 1 hits 2tdt_c00 naa= 3 ULMN 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 1 3 # 1 A 81 ASP A 65 ASP.? 14.44 O4' RBF A 200 A 99 GLY A 66 GLY.? 15.47 O4' RBF A 200 A 125 ASN A 33 ASN.? 11.91 O4' RBF A 200 coo -12.71 41.15 -12.81 -13.46 42.96 -13.57 6.12 28.97 -15.23 4.74 30.16 -16.32 coo -9.98 44.30 -14.04 -9.74 44.63 -13.34 10.37 27.03 -15.32 9.99 26.38 -15.48 coo -9.28 44.56 -19.45 -10.46 44.31 -17.70 9.42 27.88 -8.48 9.79 29.49 -9.82 1hkd_p00 source 1hkd PEA LECTIN ALPHA CHAIN : 1 hits 1hkd_p00 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 33 ASN.? 11.91 O4' RBF A 200 coo 5.80 63.03 55.85 5.52 65.03 56.45 9.42 27.88 -8.48 9.79 29.49 -9.82 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 1 hits 1kbk_p00 naa= 1 ULMN 3 1b01_d00 GENE REGULATION/DNA user 1 3 # 1 B 4 ARG A 52 ARG.? 12.69 MG MG A 201 B 6 THR A 53 THR^? 9.82 MG MG A 201 B 8 THR A 11 THR^? 12.73 MG MG A 201 coo 40.52 16.08 100.90 37.97 16.41 102.60 23.84 4.53 13.86 23.42 2.96 16.45 coo 36.11 13.64 95.03 34.54 14.86 95.91 24.33 8.17 8.27 25.53 8.79 6.65 coo 32.72 8.05 92.39 31.25 9.11 91.35 21.92 12.33 4.05 23.51 11.55 2.72 1b01_d00 source 1b01 GENE REGULATION/DNA : 1 hits 1b01_d00 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 14 GLU.? -2.64 MG MG A 201s A 44 ASP A 21 ASP~? 10.21 CL CL A 205 A 50 THR A 17 THR~? -4.58 CL CL A 205s coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 24.27 16.08 12.66 25.65 15.19 14.03 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 17.65 20.12 5.81 16.27 21.08 7.00 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 15.13 16.09 9.66 14.08 17.47 11.01 ULMN 3 3hde_o00 LYSOZYME user 2 3 # 2 A 35 GLU A 14 GLU.? -2.64 MG MG A 201s A 44 ASP A 22 ASP~? 13.54 MG MG A 201 A 50 THR A 11 THR^? 12.73 MG MG A 201 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 24.27 16.08 12.66 25.65 15.19 14.03 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 20.90 16.89 3.17 22.62 16.55 2.02 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 21.92 12.33 4.05 23.51 11.55 2.72 ULMN 3 3hde_o00 LYSOZYME user 3 3 # 3 A 35 GLU A 57 GLU^? 8.10 CL CL A 204 A 44 ASP A 22 ASP~? 13.54 MG MG A 201 A 50 THR A 11 THR^? 12.73 MG MG A 201 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 13.53 9.08 -1.40 13.32 7.21 -2.26 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 20.90 16.89 3.17 22.62 16.55 2.02 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 21.92 12.33 4.05 23.51 11.55 2.72 3hde_o00 source 3HDE LYSOZYME : 3 hits 3hde_o00 naa= 3 ULMN 3 3hde_o01 LYSOZYME user 1 3 # 1 B 35 GLU A 13 GLU.? 5.58 MG MG A 201 B 44 ASP A 21 ASP~? 10.21 CL CL A 205 B 50 THR A 17 THR~? -4.58 CL CL A 205s coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 27.41 11.93 9.21 29.53 12.06 9.35 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 17.65 20.12 5.81 16.27 21.08 7.00 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 15.13 16.09 9.66 14.08 17.47 11.01 ULMN 3 3hde_o01 LYSOZYME user 2 3 # 2 B 35 GLU A 14 GLU.? -2.64 MG MG A 201s B 44 ASP A 21 ASP~? 10.21 CL CL A 205 B 50 THR A 17 THR~? -4.58 CL CL A 205s coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 24.27 16.08 12.66 25.65 15.19 14.03 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 17.65 20.12 5.81 16.27 21.08 7.00 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 15.13 16.09 9.66 14.08 17.47 11.01 ULMN 3 3hde_o01 LYSOZYME user 3 3 # 3 B 35 GLU A 14 GLU.? -2.64 MG MG A 201s B 44 ASP A 22 ASP~? 13.54 MG MG A 201 B 50 THR A 11 THR^? 12.73 MG MG A 201 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 24.27 16.08 12.66 25.65 15.19 14.03 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 20.90 16.89 3.17 22.62 16.55 2.02 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 21.92 12.33 4.05 23.51 11.55 2.72 ULMN 3 3hde_o01 LYSOZYME user 4 3 # 4 B 35 GLU A 38 GLU^? 3.96 MG MG A 202 B 44 ASP A 41 ASP^? -12.41 CL CL A 204s B 50 THR A 56 THR^? 8.72 CL CL A 205 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 4.92 15.48 -0.56 3.38 14.79 -1.87 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 12.01 5.97 1.89 11.89 3.91 2.21 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 15.57 10.73 4.16 14.47 11.95 5.56 ULMN 3 3hde_o01 LYSOZYME user 5 3 # 5 B 35 GLU A 57 GLU^? 8.10 CL CL A 204 B 44 ASP A 22 ASP~? 13.54 MG MG A 201 B 50 THR A 11 THR^? 12.73 MG MG A 201 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 13.53 9.08 -1.40 13.32 7.21 -2.26 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 20.90 16.89 3.17 22.62 16.55 2.02 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 21.92 12.33 4.05 23.51 11.55 2.72 3hde_o01 source 3HDE LYSOZYME : 5 hits 3hde_o01 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU A 13 GLU.? 5.58 MG MG A 201 C 44 ASP A 21 ASP~? 10.21 CL CL A 205 C 50 THR A 17 THR~? -4.58 CL CL A 205s coo 15.89 -0.52 0.58 15.91 1.38 -0.35 27.41 11.93 9.21 29.53 12.06 9.35 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 17.65 20.12 5.81 16.27 21.08 7.00 coo 25.48 4.87 1.60 23.90 4.95 0.15 15.13 16.09 9.66 14.08 17.47 11.01 ULMN 3 3hde_o02 LYSOZYME user 2 3 # 2 C 35 GLU A 14 GLU.? -2.64 MG MG A 201s C 44 ASP A 21 ASP~? 10.21 CL CL A 205 C 50 THR A 17 THR~? -4.58 CL CL A 205s coo 15.89 -0.52 0.58 15.91 1.38 -0.35 24.27 16.08 12.66 25.65 15.19 14.03 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 17.65 20.12 5.81 16.27 21.08 7.00 coo 25.48 4.87 1.60 23.90 4.95 0.15 15.13 16.09 9.66 14.08 17.47 11.01 ULMN 3 3hde_o02 LYSOZYME user 3 3 # 3 C 35 GLU A 38 GLU^? 3.96 MG MG A 202 C 44 ASP A 41 ASP^? -12.41 CL CL A 204s C 50 THR A 56 THR^? 8.72 CL CL A 205 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 4.92 15.48 -0.56 3.38 14.79 -1.87 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 12.01 5.97 1.89 11.89 3.91 2.21 coo 25.48 4.87 1.60 23.90 4.95 0.15 15.57 10.73 4.16 14.47 11.95 5.56 ULMN 3 3hde_o02 LYSOZYME user 4 3 # 4 C 35 GLU A 45 GLU^? -16.49 MG MG A 201s C 44 ASP A 22 ASP~? 13.54 MG MG A 201 C 50 THR A 9 THR^? 12.15 CL CL A 204 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 25.48 3.77 4.90 25.28 1.94 3.90 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 20.90 16.89 3.17 22.62 16.55 2.02 coo 25.48 4.87 1.60 23.90 4.95 0.15 17.67 11.10 -0.93 17.74 8.97 -0.57 ULMN 3 3hde_o02 LYSOZYME user 5 3 # 5 C 35 GLU A 45 GLU^? -16.49 MG MG A 201s C 44 ASP A 22 ASP~? 13.54 MG MG A 201 C 50 THR A 11 THR^? 12.73 MG MG A 201 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 25.48 3.77 4.90 25.28 1.94 3.90 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 20.90 16.89 3.17 22.62 16.55 2.02 coo 25.48 4.87 1.60 23.90 4.95 0.15 21.92 12.33 4.05 23.51 11.55 2.72 ULMN 3 3hde_o02 LYSOZYME user 6 3 # 6 C 35 GLU A 45 GLU^? -16.49 MG MG A 201s C 44 ASP A 22 ASP~? 13.54 MG MG A 201 C 50 THR A 56 THR^? 8.72 CL CL A 205 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 25.48 3.77 4.90 25.28 1.94 3.90 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 20.90 16.89 3.17 22.62 16.55 2.02 coo 25.48 4.87 1.60 23.90 4.95 0.15 15.57 10.73 4.16 14.47 11.95 5.56 ULMN 3 3hde_o02 LYSOZYME user 7 3 # 7 C 35 GLU A 45 GLU^? -16.49 MG MG A 201s C 44 ASP A 41 ASP^? -12.41 CL CL A 204s C 50 THR A 9 THR^? 12.15 CL CL A 204 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 25.48 3.77 4.90 25.28 1.94 3.90 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 12.01 5.97 1.89 11.89 3.91 2.21 coo 25.48 4.87 1.60 23.90 4.95 0.15 17.67 11.10 -0.93 17.74 8.97 -0.57 ULMN 3 3hde_o02 LYSOZYME user 8 3 # 8 C 35 GLU A 45 GLU^? -16.49 MG MG A 201s C 44 ASP A 41 ASP^? -12.41 CL CL A 204s C 50 THR A 56 THR^? 8.72 CL CL A 205 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 25.48 3.77 4.90 25.28 1.94 3.90 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 12.01 5.97 1.89 11.89 3.91 2.21 coo 25.48 4.87 1.60 23.90 4.95 0.15 15.57 10.73 4.16 14.47 11.95 5.56 ULMN 3 3hde_o02 LYSOZYME user 9 3 # 9 C 35 GLU A 57 GLU^? 8.10 CL CL A 204 C 44 ASP A 22 ASP~? 13.54 MG MG A 201 C 50 THR A 11 THR^? 12.73 MG MG A 201 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 13.53 9.08 -1.40 13.32 7.21 -2.26 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 20.90 16.89 3.17 22.62 16.55 2.02 coo 25.48 4.87 1.60 23.90 4.95 0.15 21.92 12.33 4.05 23.51 11.55 2.72 3hde_o02 source 3HDE LYSOZYME : 9 hits 3hde_o02 naa= 3