*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 180 ASP~? 1000.00 A 86 HIS A 179 HIS~? 1000.00 A 250 ALA A 218 ALA~? 1000.00 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 40.41 44.46 -31.53 40.92 43.32 -30.64 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP B 180 ASP~? 1000.00 A 86 HIS B 179 HIS~? 1000.00 A 250 ALA B 218 ALA~? 1000.00 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 -24.24 51.06 -28.15 -23.94 49.76 -27.45 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o00 naa= 3 ULMN 4 1aj8_c02 CITRATE SYNTHASE user 1 4 # 1 A 193 SER B 236 SER^? 1000.00 A 223 HIS B 258 HIS^? 1000.00 A 262 HIS B 211 HIS.? 1000.00 A 312 ASP B 216 ASP~? 1000.00 coo 28.44 32.05 73.53 28.64 31.12 71.24 -13.40 61.82 -38.71 -11.69 62.84 -40.02 coo 29.33 36.13 69.70 30.07 34.20 70.11 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 38.54 36.60 66.38 37.88 34.77 67.15 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 30.62 37.23 61.07 30.08 35.73 62.49 -19.23 49.40 -32.78 -18.00 47.70 -33.08 1aj8_c02 source 1aj8 CITRATE SYNTHASE : 1 hits 1aj8_c02 naa= 4 ULMN 4 1aj8_c03 CITRATE SYNTHASE user 1 4 # 1 B 193 SER B 236 SER^? 1000.00 B 223 HIS B 258 HIS^? 1000.00 B 262 HIS B 211 HIS.? 1000.00 B 312 ASP B 216 ASP~? 1000.00 coo 24.20 33.47 87.18 22.82 34.14 89.12 -13.40 61.82 -38.71 -11.69 62.84 -40.02 coo 23.86 29.50 91.20 24.12 31.58 91.00 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 29.35 31.42 99.15 28.72 33.09 98.04 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 20.42 28.25 99.26 20.25 29.62 97.63 -19.23 49.40 -32.78 -18.00 47.70 -33.08 1aj8_c03 source 1aj8 CITRATE SYNTHASE : 1 hits 1aj8_c03 naa= 4 ULMN 4 1bh2_c00 GUANINE NUCLEOTIDE-BINDING PROTEIN user 1 4 # 1 43 GLU B 31 GLU^? 1000.00 178 ARG B 29 ARG.? 1000.00 181 THR A 159 THR~? 1000.00 204 GLN B 48 GLN^? 1000.00 coo 41.47 -31.24 9.85 43.56 -31.54 10.01 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 41.39 -27.92 12.62 40.37 -30.81 12.72 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 35.15 -30.74 16.68 33.40 -30.14 15.52 12.23 54.48 -20.55 14.17 53.76 -21.00 coo 40.67 -37.01 14.42 40.72 -35.28 13.16 6.00 56.24 -14.63 6.93 56.05 -12.74 ULMN 4 1bh2_c00 GUANINE NUCLEOTIDE-BINDING PROTEIN user 2 4 # 2 43 GLU B 31 GLU^? 1000.00 178 ARG B 29 ARG.? 1000.00 181 THR B 50 THR.? 1000.00 204 GLN B 48 GLN^? 1000.00 coo 41.47 -31.24 9.85 43.56 -31.54 10.01 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 41.39 -27.92 12.62 40.37 -30.81 12.72 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 35.15 -30.74 16.68 33.40 -30.14 15.52 -0.22 50.82 -14.22 -2.27 50.70 -13.43 coo 40.67 -37.01 14.42 40.72 -35.28 13.16 6.00 56.24 -14.63 6.93 56.05 -12.74 1bh2_c00 source 1bh2 GUANINE NUCLEOTIDE-BINDING PROTEIN : 2 hits 1bh2_c00 naa= 4 ULMN 4 1dco_c03 DCOH user 1 4 # 1 D 62 HIS B 207 HIS.? 1000.00 D 63 HIS B 208 HIS.? 1000.00 D 80 HIS B 211 HIS.? 1000.00 D 89 ASP B 216 ASP~? 1000.00 coo 57.14 54.52 28.76 58.02 56.20 27.93 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 50.55 54.00 30.19 50.52 53.10 32.06 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 55.23 64.51 29.49 55.46 66.50 28.94 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 60.71 56.13 24.08 59.92 57.52 25.41 -19.23 49.40 -32.78 -18.00 47.70 -33.08 1dco_c03 source 1dco DCOH : 1 hits 1dco_c03 naa= 4 ULMN 4 1kfu_c00 M-CALPAIN LARGE SUBUNIT user 1 4 # 1 L 99 GLN A 34 GLN^? 1000.00 L 105 CYH A 43 CYH.? 1000.00 L 262 HIS A 126 HIS.? 1000.00 L 286 ASN A 122 ASN~? 1000.00 coo 7.90 16.57 52.21 10.05 16.67 52.36 36.46 72.94 -14.61 36.30 74.49 -13.14 coo 11.89 18.44 48.84 14.48 19.59 48.08 29.85 73.85 -16.38 28.65 71.48 -17.04 coo 12.67 28.39 49.40 10.59 28.60 49.39 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 9.74 33.64 46.66 9.63 32.28 48.30 26.58 61.39 -9.58 28.06 60.87 -8.14 ULMN 4 1kfu_c00 M-CALPAIN LARGE SUBUNIT user 2 4 # 2 L 99 GLN B 34 GLN^? 1000.00 L 105 CYH B 43 CYH.? 1000.00 L 262 HIS B 126 HIS.? 1000.00 L 286 ASN B 122 ASN~? 1000.00 coo 7.90 16.57 52.21 10.05 16.67 52.36 6.90 64.75 -30.21 7.61 66.16 -28.78 coo 11.89 18.44 48.84 14.48 19.59 48.08 4.94 69.22 -25.98 2.41 68.38 -25.26 coo 12.67 28.39 49.40 10.59 28.60 49.39 4.52 66.06 -17.34 5.49 64.29 -17.91 coo 9.74 33.64 46.66 9.63 32.28 48.30 1.60 60.89 -14.49 2.17 58.90 -14.85 1kfu_c00 source 1kfu M-CALPAIN LARGE SUBUNIT : 2 hits 1kfu_c00 naa= 4 ULMN 4 1pix_c02 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 1 4 # 1 A 457 ALA A 100 ALA~? 1000.00 A 458 ALA A 97 ALA~? 1000.00 B 193 ALA A 79 ALA.? 1000.00 B 194 GLY A 80 GLY.? 1000.00 coo 43.27 124.32 20.47 43.79 125.29 21.53 23.81 69.79 -23.73 24.77 68.86 -24.42 coo 39.57 123.53 20.89 38.42 124.25 20.20 24.78 65.00 -22.34 24.52 63.52 -22.51 coo 47.95 129.15 20.31 47.81 128.95 18.79 21.28 68.36 -28.97 21.60 69.72 -29.60 coo 50.40 126.23 20.48 50.46 127.00 20.75 17.64 67.16 -29.06 18.28 66.65 -29.06 ULMN 4 1pix_c02 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 2 4 # 2 A 457 ALA A 170 ALA^? 1000.00 A 458 ALA A 64 ALA~? 1000.00 B 193 ALA A 88 ALA.? 1000.00 B 194 GLY A 87 GLY.? 1000.00 coo 43.27 124.32 20.47 43.79 125.29 21.53 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 39.57 123.53 20.89 38.42 124.25 20.20 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 47.95 129.15 20.31 47.81 128.95 18.79 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 50.40 126.23 20.48 50.46 127.00 20.75 28.58 51.63 -18.31 28.23 52.29 -18.68 ULMN 4 1pix_c02 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 3 4 # 3 A 457 ALA B 170 ALA^? 1000.00 A 458 ALA B 64 ALA~? 1000.00 B 193 ALA B 88 ALA.? 1000.00 B 194 GLY B 87 GLY.? 1000.00 coo 43.27 124.32 20.47 43.79 125.29 21.53 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 39.57 123.53 20.89 38.42 124.25 20.20 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 47.95 129.15 20.31 47.81 128.95 18.79 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 50.40 126.23 20.48 50.46 127.00 20.75 -11.14 57.34 -16.26 -10.91 58.10 -16.36 1pix_c02 source 1pix GLUTACONYL-COA DECARBOXYLASE A SUBUNIT : 3 hits 1pix_c02 naa= 4 ULMN 4 1pix_c03 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 1 4 # 1 A 193 ALA A 79 ALA.? 1000.00 A 194 GLY A 80 GLY.? 1000.00 B 457 ALA A 100 ALA~? 1000.00 B 458 ALA A 97 ALA~? 1000.00 coo 61.89 87.20 13.50 62.59 88.00 12.38 21.28 68.36 -28.97 21.60 69.72 -29.60 coo 59.34 89.99 13.88 59.24 89.18 13.73 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 65.50 91.13 17.77 64.65 89.88 18.00 23.81 69.79 -23.73 24.77 68.86 -24.42 coo 68.56 91.15 20.03 69.95 90.68 19.64 24.78 65.00 -22.34 24.52 63.52 -22.51 ULMN 4 1pix_c03 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 2 4 # 2 A 193 ALA A 88 ALA.? 1000.00 A 194 GLY A 87 GLY.? 1000.00 B 457 ALA A 170 ALA^? 1000.00 B 458 ALA A 64 ALA~? 1000.00 coo 61.89 87.20 13.50 62.59 88.00 12.38 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 59.34 89.99 13.88 59.24 89.18 13.73 28.58 51.63 -18.31 28.23 52.29 -18.68 coo 65.50 91.13 17.77 64.65 89.88 18.00 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 68.56 91.15 20.03 69.95 90.68 19.64 34.93 59.77 -19.93 34.59 59.38 -18.51 ULMN 4 1pix_c03 GLUTACONYL-COA DECARBOXYLASE A SUBUNuser 3 4 # 3 A 193 ALA B 88 ALA.? 1000.00 A 194 GLY B 87 GLY.? 1000.00 B 457 ALA B 170 ALA^? 1000.00 B 458 ALA B 64 ALA~? 1000.00 coo 61.89 87.20 13.50 62.59 88.00 12.38 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 59.34 89.99 13.88 59.24 89.18 13.73 -11.14 57.34 -16.26 -10.91 58.10 -16.36 coo 65.50 91.13 17.77 64.65 89.88 18.00 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 68.56 91.15 20.03 69.95 90.68 19.64 -5.90 58.64 -25.21 -5.18 58.13 -23.98 1pix_c03 source 1pix GLUTACONYL-COA DECARBOXYLASE A SUBUNIT : 3 hits 1pix_c03 naa= 4 ULMN 4 1pma_c14 PROTEASOME user 1 4 # 1 A 35 SER A 121 SER~? 1000.00 A 66 LYS A 142 LYS^? 1000.00 A 80 GLY A 91 GLY~? 1000.00 A 167 SER A 118 SER~? 1000.00 coo 89.76 104.51 121.28 91.03 106.44 121.99 22.74 60.44 -6.78 23.90 60.97 -4.72 coo 99.01 105.66 122.24 93.37 107.22 124.79 16.76 57.98 -16.13 11.82 58.93 -17.29 coo 91.58 97.09 120.24 92.08 97.51 120.80 27.73 59.56 -14.59 28.47 59.85 -14.62 coo 85.59 103.89 117.95 84.01 104.68 119.62 25.44 56.75 -6.65 27.54 55.65 -7.08 ULMN 4 1pma_c14 PROTEASOME user 2 4 # 2 A 35 SER B 121 SER~? 1000.00 A 66 LYS B 142 LYS^? 1000.00 A 80 GLY B 91 GLY~? 1000.00 A 167 SER B 118 SER~? 1000.00 coo 89.76 104.51 121.28 91.03 106.44 121.99 3.01 61.33 -9.81 4.05 59.21 -10.36 coo 99.01 105.66 122.24 93.37 107.22 124.79 -6.19 67.97 -9.05 -7.36 69.51 -3.96 coo 91.58 97.09 120.24 92.08 97.51 120.80 -3.32 61.09 -17.15 -2.94 60.75 -17.73 coo 85.59 103.89 117.95 84.01 104.68 119.62 0.89 57.06 -10.45 -0.04 55.05 -11.41 1pma_c14 source 1pma PROTEASOME : 2 hits 1pma_c14 naa= 4 ULMN 4 1rk2_c00 RIBOKINASE user 1 4 # 1 A 252 ALA A 64 ALA~? 1000.00 A 253 ALA A 170 ALA^? 1000.00 A 254 GLY A 63 GLY~? 1000.00 A 255 ASP A 171 ASP.? 1000.00 coo 19.22 5.40 78.99 19.00 6.90 79.25 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 22.30 4.08 77.15 23.28 3.04 77.64 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 20.04 2.01 74.92 19.93 2.78 75.17 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 16.76 5.52 75.75 15.62 4.24 76.95 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 4 1rk2_c00 RIBOKINASE user 2 4 # 2 A 252 ALA A 102 ALA.? 1000.00 A 253 ALA A 79 ALA.? 1000.00 A 254 GLY A 80 GLY.? 1000.00 A 255 ASP A 103 ASP.? 1000.00 coo 19.22 5.40 78.99 19.00 6.90 79.25 19.40 65.92 -25.18 20.15 64.73 -24.61 coo 22.30 4.08 77.15 23.28 3.04 77.64 21.28 68.36 -28.97 21.60 69.72 -29.60 coo 20.04 2.01 74.92 19.93 2.78 75.17 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 16.76 5.52 75.75 15.62 4.24 76.95 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 4 1rk2_c00 RIBOKINASE user 3 4 # 3 A 252 ALA A 170 ALA^? 1000.00 A 253 ALA A 64 ALA~? 1000.00 A 254 GLY A 63 GLY~? 1000.00 A 255 ASP A 171 ASP.? 1000.00 coo 19.22 5.40 78.99 19.00 6.90 79.25 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 22.30 4.08 77.15 23.28 3.04 77.64 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 20.04 2.01 74.92 19.93 2.78 75.17 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 16.76 5.52 75.75 15.62 4.24 76.95 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 4 1rk2_c00 RIBOKINASE user 4 4 # 4 A 252 ALA B 64 ALA~? 1000.00 A 253 ALA B 170 ALA^? 1000.00 A 254 GLY B 63 GLY~? 1000.00 A 255 ASP B 171 ASP.? 1000.00 coo 19.22 5.40 78.99 19.00 6.90 79.25 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 22.30 4.08 77.15 23.28 3.04 77.64 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 20.04 2.01 74.92 19.93 2.78 75.17 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 16.76 5.52 75.75 15.62 4.24 76.95 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 4 1rk2_c00 RIBOKINASE user 5 4 # 5 A 252 ALA B 102 ALA.? 1000.00 A 253 ALA B 79 ALA.? 1000.00 A 254 GLY B 80 GLY.? 1000.00 A 255 ASP B 103 ASP.? 1000.00 coo 19.22 5.40 78.99 19.00 6.90 79.25 -7.18 75.09 -19.42 -7.62 73.69 -19.16 coo 22.30 4.08 77.15 23.28 3.04 77.64 -7.99 76.77 -23.60 -7.43 77.49 -24.80 coo 20.04 2.01 74.92 19.93 2.78 75.17 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 16.76 5.52 75.75 15.62 4.24 76.95 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 4 1rk2_c00 RIBOKINASE user 6 4 # 6 A 252 ALA B 170 ALA^? 1000.00 A 253 ALA B 64 ALA~? 1000.00 A 254 GLY B 63 GLY~? 1000.00 A 255 ASP B 171 ASP.? 1000.00 coo 19.22 5.40 78.99 19.00 6.90 79.25 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 22.30 4.08 77.15 23.28 3.04 77.64 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 20.04 2.01 74.92 19.93 2.78 75.17 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 16.76 5.52 75.75 15.62 4.24 76.95 -10.01 54.17 -24.64 -9.83 53.41 -26.64 1rk2_c00 source 1rk2 RIBOKINASE : 6 hits 1rk2_c00 naa= 4 ULMN 4 1rk2_c01 RIBOKINASE user 1 4 # 1 B 252 ALA A 64 ALA~? 1000.00 B 253 ALA A 170 ALA^? 1000.00 B 254 GLY A 63 GLY~? 1000.00 B 255 ASP A 171 ASP.? 1000.00 coo 5.65 0.71 109.93 4.85 1.99 109.63 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 4.16 -2.29 111.77 4.09 -3.72 111.27 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 7.20 -2.36 114.01 6.78 -1.70 113.77 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 7.39 2.43 113.17 9.13 2.23 112.02 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 4 1rk2_c01 RIBOKINASE user 2 4 # 2 B 252 ALA A 102 ALA.? 1000.00 B 253 ALA A 79 ALA.? 1000.00 B 254 GLY A 80 GLY.? 1000.00 B 255 ASP A 103 ASP.? 1000.00 coo 5.65 0.71 109.93 4.85 1.99 109.63 19.40 65.92 -25.18 20.15 64.73 -24.61 coo 4.16 -2.29 111.77 4.09 -3.72 111.27 21.28 68.36 -28.97 21.60 69.72 -29.60 coo 7.20 -2.36 114.01 6.78 -1.70 113.77 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 7.39 2.43 113.17 9.13 2.23 112.02 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 4 1rk2_c01 RIBOKINASE user 3 4 # 3 B 252 ALA A 170 ALA^? 1000.00 B 253 ALA A 64 ALA~? 1000.00 B 254 GLY A 63 GLY~? 1000.00 B 255 ASP A 171 ASP.? 1000.00 coo 5.65 0.71 109.93 4.85 1.99 109.63 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 4.16 -2.29 111.77 4.09 -3.72 111.27 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 7.20 -2.36 114.01 6.78 -1.70 113.77 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 7.39 2.43 113.17 9.13 2.23 112.02 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 4 1rk2_c01 RIBOKINASE user 4 4 # 4 B 252 ALA B 64 ALA~? 1000.00 B 253 ALA B 170 ALA^? 1000.00 B 254 GLY B 63 GLY~? 1000.00 B 255 ASP B 171 ASP.? 1000.00 coo 5.65 0.71 109.93 4.85 1.99 109.63 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 4.16 -2.29 111.77 4.09 -3.72 111.27 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 7.20 -2.36 114.01 6.78 -1.70 113.77 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 7.39 2.43 113.17 9.13 2.23 112.02 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 4 1rk2_c01 RIBOKINASE user 5 4 # 5 B 252 ALA B 102 ALA.? 1000.00 B 253 ALA B 79 ALA.? 1000.00 B 254 GLY B 80 GLY.? 1000.00 B 255 ASP B 103 ASP.? 1000.00 coo 5.65 0.71 109.93 4.85 1.99 109.63 -7.18 75.09 -19.42 -7.62 73.69 -19.16 coo 4.16 -2.29 111.77 4.09 -3.72 111.27 -7.99 76.77 -23.60 -7.43 77.49 -24.80 coo 7.20 -2.36 114.01 6.78 -1.70 113.77 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 7.39 2.43 113.17 9.13 2.23 112.02 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 4 1rk2_c01 RIBOKINASE user 6 4 # 6 B 252 ALA B 170 ALA^? 1000.00 B 253 ALA B 64 ALA~? 1000.00 B 254 GLY B 63 GLY~? 1000.00 B 255 ASP B 171 ASP.? 1000.00 coo 5.65 0.71 109.93 4.85 1.99 109.63 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 4.16 -2.29 111.77 4.09 -3.72 111.27 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 7.20 -2.36 114.01 6.78 -1.70 113.77 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 7.39 2.43 113.17 9.13 2.23 112.02 -10.01 54.17 -24.64 -9.83 53.41 -26.64 1rk2_c01 source 1rk2 RIBOKINASE : 6 hits 1rk2_c01 naa= 4 ULMN 4 1rk2_c02 RIBOKINASE user 1 4 # 1 C 252 ALA A 64 ALA~? 1000.00 C 253 ALA A 170 ALA^? 1000.00 C 254 GLY A 63 GLY~? 1000.00 C 255 ASP A 171 ASP.? 1000.00 coo 11.35 5.28 194.49 12.50 6.27 194.18 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 8.26 6.36 196.43 6.81 6.31 195.96 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 8.52 3.23 198.55 9.13 3.73 198.31 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 13.27 3.50 197.59 13.27 1.76 196.39 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 4 1rk2_c02 RIBOKINASE user 2 4 # 2 C 252 ALA A 102 ALA.? 1000.00 C 253 ALA A 79 ALA.? 1000.00 C 254 GLY A 80 GLY.? 1000.00 C 255 ASP A 103 ASP.? 1000.00 coo 11.35 5.28 194.49 12.50 6.27 194.18 19.40 65.92 -25.18 20.15 64.73 -24.61 coo 8.26 6.36 196.43 6.81 6.31 195.96 21.28 68.36 -28.97 21.60 69.72 -29.60 coo 8.52 3.23 198.55 9.13 3.73 198.31 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 13.27 3.50 197.59 13.27 1.76 196.39 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 4 1rk2_c02 RIBOKINASE user 3 4 # 3 C 252 ALA A 170 ALA^? 1000.00 C 253 ALA A 64 ALA~? 1000.00 C 254 GLY A 63 GLY~? 1000.00 C 255 ASP A 171 ASP.? 1000.00 coo 11.35 5.28 194.49 12.50 6.27 194.18 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 8.26 6.36 196.43 6.81 6.31 195.96 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 8.52 3.23 198.55 9.13 3.73 198.31 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 13.27 3.50 197.59 13.27 1.76 196.39 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 4 1rk2_c02 RIBOKINASE user 4 4 # 4 C 252 ALA B 64 ALA~? 1000.00 C 253 ALA B 170 ALA^? 1000.00 C 254 GLY B 63 GLY~? 1000.00 C 255 ASP B 171 ASP.? 1000.00 coo 11.35 5.28 194.49 12.50 6.27 194.18 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 8.26 6.36 196.43 6.81 6.31 195.96 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 8.52 3.23 198.55 9.13 3.73 198.31 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 13.27 3.50 197.59 13.27 1.76 196.39 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 4 1rk2_c02 RIBOKINASE user 5 4 # 5 C 252 ALA B 102 ALA.? 1000.00 C 253 ALA B 79 ALA.? 1000.00 C 254 GLY B 80 GLY.? 1000.00 C 255 ASP B 103 ASP.? 1000.00 coo 11.35 5.28 194.49 12.50 6.27 194.18 -7.18 75.09 -19.42 -7.62 73.69 -19.16 coo 8.26 6.36 196.43 6.81 6.31 195.96 -7.99 76.77 -23.60 -7.43 77.49 -24.80 coo 8.52 3.23 198.55 9.13 3.73 198.31 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 13.27 3.50 197.59 13.27 1.76 196.39 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 4 1rk2_c02 RIBOKINASE user 6 4 # 6 C 252 ALA B 170 ALA^? 1000.00 C 253 ALA B 64 ALA~? 1000.00 C 254 GLY B 63 GLY~? 1000.00 C 255 ASP B 171 ASP.? 1000.00 coo 11.35 5.28 194.49 12.50 6.27 194.18 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 8.26 6.36 196.43 6.81 6.31 195.96 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 8.52 3.23 198.55 9.13 3.73 198.31 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 13.27 3.50 197.59 13.27 1.76 196.39 -10.01 54.17 -24.64 -9.83 53.41 -26.64 1rk2_c02 source 1rk2 RIBOKINASE : 6 hits 1rk2_c02 naa= 4 ULMN 4 1rk2_c03 RIBOKINASE user 1 4 # 1 D 252 ALA A 64 ALA~? 1000.00 D 253 ALA A 170 ALA^? 1000.00 D 254 GLY A 63 GLY~? 1000.00 D 255 ASP A 171 ASP.? 1000.00 coo 15.44 -6.06 163.02 16.93 -5.92 163.28 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 13.90 -8.94 161.04 12.81 -9.89 161.50 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 11.98 -6.40 159.00 12.77 -6.36 159.23 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 15.72 -3.40 159.93 14.56 -2.20 161.19 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 4 1rk2_c03 RIBOKINASE user 2 4 # 2 D 252 ALA A 102 ALA.? 1000.00 D 253 ALA A 79 ALA.? 1000.00 D 254 GLY A 80 GLY.? 1000.00 D 255 ASP A 103 ASP.? 1000.00 coo 15.44 -6.06 163.02 16.93 -5.92 163.28 19.40 65.92 -25.18 20.15 64.73 -24.61 coo 13.90 -8.94 161.04 12.81 -9.89 161.50 21.28 68.36 -28.97 21.60 69.72 -29.60 coo 11.98 -6.40 159.00 12.77 -6.36 159.23 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 15.72 -3.40 159.93 14.56 -2.20 161.19 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 4 1rk2_c03 RIBOKINASE user 3 4 # 3 D 252 ALA A 170 ALA^? 1000.00 D 253 ALA A 64 ALA~? 1000.00 D 254 GLY A 63 GLY~? 1000.00 D 255 ASP A 171 ASP.? 1000.00 coo 15.44 -6.06 163.02 16.93 -5.92 163.28 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 13.90 -8.94 161.04 12.81 -9.89 161.50 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 11.98 -6.40 159.00 12.77 -6.36 159.23 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 15.72 -3.40 159.93 14.56 -2.20 161.19 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 4 1rk2_c03 RIBOKINASE user 4 4 # 4 D 252 ALA B 64 ALA~? 1000.00 D 253 ALA B 170 ALA^? 1000.00 D 254 GLY B 63 GLY~? 1000.00 D 255 ASP B 171 ASP.? 1000.00 coo 15.44 -6.06 163.02 16.93 -5.92 163.28 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 13.90 -8.94 161.04 12.81 -9.89 161.50 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 11.98 -6.40 159.00 12.77 -6.36 159.23 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 15.72 -3.40 159.93 14.56 -2.20 161.19 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 4 1rk2_c03 RIBOKINASE user 5 4 # 5 D 252 ALA B 102 ALA.? 1000.00 D 253 ALA B 79 ALA.? 1000.00 D 254 GLY B 80 GLY.? 1000.00 D 255 ASP B 103 ASP.? 1000.00 coo 15.44 -6.06 163.02 16.93 -5.92 163.28 -7.18 75.09 -19.42 -7.62 73.69 -19.16 coo 13.90 -8.94 161.04 12.81 -9.89 161.50 -7.99 76.77 -23.60 -7.43 77.49 -24.80 coo 11.98 -6.40 159.00 12.77 -6.36 159.23 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 15.72 -3.40 159.93 14.56 -2.20 161.19 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 4 1rk2_c03 RIBOKINASE user 6 4 # 6 D 252 ALA B 170 ALA^? 1000.00 D 253 ALA B 64 ALA~? 1000.00 D 254 GLY B 63 GLY~? 1000.00 D 255 ASP B 171 ASP.? 1000.00 coo 15.44 -6.06 163.02 16.93 -5.92 163.28 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 13.90 -8.94 161.04 12.81 -9.89 161.50 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 11.98 -6.40 159.00 12.77 -6.36 159.23 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 15.72 -3.40 159.93 14.56 -2.20 161.19 -10.01 54.17 -24.64 -9.83 53.41 -26.64 1rk2_c03 source 1rk2 RIBOKINASE : 6 hits 1rk2_c03 naa= 4 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 1 3 # 1 A 46 ASP A 69 ASP~? 1000.00 A 100 ARG A 65 ARG~? 1000.00 A 116 GLN A 34 GLN^? 1000.00 coo 32.24 20.09 5.34 30.38 19.04 5.27 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 26.40 25.34 6.28 26.15 22.33 7.25 39.12 64.28 -16.95 39.71 67.26 -16.39 coo 26.74 21.94 13.78 27.57 20.97 12.08 36.46 72.94 -14.61 36.30 74.49 -13.14 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 2 3 # 2 A 46 ASP A 69 ASP~? 1000.00 A 100 ARG A 259 ARG^? 1000.00 A 116 GLN A 74 GLN~? 1000.00 coo 32.24 20.09 5.34 30.38 19.04 5.27 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 26.40 25.34 6.28 26.15 22.33 7.25 37.44 62.38 -29.11 38.25 65.13 -30.27 coo 26.74 21.94 13.78 27.57 20.97 12.08 32.03 69.06 -32.10 32.73 67.48 -33.36 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 3 3 # 3 A 46 ASP A 103 ASP.? 1000.00 A 100 ARG B 32 ARG^? 1000.00 A 116 GLN B 34 GLN^? 1000.00 coo 32.24 20.09 5.34 30.38 19.04 5.27 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 26.40 25.34 6.28 26.15 22.33 7.25 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 26.74 21.94 13.78 27.57 20.97 12.08 6.90 64.75 -30.21 7.61 66.16 -28.78 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 4 3 # 4 A 46 ASP B 69 ASP~? 1000.00 A 100 ARG B 259 ARG^? 1000.00 A 116 GLN B 74 GLN~? 1000.00 coo 32.24 20.09 5.34 30.38 19.04 5.27 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 26.40 25.34 6.28 26.15 22.33 7.25 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo 26.74 21.94 13.78 27.57 20.97 12.08 -8.62 71.51 -33.35 -10.45 70.57 -33.84 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 5 3 # 5 A 46 ASP B 216 ASP~? 1000.00 A 100 ARG B 209 ARG.? 1000.00 A 116 GLN B 256 GLN.? 1000.00 coo 32.24 20.09 5.34 30.38 19.04 5.27 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 26.40 25.34 6.28 26.15 22.33 7.25 -14.48 44.51 -35.31 -16.23 42.88 -33.39 coo 26.74 21.94 13.78 27.57 20.97 12.08 -10.38 53.29 -38.42 -12.33 53.43 -39.31 12as_c00 source 12as ASPARAGINE SYNTHETASE : 5 hits 12as_c00 naa= 3 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 1 3 # 1 B 46 ASP A 69 ASP~? 1000.00 B 100 ARG A 65 ARG~? 1000.00 B 116 GLN A 34 GLN^? 1000.00 coo 32.18 48.37 12.48 33.96 49.46 12.97 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 39.04 43.25 11.37 38.30 45.35 13.56 39.12 64.28 -16.95 39.71 67.26 -16.39 coo 37.43 42.63 19.41 36.76 44.08 17.97 36.46 72.94 -14.61 36.30 74.49 -13.14 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 2 3 # 2 B 46 ASP A 69 ASP~? 1000.00 B 100 ARG A 259 ARG^? 1000.00 B 116 GLN A 74 GLN~? 1000.00 coo 32.18 48.37 12.48 33.96 49.46 12.97 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 39.04 43.25 11.37 38.30 45.35 13.56 37.44 62.38 -29.11 38.25 65.13 -30.27 coo 37.43 42.63 19.41 36.76 44.08 17.97 32.03 69.06 -32.10 32.73 67.48 -33.36 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 3 3 # 3 B 46 ASP A 103 ASP.? 1000.00 B 100 ARG B 32 ARG^? 1000.00 B 116 GLN B 34 GLN^? 1000.00 coo 32.18 48.37 12.48 33.96 49.46 12.97 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 39.04 43.25 11.37 38.30 45.35 13.56 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 37.43 42.63 19.41 36.76 44.08 17.97 6.90 64.75 -30.21 7.61 66.16 -28.78 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 4 3 # 4 B 46 ASP B 69 ASP~? 1000.00 B 100 ARG B 259 ARG^? 1000.00 B 116 GLN B 74 GLN~? 1000.00 coo 32.18 48.37 12.48 33.96 49.46 12.97 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 39.04 43.25 11.37 38.30 45.35 13.56 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo 37.43 42.63 19.41 36.76 44.08 17.97 -8.62 71.51 -33.35 -10.45 70.57 -33.84 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 5 3 # 5 B 46 ASP B 196 ASP.? 1000.00 B 100 ARG B 163 ARG.? 1000.00 B 116 GLN B 162 GLN.? 1000.00 coo 32.18 48.37 12.48 33.96 49.46 12.97 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo 39.04 43.25 11.37 38.30 45.35 13.56 -23.66 71.32 -13.90 -25.52 68.98 -13.20 coo 37.43 42.63 19.41 36.76 44.08 17.97 -21.62 74.08 -8.65 -22.59 72.95 -7.11 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 6 3 # 6 B 46 ASP B 216 ASP~? 1000.00 B 100 ARG B 209 ARG.? 1000.00 B 116 GLN B 256 GLN.? 1000.00 coo 32.18 48.37 12.48 33.96 49.46 12.97 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 39.04 43.25 11.37 38.30 45.35 13.56 -14.48 44.51 -35.31 -16.23 42.88 -33.39 coo 37.43 42.63 19.41 36.76 44.08 17.97 -10.38 53.29 -38.42 -12.33 53.43 -39.31 12as_c01 source 12as ASPARAGINE SYNTHETASE : 6 hits 12as_c01 naa= 3 ULMN 3 1a0j_c00 TRYPSIN user 1 3 # 1 A 57 HIS A 176 HIS~? 1000.00 A 102 ASP A 216 ASP.? 1000.00 A 195 SER A 174 SER.? 1000.00 coo 25.57 41.22 61.68 24.18 39.98 62.50 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 22.33 45.48 59.73 23.35 43.67 60.06 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 20.90 36.72 61.65 22.18 37.53 63.52 39.69 47.27 -21.33 40.40 49.18 -20.03 1a0j_c00 source 1a0j TRYPSIN : 1 hits 1a0j_c00 naa= 3 ULMN 3 1a0j_c01 TRYPSIN user 1 3 # 1 B 57 HIS A 176 HIS~? 1000.00 B 102 ASP A 216 ASP.? 1000.00 B 195 SER A 174 SER.? 1000.00 coo 44.08 45.58 52.81 45.86 46.55 52.85 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 43.04 44.75 47.18 43.31 45.51 49.13 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 48.11 50.52 52.24 48.62 48.46 53.13 39.69 47.27 -21.33 40.40 49.18 -20.03 1a0j_c01 source 1a0j TRYPSIN : 1 hits 1a0j_c01 naa= 3 ULMN 3 1a0j_c02 TRYPSIN user 1 3 # 1 C 57 HIS A 176 HIS~? 1000.00 C 102 ASP A 216 ASP.? 1000.00 C 195 SER A 174 SER.? 1000.00 coo 34.37 41.18 73.21 34.04 43.09 73.87 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 34.89 38.34 78.12 35.11 39.59 76.42 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 36.16 46.87 75.66 34.01 46.43 74.59 39.69 47.27 -21.33 40.40 49.18 -20.03 1a0j_c02 source 1a0j TRYPSIN : 1 hits 1a0j_c02 naa= 3 ULMN 3 1a0j_c03 TRYPSIN user 1 3 # 1 D 57 HIS A 176 HIS~? 1000.00 D 102 ASP A 216 ASP.? 1000.00 D 195 SER A 174 SER.? 1000.00 coo 8.19 15.01 95.72 7.78 16.53 97.01 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 13.53 16.28 93.98 11.45 16.21 94.40 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 6.63 21.03 97.42 6.71 19.20 98.95 39.69 47.27 -21.33 40.40 49.18 -20.03 1a0j_c03 source 1a0j TRYPSIN : 1 hits 1a0j_c03 naa= 3 ULMN 3 1a0j_c12 TRYPSIN user 1 3 # 1 A 57 HIS B 207 HIS.? 1000.00 A 102 ASP B 216 ASP~? 1000.00 A 193 GLY B 63 GLY~? 1000.00 coo 25.57 41.22 61.68 24.18 39.98 62.50 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 22.33 45.48 59.73 23.35 43.67 60.06 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 22.57 32.23 64.13 21.98 32.82 64.22 -7.85 56.57 -27.70 -7.10 56.66 -27.29 1a0j_c12 source 1a0j TRYPSIN : 1 hits 1a0j_c12 naa= 3 ULMN 3 1a0j_c13 TRYPSIN user 1 3 # 1 B 57 HIS B 207 HIS.? 1000.00 B 102 ASP B 216 ASP~? 1000.00 B 193 GLY B 63 GLY~? 1000.00 coo 44.08 45.58 52.81 45.86 46.55 52.85 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 43.04 44.75 47.18 43.31 45.51 49.13 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 50.46 51.91 56.90 50.65 51.62 56.14 -7.85 56.57 -27.70 -7.10 56.66 -27.29 1a0j_c13 source 1a0j TRYPSIN : 1 hits 1a0j_c13 naa= 3 ULMN 3 1a0j_c14 TRYPSIN user 1 3 # 1 C 57 HIS B 207 HIS.? 1000.00 C 102 ASP B 216 ASP~? 1000.00 C 193 GLY B 63 GLY~? 1000.00 coo 34.37 41.18 73.21 34.04 43.09 73.87 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 34.89 38.34 78.12 35.11 39.59 76.42 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 35.43 51.03 72.12 35.20 50.72 72.87 -7.85 56.57 -27.70 -7.10 56.66 -27.29 1a0j_c14 source 1a0j TRYPSIN : 1 hits 1a0j_c14 naa= 3 ULMN 3 1a0j_c15 TRYPSIN user 1 3 # 1 D 57 HIS B 207 HIS.? 1000.00 D 102 ASP B 216 ASP~? 1000.00 D 193 GLY B 63 GLY~? 1000.00 coo 8.19 15.01 95.72 7.78 16.53 97.01 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 13.53 16.28 93.98 11.45 16.21 94.40 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 1.80 21.25 100.04 2.61 21.42 100.18 -7.85 56.57 -27.70 -7.10 56.66 -27.29 1a0j_c15 source 1a0j TRYPSIN : 1 hits 1a0j_c15 naa= 3 ULMN 3 1a41_c01 TOPOISOMERASE I user 1 3 # 1 223 ARG A 184 ARG~? 1000.00 265 HIS A 179 HIS~? 1000.00 274 TYR A 110 TYR.? 1000.00 coo -15.18 55.46 8.55 -14.82 52.98 10.38 25.35 39.14 -29.34 25.56 38.90 -26.28 coo -14.48 45.59 11.18 -14.02 47.49 10.42 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 0.94 52.26 9.16 1.95 54.78 9.91 26.55 44.56 -13.80 26.13 41.81 -13.54 ULMN 3 1a41_c01 TOPOISOMERASE I user 2 3 # 2 223 ARG B 184 ARG~? 1000.00 265 HIS B 179 HIS~? 1000.00 274 TYR B 110 TYR.? 1000.00 coo -15.18 55.46 8.55 -14.82 52.98 10.38 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo -14.48 45.59 11.18 -14.02 47.49 10.42 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 0.94 52.26 9.16 1.95 54.78 9.91 -12.51 52.38 -9.11 -14.12 50.95 -7.35 1a41_c01 source 1a41 TOPOISOMERASE I : 2 hits 1a41_c01 naa= 3 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 # 1 A 49 GLU B 31 GLU^? 1000.00 A 60 ASP B 171 ASP.? 1000.00 A 175 TYR B 33 TYR^? 1000.00 coo 46.10 28.27 19.27 45.48 26.99 20.84 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 56.42 28.06 12.93 55.01 27.92 14.50 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 45.02 22.04 15.38 46.16 24.00 13.76 1.90 62.22 -26.29 0.23 63.78 -27.88 1a50_c03 source 1a50 TRYPTOPHAN SYNTHASE : 1 hits 1a50_c03 naa= 3 ULMN 3 1a8h_c02 METHIONYL-TRNA SYNTHETASE user 1 3 # 1 16 ALA A 218 ALA~? 1000.00 19 HIS A 176 HIS~? 1000.00 22 HIS A 179 HIS~? 1000.00 coo 53.27 36.51 45.29 51.98 36.45 44.47 40.41 44.46 -31.53 40.92 43.32 -30.64 coo 46.88 33.59 48.26 46.24 34.32 46.40 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 48.05 31.12 44.60 48.20 33.05 43.77 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1a8h_c02 METHIONYL-TRNA SYNTHETASE user 2 3 # 2 16 ALA A 218 ALA~? 1000.00 19 HIS A 179 HIS~? 1000.00 22 HIS A 176 HIS~? 1000.00 coo 53.27 36.51 45.29 51.98 36.45 44.47 40.41 44.46 -31.53 40.92 43.32 -30.64 coo 46.88 33.59 48.26 46.24 34.32 46.40 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 48.05 31.12 44.60 48.20 33.05 43.77 40.29 42.17 -25.19 41.57 43.60 -26.04 ULMN 3 1a8h_c02 METHIONYL-TRNA SYNTHETASE user 3 3 # 3 16 ALA B 218 ALA~? 1000.00 19 HIS B 176 HIS~? 1000.00 22 HIS B 179 HIS~? 1000.00 coo 53.27 36.51 45.29 51.98 36.45 44.47 -24.24 51.06 -28.15 -23.94 49.76 -27.45 coo 46.88 33.59 48.26 46.24 34.32 46.40 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 48.05 31.12 44.60 48.20 33.05 43.77 -21.96 51.60 -22.33 -20.77 50.80 -23.86 ULMN 3 1a8h_c02 METHIONYL-TRNA SYNTHETASE user 4 3 # 4 16 ALA B 218 ALA~? 1000.00 19 HIS B 179 HIS~? 1000.00 22 HIS B 176 HIS~? 1000.00 coo 53.27 36.51 45.29 51.98 36.45 44.47 -24.24 51.06 -28.15 -23.94 49.76 -27.45 coo 46.88 33.59 48.26 46.24 34.32 46.40 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 48.05 31.12 44.60 48.20 33.05 43.77 -21.58 46.84 -24.01 -21.23 47.14 -26.06 1a8h_c02 source 1a8h METHIONYL-TRNA SYNTHETASE : 4 hits 1a8h_c02 naa= 3 ULMN 3 1aam_c01 ASPARTATE AMINOTRANSFERASE user 1 3 # 1 142 TRP A 148 TRP.? 1000.00 223 ASP A 150 ASP.? 1000.00 258 LYS A 187 LYS~? 1000.00 coo 127.19 33.46 26.14 126.78 36.79 28.15 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 126.95 41.66 23.38 128.48 40.72 24.51 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 138.83 37.95 25.17 133.50 36.37 26.52 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1aam_c01 ASPARTATE AMINOTRANSFERASE user 2 3 # 2 142 TRP B 148 TRP.? 1000.00 223 ASP B 150 ASP.? 1000.00 258 LYS B 187 LYS~? 1000.00 coo 127.19 33.46 26.14 126.78 36.79 28.15 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 126.95 41.66 23.38 128.48 40.72 24.51 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 138.83 37.95 25.17 133.50 36.37 26.52 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1aam_c01 source 1aam ASPARTATE AMINOTRANSFERASE : 2 hits 1aam_c01 naa= 3 ULMN 3 1ab4_c00 GYRASE A user 1 3 # 1 32 ARG B 209 ARG.? 1000.00 78 HIS B 208 HIS.? 1000.00 122 TYR B 110 TYR.? 1000.00 coo 48.32 72.26 30.89 48.69 69.28 31.53 -14.48 44.51 -35.31 -16.23 42.88 -33.39 coo 53.63 68.24 34.99 53.08 69.10 33.16 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 75.01 61.87 32.93 75.34 59.26 31.96 -12.51 52.38 -9.11 -14.12 50.95 -7.35 ULMN 3 1ab4_c00 GYRASE A user 2 3 # 2 32 ARG B 215 ARG~? 1000.00 78 HIS B 207 HIS.? 1000.00 122 TYR B 33 TYR^? 1000.00 coo 48.32 72.26 30.89 48.69 69.28 31.53 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 53.63 68.24 34.99 53.08 69.10 33.16 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 75.01 61.87 32.93 75.34 59.26 31.96 1.90 62.22 -26.29 0.23 63.78 -27.88 1ab4_c00 source 1ab4 GYRASE A : 2 hits 1ab4_c00 naa= 3 ULMN 3 1aj8_c00 CITRATE SYNTHASE user 1 3 # 1 A 223 HIS B 208 HIS.? 1000.00 A 262 HIS B 258 HIS^? 1000.00 A 312 ASP B 171 ASP.? 1000.00 coo 29.33 36.13 69.70 30.07 34.20 70.11 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 38.54 36.60 66.38 37.88 34.77 67.15 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 30.62 37.23 61.07 30.08 35.73 62.49 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1aj8_c00 CITRATE SYNTHASE user 2 3 # 2 A 223 HIS B 208 HIS.? 1000.00 A 262 HIS B 258 HIS^? 1000.00 A 312 ASP B 216 ASP~? 1000.00 coo 29.33 36.13 69.70 30.07 34.20 70.11 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 38.54 36.60 66.38 37.88 34.77 67.15 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 30.62 37.23 61.07 30.08 35.73 62.49 -19.23 49.40 -32.78 -18.00 47.70 -33.08 ULMN 3 1aj8_c00 CITRATE SYNTHASE user 3 3 # 3 A 223 HIS B 211 HIS.? 1000.00 A 262 HIS B 258 HIS^? 1000.00 A 312 ASP B 216 ASP~? 1000.00 coo 29.33 36.13 69.70 30.07 34.20 70.11 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 38.54 36.60 66.38 37.88 34.77 67.15 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 30.62 37.23 61.07 30.08 35.73 62.49 -19.23 49.40 -32.78 -18.00 47.70 -33.08 ULMN 3 1aj8_c00 CITRATE SYNTHASE user 4 3 # 4 A 223 HIS B 258 HIS^? 1000.00 A 262 HIS B 208 HIS.? 1000.00 A 312 ASP B 216 ASP~? 1000.00 coo 29.33 36.13 69.70 30.07 34.20 70.11 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 38.54 36.60 66.38 37.88 34.77 67.15 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 30.62 37.23 61.07 30.08 35.73 62.49 -19.23 49.40 -32.78 -18.00 47.70 -33.08 ULMN 3 1aj8_c00 CITRATE SYNTHASE user 5 3 # 5 A 223 HIS B 258 HIS^? 1000.00 A 262 HIS B 211 HIS.? 1000.00 A 312 ASP B 216 ASP~? 1000.00 coo 29.33 36.13 69.70 30.07 34.20 70.11 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 38.54 36.60 66.38 37.88 34.77 67.15 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 30.62 37.23 61.07 30.08 35.73 62.49 -19.23 49.40 -32.78 -18.00 47.70 -33.08 1aj8_c00 source 1aj8 CITRATE SYNTHASE : 5 hits 1aj8_c00 naa= 3 ULMN 3 1aj8_c01 CITRATE SYNTHASE user 1 3 # 1 B 223 HIS B 208 HIS.? 1000.00 B 262 HIS B 258 HIS^? 1000.00 B 312 ASP B 171 ASP.? 1000.00 coo 23.86 29.50 91.20 24.12 31.58 91.00 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 29.35 31.42 99.15 28.72 33.09 98.04 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 20.42 28.25 99.26 20.25 29.62 97.63 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1aj8_c01 CITRATE SYNTHASE user 2 3 # 2 B 223 HIS B 208 HIS.? 1000.00 B 262 HIS B 258 HIS^? 1000.00 B 312 ASP B 216 ASP~? 1000.00 coo 23.86 29.50 91.20 24.12 31.58 91.00 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 29.35 31.42 99.15 28.72 33.09 98.04 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 20.42 28.25 99.26 20.25 29.62 97.63 -19.23 49.40 -32.78 -18.00 47.70 -33.08 ULMN 3 1aj8_c01 CITRATE SYNTHASE user 3 3 # 3 B 223 HIS B 211 HIS.? 1000.00 B 262 HIS B 258 HIS^? 1000.00 B 312 ASP B 216 ASP~? 1000.00 coo 23.86 29.50 91.20 24.12 31.58 91.00 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 29.35 31.42 99.15 28.72 33.09 98.04 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 20.42 28.25 99.26 20.25 29.62 97.63 -19.23 49.40 -32.78 -18.00 47.70 -33.08 ULMN 3 1aj8_c01 CITRATE SYNTHASE user 4 3 # 4 B 223 HIS B 258 HIS^? 1000.00 B 262 HIS B 208 HIS.? 1000.00 B 312 ASP B 216 ASP~? 1000.00 coo 23.86 29.50 91.20 24.12 31.58 91.00 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 29.35 31.42 99.15 28.72 33.09 98.04 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 20.42 28.25 99.26 20.25 29.62 97.63 -19.23 49.40 -32.78 -18.00 47.70 -33.08 ULMN 3 1aj8_c01 CITRATE SYNTHASE user 5 3 # 5 B 223 HIS B 258 HIS^? 1000.00 B 262 HIS B 211 HIS.? 1000.00 B 312 ASP B 216 ASP~? 1000.00 coo 23.86 29.50 91.20 24.12 31.58 91.00 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 29.35 31.42 99.15 28.72 33.09 98.04 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 20.42 28.25 99.26 20.25 29.62 97.63 -19.23 49.40 -32.78 -18.00 47.70 -33.08 1aj8_c01 source 1aj8 CITRATE SYNTHASE : 5 hits 1aj8_c01 naa= 3 ULMN 3 1akd_c01 CYTOCHROME P450CAM user 1 3 # 1 252 THR A 159 THR~? 1000.00 350 PHE A 164 PHE.? 1000.00 357 CYH A 84 CYH^? 1000.00 coo 17.85 20.47 14.62 16.85 19.84 12.80 12.23 54.48 -20.55 14.17 53.76 -21.00 coo 7.92 21.96 13.27 8.57 20.30 15.42 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 8.82 20.77 7.90 10.59 19.75 9.80 21.98 56.01 -24.01 21.70 53.26 -23.68 ULMN 3 1akd_c01 CYTOCHROME P450CAM user 2 3 # 2 252 THR B 159 THR~? 1000.00 350 PHE B 164 PHE.? 1000.00 357 CYH B 84 CYH^? 1000.00 coo 17.85 20.47 14.62 16.85 19.84 12.80 -11.88 71.81 -6.50 -12.42 70.32 -7.96 coo 7.92 21.96 13.27 8.57 20.30 15.42 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 8.82 20.77 7.90 10.59 19.75 9.80 -12.63 67.19 -16.08 -14.23 65.55 -14.52 1akd_c01 source 1akd CYTOCHROME P450CAM : 2 hits 1akd_c01 naa= 3 ULMN 3 1al6_c00 CITRATE SYNTHASE user 1 3 # 1 274 HIS B 208 HIS.? 1000.00 320 HIS B 258 HIS^? 1000.00 375 ASP B 171 ASP.? 1000.00 coo 11.08 -2.90 2.00 11.09 -3.48 -0.01 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 17.22 -10.90 1.81 16.10 -10.23 0.18 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 20.14 -1.52 3.09 18.48 -1.53 1.77 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1al6_c00 CITRATE SYNTHASE user 2 3 # 2 274 HIS B 258 HIS^? 1000.00 320 HIS B 208 HIS.? 1000.00 375 ASP B 171 ASP.? 1000.00 coo 11.08 -2.90 2.00 11.09 -3.48 -0.01 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 17.22 -10.90 1.81 16.10 -10.23 0.18 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 20.14 -1.52 3.09 18.48 -1.53 1.77 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1al6_c00 CITRATE SYNTHASE user 3 3 # 3 274 HIS B 258 HIS^? 1000.00 320 HIS B 208 HIS.? 1000.00 375 ASP B 216 ASP~? 1000.00 coo 11.08 -2.90 2.00 11.09 -3.48 -0.01 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 17.22 -10.90 1.81 16.10 -10.23 0.18 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 20.14 -1.52 3.09 18.48 -1.53 1.77 -19.23 49.40 -32.78 -18.00 47.70 -33.08 ULMN 3 1al6_c00 CITRATE SYNTHASE user 4 3 # 4 274 HIS B 258 HIS^? 1000.00 320 HIS B 211 HIS.? 1000.00 375 ASP B 216 ASP~? 1000.00 coo 11.08 -2.90 2.00 11.09 -3.48 -0.01 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 17.22 -10.90 1.81 16.10 -10.23 0.18 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 20.14 -1.52 3.09 18.48 -1.53 1.77 -19.23 49.40 -32.78 -18.00 47.70 -33.08 1al6_c00 source 1al6 CITRATE SYNTHASE : 4 hits 1al6_c00 naa= 3 ULMN 3 1am5_c04 PEPSIN user 1 3 # 1 32 ASP A 153 ASP~? 1000.00 35 SER A 154 SER~? 1000.00 215 ASP A 150 ASP.? 1000.00 coo -7.18 8.92 145.10 -8.77 8.81 143.59 12.44 43.33 -23.10 12.35 42.31 -24.93 coo -12.30 10.35 145.24 -10.75 8.55 145.88 13.11 45.91 -19.64 15.16 45.40 -18.51 coo -8.20 12.64 138.30 -8.86 10.97 139.38 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1am5_c04 PEPSIN user 2 3 # 2 32 ASP B 153 ASP~? 1000.00 35 SER B 154 SER~? 1000.00 215 ASP B 150 ASP.? 1000.00 coo -7.18 8.92 145.10 -8.77 8.81 143.59 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo -12.30 10.35 145.24 -10.75 8.55 145.88 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo -8.20 12.64 138.30 -8.86 10.97 139.38 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1am5_c04 source 1am5 PEPSIN : 2 hits 1am5_c04 naa= 3 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 150 ASP.? 1000.00 214 ASP B 69 ASP~? 1000.00 289 ASP A 153 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 26.86 59.76 46.36 25.42 58.23 45.92 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 9.42 68.07 30.27 7.35 68.27 30.10 12.44 43.33 -23.10 12.35 42.31 -24.93 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 150 ASP.? 1000.00 214 ASP B 112 ASP~? 1000.00 289 ASP A 153 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 26.86 59.76 46.36 25.42 58.23 45.92 -7.51 51.42 -7.29 -5.75 50.19 -7.48 coo 9.42 68.07 30.27 7.35 68.27 30.10 12.44 43.33 -23.10 12.35 42.31 -24.93 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 150 ASP.? 1000.00 214 ASP B 171 ASP.? 1000.00 289 ASP A 153 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 26.86 59.76 46.36 25.42 58.23 45.92 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 9.42 68.07 30.27 7.35 68.27 30.10 12.44 43.33 -23.10 12.35 42.31 -24.93 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP A 153 ASP~? 1000.00 214 ASP A 216 ASP.? 1000.00 289 ASP A 150 ASP.? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 26.86 59.76 46.36 25.42 58.23 45.92 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 9.42 68.07 30.27 7.35 68.27 30.10 20.55 41.70 -21.16 21.17 40.31 -19.69 1amy_c01 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 4 hits 1amy_c01 naa= 3 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 226 ASP~? 1000.00 227 GLU A 232 GLU^? 1000.00 289 ASP A 180 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 30.12 41.11 -36.46 28.02 41.19 -36.22 coo 3.96 55.76 41.24 4.83 57.69 41.17 33.90 53.97 -40.27 31.97 54.88 -40.30 coo 9.42 68.07 30.27 7.35 68.27 30.10 31.16 39.15 -28.07 29.29 38.21 -28.51 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP B 150 ASP.? 1000.00 227 GLU B 85 GLU^? 1000.00 289 ASP B 153 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 3.96 55.76 41.24 4.83 57.69 41.17 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo 9.42 68.07 30.27 7.35 68.27 30.10 -21.01 65.81 -3.11 -22.79 67.01 -3.06 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP B 180 ASP~? 1000.00 227 GLU B 214 GLU~? 1000.00 289 ASP B 226 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 3.96 55.76 41.24 4.83 57.69 41.17 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 9.42 68.07 30.27 7.35 68.27 30.10 -31.03 58.88 -21.73 -30.98 60.38 -20.22 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP B 226 ASP~? 1000.00 227 GLU B 214 GLU~? 1000.00 289 ASP B 180 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo 3.96 55.76 41.24 4.83 57.69 41.17 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 9.42 68.07 30.27 7.35 68.27 30.10 -26.29 53.00 -17.37 -27.58 54.12 -16.14 1amy_c06 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 4 hits 1amy_c06 naa= 3 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 3 # 1 E 33 ASP A 153 ASP~? 1000.00 E 36 SER A 154 SER~? 1000.00 E 213 ASP A 150 ASP.? 1000.00 coo 26.30 12.96 16.78 25.46 12.99 18.72 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 28.33 15.15 21.27 28.70 13.12 19.97 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 20.15 16.04 19.79 21.65 14.49 19.86 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 2 3 # 2 E 33 ASP B 153 ASP~? 1000.00 E 36 SER B 154 SER~? 1000.00 E 213 ASP B 150 ASP.? 1000.00 coo 26.30 12.96 16.78 25.46 12.99 18.72 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 28.33 15.15 21.27 28.70 13.12 19.97 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 20.15 16.04 19.79 21.65 14.49 19.86 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1apt_c04 source 1apt ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET (LYSTA IS : 2 hits 1apt_c04 naa= 3 ULMN 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 # 1 A 194 SER A 185 SER~? 1000.00 A 292 ASP A 103 ASP.? 1000.00 A 322 HIS A 176 HIS~? 1000.00 coo 36.34 32.23 39.60 36.43 34.62 39.93 24.33 45.74 -27.14 24.89 45.34 -24.82 coo 19.73 19.18 41.39 21.50 18.65 40.34 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 41.69 45.14 46.60 41.78 47.19 46.18 40.29 42.17 -25.19 41.57 43.60 -26.04 ULMN 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 2 3 # 2 A 194 SER B 185 SER~? 1000.00 A 292 ASP B 103 ASP.? 1000.00 A 322 HIS B 176 HIS~? 1000.00 coo 36.34 32.23 39.60 36.43 34.62 39.93 -21.68 60.93 -14.68 -20.41 58.94 -14.15 coo 19.73 19.18 41.39 21.50 18.65 40.34 -8.55 78.62 -16.37 -10.58 78.38 -15.81 coo 41.69 45.14 46.60 41.78 47.19 46.18 -21.58 46.84 -24.01 -21.23 47.14 -26.06 1aql_c02 source 1aql BILE-SALT ACTIVATED LIPASE : 2 hits 1aql_c02 naa= 3 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 # 1 B 194 SER A 185 SER~? 1000.00 B 292 ASP A 103 ASP.? 1000.00 B 322 HIS A 176 HIS~? 1000.00 coo 35.42 71.28 22.94 36.24 69.06 22.37 24.33 45.74 -27.14 24.89 45.34 -24.82 coo 24.74 78.07 5.59 24.32 79.03 7.46 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 48.81 64.16 26.34 49.30 62.16 26.73 40.29 42.17 -25.19 41.57 43.60 -26.04 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 2 3 # 2 B 194 SER B 185 SER~? 1000.00 B 292 ASP B 103 ASP.? 1000.00 B 322 HIS B 176 HIS~? 1000.00 coo 35.42 71.28 22.94 36.24 69.06 22.37 -21.68 60.93 -14.68 -20.41 58.94 -14.15 coo 24.74 78.07 5.59 24.32 79.03 7.46 -8.55 78.62 -16.37 -10.58 78.38 -15.81 coo 48.81 64.16 26.34 49.30 62.16 26.73 -21.58 46.84 -24.01 -21.23 47.14 -26.06 1aql_c03 source 1aql BILE-SALT ACTIVATED LIPASE : 2 hits 1aql_c03 naa= 3 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 B 325 ARG A 147 ARG.? 1000.00 B 342 ASP A 153 ASP~? 1000.00 B 531 ARG A 184 ARG~? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 24.02 40.19 -18.03 22.48 40.38 -15.40 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 25.35 39.14 -29.34 25.56 38.90 -26.28 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 B 325 ARG A 265 ARG.? 1000.00 B 342 ASP A 196 ASP.? 1000.00 B 531 ARG A 261 ARG^? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 24.20 53.21 -44.49 22.10 54.73 -46.19 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 30.87 57.44 -37.15 31.09 59.67 -39.22 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 B 325 ARG B 29 ARG.? 1000.00 B 342 ASP A 153 ASP~? 1000.00 B 531 ARG B 32 ARG^? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 10.27 58.20 -24.55 11.21 60.44 -26.40 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 B 325 ARG B 65 ARG~? 1000.00 B 342 ASP B 171 ASP.? 1000.00 B 531 ARG B 29 ARG.? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 4.10 49.74 -21.56 2.98 48.55 -24.19 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 5 3 # 5 B 325 ARG B 147 ARG.? 1000.00 B 342 ASP B 153 ASP~? 1000.00 B 531 ARG B 184 ARG~? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -18.58 53.32 -7.29 -16.65 53.40 -4.90 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 -27.45 56.94 -13.67 -25.49 55.61 -11.69 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 6 3 # 6 B 325 ARG B 263 ARG^? 1000.00 B 342 ASP B 196 ASP.? 1000.00 B 531 ARG B 265 ARG.? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 -32.45 71.36 -26.68 -29.93 72.96 -27.59 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 7 3 # 7 B 325 ARG B 265 ARG.? 1000.00 B 342 ASP B 226 ASP~? 1000.00 B 531 ARG B 263 ARG^? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -32.45 71.36 -26.68 -29.93 72.96 -27.59 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 -23.50 69.78 -28.71 -26.08 70.11 -30.40 1asy_c00 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 7 hits 1asy_c00 naa= 3 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 A 325 ARG A 147 ARG.? 1000.00 A 342 ASP A 153 ASP~? 1000.00 A 531 ARG A 184 ARG~? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 24.02 40.19 -18.03 22.48 40.38 -15.40 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 25.35 39.14 -29.34 25.56 38.90 -26.28 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 A 325 ARG A 163 ARG.? 1000.00 A 342 ASP A 153 ASP~? 1000.00 A 531 ARG B 32 ARG^? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 16.66 50.10 -32.81 17.39 47.13 -32.98 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 10.27 58.20 -24.55 11.21 60.44 -26.40 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 A 325 ARG A 184 ARG~? 1000.00 A 342 ASP A 153 ASP~? 1000.00 A 531 ARG A 147 ARG.? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 25.35 39.14 -29.34 25.56 38.90 -26.28 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 24.02 40.19 -18.03 22.48 40.38 -15.40 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 A 325 ARG A 265 ARG.? 1000.00 A 342 ASP A 196 ASP.? 1000.00 A 531 ARG A 261 ARG^? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 24.20 53.21 -44.49 22.10 54.73 -46.19 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 30.87 57.44 -37.15 31.09 59.67 -39.22 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 5 3 # 5 A 325 ARG B 147 ARG.? 1000.00 A 342 ASP B 153 ASP~? 1000.00 A 531 ARG B 184 ARG~? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -18.58 53.32 -7.29 -16.65 53.40 -4.90 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -27.45 56.94 -13.67 -25.49 55.61 -11.69 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 6 3 # 6 A 325 ARG B 221 ARG~? 1000.00 A 342 ASP B 180 ASP~? 1000.00 A 531 ARG B 215 ARG~? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -27.20 52.01 -31.22 -27.06 49.11 -30.18 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -20.00 45.16 -30.78 -18.84 42.81 -32.44 1asy_c01 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 6 hits 1asy_c01 naa= 3 ULMN 3 1avf_c04 GASTRICSIN user 1 3 # 1 A 32 ASP A 153 ASP~? 1000.00 A 35 SER A 154 SER~? 1000.00 A 217 ASP A 150 ASP.? 1000.00 coo -10.06 2.54 49.69 -8.83 3.73 50.96 12.44 43.33 -23.10 12.35 42.31 -24.93 coo -11.96 5.74 52.90 -10.55 6.74 51.22 13.11 45.91 -19.64 15.16 45.40 -18.51 coo -5.22 1.43 56.08 -5.36 2.84 54.49 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1avf_c04 GASTRICSIN user 2 3 # 2 A 32 ASP B 153 ASP~? 1000.00 A 35 SER B 154 SER~? 1000.00 A 217 ASP B 150 ASP.? 1000.00 coo -10.06 2.54 49.69 -8.83 3.73 50.96 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo -11.96 5.74 52.90 -10.55 6.74 51.22 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo -5.22 1.43 56.08 -5.36 2.84 54.49 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1avf_c04 source 1avf GASTRICSIN : 2 hits 1avf_c04 naa= 3 ULMN 3 1avf_c05 GASTRICSIN user 1 3 # 1 J 32 ASP A 153 ASP~? 1000.00 J 35 SER A 154 SER~? 1000.00 J 217 ASP A 150 ASP.? 1000.00 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 12.44 43.33 -23.10 12.35 42.31 -24.93 coo -40.93 -20.91 21.81 -38.85 -21.36 20.65 13.11 45.91 -19.64 15.16 45.40 -18.51 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1avf_c05 GASTRICSIN user 2 3 # 2 J 32 ASP B 153 ASP~? 1000.00 J 35 SER B 154 SER~? 1000.00 J 217 ASP B 150 ASP.? 1000.00 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo -40.93 -20.91 21.81 -38.85 -21.36 20.65 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1avf_c05 source 1avf GASTRICSIN : 2 hits 1avf_c05 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 175 PHE~? 1000.00 A 223 ASP A 180 ASP~? 1000.00 A 265 LYS A 187 LYS~? 1000.00 coo 39.74 52.86 65.74 41.15 55.14 66.52 37.18 42.29 -18.99 37.49 39.73 -17.89 coo 30.70 47.50 67.53 29.83 49.47 67.39 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 19.99 54.53 64.11 20.55 58.78 68.33 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1ax4_c04 TRYPTOPHANASE user 2 3 # 2 A 130 PHE B 175 PHE~? 1000.00 A 223 ASP B 180 ASP~? 1000.00 A 265 LYS B 187 LYS~? 1000.00 coo 39.74 52.86 65.74 41.15 55.14 66.52 -17.18 46.27 -18.74 -18.37 44.26 -17.14 coo 30.70 47.50 67.53 29.83 49.47 67.39 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 19.99 54.53 64.11 20.55 58.78 68.33 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1ax4_c04 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 175 PHE~? 1000.00 B 223 ASP A 180 ASP~? 1000.00 B 265 LYS A 187 LYS~? 1000.00 coo 7.48 54.94 99.62 7.67 52.27 100.42 37.18 42.29 -18.99 37.49 39.73 -17.89 coo 10.43 61.66 91.81 9.80 60.04 90.61 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 5.43 58.06 80.08 8.57 53.00 79.37 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1ax4_c05 TRYPTOPHANASE user 2 3 # 2 B 130 PHE B 175 PHE~? 1000.00 B 223 ASP B 180 ASP~? 1000.00 B 265 LYS B 187 LYS~? 1000.00 coo 7.48 54.94 99.62 7.67 52.27 100.42 -17.18 46.27 -18.74 -18.37 44.26 -17.14 coo 10.43 61.66 91.81 9.80 60.04 90.61 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 5.43 58.06 80.08 8.57 53.00 79.37 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1ax4_c05 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 175 PHE~? 1000.00 C 223 ASP A 180 ASP~? 1000.00 C 265 LYS A 187 LYS~? 1000.00 coo -6.55 73.45 23.60 -6.77 71.48 21.66 37.18 42.29 -18.99 37.49 39.73 -17.89 coo -9.52 75.74 33.62 -8.85 73.74 33.93 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -4.44 67.20 42.32 -7.50 62.41 40.49 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1ax4_c06 TRYPTOPHANASE user 2 3 # 2 C 130 PHE B 175 PHE~? 1000.00 C 223 ASP B 180 ASP~? 1000.00 C 265 LYS B 187 LYS~? 1000.00 coo -6.55 73.45 23.60 -6.77 71.48 21.66 -17.18 46.27 -18.74 -18.37 44.26 -17.14 coo -9.52 75.74 33.62 -8.85 73.74 33.93 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -4.44 67.20 42.32 -7.50 62.41 40.49 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1ax4_c06 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 175 PHE~? 1000.00 D 223 ASP A 180 ASP~? 1000.00 D 265 LYS A 187 LYS~? 1000.00 coo -38.60 55.38 52.70 -40.06 57.72 53.04 37.18 42.29 -18.99 37.49 39.73 -17.89 coo -29.46 51.67 48.51 -28.63 53.31 49.56 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -18.87 56.53 54.79 -19.47 62.22 53.03 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1ax4_c07 TRYPTOPHANASE user 2 3 # 2 D 130 PHE B 175 PHE~? 1000.00 D 223 ASP B 180 ASP~? 1000.00 D 265 LYS B 187 LYS~? 1000.00 coo -38.60 55.38 52.70 -40.06 57.72 53.04 -17.18 46.27 -18.74 -18.37 44.26 -17.14 coo -29.46 51.67 48.51 -28.63 53.31 49.56 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -18.87 56.53 54.79 -19.47 62.22 53.03 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1ax4_c07 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c07 naa= 3 ULMN 3 1ay4_c02 AROMATIC AMINO ACID AMINOTRANSFERASEuser 1 3 # 1 A 140 TRP A 148 TRP.? 1000.00 A 222 ASP A 150 ASP.? 1000.00 A 258 LYS A 187 LYS~? 1000.00 coo 89.83 15.40 0.01 90.61 18.86 1.71 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 82.92 20.43 2.47 84.82 20.45 1.55 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 89.09 24.00 -8.81 89.39 20.33 -4.16 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1ay4_c02 AROMATIC AMINO ACID AMINOTRANSFERASEuser 2 3 # 2 A 140 TRP B 148 TRP.? 1000.00 A 222 ASP B 150 ASP.? 1000.00 A 258 LYS B 187 LYS~? 1000.00 coo 89.83 15.40 0.01 90.61 18.86 1.71 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 82.92 20.43 2.47 84.82 20.45 1.55 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 89.09 24.00 -8.81 89.39 20.33 -4.16 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1ay4_c02 source 1ay4 AROMATIC AMINO ACID AMINOTRANSFERASE : 2 hits 1ay4_c02 naa= 3 ULMN 3 1ay4_c03 AROMATIC AMINO ACID AMINOTRANSFERASEuser 1 3 # 1 B 140 TRP A 148 TRP.? 1000.00 B 222 ASP A 150 ASP.? 1000.00 B 258 LYS A 187 LYS~? 1000.00 coo 103.45 44.39 16.20 102.66 41.02 14.32 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 110.10 38.66 15.58 108.40 39.41 14.53 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 107.51 45.54 4.76 105.41 44.51 10.25 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1ay4_c03 AROMATIC AMINO ACID AMINOTRANSFERASEuser 2 3 # 2 B 140 TRP B 148 TRP.? 1000.00 B 222 ASP B 150 ASP.? 1000.00 B 258 LYS B 187 LYS~? 1000.00 coo 103.45 44.39 16.20 102.66 41.02 14.32 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 110.10 38.66 15.58 108.40 39.41 14.53 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 107.51 45.54 4.76 105.41 44.51 10.25 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1ay4_c03 source 1ay4 AROMATIC AMINO ACID AMINOTRANSFERASE : 2 hits 1ay4_c03 naa= 3 ULMN 3 1b66_c00 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASEuser 1 3 # 1 A 133 GLU B 214 GLU~? 1000.00 B 88 ASP A 180 ASP~? 1000.00 B 89 HIS A 179 HIS~? 1000.00 coo 44.53 38.98 5.35 43.53 40.60 6.22 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 58.74 13.49 55.78 58.72 14.38 57.67 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 60.89 12.20 60.42 60.43 13.81 61.68 36.05 43.80 -26.83 37.70 44.95 -26.27 1b66_c00 source 1b66 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASE : 1 hits 1b66_c00 naa= 3 ULMN 3 1b66_c02 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASEuser 1 3 # 1 A 133 GLU B 214 GLU~? 1000.00 B 88 ASP A 180 ASP~? 1000.00 B 89 HIS A 179 HIS~? 1000.00 coo 44.53 38.98 5.35 43.53 40.60 6.22 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 58.74 13.49 55.78 58.72 14.38 57.67 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 60.89 12.20 60.42 60.43 13.81 61.68 36.05 43.80 -26.83 37.70 44.95 -26.27 1b66_c02 source 1b66 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASE : 1 hits 1b66_c02 naa= 3 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 1 3 # 1 A 18 HIS A 126 HIS.? 1000.00 A 91 ARG A 124 ARG~? 1000.00 A 129 SER A 121 SER~? 1000.00 coo 24.39 47.01 49.70 26.42 47.04 49.21 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 25.98 44.20 42.23 28.53 42.98 43.43 17.74 63.32 -6.93 16.21 63.99 -4.36 coo 30.00 49.76 45.68 28.73 48.72 47.47 22.74 60.44 -6.78 23.90 60.97 -4.72 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 2 3 # 2 A 18 HIS A 258 HIS^? 1000.00 A 91 ARG A 259 ARG^? 1000.00 A 129 SER A 236 SER.? 1000.00 coo 24.39 47.01 49.70 26.42 47.04 49.21 43.13 56.70 -29.91 45.18 56.51 -30.28 coo 25.98 44.20 42.23 28.53 42.98 43.43 37.44 62.38 -29.11 38.25 65.13 -30.27 coo 30.00 49.76 45.68 28.73 48.72 47.47 41.86 63.23 -33.55 42.01 65.65 -33.24 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 3 3 # 3 A 18 HIS B 176 HIS~? 1000.00 A 91 ARG B 215 ARG~? 1000.00 A 129 SER B 174 SER.? 1000.00 coo 24.39 47.01 49.70 26.42 47.04 49.21 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 25.98 44.20 42.23 28.53 42.98 43.43 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 30.00 49.76 45.68 28.73 48.72 47.47 -15.19 48.74 -23.97 -12.89 48.81 -23.13 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 4 3 # 4 A 18 HIS B 258 HIS^? 1000.00 A 91 ARG B 259 ARG^? 1000.00 A 129 SER B 236 SER^? 1000.00 coo 24.39 47.01 49.70 26.42 47.04 49.21 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 25.98 44.20 42.23 28.53 42.98 43.43 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo 30.00 49.76 45.68 28.73 48.72 47.47 -13.40 61.82 -38.71 -11.69 62.84 -40.02 1b6t_c00 source 1b6t PHOSPHOPANTETHEINE ADENYLYLTRANSFERASE : 4 hits 1b6t_c00 naa= 3 ULMN 3 1b6t_c01 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 1 3 # 1 B 18 HIS B 176 HIS~? 1000.00 B 91 ARG B 215 ARG~? 1000.00 B 129 SER B 174 SER.? 1000.00 coo 18.19 17.03 40.71 18.55 17.18 38.64 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 25.60 21.10 38.54 23.57 20.93 36.25 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 21.33 14.29 34.62 19.25 14.88 35.71 -15.19 48.74 -23.97 -12.89 48.81 -23.13 1b6t_c01 source 1b6t PHOSPHOPANTETHEINE ADENYLYLTRANSFERASE : 1 hits 1b6t_c01 naa= 3 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 A 145 TYR A 146 TYR.? 1000.00 A 230 ASP A 109 ASP^? 1000.00 A 273 LYS A 142 LYS^? 1000.00 coo 9.23 21.44 106.88 10.18 19.34 105.31 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 1.45 22.80 104.16 2.58 21.02 104.01 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 2.97 11.64 107.87 6.59 15.13 107.03 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 2 3 # 2 A 145 TYR B 146 TYR.? 1000.00 A 230 ASP B 109 ASP^? 1000.00 A 273 LYS B 142 LYS^? 1000.00 coo 9.23 21.44 106.88 10.18 19.34 105.31 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 1.45 22.80 104.16 2.58 21.02 104.01 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 2.97 11.64 107.87 6.59 15.13 107.03 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1b8g_c04 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 2 hits 1b8g_c04 naa= 3 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 B 145 TYR A 146 TYR.? 1000.00 B 230 ASP A 109 ASP^? 1000.00 B 273 LYS A 142 LYS^? 1000.00 coo 11.81 13.41 73.03 10.00 13.03 75.12 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 19.17 11.01 76.14 17.26 10.42 76.77 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 11.10 2.31 76.60 10.24 7.24 75.62 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 2 3 # 2 B 145 TYR B 146 TYR.? 1000.00 B 230 ASP B 109 ASP^? 1000.00 B 273 LYS B 142 LYS^? 1000.00 coo 11.81 13.41 73.03 10.00 13.03 75.12 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 19.17 11.01 76.14 17.26 10.42 76.77 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 11.10 2.31 76.60 10.24 7.24 75.62 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1b8g_c05 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 2 hits 1b8g_c05 naa= 3 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 1 3 # 1 A 88 PHE A 98 PHE~? 1000.00 A 159 ASP A 103 ASP.? 1000.00 A 188 LYS A 142 LYS^? 1000.00 coo 13.91 34.58 14.67 12.95 36.00 12.47 20.41 66.79 -18.28 18.29 68.29 -17.20 coo 20.97 28.40 16.26 20.19 30.15 15.34 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 22.55 41.65 15.60 18.92 37.20 14.63 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 2 3 # 2 A 88 PHE A 164 PHE.? 1000.00 A 159 ASP A 103 ASP.? 1000.00 A 188 LYS A 142 LYS^? 1000.00 coo 13.91 34.58 14.67 12.95 36.00 12.47 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 20.97 28.40 16.26 20.19 30.15 15.34 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 22.55 41.65 15.60 18.92 37.20 14.63 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 3 3 # 3 A 88 PHE A 164 PHE.? 1000.00 A 159 ASP A 196 ASP.? 1000.00 A 188 LYS A 187 LYS~? 1000.00 coo 13.91 34.58 14.67 12.95 36.00 12.47 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 20.97 28.40 16.26 20.19 30.15 15.34 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 22.55 41.65 15.60 18.92 37.20 14.63 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 4 3 # 4 A 88 PHE A 219 PHE~? 1000.00 A 159 ASP A 180 ASP~? 1000.00 A 188 LYS A 187 LYS~? 1000.00 coo 13.91 34.58 14.67 12.95 36.00 12.47 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 20.97 28.40 16.26 20.19 30.15 15.34 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 22.55 41.65 15.60 18.92 37.20 14.63 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 5 3 # 5 A 88 PHE B 98 PHE~? 1000.00 A 159 ASP B 103 ASP.? 1000.00 A 188 LYS B 142 LYS^? 1000.00 coo 13.91 34.58 14.67 12.95 36.00 12.47 -1.57 71.96 -16.72 0.00 73.74 -15.26 coo 20.97 28.40 16.26 20.19 30.15 15.34 -8.55 78.62 -16.37 -10.58 78.38 -15.81 coo 22.55 41.65 15.60 18.92 37.20 14.63 -6.19 67.97 -9.05 -7.36 69.51 -3.96 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 6 3 # 6 A 88 PHE B 164 PHE.? 1000.00 A 159 ASP B 103 ASP.? 1000.00 A 188 LYS B 142 LYS^? 1000.00 coo 13.91 34.58 14.67 12.95 36.00 12.47 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 20.97 28.40 16.26 20.19 30.15 15.34 -8.55 78.62 -16.37 -10.58 78.38 -15.81 coo 22.55 41.65 15.60 18.92 37.20 14.63 -6.19 67.97 -9.05 -7.36 69.51 -3.96 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 7 3 # 7 A 88 PHE B 164 PHE.? 1000.00 A 159 ASP B 196 ASP.? 1000.00 A 188 LYS B 187 LYS~? 1000.00 coo 13.91 34.58 14.67 12.95 36.00 12.47 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 20.97 28.40 16.26 20.19 30.15 15.34 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo 22.55 41.65 15.60 18.92 37.20 14.63 -25.11 64.37 -17.06 -29.98 61.05 -17.38 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 8 3 # 8 A 88 PHE B 219 PHE~? 1000.00 A 159 ASP B 180 ASP~? 1000.00 A 188 LYS B 187 LYS~? 1000.00 coo 13.91 34.58 14.67 12.95 36.00 12.47 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 20.97 28.40 16.26 20.19 30.15 15.34 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 22.55 41.65 15.60 18.92 37.20 14.63 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1b9h_c02 source 1b9h 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHASE : 8 hits 1b9h_c02 naa= 3 ULMN 3 1bbs_c06 RENIN user 1 3 # 1 32 ASP A 153 ASP~? 1000.00 35 SER A 154 SER~? 1000.00 215 ASP A 150 ASP.? 1000.00 coo 61.19 45.85 78.73 62.86 45.48 77.48 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 66.00 46.17 80.29 64.31 47.92 79.91 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 63.61 40.10 74.06 64.05 42.07 74.70 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1bbs_c06 RENIN user 2 3 # 2 32 ASP B 153 ASP~? 1000.00 35 SER B 154 SER~? 1000.00 215 ASP B 150 ASP.? 1000.00 coo 61.19 45.85 78.73 62.86 45.48 77.48 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 66.00 46.17 80.29 64.31 47.92 79.91 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 63.61 40.10 74.06 64.05 42.07 74.70 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1bbs_c06 source 1bbs RENIN : 2 hits 1bbs_c06 naa= 3 ULMN 3 1bbs_c07 RENIN user 1 3 # 1 32 ASP A 153 ASP~? 1000.00 35 SER A 154 SER~? 1000.00 215 ASP A 150 ASP.? 1000.00 coo 61.19 45.85 78.73 62.86 45.48 77.48 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 66.00 46.17 80.29 64.31 47.92 79.91 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 63.61 40.10 74.06 64.05 42.07 74.70 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1bbs_c07 RENIN user 2 3 # 2 32 ASP B 153 ASP~? 1000.00 35 SER B 154 SER~? 1000.00 215 ASP B 150 ASP.? 1000.00 coo 61.19 45.85 78.73 62.86 45.48 77.48 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 66.00 46.17 80.29 64.31 47.92 79.91 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 63.61 40.10 74.06 64.05 42.07 74.70 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1bbs_c07 source 1bbs RENIN : 2 hits 1bbs_c07 naa= 3 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 A 137 ARG B 32 ARG^? 1000.00 A 141 THR A 82 THR^? 1000.00 A 235 ASP A 153 ASP~? 1000.00 coo 6.21 93.81 36.58 4.58 96.33 37.17 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 6.80 92.87 28.33 4.91 92.74 27.40 17.89 60.42 -27.59 16.15 59.46 -28.49 coo 12.98 90.36 47.57 11.26 89.62 46.62 12.44 43.33 -23.10 12.35 42.31 -24.93 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 A 137 ARG B 263 ARG^? 1000.00 A 141 THR B 198 THR.? 1000.00 A 235 ASP B 226 ASP~? 1000.00 coo 6.21 93.81 36.58 4.58 96.33 37.17 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo 6.80 92.87 28.33 4.91 92.74 27.40 -20.79 75.66 -25.85 -19.05 76.91 -26.40 coo 12.98 90.36 47.57 11.26 89.62 46.62 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1bd3_c00 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 2 hits 1bd3_c00 naa= 3 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 D 137 ARG A 157 ARG~? 1000.00 D 141 THR B 49 THR.? 1000.00 D 235 ASP A 150 ASP.? 1000.00 coo -8.33 92.80 100.06 -7.71 95.33 98.44 8.37 47.22 -17.87 10.68 45.40 -16.87 coo -9.24 93.49 108.77 -7.37 94.21 109.61 1.45 53.07 -16.84 0.95 52.67 -18.92 coo -14.64 87.74 89.51 -12.89 87.43 90.65 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 D 137 ARG B 29 ARG.? 1000.00 D 141 THR A 159 THR~? 1000.00 D 235 ASP B 171 ASP.? 1000.00 coo -8.33 92.80 100.06 -7.71 95.33 98.44 4.10 49.74 -21.56 2.98 48.55 -24.19 coo -9.24 93.49 108.77 -7.37 94.21 109.61 12.23 54.48 -20.55 14.17 53.76 -21.00 coo -14.64 87.74 89.51 -12.89 87.43 90.65 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 D 137 ARG B 263 ARG^? 1000.00 D 141 THR B 198 THR.? 1000.00 D 235 ASP B 226 ASP~? 1000.00 coo -8.33 92.80 100.06 -7.71 95.33 98.44 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo -9.24 93.49 108.77 -7.37 94.21 109.61 -20.79 75.66 -25.85 -19.05 76.91 -26.40 coo -14.64 87.74 89.51 -12.89 87.43 90.65 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1bd3_c01 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 3 hits 1bd3_c01 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG B 32 ARG^? 1000.00 C 141 THR A 82 THR^? 1000.00 C 235 ASP A 153 ASP~? 1000.00 coo -5.79 67.26 36.83 -4.57 64.58 37.74 10.27 58.20 -24.55 11.21 60.44 -26.40 coo -6.81 68.31 28.28 -4.82 68.47 27.57 17.89 60.42 -27.59 16.15 59.46 -28.49 coo -13.01 70.96 47.58 -11.44 71.65 46.34 12.44 43.33 -23.10 12.35 42.31 -24.93 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 C 137 ARG B 263 ARG^? 1000.00 C 141 THR B 198 THR.? 1000.00 C 235 ASP B 226 ASP~? 1000.00 coo -5.79 67.26 36.83 -4.57 64.58 37.74 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo -6.81 68.31 28.28 -4.82 68.47 27.57 -20.79 75.66 -25.85 -19.05 76.91 -26.40 coo -13.01 70.96 47.58 -11.44 71.65 46.34 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 2 hits 1bd3_c02 naa= 3 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 B 137 ARG A 157 ARG~? 1000.00 B 141 THR B 49 THR.? 1000.00 B 235 ASP A 150 ASP.? 1000.00 coo 8.13 67.41 100.27 7.18 68.35 97.45 8.37 47.22 -17.87 10.68 45.40 -16.87 coo 8.28 67.78 108.81 6.22 67.65 109.43 1.45 53.07 -16.84 0.95 52.67 -18.92 coo 14.55 73.52 89.47 12.81 73.95 90.56 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 B 137 ARG A 263 ARG^? 1000.00 B 141 THR A 198 THR.? 1000.00 B 235 ASP A 226 ASP~? 1000.00 coo 8.13 67.41 100.27 7.18 68.35 97.45 27.84 56.47 -39.37 28.80 55.40 -42.11 coo 8.28 67.78 108.81 6.22 67.65 109.43 22.33 59.92 -38.79 21.99 61.99 -38.10 coo 14.55 73.52 89.47 12.81 73.95 90.56 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 B 137 ARG A 265 ARG.? 1000.00 B 141 THR A 198 THR.? 1000.00 B 235 ASP A 226 ASP~? 1000.00 coo 8.13 67.41 100.27 7.18 68.35 97.45 24.20 53.21 -44.49 22.10 54.73 -46.19 coo 8.28 67.78 108.81 6.22 67.65 109.43 22.33 59.92 -38.79 21.99 61.99 -38.10 coo 14.55 73.52 89.47 12.81 73.95 90.56 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 B 137 ARG B 29 ARG.? 1000.00 B 141 THR A 159 THR~? 1000.00 B 235 ASP B 171 ASP.? 1000.00 coo 8.13 67.41 100.27 7.18 68.35 97.45 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 8.28 67.78 108.81 6.22 67.65 109.43 12.23 54.48 -20.55 14.17 53.76 -21.00 coo 14.55 73.52 89.47 12.81 73.95 90.56 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 B 137 ARG B 263 ARG^? 1000.00 B 141 THR B 198 THR.? 1000.00 B 235 ASP B 226 ASP~? 1000.00 coo 8.13 67.41 100.27 7.18 68.35 97.45 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo 8.28 67.78 108.81 6.22 67.65 109.43 -20.79 75.66 -25.85 -19.05 76.91 -26.40 coo 14.55 73.52 89.47 12.81 73.95 90.56 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1bd3_c03 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 5 hits 1bd3_c03 naa= 3 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 1 3 # 1 14 ASP A 216 ASP.? 1000.00 16 HIS A 176 HIS~? 1000.00 67 GLY A 89 GLY.? 1000.00 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 30.13 54.80 -14.22 29.42 55.21 -14.27 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 2 3 # 2 14 ASP A 216 ASP.? 1000.00 16 HIS A 207 HIS.? 1000.00 67 GLY A 87 GLY.? 1000.00 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 47.62 53.84 -26.65 48.80 52.61 -27.88 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 28.58 51.63 -18.31 28.23 52.29 -18.68 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 3 3 # 3 14 ASP A 216 ASP.? 1000.00 16 HIS A 207 HIS.? 1000.00 67 GLY A 89 GLY.? 1000.00 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 47.62 53.84 -26.65 48.80 52.61 -27.88 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 30.13 54.80 -14.22 29.42 55.21 -14.27 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 4 3 # 4 14 ASP B 216 ASP~? 1000.00 16 HIS B 207 HIS.? 1000.00 67 GLY B 87 GLY.? 1000.00 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -11.14 57.34 -16.26 -10.91 58.10 -16.36 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 5 3 # 5 14 ASP B 216 ASP~? 1000.00 16 HIS B 207 HIS.? 1000.00 67 GLY B 89 GLY.? 1000.00 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -5.69 56.38 -16.53 -5.55 57.13 -16.19 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 6 3 # 6 14 ASP B 216 ASP~? 1000.00 16 HIS B 258 HIS^? 1000.00 67 GLY B 87 GLY.? 1000.00 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -11.14 57.34 -16.26 -10.91 58.10 -16.36 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 7 3 # 7 14 ASP B 216 ASP~? 1000.00 16 HIS B 258 HIS^? 1000.00 67 GLY B 89 GLY.? 1000.00 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -5.69 56.38 -16.53 -5.55 57.13 -16.19 1be1_c02 source 1be1 GLUTAMATE MUTASE : 7 hits 1be1_c02 naa= 3 ULMN 3 1bfd_c00 BENZOYLFORMATE DECARBOXYLASE user 1 3 # 1 28 GLU B 125 GLU~? 1000.00 70 HIS B 126 HIS.? 1000.00 281 HIS B 176 HIS~? 1000.00 coo 66.09 46.17 155.81 66.77 48.19 155.70 7.31 63.46 -12.63 8.49 61.96 -13.60 coo 69.05 50.55 157.03 68.00 52.29 156.51 4.52 66.06 -17.34 5.49 64.29 -17.91 coo 100.93 36.73 156.02 100.47 38.42 157.18 -21.58 46.84 -24.01 -21.23 47.14 -26.06 1bfd_c00 source 1bfd BENZOYLFORMATE DECARBOXYLASE : 1 hits 1bfd_c00 naa= 3 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 1 3 # 1 118 ARG A 157 ARG~? 1000.00 183 LYS A 142 LYS^? 1000.00 317 ARG B 124 ARG~? 1000.00 coo 76.57 109.19 73.41 73.86 110.26 72.16 8.37 47.22 -17.87 10.68 45.40 -16.87 coo 82.09 117.51 66.37 80.60 114.32 71.44 16.76 57.98 -16.13 11.82 58.93 -17.29 coo 65.21 120.62 58.76 63.62 123.14 59.66 4.43 66.08 -6.94 4.84 63.03 -6.70 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 2 3 # 2 118 ARG A 263 ARG^? 1000.00 183 LYS A 187 LYS~? 1000.00 317 ARG B 32 ARG^? 1000.00 coo 76.57 109.19 73.41 73.86 110.26 72.16 27.84 56.47 -39.37 28.80 55.40 -42.11 coo 82.09 117.51 66.37 80.60 114.32 71.44 23.37 46.40 -32.46 25.34 41.04 -34.48 coo 65.21 120.62 58.76 63.62 123.14 59.66 10.27 58.20 -24.55 11.21 60.44 -26.40 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 3 3 # 3 118 ARG A 265 ARG.? 1000.00 183 LYS A 187 LYS~? 1000.00 317 ARG A 221 ARG~? 1000.00 coo 76.57 109.19 73.41 73.86 110.26 72.16 24.20 53.21 -44.49 22.10 54.73 -46.19 coo 82.09 117.51 66.37 80.60 114.32 71.44 23.37 46.40 -32.46 25.34 41.04 -34.48 coo 65.21 120.62 58.76 63.62 123.14 59.66 41.84 43.61 -35.19 44.19 44.98 -33.77 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 4 3 # 4 118 ARG B 32 ARG^? 1000.00 183 LYS A 142 LYS^? 1000.00 317 ARG A 147 ARG.? 1000.00 coo 76.57 109.19 73.41 73.86 110.26 72.16 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 82.09 117.51 66.37 80.60 114.32 71.44 16.76 57.98 -16.13 11.82 58.93 -17.29 coo 65.21 120.62 58.76 63.62 123.14 59.66 24.02 40.19 -18.03 22.48 40.38 -15.40 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 5 3 # 5 118 ARG B 32 ARG^? 1000.00 183 LYS A 142 LYS^? 1000.00 317 ARG B 124 ARG~? 1000.00 coo 76.57 109.19 73.41 73.86 110.26 72.16 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 82.09 117.51 66.37 80.60 114.32 71.44 16.76 57.98 -16.13 11.82 58.93 -17.29 coo 65.21 120.62 58.76 63.62 123.14 59.66 4.43 66.08 -6.94 4.84 63.03 -6.70 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 6 3 # 6 118 ARG B 265 ARG.? 1000.00 183 LYS B 187 LYS~? 1000.00 317 ARG B 221 ARG~? 1000.00 coo 76.57 109.19 73.41 73.86 110.26 72.16 -32.45 71.36 -26.68 -29.93 72.96 -27.59 coo 82.09 117.51 66.37 80.60 114.32 71.44 -25.11 64.37 -17.06 -29.98 61.05 -17.38 coo 65.21 120.62 58.76 63.62 123.14 59.66 -27.20 52.01 -31.22 -27.06 49.11 -30.18 1bib_c00 source 1bib BIRA BIFUNCTIONAL PROTEIN (ACTS AS BIOTIN OPER: 6 hits 1bib_c00 naa= 3 ULMN 3 1bjo_c00 PHOSPHOSERINE AMINOTRANSFERASE user 1 3 # 1 A 102 TRP A 148 TRP.? 1000.00 A 174 ASP A 150 ASP.? 1000.00 A 198 LYS A 187 LYS~? 1000.00 coo 21.59 67.76 35.19 19.10 64.95 36.34 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 19.39 73.14 39.98 19.70 71.07 40.14 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 27.94 65.10 43.55 24.20 64.94 40.01 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1bjo_c00 PHOSPHOSERINE AMINOTRANSFERASE user 2 3 # 2 A 102 TRP B 148 TRP.? 1000.00 A 174 ASP B 150 ASP.? 1000.00 A 198 LYS B 187 LYS~? 1000.00 coo 21.59 67.76 35.19 19.10 64.95 36.34 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 19.39 73.14 39.98 19.70 71.07 40.14 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 27.94 65.10 43.55 24.20 64.94 40.01 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1bjo_c00 source 1bjo PHOSPHOSERINE AMINOTRANSFERASE : 2 hits 1bjo_c00 naa= 3 ULMN 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 1 3 # 1 A 53 SER A 151 SER.? 1000.00 A 54 PRO A 152 PRO~? 1000.00 A 96 ASP A 150 ASP.? 1000.00 coo -9.03 45.15 44.45 -7.51 43.26 44.28 17.70 41.87 -24.64 15.49 41.01 -23.98 coo -12.82 46.62 43.11 -11.69 44.75 42.79 17.74 45.85 -26.04 16.93 44.84 -24.17 coo -5.86 47.39 44.34 -4.55 46.60 42.83 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 2 3 # 2 A 53 SER A 151 SER.? 1000.00 A 54 PRO A 152 PRO~? 1000.00 A 96 ASP A 153 ASP~? 1000.00 coo -9.03 45.15 44.45 -7.51 43.26 44.28 17.70 41.87 -24.64 15.49 41.01 -23.98 coo -12.82 46.62 43.11 -11.69 44.75 42.79 17.74 45.85 -26.04 16.93 44.84 -24.17 coo -5.86 47.39 44.34 -4.55 46.60 42.83 12.44 43.33 -23.10 12.35 42.31 -24.93 ULMN 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 3 3 # 3 A 53 SER B 151 SER.? 1000.00 A 54 PRO B 152 PRO~? 1000.00 A 96 ASP B 150 ASP.? 1000.00 coo -9.03 45.15 44.45 -7.51 43.26 44.28 -22.74 61.81 -6.90 -22.89 62.92 -4.74 coo -12.82 46.62 43.11 -11.69 44.75 42.79 -21.45 65.48 -8.94 -20.54 63.93 -7.60 coo -5.86 47.39 44.34 -4.55 46.60 42.83 -20.37 58.06 -6.86 -20.05 56.11 -6.15 ULMN 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 4 3 # 4 A 53 SER B 151 SER.? 1000.00 A 54 PRO B 152 PRO~? 1000.00 A 96 ASP B 153 ASP~? 1000.00 coo -9.03 45.15 44.45 -7.51 43.26 44.28 -22.74 61.81 -6.90 -22.89 62.92 -4.74 coo -12.82 46.62 43.11 -11.69 44.75 42.79 -21.45 65.48 -8.94 -20.54 63.93 -7.60 coo -5.86 47.39 44.34 -4.55 46.60 42.83 -21.01 65.81 -3.11 -22.79 67.01 -3.06 1boo_c00 source 1boo N-4 CYTOSINE-SPECIFIC METHYLTRANSFERASE PVU II: 4 hits 1boo_c00 naa= 3 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 1 3 # 1 30 GLY B 63 GLY~? 1000.00 48 HIS B 207 HIS.? 1000.00 99 ASP B 216 ASP~? 1000.00 coo 12.38 5.55 24.25 13.27 5.59 24.39 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 18.80 12.68 24.53 17.69 13.54 26.08 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 17.07 18.51 26.62 16.67 17.07 28.09 -19.23 49.40 -32.78 -18.00 47.70 -33.08 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 2 3 # 2 30 GLY B 63 GLY~? 1000.00 48 HIS B 258 HIS^? 1000.00 99 ASP B 216 ASP~? 1000.00 coo 12.38 5.55 24.25 13.27 5.59 24.39 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 18.80 12.68 24.53 17.69 13.54 26.08 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 17.07 18.51 26.62 16.67 17.07 28.09 -19.23 49.40 -32.78 -18.00 47.70 -33.08 1bp2_c00 source 1bp2 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSPHATIDE AC: 2 hits 1bp2_c00 naa= 3 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 1 3 # 1 A 109 PHE A 220 PHE~? 1000.00 A 205 ASP A 180 ASP~? 1000.00 A 236 LYS A 187 LYS~? 1000.00 coo 4.14 2.10 36.34 6.69 3.08 36.92 37.14 49.75 -33.03 36.85 51.68 -31.02 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 2 3 # 2 A 109 PHE B 220 PHE~? 1000.00 A 205 ASP B 180 ASP~? 1000.00 A 236 LYS B 187 LYS~? 1000.00 coo 4.14 2.10 36.34 6.69 3.08 36.92 -21.98 57.13 -29.07 -19.25 57.39 -28.59 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1bs0_c01 source 1bs0 8-AMINO-7-OXONANOATE SYNTHASE : 2 hits 1bs0_c01 naa= 3 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 74 GLN~? 1000.00 A 91 LEU A 71 LEU~? 1000.00 A 133 GLU A 76 GLU~? 1000.00 coo 43.58 43.67 66.73 42.32 42.78 68.15 32.03 69.06 -32.10 32.73 67.48 -33.36 coo 38.58 45.09 70.44 38.28 45.21 72.59 29.60 66.14 -25.23 28.66 64.23 -25.82 coo 44.05 36.87 70.65 43.15 38.64 69.97 26.44 70.16 -33.87 28.34 70.73 -33.08 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN B 74 GLN~? 1000.00 A 91 LEU B 71 LEU~? 1000.00 A 133 GLU B 76 GLU~? 1000.00 coo 43.58 43.67 66.73 42.32 42.78 68.15 -8.62 71.51 -33.35 -10.45 70.57 -33.84 coo 38.58 45.09 70.44 38.28 45.21 72.59 -6.20 68.49 -26.95 -7.88 67.86 -25.76 coo 44.05 36.87 70.65 43.15 38.64 69.97 -8.83 77.04 -30.71 -8.86 75.29 -31.91 1bs4_c00 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c00 naa= 3 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 # 1 B 550 GLN A 74 GLN~? 1000.00 B 591 LEU A 71 LEU~? 1000.00 B 633 GLU A 76 GLU~? 1000.00 coo 88.06 44.34 57.19 89.06 45.53 55.74 32.03 69.06 -32.10 32.73 67.48 -33.36 coo 86.70 48.66 52.61 87.15 48.69 50.51 29.60 66.14 -25.23 28.66 64.23 -25.82 coo 95.42 44.52 54.43 93.46 45.31 54.70 26.44 70.16 -33.87 28.34 70.73 -33.08 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 2 3 # 2 B 550 GLN B 74 GLN~? 1000.00 B 591 LEU B 71 LEU~? 1000.00 B 633 GLU B 76 GLU~? 1000.00 coo 88.06 44.34 57.19 89.06 45.53 55.74 -8.62 71.51 -33.35 -10.45 70.57 -33.84 coo 86.70 48.66 52.61 87.15 48.69 50.51 -6.20 68.49 -26.95 -7.88 67.86 -25.76 coo 95.42 44.52 54.43 93.46 45.31 54.70 -8.83 77.04 -30.71 -8.86 75.29 -31.91 1bs4_c01 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c01 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 74 GLN~? 1000.00 C1091 LEU A 71 LEU~? 1000.00 C1133 GLU A 76 GLU~? 1000.00 coo 68.29 34.44 43.03 66.67 34.74 44.37 32.03 69.06 -32.10 32.73 67.48 -33.36 coo 65.83 38.95 47.05 65.46 38.90 49.20 29.60 66.14 -25.23 28.66 64.23 -25.82 coo 63.14 29.39 46.25 63.84 31.31 45.74 26.44 70.16 -33.87 28.34 70.73 -33.08 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 # 2 C1050 GLN B 74 GLN~? 1000.00 C1091 LEU B 71 LEU~? 1000.00 C1133 GLU B 76 GLU~? 1000.00 coo 68.29 34.44 43.03 66.67 34.74 44.37 -8.62 71.51 -33.35 -10.45 70.57 -33.84 coo 65.83 38.95 47.05 65.46 38.90 49.20 -6.20 68.49 -26.95 -7.88 67.86 -25.76 coo 63.14 29.39 46.25 63.84 31.31 45.74 -8.83 77.04 -30.71 -8.86 75.29 -31.91 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c02 naa= 3 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN B 74 GLN~? 1000.00 A 91 LEU B 71 LEU~? 1000.00 A 133 GLU B 76 GLU~? 1000.00 coo 38.23 53.34 67.59 38.84 53.87 69.56 -8.62 71.51 -33.35 -10.45 70.57 -33.84 coo 35.40 53.22 73.30 35.37 54.87 74.74 -6.20 68.49 -26.95 -7.88 67.86 -25.76 coo 45.08 56.04 70.60 43.15 55.19 70.77 -8.83 77.04 -30.71 -8.86 75.29 -31.91 1bsj_c00 source 1bsj PEPTIDE DEFORMYLASE : 1 hits 1bsj_c00 naa= 3 ULMN 3 1bu7_c02 CYTOCHROME P450 user 1 3 # 1 A 268 THR A 159 THR~? 1000.00 A 393 PHE A 164 PHE.? 1000.00 A 400 CYH A 84 CYH^? 1000.00 coo 45.81 71.19 43.26 47.70 70.19 43.25 12.23 54.48 -20.55 14.17 53.76 -21.00 coo 48.54 63.17 48.16 46.74 64.99 49.22 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 53.76 64.39 46.87 52.06 66.55 47.33 21.98 56.01 -24.01 21.70 53.26 -23.68 ULMN 3 1bu7_c02 CYTOCHROME P450 user 2 3 # 2 A 268 THR B 159 THR~? 1000.00 A 393 PHE B 164 PHE.? 1000.00 A 400 CYH B 84 CYH^? 1000.00 coo 45.81 71.19 43.26 47.70 70.19 43.25 -11.88 71.81 -6.50 -12.42 70.32 -7.96 coo 48.54 63.17 48.16 46.74 64.99 49.22 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 53.76 64.39 46.87 52.06 66.55 47.33 -12.63 67.19 -16.08 -14.23 65.55 -14.52 1bu7_c02 source 1bu7 CYTOCHROME P450 : 2 hits 1bu7_c02 naa= 3 ULMN 3 1bu7_c03 CYTOCHROME P450 user 1 3 # 1 B 268 THR A 159 THR~? 1000.00 B 393 PHE A 164 PHE.? 1000.00 B 400 CYH A 84 CYH^? 1000.00 coo 37.20 116.32 52.00 35.18 117.07 52.13 12.23 54.48 -20.55 14.17 53.76 -21.00 coo 33.81 121.65 59.26 35.49 119.55 59.81 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 28.79 121.15 57.00 30.51 118.99 56.70 21.98 56.01 -24.01 21.70 53.26 -23.68 ULMN 3 1bu7_c03 CYTOCHROME P450 user 2 3 # 2 B 268 THR B 159 THR~? 1000.00 B 393 PHE B 164 PHE.? 1000.00 B 400 CYH B 84 CYH^? 1000.00 coo 37.20 116.32 52.00 35.18 117.07 52.13 -11.88 71.81 -6.50 -12.42 70.32 -7.96 coo 33.81 121.65 59.26 35.49 119.55 59.81 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 28.79 121.15 57.00 30.51 118.99 56.70 -12.63 67.19 -16.08 -14.23 65.55 -14.52 1bu7_c03 source 1bu7 CYTOCHROME P450 : 2 hits 1bu7_c03 naa= 3 ULMN 3 1bvz_c08 ALPHA-AMYLASE II user 1 3 # 1 A 325 ASP B 109 ASP^? 1000.00 A 354 GLU B 85 GLU^? 1000.00 A 421 ASP B 171 ASP.? 1000.00 coo 31.05 49.37 64.51 31.97 51.11 63.85 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 29.07 50.42 58.36 29.02 52.18 59.49 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo 30.82 59.76 58.47 31.12 59.02 60.40 -10.01 54.17 -24.64 -9.83 53.41 -26.64 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 109 ASP^? 1000.00 B 354 GLU B 85 GLU^? 1000.00 B 421 ASP B 171 ASP.? 1000.00 coo 25.90 8.19 53.87 25.36 6.97 52.29 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 27.87 10.66 47.95 27.82 8.60 48.27 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo 26.02 1.87 43.38 25.90 1.97 45.49 -10.01 54.17 -24.64 -9.83 53.41 -26.64 1bvz_c09 source 1bvz ALPHA-AMYLASE II : 1 hits 1bvz_c09 naa= 3 ULMN 3 1bzc_c00 PROTEIN-TYROSINE-PHOSPHATASE user 1 3 # 1 A 181 ASP B 153 ASP~? 1000.00 A 215 CYH B 158 CYH~? 1000.00 A 221 ARG B 157 ARG~? 1000.00 coo -20.67 62.35 15.68 -20.16 63.09 17.59 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo -17.06 60.65 8.77 -19.43 59.04 8.89 -12.08 69.38 -3.58 -11.47 66.78 -2.72 coo -21.54 63.29 10.68 -19.32 62.77 12.69 -17.32 68.53 0.64 -19.15 66.09 0.17 1bzc_c00 source 1bzc PROTEIN-TYROSINE-PHOSPHATASE : 1 hits 1bzc_c00 naa= 3 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 # 1 A 14 ASP A 180 ASP~? 1000.00 A 16 HIS A 179 HIS~? 1000.00 A 67 GLY A 149 GLY.? 1000.00 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 24.26 41.57 -24.29 23.75 41.95 -23.82 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 2 3 # 2 A 14 ASP B 180 ASP~? 1000.00 A 16 HIS B 179 HIS~? 1000.00 A 67 GLY B 149 GLY.? 1000.00 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 -22.40 57.02 -11.14 -21.86 57.41 -10.67 1cb7_c06 source 1cb7 GLUTAMATE MUTASE : 2 hits 1cb7_c06 naa= 3 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 # 1 C 14 ASP A 180 ASP~? 1000.00 C 16 HIS A 179 HIS~? 1000.00 C 67 GLY A 149 GLY.? 1000.00 coo 10.04 44.27 88.44 9.47 42.32 89.03 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 6.38 39.80 88.71 6.88 38.89 86.87 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 17.63 42.50 89.25 18.11 42.29 88.64 24.26 41.57 -24.29 23.75 41.95 -23.82 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 2 3 # 2 C 14 ASP B 180 ASP~? 1000.00 C 16 HIS B 179 HIS~? 1000.00 C 67 GLY B 149 GLY.? 1000.00 coo 10.04 44.27 88.44 9.47 42.32 89.03 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 6.38 39.80 88.71 6.88 38.89 86.87 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 17.63 42.50 89.25 18.11 42.29 88.64 -22.40 57.02 -11.14 -21.86 57.41 -10.67 1cb7_c07 source 1cb7 GLUTAMATE MUTASE : 2 hits 1cb7_c07 naa= 3 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 1 3 # 1 71 ARG A 263 ARG^? 1000.00 127 ARG A 261 ARG^? 1000.00 270 GLU A 76 GLU~? 1000.00 coo -0.83 25.63 1.57 0.97 28.05 0.90 27.84 56.47 -39.37 28.80 55.40 -42.11 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 30.87 57.44 -37.15 31.09 59.67 -39.22 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 26.44 70.16 -33.87 28.34 70.73 -33.08 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 2 3 # 2 71 ARG B 29 ARG.? 1000.00 127 ARG A 157 ARG~? 1000.00 270 GLU B 114 GLU~? 1000.00 coo -0.83 25.63 1.57 0.97 28.05 0.90 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 8.37 47.22 -17.87 10.68 45.40 -16.87 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 -0.41 50.21 -7.66 -0.26 48.43 -6.50 1cbx_c01 source 1cbx CARBOXYPEPTIDASE A (E.C.3.4.17.1) COMPLEX WITH: 2 hits 1cbx_c01 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP B 180 ASP~? 1000.00 264 GLU B 232 GLU^? 1000.00 328 ASP B 226 ASP~? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 59.69 92.71 39.85 58.53 92.03 41.47 -23.91 65.19 -31.75 -23.94 67.24 -32.30 coo 45.39 90.72 40.63 45.07 89.14 41.90 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 1 hits 1cdg_c00 naa= 3 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 A 198 GLY B 38 GLY.? 1000.00 A 228 SER B 35 SER.? 1000.00 A 549 ASP B 69 ASP~? 1000.00 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 3.42 71.15 -36.87 3.16 70.82 -36.21 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 2.59 66.18 -29.95 3.35 68.46 -29.55 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 -3.24 63.62 -31.80 -1.56 62.34 -31.63 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 # 2 A 198 GLY B 149 GLY.? 1000.00 A 228 SER B 151 SER.? 1000.00 A 549 ASP B 153 ASP~? 1000.00 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 -22.40 57.02 -11.14 -21.86 57.41 -10.67 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 -22.74 61.81 -6.90 -22.89 62.92 -4.74 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 -21.01 65.81 -3.11 -22.79 67.01 -3.06 1cjy_c00 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 2 hits 1cjy_c00 naa= 3 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 B1198 GLY A 149 GLY.? 1000.00 B1228 SER A 151 SER.? 1000.00 B1549 ASP A 153 ASP~? 1000.00 coo 126.34 72.75 125.66 125.95 73.27 126.11 24.26 41.57 -24.29 23.75 41.95 -23.82 coo 131.65 74.68 129.41 130.31 72.73 128.82 17.70 41.87 -24.64 15.49 41.01 -23.98 coo 134.72 69.43 130.42 133.03 70.65 130.08 12.44 43.33 -23.10 12.35 42.31 -24.93 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 # 2 B1198 GLY B 38 GLY.? 1000.00 B1228 SER B 35 SER.? 1000.00 B1549 ASP B 69 ASP~? 1000.00 coo 126.34 72.75 125.66 125.95 73.27 126.11 3.42 71.15 -36.87 3.16 70.82 -36.21 coo 131.65 74.68 129.41 130.31 72.73 128.82 2.59 66.18 -29.95 3.35 68.46 -29.55 coo 134.72 69.43 130.42 133.03 70.65 130.08 -3.24 63.62 -31.80 -1.56 62.34 -31.63 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 3 3 # 3 B1198 GLY B 149 GLY.? 1000.00 B1228 SER B 151 SER.? 1000.00 B1549 ASP B 153 ASP~? 1000.00 coo 126.34 72.75 125.66 125.95 73.27 126.11 -22.40 57.02 -11.14 -21.86 57.41 -10.67 coo 131.65 74.68 129.41 130.31 72.73 128.82 -22.74 61.81 -6.90 -22.89 62.92 -4.74 coo 134.72 69.43 130.42 133.03 70.65 130.08 -21.01 65.81 -3.11 -22.79 67.01 -3.06 1cjy_c01 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 3 hits 1cjy_c01 naa= 3 ULMN 3 1cms_c04 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 1 3 # 1 34 ASP A 153 ASP~? 1000.00 37 SER A 154 SER~? 1000.00 216 ASP A 150 ASP.? 1000.00 coo 16.90 26.20 29.49 16.22 24.50 28.41 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 12.23 24.31 30.40 14.55 23.96 31.03 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 13.93 25.52 22.10 14.75 24.44 23.75 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1cms_c04 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 2 3 # 2 34 ASP B 153 ASP~? 1000.00 37 SER B 154 SER~? 1000.00 216 ASP B 150 ASP.? 1000.00 coo 16.90 26.20 29.49 16.22 24.50 28.41 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 12.23 24.31 30.40 14.55 23.96 31.03 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 13.93 25.52 22.10 14.75 24.44 23.75 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1cms_c04 source 1cms CHYMOSIN B (FORMERLY KNOWN AS RENNIN) (E.C.3.4: 2 hits 1cms_c04 naa= 3 ULMN 3 1cns_c00 CHITINASE user 1 3 # 1 A 67 GLU A 125 GLU~? 1000.00 A 89 GLU A 120 GLU~? 1000.00 A 120 SER A 118 SER~? 1000.00 coo -24.35 9.53 67.64 -25.07 11.29 68.60 23.57 65.98 -5.71 25.38 66.11 -4.60 coo -31.18 6.91 75.60 -32.39 8.51 74.91 19.22 58.37 -9.01 17.46 57.61 -9.85 coo -34.73 8.57 68.21 -33.63 9.08 70.28 25.44 56.75 -6.65 27.54 55.65 -7.08 ULMN 3 1cns_c00 CHITINASE user 2 3 # 2 A 67 GLU B 125 GLU~? 1000.00 A 89 GLU B 120 GLU~? 1000.00 A 120 SER B 118 SER~? 1000.00 coo -24.35 9.53 67.64 -25.07 11.29 68.60 7.31 63.46 -12.63 8.49 61.96 -13.60 coo -31.18 6.91 75.60 -32.39 8.51 74.91 -1.89 62.61 -7.03 -2.47 61.78 -5.12 coo -34.73 8.57 68.21 -33.63 9.08 70.28 0.89 57.06 -10.45 -0.04 55.05 -11.41 1cns_c00 source 1cns CHITINASE : 2 hits 1cns_c00 naa= 3 ULMN 3 1cns_c01 CHITINASE user 1 3 # 1 B 67 GLU A 120 GLU~? 1000.00 B 89 GLU B 125 GLU~? 1000.00 B 120 SER A 140 SER.? 1000.00 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 19.22 58.37 -9.01 17.46 57.61 -9.85 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 7.31 63.46 -12.63 8.49 61.96 -13.60 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 15.23 64.32 -16.11 13.87 63.76 -14.16 ULMN 3 1cns_c01 CHITINASE user 2 3 # 2 B 67 GLU B 125 GLU~? 1000.00 B 89 GLU B 120 GLU~? 1000.00 B 120 SER B 118 SER~? 1000.00 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 7.31 63.46 -12.63 8.49 61.96 -13.60 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 -1.89 62.61 -7.03 -2.47 61.78 -5.12 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 0.89 57.06 -10.45 -0.04 55.05 -11.41 1cns_c01 source 1cns CHITINASE : 2 hits 1cns_c01 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR B 33 TYR^? 1000.00 A 173 ASP B 69 ASP~? 1000.00 C 48 ARG B 32 ARG^? 1000.00 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 1.90 62.22 -26.29 0.23 63.78 -27.88 coo 24.35 4.55 25.11 25.94 3.23 25.53 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 10.27 58.20 -24.55 11.21 60.44 -26.40 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c00 naa= 3 ULMN 3 1d5r_c00 PHOSPHOINOSITIDE PHOSPHOTASE PTEN user 1 3 # 1 A 92 ASP B 153 ASP~? 1000.00 A 124 CYH B 158 CYH~? 1000.00 A 130 ARG B 157 ARG~? 1000.00 coo 38.50 84.15 22.11 36.72 85.12 21.46 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 39.50 92.46 25.29 36.94 91.57 26.24 -12.08 69.38 -3.58 -11.47 66.78 -2.72 coo 39.28 86.97 26.61 39.95 87.60 23.68 -17.32 68.53 0.64 -19.15 66.09 0.17 1d5r_c00 source 1d5r PHOSPHOINOSITIDE PHOSPHOTASE PTEN : 1 hits 1d5r_c00 naa= 3 ULMN 3 1d7r_c01 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 1 3 # 1 A 138 TRP A 148 TRP.? 1000.00 A 243 ASP A 150 ASP.? 1000.00 A 272 LYS A 187 LYS~? 1000.00 coo 18.21 54.75 18.05 19.91 55.17 21.59 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 16.93 55.67 9.65 17.16 54.23 11.19 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 14.13 45.79 13.40 14.25 49.41 18.30 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1d7r_c01 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 2 3 # 2 A 138 TRP B 148 TRP.? 1000.00 A 243 ASP B 150 ASP.? 1000.00 A 272 LYS B 187 LYS~? 1000.00 coo 18.21 54.75 18.05 19.91 55.17 21.59 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 16.93 55.67 9.65 17.16 54.23 11.19 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 14.13 45.79 13.40 14.25 49.41 18.30 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1d7r_c01 source 1d7r 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYRUVATE) : 2 hits 1d7r_c01 naa= 3 ULMN 3 1dco_c00 DCOH user 1 3 # 1 A 62 HIS A 179 HIS~? 1000.00 A 63 HIS A 176 HIS~? 1000.00 A 89 ASP A 180 ASP~? 1000.00 coo 49.66 36.74 42.37 48.88 35.30 43.64 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 49.93 35.76 35.94 51.58 36.96 35.47 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 46.15 35.33 47.12 47.46 33.99 46.29 31.16 39.15 -28.07 29.29 38.21 -28.51 ULMN 3 1dco_c00 DCOH user 2 3 # 2 A 62 HIS B 179 HIS~? 1000.00 A 63 HIS B 176 HIS~? 1000.00 A 89 ASP B 180 ASP~? 1000.00 coo 49.66 36.74 42.37 48.88 35.30 43.64 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 49.93 35.76 35.94 51.58 36.96 35.47 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 46.15 35.33 47.12 47.46 33.99 46.29 -26.29 53.00 -17.37 -27.58 54.12 -16.14 ULMN 3 1dco_c00 DCOH user 3 3 # 3 A 62 HIS B 207 HIS.? 1000.00 A 63 HIS B 208 HIS.? 1000.00 A 89 ASP B 216 ASP~? 1000.00 coo 49.66 36.74 42.37 48.88 35.30 43.64 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 49.93 35.76 35.94 51.58 36.96 35.47 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 46.15 35.33 47.12 47.46 33.99 46.29 -19.23 49.40 -32.78 -18.00 47.70 -33.08 1dco_c00 source 1dco DCOH : 3 hits 1dco_c00 naa= 3 ULMN 3 1ddj_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 207 HIS.? 1000.00 A 646 ASP A 216 ASP.? 1000.00 A 739 GLY A 63 GLY~? 1000.00 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 47.62 53.84 -26.65 48.80 52.61 -27.88 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 11.37 50.89 2.29 11.05 51.63 2.25 37.99 58.72 -21.88 37.62 58.91 -21.10 ULMN 3 1ddj_c12 PLASMINOGEN user 2 3 # 2 A 603 HIS B 179 HIS~? 1000.00 A 646 ASP B 180 ASP~? 1000.00 A 739 GLY B 87 GLY.? 1000.00 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 11.37 50.89 2.29 11.05 51.63 2.25 -11.14 57.34 -16.26 -10.91 58.10 -16.36 ULMN 3 1ddj_c12 PLASMINOGEN user 3 3 # 3 A 603 HIS B 207 HIS.? 1000.00 A 646 ASP B 216 ASP~? 1000.00 A 739 GLY B 63 GLY~? 1000.00 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 11.37 50.89 2.29 11.05 51.63 2.25 -7.85 56.57 -27.70 -7.10 56.66 -27.29 1ddj_c12 source 1ddj PLASMINOGEN : 3 hits 1ddj_c12 naa= 3 ULMN 3 1ddj_c13 PLASMINOGEN user 1 3 # 1 B 603 HIS A 179 HIS~? 1000.00 B 646 ASP A 180 ASP~? 1000.00 B 739 GLY A 87 GLY.? 1000.00 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 28.58 51.63 -18.31 28.23 52.29 -18.68 ULMN 3 1ddj_c13 PLASMINOGEN user 2 3 # 2 B 603 HIS A 207 HIS.? 1000.00 B 646 ASP A 216 ASP.? 1000.00 B 739 GLY A 63 GLY~? 1000.00 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 47.62 53.84 -26.65 48.80 52.61 -27.88 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 37.99 58.72 -21.88 37.62 58.91 -21.10 ULMN 3 1ddj_c13 PLASMINOGEN user 3 3 # 3 B 603 HIS B 179 HIS~? 1000.00 B 646 ASP B 180 ASP~? 1000.00 B 739 GLY B 87 GLY.? 1000.00 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 -11.14 57.34 -16.26 -10.91 58.10 -16.36 ULMN 3 1ddj_c13 PLASMINOGEN user 4 3 # 4 B 603 HIS B 207 HIS.? 1000.00 B 646 ASP B 216 ASP~? 1000.00 B 739 GLY B 63 GLY~? 1000.00 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 -7.85 56.57 -27.70 -7.10 56.66 -27.29 1ddj_c13 source 1ddj PLASMINOGEN : 4 hits 1ddj_c13 naa= 3 ULMN 3 1ddj_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 179 HIS~? 1000.00 C 646 ASP A 180 ASP~? 1000.00 C 739 GLY A 87 GLY.? 1000.00 coo 15.33 59.81 59.60 13.98 60.99 60.69 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 16.06 55.72 54.73 15.97 56.49 56.70 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 9.38 49.29 65.28 9.01 50.03 65.31 28.58 51.63 -18.31 28.23 52.29 -18.68 ULMN 3 1ddj_c14 PLASMINOGEN user 2 3 # 2 C 603 HIS A 207 HIS.? 1000.00 C 646 ASP A 216 ASP.? 1000.00 C 739 GLY A 63 GLY~? 1000.00 coo 15.33 59.81 59.60 13.98 60.99 60.69 47.62 53.84 -26.65 48.80 52.61 -27.88 coo 16.06 55.72 54.73 15.97 56.49 56.70 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 9.38 49.29 65.28 9.01 50.03 65.31 37.99 58.72 -21.88 37.62 58.91 -21.10 ULMN 3 1ddj_c14 PLASMINOGEN user 3 3 # 3 C 603 HIS B 179 HIS~? 1000.00 C 646 ASP B 180 ASP~? 1000.00 C 739 GLY B 87 GLY.? 1000.00 coo 15.33 59.81 59.60 13.98 60.99 60.69 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 16.06 55.72 54.73 15.97 56.49 56.70 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 9.38 49.29 65.28 9.01 50.03 65.31 -11.14 57.34 -16.26 -10.91 58.10 -16.36 ULMN 3 1ddj_c14 PLASMINOGEN user 4 3 # 4 C 603 HIS B 207 HIS.? 1000.00 C 646 ASP B 216 ASP~? 1000.00 C 739 GLY B 63 GLY~? 1000.00 coo 15.33 59.81 59.60 13.98 60.99 60.69 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 16.06 55.72 54.73 15.97 56.49 56.70 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 9.38 49.29 65.28 9.01 50.03 65.31 -7.85 56.57 -27.70 -7.10 56.66 -27.29 1ddj_c14 source 1ddj PLASMINOGEN : 4 hits 1ddj_c14 naa= 3 ULMN 3 1ddj_c15 PLASMINOGEN user 1 3 # 1 D 603 HIS A 179 HIS~? 1000.00 D 646 ASP A 180 ASP~? 1000.00 D 739 GLY A 87 GLY.? 1000.00 coo -30.51 33.83 43.05 -30.50 33.12 45.03 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -25.73 33.05 39.28 -27.50 34.05 39.88 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -27.66 47.32 40.66 -27.81 47.01 41.41 28.58 51.63 -18.31 28.23 52.29 -18.68 ULMN 3 1ddj_c15 PLASMINOGEN user 2 3 # 2 D 603 HIS A 179 HIS~? 1000.00 D 646 ASP A 180 ASP~? 1000.00 D 739 GLY A 227 GLY.? 1000.00 coo -30.51 33.83 43.05 -30.50 33.12 45.03 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -25.73 33.05 39.28 -27.50 34.05 39.88 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -27.66 47.32 40.66 -27.81 47.01 41.41 29.43 42.95 -40.95 28.91 42.83 -40.42 ULMN 3 1ddj_c15 PLASMINOGEN user 3 3 # 3 D 603 HIS B 179 HIS~? 1000.00 D 646 ASP B 180 ASP~? 1000.00 D 739 GLY B 87 GLY.? 1000.00 coo -30.51 33.83 43.05 -30.50 33.12 45.03 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -25.73 33.05 39.28 -27.50 34.05 39.88 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -27.66 47.32 40.66 -27.81 47.01 41.41 -11.14 57.34 -16.26 -10.91 58.10 -16.36 ULMN 3 1ddj_c15 PLASMINOGEN user 4 3 # 4 D 603 HIS B 179 HIS~? 1000.00 D 646 ASP B 180 ASP~? 1000.00 D 739 GLY B 227 GLY.? 1000.00 coo -30.51 33.83 43.05 -30.50 33.12 45.03 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -25.73 33.05 39.28 -27.50 34.05 39.88 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -27.66 47.32 40.66 -27.81 47.01 41.41 -33.34 62.44 -23.64 -32.68 62.31 -23.22 1ddj_c15 source 1ddj PLASMINOGEN : 4 hits 1ddj_c15 naa= 3 ULMN 3 1diz_c00 3-METHYLADENINE DNA GLYCOSYLASE II user 1 3 # 1 A 222 TYR A 33 TYR^? 1000.00 A 238 ASP A 69 ASP~? 1000.00 A 272 TRP A 73 TRP~? 1000.00 coo -17.92 42.46 111.37 -18.35 40.11 109.91 34.59 67.34 -16.12 34.26 67.92 -18.84 coo -25.50 44.84 112.68 -25.52 43.37 111.17 36.79 67.01 -23.90 37.87 67.50 -22.12 coo -27.19 39.29 113.01 -23.27 39.61 112.78 35.97 71.50 -26.88 37.67 74.10 -29.30 ULMN 3 1diz_c00 3-METHYLADENINE DNA GLYCOSYLASE II user 2 3 # 2 A 222 TYR B 33 TYR^? 1000.00 A 238 ASP B 69 ASP~? 1000.00 A 272 TRP B 73 TRP~? 1000.00 coo -17.92 42.46 111.37 -18.35 40.11 109.91 1.90 62.22 -26.29 0.23 63.78 -27.88 coo -25.50 44.84 112.68 -25.52 43.37 111.17 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo -27.19 39.29 113.01 -23.27 39.61 112.78 -3.27 67.43 -34.82 -0.97 69.60 -37.17 1diz_c00 source 1diz 3-METHYLADENINE DNA GLYCOSYLASE II : 2 hits 1diz_c00 naa= 3 ULMN 3 1diz_c01 3-METHYLADENINE DNA GLYCOSYLASE II user 1 3 # 1 B 222 TYR A 33 TYR^? 1000.00 B 238 ASP A 69 ASP~? 1000.00 B 272 TRP A 73 TRP~? 1000.00 coo 17.91 42.42 121.64 18.26 40.06 123.11 34.59 67.34 -16.12 34.26 67.92 -18.84 coo 25.38 44.99 120.20 25.38 43.50 121.71 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 27.19 39.35 120.02 23.28 39.60 120.23 35.97 71.50 -26.88 37.67 74.10 -29.30 ULMN 3 1diz_c01 3-METHYLADENINE DNA GLYCOSYLASE II user 2 3 # 2 B 222 TYR B 33 TYR^? 1000.00 B 238 ASP B 69 ASP~? 1000.00 B 272 TRP B 73 TRP~? 1000.00 coo 17.91 42.42 121.64 18.26 40.06 123.11 1.90 62.22 -26.29 0.23 63.78 -27.88 coo 25.38 44.99 120.20 25.38 43.50 121.71 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 27.19 39.35 120.02 23.28 39.60 120.23 -3.27 67.43 -34.82 -0.97 69.60 -37.17 1diz_c01 source 1diz 3-METHYLADENINE DNA GLYCOSYLASE II : 2 hits 1diz_c01 naa= 3 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 1 3 # 1 A 48 ALA A 218 ALA~? 1000.00 A 52 HIS A 176 HIS~? 1000.00 A 191 TRP A 260 TRP^? 1000.00 coo 0.32 19.13 2.10 -0.45 20.12 1.22 40.41 44.46 -31.53 40.92 43.32 -30.64 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -12.27 21.19 4.26 -8.94 21.66 2.22 38.92 55.33 -32.90 39.29 52.40 -35.50 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 2 3 # 2 A 48 ALA A 218 ALA~? 1000.00 A 52 HIS A 179 HIS~? 1000.00 A 191 TRP A 260 TRP^? 1000.00 coo 0.32 19.13 2.10 -0.45 20.12 1.22 40.41 44.46 -31.53 40.92 43.32 -30.64 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -12.27 21.19 4.26 -8.94 21.66 2.22 38.92 55.33 -32.90 39.29 52.40 -35.50 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 3 3 # 3 A 48 ALA B 213 ALA.? 1000.00 A 52 HIS B 211 HIS.? 1000.00 A 191 TRP B 260 TRP^? 1000.00 coo 0.32 19.13 2.10 -0.45 20.12 1.22 -21.41 47.59 -36.05 -21.01 46.13 -35.79 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo -12.27 21.19 4.26 -8.94 21.66 2.22 -17.84 59.00 -32.64 -21.71 58.61 -33.31 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 4 3 # 4 A 48 ALA B 218 ALA~? 1000.00 A 52 HIS B 176 HIS~? 1000.00 A 191 TRP B 260 TRP^? 1000.00 coo 0.32 19.13 2.10 -0.45 20.12 1.22 -24.24 51.06 -28.15 -23.94 49.76 -27.45 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -12.27 21.19 4.26 -8.94 21.66 2.22 -17.84 59.00 -32.64 -21.71 58.61 -33.31 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 5 3 # 5 A 48 ALA B 218 ALA~? 1000.00 A 52 HIS B 179 HIS~? 1000.00 A 191 TRP B 260 TRP^? 1000.00 coo 0.32 19.13 2.10 -0.45 20.12 1.22 -24.24 51.06 -28.15 -23.94 49.76 -27.45 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -12.27 21.19 4.26 -8.94 21.66 2.22 -17.84 59.00 -32.64 -21.71 58.61 -33.31 1dj1_c00 source 1dj1 CYTOCHROME C PEROXIDASE : 5 hits 1dj1_c00 naa= 3 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 # 1 E 57 HIS B 207 HIS.? 1000.00 E 102 ASP B 216 ASP~? 1000.00 E 193 GLY B 63 GLY~? 1000.00 coo 11.39 26.86 25.95 9.85 26.64 27.36 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 10.90 32.83 25.96 10.83 30.68 25.98 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 4.57 20.60 30.29 4.74 21.36 30.66 -7.85 56.57 -27.70 -7.10 56.66 -27.29 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 2 3 # 2 E 57 HIS B 258 HIS^? 1000.00 E 102 ASP B 216 ASP~? 1000.00 E 193 GLY B 63 GLY~? 1000.00 coo 11.39 26.86 25.95 9.85 26.64 27.36 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 10.90 32.83 25.96 10.83 30.68 25.98 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 4.57 20.60 30.29 4.74 21.36 30.66 -7.85 56.57 -27.70 -7.10 56.66 -27.29 1ds2_c02 source 1ds2 PROTEINASE B (SGPB : 2 hits 1ds2_c02 naa= 3 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 146 TYR.? 1000.00 A 40 ASP A 112 ASP~? 1000.00 A 103 ASP A 109 ASP^? 1000.00 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 26.00 46.66 -8.90 27.08 46.77 -7.09 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR A 146 TYR.? 1000.00 A 40 ASP A 153 ASP~? 1000.00 A 103 ASP A 150 ASP.? 1000.00 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 3 3 # 3 A 16 TYR B 146 TYR.? 1000.00 A 40 ASP B 112 ASP~? 1000.00 A 103 ASP B 109 ASP^? 1000.00 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 -7.51 51.42 -7.29 -5.75 50.19 -7.48 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 -8.78 56.88 -12.11 -8.97 55.48 -13.69 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 4 3 # 4 A 16 TYR B 146 TYR.? 1000.00 A 40 ASP B 153 ASP~? 1000.00 A 103 ASP B 150 ASP.? 1000.00 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1e3v_c02 source 1e3v STEROID DELTA-ISOMERASE : 4 hits 1e3v_c02 naa= 3 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 146 TYR.? 1000.00 B 40 ASP A 112 ASP~? 1000.00 B 103 ASP A 109 ASP^? 1000.00 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 26.00 46.66 -8.90 27.08 46.77 -7.09 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR A 146 TYR.? 1000.00 B 40 ASP A 153 ASP~? 1000.00 B 103 ASP A 150 ASP.? 1000.00 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 3 3 # 3 B 16 TYR B 146 TYR.? 1000.00 B 40 ASP B 112 ASP~? 1000.00 B 103 ASP B 109 ASP^? 1000.00 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 -7.51 51.42 -7.29 -5.75 50.19 -7.48 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 -8.78 56.88 -12.11 -8.97 55.48 -13.69 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 4 3 # 4 B 16 TYR B 146 TYR.? 1000.00 B 40 ASP B 153 ASP~? 1000.00 B 103 ASP B 150 ASP.? 1000.00 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1e3v_c03 source 1e3v STEROID DELTA-ISOMERASE : 4 hits 1e3v_c03 naa= 3 ULMN 3 1e7l_c01 RECOMBINATION ENDONUCLEASE VII user 1 3 # 1 B 41 HIS B 179 HIS~? 1000.00 B 43 HIS B 176 HIS~? 1000.00 B 65 GLU B 214 GLU~? 1000.00 coo 20.15 22.08 34.36 20.84 20.10 34.21 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 19.55 18.91 30.27 18.21 18.65 31.84 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 10.90 21.31 28.81 12.14 22.15 30.31 -26.47 46.70 -32.43 -28.19 45.50 -32.60 1e7l_c01 source 1e7l RECOMBINATION ENDONUCLEASE VII : 1 hits 1e7l_c01 naa= 3 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 # 1 A 32 ASP A 153 ASP~? 1000.00 A 35 SER A 154 SER~? 1000.00 A 218 ASP A 150 ASP.? 1000.00 coo 47.22 22.34 8.57 45.16 22.02 9.13 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 43.58 20.85 5.15 44.62 23.01 5.76 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 44.05 16.99 12.67 44.05 18.89 11.74 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 2 3 # 2 A 32 ASP B 153 ASP~? 1000.00 A 35 SER B 154 SER~? 1000.00 A 218 ASP B 150 ASP.? 1000.00 coo 47.22 22.34 8.57 45.16 22.02 9.13 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 43.58 20.85 5.15 44.62 23.01 5.76 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 44.05 16.99 12.67 44.05 18.89 11.74 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1eag_c04 source 1eag PEPTIDE INHIBITOR : 2 hits 1eag_c04 naa= 3 ULMN 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 1 3 # 1 P 32 ASP A 153 ASP~? 1000.00 P 35 SER A 154 SER~? 1000.00 P 215 ASP A 150 ASP.? 1000.00 coo 10.15 33.41 11.98 7.98 33.66 12.07 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 7.57 37.60 10.00 8.86 37.02 12.03 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 4.04 29.97 8.82 4.78 31.15 10.46 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 2 3 # 2 P 32 ASP B 153 ASP~? 1000.00 P 35 SER B 154 SER~? 1000.00 P 215 ASP B 150 ASP.? 1000.00 coo 10.15 33.41 11.98 7.98 33.66 12.07 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 7.57 37.60 10.00 8.86 37.02 12.03 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 4.04 29.97 8.82 4.78 31.15 10.46 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1eed_c04 source 1eed ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLEX WITH TH: 2 hits 1eed_c04 naa= 3 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 A 107 ASP A 180 ASP~? 1000.00 A 246 ASP A 216 ASP.? 1000.00 A 275 HIS A 179 HIS~? 1000.00 coo 28.44 37.56 46.79 26.87 37.11 48.10 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 22.84 50.35 52.24 23.24 48.32 52.90 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 26.67 42.94 48.26 27.49 41.07 48.73 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 A 107 ASP A 216 ASP.? 1000.00 A 246 ASP A 180 ASP~? 1000.00 A 275 HIS A 176 HIS~? 1000.00 coo 28.44 37.56 46.79 26.87 37.11 48.10 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 22.84 50.35 52.24 23.24 48.32 52.90 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 26.67 42.94 48.26 27.49 41.07 48.73 40.29 42.17 -25.19 41.57 43.60 -26.04 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 A 107 ASP B 216 ASP~? 1000.00 A 246 ASP B 171 ASP.? 1000.00 A 275 HIS B 258 HIS^? 1000.00 coo 28.44 37.56 46.79 26.87 37.11 48.10 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 22.84 50.35 52.24 23.24 48.32 52.90 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 26.67 42.94 48.26 27.49 41.07 48.73 -14.61 55.49 -34.67 -14.73 54.17 -36.30 1ehy_c00 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 3 hits 1ehy_c00 naa= 3 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 B 107 ASP A 180 ASP~? 1000.00 B 246 ASP A 171 ASP.? 1000.00 B 275 HIS A 179 HIS~? 1000.00 coo 34.84 56.77 81.62 34.95 54.74 82.03 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 43.18 49.30 68.39 44.75 49.87 69.78 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 38.73 55.10 77.62 36.80 55.01 78.46 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 B 107 ASP A 216 ASP.? 1000.00 B 246 ASP A 180 ASP~? 1000.00 B 275 HIS A 176 HIS~? 1000.00 coo 34.84 56.77 81.62 34.95 54.74 82.03 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 43.18 49.30 68.39 44.75 49.87 69.78 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 38.73 55.10 77.62 36.80 55.01 78.46 40.29 42.17 -25.19 41.57 43.60 -26.04 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 B 107 ASP B 180 ASP~? 1000.00 B 246 ASP B 171 ASP.? 1000.00 B 275 HIS B 179 HIS~? 1000.00 coo 34.84 56.77 81.62 34.95 54.74 82.03 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 43.18 49.30 68.39 44.75 49.87 69.78 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 38.73 55.10 77.62 36.80 55.01 78.46 -21.96 51.60 -22.33 -20.77 50.80 -23.86 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 4 3 # 4 B 107 ASP B 180 ASP~? 1000.00 B 246 ASP B 216 ASP~? 1000.00 B 275 HIS B 179 HIS~? 1000.00 coo 34.84 56.77 81.62 34.95 54.74 82.03 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 43.18 49.30 68.39 44.75 49.87 69.78 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 38.73 55.10 77.62 36.80 55.01 78.46 -21.96 51.60 -22.33 -20.77 50.80 -23.86 1ehy_c01 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 4 hits 1ehy_c01 naa= 3 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 C 107 ASP A 180 ASP~? 1000.00 C 246 ASP A 171 ASP.? 1000.00 C 275 HIS A 179 HIS~? 1000.00 coo 1.90 35.26 72.76 3.20 35.74 71.18 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 12.03 20.33 71.56 10.48 19.25 70.56 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 3.92 29.96 71.75 4.22 31.96 72.31 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 C 107 ASP B 180 ASP~? 1000.00 C 246 ASP B 171 ASP.? 1000.00 C 275 HIS B 179 HIS~? 1000.00 coo 1.90 35.26 72.76 3.20 35.74 71.18 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 12.03 20.33 71.56 10.48 19.25 70.56 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 3.92 29.96 71.75 4.22 31.96 72.31 -21.96 51.60 -22.33 -20.77 50.80 -23.86 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 C 107 ASP B 180 ASP~? 1000.00 C 246 ASP B 216 ASP~? 1000.00 C 275 HIS B 179 HIS~? 1000.00 coo 1.90 35.26 72.76 3.20 35.74 71.18 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 12.03 20.33 71.56 10.48 19.25 70.56 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 3.92 29.96 71.75 4.22 31.96 72.31 -21.96 51.60 -22.33 -20.77 50.80 -23.86 1ehy_c02 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 3 hits 1ehy_c02 naa= 3 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 D 107 ASP A 180 ASP~? 1000.00 D 246 ASP A 171 ASP.? 1000.00 D 275 HIS A 179 HIS~? 1000.00 coo 37.41 19.89 81.58 37.64 21.98 81.53 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 23.50 26.43 88.52 24.76 26.47 90.29 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 33.16 21.44 85.29 34.07 21.53 83.40 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 D 107 ASP A 180 ASP~? 1000.00 D 246 ASP A 216 ASP.? 1000.00 D 275 HIS A 179 HIS~? 1000.00 coo 37.41 19.89 81.58 37.64 21.98 81.53 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 23.50 26.43 88.52 24.76 26.47 90.29 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 33.16 21.44 85.29 34.07 21.53 83.40 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 D 107 ASP A 216 ASP.? 1000.00 D 246 ASP A 180 ASP~? 1000.00 D 275 HIS A 176 HIS~? 1000.00 coo 37.41 19.89 81.58 37.64 21.98 81.53 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 23.50 26.43 88.52 24.76 26.47 90.29 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 33.16 21.44 85.29 34.07 21.53 83.40 40.29 42.17 -25.19 41.57 43.60 -26.04 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 4 3 # 4 D 107 ASP B 180 ASP~? 1000.00 D 246 ASP B 171 ASP.? 1000.00 D 275 HIS B 179 HIS~? 1000.00 coo 37.41 19.89 81.58 37.64 21.98 81.53 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 23.50 26.43 88.52 24.76 26.47 90.29 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 33.16 21.44 85.29 34.07 21.53 83.40 -21.96 51.60 -22.33 -20.77 50.80 -23.86 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 5 3 # 5 D 107 ASP B 180 ASP~? 1000.00 D 246 ASP B 216 ASP~? 1000.00 D 275 HIS B 179 HIS~? 1000.00 coo 37.41 19.89 81.58 37.64 21.98 81.53 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 23.50 26.43 88.52 24.76 26.47 90.29 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 33.16 21.44 85.29 34.07 21.53 83.40 -21.96 51.60 -22.33 -20.77 50.80 -23.86 1ehy_c03 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 5 hits 1ehy_c03 naa= 3 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 1 3 # 1 A 114 HIS A 179 HIS~? 1000.00 A 197 ASP A 180 ASP~? 1000.00 A 223 LYS A 187 LYS~? 1000.00 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 2 3 # 2 A 114 HIS B 179 HIS~? 1000.00 A 197 ASP B 180 ASP~? 1000.00 A 223 LYS B 187 LYS~? 1000.00 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1elq_c02 source 1elq L-CYSTEINE/L-CYSTINE C-S LYASE : 2 hits 1elq_c02 naa= 3 ULMN 3 1elq_c03 L-CYSTEINE/L-CYSTINE C-S LYASE user 1 3 # 1 B 114 HIS A 179 HIS~? 1000.00 B 197 ASP A 180 ASP~? 1000.00 B 223 LYS A 187 LYS~? 1000.00 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1elq_c03 L-CYSTEINE/L-CYSTINE C-S LYASE user 2 3 # 2 B 114 HIS B 179 HIS~? 1000.00 B 197 ASP B 180 ASP~? 1000.00 B 223 LYS B 187 LYS~? 1000.00 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1elq_c03 source 1elq L-CYSTEINE/L-CYSTINE C-S LYASE : 2 hits 1elq_c03 naa= 3 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 1 3 # 1 150 ASP A 216 ASP.? 1000.00 153 ARG A 221 ARG~? 1000.00 177 HIS A 176 HIS~? 1000.00 coo 6.83 2.75 19.17 7.40 0.75 19.11 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 1.78 0.50 17.43 2.55 -2.31 16.44 41.84 43.61 -35.19 44.19 44.98 -33.77 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 40.29 42.17 -25.19 41.57 43.60 -26.04 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 2 3 # 2 150 ASP B 216 ASP~? 1000.00 153 ARG B 215 ARG~? 1000.00 177 HIS B 207 HIS.? 1000.00 coo 6.83 2.75 19.17 7.40 0.75 19.11 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 1.78 0.50 17.43 2.55 -2.31 16.44 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 -14.18 49.88 -34.42 -15.60 48.73 -35.45 1emd_c01 source 1emd MALATE DEHYDROGENASE (E.C.1.1.1.37) : 2 hits 1emd_c01 naa= 3 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 # 1 A 229 ALA A 37 ALA.? 1000.00 A 257 ALA A 39 ALA.? 1000.00 A 328 ASP A 69 ASP~? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 38.35 76.86 -22.49 39.69 77.57 -22.41 coo 43.22 26.73 5.37 41.81 27.09 5.79 33.55 75.68 -25.50 33.74 74.45 -24.64 coo 38.17 34.10 6.67 37.72 32.06 6.84 36.79 67.01 -23.90 37.87 67.50 -22.12 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 # 2 A 229 ALA A 39 ALA.? 1000.00 A 257 ALA A 37 ALA.? 1000.00 A 328 ASP A 69 ASP~? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 33.55 75.68 -25.50 33.74 74.45 -24.64 coo 43.22 26.73 5.37 41.81 27.09 5.79 38.35 76.86 -22.49 39.69 77.57 -22.41 coo 38.17 34.10 6.67 37.72 32.06 6.84 36.79 67.01 -23.90 37.87 67.50 -22.12 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 # 3 A 229 ALA A 68 ALA~? 1000.00 A 257 ALA A 66 ALA~? 1000.00 A 328 ASP A 171 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 32.73 64.82 -22.33 32.99 64.98 -20.84 coo 43.22 26.73 5.37 41.81 27.09 5.79 37.46 62.91 -23.42 38.36 61.83 -23.98 coo 38.17 34.10 6.67 37.72 32.06 6.84 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 # 4 A 229 ALA A 90 ALA.? 1000.00 A 257 ALA A 88 ALA.? 1000.00 A 328 ASP A 171 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 30.05 57.92 -12.03 31.26 58.74 -11.61 coo 43.22 26.73 5.37 41.81 27.09 5.79 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 38.17 34.10 6.67 37.72 32.06 6.84 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 5 3 # 5 A 229 ALA A 97 ALA~? 1000.00 A 257 ALA A 100 ALA~? 1000.00 A 328 ASP A 103 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 24.78 65.00 -22.34 24.52 63.52 -22.51 coo 43.22 26.73 5.37 41.81 27.09 5.79 23.81 69.79 -23.73 24.77 68.86 -24.42 coo 38.17 34.10 6.67 37.72 32.06 6.84 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 6 3 # 6 A 229 ALA A 100 ALA~? 1000.00 A 257 ALA A 79 ALA.? 1000.00 A 328 ASP A 103 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 23.81 69.79 -23.73 24.77 68.86 -24.42 coo 43.22 26.73 5.37 41.81 27.09 5.79 21.28 68.36 -28.97 21.60 69.72 -29.60 coo 38.17 34.10 6.67 37.72 32.06 6.84 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 7 3 # 7 A 229 ALA A 100 ALA~? 1000.00 A 257 ALA A 97 ALA~? 1000.00 A 328 ASP A 103 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 23.81 69.79 -23.73 24.77 68.86 -24.42 coo 43.22 26.73 5.37 41.81 27.09 5.79 24.78 65.00 -22.34 24.52 63.52 -22.51 coo 38.17 34.10 6.67 37.72 32.06 6.84 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 8 3 # 8 A 229 ALA A 170 ALA^? 1000.00 A 257 ALA A 64 ALA~? 1000.00 A 328 ASP A 69 ASP~? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 43.22 26.73 5.37 41.81 27.09 5.79 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 38.17 34.10 6.67 37.72 32.06 6.84 36.79 67.01 -23.90 37.87 67.50 -22.12 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 9 3 # 9 A 229 ALA B 37 ALA.? 1000.00 A 257 ALA B 39 ALA.? 1000.00 A 328 ASP B 69 ASP~? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 4.76 67.75 -35.82 5.67 67.11 -36.84 coo 43.22 26.73 5.37 41.81 27.09 5.79 0.57 71.28 -34.34 0.02 70.11 -33.53 coo 38.17 34.10 6.67 37.72 32.06 6.84 -3.24 63.62 -31.80 -1.56 62.34 -31.63 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 10 3 # 10 A 229 ALA B 39 ALA.? 1000.00 A 257 ALA B 37 ALA.? 1000.00 A 328 ASP B 69 ASP~? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 0.57 71.28 -34.34 0.02 70.11 -33.53 coo 43.22 26.73 5.37 41.81 27.09 5.79 4.76 67.75 -35.82 5.67 67.11 -36.84 coo 38.17 34.10 6.67 37.72 32.06 6.84 -3.24 63.62 -31.80 -1.56 62.34 -31.63 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 11 3 # 11 A 229 ALA B 68 ALA~? 1000.00 A 257 ALA B 66 ALA~? 1000.00 A 328 ASP B 171 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 -4.23 64.18 -27.03 -3.06 63.44 -26.41 coo 43.22 26.73 5.37 41.81 27.09 5.79 -5.82 60.22 -30.38 -6.94 59.31 -30.82 coo 38.17 34.10 6.67 37.72 32.06 6.84 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 12 3 # 12 A 229 ALA B 90 ALA.? 1000.00 A 257 ALA B 88 ALA.? 1000.00 A 328 ASP B 171 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 -2.08 57.50 -16.71 -1.09 56.98 -17.70 coo 43.22 26.73 5.37 41.81 27.09 5.79 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 38.17 34.10 6.67 37.72 32.06 6.84 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 13 3 # 13 A 229 ALA B 97 ALA~? 1000.00 A 257 ALA B 100 ALA~? 1000.00 A 328 ASP B 103 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 -5.28 69.79 -21.25 -6.44 69.23 -20.49 coo 43.22 26.73 5.37 41.81 27.09 5.79 -3.12 73.61 -23.58 -4.17 72.75 -24.24 coo 38.17 34.10 6.67 37.72 32.06 6.84 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 14 3 # 14 A 229 ALA B 100 ALA~? 1000.00 A 257 ALA B 79 ALA.? 1000.00 A 328 ASP B 103 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 -3.12 73.61 -23.58 -4.17 72.75 -24.24 coo 43.22 26.73 5.37 41.81 27.09 5.79 -7.99 76.77 -23.60 -7.43 77.49 -24.80 coo 38.17 34.10 6.67 37.72 32.06 6.84 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 15 3 # 15 A 229 ALA B 100 ALA~? 1000.00 A 257 ALA B 97 ALA~? 1000.00 A 328 ASP B 103 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 -3.12 73.61 -23.58 -4.17 72.75 -24.24 coo 43.22 26.73 5.37 41.81 27.09 5.79 -5.28 69.79 -21.25 -6.44 69.23 -20.49 coo 38.17 34.10 6.67 37.72 32.06 6.84 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 16 3 # 16 A 229 ALA B 170 ALA^? 1000.00 A 257 ALA B 64 ALA~? 1000.00 A 328 ASP B 69 ASP~? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 43.22 26.73 5.37 41.81 27.09 5.79 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 38.17 34.10 6.67 37.72 32.06 6.84 -3.24 63.62 -31.80 -1.56 62.34 -31.63 1eo7_c00 source 1eo7 CYCLODEXTRIN GLYCOSYLTRANSFERASE : 16 hits 1eo7_c00 naa= 3 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 159 LYS A 142 LYS^? 1000.00 A 193 GLU A 85 GLU^? 1000.00 A 217 VAL A 106 VAL^? 1000.00 coo 2.10 10.68 61.44 -2.14 13.16 60.61 16.76 57.98 -16.13 11.82 58.93 -17.29 coo -5.33 11.71 69.72 -4.62 11.92 67.73 27.14 56.96 -21.30 28.32 57.46 -19.62 coo 0.07 12.29 66.53 -0.24 11.95 64.38 19.18 56.95 -20.27 17.68 55.54 -20.93 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 2 3 # 2 A 159 LYS B 142 LYS^? 1000.00 A 193 GLU B 85 GLU^? 1000.00 A 217 VAL B 106 VAL^? 1000.00 coo 2.10 10.68 61.44 -2.14 13.16 60.61 -6.19 67.97 -9.05 -7.36 69.51 -3.96 coo -5.33 11.71 69.72 -4.62 11.92 67.73 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo 0.07 12.29 66.53 -0.24 11.95 64.38 -9.55 67.62 -12.64 -11.10 67.97 -11.11 1et0_c00 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 2 hits 1et0_c00 naa= 3 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 38 THR A 127 THR.? 1000.00 A 159 LYS A 142 LYS^? 1000.00 A 193 GLU A 85 GLU^? 1000.00 coo -2.58 16.31 54.79 -4.02 14.93 55.64 19.59 68.19 -12.74 19.12 66.41 -13.88 coo 2.10 10.68 61.44 -2.14 13.16 60.61 16.76 57.98 -16.13 11.82 58.93 -17.29 coo -5.33 11.71 69.72 -4.62 11.92 67.73 27.14 56.96 -21.30 28.32 57.46 -19.62 1et0_c02 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 1 hits 1et0_c02 naa= 3 ULMN 3 1eu1_c02 DIMETHYL SULFOXIDE REDUCTASE user 1 3 # 1 A 114 TYR A 110 TYR.? 1000.00 A 116 TRP A 148 TRP.? 1000.00 A 219 CYH A 72 CYH~? 1000.00 coo 10.61 42.98 20.85 11.47 41.62 23.11 26.55 44.56 -13.80 26.13 41.81 -13.54 coo 13.76 44.58 26.83 13.70 44.23 30.76 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 27.62 26.76 37.66 28.09 29.44 38.54 31.08 70.50 -25.01 31.60 69.90 -22.36 ULMN 3 1eu1_c02 DIMETHYL SULFOXIDE REDUCTASE user 2 3 # 2 A 114 TYR B 110 TYR.? 1000.00 A 116 TRP B 148 TRP.? 1000.00 A 219 CYH B 72 CYH~? 1000.00 coo 10.61 42.98 20.85 11.47 41.62 23.11 -12.51 52.38 -9.11 -14.12 50.95 -7.35 coo 13.76 44.58 26.83 13.70 44.23 30.76 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 27.62 26.76 37.66 28.09 29.44 38.54 -2.75 69.62 -29.73 -0.99 68.17 -28.30 1eu1_c02 source 1eu1 DIMETHYL SULFOXIDE REDUCTASE : 2 hits 1eu1_c02 naa= 3 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 1 3 # 1 A 34 GLU B 125 GLU~? 1000.00 A 260 ARG B 32 ARG^? 1000.00 A 270 LYS A 142 LYS^? 1000.00 coo 50.99 29.43 12.86 52.11 29.45 14.65 7.31 63.46 -12.63 8.49 61.96 -13.60 coo 39.80 27.50 22.98 42.20 26.56 21.34 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 48.83 21.70 19.50 47.44 24.99 15.25 16.76 57.98 -16.13 11.82 58.93 -17.29 1euy_c00 source 1euy GLUTAMINYL-TRNA SYNTHETASE : 1 hits 1euy_c00 naa= 3 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 1 3 # 1 A 105 HIS A 179 HIS~? 1000.00 C 62 LYS A 187 LYS~? 1000.00 F 35 ASP A 180 ASP~? 1000.00 coo 15.40 22.79 16.66 13.93 24.10 15.98 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 19.95 18.98 4.81 18.82 20.94 10.49 23.37 46.40 -32.46 25.34 41.04 -34.48 coo 16.32 15.30 17.19 17.71 14.73 18.69 31.16 39.15 -28.07 29.29 38.21 -28.51 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 2 3 # 2 A 105 HIS B 179 HIS~? 1000.00 C 62 LYS B 187 LYS~? 1000.00 F 35 ASP B 180 ASP~? 1000.00 coo 15.40 22.79 16.66 13.93 24.10 15.98 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 19.95 18.98 4.81 18.82 20.94 10.49 -25.11 64.37 -17.06 -29.98 61.05 -17.38 coo 16.32 15.30 17.19 17.71 14.73 18.69 -26.29 53.00 -17.37 -27.58 54.12 -16.14 1f80_c03 source 1f80 ACYL CARRIER PROTEIN : 2 hits 1f80_c03 naa= 3 ULMN 3 1f80_c05 ACYL CARRIER PROTEIN user 1 3 # 1 A 62 LYS A 187 LYS~? 1000.00 B 105 HIS A 179 HIS~? 1000.00 E 35 ASP A 180 ASP~? 1000.00 coo 20.51 39.76 8.83 21.23 37.38 14.18 23.37 46.40 -32.46 25.34 41.04 -34.48 coo 27.18 37.56 20.68 29.07 38.28 20.13 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 19.97 40.39 22.03 18.53 39.30 23.18 31.16 39.15 -28.07 29.29 38.21 -28.51 ULMN 3 1f80_c05 ACYL CARRIER PROTEIN user 2 3 # 2 A 62 LYS B 187 LYS~? 1000.00 B 105 HIS B 179 HIS~? 1000.00 E 35 ASP B 180 ASP~? 1000.00 coo 20.51 39.76 8.83 21.23 37.38 14.18 -25.11 64.37 -17.06 -29.98 61.05 -17.38 coo 27.18 37.56 20.68 29.07 38.28 20.13 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 19.97 40.39 22.03 18.53 39.30 23.18 -26.29 53.00 -17.37 -27.58 54.12 -16.14 1f80_c05 source 1f80 ACYL CARRIER PROTEIN : 2 hits 1f80_c05 naa= 3 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 112 PHE A 219 PHE~? 1000.00 A 210 ASP A 180 ASP~? 1000.00 A 244 LYS A 187 LYS~? 1000.00 coo 9.23 46.77 25.11 11.48 48.39 24.76 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 10.51 37.86 19.71 9.07 39.38 20.04 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -1.20 42.34 17.67 3.19 45.13 19.06 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 112 PHE B 219 PHE~? 1000.00 A 210 ASP B 180 ASP~? 1000.00 A 244 LYS B 187 LYS~? 1000.00 coo 9.23 46.77 25.11 11.48 48.39 24.76 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 10.51 37.86 19.71 9.07 39.38 20.04 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -1.20 42.34 17.67 3.19 45.13 19.06 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1fc4_c02 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c02 naa= 3 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 112 PHE A 219 PHE~? 1000.00 B 210 ASP A 180 ASP~? 1000.00 B 244 LYS A 187 LYS~? 1000.00 coo 8.76 47.85 34.91 11.08 46.36 35.41 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 9.06 56.85 40.30 7.71 55.27 39.90 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -2.38 51.82 41.62 2.07 49.19 40.42 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 112 PHE B 219 PHE~? 1000.00 B 210 ASP B 180 ASP~? 1000.00 B 244 LYS B 187 LYS~? 1000.00 coo 8.76 47.85 34.91 11.08 46.36 35.41 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 9.06 56.85 40.30 7.71 55.27 39.90 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -2.38 51.82 41.62 2.07 49.19 40.42 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1fc4_c03 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c03 naa= 3 ULMN 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 136 HIS A 179 HIS~? 1000.00 A 210 ASP A 180 ASP~? 1000.00 A 244 LYS A 187 LYS~? 1000.00 coo 11.28 44.53 18.60 9.91 46.00 19.20 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 10.51 37.86 19.71 9.07 39.38 20.04 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -1.20 42.34 17.67 3.19 45.13 19.06 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 136 HIS B 179 HIS~? 1000.00 A 210 ASP B 180 ASP~? 1000.00 A 244 LYS B 187 LYS~? 1000.00 coo 11.28 44.53 18.60 9.91 46.00 19.20 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 10.51 37.86 19.71 9.07 39.38 20.04 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -1.20 42.34 17.67 3.19 45.13 19.06 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1fc4_c04 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c04 naa= 3 ULMN 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 136 HIS A 179 HIS~? 1000.00 B 210 ASP A 180 ASP~? 1000.00 B 244 LYS A 187 LYS~? 1000.00 coo 10.08 50.18 41.78 8.91 48.61 41.04 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 9.06 56.85 40.30 7.71 55.27 39.90 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -2.38 51.82 41.62 2.07 49.19 40.42 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 136 HIS B 179 HIS~? 1000.00 B 210 ASP B 180 ASP~? 1000.00 B 244 LYS B 187 LYS~? 1000.00 coo 10.08 50.18 41.78 8.91 48.61 41.04 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 9.06 56.85 40.30 7.71 55.27 39.90 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -2.38 51.82 41.62 2.07 49.19 40.42 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1fc4_c05 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c05 naa= 3 ULMN 3 1ff3_c00 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 1 3 # 1 A 94 GLU A 85 GLU^? 1000.00 A 198 CYH A 158 CYH~? 1000.00 A 206 CYH B 43 CYH.? 1000.00 coo 49.92 26.66 0.19 51.26 25.02 0.19 27.14 56.96 -21.30 28.32 57.46 -19.62 coo 51.25 11.31 6.04 51.91 8.58 5.83 11.39 51.64 -18.24 12.62 50.20 -16.29 coo 38.98 17.42 20.63 38.42 14.68 20.70 4.94 69.22 -25.98 2.41 68.38 -25.26 ULMN 3 1ff3_c00 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 2 3 # 2 A 94 GLU A 120 GLU~? 1000.00 A 198 CYH A 84 CYH^? 1000.00 A 206 CYH B 43 CYH.? 1000.00 coo 49.92 26.66 0.19 51.26 25.02 0.19 19.22 58.37 -9.01 17.46 57.61 -9.85 coo 51.25 11.31 6.04 51.91 8.58 5.83 21.98 56.01 -24.01 21.70 53.26 -23.68 coo 38.98 17.42 20.63 38.42 14.68 20.70 4.94 69.22 -25.98 2.41 68.38 -25.26 ULMN 3 1ff3_c00 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 3 3 # 3 A 94 GLU B 85 GLU^? 1000.00 A 198 CYH B 43 CYH.? 1000.00 A 206 CYH A 158 CYH~? 1000.00 coo 49.92 26.66 0.19 51.26 25.02 0.19 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo 51.25 11.31 6.04 51.91 8.58 5.83 4.94 69.22 -25.98 2.41 68.38 -25.26 coo 38.98 17.42 20.63 38.42 14.68 20.70 11.39 51.64 -18.24 12.62 50.20 -16.29 ULMN 3 1ff3_c00 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 4 3 # 4 A 94 GLU B 114 GLU~? 1000.00 A 198 CYH A 158 CYH~? 1000.00 A 206 CYH B 43 CYH.? 1000.00 coo 49.92 26.66 0.19 51.26 25.02 0.19 -0.41 50.21 -7.66 -0.26 48.43 -6.50 coo 51.25 11.31 6.04 51.91 8.58 5.83 11.39 51.64 -18.24 12.62 50.20 -16.29 coo 38.98 17.42 20.63 38.42 14.68 20.70 4.94 69.22 -25.98 2.41 68.38 -25.26 1ff3_c00 source 1ff3 PEPTIDE METHIONINE SULFOXIDE REDUCTASE : 4 hits 1ff3_c00 naa= 3 ULMN 3 1ff3_c01 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 1 3 # 1 A 94 GLU A 85 GLU^? 1000.00 A 198 CYH A 158 CYH~? 1000.00 A 206 CYH B 43 CYH.? 1000.00 coo 49.92 26.66 0.19 51.26 25.02 0.19 27.14 56.96 -21.30 28.32 57.46 -19.62 coo 51.25 11.31 6.04 51.91 8.58 5.83 11.39 51.64 -18.24 12.62 50.20 -16.29 coo 38.98 17.42 20.63 38.42 14.68 20.70 4.94 69.22 -25.98 2.41 68.38 -25.26 ULMN 3 1ff3_c01 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 2 3 # 2 A 94 GLU A 120 GLU~? 1000.00 A 198 CYH A 84 CYH^? 1000.00 A 206 CYH B 43 CYH.? 1000.00 coo 49.92 26.66 0.19 51.26 25.02 0.19 19.22 58.37 -9.01 17.46 57.61 -9.85 coo 51.25 11.31 6.04 51.91 8.58 5.83 21.98 56.01 -24.01 21.70 53.26 -23.68 coo 38.98 17.42 20.63 38.42 14.68 20.70 4.94 69.22 -25.98 2.41 68.38 -25.26 ULMN 3 1ff3_c01 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 3 3 # 3 A 94 GLU B 85 GLU^? 1000.00 A 198 CYH B 43 CYH.? 1000.00 A 206 CYH A 158 CYH~? 1000.00 coo 49.92 26.66 0.19 51.26 25.02 0.19 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo 51.25 11.31 6.04 51.91 8.58 5.83 4.94 69.22 -25.98 2.41 68.38 -25.26 coo 38.98 17.42 20.63 38.42 14.68 20.70 11.39 51.64 -18.24 12.62 50.20 -16.29 ULMN 3 1ff3_c01 PEPTIDE METHIONINE SULFOXIDE REDUCTAuser 4 3 # 4 A 94 GLU B 114 GLU~? 1000.00 A 198 CYH A 158 CYH~? 1000.00 A 206 CYH B 43 CYH.? 1000.00 coo 49.92 26.66 0.19 51.26 25.02 0.19 -0.41 50.21 -7.66 -0.26 48.43 -6.50 coo 51.25 11.31 6.04 51.91 8.58 5.83 11.39 51.64 -18.24 12.62 50.20 -16.29 coo 38.98 17.42 20.63 38.42 14.68 20.70 4.94 69.22 -25.98 2.41 68.38 -25.26 1ff3_c01 source 1ff3 PEPTIDE METHIONINE SULFOXIDE REDUCTASE : 4 hits 1ff3_c01 naa= 3 ULMN 3 1fnb_c00 FERREDOXIN:NADP+ OXIDOREDUCTASE (FERuser 1 3 # 1 96 SER A 94 SER~? 1000.00 272 CYH A 84 CYH^? 1000.00 312 GLU A 85 GLU^? 1000.00 coo 27.57 5.78 14.13 25.30 6.31 13.99 25.37 61.51 -19.07 25.00 59.15 -18.84 coo 18.48 7.50 15.98 21.17 6.92 15.38 21.98 56.01 -24.01 21.70 53.26 -23.68 coo 22.30 10.15 12.52 24.07 9.52 13.47 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1fnb_c00 FERREDOXIN:NADP+ OXIDOREDUCTASE (FERuser 2 3 # 2 96 SER B 94 SER~? 1000.00 272 CYH B 84 CYH^? 1000.00 312 GLU B 85 GLU^? 1000.00 coo 27.57 5.78 14.13 25.30 6.31 13.99 -5.28 65.60 -18.44 -6.81 64.67 -16.85 coo 18.48 7.50 15.98 21.17 6.92 15.38 -12.63 67.19 -16.08 -14.23 65.55 -14.52 coo 22.30 10.15 12.52 24.07 9.52 13.47 -9.78 62.16 -18.27 -7.90 61.87 -19.25 1fnb_c00 source 1fnb FERREDOXIN:NADP+ OXIDOREDUCTASE (FERREDOXIN RE: 2 hits 1fnb_c00 naa= 3 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 B 317 GLU B 214 GLU~? 1000.00 B 319 ASP B 216 ASP~? 1000.00 B 359 ARG B 209 ARG.? 1000.00 coo 10.77 13.13 40.94 11.03 14.73 39.51 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 3.77 12.64 38.21 3.35 14.53 37.39 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -1.16 15.32 35.60 -3.32 13.56 36.98 -14.48 44.51 -35.31 -16.23 42.88 -33.39 1fr8_c01 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 1 hits 1fr8_c01 naa= 3 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 1 3 # 1 A 197 ARG A 184 ARG~? 1000.00 A 201 HIS A 176 HIS~? 1000.00 A 204 HIS A 179 HIS~? 1000.00 coo -27.47 20.45 37.96 -26.70 17.86 36.51 25.35 39.14 -29.34 25.56 38.90 -26.28 coo -15.08 14.90 41.58 -16.70 13.64 42.02 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -15.44 20.23 39.72 -16.43 18.87 38.47 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 2 3 # 2 A 197 ARG A 221 ARG~? 1000.00 A 201 HIS A 207 HIS.? 1000.00 A 204 HIS A 258 HIS^? 1000.00 coo -27.47 20.45 37.96 -26.70 17.86 36.51 41.84 43.61 -35.19 44.19 44.98 -33.77 coo -15.08 14.90 41.58 -16.70 13.64 42.02 47.62 53.84 -26.65 48.80 52.61 -27.88 coo -15.44 20.23 39.72 -16.43 18.87 38.47 43.13 56.70 -29.91 45.18 56.51 -30.28 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 3 3 # 3 A 197 ARG B 184 ARG~? 1000.00 A 201 HIS B 176 HIS~? 1000.00 A 204 HIS B 179 HIS~? 1000.00 coo -27.47 20.45 37.96 -26.70 17.86 36.51 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo -15.08 14.90 41.58 -16.70 13.64 42.02 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -15.44 20.23 39.72 -16.43 18.87 38.47 -21.96 51.60 -22.33 -20.77 50.80 -23.86 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 4 3 # 4 A 197 ARG B 221 ARG~? 1000.00 A 201 HIS B 207 HIS.? 1000.00 A 204 HIS B 258 HIS^? 1000.00 coo -27.47 20.45 37.96 -26.70 17.86 36.51 -27.20 52.01 -31.22 -27.06 49.11 -30.18 coo -15.08 14.90 41.58 -16.70 13.64 42.02 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -15.44 20.23 39.72 -16.43 18.87 38.47 -14.61 55.49 -34.67 -14.73 54.17 -36.30 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 5 3 # 5 A 197 ARG B 221 ARG~? 1000.00 A 201 HIS B 258 HIS^? 1000.00 A 204 HIS B 207 HIS.? 1000.00 coo -27.47 20.45 37.96 -26.70 17.86 36.51 -27.20 52.01 -31.22 -27.06 49.11 -30.18 coo -15.08 14.90 41.58 -16.70 13.64 42.02 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo -15.44 20.23 39.72 -16.43 18.87 38.47 -14.18 49.88 -34.42 -15.60 48.73 -35.45 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 6 3 # 6 A 197 ARG B 259 ARG^? 1000.00 A 201 HIS B 208 HIS.? 1000.00 A 204 HIS B 207 HIS.? 1000.00 coo -27.47 20.45 37.96 -26.70 17.86 36.51 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo -15.08 14.90 41.58 -16.70 13.64 42.02 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo -15.44 20.23 39.72 -16.43 18.87 38.47 -14.18 49.88 -34.42 -15.60 48.73 -35.45 1g8f_c00 source 1g8f SULFATE ADENYLYLTRANSFERASE : 6 hits 1g8f_c00 naa= 3 ULMN 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 1 3 # 1 13 ASP A 180 ASP~? 1000.00 41 HIS A 179 HIS~? 1000.00 224 GLN A 177 GLN~? 1000.00 coo -3.80 50.71 49.48 -5.59 51.85 49.27 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -6.45 47.32 41.99 -8.32 46.87 42.83 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -12.35 49.13 49.89 -13.38 48.89 48.03 37.09 37.20 -21.80 36.58 35.44 -22.90 ULMN 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 2 3 # 2 13 ASP B 180 ASP~? 1000.00 41 HIS B 179 HIS~? 1000.00 224 GLN B 177 GLN~? 1000.00 coo -3.80 50.71 49.48 -5.59 51.85 49.27 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -6.45 47.32 41.99 -8.32 46.87 42.83 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -12.35 49.13 49.89 -13.38 48.89 48.03 -22.46 44.89 -17.46 -24.54 44.68 -17.12 1gim_c00 source 1gim ADENYLOSUCCINATE SYNTHETASE : 2 hits 1gim_c00 naa= 3 ULMN 3 1gns_c00 SUBTILISIN BPN' user 1 3 # 1 A 32 ASP A 180 ASP~? 1000.00 A 64 HIS A 179 HIS~? 1000.00 A 155 ASN A 224 ASN~? 1000.00 coo 3.12 38.70 24.20 3.24 38.59 26.33 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 1.90 38.00 29.77 3.91 38.35 29.95 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 9.89 36.55 37.38 9.27 37.99 36.08 35.03 45.63 -39.37 35.20 47.65 -38.71 ULMN 3 1gns_c00 SUBTILISIN BPN' user 2 3 # 2 A 32 ASP B 180 ASP~? 1000.00 A 64 HIS B 179 HIS~? 1000.00 A 155 ASN B 224 ASN~? 1000.00 coo 3.12 38.70 24.20 3.24 38.59 26.33 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 1.90 38.00 29.77 3.91 38.35 29.95 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 9.89 36.55 37.38 9.27 37.99 36.08 -29.62 59.26 -28.83 -27.87 60.14 -29.67 1gns_c00 source 1gns SUBTILISIN BPN' : 2 hits 1gns_c00 naa= 3 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 1 3 # 1 160 LYS A 81 LYS.? 1000.00 210 ARG A 265 ARG.? 1000.00 225 ARG A 263 ARG^? 1000.00 coo 17.51 28.50 73.42 17.24 23.02 75.86 18.76 63.56 -29.56 21.14 63.10 -34.87 coo 24.74 11.56 73.05 25.29 14.32 71.80 24.20 53.21 -44.49 22.10 54.73 -46.19 coo 27.81 15.44 77.10 25.66 16.50 75.19 27.84 56.47 -39.37 28.80 55.40 -42.11 1gsa_c00 source 1gsa GLUTATHIONE SYNTHETASE : 1 hits 1gsa_c00 naa= 3 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 A 189 PHE A 164 PHE.? 1000.00 A 298 ASP A 196 ASP.? 1000.00 A 329 LYS A 187 LYS~? 1000.00 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 2.59 0.29 25.55 4.65 0.18 25.07 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 12.42 6.10 23.27 9.95 1.57 20.16 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 A 189 PHE A 219 PHE~? 1000.00 A 298 ASP A 180 ASP~? 1000.00 A 329 LYS A 187 LYS~? 1000.00 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 2.59 0.29 25.55 4.65 0.18 25.07 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 12.42 6.10 23.27 9.95 1.57 20.16 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 A 189 PHE B 219 PHE~? 1000.00 A 298 ASP B 180 ASP~? 1000.00 A 329 LYS B 187 LYS~? 1000.00 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 2.59 0.29 25.55 4.65 0.18 25.07 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 12.42 6.10 23.27 9.95 1.57 20.16 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1gtx_c00 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c00 naa= 3 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 B 189 PHE A 164 PHE.? 1000.00 B 298 ASP A 196 ASP.? 1000.00 B 329 LYS A 187 LYS~? 1000.00 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 B 189 PHE A 219 PHE~? 1000.00 B 298 ASP A 180 ASP~? 1000.00 B 329 LYS A 187 LYS~? 1000.00 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 B 189 PHE B 219 PHE~? 1000.00 B 298 ASP B 180 ASP~? 1000.00 B 329 LYS B 187 LYS~? 1000.00 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1gtx_c01 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c01 naa= 3 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 C 189 PHE A 164 PHE.? 1000.00 C 298 ASP A 196 ASP.? 1000.00 C 329 LYS A 187 LYS~? 1000.00 coo 17.41 60.57 64.39 18.40 58.12 65.34 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 24.10 66.43 63.33 24.18 64.30 63.40 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 27.64 56.61 58.17 22.18 57.92 60.36 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 C 189 PHE A 219 PHE~? 1000.00 C 298 ASP A 180 ASP~? 1000.00 C 329 LYS A 187 LYS~? 1000.00 coo 17.41 60.57 64.39 18.40 58.12 65.34 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 24.10 66.43 63.33 24.18 64.30 63.40 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 27.64 56.61 58.17 22.18 57.92 60.36 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 C 189 PHE B 219 PHE~? 1000.00 C 298 ASP B 180 ASP~? 1000.00 C 329 LYS B 187 LYS~? 1000.00 coo 17.41 60.57 64.39 18.40 58.12 65.34 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 24.10 66.43 63.33 24.18 64.30 63.40 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 27.64 56.61 58.17 22.18 57.92 60.36 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1gtx_c02 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c02 naa= 3 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 D 189 PHE A 164 PHE.? 1000.00 D 298 ASP A 196 ASP.? 1000.00 D 329 LYS A 187 LYS~? 1000.00 coo 35.44 53.35 83.81 35.65 54.53 81.28 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 29.72 46.46 83.60 30.79 47.36 81.99 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 36.89 44.91 74.55 37.33 48.94 79.01 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 D 189 PHE A 219 PHE~? 1000.00 D 298 ASP A 180 ASP~? 1000.00 D 329 LYS A 187 LYS~? 1000.00 coo 35.44 53.35 83.81 35.65 54.53 81.28 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 29.72 46.46 83.60 30.79 47.36 81.99 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 36.89 44.91 74.55 37.33 48.94 79.01 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 3 3 # 3 D 189 PHE B 219 PHE~? 1000.00 D 298 ASP B 180 ASP~? 1000.00 D 329 LYS B 187 LYS~? 1000.00 coo 35.44 53.35 83.81 35.65 54.53 81.28 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 29.72 46.46 83.60 30.79 47.36 81.99 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 36.89 44.91 74.55 37.33 48.94 79.01 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1gtx_c03 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 3 hits 1gtx_c03 naa= 3 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 1 3 # 1 A 50 ASP A 226 ASP~? 1000.00 A 327 GLU B 120 GLU~? 1000.00 A 339 ARG B 124 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 30.12 41.11 -36.46 28.02 41.19 -36.22 coo 75.11 41.01 160.30 76.65 40.06 161.41 -1.89 62.61 -7.03 -2.47 61.78 -5.12 coo 82.23 40.35 159.87 85.09 40.67 161.01 4.43 66.08 -6.94 4.84 63.03 -6.70 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 2 3 # 2 A 50 ASP B 69 ASP~? 1000.00 A 327 GLU A 31 GLU^? 1000.00 A 339 ARG A 32 ARG^? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 75.11 41.01 160.30 76.65 40.06 161.41 37.90 61.51 -9.53 39.97 61.99 -9.80 coo 82.23 40.35 159.87 85.09 40.67 161.01 37.46 69.57 -7.37 40.53 69.52 -7.08 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 3 3 # 3 A 50 ASP B 103 ASP.? 1000.00 A 327 GLU A 31 GLU^? 1000.00 A 339 ARG A 32 ARG^? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 -8.55 78.62 -16.37 -10.58 78.38 -15.81 coo 75.11 41.01 160.30 76.65 40.06 161.41 37.90 61.51 -9.53 39.97 61.99 -9.80 coo 82.23 40.35 159.87 85.09 40.67 161.01 37.46 69.57 -7.37 40.53 69.52 -7.08 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 4 3 # 4 A 50 ASP B 109 ASP^? 1000.00 A 327 GLU A 31 GLU^? 1000.00 A 339 ARG A 32 ARG^? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 75.11 41.01 160.30 76.65 40.06 161.41 37.90 61.51 -9.53 39.97 61.99 -9.80 coo 82.23 40.35 159.87 85.09 40.67 161.01 37.46 69.57 -7.37 40.53 69.52 -7.08 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 5 3 # 5 A 50 ASP B 109 ASP^? 1000.00 A 327 GLU A 31 GLU^? 1000.00 A 339 ARG A 65 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 75.11 41.01 160.30 76.65 40.06 161.41 37.90 61.51 -9.53 39.97 61.99 -9.80 coo 82.23 40.35 159.87 85.09 40.67 161.01 39.12 64.28 -16.95 39.71 67.26 -16.39 1hto_c00 source 1hto GLUTAMINE SYNTHETASE : 5 hits 1hto_c00 naa= 3 ULMN 3 1i29_c01 CSDB user 1 3 # 1 A 123 HIS A 179 HIS~? 1000.00 A 200 ASP A 180 ASP~? 1000.00 A 226 LYS A 187 LYS~? 1000.00 coo 23.24 46.58 4.39 24.43 46.59 2.66 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 24.51 43.28 11.18 25.17 44.50 9.58 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 34.47 51.09 7.19 28.58 51.18 7.53 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1i29_c01 CSDB user 2 3 # 2 A 123 HIS B 179 HIS~? 1000.00 A 200 ASP B 180 ASP~? 1000.00 A 226 LYS B 187 LYS~? 1000.00 coo 23.24 46.58 4.39 24.43 46.59 2.66 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 24.51 43.28 11.18 25.17 44.50 9.58 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 34.47 51.09 7.19 28.58 51.18 7.53 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1i29_c01 source 1i29 CSDB : 2 hits 1i29_c01 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL B 30 VAL^? 1000.00 A 200 ASP A 153 ASP~? 1000.00 A 226 LYS A 187 LYS~? 1000.00 coo 19.13 38.05 1.41 19.72 38.80 -0.53 6.89 54.25 -19.46 8.36 55.73 -18.79 coo 24.51 43.28 11.18 25.17 44.50 9.58 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 34.47 51.09 7.19 28.58 51.18 7.53 23.37 46.40 -32.46 25.34 41.04 -34.48 1i29_c03 source 1i29 CSDB : 1 hits 1i29_c03 naa= 3 ULMN 3 1ig8_c00 HEXOKINASE PII user 1 3 # 1 A 158 SER A 35 SER.? 1000.00 A 173 ARG A 32 ARG^? 1000.00 A 211 ASP A 69 ASP~? 1000.00 coo 22.72 76.24 0.23 24.60 76.86 -1.25 34.76 71.79 -19.69 32.79 73.22 -19.62 coo 18.77 77.82 11.69 20.55 80.22 10.73 37.46 69.57 -7.37 40.53 69.52 -7.08 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 36.79 67.01 -23.90 37.87 67.50 -22.12 ULMN 3 1ig8_c00 HEXOKINASE PII user 2 3 # 2 A 158 SER B 35 SER.? 1000.00 A 173 ARG B 32 ARG^? 1000.00 A 211 ASP B 69 ASP~? 1000.00 coo 22.72 76.24 0.23 24.60 76.86 -1.25 2.59 66.18 -29.95 3.35 68.46 -29.55 coo 18.77 77.82 11.69 20.55 80.22 10.73 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 -3.24 63.62 -31.80 -1.56 62.34 -31.63 1ig8_c00 source 1ig8 HEXOKINASE PII : 2 hits 1ig8_c00 naa= 3 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 1 3 # 1 54 ASP A 171 ASP.? 1000.00 158 THR A 204 THR^? 1000.00 317 ASP A 69 ASP~? 1000.00 coo -2.63 8.40 35.07 -3.66 9.81 36.17 36.72 54.39 -20.35 38.41 55.64 -20.64 coo -5.30 12.75 41.86 -4.34 13.05 39.99 36.15 56.61 -26.72 36.22 58.33 -25.43 coo -12.63 17.64 33.66 -10.65 17.90 34.40 36.79 67.01 -23.90 37.87 67.50 -22.12 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 2 3 # 2 54 ASP A 171 ASP.? 1000.00 158 THR A 204 THR^? 1000.00 317 ASP A 216 ASP.? 1000.00 coo -2.63 8.40 35.07 -3.66 9.81 36.17 36.72 54.39 -20.35 38.41 55.64 -20.64 coo -5.30 12.75 41.86 -4.34 13.05 39.99 36.15 56.61 -26.72 36.22 58.33 -25.43 coo -12.63 17.64 33.66 -10.65 17.90 34.40 44.82 46.44 -29.25 46.02 48.15 -29.05 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 3 3 # 3 54 ASP A 171 ASP.? 1000.00 158 THR A 206 THR.? 1000.00 317 ASP A 69 ASP~? 1000.00 coo -2.63 8.40 35.07 -3.66 9.81 36.17 36.72 54.39 -20.35 38.41 55.64 -20.64 coo -5.30 12.75 41.86 -4.34 13.05 39.99 42.51 55.26 -23.36 42.84 55.25 -21.18 coo -12.63 17.64 33.66 -10.65 17.90 34.40 36.79 67.01 -23.90 37.87 67.50 -22.12 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 4 3 # 4 54 ASP A 171 ASP.? 1000.00 158 THR A 206 THR.? 1000.00 317 ASP A 216 ASP.? 1000.00 coo -2.63 8.40 35.07 -3.66 9.81 36.17 36.72 54.39 -20.35 38.41 55.64 -20.64 coo -5.30 12.75 41.86 -4.34 13.05 39.99 42.51 55.26 -23.36 42.84 55.25 -21.18 coo -12.63 17.64 33.66 -10.65 17.90 34.40 44.82 46.44 -29.25 46.02 48.15 -29.05 1inp_c02 source 1inp INOSITOL POLYPHOSPHATE 1-PHOSPHATASE (1-PTASE): 4 hits 1inp_c02 naa= 3 ULMN 3 1ir3_c02 INSULIN RECEPTOR user 1 3 # 1 A1132 ASP A 196 ASP.? 1000.00 A1134 ALA A 191 ALA.? 1000.00 A1137 ASN A 195 ASN.? 1000.00 coo -27.05 34.58 17.12 -25.81 32.84 17.16 17.64 57.85 -36.75 18.26 59.84 -36.39 coo -20.53 36.39 15.81 -20.80 35.01 16.40 18.59 53.44 -34.00 18.22 54.93 -34.03 coo -23.72 34.69 12.49 -24.32 32.83 13.34 13.69 55.33 -37.79 12.29 53.74 -37.87 ULMN 3 1ir3_c02 INSULIN RECEPTOR user 2 3 # 2 A1132 ASP A 196 ASP.? 1000.00 A1134 ALA A 194 ALA.? 1000.00 A1137 ASN A 195 ASN.? 1000.00 coo -27.05 34.58 17.12 -25.81 32.84 17.16 17.64 57.85 -36.75 18.26 59.84 -36.39 coo -20.53 36.39 15.81 -20.80 35.01 16.40 15.32 53.25 -41.83 14.42 52.03 -41.63 coo -23.72 34.69 12.49 -24.32 32.83 13.34 13.69 55.33 -37.79 12.29 53.74 -37.87 ULMN 3 1ir3_c02 INSULIN RECEPTOR user 3 3 # 3 A1132 ASP B 196 ASP.? 1000.00 A1134 ALA B 191 ALA.? 1000.00 A1137 ASN B 195 ASN.? 1000.00 coo -27.05 34.58 17.12 -25.81 32.84 17.16 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo -20.53 36.39 15.81 -20.80 35.01 16.40 -21.95 72.44 -17.51 -20.94 73.53 -17.82 coo -23.72 34.69 12.49 -24.32 32.83 13.34 -23.79 78.19 -16.66 -25.08 78.42 -14.99 ULMN 3 1ir3_c02 INSULIN RECEPTOR user 4 3 # 4 A1132 ASP B 196 ASP.? 1000.00 A1134 ALA B 194 ALA.? 1000.00 A1137 ASN B 195 ASN.? 1000.00 coo -27.05 34.58 17.12 -25.81 32.84 17.16 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo -20.53 36.39 15.81 -20.80 35.01 16.40 -28.01 77.95 -18.86 -28.91 77.67 -17.65 coo -23.72 34.69 12.49 -24.32 32.83 13.34 -23.79 78.19 -16.66 -25.08 78.42 -14.99 1ir3_c02 source 1ir3 INSULIN RECEPTOR : 4 hits 1ir3_c02 naa= 3 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 1 3 # 1 A 14 GLU B 125 GLU~? 1000.00 A 61 GLU B 120 GLU~? 1000.00 A 162 HIS B 126 HIS.? 1000.00 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 7.31 63.46 -12.63 8.49 61.96 -13.60 coo -4.89 20.85 5.22 -3.95 21.69 6.91 -1.89 62.61 -7.03 -2.47 61.78 -5.12 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 4.52 66.06 -17.34 5.49 64.29 -17.91 1j53_c00 source 1j53 DNA POLYMERASE III, EPSILON CHAIN : 1 hits 1j53_c00 naa= 3 ULMN 3 1j70_c00 ATP SULPHURYLASE user 1 3 # 1 A 197 ARG A 184 ARG~? 1000.00 A 201 HIS A 176 HIS~? 1000.00 A 204 HIS A 179 HIS~? 1000.00 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 25.35 39.14 -29.34 25.56 38.90 -26.28 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1j70_c00 ATP SULPHURYLASE user 2 3 # 2 A 197 ARG A 221 ARG~? 1000.00 A 201 HIS A 207 HIS.? 1000.00 A 204 HIS A 258 HIS^? 1000.00 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 41.84 43.61 -35.19 44.19 44.98 -33.77 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 47.62 53.84 -26.65 48.80 52.61 -27.88 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 43.13 56.70 -29.91 45.18 56.51 -30.28 ULMN 3 1j70_c00 ATP SULPHURYLASE user 3 3 # 3 A 197 ARG B 184 ARG~? 1000.00 A 201 HIS B 176 HIS~? 1000.00 A 204 HIS B 179 HIS~? 1000.00 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 -21.96 51.60 -22.33 -20.77 50.80 -23.86 ULMN 3 1j70_c00 ATP SULPHURYLASE user 4 3 # 4 A 197 ARG B 221 ARG~? 1000.00 A 201 HIS B 207 HIS.? 1000.00 A 204 HIS B 258 HIS^? 1000.00 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 -27.20 52.01 -31.22 -27.06 49.11 -30.18 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 -14.61 55.49 -34.67 -14.73 54.17 -36.30 ULMN 3 1j70_c00 ATP SULPHURYLASE user 5 3 # 5 A 197 ARG B 221 ARG~? 1000.00 A 201 HIS B 258 HIS^? 1000.00 A 204 HIS B 207 HIS.? 1000.00 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 -27.20 52.01 -31.22 -27.06 49.11 -30.18 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 -14.18 49.88 -34.42 -15.60 48.73 -35.45 ULMN 3 1j70_c00 ATP SULPHURYLASE user 6 3 # 6 A 197 ARG B 259 ARG^? 1000.00 A 201 HIS B 208 HIS.? 1000.00 A 204 HIS B 207 HIS.? 1000.00 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 -14.18 49.88 -34.42 -15.60 48.73 -35.45 1j70_c00 source 1j70 ATP SULPHURYLASE : 6 hits 1j70_c00 naa= 3 ULMN 3 1j70_c01 ATP SULPHURYLASE user 1 3 # 1 B 197 ARG A 184 ARG~? 1000.00 B 201 HIS A 176 HIS~? 1000.00 B 204 HIS A 179 HIS~? 1000.00 coo -18.85 104.93 27.44 -18.03 106.58 29.88 25.35 39.14 -29.34 25.56 38.90 -26.28 coo -8.48 114.03 24.38 -10.47 114.55 23.97 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -6.99 108.94 26.28 -8.54 109.57 27.55 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1j70_c01 ATP SULPHURYLASE user 2 3 # 2 B 197 ARG A 221 ARG~? 1000.00 B 201 HIS A 207 HIS.? 1000.00 B 204 HIS A 258 HIS^? 1000.00 coo -18.85 104.93 27.44 -18.03 106.58 29.88 41.84 43.61 -35.19 44.19 44.98 -33.77 coo -8.48 114.03 24.38 -10.47 114.55 23.97 47.62 53.84 -26.65 48.80 52.61 -27.88 coo -6.99 108.94 26.28 -8.54 109.57 27.55 43.13 56.70 -29.91 45.18 56.51 -30.28 ULMN 3 1j70_c01 ATP SULPHURYLASE user 3 3 # 3 B 197 ARG A 221 ARG~? 1000.00 B 201 HIS A 258 HIS^? 1000.00 B 204 HIS A 207 HIS.? 1000.00 coo -18.85 104.93 27.44 -18.03 106.58 29.88 41.84 43.61 -35.19 44.19 44.98 -33.77 coo -8.48 114.03 24.38 -10.47 114.55 23.97 43.13 56.70 -29.91 45.18 56.51 -30.28 coo -6.99 108.94 26.28 -8.54 109.57 27.55 47.62 53.84 -26.65 48.80 52.61 -27.88 ULMN 3 1j70_c01 ATP SULPHURYLASE user 4 3 # 4 B 197 ARG B 184 ARG~? 1000.00 B 201 HIS B 176 HIS~? 1000.00 B 204 HIS B 179 HIS~? 1000.00 coo -18.85 104.93 27.44 -18.03 106.58 29.88 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo -8.48 114.03 24.38 -10.47 114.55 23.97 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -6.99 108.94 26.28 -8.54 109.57 27.55 -21.96 51.60 -22.33 -20.77 50.80 -23.86 ULMN 3 1j70_c01 ATP SULPHURYLASE user 5 3 # 5 B 197 ARG B 221 ARG~? 1000.00 B 201 HIS B 207 HIS.? 1000.00 B 204 HIS B 258 HIS^? 1000.00 coo -18.85 104.93 27.44 -18.03 106.58 29.88 -27.20 52.01 -31.22 -27.06 49.11 -30.18 coo -8.48 114.03 24.38 -10.47 114.55 23.97 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -6.99 108.94 26.28 -8.54 109.57 27.55 -14.61 55.49 -34.67 -14.73 54.17 -36.30 ULMN 3 1j70_c01 ATP SULPHURYLASE user 6 3 # 6 B 197 ARG B 221 ARG~? 1000.00 B 201 HIS B 258 HIS^? 1000.00 B 204 HIS B 207 HIS.? 1000.00 coo -18.85 104.93 27.44 -18.03 106.58 29.88 -27.20 52.01 -31.22 -27.06 49.11 -30.18 coo -8.48 114.03 24.38 -10.47 114.55 23.97 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo -6.99 108.94 26.28 -8.54 109.57 27.55 -14.18 49.88 -34.42 -15.60 48.73 -35.45 ULMN 3 1j70_c01 ATP SULPHURYLASE user 7 3 # 7 B 197 ARG B 259 ARG^? 1000.00 B 201 HIS B 208 HIS.? 1000.00 B 204 HIS B 207 HIS.? 1000.00 coo -18.85 104.93 27.44 -18.03 106.58 29.88 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo -8.48 114.03 24.38 -10.47 114.55 23.97 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo -6.99 108.94 26.28 -8.54 109.57 27.55 -14.18 49.88 -34.42 -15.60 48.73 -35.45 1j70_c01 source 1j70 ATP SULPHURYLASE : 7 hits 1j70_c01 naa= 3 ULMN 3 1j70_c02 ATP SULPHURYLASE user 1 3 # 1 C 197 ARG A 184 ARG~? 1000.00 C 201 HIS A 176 HIS~? 1000.00 C 204 HIS A 179 HIS~? 1000.00 coo 30.92 14.23 15.70 28.82 13.90 13.48 25.35 39.14 -29.34 25.56 38.90 -26.28 coo 20.16 5.55 18.86 20.00 7.59 19.34 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 24.92 3.29 16.90 24.41 4.92 15.69 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1j70_c02 ATP SULPHURYLASE user 2 3 # 2 C 197 ARG A 221 ARG~? 1000.00 C 201 HIS A 207 HIS.? 1000.00 C 204 HIS A 258 HIS^? 1000.00 coo 30.92 14.23 15.70 28.82 13.90 13.48 41.84 43.61 -35.19 44.19 44.98 -33.77 coo 20.16 5.55 18.86 20.00 7.59 19.34 47.62 53.84 -26.65 48.80 52.61 -27.88 coo 24.92 3.29 16.90 24.41 4.92 15.69 43.13 56.70 -29.91 45.18 56.51 -30.28 ULMN 3 1j70_c02 ATP SULPHURYLASE user 3 3 # 3 C 197 ARG B 184 ARG~? 1000.00 C 201 HIS B 176 HIS~? 1000.00 C 204 HIS B 179 HIS~? 1000.00 coo 30.92 14.23 15.70 28.82 13.90 13.48 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo 20.16 5.55 18.86 20.00 7.59 19.34 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 24.92 3.29 16.90 24.41 4.92 15.69 -21.96 51.60 -22.33 -20.77 50.80 -23.86 ULMN 3 1j70_c02 ATP SULPHURYLASE user 4 3 # 4 C 197 ARG B 221 ARG~? 1000.00 C 201 HIS B 207 HIS.? 1000.00 C 204 HIS B 258 HIS^? 1000.00 coo 30.92 14.23 15.70 28.82 13.90 13.48 -27.20 52.01 -31.22 -27.06 49.11 -30.18 coo 20.16 5.55 18.86 20.00 7.59 19.34 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 24.92 3.29 16.90 24.41 4.92 15.69 -14.61 55.49 -34.67 -14.73 54.17 -36.30 ULMN 3 1j70_c02 ATP SULPHURYLASE user 5 3 # 5 C 197 ARG B 221 ARG~? 1000.00 C 201 HIS B 258 HIS^? 1000.00 C 204 HIS B 207 HIS.? 1000.00 coo 30.92 14.23 15.70 28.82 13.90 13.48 -27.20 52.01 -31.22 -27.06 49.11 -30.18 coo 20.16 5.55 18.86 20.00 7.59 19.34 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 24.92 3.29 16.90 24.41 4.92 15.69 -14.18 49.88 -34.42 -15.60 48.73 -35.45 ULMN 3 1j70_c02 ATP SULPHURYLASE user 6 3 # 6 C 197 ARG B 259 ARG^? 1000.00 C 201 HIS B 208 HIS.? 1000.00 C 204 HIS B 207 HIS.? 1000.00 coo 30.92 14.23 15.70 28.82 13.90 13.48 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo 20.16 5.55 18.86 20.00 7.59 19.34 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 24.92 3.29 16.90 24.41 4.92 15.69 -14.18 49.88 -34.42 -15.60 48.73 -35.45 1j70_c02 source 1j70 ATP SULPHURYLASE : 6 hits 1j70_c02 naa= 3 ULMN 3 1j7g_c00 D-TYROSYL-TRNA(TYR) DEACYLASE user 1 3 # 1 A 78 GLN A 104 GLN^? 1000.00 A 79 PHE A 164 PHE.? 1000.00 A 80 THR A 82 THR^? 1000.00 coo 18.18 6.97 -1.14 17.20 5.70 -2.56 15.06 59.89 -22.25 14.38 60.78 -20.42 coo 24.87 4.39 -2.11 26.74 2.89 -0.67 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 21.26 8.65 -4.24 19.54 7.67 -5.04 17.89 60.42 -27.59 16.15 59.46 -28.49 ULMN 3 1j7g_c00 D-TYROSYL-TRNA(TYR) DEACYLASE user 2 3 # 2 A 78 GLN A 165 GLN.? 1000.00 A 79 PHE A 164 PHE.? 1000.00 A 80 THR A 82 THR^? 1000.00 coo 18.18 6.97 -1.14 17.20 5.70 -2.56 17.92 59.61 -32.44 16.92 61.47 -32.20 coo 24.87 4.39 -2.11 26.74 2.89 -0.67 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 21.26 8.65 -4.24 19.54 7.67 -5.04 17.89 60.42 -27.59 16.15 59.46 -28.49 ULMN 3 1j7g_c00 D-TYROSYL-TRNA(TYR) DEACYLASE user 3 3 # 3 A 78 GLN B 104 GLN^? 1000.00 A 79 PHE B 164 PHE.? 1000.00 A 80 THR B 82 THR^? 1000.00 coo 18.18 6.97 -1.14 17.20 5.70 -2.56 -9.27 73.99 -11.84 -10.45 74.75 -10.23 coo 24.87 4.39 -2.11 26.74 2.89 -0.67 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 21.26 8.65 -4.24 19.54 7.67 -5.04 -12.81 74.19 -16.93 -14.49 74.38 -15.53 ULMN 3 1j7g_c00 D-TYROSYL-TRNA(TYR) DEACYLASE user 4 3 # 4 A 78 GLN B 165 GLN.? 1000.00 A 79 PHE B 164 PHE.? 1000.00 A 80 THR B 82 THR^? 1000.00 coo 18.18 6.97 -1.14 17.20 5.70 -2.56 -16.87 75.53 -19.21 -15.75 77.25 -19.72 coo 24.87 4.39 -2.11 26.74 2.89 -0.67 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 21.26 8.65 -4.24 19.54 7.67 -5.04 -12.81 74.19 -16.93 -14.49 74.38 -15.53 1j7g_c00 source 1j7g D-TYROSYL-TRNA(TYR) DEACYLASE : 4 hits 1j7g_c00 naa= 3 ULMN 3 1joa_c00 NADH PEROXIDASE user 1 3 # 1 10 HIS B 207 HIS.? 1000.00 41 SER B 174 SER.? 1000.00 303 ARG B 209 ARG.? 1000.00 coo 62.94 54.74 73.45 64.13 56.17 74.27 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 65.67 62.51 70.93 64.56 61.94 68.74 -15.19 48.74 -23.97 -12.89 48.81 -23.13 coo 63.38 52.38 77.01 66.48 52.75 76.49 -14.48 44.51 -35.31 -16.23 42.88 -33.39 1joa_c00 source 1joa NADH PEROXIDASE : 1 hits 1joa_c00 naa= 3 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 1 3 # 1 A 396 ARG B 29 ARG.? 1000.00 A 581 ARG B 32 ARG^? 1000.00 A 713 ARG B 65 ARG~? 1000.00 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 -0.40 56.71 -28.30 2.57 57.06 -27.54 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 2 3 # 2 A 396 ARG B 29 ARG.? 1000.00 A 581 ARG B 65 ARG~? 1000.00 A 713 ARG B 32 ARG^? 1000.00 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 10.27 58.20 -24.55 11.21 60.44 -26.40 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 3 3 # 3 A 396 ARG B 32 ARG^? 1000.00 A 581 ARG B 29 ARG.? 1000.00 A 713 ARG B 65 ARG~? 1000.00 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 -0.40 56.71 -28.30 2.57 57.06 -27.54 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 4 3 # 4 A 396 ARG B 32 ARG^? 1000.00 A 581 ARG B 65 ARG~? 1000.00 A 713 ARG B 29 ARG.? 1000.00 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 4.10 49.74 -21.56 2.98 48.55 -24.19 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 5 3 # 5 A 396 ARG B 65 ARG~? 1000.00 A 581 ARG B 29 ARG.? 1000.00 A 713 ARG B 32 ARG^? 1000.00 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 10.27 58.20 -24.55 11.21 60.44 -26.40 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 6 3 # 6 A 396 ARG B 65 ARG~? 1000.00 A 581 ARG B 32 ARG^? 1000.00 A 713 ARG B 29 ARG.? 1000.00 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 4.10 49.74 -21.56 2.98 48.55 -24.19 1jqn_c01 source 1jqn PHOSPHOENOLPYRUVATE CARBOXYLASE : 6 hits 1jqn_c01 naa= 3 ULMN 3 1kim_c00 THYMIDINE KINASE user 1 3 # 1 A 83 GLU B 31 GLU^? 1000.00 A 163 ARG B 29 ARG.? 1000.00 A 222 ARG B 32 ARG^? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 48.06 78.22 50.94 48.51 78.27 53.98 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 54.85 84.16 52.60 54.26 81.23 53.34 10.27 58.20 -24.55 11.21 60.44 -26.40 ULMN 3 1kim_c00 THYMIDINE KINASE user 2 3 # 2 A 83 GLU B 31 GLU^? 1000.00 A 163 ARG B 29 ARG.? 1000.00 A 222 ARG B 65 ARG~? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 48.06 78.22 50.94 48.51 78.27 53.98 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 54.85 84.16 52.60 54.26 81.23 53.34 -0.40 56.71 -28.30 2.57 57.06 -27.54 ULMN 3 1kim_c00 THYMIDINE KINASE user 3 3 # 3 A 83 GLU B 31 GLU^? 1000.00 A 163 ARG B 65 ARG~? 1000.00 A 222 ARG B 29 ARG.? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 48.06 78.22 50.94 48.51 78.27 53.98 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo 54.85 84.16 52.60 54.26 81.23 53.34 4.10 49.74 -21.56 2.98 48.55 -24.19 ULMN 3 1kim_c00 THYMIDINE KINASE user 4 3 # 4 A 83 GLU B 214 GLU~? 1000.00 A 163 ARG B 215 ARG~? 1000.00 A 222 ARG B 221 ARG~? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 48.06 78.22 50.94 48.51 78.27 53.98 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 54.85 84.16 52.60 54.26 81.23 53.34 -27.20 52.01 -31.22 -27.06 49.11 -30.18 ULMN 3 1kim_c00 THYMIDINE KINASE user 5 3 # 5 A 83 GLU B 214 GLU~? 1000.00 A 163 ARG B 221 ARG~? 1000.00 A 222 ARG B 215 ARG~? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 48.06 78.22 50.94 48.51 78.27 53.98 -27.20 52.01 -31.22 -27.06 49.11 -30.18 coo 54.85 84.16 52.60 54.26 81.23 53.34 -20.00 45.16 -30.78 -18.84 42.81 -32.44 1kim_c00 source 1kim THYMIDINE KINASE : 5 hits 1kim_c00 naa= 3 ULMN 3 1knp_c00 L-ASPARTATE OXIDASE user 1 3 # 1 A 290 ARG A 259 ARG^? 1000.00 A 351 HIS A 258 HIS^? 1000.00 A 386 LEU A 238 LEU.? 1000.00 coo 57.36 53.34 128.83 58.45 50.56 128.34 37.44 62.38 -29.11 38.25 65.13 -30.27 coo 60.60 50.64 133.59 60.63 48.82 132.56 43.13 56.70 -29.91 45.18 56.51 -30.28 coo 63.28 54.23 126.45 63.53 52.07 126.70 42.56 64.24 -26.17 40.94 65.56 -26.85 ULMN 3 1knp_c00 L-ASPARTATE OXIDASE user 2 3 # 2 A 290 ARG B 259 ARG^? 1000.00 A 351 HIS B 258 HIS^? 1000.00 A 386 LEU B 238 LEU^? 1000.00 coo 57.36 53.34 128.83 58.45 50.56 128.34 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo 60.60 50.64 133.59 60.63 48.82 132.56 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 63.28 54.23 126.45 63.53 52.07 126.70 -7.23 59.22 -35.87 -7.02 61.35 -35.52 1knp_c00 source 1knp L-ASPARTATE OXIDASE : 2 hits 1knp_c00 naa= 3 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 # 1 255 ASP A 196 ASP.? 1000.00 262 LYS A 81 LYS.? 1000.00 336 ARG A 261 ARG^? 1000.00 coo 61.88 50.78 12.96 63.84 50.60 13.71 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 63.59 44.40 18.32 63.20 49.74 17.95 18.76 63.56 -29.56 21.14 63.10 -34.87 coo 72.60 57.42 15.86 71.61 56.68 18.70 30.87 57.44 -37.15 31.09 59.67 -39.22 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP B 196 ASP.? 1000.00 262 LYS B 81 LYS.? 1000.00 336 ARG B 261 ARG^? 1000.00 coo 61.88 50.78 12.96 63.84 50.60 13.71 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo 63.59 44.40 18.32 63.20 49.74 17.95 -11.97 76.30 -19.94 -15.62 76.75 -24.03 coo 72.60 57.42 15.86 71.61 56.68 18.70 -19.12 67.47 -30.67 -19.76 70.17 -31.94 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 3 3 # 3 255 ASP B 196 ASP.? 1000.00 262 LYS B 81 LYS.? 1000.00 336 ARG B 263 ARG^? 1000.00 coo 61.88 50.78 12.96 63.84 50.60 13.71 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo 63.59 44.40 18.32 63.20 49.74 17.95 -11.97 76.30 -19.94 -15.62 76.75 -24.03 coo 72.60 57.42 15.86 71.61 56.68 18.70 -23.50 69.78 -28.71 -26.08 70.11 -30.40 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 3 hits 1lam_c00 naa= 3 ULMN 3 1lci_c00 LUCIFERASE user 1 3 # 1 218 ARG A 259 ARG^? 1000.00 245 HIS A 207 HIS.? 1000.00 343 THR A 206 THR.? 1000.00 coo 18.11 85.25 41.19 18.04 83.33 43.59 37.44 62.38 -29.11 38.25 65.13 -30.27 coo 5.34 86.23 43.48 6.16 87.26 45.12 47.62 53.84 -26.65 48.80 52.61 -27.88 coo 9.06 92.76 42.80 7.04 92.63 42.14 42.51 55.26 -23.36 42.84 55.25 -21.18 ULMN 3 1lci_c00 LUCIFERASE user 2 3 # 2 218 ARG A 261 ARG^? 1000.00 245 HIS A 258 HIS^? 1000.00 343 THR A 204 THR^? 1000.00 coo 18.11 85.25 41.19 18.04 83.33 43.59 30.87 57.44 -37.15 31.09 59.67 -39.22 coo 5.34 86.23 43.48 6.16 87.26 45.12 43.13 56.70 -29.91 45.18 56.51 -30.28 coo 9.06 92.76 42.80 7.04 92.63 42.14 36.15 56.61 -26.72 36.22 58.33 -25.43 ULMN 3 1lci_c00 LUCIFERASE user 3 3 # 3 218 ARG B 65 ARG~? 1000.00 245 HIS B 208 HIS.? 1000.00 343 THR B 206 THR^? 1000.00 coo 18.11 85.25 41.19 18.04 83.33 43.59 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo 5.34 86.23 43.48 6.16 87.26 45.12 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 9.06 92.76 42.80 7.04 92.63 42.14 -10.64 52.53 -30.49 -8.59 52.04 -30.11 ULMN 3 1lci_c00 LUCIFERASE user 4 3 # 4 218 ARG B 215 ARG~? 1000.00 245 HIS B 208 HIS.? 1000.00 343 THR B 206 THR^? 1000.00 coo 18.11 85.25 41.19 18.04 83.33 43.59 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 5.34 86.23 43.48 6.16 87.26 45.12 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 9.06 92.76 42.80 7.04 92.63 42.14 -10.64 52.53 -30.49 -8.59 52.04 -30.11 ULMN 3 1lci_c00 LUCIFERASE user 5 3 # 5 218 ARG B 215 ARG~? 1000.00 245 HIS B 258 HIS^? 1000.00 343 THR B 206 THR^? 1000.00 coo 18.11 85.25 41.19 18.04 83.33 43.59 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 5.34 86.23 43.48 6.16 87.26 45.12 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 9.06 92.76 42.80 7.04 92.63 42.14 -10.64 52.53 -30.49 -8.59 52.04 -30.11 ULMN 3 1lci_c00 LUCIFERASE user 6 3 # 6 218 ARG B 259 ARG^? 1000.00 245 HIS B 207 HIS.? 1000.00 343 THR B 206 THR^? 1000.00 coo 18.11 85.25 41.19 18.04 83.33 43.59 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo 5.34 86.23 43.48 6.16 87.26 45.12 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 9.06 92.76 42.80 7.04 92.63 42.14 -10.64 52.53 -30.49 -8.59 52.04 -30.11 ULMN 3 1lci_c00 LUCIFERASE user 7 3 # 7 218 ARG B 261 ARG^? 1000.00 245 HIS B 258 HIS^? 1000.00 343 THR B 204 THR^? 1000.00 coo 18.11 85.25 41.19 18.04 83.33 43.59 -19.12 67.47 -30.67 -19.76 70.17 -31.94 coo 5.34 86.23 43.48 6.16 87.26 45.12 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 9.06 92.76 42.80 7.04 92.63 42.14 -12.74 58.88 -28.08 -10.74 59.59 -28.28 1lci_c00 source 1lci LUCIFERASE : 7 hits 1lci_c00 naa= 3 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 1 3 # 1 166 ASP A 216 ASP.? 1000.00 169 ARG A 221 ARG~? 1000.00 193 HIS A 176 HIS~? 1000.00 coo 20.88 15.91 3.60 20.25 17.72 4.50 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 17.70 17.91 -0.80 15.74 19.74 0.84 41.84 43.61 -35.19 44.19 44.98 -33.77 coo 18.81 19.85 7.63 17.55 19.89 5.97 40.29 42.17 -25.19 41.57 43.60 -26.04 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 2 3 # 2 166 ASP B 216 ASP~? 1000.00 169 ARG B 215 ARG~? 1000.00 193 HIS B 207 HIS.? 1000.00 coo 20.88 15.91 3.60 20.25 17.72 4.50 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 17.70 17.91 -0.80 15.74 19.74 0.84 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 18.81 19.85 7.63 17.55 19.89 5.97 -14.18 49.88 -34.42 -15.60 48.73 -35.45 1ldm_c01 source 1ldm M4 LACTATE DEHYDROGENASE : 2 hits 1ldm_c01 naa= 3 ULMN 3 1lij_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 64 ALA~? 1000.00 A 317 GLY A 63 GLY~? 1000.00 A 318 ASP A 171 ASP.? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 3 1lij_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA A 79 ALA.? 1000.00 A 317 GLY A 80 GLY.? 1000.00 A 318 ASP A 103 ASP.? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 21.28 68.36 -28.97 21.60 69.72 -29.60 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 3 1lij_c01 ADENOSINE KINASE user 3 3 # 3 A 316 ALA A 88 ALA.? 1000.00 A 317 GLY A 87 GLY.? 1000.00 A 318 ASP A 109 ASP^? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 28.58 51.63 -18.31 28.23 52.29 -18.68 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 3 1lij_c01 ADENOSINE KINASE user 4 3 # 4 A 316 ALA A 88 ALA.? 1000.00 A 317 GLY A 89 GLY.? 1000.00 A 318 ASP A 109 ASP^? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 30.13 54.80 -14.22 29.42 55.21 -14.27 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 3 1lij_c01 ADENOSINE KINASE user 5 3 # 5 A 316 ALA A 102 ALA.? 1000.00 A 317 GLY A 80 GLY.? 1000.00 A 318 ASP A 103 ASP.? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 19.40 65.92 -25.18 20.15 64.73 -24.61 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 3 1lij_c01 ADENOSINE KINASE user 6 3 # 6 A 316 ALA A 170 ALA^? 1000.00 A 317 GLY A 63 GLY~? 1000.00 A 318 ASP A 171 ASP.? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 3 1lij_c01 ADENOSINE KINASE user 7 3 # 7 A 316 ALA A 225 ALA~? 1000.00 A 317 GLY A 227 GLY.? 1000.00 A 318 ASP A 226 ASP~? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 34.22 41.09 -39.00 35.05 40.23 -38.05 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 29.43 42.95 -40.95 28.91 42.83 -40.42 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1lij_c01 ADENOSINE KINASE user 8 3 # 8 A 316 ALA A 228 ALA.? 1000.00 A 317 GLY A 227 GLY.? 1000.00 A 318 ASP A 226 ASP~? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 26.27 44.52 -39.48 25.47 43.94 -38.32 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 29.43 42.95 -40.95 28.91 42.83 -40.42 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1lij_c01 ADENOSINE KINASE user 9 3 # 9 A 316 ALA B 64 ALA~? 1000.00 A 317 GLY B 63 GLY~? 1000.00 A 318 ASP B 171 ASP.? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1lij_c01 ADENOSINE KINASE user 10 3 # 10 A 316 ALA B 79 ALA.? 1000.00 A 317 GLY B 80 GLY.? 1000.00 A 318 ASP B 103 ASP.? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 -7.99 76.77 -23.60 -7.43 77.49 -24.80 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 3 1lij_c01 ADENOSINE KINASE user 11 3 # 11 A 316 ALA B 88 ALA.? 1000.00 A 317 GLY B 87 GLY.? 1000.00 A 318 ASP B 109 ASP^? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -11.14 57.34 -16.26 -10.91 58.10 -16.36 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -8.78 56.88 -12.11 -8.97 55.48 -13.69 ULMN 3 1lij_c01 ADENOSINE KINASE user 12 3 # 12 A 316 ALA B 88 ALA.? 1000.00 A 317 GLY B 89 GLY.? 1000.00 A 318 ASP B 109 ASP^? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -5.69 56.38 -16.53 -5.55 57.13 -16.19 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -8.78 56.88 -12.11 -8.97 55.48 -13.69 ULMN 3 1lij_c01 ADENOSINE KINASE user 13 3 # 13 A 316 ALA B 102 ALA.? 1000.00 A 317 GLY B 80 GLY.? 1000.00 A 318 ASP B 103 ASP.? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 -7.18 75.09 -19.42 -7.62 73.69 -19.16 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 3 1lij_c01 ADENOSINE KINASE user 14 3 # 14 A 316 ALA B 170 ALA^? 1000.00 A 317 GLY B 63 GLY~? 1000.00 A 318 ASP B 171 ASP.? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1lij_c01 ADENOSINE KINASE user 15 3 # 15 A 316 ALA B 228 ALA.? 1000.00 A 317 GLY B 227 GLY.? 1000.00 A 318 ASP B 226 ASP~? 1000.00 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 -30.92 64.76 -21.90 -30.51 64.62 -20.43 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -33.34 62.44 -23.64 -32.68 62.31 -23.22 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1lij_c01 source 1lij ADENOSINE KINASE : 15 hits 1lij_c01 naa= 3 ULMN 3 1lio_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 64 ALA~? 1000.00 A 317 GLY A 63 GLY~? 1000.00 A 318 ASP A 171 ASP.? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 27.87 23.16 38.17 28.43 22.97 38.87 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 32.11 22.71 40.58 33.42 24.22 39.78 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 3 1lio_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA A 88 ALA.? 1000.00 A 317 GLY A 87 GLY.? 1000.00 A 318 ASP A 109 ASP^? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 27.87 23.16 38.17 28.43 22.97 38.87 28.58 51.63 -18.31 28.23 52.29 -18.68 coo 32.11 22.71 40.58 33.42 24.22 39.78 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 3 1lio_c01 ADENOSINE KINASE user 3 3 # 3 A 316 ALA A 88 ALA.? 1000.00 A 317 GLY A 89 GLY.? 1000.00 A 318 ASP A 109 ASP^? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 27.87 23.16 38.17 28.43 22.97 38.87 30.13 54.80 -14.22 29.42 55.21 -14.27 coo 32.11 22.71 40.58 33.42 24.22 39.78 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 3 1lio_c01 ADENOSINE KINASE user 4 3 # 4 A 316 ALA A 102 ALA.? 1000.00 A 317 GLY A 80 GLY.? 1000.00 A 318 ASP A 103 ASP.? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 19.40 65.92 -25.18 20.15 64.73 -24.61 coo 27.87 23.16 38.17 28.43 22.97 38.87 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 32.11 22.71 40.58 33.42 24.22 39.78 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 3 1lio_c01 ADENOSINE KINASE user 5 3 # 5 A 316 ALA A 170 ALA^? 1000.00 A 317 GLY A 63 GLY~? 1000.00 A 318 ASP A 171 ASP.? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 27.87 23.16 38.17 28.43 22.97 38.87 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 32.11 22.71 40.58 33.42 24.22 39.78 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 3 1lio_c01 ADENOSINE KINASE user 6 3 # 6 A 316 ALA A 225 ALA~? 1000.00 A 317 GLY A 227 GLY.? 1000.00 A 318 ASP A 226 ASP~? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 34.22 41.09 -39.00 35.05 40.23 -38.05 coo 27.87 23.16 38.17 28.43 22.97 38.87 29.43 42.95 -40.95 28.91 42.83 -40.42 coo 32.11 22.71 40.58 33.42 24.22 39.78 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1lio_c01 ADENOSINE KINASE user 7 3 # 7 A 316 ALA A 228 ALA.? 1000.00 A 317 GLY A 227 GLY.? 1000.00 A 318 ASP A 226 ASP~? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 26.27 44.52 -39.48 25.47 43.94 -38.32 coo 27.87 23.16 38.17 28.43 22.97 38.87 29.43 42.95 -40.95 28.91 42.83 -40.42 coo 32.11 22.71 40.58 33.42 24.22 39.78 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1lio_c01 ADENOSINE KINASE user 8 3 # 8 A 316 ALA B 64 ALA~? 1000.00 A 317 GLY B 63 GLY~? 1000.00 A 318 ASP B 171 ASP.? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 27.87 23.16 38.17 28.43 22.97 38.87 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 32.11 22.71 40.58 33.42 24.22 39.78 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1lio_c01 ADENOSINE KINASE user 9 3 # 9 A 316 ALA B 88 ALA.? 1000.00 A 317 GLY B 87 GLY.? 1000.00 A 318 ASP B 109 ASP^? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 27.87 23.16 38.17 28.43 22.97 38.87 -11.14 57.34 -16.26 -10.91 58.10 -16.36 coo 32.11 22.71 40.58 33.42 24.22 39.78 -8.78 56.88 -12.11 -8.97 55.48 -13.69 ULMN 3 1lio_c01 ADENOSINE KINASE user 10 3 # 10 A 316 ALA B 88 ALA.? 1000.00 A 317 GLY B 89 GLY.? 1000.00 A 318 ASP B 109 ASP^? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 27.87 23.16 38.17 28.43 22.97 38.87 -5.69 56.38 -16.53 -5.55 57.13 -16.19 coo 32.11 22.71 40.58 33.42 24.22 39.78 -8.78 56.88 -12.11 -8.97 55.48 -13.69 ULMN 3 1lio_c01 ADENOSINE KINASE user 11 3 # 11 A 316 ALA B 102 ALA.? 1000.00 A 317 GLY B 80 GLY.? 1000.00 A 318 ASP B 103 ASP.? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 -7.18 75.09 -19.42 -7.62 73.69 -19.16 coo 27.87 23.16 38.17 28.43 22.97 38.87 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 32.11 22.71 40.58 33.42 24.22 39.78 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 3 1lio_c01 ADENOSINE KINASE user 12 3 # 12 A 316 ALA B 170 ALA^? 1000.00 A 317 GLY B 63 GLY~? 1000.00 A 318 ASP B 171 ASP.? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 27.87 23.16 38.17 28.43 22.97 38.87 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 32.11 22.71 40.58 33.42 24.22 39.78 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1lio_c01 ADENOSINE KINASE user 13 3 # 13 A 316 ALA B 228 ALA.? 1000.00 A 317 GLY B 227 GLY.? 1000.00 A 318 ASP B 226 ASP~? 1000.00 coo 27.04 23.54 41.85 25.72 24.19 42.18 -30.92 64.76 -21.90 -30.51 64.62 -20.43 coo 27.87 23.16 38.17 28.43 22.97 38.87 -33.34 62.44 -23.64 -32.68 62.31 -23.22 coo 32.11 22.71 40.58 33.42 24.22 39.78 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1lio_c01 source 1lio ADENOSINE KINASE : 13 hits 1lio_c01 naa= 3 ULMN 3 1luc_c00 BACTERIAL LUCIFERASE user 1 3 # 1 A 44 HIS A 176 HIS~? 1000.00 A 45 HIS A 179 HIS~? 1000.00 A 261 PHE A 205 PHE^? 1000.00 coo 49.89 1.93 30.83 50.54 1.43 32.81 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 45.01 -1.52 29.84 44.56 -2.07 27.88 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 46.05 -5.25 41.21 44.22 -4.43 39.26 39.74 53.37 -27.06 40.86 53.29 -29.62 ULMN 3 1luc_c00 BACTERIAL LUCIFERASE user 2 3 # 2 A 44 HIS A 207 HIS.? 1000.00 A 45 HIS A 258 HIS^? 1000.00 A 261 PHE A 219 PHE~? 1000.00 coo 49.89 1.93 30.83 50.54 1.43 32.81 47.62 53.84 -26.65 48.80 52.61 -27.88 coo 45.01 -1.52 29.84 44.56 -2.07 27.88 43.13 56.70 -29.91 45.18 56.51 -30.28 coo 46.05 -5.25 41.21 44.22 -4.43 39.26 35.08 47.04 -29.48 32.37 47.72 -29.62 ULMN 3 1luc_c00 BACTERIAL LUCIFERASE user 3 3 # 3 A 44 HIS B 176 HIS~? 1000.00 A 45 HIS B 179 HIS~? 1000.00 A 261 PHE B 205 PHE^? 1000.00 coo 49.89 1.93 30.83 50.54 1.43 32.81 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 45.01 -1.52 29.84 44.56 -2.07 27.88 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 46.05 -5.25 41.21 44.22 -4.43 39.26 -15.10 54.57 -29.64 -16.85 54.62 -31.84 ULMN 3 1luc_c00 BACTERIAL LUCIFERASE user 4 3 # 4 A 44 HIS B 207 HIS.? 1000.00 A 45 HIS B 258 HIS^? 1000.00 A 261 PHE B 219 PHE~? 1000.00 coo 49.89 1.93 30.83 50.54 1.43 32.81 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 45.01 -1.52 29.84 44.56 -2.07 27.88 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 46.05 -5.25 41.21 44.22 -4.43 39.26 -21.57 55.31 -24.41 -21.44 57.58 -22.78 ULMN 3 1luc_c00 BACTERIAL LUCIFERASE user 5 3 # 5 A 44 HIS B 258 HIS^? 1000.00 A 45 HIS B 207 HIS.? 1000.00 A 261 PHE B 219 PHE~? 1000.00 coo 49.89 1.93 30.83 50.54 1.43 32.81 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 45.01 -1.52 29.84 44.56 -2.07 27.88 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 46.05 -5.25 41.21 44.22 -4.43 39.26 -21.57 55.31 -24.41 -21.44 57.58 -22.78 1luc_c00 source 1luc BACTERIAL LUCIFERASE : 5 hits 1luc_c00 naa= 3 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP B 150 ASP.? 1000.00 A 265 GLU B 85 GLU^? 1000.00 A 369 ASP B 153 ASP~? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 17.36 23.57 72.04 18.68 21.92 71.98 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo 12.19 31.08 87.29 11.13 32.66 86.38 -21.01 65.81 -3.11 -22.79 67.01 -3.06 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP B 150 ASP.? 1000.00 A 265 GLU B 120 GLU~? 1000.00 A 369 ASP B 153 ASP~? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 17.36 23.57 72.04 18.68 21.92 71.98 -1.89 62.61 -7.03 -2.47 61.78 -5.12 coo 12.19 31.08 87.29 11.13 32.66 86.38 -21.01 65.81 -3.11 -22.79 67.01 -3.06 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP B 153 ASP~? 1000.00 A 265 GLU B 85 GLU^? 1000.00 A 369 ASP B 150 ASP.? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 17.36 23.57 72.04 18.68 21.92 71.98 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo 12.19 31.08 87.29 11.13 32.66 86.38 -20.37 58.06 -6.86 -20.05 56.11 -6.15 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 4 3 # 4 A 241 ASP B 180 ASP~? 1000.00 A 265 GLU B 214 GLU~? 1000.00 A 369 ASP B 226 ASP~? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 17.36 23.57 72.04 18.68 21.92 71.98 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 12.19 31.08 87.29 11.13 32.66 86.38 -31.03 58.88 -21.73 -30.98 60.38 -20.22 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 5 3 # 5 A 241 ASP B 226 ASP~? 1000.00 A 265 GLU B 214 GLU~? 1000.00 A 369 ASP B 180 ASP~? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo 17.36 23.57 72.04 18.68 21.92 71.98 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 12.19 31.08 87.29 11.13 32.66 86.38 -26.29 53.00 -17.37 -27.58 54.12 -16.14 1m53_c05 source 1m53 ISOMALTULOSE SYNTHASE : 5 hits 1m53_c05 naa= 3 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 # 1 159 ARG A 124 ARG~? 1000.00 229 SER A 118 SER~? 1000.00 325 GLU A 120 GLU~? 1000.00 coo 2.54 15.84 18.57 3.24 17.85 16.30 17.74 63.32 -6.93 16.21 63.99 -4.36 coo 10.17 13.48 15.92 9.61 15.76 15.27 25.44 56.75 -6.65 27.54 55.65 -7.08 coo 5.42 13.04 19.75 5.74 13.81 17.79 19.22 58.37 -9.01 17.46 57.61 -9.85 1mbb_c00 source 1mbb URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMI: 1 hits 1mbb_c00 naa= 3 ULMN 3 1mpp_c04 PEPSIN (RENIN) (E.C.3.4.23.23) user 1 3 # 1 32 ASP A 153 ASP~? 1000.00 35 SER A 154 SER~? 1000.00 215 ASP A 150 ASP.? 1000.00 coo 20.97 14.47 32.28 19.66 15.96 31.62 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 16.04 14.72 33.82 17.27 13.71 31.95 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 20.65 22.00 33.80 20.06 20.56 32.39 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1mpp_c04 PEPSIN (RENIN) (E.C.3.4.23.23) user 2 3 # 2 32 ASP B 153 ASP~? 1000.00 35 SER B 154 SER~? 1000.00 215 ASP B 150 ASP.? 1000.00 coo 20.97 14.47 32.28 19.66 15.96 31.62 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 16.04 14.72 33.82 17.27 13.71 31.95 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 20.65 22.00 33.80 20.06 20.56 32.39 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1mpp_c04 source 1mpp PEPSIN (RENIN) (E.C.3.4.23.23) : 2 hits 1mpp_c04 naa= 3 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 A 114 HIS A 179 HIS~? 1000.00 A 197 ASP A 180 ASP~? 1000.00 A 223 ALA A 225 ALA~? 1000.00 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 34.22 41.09 -39.00 35.05 40.23 -38.05 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 A 114 HIS A 179 HIS~? 1000.00 A 197 ASP A 180 ASP~? 1000.00 A 223 ALA A 231 ALA^? 1000.00 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 33.61 50.82 -37.07 34.20 49.86 -36.04 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 # 3 A 114 HIS A 179 HIS~? 1000.00 A 197 ASP A 216 ASP.? 1000.00 A 223 ALA A 225 ALA~? 1000.00 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 34.22 41.09 -39.00 35.05 40.23 -38.05 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 4 3 # 4 A 114 HIS A 179 HIS~? 1000.00 A 197 ASP A 216 ASP.? 1000.00 A 223 ALA A 231 ALA^? 1000.00 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 33.61 50.82 -37.07 34.20 49.86 -36.04 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 5 3 # 5 A 114 HIS B 179 HIS~? 1000.00 A 197 ASP B 180 ASP~? 1000.00 A 223 ALA B 231 ALA^? 1000.00 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 -24.39 62.06 -28.93 -24.32 60.63 -28.46 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 6 3 # 6 A 114 HIS B 258 HIS^? 1000.00 A 197 ASP B 216 ASP~? 1000.00 A 223 ALA B 170 ALA^? 1000.00 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 -10.80 58.59 -23.75 -9.39 59.10 -23.65 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 7 3 # 7 A 114 HIS B 258 HIS^? 1000.00 A 197 ASP B 216 ASP~? 1000.00 A 223 ALA B 231 ALA^? 1000.00 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 -24.39 62.06 -28.93 -24.32 60.63 -28.46 1n2t_c02 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 7 hits 1n2t_c02 naa= 3 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 B 114 HIS A 179 HIS~? 1000.00 B 197 ASP A 180 ASP~? 1000.00 B 223 ALA A 225 ALA~? 1000.00 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 34.22 41.09 -39.00 35.05 40.23 -38.05 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 B 114 HIS A 179 HIS~? 1000.00 B 197 ASP A 180 ASP~? 1000.00 B 223 ALA A 231 ALA^? 1000.00 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 33.61 50.82 -37.07 34.20 49.86 -36.04 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 # 3 B 114 HIS A 179 HIS~? 1000.00 B 197 ASP A 216 ASP.? 1000.00 B 223 ALA A 225 ALA~? 1000.00 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 34.22 41.09 -39.00 35.05 40.23 -38.05 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 4 3 # 4 B 114 HIS A 179 HIS~? 1000.00 B 197 ASP A 216 ASP.? 1000.00 B 223 ALA A 231 ALA^? 1000.00 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 33.61 50.82 -37.07 34.20 49.86 -36.04 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 5 3 # 5 B 114 HIS B 179 HIS~? 1000.00 B 197 ASP B 180 ASP~? 1000.00 B 223 ALA B 231 ALA^? 1000.00 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 -24.39 62.06 -28.93 -24.32 60.63 -28.46 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 6 3 # 6 B 114 HIS B 258 HIS^? 1000.00 B 197 ASP B 216 ASP~? 1000.00 B 223 ALA B 170 ALA^? 1000.00 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 -10.80 58.59 -23.75 -9.39 59.10 -23.65 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 7 3 # 7 B 114 HIS B 258 HIS^? 1000.00 B 197 ASP B 216 ASP~? 1000.00 B 223 ALA B 231 ALA^? 1000.00 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 -24.39 62.06 -28.93 -24.32 60.63 -28.46 1n2t_c03 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 7 hits 1n2t_c03 naa= 3 ULMN 3 1ndo_c00 NAPTHALENE 1,2-DIOXYGENASE user 1 3 # 1 A 205 ASP B 216 ASP~? 1000.00 A 208 HIS B 207 HIS.? 1000.00 C 104 HIS B 258 HIS^? 1000.00 coo 20.72 31.33 73.27 20.15 33.36 73.56 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 17.00 33.82 71.84 16.59 31.98 70.88 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 20.06 38.06 74.21 21.19 36.81 72.96 -14.61 55.49 -34.67 -14.73 54.17 -36.30 1ndo_c00 source 1ndo NAPTHALENE 1,2-DIOXYGENASE : 1 hits 1ndo_c00 naa= 3 ULMN 3 1ndo_c01 NAPTHALENE 1,2-DIOXYGENASE user 1 3 # 1 A 104 HIS B 258 HIS^? 1000.00 E 205 ASP B 216 ASP~? 1000.00 E 208 HIS B 207 HIS.? 1000.00 coo 36.32 11.24 30.83 37.00 13.22 30.81 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 38.79 15.70 26.44 37.66 14.35 27.62 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 34.24 14.63 26.81 34.14 16.25 25.49 -14.18 49.88 -34.42 -15.60 48.73 -35.45 1ndo_c01 source 1ndo NAPTHALENE 1,2-DIOXYGENASE : 1 hits 1ndo_c01 naa= 3 ULMN 3 1ndo_c02 NAPTHALENE 1,2-DIOXYGENASE user 1 3 # 1 C 205 ASP B 216 ASP~? 1000.00 C 208 HIS B 207 HIS.? 1000.00 E 104 HIS B 258 HIS^? 1000.00 coo 36.50 67.03 37.59 36.77 66.38 35.61 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 33.45 66.12 34.16 32.13 66.40 35.76 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 38.29 64.94 31.33 38.08 64.16 33.27 -14.61 55.49 -34.67 -14.73 54.17 -36.30 1ndo_c02 source 1ndo NAPTHALENE 1,2-DIOXYGENASE : 1 hits 1ndo_c02 naa= 3 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 1 3 # 1 B 59 GLU B 214 GLU~? 1000.00 B 128 HIS B 211 HIS.? 1000.00 C 263 HIS B 258 HIS^? 1000.00 coo 6.12 5.94 82.00 7.16 6.32 83.81 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 12.51 16.35 80.99 13.16 14.90 82.37 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 11.58 14.94 93.26 12.25 14.03 91.50 -14.61 55.49 -34.67 -14.73 54.17 -36.30 1ni4_c00 source 1ni4 PYRUVATE DEHYDROGENASE E1 COMPONENT: ALPHA SUB: 1 hits 1ni4_c00 naa= 3 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 1 3 # 1 A 263 HIS B 258 HIS^? 1000.00 D 59 GLU B 214 GLU~? 1000.00 D 128 HIS B 211 HIS.? 1000.00 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 -17.26 48.53 -42.58 -16.44 48.63 -44.51 1ni4_c01 source 1ni4 PYRUVATE DEHYDROGENASE E1 COMPONENT: ALPHA SUB: 1 hits 1ni4_c01 naa= 3 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 184 ARG~? 1000.00 A 101 ASP A 180 ASP~? 1000.00 A 132 ASP A 226 ASP~? 1000.00 coo 11.61 22.83 17.30 14.06 21.71 15.78 25.35 39.14 -29.34 25.56 38.90 -26.28 coo 11.37 24.94 11.48 12.48 24.45 13.28 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 16.14 18.17 13.37 15.92 19.81 14.71 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG B 184 ARG~? 1000.00 A 101 ASP B 180 ASP~? 1000.00 A 132 ASP B 226 ASP~? 1000.00 coo 11.61 22.83 17.30 14.06 21.71 15.78 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo 11.37 24.94 11.48 12.48 24.45 13.28 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 16.14 18.17 13.37 15.92 19.81 14.71 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1nu3_c00 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nu3_c00 naa= 3 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 184 ARG~? 1000.00 B 101 ASP A 180 ASP~? 1000.00 B 132 ASP A 226 ASP~? 1000.00 coo 11.61 3.43 18.38 9.11 4.29 16.86 25.35 39.14 -29.34 25.56 38.90 -26.28 coo 11.74 0.51 12.98 10.75 1.32 14.67 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 6.93 7.52 14.08 7.18 6.08 15.65 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG B 184 ARG~? 1000.00 B 101 ASP B 180 ASP~? 1000.00 B 132 ASP B 226 ASP~? 1000.00 coo 11.61 3.43 18.38 9.11 4.29 16.86 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo 11.74 0.51 12.98 10.75 1.32 14.67 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 6.93 7.52 14.08 7.18 6.08 15.65 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1nu3_c01 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nu3_c01 naa= 3 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 184 ARG~? 1000.00 A 101 ASP A 180 ASP~? 1000.00 A 132 ASP A 226 ASP~? 1000.00 coo 11.50 22.77 17.24 14.00 21.62 15.86 25.35 39.14 -29.34 25.56 38.90 -26.28 coo 11.19 25.00 11.76 12.16 24.45 13.59 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 16.04 18.11 13.43 15.88 19.70 14.83 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG B 184 ARG~? 1000.00 A 101 ASP B 180 ASP~? 1000.00 A 132 ASP B 226 ASP~? 1000.00 coo 11.50 22.77 17.24 14.00 21.62 15.86 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo 11.19 25.00 11.76 12.16 24.45 13.59 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 16.04 18.11 13.43 15.88 19.70 14.83 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1nww_c02 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nww_c02 naa= 3 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 184 ARG~? 1000.00 B 101 ASP A 180 ASP~? 1000.00 B 132 ASP A 226 ASP~? 1000.00 coo 11.48 3.09 18.25 9.01 4.07 16.77 25.35 39.14 -29.34 25.56 38.90 -26.28 coo 11.83 0.33 13.01 10.88 1.04 14.81 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 6.85 7.33 14.07 7.10 5.88 15.60 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG B 184 ARG~? 1000.00 B 101 ASP B 180 ASP~? 1000.00 B 132 ASP B 226 ASP~? 1000.00 coo 11.48 3.09 18.25 9.01 4.07 16.77 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo 11.83 0.33 13.01 10.88 1.04 14.81 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 6.85 7.33 14.07 7.10 5.88 15.60 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1nww_c03 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nww_c03 naa= 3 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 # 1 A 62 SER A 62 SER~? 1000.00 A 154 ASP A 69 ASP~? 1000.00 A 261 ARG A 65 ARG~? 1000.00 coo 16.10 74.10 3.11 17.18 73.52 5.20 39.62 59.33 -18.48 41.66 58.46 -19.47 coo 16.07 84.71 8.14 15.20 82.81 8.14 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 10.59 77.85 4.81 13.09 76.36 5.76 39.12 64.28 -16.95 39.71 67.26 -16.39 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 2 3 # 2 A 62 SER A 185 SER~? 1000.00 A 154 ASP A 226 ASP~? 1000.00 A 261 ARG A 184 ARG~? 1000.00 coo 16.10 74.10 3.11 17.18 73.52 5.20 24.33 45.74 -27.14 24.89 45.34 -24.82 coo 16.07 84.71 8.14 15.20 82.81 8.14 30.12 41.11 -36.46 28.02 41.19 -36.22 coo 10.59 77.85 4.81 13.09 76.36 5.76 25.35 39.14 -29.34 25.56 38.90 -26.28 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 3 3 # 3 A 62 SER B 185 SER~? 1000.00 A 154 ASP B 226 ASP~? 1000.00 A 261 ARG B 184 ARG~? 1000.00 coo 16.10 74.10 3.11 17.18 73.52 5.20 -21.68 60.93 -14.68 -20.41 58.94 -14.15 coo 16.07 84.71 8.14 15.20 82.81 8.14 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo 10.59 77.85 4.81 13.09 76.36 5.76 -27.45 56.94 -13.67 -25.49 55.61 -11.69 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 4 3 # 4 A 62 SER B 236 SER^? 1000.00 A 154 ASP B 69 ASP~? 1000.00 A 261 ARG B 259 ARG^? 1000.00 coo 16.10 74.10 3.11 17.18 73.52 5.20 -13.40 61.82 -38.71 -11.69 62.84 -40.02 coo 16.07 84.71 8.14 15.20 82.81 8.14 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 10.59 77.85 4.81 13.09 76.36 5.76 -10.57 62.34 -33.08 -9.53 63.90 -35.49 1o98_c00 source 1o98 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT PHOSPHOGLY: 4 hits 1o98_c00 naa= 3 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 B 175 LYS A 81 LYS.? 1000.00 B 208 GLN A 104 GLN^? 1000.00 B 209 LYS A 142 LYS^? 1000.00 coo 105.03 46.01 19.55 106.59 42.35 15.55 18.76 63.56 -29.56 21.14 63.10 -34.87 coo 113.93 46.99 13.56 113.37 48.52 14.95 15.06 59.89 -22.25 14.38 60.78 -20.42 coo 115.66 49.12 8.60 111.19 49.52 4.73 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 2 3 # 2 B 175 LYS B 81 LYS.? 1000.00 B 208 GLN B 104 GLN^? 1000.00 B 209 LYS B 142 LYS^? 1000.00 coo 105.03 46.01 19.55 106.59 42.35 15.55 -11.97 76.30 -19.94 -15.62 76.75 -24.03 coo 113.93 46.99 13.56 113.37 48.52 14.95 -9.27 73.99 -11.84 -10.45 74.75 -10.23 coo 115.66 49.12 8.60 111.19 49.52 4.73 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1ohh_c07 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 2 hits 1ohh_c07 naa= 3 ULMN 3 1opm_c00 1.14.17.0003 user 1 3 # 1 A 108 HIS B 207 HIS.? 1000.00 A 170 GLN B 256 GLN.? 1000.00 A 242 HIS B 211 HIS.? 1000.00 coo 36.16 34.36 39.40 38.12 34.09 40.00 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 40.85 35.41 43.73 41.85 33.73 42.88 -10.38 53.29 -38.42 -12.33 53.43 -39.31 coo 40.72 26.15 37.61 42.10 27.69 37.19 -17.26 48.53 -42.58 -16.44 48.63 -44.51 ULMN 3 1opm_c00 1.14.17.0003 user 2 3 # 2 A 108 HIS B 258 HIS^? 1000.00 A 170 GLN B 256 GLN.? 1000.00 A 242 HIS B 211 HIS.? 1000.00 coo 36.16 34.36 39.40 38.12 34.09 40.00 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 40.85 35.41 43.73 41.85 33.73 42.88 -10.38 53.29 -38.42 -12.33 53.43 -39.31 coo 40.72 26.15 37.61 42.10 27.69 37.19 -17.26 48.53 -42.58 -16.44 48.63 -44.51 1opm_c00 source 1opm 1.14.17.0003 : 2 hits 1opm_c00 naa= 3 ULMN 3 1oqz_c00 GLUTARYL ACYLASE user 1 3 # 1 A 170 SER A 118 SER~? 1000.00 A 239 VAL A 47 VAL^? 1000.00 A 413 ASN A 122 ASN~? 1000.00 coo 80.14 40.76 52.28 77.73 40.59 51.94 25.44 56.75 -6.65 27.54 55.65 -7.08 coo 75.67 35.37 52.30 76.00 35.96 50.23 30.91 63.40 -8.45 30.83 63.01 -10.62 coo 81.75 35.21 52.13 80.92 37.12 51.69 26.58 61.39 -9.58 28.06 60.87 -8.14 ULMN 3 1oqz_c00 GLUTARYL ACYLASE user 2 3 # 2 A 170 SER A 121 SER~? 1000.00 A 239 VAL A 47 VAL^? 1000.00 A 413 ASN A 122 ASN~? 1000.00 coo 80.14 40.76 52.28 77.73 40.59 51.94 22.74 60.44 -6.78 23.90 60.97 -4.72 coo 75.67 35.37 52.30 76.00 35.96 50.23 30.91 63.40 -8.45 30.83 63.01 -10.62 coo 81.75 35.21 52.13 80.92 37.12 51.69 26.58 61.39 -9.58 28.06 60.87 -8.14 ULMN 3 1oqz_c00 GLUTARYL ACYLASE user 3 3 # 3 A 170 SER B 118 SER~? 1000.00 A 239 VAL B 47 VAL^? 1000.00 A 413 ASN B 122 ASN~? 1000.00 coo 80.14 40.76 52.28 77.73 40.59 51.94 0.89 57.06 -10.45 -0.04 55.05 -11.41 coo 75.67 35.37 52.30 76.00 35.96 50.23 4.04 58.85 -18.28 1.93 59.17 -18.73 coo 81.75 35.21 52.13 80.92 37.12 51.69 1.60 60.89 -14.49 2.17 58.90 -14.85 ULMN 3 1oqz_c00 GLUTARYL ACYLASE user 4 3 # 4 A 170 SER B 121 SER~? 1000.00 A 239 VAL B 47 VAL^? 1000.00 A 413 ASN B 122 ASN~? 1000.00 coo 80.14 40.76 52.28 77.73 40.59 51.94 3.01 61.33 -9.81 4.05 59.21 -10.36 coo 75.67 35.37 52.30 76.00 35.96 50.23 4.04 58.85 -18.28 1.93 59.17 -18.73 coo 81.75 35.21 52.13 80.92 37.12 51.69 1.60 60.89 -14.49 2.17 58.90 -14.85 1oqz_c00 source 1oqz GLUTARYL ACYLASE : 4 hits 1oqz_c00 naa= 3 ULMN 3 1oqz_c01 GLUTARYL ACYLASE user 1 3 # 1 B 170 SER A 118 SER~? 1000.00 B 239 VAL A 47 VAL^? 1000.00 B 413 ASN A 122 ASN~? 1000.00 coo 25.22 6.41 2.90 27.67 6.33 3.11 25.44 56.75 -6.65 27.54 55.65 -7.08 coo 29.71 1.00 2.66 29.43 1.57 4.74 30.91 63.40 -8.45 30.83 63.01 -10.62 coo 23.72 0.88 2.95 24.56 2.79 3.34 26.58 61.39 -9.58 28.06 60.87 -8.14 ULMN 3 1oqz_c01 GLUTARYL ACYLASE user 2 3 # 2 B 170 SER A 121 SER~? 1000.00 B 239 VAL A 47 VAL^? 1000.00 B 413 ASN A 122 ASN~? 1000.00 coo 25.22 6.41 2.90 27.67 6.33 3.11 22.74 60.44 -6.78 23.90 60.97 -4.72 coo 29.71 1.00 2.66 29.43 1.57 4.74 30.91 63.40 -8.45 30.83 63.01 -10.62 coo 23.72 0.88 2.95 24.56 2.79 3.34 26.58 61.39 -9.58 28.06 60.87 -8.14 ULMN 3 1oqz_c01 GLUTARYL ACYLASE user 3 3 # 3 B 170 SER B 118 SER~? 1000.00 B 239 VAL B 47 VAL^? 1000.00 B 413 ASN B 122 ASN~? 1000.00 coo 25.22 6.41 2.90 27.67 6.33 3.11 0.89 57.06 -10.45 -0.04 55.05 -11.41 coo 29.71 1.00 2.66 29.43 1.57 4.74 4.04 58.85 -18.28 1.93 59.17 -18.73 coo 23.72 0.88 2.95 24.56 2.79 3.34 1.60 60.89 -14.49 2.17 58.90 -14.85 ULMN 3 1oqz_c01 GLUTARYL ACYLASE user 4 3 # 4 B 170 SER B 121 SER~? 1000.00 B 239 VAL B 47 VAL^? 1000.00 B 413 ASN B 122 ASN~? 1000.00 coo 25.22 6.41 2.90 27.67 6.33 3.11 3.01 61.33 -9.81 4.05 59.21 -10.36 coo 29.71 1.00 2.66 29.43 1.57 4.74 4.04 58.85 -18.28 1.93 59.17 -18.73 coo 23.72 0.88 2.95 24.56 2.79 3.34 1.60 60.89 -14.49 2.17 58.90 -14.85 1oqz_c01 source 1oqz GLUTARYL ACYLASE : 4 hits 1oqz_c01 naa= 3 ULMN 3 1oyg_c00 LEVANSUCRASE user 1 3 # 1 A 86 ASP B 109 ASP^? 1000.00 A 247 ASP B 112 ASP~? 1000.00 A 342 GLU B 114 GLU~? 1000.00 coo 44.36 35.68 9.71 43.29 36.20 11.51 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 41.40 28.81 12.91 40.82 30.90 12.97 -7.51 51.42 -7.29 -5.75 50.19 -7.48 coo 40.37 33.11 18.06 39.99 34.93 17.06 -0.41 50.21 -7.66 -0.26 48.43 -6.50 1oyg_c00 source 1oyg LEVANSUCRASE : 1 hits 1oyg_c00 naa= 3 ULMN 3 1p7m_c00 DNA-3-METHYLADENINE GLYCOSYLASE I user 1 3 # 1 A 16 TYR A 146 TYR.? 1000.00 A 38 GLU A 85 GLU^? 1000.00 A 46 TRP A 148 TRP.? 1000.00 coo 141.05 24.62 -1.85 142.62 22.60 -2.97 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 142.20 14.40 -6.46 142.04 16.49 -6.62 27.14 56.96 -21.30 28.32 57.46 -19.62 coo 137.32 22.45 -5.52 140.17 20.39 -3.63 26.89 46.71 -20.94 30.78 47.15 -20.58 ULMN 3 1p7m_c00 DNA-3-METHYLADENINE GLYCOSYLASE I user 2 3 # 2 A 16 TYR B 146 TYR.? 1000.00 A 38 GLU B 85 GLU^? 1000.00 A 46 TRP B 148 TRP.? 1000.00 coo 141.05 24.62 -1.85 142.62 22.60 -2.97 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 142.20 14.40 -6.46 142.04 16.49 -6.62 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo 137.32 22.45 -5.52 140.17 20.39 -3.63 -16.31 56.98 -14.06 -15.62 54.26 -16.81 1p7m_c00 source 1p7m DNA-3-METHYLADENINE GLYCOSYLASE I : 2 hits 1p7m_c00 naa= 3 ULMN 3 1pfq_c01 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 # 1 B 630 SER A 174 SER.? 1000.00 B 708 ASP A 216 ASP.? 1000.00 B 740 HIS A 176 HIS~? 1000.00 coo 4.44 13.29 37.64 6.01 11.66 38.49 39.69 47.27 -21.33 40.40 49.18 -20.03 coo 6.39 7.18 30.33 6.92 8.20 32.17 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 8.57 10.09 34.47 7.10 10.73 35.82 40.29 42.17 -25.19 41.57 43.60 -26.04 1pfq_c01 source 1pfq DIPEPTIDYL PEPTIDASE IV SOLUBLE FORM : 1 hits 1pfq_c01 naa= 3 ULMN 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 # 1 A 630 SER A 174 SER.? 1000.00 A 709 ASP A 180 ASP~? 1000.00 A 740 HIS A 179 HIS~? 1000.00 coo -7.09 7.44 6.22 -7.53 5.14 5.59 39.69 47.27 -21.33 40.40 49.18 -20.03 coo -6.04 -3.54 13.59 -7.99 -3.21 12.73 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -8.70 2.86 9.96 -8.03 3.92 8.29 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 2 3 # 2 A 630 SER B 174 SER.? 1000.00 A 709 ASP B 180 ASP~? 1000.00 A 740 HIS B 179 HIS~? 1000.00 coo -7.09 7.44 6.22 -7.53 5.14 5.59 -15.19 48.74 -23.97 -12.89 48.81 -23.13 coo -6.04 -3.54 13.59 -7.99 -3.21 12.73 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -8.70 2.86 9.96 -8.03 3.92 8.29 -21.96 51.60 -22.33 -20.77 50.80 -23.86 ULMN 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 3 3 # 3 A 630 SER B 236 SER^? 1000.00 A 709 ASP B 216 ASP~? 1000.00 A 740 HIS B 258 HIS^? 1000.00 coo -7.09 7.44 6.22 -7.53 5.14 5.59 -13.40 61.82 -38.71 -11.69 62.84 -40.02 coo -6.04 -3.54 13.59 -7.99 -3.21 12.73 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -8.70 2.86 9.96 -8.03 3.92 8.29 -14.61 55.49 -34.67 -14.73 54.17 -36.30 1pfq_c02 source 1pfq DIPEPTIDYL PEPTIDASE IV SOLUBLE FORM : 3 hits 1pfq_c02 naa= 3 ULMN 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 # 1 B 630 SER A 174 SER.? 1000.00 B 709 ASP A 180 ASP~? 1000.00 B 740 HIS A 179 HIS~? 1000.00 coo 4.44 13.29 37.64 6.01 11.66 38.49 39.69 47.27 -21.33 40.40 49.18 -20.03 coo 10.26 2.81 31.69 11.64 4.30 32.43 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 8.57 10.09 34.47 7.10 10.73 35.82 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 2 3 # 2 B 630 SER B 174 SER.? 1000.00 B 709 ASP B 180 ASP~? 1000.00 B 740 HIS B 179 HIS~? 1000.00 coo 4.44 13.29 37.64 6.01 11.66 38.49 -15.19 48.74 -23.97 -12.89 48.81 -23.13 coo 10.26 2.81 31.69 11.64 4.30 32.43 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 8.57 10.09 34.47 7.10 10.73 35.82 -21.96 51.60 -22.33 -20.77 50.80 -23.86 ULMN 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 3 3 # 3 B 630 SER B 236 SER^? 1000.00 B 709 ASP B 216 ASP~? 1000.00 B 740 HIS B 258 HIS^? 1000.00 coo 4.44 13.29 37.64 6.01 11.66 38.49 -13.40 61.82 -38.71 -11.69 62.84 -40.02 coo 10.26 2.81 31.69 11.64 4.30 32.43 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 8.57 10.09 34.47 7.10 10.73 35.82 -14.61 55.49 -34.67 -14.73 54.17 -36.30 1pfq_c03 source 1pfq DIPEPTIDYL PEPTIDASE IV SOLUBLE FORM : 3 hits 1pfq_c03 naa= 3 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 A 70 ALA A 64 ALA~? 1000.00 A 126 LEU A 67 LEU~? 1000.00 A 158 GLU A 85 GLU^? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 34.93 59.77 -19.93 34.59 59.38 -18.51 coo -4.62 32.83 147.14 -5.50 32.85 149.12 33.17 60.72 -24.22 31.61 59.87 -25.51 coo -0.83 29.57 149.77 -0.39 31.47 148.95 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA A 68 ALA~? 1000.00 A 126 LEU A 67 LEU~? 1000.00 A 158 GLU A 85 GLU^? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 32.73 64.82 -22.33 32.99 64.98 -20.84 coo -4.62 32.83 147.14 -5.50 32.85 149.12 33.17 60.72 -24.22 31.61 59.87 -25.51 coo -0.83 29.57 149.77 -0.39 31.47 148.95 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 A 70 ALA A 90 ALA.? 1000.00 A 126 LEU A 119 LEU~? 1000.00 A 158 GLU A 120 GLU~? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 30.05 57.92 -12.03 31.26 58.74 -11.61 coo -4.62 32.83 147.14 -5.50 32.85 149.12 24.83 55.85 -11.41 25.09 56.03 -13.58 coo -0.83 29.57 149.77 -0.39 31.47 148.95 19.22 58.37 -9.01 17.46 57.61 -9.85 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 A 70 ALA A 107 ALA^? 1000.00 A 126 LEU A 119 LEU~? 1000.00 A 158 GLU A 120 GLU~? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 22.32 56.29 -18.23 22.88 57.25 -17.21 coo -4.62 32.83 147.14 -5.50 32.85 149.12 24.83 55.85 -11.41 25.09 56.03 -13.58 coo -0.83 29.57 149.77 -0.39 31.47 148.95 19.22 58.37 -9.01 17.46 57.61 -9.85 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 5 3 # 5 A 70 ALA A 201 ALA^? 1000.00 A 126 LEU A 169 LEU^? 1000.00 A 158 GLU A 85 GLU^? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 27.52 55.15 -31.37 27.55 53.63 -31.22 coo -4.62 32.83 147.14 -5.50 32.85 149.12 30.83 53.10 -25.74 29.28 51.91 -26.71 coo -0.83 29.57 149.77 -0.39 31.47 148.95 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 6 3 # 6 A 70 ALA B 90 ALA.? 1000.00 A 126 LEU B 119 LEU~? 1000.00 A 158 GLU B 120 GLU~? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -2.08 57.50 -16.71 -1.09 56.98 -17.70 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -3.21 59.29 -11.73 -4.61 60.35 -12.98 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -1.89 62.61 -7.03 -2.47 61.78 -5.12 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 7 3 # 7 A 70 ALA B 107 ALA^? 1000.00 A 126 LEU B 119 LEU~? 1000.00 A 158 GLU B 120 GLU~? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -8.23 64.09 -13.37 -6.76 63.74 -13.61 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -3.21 59.29 -11.73 -4.61 60.35 -12.98 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -1.89 62.61 -7.03 -2.47 61.78 -5.12 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 8 3 # 8 A 70 ALA B 201 ALA^? 1000.00 A 126 LEU B 168 LEU^? 1000.00 A 158 GLU B 85 GLU^? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -18.10 65.95 -23.54 -19.03 64.99 -22.86 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -11.50 64.46 -21.29 -10.63 66.25 -22.16 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 9 3 # 9 A 70 ALA B 201 ALA^? 1000.00 A 126 LEU B 169 LEU^? 1000.00 A 158 GLU B 85 GLU^? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -18.10 65.95 -23.54 -19.03 64.99 -22.86 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -15.19 60.09 -22.29 -17.05 60.73 -21.39 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 10 3 # 10 A 70 ALA B 201 ALA^? 1000.00 A 126 LEU B 262 LEU^? 1000.00 A 158 GLU B 232 GLU^? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -18.10 65.95 -23.54 -19.03 64.99 -22.86 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -21.98 63.80 -24.97 -21.89 61.63 -24.73 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -23.91 65.19 -31.75 -23.94 67.24 -32.30 1pjh_c00 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 10 hits 1pjh_c00 naa= 3 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 B 70 ALA A 90 ALA.? 1000.00 B 126 LEU A 119 LEU~? 1000.00 B 158 GLU A 120 GLU~? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 30.05 57.92 -12.03 31.26 58.74 -11.61 coo -34.22 5.06 149.25 -33.65 4.24 151.15 24.83 55.85 -11.41 25.09 56.03 -13.58 coo -33.03 9.93 151.71 -34.98 9.38 151.11 19.22 58.37 -9.01 17.46 57.61 -9.85 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA A 107 ALA^? 1000.00 B 126 LEU A 119 LEU~? 1000.00 B 158 GLU A 120 GLU~? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 22.32 56.29 -18.23 22.88 57.25 -17.21 coo -34.22 5.06 149.25 -33.65 4.24 151.15 24.83 55.85 -11.41 25.09 56.03 -13.58 coo -33.03 9.93 151.71 -34.98 9.38 151.11 19.22 58.37 -9.01 17.46 57.61 -9.85 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 B 70 ALA A 201 ALA^? 1000.00 B 126 LEU A 169 LEU^? 1000.00 B 158 GLU A 85 GLU^? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 27.52 55.15 -31.37 27.55 53.63 -31.22 coo -34.22 5.06 149.25 -33.65 4.24 151.15 30.83 53.10 -25.74 29.28 51.91 -26.71 coo -33.03 9.93 151.71 -34.98 9.38 151.11 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 B 70 ALA B 90 ALA.? 1000.00 B 126 LEU B 119 LEU~? 1000.00 B 158 GLU B 120 GLU~? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -2.08 57.50 -16.71 -1.09 56.98 -17.70 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -3.21 59.29 -11.73 -4.61 60.35 -12.98 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -1.89 62.61 -7.03 -2.47 61.78 -5.12 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 5 3 # 5 B 70 ALA B 107 ALA^? 1000.00 B 126 LEU B 119 LEU~? 1000.00 B 158 GLU B 120 GLU~? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -8.23 64.09 -13.37 -6.76 63.74 -13.61 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -3.21 59.29 -11.73 -4.61 60.35 -12.98 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -1.89 62.61 -7.03 -2.47 61.78 -5.12 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 6 3 # 6 B 70 ALA B 201 ALA^? 1000.00 B 126 LEU B 168 LEU^? 1000.00 B 158 GLU B 85 GLU^? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -18.10 65.95 -23.54 -19.03 64.99 -22.86 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -11.50 64.46 -21.29 -10.63 66.25 -22.16 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 7 3 # 7 B 70 ALA B 201 ALA^? 1000.00 B 126 LEU B 169 LEU^? 1000.00 B 158 GLU B 85 GLU^? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -18.10 65.95 -23.54 -19.03 64.99 -22.86 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -15.19 60.09 -22.29 -17.05 60.73 -21.39 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 8 3 # 8 B 70 ALA B 201 ALA^? 1000.00 B 126 LEU B 262 LEU^? 1000.00 B 158 GLU B 232 GLU^? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -18.10 65.95 -23.54 -19.03 64.99 -22.86 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -21.98 63.80 -24.97 -21.89 61.63 -24.73 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -23.91 65.19 -31.75 -23.94 67.24 -32.30 1pjh_c01 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 8 hits 1pjh_c01 naa= 3 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 C 70 ALA A 64 ALA~? 1000.00 C 126 LEU A 67 LEU~? 1000.00 C 158 GLU A 85 GLU^? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 33.17 60.72 -24.22 31.61 59.87 -25.51 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA A 68 ALA~? 1000.00 C 126 LEU A 67 LEU~? 1000.00 C 158 GLU A 85 GLU^? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 32.73 64.82 -22.33 32.99 64.98 -20.84 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 33.17 60.72 -24.22 31.61 59.87 -25.51 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 C 70 ALA A 90 ALA.? 1000.00 C 126 LEU A 119 LEU~? 1000.00 C 158 GLU A 120 GLU~? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 30.05 57.92 -12.03 31.26 58.74 -11.61 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 24.83 55.85 -11.41 25.09 56.03 -13.58 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 19.22 58.37 -9.01 17.46 57.61 -9.85 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 C 70 ALA A 107 ALA^? 1000.00 C 126 LEU A 119 LEU~? 1000.00 C 158 GLU A 120 GLU~? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 22.32 56.29 -18.23 22.88 57.25 -17.21 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 24.83 55.85 -11.41 25.09 56.03 -13.58 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 19.22 58.37 -9.01 17.46 57.61 -9.85 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 5 3 # 5 C 70 ALA A 201 ALA^? 1000.00 C 126 LEU A 169 LEU^? 1000.00 C 158 GLU A 85 GLU^? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 27.52 55.15 -31.37 27.55 53.63 -31.22 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 30.83 53.10 -25.74 29.28 51.91 -26.71 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 6 3 # 6 C 70 ALA B 90 ALA.? 1000.00 C 126 LEU B 119 LEU~? 1000.00 C 158 GLU B 120 GLU~? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -2.08 57.50 -16.71 -1.09 56.98 -17.70 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -3.21 59.29 -11.73 -4.61 60.35 -12.98 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -1.89 62.61 -7.03 -2.47 61.78 -5.12 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 7 3 # 7 C 70 ALA B 107 ALA^? 1000.00 C 126 LEU B 119 LEU~? 1000.00 C 158 GLU B 120 GLU~? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -8.23 64.09 -13.37 -6.76 63.74 -13.61 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -3.21 59.29 -11.73 -4.61 60.35 -12.98 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -1.89 62.61 -7.03 -2.47 61.78 -5.12 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 8 3 # 8 C 70 ALA B 201 ALA^? 1000.00 C 126 LEU B 168 LEU^? 1000.00 C 158 GLU B 85 GLU^? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -18.10 65.95 -23.54 -19.03 64.99 -22.86 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -11.50 64.46 -21.29 -10.63 66.25 -22.16 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 9 3 # 9 C 70 ALA B 201 ALA^? 1000.00 C 126 LEU B 169 LEU^? 1000.00 C 158 GLU B 85 GLU^? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -18.10 65.95 -23.54 -19.03 64.99 -22.86 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -15.19 60.09 -22.29 -17.05 60.73 -21.39 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 10 3 # 10 C 70 ALA B 201 ALA^? 1000.00 C 126 LEU B 262 LEU^? 1000.00 C 158 GLU B 232 GLU^? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -18.10 65.95 -23.54 -19.03 64.99 -22.86 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -21.98 63.80 -24.97 -21.89 61.63 -24.73 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -23.91 65.19 -31.75 -23.94 67.24 -32.30 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 10 hits 1pjh_c02 naa= 3 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 1 3 # 1 A 248 ASP A 196 ASP.? 1000.00 A 270 LYS A 81 LYS.? 1000.00 A 382 MET A 188 MET?? 1000.00 coo -27.63 121.99 45.48 -26.66 123.86 45.68 17.64 57.85 -36.75 18.26 59.84 -36.39 coo -32.20 115.91 49.56 -31.37 121.03 53.12 18.76 63.56 -29.56 21.14 63.10 -34.87 coo -23.75 127.89 58.42 -26.02 128.79 55.12 20.26 46.26 -30.22 20.13 42.66 -28.05 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 2 3 # 2 A 248 ASP B 196 ASP.? 1000.00 A 270 LYS B 81 LYS.? 1000.00 A 382 MET B 188 MET?? 1000.00 coo -27.63 121.99 45.48 -26.66 123.86 45.68 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo -32.20 115.91 49.56 -31.37 121.03 53.12 -11.97 76.30 -19.94 -15.62 76.75 -24.03 coo -23.75 127.89 58.42 -26.02 128.79 55.12 -23.88 65.43 -13.59 -24.68 62.34 -10.73 1pjq_c02 source 1pjq SIROHEME SYNTHASE : 2 hits 1pjq_c02 naa= 3 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 1 3 # 1 111 GLN A 104 GLN^? 1000.00 294 GLU A 85 GLU^? 1000.00 304 ARG B 32 ARG^? 1000.00 coo 15.89 18.45 46.53 15.82 16.91 48.02 15.06 59.89 -22.25 14.38 60.78 -20.42 coo 22.84 13.44 52.91 20.84 13.18 52.38 27.14 56.96 -21.30 28.32 57.46 -19.62 coo 8.71 17.11 46.51 7.23 17.64 49.20 10.27 58.20 -24.55 11.21 60.44 -26.40 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 2 3 # 2 111 GLN A 156 GLN~? 1000.00 294 GLU B 31 GLU^? 1000.00 304 ARG A 163 ARG.? 1000.00 coo 15.89 18.45 46.53 15.82 16.91 48.02 13.99 48.96 -25.41 14.23 47.45 -26.93 coo 22.84 13.44 52.91 20.84 13.18 52.38 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 8.71 17.11 46.51 7.23 17.64 49.20 16.66 50.10 -32.81 17.39 47.13 -32.98 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 3 3 # 3 111 GLN A 162 GLN.? 1000.00 294 GLU B 31 GLU^? 1000.00 304 ARG A 163 ARG.? 1000.00 coo 15.89 18.45 46.53 15.82 16.91 48.02 10.82 50.51 -29.34 10.44 49.14 -27.72 coo 22.84 13.44 52.91 20.84 13.18 52.38 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 8.71 17.11 46.51 7.23 17.64 49.20 16.66 50.10 -32.81 17.39 47.13 -32.98 1pmi_c00 source 1pmi PHOSPHOMANNOSE ISOMERASE : 3 hits 1pmi_c00 naa= 3 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 # 1 B 1 SER A 118 SER~? 1000.00 B 69 ALA A 90 ALA.? 1000.00 B 241 ASN A 122 ASN~? 1000.00 coo 13.24 41.94 33.13 13.08 39.54 33.17 25.44 56.75 -6.65 27.54 55.65 -7.08 coo 9.15 37.89 36.69 10.55 37.76 37.22 30.05 57.92 -12.03 31.26 58.74 -11.61 coo 10.91 43.03 38.47 11.81 41.82 36.93 26.58 61.39 -9.58 28.06 60.87 -8.14 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 2 3 # 2 B 1 SER B 118 SER~? 1000.00 B 69 ALA B 90 ALA.? 1000.00 B 241 ASN B 122 ASN~? 1000.00 coo 13.24 41.94 33.13 13.08 39.54 33.17 0.89 57.06 -10.45 -0.04 55.05 -11.41 coo 9.15 37.89 36.69 10.55 37.76 37.22 -2.08 57.50 -16.71 -1.09 56.98 -17.70 coo 10.91 43.03 38.47 11.81 41.82 36.93 1.60 60.89 -14.49 2.17 58.90 -14.85 1pnl_c00 source 1pnl PENICILLIN AMIDOHYDROLASE : 2 hits 1pnl_c00 naa= 3 ULMN 3 1pp4_c02 RHAMNOGALACTURONAN ACETYLESTERASE user 1 3 # 1 A 74 ASN A 224 ASN~? 1000.00 A 192 ASP A 180 ASP~? 1000.00 A 195 HIS A 179 HIS~? 1000.00 coo -4.84 51.77 30.37 -3.89 50.12 29.46 35.03 45.63 -39.37 35.20 47.65 -38.71 coo 2.03 47.14 19.75 1.72 46.26 21.64 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 1.41 44.84 24.92 -0.49 45.70 25.19 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1pp4_c02 RHAMNOGALACTURONAN ACETYLESTERASE user 2 3 # 2 A 74 ASN B 224 ASN~? 1000.00 A 192 ASP B 180 ASP~? 1000.00 A 195 HIS B 179 HIS~? 1000.00 coo -4.84 51.77 30.37 -3.89 50.12 29.46 -29.62 59.26 -28.83 -27.87 60.14 -29.67 coo 2.03 47.14 19.75 1.72 46.26 21.64 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 1.41 44.84 24.92 -0.49 45.70 25.19 -21.96 51.60 -22.33 -20.77 50.80 -23.86 1pp4_c02 source 1pp4 RHAMNOGALACTURONAN ACETYLESTERASE : 2 hits 1pp4_c02 naa= 3 ULMN 3 1pp4_c03 RHAMNOGALACTURONAN ACETYLESTERASE user 1 3 # 1 B 74 ASN A 224 ASN~? 1000.00 B 192 ASP A 180 ASP~? 1000.00 B 195 HIS A 179 HIS~? 1000.00 coo -1.08 51.41 10.34 0.65 52.62 10.17 35.03 45.63 -39.37 35.20 47.65 -38.71 coo 11.36 52.33 5.59 10.18 53.87 6.47 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 7.99 56.74 7.55 6.88 55.39 8.70 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1pp4_c03 RHAMNOGALACTURONAN ACETYLESTERASE user 2 3 # 2 B 74 ASN B 224 ASN~? 1000.00 B 192 ASP B 180 ASP~? 1000.00 B 195 HIS B 179 HIS~? 1000.00 coo -1.08 51.41 10.34 0.65 52.62 10.17 -29.62 59.26 -28.83 -27.87 60.14 -29.67 coo 11.36 52.33 5.59 10.18 53.87 6.47 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 7.99 56.74 7.55 6.88 55.39 8.70 -21.96 51.60 -22.33 -20.77 50.80 -23.86 1pp4_c03 source 1pp4 RHAMNOGALACTURONAN ACETYLESTERASE : 2 hits 1pp4_c03 naa= 3 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 A 48 LEU A 222 LEU~? 1000.00 A 58 ASP A 226 ASP~? 1000.00 A 120 LYS A 187 LYS~? 1000.00 coo 34.02 69.29 75.26 34.82 67.82 76.74 35.17 42.19 -32.48 34.13 40.55 -31.45 coo 34.46 72.45 78.57 32.82 72.75 77.28 30.12 41.11 -36.46 28.02 41.19 -36.22 coo 28.96 77.64 81.19 29.05 74.53 77.51 23.37 46.40 -32.46 25.34 41.04 -34.48 1pym_c00 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 1 hits 1pym_c00 naa= 3 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 B 48 LEU A 222 LEU~? 1000.00 B 58 ASP A 226 ASP~? 1000.00 B 120 LYS A 187 LYS~? 1000.00 coo 54.50 104.32 58.69 55.83 105.69 59.81 35.17 42.19 -32.48 34.13 40.55 -31.45 coo 57.63 101.19 59.83 56.60 100.89 57.99 30.12 41.11 -36.46 28.02 41.19 -36.22 coo 61.58 95.88 55.22 58.18 99.30 54.71 23.37 46.40 -32.46 25.34 41.04 -34.48 1pym_c01 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 1 hits 1pym_c01 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 69 ASP~? 1000.00 A 68 ALA A 66 ALA~? 1000.00 A 72 LEU A 67 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 48.88 4.35 16.59 48.73 5.09 15.20 37.46 62.91 -23.42 38.36 61.83 -23.98 coo 53.89 6.25 15.09 52.88 7.92 14.14 33.17 60.72 -24.22 31.61 59.87 -25.51 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP A 69 ASP~? 1000.00 A 68 ALA A 66 ALA~? 1000.00 A 72 LEU A 238 LEU.? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 48.88 4.35 16.59 48.73 5.09 15.20 37.46 62.91 -23.42 38.36 61.83 -23.98 coo 53.89 6.25 15.09 52.88 7.92 14.14 42.56 64.24 -26.17 40.94 65.56 -26.85 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 # 3 A 67 ASP A 69 ASP~? 1000.00 A 68 ALA A 68 ALA~? 1000.00 A 72 LEU A 67 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 48.88 4.35 16.59 48.73 5.09 15.20 32.73 64.82 -22.33 32.99 64.98 -20.84 coo 53.89 6.25 15.09 52.88 7.92 14.14 33.17 60.72 -24.22 31.61 59.87 -25.51 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 4 3 # 4 A 67 ASP A 69 ASP~? 1000.00 A 68 ALA A 68 ALA~? 1000.00 A 72 LEU A 71 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 48.88 4.35 16.59 48.73 5.09 15.20 32.73 64.82 -22.33 32.99 64.98 -20.84 coo 53.89 6.25 15.09 52.88 7.92 14.14 29.60 66.14 -25.23 28.66 64.23 -25.82 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 5 3 # 5 A 67 ASP A 109 ASP^? 1000.00 A 68 ALA A 88 ALA.? 1000.00 A 72 LEU A 86 LEU.? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 48.88 4.35 16.59 48.73 5.09 15.20 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 53.89 6.25 15.09 52.88 7.92 14.14 27.05 51.21 -22.71 25.69 49.99 -23.87 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 6 3 # 6 A 67 ASP A 171 ASP.? 1000.00 A 68 ALA A 64 ALA~? 1000.00 A 72 LEU A 67 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 48.88 4.35 16.59 48.73 5.09 15.20 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 53.89 6.25 15.09 52.88 7.92 14.14 33.17 60.72 -24.22 31.61 59.87 -25.51 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 7 3 # 7 A 67 ASP A 171 ASP.? 1000.00 A 68 ALA A 170 ALA^? 1000.00 A 72 LEU A 67 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 48.88 4.35 16.59 48.73 5.09 15.20 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 53.89 6.25 15.09 52.88 7.92 14.14 33.17 60.72 -24.22 31.61 59.87 -25.51 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 8 3 # 8 A 67 ASP A 171 ASP.? 1000.00 A 68 ALA A 170 ALA^? 1000.00 A 72 LEU A 169 LEU^? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 48.88 4.35 16.59 48.73 5.09 15.20 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 53.89 6.25 15.09 52.88 7.92 14.14 30.83 53.10 -25.74 29.28 51.91 -26.71 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 9 3 # 9 A 67 ASP A 180 ASP~? 1000.00 A 68 ALA A 178 ALA~? 1000.00 A 72 LEU A 182 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 48.88 4.35 16.59 48.73 5.09 15.20 33.07 41.70 -22.99 33.02 42.70 -21.85 coo 53.89 6.25 15.09 52.88 7.92 14.14 30.54 45.87 -25.93 30.98 47.80 -25.06 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 10 3 # 10 A 67 ASP A 180 ASP~? 1000.00 A 68 ALA A 181 ALA~? 1000.00 A 72 LEU A 182 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 48.88 4.35 16.59 48.73 5.09 15.20 28.34 41.56 -25.54 28.32 41.22 -24.06 coo 53.89 6.25 15.09 52.88 7.92 14.14 30.54 45.87 -25.93 30.98 47.80 -25.06 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 11 3 # 11 A 67 ASP A 196 ASP.? 1000.00 A 68 ALA A 191 ALA.? 1000.00 A 72 LEU A 190 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 48.88 4.35 16.59 48.73 5.09 15.20 18.59 53.44 -34.00 18.22 54.93 -34.03 coo 53.89 6.25 15.09 52.88 7.92 14.14 22.65 51.79 -32.65 23.77 53.48 -33.46 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 12 3 # 12 A 67 ASP A 196 ASP.? 1000.00 A 68 ALA A 191 ALA.? 1000.00 A 72 LEU A 192 LEU.? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 48.88 4.35 16.59 48.73 5.09 15.20 18.59 53.44 -34.00 18.22 54.93 -34.03 coo 53.89 6.25 15.09 52.88 7.92 14.14 16.86 50.64 -37.53 16.60 48.59 -36.81 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 13 3 # 13 A 67 ASP A 196 ASP.? 1000.00 A 68 ALA A 199 ALA.? 1000.00 A 72 LEU A 190 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 48.88 4.35 16.59 48.73 5.09 15.20 22.27 57.39 -35.90 21.37 56.17 -35.86 coo 53.89 6.25 15.09 52.88 7.92 14.14 22.65 51.79 -32.65 23.77 53.48 -33.46 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 14 3 # 14 A 67 ASP A 226 ASP~? 1000.00 A 68 ALA A 225 ALA~? 1000.00 A 72 LEU A 222 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 30.12 41.11 -36.46 28.02 41.19 -36.22 coo 48.88 4.35 16.59 48.73 5.09 15.20 34.22 41.09 -39.00 35.05 40.23 -38.05 coo 53.89 6.25 15.09 52.88 7.92 14.14 35.17 42.19 -32.48 34.13 40.55 -31.45 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 15 3 # 15 A 67 ASP A 226 ASP~? 1000.00 A 68 ALA A 228 ALA.? 1000.00 A 72 LEU A 229 LEU^? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 30.12 41.11 -36.46 28.02 41.19 -36.22 coo 48.88 4.35 16.59 48.73 5.09 15.20 26.27 44.52 -39.48 25.47 43.94 -38.32 coo 53.89 6.25 15.09 52.88 7.92 14.14 27.91 47.98 -36.52 26.49 48.27 -34.92 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 16 3 # 16 A 67 ASP B 69 ASP~? 1000.00 A 68 ALA B 66 ALA~? 1000.00 A 72 LEU B 67 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 48.88 4.35 16.59 48.73 5.09 15.20 -5.82 60.22 -30.38 -6.94 59.31 -30.82 coo 53.89 6.25 15.09 52.88 7.92 14.14 -8.26 62.27 -26.70 -10.05 63.38 -26.15 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 17 3 # 17 A 67 ASP B 69 ASP~? 1000.00 A 68 ALA B 66 ALA~? 1000.00 A 72 LEU B 238 LEU^? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 48.88 4.35 16.59 48.73 5.09 15.20 -5.82 60.22 -30.38 -6.94 59.31 -30.82 coo 53.89 6.25 15.09 52.88 7.92 14.14 -7.23 59.22 -35.87 -7.02 61.35 -35.52 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 18 3 # 18 A 67 ASP B 69 ASP~? 1000.00 A 68 ALA B 68 ALA~? 1000.00 A 72 LEU B 67 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 48.88 4.35 16.59 48.73 5.09 15.20 -4.23 64.18 -27.03 -3.06 63.44 -26.41 coo 53.89 6.25 15.09 52.88 7.92 14.14 -8.26 62.27 -26.70 -10.05 63.38 -26.15 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 19 3 # 19 A 67 ASP B 69 ASP~? 1000.00 A 68 ALA B 68 ALA~? 1000.00 A 72 LEU B 71 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 48.88 4.35 16.59 48.73 5.09 15.20 -4.23 64.18 -27.03 -3.06 63.44 -26.41 coo 53.89 6.25 15.09 52.88 7.92 14.14 -6.20 68.49 -26.95 -7.88 67.86 -25.76 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 20 3 # 20 A 67 ASP B 109 ASP^? 1000.00 A 68 ALA B 88 ALA.? 1000.00 A 72 LEU B 86 LEU.? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 48.88 4.35 16.59 48.73 5.09 15.20 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 53.89 6.25 15.09 52.88 7.92 14.14 -14.63 60.26 -16.82 -16.54 60.98 -16.06 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 21 3 # 21 A 67 ASP B 171 ASP.? 1000.00 A 68 ALA B 64 ALA~? 1000.00 A 72 LEU B 67 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 48.88 4.35 16.59 48.73 5.09 15.20 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 53.89 6.25 15.09 52.88 7.92 14.14 -8.26 62.27 -26.70 -10.05 63.38 -26.15 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 22 3 # 22 A 67 ASP B 171 ASP.? 1000.00 A 68 ALA B 170 ALA^? 1000.00 A 72 LEU B 67 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 48.88 4.35 16.59 48.73 5.09 15.20 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 53.89 6.25 15.09 52.88 7.92 14.14 -8.26 62.27 -26.70 -10.05 63.38 -26.15 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 23 3 # 23 A 67 ASP B 171 ASP.? 1000.00 A 68 ALA B 170 ALA^? 1000.00 A 72 LEU B 169 LEU^? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 48.88 4.35 16.59 48.73 5.09 15.20 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 53.89 6.25 15.09 52.88 7.92 14.14 -15.19 60.09 -22.29 -17.05 60.73 -21.39 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 24 3 # 24 A 67 ASP B 180 ASP~? 1000.00 A 68 ALA B 178 ALA~? 1000.00 A 72 LEU B 182 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 48.88 4.35 16.59 48.73 5.09 15.20 -20.60 50.73 -17.23 -19.11 50.84 -16.99 coo 53.89 6.25 15.09 52.88 7.92 14.14 -20.14 56.46 -18.81 -18.05 56.12 -19.21 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 25 3 # 25 A 67 ASP B 180 ASP~? 1000.00 A 68 ALA B 181 ALA~? 1000.00 A 72 LEU B 182 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 48.88 4.35 16.59 48.73 5.09 15.20 -22.86 54.87 -15.09 -21.85 53.97 -14.39 coo 53.89 6.25 15.09 52.88 7.92 14.14 -20.14 56.46 -18.81 -18.05 56.12 -19.21 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 26 3 # 26 A 67 ASP B 196 ASP.? 1000.00 A 68 ALA B 191 ALA.? 1000.00 A 72 LEU B 190 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo 48.88 4.35 16.59 48.73 5.09 15.20 -21.95 72.44 -17.51 -20.94 73.53 -17.82 coo 53.89 6.25 15.09 52.88 7.92 14.14 -21.62 68.01 -19.05 -21.27 68.54 -21.13 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 27 3 # 27 A 67 ASP B 196 ASP.? 1000.00 A 68 ALA B 191 ALA.? 1000.00 A 72 LEU B 192 LEU.? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo 48.88 4.35 16.59 48.73 5.09 15.20 -21.95 72.44 -17.51 -20.94 73.53 -17.82 coo 53.89 6.25 15.09 52.88 7.92 14.14 -26.61 73.61 -17.15 -27.48 72.32 -15.63 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 28 3 # 28 A 67 ASP B 196 ASP.? 1000.00 A 68 ALA B 199 ALA.? 1000.00 A 72 LEU B 190 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -21.02 76.89 -20.51 -19.57 76.97 -22.07 coo 48.88 4.35 16.59 48.73 5.09 15.20 -19.98 72.91 -23.30 -20.65 72.86 -21.93 coo 53.89 6.25 15.09 52.88 7.92 14.14 -21.62 68.01 -19.05 -21.27 68.54 -21.13 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 29 3 # 29 A 67 ASP B 226 ASP~? 1000.00 A 68 ALA B 225 ALA~? 1000.00 A 72 LEU B 222 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo 48.88 4.35 16.59 48.73 5.09 15.20 -32.44 57.10 -25.93 -32.27 55.62 -25.64 coo 53.89 6.25 15.09 52.88 7.92 14.14 -27.11 54.03 -24.09 -27.52 53.16 -22.14 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 30 3 # 30 A 67 ASP B 226 ASP~? 1000.00 A 68 ALA B 228 ALA.? 1000.00 A 72 LEU B 229 LEU^? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo 48.88 4.35 16.59 48.73 5.09 15.20 -30.92 64.76 -21.90 -30.51 64.62 -20.43 coo 53.89 6.25 15.09 52.88 7.92 14.14 -26.58 64.21 -23.65 -25.55 64.59 -21.77 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 30 hits 1q6l_c05 naa= 3 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 155 HIS A 176 HIS~? 1000.00 A 236 ASP A 109 ASP^? 1000.00 A 261 LYS A 142 LYS^? 1000.00 coo 55.45 46.76 42.08 57.34 46.16 42.75 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 48.87 29.19 44.63 49.10 27.34 43.63 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 47.58 17.35 41.83 51.40 20.85 40.83 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 155 HIS B 176 HIS~? 1000.00 A 236 ASP B 109 ASP^? 1000.00 A 261 LYS B 142 LYS^? 1000.00 coo 55.45 46.76 42.08 57.34 46.16 42.75 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 48.87 29.19 44.63 49.10 27.34 43.63 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 47.58 17.35 41.83 51.40 20.85 40.83 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c00 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c00 naa= 3 ULMN 3 1qgn_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 155 HIS A 176 HIS~? 1000.00 B 236 ASP A 109 ASP^? 1000.00 B 261 LYS A 142 LYS^? 1000.00 coo 17.23 -29.05 11.63 18.63 -29.78 10.25 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c01 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 155 HIS B 176 HIS~? 1000.00 B 236 ASP B 109 ASP^? 1000.00 B 261 LYS B 142 LYS^? 1000.00 coo 17.23 -29.05 11.63 18.63 -29.78 10.25 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c01 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c01 naa= 3 ULMN 3 1qgn_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 C 155 HIS A 176 HIS~? 1000.00 C 236 ASP A 109 ASP^? 1000.00 C 261 LYS A 142 LYS^? 1000.00 coo 55.11 47.10 12.61 53.44 47.85 11.58 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 45.78 31.11 9.51 44.25 30.06 10.53 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 37.54 22.37 12.10 37.83 27.55 13.24 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c02 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 C 155 HIS B 176 HIS~? 1000.00 C 236 ASP B 109 ASP^? 1000.00 C 261 LYS B 142 LYS^? 1000.00 coo 55.11 47.10 12.61 53.44 47.85 11.58 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 45.78 31.11 9.51 44.25 30.06 10.53 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 37.54 22.37 12.10 37.83 27.55 13.24 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c02 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c02 naa= 3 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 155 HIS A 176 HIS~? 1000.00 D 236 ASP A 109 ASP^? 1000.00 D 261 LYS A 142 LYS^? 1000.00 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 D 155 HIS B 176 HIS~? 1000.00 D 236 ASP B 109 ASP^? 1000.00 D 261 LYS B 142 LYS^? 1000.00 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c03 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c03 naa= 3 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 155 HIS A 176 HIS~? 1000.00 E 236 ASP A 109 ASP^? 1000.00 E 261 LYS A 142 LYS^? 1000.00 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 155 HIS B 176 HIS~? 1000.00 E 236 ASP B 109 ASP^? 1000.00 E 261 LYS B 142 LYS^? 1000.00 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c04 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c04 naa= 3 ULMN 3 1qgn_c05 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 155 HIS A 176 HIS~? 1000.00 F 236 ASP A 109 ASP^? 1000.00 F 261 LYS A 142 LYS^? 1000.00 coo 3.13 15.54 -65.72 2.08 14.15 -66.89 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c05 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 155 HIS B 176 HIS~? 1000.00 F 236 ASP B 109 ASP^? 1000.00 F 261 LYS B 142 LYS^? 1000.00 coo 3.13 15.54 -65.72 2.08 14.15 -66.89 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c05 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c05 naa= 3 ULMN 3 1qgn_c06 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 G 155 HIS A 176 HIS~? 1000.00 G 236 ASP A 109 ASP^? 1000.00 G 261 LYS A 142 LYS^? 1000.00 coo 76.68 -27.27 -65.07 77.71 -25.72 -66.04 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c06 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 G 155 HIS B 176 HIS~? 1000.00 G 236 ASP B 109 ASP^? 1000.00 G 261 LYS B 142 LYS^? 1000.00 coo 76.68 -27.27 -65.07 77.71 -25.72 -66.04 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c06 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c06 naa= 3 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 155 HIS A 176 HIS~? 1000.00 H 236 ASP A 109 ASP^? 1000.00 H 261 LYS A 142 LYS^? 1000.00 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 H 155 HIS B 176 HIS~? 1000.00 H 236 ASP B 109 ASP^? 1000.00 H 261 LYS B 142 LYS^? 1000.00 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c07 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c07 naa= 3 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 146 TYR.? 1000.00 A 236 ASP A 109 ASP^? 1000.00 A 261 LYS A 142 LYS^? 1000.00 coo 55.48 26.51 40.65 55.39 23.99 39.43 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 48.87 29.19 44.63 49.10 27.34 43.63 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 47.58 17.35 41.83 51.40 20.85 40.83 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR B 146 TYR.? 1000.00 A 236 ASP B 109 ASP^? 1000.00 A 261 LYS B 142 LYS^? 1000.00 coo 55.48 26.51 40.65 55.39 23.99 39.43 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 48.87 29.19 44.63 49.10 27.34 43.63 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 47.58 17.35 41.83 51.40 20.85 40.83 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c08 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c08 naa= 3 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 146 TYR.? 1000.00 B 236 ASP A 109 ASP^? 1000.00 B 261 LYS A 142 LYS^? 1000.00 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR B 146 TYR.? 1000.00 B 236 ASP B 109 ASP^? 1000.00 B 261 LYS B 142 LYS^? 1000.00 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c09 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c09 naa= 3 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 C 163 TYR A 146 TYR.? 1000.00 C 236 ASP A 109 ASP^? 1000.00 C 261 LYS A 142 LYS^? 1000.00 coo 39.51 34.34 13.63 37.63 32.61 14.79 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 45.78 31.11 9.51 44.25 30.06 10.53 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 37.54 22.37 12.10 37.83 27.55 13.24 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 C 163 TYR B 146 TYR.? 1000.00 C 236 ASP B 109 ASP^? 1000.00 C 261 LYS B 142 LYS^? 1000.00 coo 39.51 34.34 13.63 37.63 32.61 14.79 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 45.78 31.11 9.51 44.25 30.06 10.53 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 37.54 22.37 12.10 37.83 27.55 13.24 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c10 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c10 naa= 3 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 163 TYR A 146 TYR.? 1000.00 D 236 ASP A 109 ASP^? 1000.00 D 261 LYS A 142 LYS^? 1000.00 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 D 163 TYR B 146 TYR.? 1000.00 D 236 ASP B 109 ASP^? 1000.00 D 261 LYS B 142 LYS^? 1000.00 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c11 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c11 naa= 3 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 146 TYR.? 1000.00 E 236 ASP A 109 ASP^? 1000.00 E 261 LYS A 142 LYS^? 1000.00 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR B 146 TYR.? 1000.00 E 236 ASP B 109 ASP^? 1000.00 E 261 LYS B 142 LYS^? 1000.00 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c12 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c12 naa= 3 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 146 TYR.? 1000.00 F 236 ASP A 109 ASP^? 1000.00 F 261 LYS A 142 LYS^? 1000.00 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR B 146 TYR.? 1000.00 F 236 ASP B 109 ASP^? 1000.00 F 261 LYS B 142 LYS^? 1000.00 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c13 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c13 naa= 3 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 G 163 TYR A 146 TYR.? 1000.00 G 236 ASP A 109 ASP^? 1000.00 G 261 LYS A 142 LYS^? 1000.00 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 G 163 TYR B 146 TYR.? 1000.00 G 236 ASP B 109 ASP^? 1000.00 G 261 LYS B 142 LYS^? 1000.00 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c14 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c14 naa= 3 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 163 TYR A 146 TYR.? 1000.00 H 236 ASP A 109 ASP^? 1000.00 H 261 LYS A 142 LYS^? 1000.00 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 H 163 TYR B 146 TYR.? 1000.00 H 236 ASP B 109 ASP^? 1000.00 H 261 LYS B 142 LYS^? 1000.00 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 -6.19 67.97 -9.05 -7.36 69.51 -3.96 1qgn_c15 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c15 naa= 3 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 110 ARG B 32 ARG^? 1000.00 C 163 TYR B 33 TYR^? 1000.00 C 236 ASP B 69 ASP~? 1000.00 coo 39.01 29.77 22.02 37.48 31.30 19.84 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 39.51 34.34 13.63 37.63 32.61 14.79 1.90 62.22 -26.29 0.23 63.78 -27.88 coo 45.78 31.11 9.51 44.25 30.06 10.53 -3.24 63.62 -31.80 -1.56 62.34 -31.63 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 110 ARG B 147 ARG.? 1000.00 C 163 TYR B 146 TYR.? 1000.00 C 236 ASP B 153 ASP~? 1000.00 coo 39.01 29.77 22.02 37.48 31.30 19.84 -18.58 53.32 -7.29 -16.65 53.40 -4.90 coo 39.51 34.34 13.63 37.63 32.61 14.79 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 45.78 31.11 9.51 44.25 30.06 10.53 -21.01 65.81 -3.11 -22.79 67.01 -3.06 1qgn_c16 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c16 naa= 3 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 110 ARG B 32 ARG^? 1000.00 D 163 TYR B 33 TYR^? 1000.00 D 236 ASP B 69 ASP~? 1000.00 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 1.90 62.22 -26.29 0.23 63.78 -27.88 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -3.24 63.62 -31.80 -1.56 62.34 -31.63 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 110 ARG B 147 ARG.? 1000.00 D 163 TYR B 146 TYR.? 1000.00 D 236 ASP B 153 ASP~? 1000.00 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 -18.58 53.32 -7.29 -16.65 53.40 -4.90 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -21.01 65.81 -3.11 -22.79 67.01 -3.06 1qgn_c17 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c17 naa= 3 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR B 146 TYR.? 1000.00 A 236 ASP B 153 ASP~? 1000.00 C 110 ARG B 147 ARG.? 1000.00 coo 55.48 26.51 40.65 55.39 23.99 39.43 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 48.87 29.19 44.63 49.10 27.34 43.63 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 52.39 23.42 32.10 54.51 23.27 34.29 -18.58 53.32 -7.29 -16.65 53.40 -4.90 1qgn_c18 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c18 naa= 3 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR B 33 TYR^? 1000.00 B 236 ASP B 69 ASP~? 1000.00 D 110 ARG B 32 ARG^? 1000.00 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 1.90 62.22 -26.29 0.23 63.78 -27.88 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 10.27 58.20 -24.55 11.21 60.44 -26.40 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR B 146 TYR.? 1000.00 B 236 ASP B 153 ASP~? 1000.00 D 110 ARG B 147 ARG.? 1000.00 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 -18.58 53.32 -7.29 -16.65 53.40 -4.90 1qgn_c19 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c19 naa= 3 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 110 ARG B 32 ARG^? 1000.00 G 163 TYR B 33 TYR^? 1000.00 G 236 ASP B 69 ASP~? 1000.00 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 1.90 62.22 -26.29 0.23 63.78 -27.88 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -3.24 63.62 -31.80 -1.56 62.34 -31.63 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 110 ARG B 147 ARG.? 1000.00 G 163 TYR B 146 TYR.? 1000.00 G 236 ASP B 153 ASP~? 1000.00 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 -18.58 53.32 -7.29 -16.65 53.40 -4.90 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -21.01 65.81 -3.11 -22.79 67.01 -3.06 1qgn_c20 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c20 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG B 32 ARG^? 1000.00 H 163 TYR B 33 TYR^? 1000.00 H 236 ASP B 69 ASP~? 1000.00 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 1.90 62.22 -26.29 0.23 63.78 -27.88 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -3.24 63.62 -31.80 -1.56 62.34 -31.63 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 110 ARG B 147 ARG.? 1000.00 H 163 TYR B 146 TYR.? 1000.00 H 236 ASP B 153 ASP~? 1000.00 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 -18.58 53.32 -7.29 -16.65 53.40 -4.90 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -21.01 65.81 -3.11 -22.79 67.01 -3.06 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c21 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR B 146 TYR.? 1000.00 E 236 ASP B 153 ASP~? 1000.00 G 110 ARG B 147 ARG.? 1000.00 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 -18.58 53.32 -7.29 -16.65 53.40 -4.90 1qgn_c22 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c22 naa= 3 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR B 33 TYR^? 1000.00 F 236 ASP B 69 ASP~? 1000.00 H 110 ARG B 32 ARG^? 1000.00 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 1.90 62.22 -26.29 0.23 63.78 -27.88 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 10.27 58.20 -24.55 11.21 60.44 -26.40 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR B 146 TYR.? 1000.00 F 236 ASP B 153 ASP~? 1000.00 H 110 ARG B 147 ARG.? 1000.00 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 -18.58 53.32 -7.29 -16.65 53.40 -4.90 1qgn_c23 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c23 naa= 3 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 # 1 A 49 ASP A 103 ASP.? 1000.00 A 147 THR A 82 THR^? 1000.00 A 294 ASP A 196 ASP.? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 17.89 60.42 -27.59 16.15 59.46 -28.49 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 17.64 57.85 -36.75 18.26 59.84 -36.39 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 2 3 # 2 A 49 ASP A 171 ASP.? 1000.00 A 147 THR A 204 THR^? 1000.00 A 294 ASP A 69 ASP~? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 36.15 56.61 -26.72 36.22 58.33 -25.43 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 36.79 67.01 -23.90 37.87 67.50 -22.12 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 3 3 # 3 A 49 ASP A 171 ASP.? 1000.00 A 147 THR A 206 THR.? 1000.00 A 294 ASP A 69 ASP~? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 42.51 55.26 -23.36 42.84 55.25 -21.18 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 36.79 67.01 -23.90 37.87 67.50 -22.12 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 4 3 # 4 A 49 ASP A 171 ASP.? 1000.00 A 147 THR A 206 THR.? 1000.00 A 294 ASP A 216 ASP.? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 42.51 55.26 -23.36 42.84 55.25 -21.18 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 44.82 46.44 -29.25 46.02 48.15 -29.05 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 5 3 # 5 A 49 ASP B 171 ASP.? 1000.00 A 147 THR B 204 THR^? 1000.00 A 294 ASP B 69 ASP~? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 -12.74 58.88 -28.08 -10.74 59.59 -28.28 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 -3.24 63.62 -31.80 -1.56 62.34 -31.63 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 6 3 # 6 A 49 ASP B 171 ASP.? 1000.00 A 147 THR B 204 THR^? 1000.00 A 294 ASP B 216 ASP~? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 -12.74 58.88 -28.08 -10.74 59.59 -28.28 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 -19.23 49.40 -32.78 -18.00 47.70 -33.08 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 7 3 # 7 A 49 ASP B 171 ASP.? 1000.00 A 147 THR B 206 THR^? 1000.00 A 294 ASP B 69 ASP~? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 -10.64 52.53 -30.49 -8.59 52.04 -30.11 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 -3.24 63.62 -31.80 -1.56 62.34 -31.63 1qgx_c02 source 1qgx 3',5'-ADENOSINE BISPHOSPHATASE : 7 hits 1qgx_c02 naa= 3 ULMN 3 1qho_c05 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 109 ASP^? 1000.00 A 261 ASP A 69 ASP~? 1000.00 A 329 ASP A 171 ASP.? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 34.02 79.89 42.60 34.73 78.01 41.86 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 37.87 70.12 31.80 36.61 69.74 30.15 36.72 54.39 -20.35 38.41 55.64 -20.64 1qho_c05 source 1qho ALPHA-AMYLASE : 1 hits 1qho_c05 naa= 3 ULMN 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 B 51 ALA B 218 ALA~? 1000.00 B 148 HIS B 176 HIS~? 1000.00 B 163 ASP B 216 ASP~? 1000.00 coo -33.97 19.78 54.18 -33.40 20.11 52.82 -24.24 51.06 -28.15 -23.94 49.76 -27.45 coo -33.17 20.01 48.16 -34.95 19.37 49.06 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -39.82 16.62 48.85 -38.59 18.24 48.48 -19.23 49.40 -32.78 -18.00 47.70 -33.08 1qol_c01 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 1 hits 1qol_c01 naa= 3 ULMN 3 1qrz_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 176 HIS~? 1000.00 A 646 ASP A 216 ASP.? 1000.00 A 741 SER A 174 SER.? 1000.00 coo -20.72 2.99 34.37 -21.94 1.82 35.61 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -18.83 7.68 26.86 -20.89 7.78 26.56 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 39.69 47.27 -21.33 40.40 49.18 -20.03 ULMN 3 1qrz_c12 PLASMINOGEN user 2 3 # 2 A 603 HIS A 179 HIS~? 1000.00 A 646 ASP A 216 ASP.? 1000.00 A 741 SER A 174 SER.? 1000.00 coo -20.72 2.99 34.37 -21.94 1.82 35.61 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -18.83 7.68 26.86 -20.89 7.78 26.56 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 39.69 47.27 -21.33 40.40 49.18 -20.03 ULMN 3 1qrz_c12 PLASMINOGEN user 3 3 # 3 A 603 HIS B 176 HIS~? 1000.00 A 646 ASP B 216 ASP~? 1000.00 A 741 SER B 174 SER.? 1000.00 coo -20.72 2.99 34.37 -21.94 1.82 35.61 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -18.83 7.68 26.86 -20.89 7.78 26.56 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 -15.19 48.74 -23.97 -12.89 48.81 -23.13 ULMN 3 1qrz_c12 PLASMINOGEN user 4 3 # 4 A 603 HIS B 179 HIS~? 1000.00 A 646 ASP B 216 ASP~? 1000.00 A 741 SER B 174 SER.? 1000.00 coo -20.72 2.99 34.37 -21.94 1.82 35.61 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -18.83 7.68 26.86 -20.89 7.78 26.56 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 -15.19 48.74 -23.97 -12.89 48.81 -23.13 1qrz_c12 source 1qrz PLASMINOGEN : 4 hits 1qrz_c12 naa= 3 ULMN 3 1qrz_c13 PLASMINOGEN user 1 3 # 1 B 603 HIS A 176 HIS~? 1000.00 B 646 ASP A 216 ASP.? 1000.00 B 741 SER A 174 SER.? 1000.00 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -43.75 -1.60 -6.12 -44.85 0.33 -5.15 39.69 47.27 -21.33 40.40 49.18 -20.03 ULMN 3 1qrz_c13 PLASMINOGEN user 2 3 # 2 B 603 HIS A 179 HIS~? 1000.00 B 646 ASP A 216 ASP.? 1000.00 B 741 SER A 174 SER.? 1000.00 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -43.75 -1.60 -6.12 -44.85 0.33 -5.15 39.69 47.27 -21.33 40.40 49.18 -20.03 ULMN 3 1qrz_c13 PLASMINOGEN user 3 3 # 3 B 603 HIS B 176 HIS~? 1000.00 B 646 ASP B 216 ASP~? 1000.00 B 741 SER B 174 SER.? 1000.00 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -43.75 -1.60 -6.12 -44.85 0.33 -5.15 -15.19 48.74 -23.97 -12.89 48.81 -23.13 1qrz_c13 source 1qrz PLASMINOGEN : 3 hits 1qrz_c13 naa= 3 ULMN 3 1qrz_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 176 HIS~? 1000.00 C 646 ASP A 216 ASP.? 1000.00 C 741 SER A 174 SER.? 1000.00 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 4.71 -4.57 4.71 3.58 -6.49 5.69 39.69 47.27 -21.33 40.40 49.18 -20.03 ULMN 3 1qrz_c14 PLASMINOGEN user 2 3 # 2 C 603 HIS A 179 HIS~? 1000.00 C 646 ASP A 216 ASP.? 1000.00 C 741 SER A 174 SER.? 1000.00 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 4.71 -4.57 4.71 3.58 -6.49 5.69 39.69 47.27 -21.33 40.40 49.18 -20.03 ULMN 3 1qrz_c14 PLASMINOGEN user 3 3 # 3 C 603 HIS B 176 HIS~? 1000.00 C 646 ASP B 216 ASP~? 1000.00 C 741 SER B 174 SER.? 1000.00 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 4.71 -4.57 4.71 3.58 -6.49 5.69 -15.19 48.74 -23.97 -12.89 48.81 -23.13 1qrz_c14 source 1qrz PLASMINOGEN : 3 hits 1qrz_c14 naa= 3 ULMN 3 1qrz_c15 PLASMINOGEN user 1 3 # 1 D 603 HIS A 176 HIS~? 1000.00 D 646 ASP A 216 ASP.? 1000.00 D 741 SER A 174 SER.? 1000.00 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 39.69 47.27 -21.33 40.40 49.18 -20.03 ULMN 3 1qrz_c15 PLASMINOGEN user 2 3 # 2 D 603 HIS A 179 HIS~? 1000.00 D 646 ASP A 216 ASP.? 1000.00 D 741 SER A 174 SER.? 1000.00 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 39.69 47.27 -21.33 40.40 49.18 -20.03 ULMN 3 1qrz_c15 PLASMINOGEN user 3 3 # 3 D 603 HIS B 176 HIS~? 1000.00 D 646 ASP B 216 ASP~? 1000.00 D 741 SER B 174 SER.? 1000.00 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 -15.19 48.74 -23.97 -12.89 48.81 -23.13 1qrz_c15 source 1qrz PLASMINOGEN : 3 hits 1qrz_c15 naa= 3 ULMN 3 1qrz_c20 PLASMINOGEN user 1 3 # 1 A 603 HIS A 207 HIS.? 1000.00 A 646 ASP A 216 ASP.? 1000.00 A 739 GLY A 63 GLY~? 1000.00 coo -20.72 2.99 34.37 -21.94 1.82 35.61 47.62 53.84 -26.65 48.80 52.61 -27.88 coo -18.83 7.68 26.86 -20.89 7.78 26.56 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 37.99 58.72 -21.88 37.62 58.91 -21.10 1qrz_c20 source 1qrz PLASMINOGEN : 1 hits 1qrz_c20 naa= 3 ULMN 3 1qrz_c21 PLASMINOGEN user 1 3 # 1 B 603 HIS A 179 HIS~? 1000.00 B 646 ASP A 180 ASP~? 1000.00 B 739 GLY A 87 GLY.? 1000.00 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 28.58 51.63 -18.31 28.23 52.29 -18.68 ULMN 3 1qrz_c21 PLASMINOGEN user 2 3 # 2 B 603 HIS A 207 HIS.? 1000.00 B 646 ASP A 216 ASP.? 1000.00 B 739 GLY A 63 GLY~? 1000.00 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 47.62 53.84 -26.65 48.80 52.61 -27.88 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 37.99 58.72 -21.88 37.62 58.91 -21.10 ULMN 3 1qrz_c21 PLASMINOGEN user 3 3 # 3 B 603 HIS B 179 HIS~? 1000.00 B 646 ASP B 180 ASP~? 1000.00 B 739 GLY B 87 GLY.? 1000.00 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 -11.14 57.34 -16.26 -10.91 58.10 -16.36 1qrz_c21 source 1qrz PLASMINOGEN : 3 hits 1qrz_c21 naa= 3 ULMN 3 1qrz_c22 PLASMINOGEN user 1 3 # 1 C 603 HIS A 179 HIS~? 1000.00 C 646 ASP A 180 ASP~? 1000.00 C 739 GLY A 87 GLY.? 1000.00 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 7.82 1.25 3.03 7.30 1.31 3.65 28.58 51.63 -18.31 28.23 52.29 -18.68 ULMN 3 1qrz_c22 PLASMINOGEN user 2 3 # 2 C 603 HIS A 207 HIS.? 1000.00 C 646 ASP A 216 ASP.? 1000.00 C 739 GLY A 63 GLY~? 1000.00 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 47.62 53.84 -26.65 48.80 52.61 -27.88 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 7.82 1.25 3.03 7.30 1.31 3.65 37.99 58.72 -21.88 37.62 58.91 -21.10 1qrz_c22 source 1qrz PLASMINOGEN : 2 hits 1qrz_c22 naa= 3 ULMN 3 1qrz_c23 PLASMINOGEN user 1 3 # 1 D 603 HIS A 207 HIS.? 1000.00 D 646 ASP A 216 ASP.? 1000.00 D 739 GLY A 63 GLY~? 1000.00 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 47.62 53.84 -26.65 48.80 52.61 -27.88 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -45.82 1.31 41.67 -46.38 1.39 42.31 37.99 58.72 -21.88 37.62 58.91 -21.10 1qrz_c23 source 1qrz PLASMINOGEN : 1 hits 1qrz_c23 naa= 3 ULMN 3 1qz9_c02 KYNURENINASE user 1 3 # 1 A 129 PHE A 219 PHE~? 1000.00 A 201 ASP A 180 ASP~? 1000.00 A 227 LYS A 187 LYS~? 1000.00 coo 23.39 49.81 32.16 21.33 51.68 32.26 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 25.52 45.12 37.98 23.98 46.65 37.85 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 12.68 46.83 36.69 18.26 48.67 34.51 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 1qz9_c02 KYNURENINASE user 2 3 # 2 A 129 PHE B 219 PHE~? 1000.00 A 201 ASP B 180 ASP~? 1000.00 A 227 LYS B 187 LYS~? 1000.00 coo 23.39 49.81 32.16 21.33 51.68 32.26 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 25.52 45.12 37.98 23.98 46.65 37.85 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 12.68 46.83 36.69 18.26 48.67 34.51 -25.11 64.37 -17.06 -29.98 61.05 -17.38 1qz9_c02 source 1qz9 KYNURENINASE : 2 hits 1qz9_c02 naa= 3 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 1 3 # 1 A 10 ASP A 112 ASP~? 1000.00 A 186 ASN A 117 ASN~? 1000.00 A 260 ALA A 90 ALA.? 1000.00 coo 11.81 33.10 11.71 13.07 31.45 11.40 26.00 46.66 -8.90 27.08 46.77 -7.09 coo 11.43 26.53 7.41 13.01 27.56 8.43 22.39 53.94 -4.99 20.71 52.72 -4.52 coo 21.53 26.33 6.96 20.26 25.69 7.52 30.05 57.92 -12.03 31.26 58.74 -11.61 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 2 3 # 2 A 10 ASP A 226 ASP~? 1000.00 A 186 ASN A 224 ASN~? 1000.00 A 260 ALA A 218 ALA~? 1000.00 coo 11.81 33.10 11.71 13.07 31.45 11.40 30.12 41.11 -36.46 28.02 41.19 -36.22 coo 11.43 26.53 7.41 13.01 27.56 8.43 35.03 45.63 -39.37 35.20 47.65 -38.71 coo 21.53 26.33 6.96 20.26 25.69 7.52 40.41 44.46 -31.53 40.92 43.32 -30.64 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 3 3 # 3 A 10 ASP B 112 ASP~? 1000.00 A 186 ASN B 117 ASN~? 1000.00 A 260 ALA B 90 ALA.? 1000.00 coo 11.81 33.10 11.71 13.07 31.45 11.40 -7.51 51.42 -7.29 -5.75 50.19 -7.48 coo 11.43 26.53 7.41 13.01 27.56 8.43 -0.03 56.28 -6.12 -0.62 56.36 -4.07 coo 21.53 26.33 6.96 20.26 25.69 7.52 -2.08 57.50 -16.71 -1.09 56.98 -17.70 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 4 3 # 4 A 10 ASP B 226 ASP~? 1000.00 A 186 ASN B 224 ASN~? 1000.00 A 260 ALA B 218 ALA~? 1000.00 coo 11.81 33.10 11.71 13.07 31.45 11.40 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo 11.43 26.53 7.41 13.01 27.56 8.43 -29.62 59.26 -28.83 -27.87 60.14 -29.67 coo 21.53 26.33 6.96 20.26 25.69 7.52 -24.24 51.06 -28.15 -23.94 49.76 -27.45 1r4f_c00 source 1r4f IAG-NUCLEOSIDE HYDROLASE : 4 hits 1r4f_c00 naa= 3 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 1 3 # 1 A 608 ASP A 216 ASP.? 1000.00 A 610 HIS A 176 HIS~? 1000.00 A 661 HIS A 207 HIS.? 1000.00 coo 75.99 81.56 1.86 73.91 81.34 2.28 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 71.04 78.84 0.46 71.54 76.90 1.02 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 75.40 81.38 12.06 74.88 79.42 12.63 47.62 53.84 -26.65 48.80 52.61 -27.88 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 2 3 # 2 A 608 ASP B 216 ASP~? 1000.00 A 610 HIS B 207 HIS.? 1000.00 A 661 HIS B 176 HIS~? 1000.00 coo 75.99 81.56 1.86 73.91 81.34 2.28 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 71.04 78.84 0.46 71.54 76.90 1.02 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 75.40 81.38 12.06 74.88 79.42 12.63 -21.58 46.84 -24.01 -21.23 47.14 -26.06 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 3 3 # 3 A 608 ASP B 216 ASP~? 1000.00 A 610 HIS B 207 HIS.? 1000.00 A 661 HIS B 179 HIS~? 1000.00 coo 75.99 81.56 1.86 73.91 81.34 2.28 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 71.04 78.84 0.46 71.54 76.90 1.02 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 75.40 81.38 12.06 74.88 79.42 12.63 -21.96 51.60 -22.33 -20.77 50.80 -23.86 1req_c10 source 1req METHYLMALONYL-COA MUTASE : 3 hits 1req_c10 naa= 3 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 1 3 # 1 C 608 ASP A 216 ASP.? 1000.00 C 610 HIS A 176 HIS~? 1000.00 C 661 HIS A 207 HIS.? 1000.00 coo -17.65 80.52 58.00 -16.23 80.79 56.41 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -16.56 83.18 53.03 -16.33 85.18 53.60 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -8.38 80.78 62.24 -7.53 82.67 62.02 47.62 53.84 -26.65 48.80 52.61 -27.88 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 2 3 # 2 C 608 ASP B 216 ASP~? 1000.00 C 610 HIS B 207 HIS.? 1000.00 C 661 HIS B 176 HIS~? 1000.00 coo -17.65 80.52 58.00 -16.23 80.79 56.41 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -16.56 83.18 53.03 -16.33 85.18 53.60 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -8.38 80.78 62.24 -7.53 82.67 62.02 -21.58 46.84 -24.01 -21.23 47.14 -26.06 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 3 3 # 3 C 608 ASP B 216 ASP~? 1000.00 C 610 HIS B 207 HIS.? 1000.00 C 661 HIS B 179 HIS~? 1000.00 coo -17.65 80.52 58.00 -16.23 80.79 56.41 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -16.56 83.18 53.03 -16.33 85.18 53.60 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -8.38 80.78 62.24 -7.53 82.67 62.02 -21.96 51.60 -22.33 -20.77 50.80 -23.86 1req_c11 source 1req METHYLMALONYL-COA MUTASE : 3 hits 1req_c11 naa= 3 ULMN 3 1rgq_c01 NS4A PEPTIDE user 1 3 # 1 B 60 HIS B 207 HIS.? 1000.00 B 84 ASP B 216 ASP~? 1000.00 B 140 GLY B 63 GLY~? 1000.00 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 -7.85 56.57 -27.70 -7.10 56.66 -27.29 ULMN 3 1rgq_c01 NS4A PEPTIDE user 2 3 # 2 B 60 HIS B 258 HIS^? 1000.00 B 84 ASP B 216 ASP~? 1000.00 B 140 GLY B 63 GLY~? 1000.00 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 -7.85 56.57 -27.70 -7.10 56.66 -27.29 1rgq_c01 source 1rgq NS4A PEPTIDE : 2 hits 1rgq_c01 naa= 3 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 # 1 32 ASP A 153 ASP~? 1000.00 35 SER A 154 SER~? 1000.00 215 ASP A 150 ASP.? 1000.00 coo 11.85 17.24 72.81 11.09 15.37 72.36 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 12.20 12.71 75.45 13.69 13.84 74.03 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 5.22 15.03 71.43 7.19 14.88 70.83 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 3 # 2 32 ASP B 153 ASP~? 1000.00 35 SER B 154 SER~? 1000.00 215 ASP B 150 ASP.? 1000.00 coo 11.85 17.24 72.81 11.09 15.37 72.36 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 12.20 12.71 75.45 13.69 13.84 74.03 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 5.22 15.03 71.43 7.19 14.88 70.83 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1rne_c04 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 2 hits 1rne_c04 naa= 3 ULMN 3 1rtf_c03 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 # 1 B 57 HIS A 176 HIS~? 1000.00 B 102 ASP A 216 ASP.? 1000.00 B 195 SER A 174 SER.? 1000.00 coo -4.60 27.52 42.88 -4.63 27.41 40.76 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -0.27 31.24 43.51 -1.49 29.62 42.98 44.82 46.44 -29.25 46.02 48.15 -29.05 coo -2.83 25.96 36.71 -4.77 27.03 37.63 39.69 47.27 -21.33 40.40 49.18 -20.03 1rtf_c03 source 1rtf TWO CHAIN TISSUE PLASMINOGEN ACTIVATOR : 1 hits 1rtf_c03 naa= 3 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 # 1 B 57 HIS B 207 HIS.? 1000.00 B 102 ASP B 216 ASP~? 1000.00 B 193 GLY B 63 GLY~? 1000.00 coo -4.60 27.52 42.88 -4.63 27.41 40.76 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -0.27 31.24 43.51 -1.49 29.62 42.98 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -6.81 22.81 34.74 -6.42 23.54 34.62 -7.85 56.57 -27.70 -7.10 56.66 -27.29 1rtf_c06 source 1rtf TWO CHAIN TISSUE PLASMINOGEN ACTIVATOR : 1 hits 1rtf_c06 naa= 3 ULMN 3 1sca_c00 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 1 3 # 1 32 ASP A 216 ASP.? 1000.00 64 HIS A 176 HIS~? 1000.00 221 SER A 174 SER.? 1000.00 coo 80.16 73.25 62.48 80.01 71.25 61.82 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 78.27 67.69 61.83 79.58 67.76 60.19 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 83.63 66.07 58.16 81.31 66.75 57.98 39.69 47.27 -21.33 40.40 49.18 -20.03 1sca_c00 source 1sca SUBTILISIN CARLSBERG (E.C.3.4.21.62) (AQUEOUS : 1 hits 1sca_c00 naa= 3 ULMN 3 1sca_c01 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 1 3 # 1 32 ASP A 180 ASP~? 1000.00 64 HIS A 179 HIS~? 1000.00 155 ASN A 224 ASN~? 1000.00 coo 80.16 73.25 62.48 80.01 71.25 61.82 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 78.27 67.69 61.83 79.58 67.76 60.19 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 80.34 61.88 52.75 81.25 63.19 54.35 35.03 45.63 -39.37 35.20 47.65 -38.71 ULMN 3 1sca_c01 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 2 3 # 2 32 ASP B 180 ASP~? 1000.00 64 HIS B 179 HIS~? 1000.00 155 ASN B 224 ASN~? 1000.00 coo 80.16 73.25 62.48 80.01 71.25 61.82 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 78.27 67.69 61.83 79.58 67.76 60.19 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 80.34 61.88 52.75 81.25 63.19 54.35 -29.62 59.26 -28.83 -27.87 60.14 -29.67 1sca_c01 source 1sca SUBTILISIN CARLSBERG (E.C.3.4.21.62) (AQUEOUS : 2 hits 1sca_c01 naa= 3 ULMN 3 1sme_c04 PLASMEPSIN II user 1 3 # 1 A 34 ASP A 153 ASP~? 1000.00 A 37 SER A 154 SER~? 1000.00 A 214 ASP A 150 ASP.? 1000.00 coo 51.75 60.57 19.10 52.05 60.90 21.19 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 51.10 65.11 20.73 52.62 63.74 19.42 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 48.59 58.89 25.78 50.13 59.74 24.61 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1sme_c04 PLASMEPSIN II user 2 3 # 2 A 34 ASP B 153 ASP~? 1000.00 A 37 SER B 154 SER~? 1000.00 A 214 ASP B 150 ASP.? 1000.00 coo 51.75 60.57 19.10 52.05 60.90 21.19 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 51.10 65.11 20.73 52.62 63.74 19.42 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 48.59 58.89 25.78 50.13 59.74 24.61 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1sme_c04 source 1sme PLASMEPSIN II : 2 hits 1sme_c04 naa= 3 ULMN 3 1sme_c05 PLASMEPSIN II user 1 3 # 1 B 34 ASP A 153 ASP~? 1000.00 B 37 SER A 154 SER~? 1000.00 B 214 ASP A 150 ASP.? 1000.00 coo 17.69 97.58 52.73 17.33 97.19 54.77 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 20.67 100.44 55.84 20.21 98.51 54.45 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 12.41 98.71 58.47 14.37 98.17 58.05 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1sme_c05 PLASMEPSIN II user 2 3 # 2 B 34 ASP B 153 ASP~? 1000.00 B 37 SER B 154 SER~? 1000.00 B 214 ASP B 150 ASP.? 1000.00 coo 17.69 97.58 52.73 17.33 97.19 54.77 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 20.67 100.44 55.84 20.21 98.51 54.45 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 12.41 98.71 58.47 14.37 98.17 58.05 -20.37 58.06 -6.86 -20.05 56.11 -6.15 1sme_c05 source 1sme PLASMEPSIN II : 2 hits 1sme_c05 naa= 3 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 1 3 # 1 B 8 HIS A 126 HIS.? 1000.00 B 80 GLU A 125 GLU~? 1000.00 B 223 ARG B 65 ARG~? 1000.00 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 25.67 67.75 -11.18 27.28 67.54 -9.86 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 23.57 65.98 -5.71 25.38 66.11 -4.60 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 -0.40 56.71 -28.30 2.57 57.06 -27.54 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 2 3 # 2 B 8 HIS A 126 HIS.? 1000.00 B 80 GLU A 125 GLU~? 1000.00 B 223 ARG B 138 ARG.? 1000.00 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 25.67 67.75 -11.18 27.28 67.54 -9.86 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 23.57 65.98 -5.71 25.38 66.11 -4.60 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 -3.35 82.04 -12.94 -4.36 84.97 -13.00 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 3 3 # 3 B 8 HIS B 126 HIS.? 1000.00 B 80 GLU B 125 GLU~? 1000.00 B 223 ARG A 263 ARG^? 1000.00 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 4.52 66.06 -17.34 5.49 64.29 -17.91 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 7.31 63.46 -12.63 8.49 61.96 -13.60 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 27.84 56.47 -39.37 28.80 55.40 -42.11 1t0u_c01 source 1t0u URIDINE PHOSPHORYLASE : 3 hits 1t0u_c01 naa= 3 ULMN 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 1 3 # 1 A 261 GLY A 160 GLY~? 1000.00 B 17 GLN B 46 GLN^? 1000.00 B 140 GLU B 31 GLU^? 1000.00 coo 61.49 19.86 5.96 61.52 19.46 5.16 9.71 54.06 -23.36 10.52 53.97 -23.51 coo 63.76 11.90 7.93 65.18 13.07 6.77 8.63 61.19 -19.87 10.65 60.72 -20.32 coo 66.44 19.00 7.38 67.69 17.67 8.37 3.53 53.86 -23.14 1.51 53.38 -23.51 ULMN 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 2 3 # 2 A 261 GLY A 160 GLY~? 1000.00 B 17 GLN B 48 GLN^? 1000.00 B 140 GLU B 31 GLU^? 1000.00 coo 61.49 19.86 5.96 61.52 19.46 5.16 9.71 54.06 -23.36 10.52 53.97 -23.51 coo 63.76 11.90 7.93 65.18 13.07 6.77 6.00 56.24 -14.63 6.93 56.05 -12.74 coo 66.44 19.00 7.38 67.69 17.67 8.37 3.53 53.86 -23.14 1.51 53.38 -23.51 1t4c_c02 source 1t4c FORMYL-COENZYME A TRANSFERASE : 2 hits 1t4c_c02 naa= 3 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 # 1 A 250 ALA A 64 ALA~? 1000.00 A 251 GLY A 63 GLY~? 1000.00 A 252 ASP A 171 ASP.? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 # 2 A 250 ALA A 79 ALA.? 1000.00 A 251 GLY A 80 GLY.? 1000.00 A 252 ASP A 103 ASP.? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 21.28 68.36 -28.97 21.60 69.72 -29.60 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 3 3 # 3 A 250 ALA A 88 ALA.? 1000.00 A 251 GLY A 87 GLY.? 1000.00 A 252 ASP A 109 ASP^? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 28.58 51.63 -18.31 28.23 52.29 -18.68 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 4 3 # 4 A 250 ALA A 88 ALA.? 1000.00 A 251 GLY A 89 GLY.? 1000.00 A 252 ASP A 109 ASP^? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 30.13 54.80 -14.22 29.42 55.21 -14.27 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 5 3 # 5 A 250 ALA A 102 ALA.? 1000.00 A 251 GLY A 80 GLY.? 1000.00 A 252 ASP A 103 ASP.? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 19.40 65.92 -25.18 20.15 64.73 -24.61 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 6 3 # 6 A 250 ALA A 170 ALA^? 1000.00 A 251 GLY A 63 GLY~? 1000.00 A 252 ASP A 171 ASP.? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 7 3 # 7 A 250 ALA A 225 ALA~? 1000.00 A 251 GLY A 227 GLY.? 1000.00 A 252 ASP A 226 ASP~? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 34.22 41.09 -39.00 35.05 40.23 -38.05 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 29.43 42.95 -40.95 28.91 42.83 -40.42 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 8 3 # 8 A 250 ALA A 228 ALA.? 1000.00 A 251 GLY A 227 GLY.? 1000.00 A 252 ASP A 226 ASP~? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 26.27 44.52 -39.48 25.47 43.94 -38.32 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 29.43 42.95 -40.95 28.91 42.83 -40.42 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 9 3 # 9 A 250 ALA B 64 ALA~? 1000.00 A 251 GLY B 63 GLY~? 1000.00 A 252 ASP B 171 ASP.? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 10 3 # 10 A 250 ALA B 79 ALA.? 1000.00 A 251 GLY B 80 GLY.? 1000.00 A 252 ASP B 103 ASP.? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 -7.99 76.77 -23.60 -7.43 77.49 -24.80 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 11 3 # 11 A 250 ALA B 88 ALA.? 1000.00 A 251 GLY B 87 GLY.? 1000.00 A 252 ASP B 109 ASP^? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -11.14 57.34 -16.26 -10.91 58.10 -16.36 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -8.78 56.88 -12.11 -8.97 55.48 -13.69 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 12 3 # 12 A 250 ALA B 88 ALA.? 1000.00 A 251 GLY B 89 GLY.? 1000.00 A 252 ASP B 109 ASP^? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -5.69 56.38 -16.53 -5.55 57.13 -16.19 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -8.78 56.88 -12.11 -8.97 55.48 -13.69 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 13 3 # 13 A 250 ALA B 102 ALA.? 1000.00 A 251 GLY B 80 GLY.? 1000.00 A 252 ASP B 103 ASP.? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 -7.18 75.09 -19.42 -7.62 73.69 -19.16 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 14 3 # 14 A 250 ALA B 170 ALA^? 1000.00 A 251 GLY B 63 GLY~? 1000.00 A 252 ASP B 171 ASP.? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 15 3 # 15 A 250 ALA B 228 ALA.? 1000.00 A 251 GLY B 227 GLY.? 1000.00 A 252 ASP B 226 ASP~? 1000.00 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 -30.92 64.76 -21.90 -30.51 64.62 -20.43 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -33.34 62.44 -23.64 -32.68 62.31 -23.22 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1tz3_c02 source 1tz3 PUTATIVE SUGAR KINASE : 15 hits 1tz3_c02 naa= 3 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 # 1 B 250 ALA A 64 ALA~? 1000.00 B 251 GLY A 63 GLY~? 1000.00 B 252 ASP A 171 ASP.? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 # 2 B 250 ALA A 79 ALA.? 1000.00 B 251 GLY A 80 GLY.? 1000.00 B 252 ASP A 103 ASP.? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 21.28 68.36 -28.97 21.60 69.72 -29.60 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 3 3 # 3 B 250 ALA A 88 ALA.? 1000.00 B 251 GLY A 87 GLY.? 1000.00 B 252 ASP A 109 ASP^? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 28.58 51.63 -18.31 28.23 52.29 -18.68 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 4 3 # 4 B 250 ALA A 88 ALA.? 1000.00 B 251 GLY A 89 GLY.? 1000.00 B 252 ASP A 109 ASP^? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 27.83 55.23 -17.25 26.42 55.77 -17.00 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 30.13 54.80 -14.22 29.42 55.21 -14.27 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 5 3 # 5 B 250 ALA A 102 ALA.? 1000.00 B 251 GLY A 80 GLY.? 1000.00 B 252 ASP A 103 ASP.? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 19.40 65.92 -25.18 20.15 64.73 -24.61 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 14.64 65.30 -26.26 14.43 63.48 -27.31 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 6 3 # 6 B 250 ALA A 170 ALA^? 1000.00 B 251 GLY A 63 GLY~? 1000.00 B 252 ASP A 171 ASP.? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 37.99 58.72 -21.88 37.62 58.91 -21.10 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 36.72 54.39 -20.35 38.41 55.64 -20.64 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 7 3 # 7 B 250 ALA A 225 ALA~? 1000.00 B 251 GLY A 227 GLY.? 1000.00 B 252 ASP A 226 ASP~? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 34.22 41.09 -39.00 35.05 40.23 -38.05 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 29.43 42.95 -40.95 28.91 42.83 -40.42 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 8 3 # 8 B 250 ALA A 228 ALA.? 1000.00 B 251 GLY A 227 GLY.? 1000.00 B 252 ASP A 226 ASP~? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 26.27 44.52 -39.48 25.47 43.94 -38.32 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 29.43 42.95 -40.95 28.91 42.83 -40.42 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 9 3 # 9 B 250 ALA B 64 ALA~? 1000.00 B 251 GLY B 63 GLY~? 1000.00 B 252 ASP B 171 ASP.? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 10 3 # 10 B 250 ALA B 79 ALA.? 1000.00 B 251 GLY B 80 GLY.? 1000.00 B 252 ASP B 103 ASP.? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 -7.99 76.77 -23.60 -7.43 77.49 -24.80 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 11 3 # 11 B 250 ALA B 88 ALA.? 1000.00 B 251 GLY B 87 GLY.? 1000.00 B 252 ASP B 109 ASP^? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -11.14 57.34 -16.26 -10.91 58.10 -16.36 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -8.78 56.88 -12.11 -8.97 55.48 -13.69 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 12 3 # 12 B 250 ALA B 88 ALA.? 1000.00 B 251 GLY B 89 GLY.? 1000.00 B 252 ASP B 109 ASP^? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 -7.97 59.44 -16.59 -7.58 60.57 -15.65 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -5.69 56.38 -16.53 -5.55 57.13 -16.19 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -8.78 56.88 -12.11 -8.97 55.48 -13.69 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 13 3 # 13 B 250 ALA B 102 ALA.? 1000.00 B 251 GLY B 80 GLY.? 1000.00 B 252 ASP B 103 ASP.? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 -7.18 75.09 -19.42 -7.62 73.69 -19.16 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -9.47 78.99 -20.87 -9.64 78.20 -20.93 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -8.55 78.62 -16.37 -10.58 78.38 -15.81 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 14 3 # 14 B 250 ALA B 170 ALA^? 1000.00 B 251 GLY B 63 GLY~? 1000.00 B 252 ASP B 171 ASP.? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -7.85 56.57 -27.70 -7.10 56.66 -27.29 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -10.01 54.17 -24.64 -9.83 53.41 -26.64 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 15 3 # 15 B 250 ALA B 228 ALA.? 1000.00 B 251 GLY B 227 GLY.? 1000.00 B 252 ASP B 226 ASP~? 1000.00 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 -30.92 64.76 -21.90 -30.51 64.62 -20.43 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -33.34 62.44 -23.64 -32.68 62.31 -23.22 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -31.03 58.88 -21.73 -30.98 60.38 -20.22 1tz3_c03 source 1tz3 PUTATIVE SUGAR KINASE : 15 hits 1tz3_c03 naa= 3 ULMN 3 1uaq_c00 CYTOSINE DEAMINASE user 1 3 # 1 A 64 GLU B 85 GLU^? 1000.00 A 89 SER B 94 SER~? 1000.00 A 91 CYH B 84 CYH^? 1000.00 coo -18.27 -3.12 10.92 -16.30 -3.26 10.07 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo -16.83 -3.83 3.62 -17.28 -5.61 2.05 -5.28 65.60 -18.44 -6.81 64.67 -16.85 coo -13.84 -8.33 7.58 -13.00 -8.13 10.24 -12.63 67.19 -16.08 -14.23 65.55 -14.52 1uaq_c00 source 1uaq CYTOSINE DEAMINASE : 1 hits 1uaq_c00 naa= 3 ULMN 3 1uaq_c01 CYTOSINE DEAMINASE user 1 3 # 1 B 64 GLU B 85 GLU^? 1000.00 B 89 SER B 94 SER~? 1000.00 B 91 CYH B 84 CYH^? 1000.00 coo -13.67 -17.67 21.70 -15.74 -17.78 22.24 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo -17.71 -23.81 20.93 -18.57 -24.92 18.94 -5.28 65.60 -18.44 -6.81 64.67 -16.85 coo -20.38 -18.31 18.13 -20.06 -15.64 18.96 -12.63 67.19 -16.08 -14.23 65.55 -14.52 1uaq_c01 source 1uaq CYTOSINE DEAMINASE : 1 hits 1uaq_c01 naa= 3 ULMN 3 1uk7_c00 3.07.01.0009 user 1 3 # 1 A 103 ALA A 218 ALA~? 1000.00 A 224 ASP A 180 ASP~? 1000.00 A 252 HIS A 179 HIS~? 1000.00 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 40.41 44.46 -31.53 40.92 43.32 -30.64 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 36.05 43.80 -26.83 37.70 44.95 -26.27 ULMN 3 1uk7_c00 3.07.01.0009 user 2 3 # 2 A 103 ALA B 218 ALA~? 1000.00 A 224 ASP B 180 ASP~? 1000.00 A 252 HIS B 179 HIS~? 1000.00 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 -24.24 51.06 -28.15 -23.94 49.76 -27.45 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 -21.96 51.60 -22.33 -20.77 50.80 -23.86 1uk7_c00 source 1uk7 3.07.01.0009 : 2 hits 1uk7_c00 naa= 3 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 150 ASP.? 1000.00 218 GLU B 120 GLU~? 1000.00 329 ASP A 153 ASP~? 1000.00 coo 49.16 35.16 15.19 51.08 34.43 15.65 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 70.09 11.71 8.46 70.56 12.89 6.77 -1.89 62.61 -7.03 -2.47 61.78 -5.12 coo 59.16 37.82 13.95 57.63 37.03 15.12 12.44 43.33 -23.10 12.35 42.31 -24.93 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 153 ASP~? 1000.00 218 GLU A 125 GLU~? 1000.00 329 ASP A 150 ASP.? 1000.00 coo 49.16 35.16 15.19 51.08 34.43 15.65 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 70.09 11.71 8.46 70.56 12.89 6.77 23.57 65.98 -5.71 25.38 66.11 -4.60 coo 59.16 37.82 13.95 57.63 37.03 15.12 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP A 180 ASP~? 1000.00 218 GLU A 76 GLU~? 1000.00 329 ASP A 226 ASP~? 1000.00 coo 49.16 35.16 15.19 51.08 34.43 15.65 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 70.09 11.71 8.46 70.56 12.89 6.77 26.44 70.16 -33.87 28.34 70.73 -33.08 coo 59.16 37.82 13.95 57.63 37.03 15.12 30.12 41.11 -36.46 28.02 41.19 -36.22 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP B 153 ASP~? 1000.00 218 GLU B 31 GLU^? 1000.00 329 ASP B 150 ASP.? 1000.00 coo 49.16 35.16 15.19 51.08 34.43 15.65 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 70.09 11.71 8.46 70.56 12.89 6.77 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 59.16 37.82 13.95 57.63 37.03 15.12 -20.37 58.06 -6.86 -20.05 56.11 -6.15 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 5 3 # 5 199 ASP B 180 ASP~? 1000.00 218 GLU B 76 GLU~? 1000.00 329 ASP B 226 ASP~? 1000.00 coo 49.16 35.16 15.19 51.08 34.43 15.65 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 70.09 11.71 8.46 70.56 12.89 6.77 -8.83 77.04 -30.71 -8.86 75.29 -31.91 coo 59.16 37.82 13.95 57.63 37.03 15.12 -31.03 58.88 -21.73 -30.98 60.38 -20.22 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 6 3 # 6 199 ASP B 226 ASP~? 1000.00 218 GLU B 120 GLU~? 1000.00 329 ASP B 180 ASP~? 1000.00 coo 49.16 35.16 15.19 51.08 34.43 15.65 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo 70.09 11.71 8.46 70.56 12.89 6.77 -1.89 62.61 -7.03 -2.47 61.78 -5.12 coo 59.16 37.82 13.95 57.63 37.03 15.12 -26.29 53.00 -17.37 -27.58 54.12 -16.14 1uok_c04 source 1uok OLIGO-1,6-GLUCOSIDASE : 6 hits 1uok_c04 naa= 3 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 1 3 # 1 A 581 GLU A 232 GLU^? 1000.00 A 596 ARG A 263 ARG^? 1000.00 A 647 ARG A 265 ARG.? 1000.00 coo 69.13 32.20 28.58 68.39 32.96 30.44 33.90 53.97 -40.27 31.97 54.88 -40.30 coo 70.89 37.31 29.70 69.54 36.29 32.39 27.84 56.47 -39.37 28.80 55.40 -42.11 coo 66.09 40.54 34.70 66.92 37.69 35.49 24.20 53.21 -44.49 22.10 54.73 -46.19 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 2 3 # 2 A 581 GLU B 31 GLU^? 1000.00 A 596 ARG B 29 ARG.? 1000.00 A 647 ARG A 157 ARG~? 1000.00 coo 69.13 32.20 28.58 68.39 32.96 30.44 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 70.89 37.31 29.70 69.54 36.29 32.39 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 66.09 40.54 34.70 66.92 37.69 35.49 8.37 47.22 -17.87 10.68 45.40 -16.87 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 3 3 # 3 A 581 GLU B 214 GLU~? 1000.00 A 596 ARG B 215 ARG~? 1000.00 A 647 ARG B 209 ARG.? 1000.00 coo 69.13 32.20 28.58 68.39 32.96 30.44 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 70.89 37.31 29.70 69.54 36.29 32.39 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 66.09 40.54 34.70 66.92 37.69 35.49 -14.48 44.51 -35.31 -16.23 42.88 -33.39 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 4 3 # 4 A 581 GLU B 232 GLU^? 1000.00 A 596 ARG B 263 ARG^? 1000.00 A 647 ARG B 265 ARG.? 1000.00 coo 69.13 32.20 28.58 68.39 32.96 30.44 -23.91 65.19 -31.75 -23.94 67.24 -32.30 coo 70.89 37.31 29.70 69.54 36.29 32.39 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo 66.09 40.54 34.70 66.92 37.69 35.49 -32.45 71.36 -26.68 -29.93 72.96 -27.59 1v0e_c00 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c00 naa= 3 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 1 3 # 1 B 581 GLU A 232 GLU^? 1000.00 B 596 ARG A 263 ARG^? 1000.00 B 647 ARG A 265 ARG.? 1000.00 coo 38.22 57.83 70.36 36.82 56.74 69.18 33.90 53.97 -40.27 31.97 54.88 -40.30 coo 34.24 60.89 68.08 33.31 57.93 67.63 27.84 56.47 -39.37 28.80 55.40 -42.11 coo 31.43 57.38 61.97 31.90 55.58 64.41 24.20 53.21 -44.49 22.10 54.73 -46.19 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 2 3 # 2 B 581 GLU B 31 GLU^? 1000.00 B 596 ARG B 29 ARG.? 1000.00 B 647 ARG A 157 ARG~? 1000.00 coo 38.22 57.83 70.36 36.82 56.74 69.18 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 34.24 60.89 68.08 33.31 57.93 67.63 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 31.43 57.38 61.97 31.90 55.58 64.41 8.37 47.22 -17.87 10.68 45.40 -16.87 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 3 3 # 3 B 581 GLU B 214 GLU~? 1000.00 B 596 ARG B 215 ARG~? 1000.00 B 647 ARG B 209 ARG.? 1000.00 coo 38.22 57.83 70.36 36.82 56.74 69.18 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 34.24 60.89 68.08 33.31 57.93 67.63 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 31.43 57.38 61.97 31.90 55.58 64.41 -14.48 44.51 -35.31 -16.23 42.88 -33.39 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 4 3 # 4 B 581 GLU B 232 GLU^? 1000.00 B 596 ARG B 263 ARG^? 1000.00 B 647 ARG B 265 ARG.? 1000.00 coo 38.22 57.83 70.36 36.82 56.74 69.18 -23.91 65.19 -31.75 -23.94 67.24 -32.30 coo 34.24 60.89 68.08 33.31 57.93 67.63 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo 31.43 57.38 61.97 31.90 55.58 64.41 -32.45 71.36 -26.68 -29.93 72.96 -27.59 1v0e_c01 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c01 naa= 3 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 1 3 # 1 C 581 GLU A 232 GLU^? 1000.00 C 596 ARG A 263 ARG^? 1000.00 C 647 ARG A 265 ARG.? 1000.00 coo 11.31 31.26 27.00 13.31 30.71 26.58 33.90 53.97 -40.27 31.97 54.88 -40.30 coo 13.44 32.78 22.07 15.56 30.91 23.37 27.84 56.47 -39.37 28.80 55.40 -42.11 coo 21.00 33.35 22.82 19.83 30.82 24.09 24.20 53.21 -44.49 22.10 54.73 -46.19 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 2 3 # 2 C 581 GLU B 31 GLU^? 1000.00 C 596 ARG B 29 ARG.? 1000.00 C 647 ARG A 157 ARG~? 1000.00 coo 11.31 31.26 27.00 13.31 30.71 26.58 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 13.44 32.78 22.07 15.56 30.91 23.37 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 21.00 33.35 22.82 19.83 30.82 24.09 8.37 47.22 -17.87 10.68 45.40 -16.87 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 3 3 # 3 C 581 GLU B 214 GLU~? 1000.00 C 596 ARG B 215 ARG~? 1000.00 C 647 ARG B 209 ARG.? 1000.00 coo 11.31 31.26 27.00 13.31 30.71 26.58 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 13.44 32.78 22.07 15.56 30.91 23.37 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 21.00 33.35 22.82 19.83 30.82 24.09 -14.48 44.51 -35.31 -16.23 42.88 -33.39 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 4 3 # 4 C 581 GLU B 232 GLU^? 1000.00 C 596 ARG B 263 ARG^? 1000.00 C 647 ARG B 265 ARG.? 1000.00 coo 11.31 31.26 27.00 13.31 30.71 26.58 -23.91 65.19 -31.75 -23.94 67.24 -32.30 coo 13.44 32.78 22.07 15.56 30.91 23.37 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo 21.00 33.35 22.82 19.83 30.82 24.09 -32.45 71.36 -26.68 -29.93 72.96 -27.59 1v0e_c02 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c02 naa= 3 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 1 3 # 1 D 581 GLU A 232 GLU^? 1000.00 D 596 ARG A 263 ARG^? 1000.00 D 647 ARG A 265 ARG.? 1000.00 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 33.90 53.97 -40.27 31.97 54.88 -40.30 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 27.84 56.47 -39.37 28.80 55.40 -42.11 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 24.20 53.21 -44.49 22.10 54.73 -46.19 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 2 3 # 2 D 581 GLU B 31 GLU^? 1000.00 D 596 ARG B 29 ARG.? 1000.00 D 647 ARG A 157 ARG~? 1000.00 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 3.53 53.86 -23.14 1.51 53.38 -23.51 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 4.10 49.74 -21.56 2.98 48.55 -24.19 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 8.37 47.22 -17.87 10.68 45.40 -16.87 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 3 3 # 3 D 581 GLU B 214 GLU~? 1000.00 D 596 ARG B 215 ARG~? 1000.00 D 647 ARG B 209 ARG.? 1000.00 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 -14.48 44.51 -35.31 -16.23 42.88 -33.39 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 4 3 # 4 D 581 GLU B 232 GLU^? 1000.00 D 596 ARG B 263 ARG^? 1000.00 D 647 ARG B 265 ARG.? 1000.00 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 -23.91 65.19 -31.75 -23.94 67.24 -32.30 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 -32.45 71.36 -26.68 -29.93 72.96 -27.59 1v0e_c03 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c03 naa= 3 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 1 3 # 1 E 581 GLU A 232 GLU^? 1000.00 E 596 ARG A 263 ARG^? 1000.00 E 647 ARG A 265 ARG.? 1000.00 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 33.90 53.97 -40.27 31.97 54.88 -40.30 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 27.84 56.47 -39.37 28.80 55.40 -42.11 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 24.20 53.21 -44.49 22.10 54.73 -46.19 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 2 3 # 2 E 581 GLU B 31 GLU^? 1000.00 E 596 ARG B 29 ARG.? 1000.00 E 647 ARG A 157 ARG~? 1000.00 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 4.10 49.74 -21.56 2.98 48.55 -24.19 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 8.37 47.22 -17.87 10.68 45.40 -16.87 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 3 3 # 3 E 581 GLU B 214 GLU~? 1000.00 E 596 ARG B 215 ARG~? 1000.00 E 647 ARG B 209 ARG.? 1000.00 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 -14.48 44.51 -35.31 -16.23 42.88 -33.39 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 4 3 # 4 E 581 GLU B 232 GLU^? 1000.00 E 596 ARG B 263 ARG^? 1000.00 E 647 ARG B 265 ARG.? 1000.00 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 -23.91 65.19 -31.75 -23.94 67.24 -32.30 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 -32.45 71.36 -26.68 -29.93 72.96 -27.59 1v0e_c04 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c04 naa= 3 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 1 3 # 1 F 581 GLU A 232 GLU^? 1000.00 F 596 ARG A 263 ARG^? 1000.00 F 647 ARG A 265 ARG.? 1000.00 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 33.90 53.97 -40.27 31.97 54.88 -40.30 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 27.84 56.47 -39.37 28.80 55.40 -42.11 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 24.20 53.21 -44.49 22.10 54.73 -46.19 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 2 3 # 2 F 581 GLU B 31 GLU^? 1000.00 F 596 ARG B 29 ARG.? 1000.00 F 647 ARG A 157 ARG~? 1000.00 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 3.53 53.86 -23.14 1.51 53.38 -23.51 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 4.10 49.74 -21.56 2.98 48.55 -24.19 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 8.37 47.22 -17.87 10.68 45.40 -16.87 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 3 3 # 3 F 581 GLU B 214 GLU~? 1000.00 F 596 ARG B 215 ARG~? 1000.00 F 647 ARG B 209 ARG.? 1000.00 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 -26.47 46.70 -32.43 -28.19 45.50 -32.60 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 -14.48 44.51 -35.31 -16.23 42.88 -33.39 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 4 3 # 4 F 581 GLU B 232 GLU^? 1000.00 F 596 ARG B 263 ARG^? 1000.00 F 647 ARG B 265 ARG.? 1000.00 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 -23.91 65.19 -31.75 -23.94 67.24 -32.30 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 -23.50 69.78 -28.71 -26.08 70.11 -30.40 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 -32.45 71.36 -26.68 -29.93 72.96 -27.59 1v0e_c05 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c05 naa= 3 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 146 TYR.? 1000.00 A 40 ASP A 153 ASP~? 1000.00 A 103 LEU A 155 LEU~? 1000.00 coo 12.09 16.13 10.57 11.28 18.80 10.73 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 7.55 25.51 14.34 9.65 25.73 14.24 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 11.83 18.73 16.99 10.99 19.71 15.26 16.57 48.99 -21.16 17.91 50.54 -21.89 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR B 146 TYR.? 1000.00 A 40 ASP B 153 ASP~? 1000.00 A 103 LEU B 155 LEU~? 1000.00 coo 12.09 16.13 10.57 11.28 18.80 10.73 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 7.55 25.51 14.34 9.65 25.73 14.24 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 11.83 18.73 16.99 10.99 19.71 15.26 -15.71 66.22 -7.97 -15.54 64.63 -9.36 1vzz_c00 source 1vzz STEROID DELTA-ISOMERASE : 2 hits 1vzz_c00 naa= 3 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 146 TYR.? 1000.00 B 40 ASP A 153 ASP~? 1000.00 B 103 LEU A 155 LEU~? 1000.00 coo 14.25 20.09 37.35 13.48 17.40 37.38 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 9.39 10.77 34.53 11.50 10.63 34.41 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 12.89 17.60 31.13 12.34 16.51 32.90 16.57 48.99 -21.16 17.91 50.54 -21.89 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR B 146 TYR.? 1000.00 B 40 ASP B 153 ASP~? 1000.00 B 103 LEU B 155 LEU~? 1000.00 coo 14.25 20.09 37.35 13.48 17.40 37.38 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 9.39 10.77 34.53 11.50 10.63 34.41 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 12.89 17.60 31.13 12.34 16.51 32.90 -15.71 66.22 -7.97 -15.54 64.63 -9.36 1vzz_c01 source 1vzz STEROID DELTA-ISOMERASE : 2 hits 1vzz_c01 naa= 3 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 1 3 # 1 A 105 HIS B 208 HIS.? 1000.00 A 169 ASP B 216 ASP~? 1000.00 A 288 GLU B 214 GLU~? 1000.00 coo 67.72 35.99 30.87 69.77 36.13 31.33 -8.88 46.79 -32.39 -7.82 47.59 -30.76 coo 73.17 30.66 22.56 72.87 30.30 20.46 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 74.06 28.51 15.92 73.77 29.56 17.73 -26.47 46.70 -32.43 -28.19 45.50 -32.60 1w1o_c00 source 1w1o CYTOKININ DEHYDROGENASE 1 : 1 hits 1w1o_c00 naa= 3 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 183 GLY A 80 GLY.? 1000.00 B 419 GLY A 101 GLY.? 1000.00 B 420 ALA A 100 ALA~? 1000.00 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 17.64 67.16 -29.06 18.28 66.65 -29.06 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 20.03 69.55 -24.30 20.49 68.90 -24.43 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 23.81 69.79 -23.73 24.77 68.86 -24.42 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 # 2 A 183 GLY A 87 GLY.? 1000.00 B 419 GLY A 89 GLY.? 1000.00 B 420 ALA A 90 ALA.? 1000.00 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 28.58 51.63 -18.31 28.23 52.29 -18.68 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 30.13 54.80 -14.22 29.42 55.21 -14.27 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 30.05 57.92 -12.03 31.26 58.74 -11.61 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 # 3 A 183 GLY B 87 GLY.? 1000.00 B 419 GLY B 89 GLY.? 1000.00 B 420 ALA B 90 ALA.? 1000.00 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 -11.14 57.34 -16.26 -10.91 58.10 -16.36 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 -5.69 56.38 -16.53 -5.55 57.13 -16.19 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 -2.08 57.50 -16.71 -1.09 56.98 -17.70 1xny_c00 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 3 hits 1xny_c00 naa= 3 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 420 ALA A 64 ALA~? 1000.00 B 182 GLY A 87 GLY.? 1000.00 B 183 GLY A 89 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 41.93-102.35-126.87 41.52-101.89-126.30 28.58 51.63 -18.31 28.23 52.29 -18.68 coo 38.37-101.99-128.11 38.63-102.24-127.37 30.13 54.80 -14.22 29.42 55.21 -14.27 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 # 2 A 420 ALA A 64 ALA~? 1000.00 B 182 GLY A 89 GLY.? 1000.00 B 183 GLY A 91 GLY~? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 41.93-102.35-126.87 41.52-101.89-126.30 30.13 54.80 -14.22 29.42 55.21 -14.27 coo 38.37-101.99-128.11 38.63-102.24-127.37 27.73 59.56 -14.59 28.47 59.85 -14.62 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 # 3 A 420 ALA A 64 ALA~? 1000.00 B 182 GLY A 91 GLY~? 1000.00 B 183 GLY A 89 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 41.93-102.35-126.87 41.52-101.89-126.30 27.73 59.56 -14.59 28.47 59.85 -14.62 coo 38.37-101.99-128.11 38.63-102.24-127.37 30.13 54.80 -14.22 29.42 55.21 -14.27 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 # 4 A 420 ALA A 107 ALA^? 1000.00 B 182 GLY A 87 GLY.? 1000.00 B 183 GLY A 89 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 22.32 56.29 -18.23 22.88 57.25 -17.21 coo 41.93-102.35-126.87 41.52-101.89-126.30 28.58 51.63 -18.31 28.23 52.29 -18.68 coo 38.37-101.99-128.11 38.63-102.24-127.37 30.13 54.80 -14.22 29.42 55.21 -14.27 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 5 3 # 5 A 420 ALA A 107 ALA^? 1000.00 B 182 GLY A 89 GLY.? 1000.00 B 183 GLY A 87 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 22.32 56.29 -18.23 22.88 57.25 -17.21 coo 41.93-102.35-126.87 41.52-101.89-126.30 30.13 54.80 -14.22 29.42 55.21 -14.27 coo 38.37-101.99-128.11 38.63-102.24-127.37 28.58 51.63 -18.31 28.23 52.29 -18.68 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 6 3 # 6 A 420 ALA A 107 ALA^? 1000.00 B 182 GLY A 89 GLY.? 1000.00 B 183 GLY A 91 GLY~? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 22.32 56.29 -18.23 22.88 57.25 -17.21 coo 41.93-102.35-126.87 41.52-101.89-126.30 30.13 54.80 -14.22 29.42 55.21 -14.27 coo 38.37-101.99-128.11 38.63-102.24-127.37 27.73 59.56 -14.59 28.47 59.85 -14.62 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 7 3 # 7 A 420 ALA A 170 ALA^? 1000.00 B 182 GLY A 87 GLY.? 1000.00 B 183 GLY A 89 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 41.93-102.35-126.87 41.52-101.89-126.30 28.58 51.63 -18.31 28.23 52.29 -18.68 coo 38.37-101.99-128.11 38.63-102.24-127.37 30.13 54.80 -14.22 29.42 55.21 -14.27 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 8 3 # 8 A 420 ALA A 170 ALA^? 1000.00 B 182 GLY A 89 GLY.? 1000.00 B 183 GLY A 87 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 41.93-102.35-126.87 41.52-101.89-126.30 30.13 54.80 -14.22 29.42 55.21 -14.27 coo 38.37-101.99-128.11 38.63-102.24-127.37 28.58 51.63 -18.31 28.23 52.29 -18.68 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 9 3 # 9 A 420 ALA A 170 ALA^? 1000.00 B 182 GLY A 91 GLY~? 1000.00 B 183 GLY A 89 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 41.93-102.35-126.87 41.52-101.89-126.30 27.73 59.56 -14.59 28.47 59.85 -14.62 coo 38.37-101.99-128.11 38.63-102.24-127.37 30.13 54.80 -14.22 29.42 55.21 -14.27 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 10 3 # 10 A 420 ALA B 64 ALA~? 1000.00 B 182 GLY B 87 GLY.? 1000.00 B 183 GLY B 89 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 41.93-102.35-126.87 41.52-101.89-126.30 -11.14 57.34 -16.26 -10.91 58.10 -16.36 coo 38.37-101.99-128.11 38.63-102.24-127.37 -5.69 56.38 -16.53 -5.55 57.13 -16.19 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 11 3 # 11 A 420 ALA B 64 ALA~? 1000.00 B 182 GLY B 89 GLY.? 1000.00 B 183 GLY B 91 GLY~? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 41.93-102.35-126.87 41.52-101.89-126.30 -5.69 56.38 -16.53 -5.55 57.13 -16.19 coo 38.37-101.99-128.11 38.63-102.24-127.37 -3.32 61.09 -17.15 -2.94 60.75 -17.73 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 12 3 # 12 A 420 ALA B 64 ALA~? 1000.00 B 182 GLY B 91 GLY~? 1000.00 B 183 GLY B 89 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 41.93-102.35-126.87 41.52-101.89-126.30 -3.32 61.09 -17.15 -2.94 60.75 -17.73 coo 38.37-101.99-128.11 38.63-102.24-127.37 -5.69 56.38 -16.53 -5.55 57.13 -16.19 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 13 3 # 13 A 420 ALA B 107 ALA^? 1000.00 B 182 GLY B 87 GLY.? 1000.00 B 183 GLY B 89 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 -8.23 64.09 -13.37 -6.76 63.74 -13.61 coo 41.93-102.35-126.87 41.52-101.89-126.30 -11.14 57.34 -16.26 -10.91 58.10 -16.36 coo 38.37-101.99-128.11 38.63-102.24-127.37 -5.69 56.38 -16.53 -5.55 57.13 -16.19 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 14 3 # 14 A 420 ALA B 107 ALA^? 1000.00 B 182 GLY B 89 GLY.? 1000.00 B 183 GLY B 87 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 -8.23 64.09 -13.37 -6.76 63.74 -13.61 coo 41.93-102.35-126.87 41.52-101.89-126.30 -5.69 56.38 -16.53 -5.55 57.13 -16.19 coo 38.37-101.99-128.11 38.63-102.24-127.37 -11.14 57.34 -16.26 -10.91 58.10 -16.36 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 15 3 # 15 A 420 ALA B 107 ALA^? 1000.00 B 182 GLY B 89 GLY.? 1000.00 B 183 GLY B 91 GLY~? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 -8.23 64.09 -13.37 -6.76 63.74 -13.61 coo 41.93-102.35-126.87 41.52-101.89-126.30 -5.69 56.38 -16.53 -5.55 57.13 -16.19 coo 38.37-101.99-128.11 38.63-102.24-127.37 -3.32 61.09 -17.15 -2.94 60.75 -17.73 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 16 3 # 16 A 420 ALA B 170 ALA^? 1000.00 B 182 GLY B 87 GLY.? 1000.00 B 183 GLY B 89 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 41.93-102.35-126.87 41.52-101.89-126.30 -11.14 57.34 -16.26 -10.91 58.10 -16.36 coo 38.37-101.99-128.11 38.63-102.24-127.37 -5.69 56.38 -16.53 -5.55 57.13 -16.19 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 17 3 # 17 A 420 ALA B 170 ALA^? 1000.00 B 182 GLY B 89 GLY.? 1000.00 B 183 GLY B 87 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 41.93-102.35-126.87 41.52-101.89-126.30 -5.69 56.38 -16.53 -5.55 57.13 -16.19 coo 38.37-101.99-128.11 38.63-102.24-127.37 -11.14 57.34 -16.26 -10.91 58.10 -16.36 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 18 3 # 18 A 420 ALA B 170 ALA^? 1000.00 B 182 GLY B 91 GLY~? 1000.00 B 183 GLY B 89 GLY.? 1000.00 coo 38.36-101.47-135.52 39.62-101.29-136.35 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 41.93-102.35-126.87 41.52-101.89-126.30 -3.32 61.09 -17.15 -2.94 60.75 -17.73 coo 38.37-101.99-128.11 38.63-102.24-127.37 -5.69 56.38 -16.53 -5.55 57.13 -16.19 1xny_c01 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 18 hits 1xny_c01 naa= 3 ULMN 3 1xqd_c02 CYTOCHROME P450 55A1 user 1 3 # 1 A 243 THR A 159 THR~? 1000.00 A 345 PHE A 164 PHE.? 1000.00 A 352 CYH A 84 CYH^? 1000.00 coo 9.58 21.79 21.50 11.25 23.03 20.90 12.23 54.48 -20.55 14.17 53.76 -21.00 coo 19.40 19.75 18.58 17.39 17.81 18.80 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 21.57 22.52 22.79 19.20 21.13 23.26 21.98 56.01 -24.01 21.70 53.26 -23.68 ULMN 3 1xqd_c02 CYTOCHROME P450 55A1 user 2 3 # 2 A 243 THR B 159 THR~? 1000.00 A 345 PHE B 164 PHE.? 1000.00 A 352 CYH B 84 CYH^? 1000.00 coo 9.58 21.79 21.50 11.25 23.03 20.90 -11.88 71.81 -6.50 -12.42 70.32 -7.96 coo 19.40 19.75 18.58 17.39 17.81 18.80 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 21.57 22.52 22.79 19.20 21.13 23.26 -12.63 67.19 -16.08 -14.23 65.55 -14.52 1xqd_c02 source 1xqd CYTOCHROME P450 55A1 : 2 hits 1xqd_c02 naa= 3 ULMN 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 1 3 # 1 A 105 ALA B 218 ALA~? 1000.00 A 244 ASP B 180 ASP~? 1000.00 A 271 HIS B 179 HIS~? 1000.00 coo 15.05 3.71 6.93 14.58 4.88 7.78 -24.24 51.06 -28.15 -23.94 49.76 -27.45 coo 9.85 8.15 0.76 10.61 7.04 2.39 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 10.61 7.65 6.01 12.39 6.55 6.23 -21.96 51.60 -22.33 -20.77 50.80 -23.86 1xqw_c00 source 1xqw PROLINE IMINOPEPTIDASE : 1 hits 1xqw_c00 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 64 ALA~? 1000.00 B 126 ARG A 65 ARG~? 1000.00 B 138 GLU A 85 GLU^? 1000.00 coo 2.11 4.00 19.31 3.14 4.86 19.99 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 2.45 5.53 11.28 3.59 7.56 13.29 39.12 64.28 -16.95 39.71 67.26 -16.39 coo 6.10 2.00 25.24 6.12 1.84 23.13 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 B 124 ALA A 64 ALA~? 1000.00 B 126 ARG A 259 ARG^? 1000.00 B 138 GLU A 85 GLU^? 1000.00 coo 2.11 4.00 19.31 3.14 4.86 19.99 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 2.45 5.53 11.28 3.59 7.56 13.29 37.44 62.38 -29.11 38.25 65.13 -30.27 coo 6.10 2.00 25.24 6.12 1.84 23.13 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 B 124 ALA A 139 ALA.? 1000.00 B 126 ARG B 32 ARG^? 1000.00 B 138 GLU B 125 GLU~? 1000.00 coo 2.11 4.00 19.31 3.14 4.86 19.99 12.63 65.76 -18.47 12.49 65.66 -19.98 coo 2.45 5.53 11.28 3.59 7.56 13.29 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 6.10 2.00 25.24 6.12 1.84 23.13 7.31 63.46 -12.63 8.49 61.96 -13.60 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 B 124 ALA A 170 ALA^? 1000.00 B 126 ARG A 259 ARG^? 1000.00 B 138 GLU A 85 GLU^? 1000.00 coo 2.11 4.00 19.31 3.14 4.86 19.99 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 2.45 5.53 11.28 3.59 7.56 13.29 37.44 62.38 -29.11 38.25 65.13 -30.27 coo 6.10 2.00 25.24 6.12 1.84 23.13 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 B 124 ALA B 64 ALA~? 1000.00 B 126 ARG B 65 ARG~? 1000.00 B 138 GLU B 85 GLU^? 1000.00 coo 2.11 4.00 19.31 3.14 4.86 19.99 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 2.45 5.53 11.28 3.59 7.56 13.29 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo 6.10 2.00 25.24 6.12 1.84 23.13 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 B 124 ALA B 64 ALA~? 1000.00 B 126 ARG B 259 ARG^? 1000.00 B 138 GLU B 85 GLU^? 1000.00 coo 2.11 4.00 19.31 3.14 4.86 19.99 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 2.45 5.53 11.28 3.59 7.56 13.29 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo 6.10 2.00 25.24 6.12 1.84 23.13 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 B 124 ALA B 170 ALA^? 1000.00 B 126 ARG B 259 ARG^? 1000.00 B 138 GLU B 85 GLU^? 1000.00 coo 2.11 4.00 19.31 3.14 4.86 19.99 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 2.45 5.53 11.28 3.59 7.56 13.29 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo 6.10 2.00 25.24 6.12 1.84 23.13 -9.78 62.16 -18.27 -7.90 61.87 -19.25 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 64 ALA~? 1000.00 C 126 ARG A 65 ARG~? 1000.00 C 138 GLU A 85 GLU^? 1000.00 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 34.93 59.77 -19.93 34.59 59.38 -18.51 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 39.12 64.28 -16.95 39.71 67.26 -16.39 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 C 124 ALA A 64 ALA~? 1000.00 C 126 ARG A 259 ARG^? 1000.00 C 138 GLU A 85 GLU^? 1000.00 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 34.93 59.77 -19.93 34.59 59.38 -18.51 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 37.44 62.38 -29.11 38.25 65.13 -30.27 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 C 124 ALA A 139 ALA.? 1000.00 C 126 ARG B 32 ARG^? 1000.00 C 138 GLU B 125 GLU~? 1000.00 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 12.63 65.76 -18.47 12.49 65.66 -19.98 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 10.27 58.20 -24.55 11.21 60.44 -26.40 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 7.31 63.46 -12.63 8.49 61.96 -13.60 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 C 124 ALA A 170 ALA^? 1000.00 C 126 ARG A 259 ARG^? 1000.00 C 138 GLU A 85 GLU^? 1000.00 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 33.34 55.97 -22.66 33.10 57.13 -21.72 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 37.44 62.38 -29.11 38.25 65.13 -30.27 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 C 124 ALA B 64 ALA~? 1000.00 C 126 ARG B 65 ARG~? 1000.00 C 138 GLU B 85 GLU^? 1000.00 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 C 124 ALA B 64 ALA~? 1000.00 C 126 ARG B 259 ARG^? 1000.00 C 138 GLU B 85 GLU^? 1000.00 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 C 124 ALA B 170 ALA^? 1000.00 C 126 ARG B 259 ARG^? 1000.00 C 138 GLU B 85 GLU^? 1000.00 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -9.78 62.16 -18.27 -7.90 61.87 -19.25 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 7 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 64 ALA~? 1000.00 D 126 ARG A 65 ARG~? 1000.00 D 138 GLU A 85 GLU^? 1000.00 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 39.12 64.28 -16.95 39.71 67.26 -16.39 coo 6.23 0.50 57.10 5.93 0.72 59.19 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 D 124 ALA A 64 ALA~? 1000.00 D 126 ARG A 259 ARG^? 1000.00 D 138 GLU A 85 GLU^? 1000.00 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 34.93 59.77 -19.93 34.59 59.38 -18.51 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 37.44 62.38 -29.11 38.25 65.13 -30.27 coo 6.23 0.50 57.10 5.93 0.72 59.19 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 D 124 ALA A 139 ALA.? 1000.00 D 126 ARG B 32 ARG^? 1000.00 D 138 GLU B 125 GLU~? 1000.00 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 12.63 65.76 -18.47 12.49 65.66 -19.98 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 10.27 58.20 -24.55 11.21 60.44 -26.40 coo 6.23 0.50 57.10 5.93 0.72 59.19 7.31 63.46 -12.63 8.49 61.96 -13.60 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 D 124 ALA A 170 ALA^? 1000.00 D 126 ARG A 259 ARG^? 1000.00 D 138 GLU A 85 GLU^? 1000.00 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 33.34 55.97 -22.66 33.10 57.13 -21.72 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 37.44 62.38 -29.11 38.25 65.13 -30.27 coo 6.23 0.50 57.10 5.93 0.72 59.19 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 D 124 ALA B 64 ALA~? 1000.00 D 126 ARG B 65 ARG~? 1000.00 D 138 GLU B 85 GLU^? 1000.00 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo 6.23 0.50 57.10 5.93 0.72 59.19 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 D 124 ALA B 64 ALA~? 1000.00 D 126 ARG B 259 ARG^? 1000.00 D 138 GLU B 85 GLU^? 1000.00 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo 6.23 0.50 57.10 5.93 0.72 59.19 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 D 124 ALA B 170 ALA^? 1000.00 D 126 ARG B 259 ARG^? 1000.00 D 138 GLU B 85 GLU^? 1000.00 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo 6.23 0.50 57.10 5.93 0.72 59.19 -9.78 62.16 -18.27 -7.90 61.87 -19.25 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 7 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 64 ALA~? 1000.00 E 126 ARG A 65 ARG~? 1000.00 E 138 GLU A 85 GLU^? 1000.00 coo -4.56 10.03 62.36 -4.38 11.31 61.55 34.93 59.77 -19.93 34.59 59.38 -18.51 coo -3.02 12.00 70.07 -1.94 13.84 67.82 39.12 64.28 -16.95 39.71 67.26 -16.39 coo -8.67 12.22 56.54 -8.68 12.09 58.65 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 E 124 ALA A 64 ALA~? 1000.00 E 126 ARG A 259 ARG^? 1000.00 E 138 GLU A 85 GLU^? 1000.00 coo -4.56 10.03 62.36 -4.38 11.31 61.55 34.93 59.77 -19.93 34.59 59.38 -18.51 coo -3.02 12.00 70.07 -1.94 13.84 67.82 37.44 62.38 -29.11 38.25 65.13 -30.27 coo -8.67 12.22 56.54 -8.68 12.09 58.65 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 E 124 ALA A 139 ALA.? 1000.00 E 126 ARG B 32 ARG^? 1000.00 E 138 GLU B 125 GLU~? 1000.00 coo -4.56 10.03 62.36 -4.38 11.31 61.55 12.63 65.76 -18.47 12.49 65.66 -19.98 coo -3.02 12.00 70.07 -1.94 13.84 67.82 10.27 58.20 -24.55 11.21 60.44 -26.40 coo -8.67 12.22 56.54 -8.68 12.09 58.65 7.31 63.46 -12.63 8.49 61.96 -13.60 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 E 124 ALA A 170 ALA^? 1000.00 E 126 ARG A 259 ARG^? 1000.00 E 138 GLU A 85 GLU^? 1000.00 coo -4.56 10.03 62.36 -4.38 11.31 61.55 33.34 55.97 -22.66 33.10 57.13 -21.72 coo -3.02 12.00 70.07 -1.94 13.84 67.82 37.44 62.38 -29.11 38.25 65.13 -30.27 coo -8.67 12.22 56.54 -8.68 12.09 58.65 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 E 124 ALA B 64 ALA~? 1000.00 E 126 ARG B 65 ARG~? 1000.00 E 138 GLU B 85 GLU^? 1000.00 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 E 124 ALA B 64 ALA~? 1000.00 E 126 ARG B 259 ARG^? 1000.00 E 138 GLU B 85 GLU^? 1000.00 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 E 124 ALA B 170 ALA^? 1000.00 E 126 ARG B 259 ARG^? 1000.00 E 138 GLU B 85 GLU^? 1000.00 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -9.78 62.16 -18.27 -7.90 61.87 -19.25 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 7 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 64 ALA~? 1000.00 F 126 ARG A 65 ARG~? 1000.00 F 138 GLU A 85 GLU^? 1000.00 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 34.93 59.77 -19.93 34.59 59.38 -18.51 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 39.12 64.28 -16.95 39.71 67.26 -16.39 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 F 124 ALA A 64 ALA~? 1000.00 F 126 ARG A 259 ARG^? 1000.00 F 138 GLU A 85 GLU^? 1000.00 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 34.93 59.77 -19.93 34.59 59.38 -18.51 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 37.44 62.38 -29.11 38.25 65.13 -30.27 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 F 124 ALA A 139 ALA.? 1000.00 F 126 ARG B 32 ARG^? 1000.00 F 138 GLU B 125 GLU~? 1000.00 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 12.63 65.76 -18.47 12.49 65.66 -19.98 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 10.27 58.20 -24.55 11.21 60.44 -26.40 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 7.31 63.46 -12.63 8.49 61.96 -13.60 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 F 124 ALA A 170 ALA^? 1000.00 F 126 ARG A 259 ARG^? 1000.00 F 138 GLU A 85 GLU^? 1000.00 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 33.34 55.97 -22.66 33.10 57.13 -21.72 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 37.44 62.38 -29.11 38.25 65.13 -30.27 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 27.14 56.96 -21.30 28.32 57.46 -19.62 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 F 124 ALA B 64 ALA~? 1000.00 F 126 ARG B 65 ARG~? 1000.00 F 138 GLU B 85 GLU^? 1000.00 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -0.40 56.71 -28.30 2.57 57.06 -27.54 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 F 124 ALA B 64 ALA~? 1000.00 F 126 ARG B 259 ARG^? 1000.00 F 138 GLU B 85 GLU^? 1000.00 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -5.90 58.64 -25.21 -5.18 58.13 -23.98 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -9.78 62.16 -18.27 -7.90 61.87 -19.25 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 F 124 ALA B 170 ALA^? 1000.00 F 126 ARG B 259 ARG^? 1000.00 F 138 GLU B 85 GLU^? 1000.00 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -10.80 58.59 -23.75 -9.39 59.10 -23.65 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -10.57 62.34 -33.08 -9.53 63.90 -35.49 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -9.78 62.16 -18.27 -7.90 61.87 -19.25 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 7 hits 1xs1_c11 naa= 3 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 # 1 142 TRP A 148 TRP.? 1000.00 223 ASP A 109 ASP^? 1000.00 258 ALA A 64 ALA~? 1000.00 coo 128.40 33.01 26.67 128.12 36.28 28.81 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 127.91 41.73 23.55 129.18 40.35 24.44 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 141.00 37.49 25.74 139.80 37.53 24.78 34.93 59.77 -19.93 34.59 59.38 -18.51 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 # 2 142 TRP B 148 TRP.? 1000.00 223 ASP B 109 ASP^? 1000.00 258 ALA B 64 ALA~? 1000.00 coo 128.40 33.01 26.67 128.12 36.28 28.81 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 127.91 41.73 23.55 129.18 40.35 24.44 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 141.00 37.49 25.74 139.80 37.53 24.78 -5.90 58.64 -25.21 -5.18 58.13 -23.98 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 2 hits 2aat_c01 naa= 3 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 126 HIS.? 1000.00 B 50 GLU A 31 GLU^? 1000.00 B 113 GLN A 46 GLN^? 1000.00 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 37.90 61.51 -9.53 39.97 61.99 -9.80 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 30.23 68.81 -7.24 30.22 70.06 -5.50 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS B 126 HIS.? 1000.00 B 50 GLU B 31 GLU^? 1000.00 B 113 GLN B 46 GLN^? 1000.00 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 4.52 66.06 -17.34 5.49 64.29 -17.91 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 8.63 61.19 -19.87 10.65 60.72 -20.32 2ag0_c04 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c04 naa= 3 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 126 HIS.? 1000.00 B 50 GLU A 31 GLU^? 1000.00 B 113 GLN A 46 GLN^? 1000.00 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 37.90 61.51 -9.53 39.97 61.99 -9.80 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 30.23 68.81 -7.24 30.22 70.06 -5.50 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS B 126 HIS.? 1000.00 B 50 GLU B 31 GLU^? 1000.00 B 113 GLN B 46 GLN^? 1000.00 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 4.52 66.06 -17.34 5.49 64.29 -17.91 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 8.63 61.19 -19.87 10.65 60.72 -20.32 2ag0_c08 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c08 naa= 3 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 1 3 # 1 A 29 HIS A 126 HIS.? 1000.00 A 50 GLU A 31 GLU^? 1000.00 A 113 GLN A 46 GLN^? 1000.00 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 37.90 61.51 -9.53 39.97 61.99 -9.80 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 30.23 68.81 -7.24 30.22 70.06 -5.50 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 2 3 # 2 A 29 HIS B 126 HIS.? 1000.00 A 50 GLU B 31 GLU^? 1000.00 A 113 GLN B 46 GLN^? 1000.00 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 4.52 66.06 -17.34 5.49 64.29 -17.91 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 8.63 61.19 -19.87 10.65 60.72 -20.32 2ag0_c09 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c09 naa= 3 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 1 3 # 1 C 29 HIS A 126 HIS.? 1000.00 C 50 GLU A 31 GLU^? 1000.00 C 113 GLN A 46 GLN^? 1000.00 coo 74.92 8.52 28.42 74.88 6.86 29.70 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 65.25 15.95 28.73 65.73 15.63 30.78 37.90 61.51 -9.53 39.97 61.99 -9.80 coo 70.80 6.73 32.72 71.88 8.55 32.53 30.23 68.81 -7.24 30.22 70.06 -5.50 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 2 3 # 2 C 29 HIS B 126 HIS.? 1000.00 C 50 GLU B 31 GLU^? 1000.00 C 113 GLN B 46 GLN^? 1000.00 coo 74.92 8.52 28.42 74.88 6.86 29.70 4.52 66.06 -17.34 5.49 64.29 -17.91 coo 65.25 15.95 28.73 65.73 15.63 30.78 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 70.80 6.73 32.72 71.88 8.55 32.53 8.63 61.19 -19.87 10.65 60.72 -20.32 2ag0_c10 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c10 naa= 3 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 1 3 # 1 D 29 HIS A 126 HIS.? 1000.00 D 50 GLU A 31 GLU^? 1000.00 D 113 GLN A 46 GLN^? 1000.00 coo 38.66 11.31 27.15 38.67 12.13 25.22 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 48.72 12.85 33.83 48.36 14.77 32.95 37.90 61.51 -9.53 39.97 61.99 -9.80 coo 42.85 14.77 24.15 41.85 15.11 26.02 30.23 68.81 -7.24 30.22 70.06 -5.50 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 2 3 # 2 D 29 HIS B 126 HIS.? 1000.00 D 50 GLU B 31 GLU^? 1000.00 D 113 GLN B 46 GLN^? 1000.00 coo 38.66 11.31 27.15 38.67 12.13 25.22 4.52 66.06 -17.34 5.49 64.29 -17.91 coo 48.72 12.85 33.83 48.36 14.77 32.95 3.53 53.86 -23.14 1.51 53.38 -23.51 coo 42.85 14.77 24.15 41.85 15.11 26.02 8.63 61.19 -19.87 10.65 60.72 -20.32 2ag0_c11 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c11 naa= 3 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP A 153 ASP~? 1000.00 231 ASP A 103 ASP.? 1000.00 294 ASP A 150 ASP.? 1000.00 coo 27.89 102.52 14.98 29.35 101.92 13.57 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 14.74 93.05 -1.00 14.30 94.22 0.73 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 33.16 106.80 7.72 33.34 104.87 6.92 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 # 2 193 ASP A 226 ASP~? 1000.00 231 ASP A 196 ASP.? 1000.00 294 ASP A 180 ASP~? 1000.00 coo 27.89 102.52 14.98 29.35 101.92 13.57 30.12 41.11 -36.46 28.02 41.19 -36.22 coo 14.74 93.05 -1.00 14.30 94.22 0.73 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 33.16 106.80 7.72 33.34 104.87 6.92 31.16 39.15 -28.07 29.29 38.21 -28.51 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 # 3 193 ASP B 153 ASP~? 1000.00 231 ASP B 103 ASP.? 1000.00 294 ASP B 150 ASP.? 1000.00 coo 27.89 102.52 14.98 29.35 101.92 13.57 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 14.74 93.05 -1.00 14.30 94.22 0.73 -8.55 78.62 -16.37 -10.58 78.38 -15.81 coo 33.16 106.80 7.72 33.34 104.87 6.92 -20.37 58.06 -6.86 -20.05 56.11 -6.15 2amg_c06 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 3 hits 2amg_c06 naa= 3 ULMN 3 2apr_c04 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 1 3 # 1 35 ASP A 153 ASP~? 1000.00 38 SER A 154 SER~? 1000.00 218 ASP A 150 ASP.? 1000.00 coo 41.14 58.72 105.19 42.39 59.85 103.92 12.44 43.33 -23.10 12.35 42.31 -24.93 coo 46.04 57.35 103.96 44.97 58.52 105.78 13.11 45.91 -19.64 15.16 45.40 -18.51 coo 41.33 60.20 97.63 42.00 60.96 99.49 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 2apr_c04 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 2 3 # 2 35 ASP B 153 ASP~? 1000.00 38 SER B 154 SER~? 1000.00 218 ASP B 150 ASP.? 1000.00 coo 41.14 58.72 105.19 42.39 59.85 103.92 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo 46.04 57.35 103.96 44.97 58.52 105.78 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo 41.33 60.20 97.63 42.00 60.96 99.49 -20.37 58.06 -6.86 -20.05 56.11 -6.15 2apr_c04 source 2apr ACID PROTEINASE (RHIZOPUSPEPSIN) (E.C.3.4.23.6: 2 hits 2apr_c04 naa= 3 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 1 3 # 1 A 14 ARG A 157 ARG~? 1000.00 A 161 ASP A 150 ASP.? 1000.00 A 174 TYR A 146 TYR.? 1000.00 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 8.37 47.22 -17.87 10.68 45.40 -16.87 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 21.59 47.12 -20.56 21.98 45.80 -22.98 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 2 3 # 2 A 14 ARG A 163 ARG.? 1000.00 A 161 ASP A 150 ASP.? 1000.00 A 174 TYR A 146 TYR.? 1000.00 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 16.66 50.10 -32.81 17.39 47.13 -32.98 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 21.59 47.12 -20.56 21.98 45.80 -22.98 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 3 3 # 3 A 14 ARG B 163 ARG.? 1000.00 A 161 ASP B 150 ASP.? 1000.00 A 174 TYR B 146 TYR.? 1000.00 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 -23.66 71.32 -13.90 -25.52 68.98 -13.20 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 -16.21 60.47 -10.06 -18.90 60.67 -10.81 2c7v_c08 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c08 naa= 3 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 1 3 # 1 B 14 ARG A 157 ARG~? 1000.00 B 161 ASP A 150 ASP.? 1000.00 B 174 TYR A 146 TYR.? 1000.00 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 8.37 47.22 -17.87 10.68 45.40 -16.87 coo -14.86 10.19 8.14 -14.82 12.31 8.42 20.55 41.70 -21.16 21.17 40.31 -19.69 coo -21.46 12.70 8.53 -19.04 12.30 7.24 21.59 47.12 -20.56 21.98 45.80 -22.98 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 2 3 # 2 B 14 ARG A 163 ARG.? 1000.00 B 161 ASP A 150 ASP.? 1000.00 B 174 TYR A 146 TYR.? 1000.00 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 16.66 50.10 -32.81 17.39 47.13 -32.98 coo -14.86 10.19 8.14 -14.82 12.31 8.42 20.55 41.70 -21.16 21.17 40.31 -19.69 coo -21.46 12.70 8.53 -19.04 12.30 7.24 21.59 47.12 -20.56 21.98 45.80 -22.98 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 3 3 # 3 B 14 ARG B 163 ARG.? 1000.00 B 161 ASP B 150 ASP.? 1000.00 B 174 TYR B 146 TYR.? 1000.00 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 -23.66 71.32 -13.90 -25.52 68.98 -13.20 coo -14.86 10.19 8.14 -14.82 12.31 8.42 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo -21.46 12.70 8.53 -19.04 12.30 7.24 -16.21 60.47 -10.06 -18.90 60.67 -10.81 2c7v_c09 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c09 naa= 3 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 1 3 # 1 C 14 ARG A 157 ARG~? 1000.00 C 161 ASP A 150 ASP.? 1000.00 C 174 TYR A 146 TYR.? 1000.00 coo 2.84 19.43 40.34 1.59 20.35 37.65 8.37 47.22 -17.87 10.68 45.40 -16.87 coo -0.62 11.10 28.05 -0.65 13.15 27.46 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 5.94 13.28 27.17 3.53 13.05 28.58 21.59 47.12 -20.56 21.98 45.80 -22.98 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 2 3 # 2 C 14 ARG A 163 ARG.? 1000.00 C 161 ASP A 150 ASP.? 1000.00 C 174 TYR A 146 TYR.? 1000.00 coo 2.84 19.43 40.34 1.59 20.35 37.65 16.66 50.10 -32.81 17.39 47.13 -32.98 coo -0.62 11.10 28.05 -0.65 13.15 27.46 20.55 41.70 -21.16 21.17 40.31 -19.69 coo 5.94 13.28 27.17 3.53 13.05 28.58 21.59 47.12 -20.56 21.98 45.80 -22.98 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 3 3 # 3 C 14 ARG B 157 ARG~? 1000.00 C 161 ASP B 150 ASP.? 1000.00 C 174 TYR B 146 TYR.? 1000.00 coo 2.84 19.43 40.34 1.59 20.35 37.65 -17.32 68.53 0.64 -19.15 66.09 0.17 coo -0.62 11.10 28.05 -0.65 13.15 27.46 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 5.94 13.28 27.17 3.53 13.05 28.58 -16.21 60.47 -10.06 -18.90 60.67 -10.81 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 4 3 # 4 C 14 ARG B 163 ARG.? 1000.00 C 161 ASP B 150 ASP.? 1000.00 C 174 TYR B 146 TYR.? 1000.00 coo 2.84 19.43 40.34 1.59 20.35 37.65 -23.66 71.32 -13.90 -25.52 68.98 -13.20 coo -0.62 11.10 28.05 -0.65 13.15 27.46 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo 5.94 13.28 27.17 3.53 13.05 28.58 -16.21 60.47 -10.06 -18.90 60.67 -10.81 2c7v_c10 source 2c7v PTERIDINE REDUCTASE : 4 hits 2c7v_c10 naa= 3 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 1 3 # 1 D 14 ARG A 157 ARG~? 1000.00 D 161 ASP A 150 ASP.? 1000.00 D 174 TYR A 146 TYR.? 1000.00 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 8.37 47.22 -17.87 10.68 45.40 -16.87 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 20.55 41.70 -21.16 21.17 40.31 -19.69 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 21.59 47.12 -20.56 21.98 45.80 -22.98 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 2 3 # 2 D 14 ARG A 163 ARG.? 1000.00 D 161 ASP A 150 ASP.? 1000.00 D 174 TYR A 146 TYR.? 1000.00 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 16.66 50.10 -32.81 17.39 47.13 -32.98 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 20.55 41.70 -21.16 21.17 40.31 -19.69 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 21.59 47.12 -20.56 21.98 45.80 -22.98 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 3 3 # 3 D 14 ARG B 157 ARG~? 1000.00 D 161 ASP B 150 ASP.? 1000.00 D 174 TYR B 146 TYR.? 1000.00 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 -17.32 68.53 0.64 -19.15 66.09 0.17 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 -16.21 60.47 -10.06 -18.90 60.67 -10.81 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 4 3 # 4 D 14 ARG B 163 ARG.? 1000.00 D 161 ASP B 150 ASP.? 1000.00 D 174 TYR B 146 TYR.? 1000.00 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 -23.66 71.32 -13.90 -25.52 68.98 -13.20 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 -16.21 60.47 -10.06 -18.90 60.67 -10.81 2c7v_c11 source 2c7v PTERIDINE REDUCTASE : 4 hits 2c7v_c11 naa= 3 ULMN 3 2cnd_c01 NADH-DEPENDENT NITRATE REDUCTASE (CYuser 1 3 # 1 65 THR A 159 THR~? 1000.00 242 CYH A 84 CYH^? 1000.00 270 PHE A 164 PHE.? 1000.00 coo 12.97 28.35 3.84 11.81 28.07 2.09 12.23 54.48 -20.55 14.17 53.76 -21.00 coo 8.65 19.49 -2.27 10.50 20.91 -0.59 21.98 56.01 -24.01 21.70 53.26 -23.68 coo 9.41 24.60 -3.66 7.52 26.57 -4.16 18.78 55.03 -27.00 17.42 54.37 -24.63 ULMN 3 2cnd_c01 NADH-DEPENDENT NITRATE REDUCTASE (CYuser 2 3 # 2 65 THR B 159 THR~? 1000.00 242 CYH B 84 CYH^? 1000.00 270 PHE B 164 PHE.? 1000.00 coo 12.97 28.35 3.84 11.81 28.07 2.09 -11.88 71.81 -6.50 -12.42 70.32 -7.96 coo 8.65 19.49 -2.27 10.50 20.91 -0.59 -12.63 67.19 -16.08 -14.23 65.55 -14.52 coo 9.41 24.60 -3.66 7.52 26.57 -4.16 -15.80 69.97 -14.88 -14.75 69.46 -12.33 2cnd_c01 source 2cnd NADH-DEPENDENT NITRATE REDUCTASE (CYTOCHROME B: 2 hits 2cnd_c01 naa= 3 ULMN 3 2cpu_c01 ALPHA-AMYLASE user 1 3 # 1 A 197 ASP A 112 ASP~? 1000.00 A 233 GLU A 114 GLU~? 1000.00 A 300 ASN A 117 ASN~? 1000.00 coo 12.51 17.07 49.46 12.44 16.89 47.35 26.00 46.66 -8.90 27.08 46.77 -7.09 coo 6.52 19.14 48.16 7.77 18.42 46.61 27.45 49.53 -2.91 28.88 48.00 -2.44 coo 9.30 22.40 41.76 10.10 20.96 40.36 22.39 53.94 -4.99 20.71 52.72 -4.52 ULMN 3 2cpu_c01 ALPHA-AMYLASE user 2 3 # 2 A 197 ASP B 112 ASP~? 1000.00 A 233 GLU B 114 GLU~? 1000.00 A 300 ASN B 117 ASN~? 1000.00 coo 12.51 17.07 49.46 12.44 16.89 47.35 -7.51 51.42 -7.29 -5.75 50.19 -7.48 coo 6.52 19.14 48.16 7.77 18.42 46.61 -0.41 50.21 -7.66 -0.26 48.43 -6.50 coo 9.30 22.40 41.76 10.10 20.96 40.36 -0.03 56.28 -6.12 -0.62 56.36 -4.07 2cpu_c01 source 2cpu ALPHA-AMYLASE : 2 hits 2cpu_c01 naa= 3 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 150 TYR A 146 TYR.? 1000.00 A 245 ASP A 109 ASP^? 1000.00 A 273 LYS A 142 LYS^? 1000.00 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 26.11 51.15 -14.55 28.22 50.86 -14.82 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 2 3 # 2 A 150 TYR B 146 TYR.? 1000.00 A 245 ASP B 109 ASP^? 1000.00 A 273 LYS B 142 LYS^? 1000.00 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 -6.19 67.97 -9.05 -7.36 69.51 -3.96 2gsa_c02 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 2 hits 2gsa_c02 naa= 3 ULMN 3 2jxr_c04 LIGAND CP-081282 user 1 3 # 1 A 32 ASP A 153 ASP~? 1000.00 A 35 SER A 154 SER~? 1000.00 A 215 ASP A 150 ASP.? 1000.00 coo -14.00 61.45 43.99 -14.19 63.14 42.84 12.44 43.33 -23.10 12.35 42.31 -24.93 coo -13.21 66.21 45.84 -15.49 65.90 45.84 13.11 45.91 -19.64 15.16 45.40 -18.51 coo -10.72 64.19 37.77 -12.20 64.43 39.15 20.55 41.70 -21.16 21.17 40.31 -19.69 ULMN 3 2jxr_c04 LIGAND CP-081282 user 2 3 # 2 A 32 ASP B 153 ASP~? 1000.00 A 35 SER B 154 SER~? 1000.00 A 215 ASP B 150 ASP.? 1000.00 coo -14.00 61.45 43.99 -14.19 63.14 42.84 -21.01 65.81 -3.11 -22.79 67.01 -3.06 coo -13.21 66.21 45.84 -15.49 65.90 45.84 -16.51 65.30 -3.22 -15.28 63.30 -3.90 coo -10.72 64.19 37.77 -12.20 64.43 39.15 -20.37 58.06 -6.86 -20.05 56.11 -6.15 2jxr_c04 source 2jxr LIGAND CP-081282 : 2 hits 2jxr_c04 naa= 3 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 1 3 # 1 A 57 HIS B 207 HIS.? 1000.00 A 102 ASP B 216 ASP~? 1000.00 A 193 GLY B 63 GLY~? 1000.00 coo 14.96 29.22 19.55 15.62 29.93 17.67 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 19.64 30.69 22.61 18.18 29.94 21.25 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 14.54 28.99 9.76 15.06 29.59 10.02 -7.85 56.57 -27.70 -7.10 56.66 -27.29 2lpr_c02 source 2lpr ALPHA-LYTIC PROTEASE : 1 hits 2lpr_c02 naa= 3 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 177 PHE A 164 PHE.? 1000.00 A 263 ASP A 103 ASP.? 1000.00 A 292 LYS A 142 LYS^? 1000.00 coo 51.51 50.32 16.39 52.13 49.68 13.75 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 54.43 44.82 23.74 55.21 45.06 21.80 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 63.95 45.30 16.71 59.11 49.15 16.05 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 A 177 PHE A 219 PHE~? 1000.00 A 263 ASP A 180 ASP~? 1000.00 A 292 LYS A 187 LYS~? 1000.00 coo 51.51 50.32 16.39 52.13 49.68 13.75 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 54.43 44.82 23.74 55.21 45.06 21.80 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 63.95 45.30 16.71 59.11 49.15 16.05 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 A 177 PHE B 164 PHE.? 1000.00 A 263 ASP B 103 ASP.? 1000.00 A 292 LYS B 142 LYS^? 1000.00 coo 51.51 50.32 16.39 52.13 49.68 13.75 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 54.43 44.82 23.74 55.21 45.06 21.80 -8.55 78.62 -16.37 -10.58 78.38 -15.81 coo 63.95 45.30 16.71 59.11 49.15 16.05 -6.19 67.97 -9.05 -7.36 69.51 -3.96 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 4 3 # 4 A 177 PHE B 219 PHE~? 1000.00 A 263 ASP B 180 ASP~? 1000.00 A 292 LYS B 187 LYS~? 1000.00 coo 51.51 50.32 16.39 52.13 49.68 13.75 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 54.43 44.82 23.74 55.21 45.06 21.80 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 63.95 45.30 16.71 59.11 49.15 16.05 -25.11 64.37 -17.06 -29.98 61.05 -17.38 2oat_c03 source 2oat ORNITHINE AMINOTRANSFERASE : 4 hits 2oat_c03 naa= 3 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 B 177 PHE A 164 PHE.? 1000.00 B 263 ASP A 103 ASP.? 1000.00 B 292 LYS A 142 LYS^? 1000.00 coo 49.99 26.05 6.28 51.46 26.87 8.49 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 60.53 31.67 0.97 57.79 27.51 3.63 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 B 177 PHE A 164 PHE.? 1000.00 B 263 ASP A 196 ASP.? 1000.00 B 292 LYS A 187 LYS~? 1000.00 coo 49.99 26.05 6.28 51.46 26.87 8.49 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 17.64 57.85 -36.75 18.26 59.84 -36.39 coo 60.53 31.67 0.97 57.79 27.51 3.63 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 B 177 PHE A 219 PHE~? 1000.00 B 263 ASP A 180 ASP~? 1000.00 B 292 LYS A 187 LYS~? 1000.00 coo 49.99 26.05 6.28 51.46 26.87 8.49 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 60.53 31.67 0.97 57.79 27.51 3.63 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 4 3 # 4 B 177 PHE B 164 PHE.? 1000.00 B 263 ASP B 103 ASP.? 1000.00 B 292 LYS B 142 LYS^? 1000.00 coo 49.99 26.05 6.28 51.46 26.87 8.49 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 -8.55 78.62 -16.37 -10.58 78.38 -15.81 coo 60.53 31.67 0.97 57.79 27.51 3.63 -6.19 67.97 -9.05 -7.36 69.51 -3.96 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 5 3 # 5 B 177 PHE B 219 PHE~? 1000.00 B 263 ASP B 180 ASP~? 1000.00 B 292 LYS B 187 LYS~? 1000.00 coo 49.99 26.05 6.28 51.46 26.87 8.49 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 60.53 31.67 0.97 57.79 27.51 3.63 -25.11 64.37 -17.06 -29.98 61.05 -17.38 2oat_c04 source 2oat ORNITHINE AMINOTRANSFERASE : 5 hits 2oat_c04 naa= 3 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 177 PHE A 164 PHE.? 1000.00 C 263 ASP A 103 ASP.? 1000.00 C 292 LYS A 142 LYS^? 1000.00 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 18.78 55.03 -27.00 17.42 54.37 -24.63 coo 19.84 12.02 9.33 18.68 11.23 7.75 14.64 65.30 -26.26 14.43 63.48 -27.31 coo 12.82 3.49 4.98 17.80 5.59 1.90 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 C 177 PHE A 219 PHE~? 1000.00 C 263 ASP A 180 ASP~? 1000.00 C 292 LYS A 187 LYS~? 1000.00 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 35.08 47.04 -29.48 32.37 47.72 -29.62 coo 19.84 12.02 9.33 18.68 11.23 7.75 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 12.82 3.49 4.98 17.80 5.59 1.90 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 3 3 # 3 C 177 PHE B 164 PHE.? 1000.00 C 263 ASP B 103 ASP.? 1000.00 C 292 LYS B 142 LYS^? 1000.00 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 -15.80 69.97 -14.88 -14.75 69.46 -12.33 coo 19.84 12.02 9.33 18.68 11.23 7.75 -8.55 78.62 -16.37 -10.58 78.38 -15.81 coo 12.82 3.49 4.98 17.80 5.59 1.90 -6.19 67.97 -9.05 -7.36 69.51 -3.96 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 4 3 # 4 C 177 PHE B 219 PHE~? 1000.00 C 263 ASP B 180 ASP~? 1000.00 C 292 LYS B 187 LYS~? 1000.00 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 -21.57 55.31 -24.41 -21.44 57.58 -22.78 coo 19.84 12.02 9.33 18.68 11.23 7.75 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 12.82 3.49 4.98 17.80 5.59 1.90 -25.11 64.37 -17.06 -29.98 61.05 -17.38 2oat_c05 source 2oat ORNITHINE AMINOTRANSFERASE : 4 hits 2oat_c05 naa= 3 ULMN 3 2oat_c06 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 178 TRP A 148 TRP.? 1000.00 A 263 ASP A 109 ASP^? 1000.00 A 292 LYS A 142 LYS^? 1000.00 coo 48.96 45.07 19.49 48.62 41.39 18.16 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 54.43 44.82 23.74 55.21 45.06 21.80 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 63.95 45.30 16.71 59.11 49.15 16.05 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 2oat_c06 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 A 178 TRP B 148 TRP.? 1000.00 A 263 ASP B 109 ASP^? 1000.00 A 292 LYS B 142 LYS^? 1000.00 coo 48.96 45.07 19.49 48.62 41.39 18.16 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 54.43 44.82 23.74 55.21 45.06 21.80 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 63.95 45.30 16.71 59.11 49.15 16.05 -6.19 67.97 -9.05 -7.36 69.51 -3.96 2oat_c06 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c06 naa= 3 ULMN 3 2oat_c07 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 B 178 TRP A 148 TRP.? 1000.00 B 263 ASP A 109 ASP^? 1000.00 B 292 LYS A 142 LYS^? 1000.00 coo 45.83 31.15 4.65 45.88 34.74 6.24 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 60.53 31.67 0.97 57.79 27.51 3.63 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 2oat_c07 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 B 178 TRP B 148 TRP.? 1000.00 B 263 ASP B 109 ASP^? 1000.00 B 292 LYS B 142 LYS^? 1000.00 coo 45.83 31.15 4.65 45.88 34.74 6.24 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 60.53 31.67 0.97 57.79 27.51 3.63 -6.19 67.97 -9.05 -7.36 69.51 -3.96 2oat_c07 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c07 naa= 3 ULMN 3 2oat_c08 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 178 TRP A 148 TRP.? 1000.00 C 263 ASP A 109 ASP^? 1000.00 C 292 LYS A 142 LYS^? 1000.00 coo 20.52 16.65 4.15 17.32 18.91 4.39 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 19.84 12.02 9.33 18.68 11.23 7.75 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 12.82 3.49 4.98 17.80 5.59 1.90 16.76 57.98 -16.13 11.82 58.93 -17.29 ULMN 3 2oat_c08 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 C 178 TRP B 148 TRP.? 1000.00 C 263 ASP B 109 ASP^? 1000.00 C 292 LYS B 142 LYS^? 1000.00 coo 20.52 16.65 4.15 17.32 18.91 4.39 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 19.84 12.02 9.33 18.68 11.23 7.75 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 12.82 3.49 4.98 17.80 5.59 1.90 -6.19 67.97 -9.05 -7.36 69.51 -3.96 2oat_c08 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c08 naa= 3 ULMN 3 2tpl_c04 TYROSINE PHENOL-LYASE user 1 3 # 1 A 122 TYR A 110 TYR.? 1000.00 A 214 ASP A 150 ASP.? 1000.00 A 256 LYS A 187 LYS~? 1000.00 coo -36.51 -15.34 5.35 -36.90 -16.76 7.69 26.55 44.56 -13.80 26.13 41.81 -13.54 coo -29.95 -11.32 -1.46 -28.83 -11.55 0.31 20.55 41.70 -21.16 21.17 40.31 -19.69 coo -18.13 -8.46 4.26 -20.75 -6.32 9.36 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 2tpl_c04 TYROSINE PHENOL-LYASE user 2 3 # 2 A 122 TYR B 110 TYR.? 1000.00 A 214 ASP B 150 ASP.? 1000.00 A 256 LYS B 187 LYS~? 1000.00 coo -36.51 -15.34 5.35 -36.90 -16.76 7.69 -12.51 52.38 -9.11 -14.12 50.95 -7.35 coo -29.95 -11.32 -1.46 -28.83 -11.55 0.31 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo -18.13 -8.46 4.26 -20.75 -6.32 9.36 -25.11 64.37 -17.06 -29.98 61.05 -17.38 2tpl_c04 source 2tpl TYROSINE PHENOL-LYASE : 2 hits 2tpl_c04 naa= 3 ULMN 3 2tpl_c05 TYROSINE PHENOL-LYASE user 1 3 # 1 B 122 TYR A 110 TYR.? 1000.00 B 214 ASP A 150 ASP.? 1000.00 B 256 LYS A 187 LYS~? 1000.00 coo -32.67 22.74 10.17 -32.85 23.98 7.70 26.55 44.56 -13.80 26.13 41.81 -13.54 coo -26.88 17.61 16.89 -26.08 17.11 15.00 20.55 41.70 -21.16 21.17 40.31 -19.69 coo -16.04 12.06 11.09 -17.97 10.54 5.71 23.37 46.40 -32.46 25.34 41.04 -34.48 ULMN 3 2tpl_c05 TYROSINE PHENOL-LYASE user 2 3 # 2 B 122 TYR B 110 TYR.? 1000.00 B 214 ASP B 150 ASP.? 1000.00 B 256 LYS B 187 LYS~? 1000.00 coo -32.67 22.74 10.17 -32.85 23.98 7.70 -12.51 52.38 -9.11 -14.12 50.95 -7.35 coo -26.88 17.61 16.89 -26.08 17.11 15.00 -20.37 58.06 -6.86 -20.05 56.11 -6.15 coo -16.04 12.06 11.09 -17.97 10.54 5.71 -25.11 64.37 -17.06 -29.98 61.05 -17.38 2tpl_c05 source 2tpl TYROSINE PHENOL-LYASE : 2 hits 2tpl_c05 naa= 3 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 1 3 # 1 18 ARG A 221 ARG~? 1000.00 195 HIS A 176 HIS~? 1000.00 199 ASP A 216 ASP.? 1000.00 coo 21.96 2.03 15.24 19.33 1.86 13.55 41.84 43.61 -35.19 44.19 44.98 -33.77 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 44.82 46.44 -29.25 46.02 48.15 -29.05 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 2 3 # 2 18 ARG B 209 ARG.? 1000.00 195 HIS B 258 HIS^? 1000.00 199 ASP B 216 ASP~? 1000.00 coo 21.96 2.03 15.24 19.33 1.86 13.55 -14.48 44.51 -35.31 -16.23 42.88 -33.39 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 -19.23 49.40 -32.78 -18.00 47.70 -33.08 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 3 3 # 3 18 ARG B 215 ARG~? 1000.00 195 HIS B 207 HIS.? 1000.00 199 ASP B 216 ASP~? 1000.00 coo 21.96 2.03 15.24 19.33 1.86 13.55 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 -19.23 49.40 -32.78 -18.00 47.70 -33.08 3cla_c00 source 3cla TYPE III CHLORAMPHENICOL ACETYLTRANSFERASE ( C: 3 hits 3cla_c00 naa= 3 ULMN 3 4kbp_c00 PURPLE ACID PHOSPHATASE user 1 3 # 1 A 202 HIS B 211 HIS.? 1000.00 A 295 HIS B 258 HIS^? 1000.00 A 296 HIS B 207 HIS.? 1000.00 coo 65.34 65.04 50.22 63.95 63.70 51.06 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 63.46 53.34 50.98 63.08 55.39 51.17 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 64.71 54.80 47.28 63.92 56.57 48.06 -14.18 49.88 -34.42 -15.60 48.73 -35.45 4kbp_c00 source 4kbp PURPLE ACID PHOSPHATASE : 1 hits 4kbp_c00 naa= 3 ULMN 3 4kbp_c01 PURPLE ACID PHOSPHATASE user 1 3 # 1 B 202 HIS B 211 HIS.? 1000.00 B 295 HIS B 258 HIS^? 1000.00 B 296 HIS B 207 HIS.? 1000.00 coo 20.09 23.80 58.44 19.07 25.34 59.44 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 19.00 35.58 58.05 18.83 33.61 58.74 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 22.88 34.01 57.66 22.04 32.37 58.63 -14.18 49.88 -34.42 -15.60 48.73 -35.45 4kbp_c01 source 4kbp PURPLE ACID PHOSPHATASE : 1 hits 4kbp_c01 naa= 3 ULMN 3 4kbp_c02 PURPLE ACID PHOSPHATASE user 1 3 # 1 C 202 HIS B 211 HIS.? 1000.00 C 295 HIS B 258 HIS^? 1000.00 C 296 HIS B 207 HIS.? 1000.00 coo 56.07 24.38 61.64 57.15 25.46 60.21 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 57.19 35.56 57.82 57.34 33.47 57.88 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 53.24 34.19 58.78 54.08 32.31 58.44 -14.18 49.88 -34.42 -15.60 48.73 -35.45 4kbp_c02 source 4kbp PURPLE ACID PHOSPHATASE : 1 hits 4kbp_c02 naa= 3 ULMN 3 4kbp_c03 PURPLE ACID PHOSPHATASE user 1 3 # 1 D 202 HIS B 211 HIS.? 1000.00 D 295 HIS B 258 HIS^? 1000.00 D 296 HIS B 207 HIS.? 1000.00 coo 61.78 113.98 49.61 62.80 115.33 50.85 -17.26 48.53 -42.58 -16.44 48.63 -44.51 coo 63.27 125.61 50.94 63.59 123.54 51.16 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 63.24 124.12 46.99 63.79 122.40 48.02 -14.18 49.88 -34.42 -15.60 48.73 -35.45 4kbp_c03 source 4kbp PURPLE ACID PHOSPHATASE : 1 hits 4kbp_c03 naa= 3 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 # 1 A 158 ASP B 216 ASP~? 1000.00 A 161 ARG B 215 ARG~? 1000.00 A 186 HIS B 207 HIS.? 1000.00 coo 18.62 26.83 58.17 18.48 28.64 57.08 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 23.76 27.69 57.88 24.05 29.81 55.69 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 16.67 31.22 54.64 18.74 31.15 54.14 -14.18 49.88 -34.42 -15.60 48.73 -35.45 4mdh_c02 source 4mdh CYTOPLASMIC MALATE DEHYDROGENASE (E.C.1.1.1.37: 1 hits 4mdh_c02 naa= 3 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 # 1 B 158 ASP A 216 ASP.? 1000.00 B 161 ARG A 221 ARG~? 1000.00 B 186 HIS A 176 HIS~? 1000.00 coo 44.53 16.44 28.54 44.89 18.45 28.77 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 39.64 19.27 28.15 40.19 21.74 29.94 41.84 43.61 -35.19 44.19 44.98 -33.77 coo 48.32 20.00 31.44 46.45 20.91 31.50 40.29 42.17 -25.19 41.57 43.60 -26.04 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 2 3 # 2 B 158 ASP B 216 ASP~? 1000.00 B 161 ARG B 209 ARG.? 1000.00 B 186 HIS B 258 HIS^? 1000.00 coo 44.53 16.44 28.54 44.89 18.45 28.77 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 39.64 19.27 28.15 40.19 21.74 29.94 -14.48 44.51 -35.31 -16.23 42.88 -33.39 coo 48.32 20.00 31.44 46.45 20.91 31.50 -14.61 55.49 -34.67 -14.73 54.17 -36.30 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 3 3 # 3 B 158 ASP B 216 ASP~? 1000.00 B 161 ARG B 215 ARG~? 1000.00 B 186 HIS B 207 HIS.? 1000.00 coo 44.53 16.44 28.54 44.89 18.45 28.77 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo 39.64 19.27 28.15 40.19 21.74 29.94 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 48.32 20.00 31.44 46.45 20.91 31.50 -14.18 49.88 -34.42 -15.60 48.73 -35.45 4mdh_c03 source 4mdh CYTOPLASMIC MALATE DEHYDROGENASE (E.C.1.1.1.37: 3 hits 4mdh_c03 naa= 3 ULMN 3 5cox_c04 CYCLOOXYGENASE-2 user 1 3 # 1 A 203 GLN A 46 GLN^? 1000.00 A 207 HIS A 126 HIS.? 1000.00 A 385 TYR A 33 TYR^? 1000.00 coo 23.69 37.92 6.66 22.22 39.29 5.97 30.23 68.81 -7.24 30.22 70.06 -5.50 coo 27.49 36.78 4.86 25.87 35.83 3.93 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 25.45 28.28 7.33 26.01 28.57 10.04 34.59 67.34 -16.12 34.26 67.92 -18.84 5cox_c04 source 5cox CYCLOOXYGENASE-2 : 1 hits 5cox_c04 naa= 3 ULMN 3 5cox_c05 CYCLOOXYGENASE-2 user 1 3 # 1 B 203 GLN A 46 GLN^? 1000.00 B 207 HIS A 126 HIS.? 1000.00 B 385 TYR A 33 TYR^? 1000.00 coo 71.73 24.29 -6.07 73.27 24.95 -7.36 30.23 68.81 -7.24 30.22 70.06 -5.50 coo 67.92 26.15 -5.01 69.53 27.05 -4.02 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 69.83 23.77 3.61 69.22 21.05 3.32 34.59 67.34 -16.12 34.26 67.92 -18.84 5cox_c05 source 5cox CYCLOOXYGENASE-2 : 1 hits 5cox_c05 naa= 3 ULMN 3 5cox_c06 CYCLOOXYGENASE-2 user 1 3 # 1 C 203 GLN A 46 GLN^? 1000.00 C 207 HIS A 126 HIS.? 1000.00 C 385 TYR A 33 TYR^? 1000.00 coo 60.00 28.49 66.40 61.43 27.08 65.71 30.23 68.81 -7.24 30.22 70.06 -5.50 coo 56.23 29.81 64.65 57.85 30.66 63.63 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 58.74 38.31 66.76 58.24 38.12 69.50 34.59 67.34 -16.12 34.26 67.92 -18.84 5cox_c06 source 5cox CYCLOOXYGENASE-2 : 1 hits 5cox_c06 naa= 3 ULMN 3 5cox_c07 CYCLOOXYGENASE-2 user 1 3 # 1 D 203 GLN A 46 GLN^? 1000.00 D 207 HIS A 126 HIS.? 1000.00 D 385 TYR A 33 TYR^? 1000.00 coo 12.27 43.90 54.45 10.71 43.30 53.17 30.23 68.81 -7.24 30.22 70.06 -5.50 coo 16.03 41.92 55.47 14.38 41.13 56.50 25.67 67.75 -11.18 27.28 67.54 -9.86 coo 14.46 44.71 64.03 15.12 47.37 63.64 34.59 67.34 -16.12 34.26 67.92 -18.84 5cox_c07 source 5cox CYCLOOXYGENASE-2 : 1 hits 5cox_c07 naa= 3 ULMN 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 1 3 # 1 A 81 ASP A 226 ASP~? 1000.00 A 99 GLY A 227 GLY.? 1000.00 A 125 ASN A 224 ASN~? 1000.00 coo -12.71 41.15 -12.81 -13.46 42.96 -13.57 30.12 41.11 -36.46 28.02 41.19 -36.22 coo -9.98 44.30 -14.04 -9.74 44.63 -13.34 29.43 42.95 -40.95 28.91 42.83 -40.42 coo -9.28 44.56 -19.45 -10.46 44.31 -17.70 35.03 45.63 -39.37 35.20 47.65 -38.71 ULMN 3 1hkd_p00 PEA LECTIN ALPHA CHAIN user 2 3 # 2 A 81 ASP B 226 ASP~? 1000.00 A 99 GLY B 227 GLY.? 1000.00 A 125 ASN B 224 ASN~? 1000.00 coo -12.71 41.15 -12.81 -13.46 42.96 -13.57 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo -9.98 44.30 -14.04 -9.74 44.63 -13.34 -33.34 62.44 -23.64 -32.68 62.31 -23.22 coo -9.28 44.56 -19.45 -10.46 44.31 -17.70 -29.62 59.26 -28.83 -27.87 60.14 -29.67 1hkd_p00 source 1hkd PEA LECTIN ALPHA CHAIN : 2 hits 1hkd_p00 naa= 3 ULMN 3 1k12_p00 LECTIN user 1 3 # 1 A 52 HIS B 207 HIS.? 1000.00 A 79 ARG B 209 ARG.? 1000.00 A 86 ARG B 215 ARG~? 1000.00 coo -5.53 26.98 5.69 -5.98 25.70 4.09 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -12.15 26.35 6.05 -10.94 27.19 3.35 -14.48 44.51 -35.31 -16.23 42.88 -33.39 coo -9.59 20.48 4.28 -9.21 22.28 1.82 -20.00 45.16 -30.78 -18.84 42.81 -32.44 1k12_p00 source 1k12 LECTIN : 1 hits 1k12_p00 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 117 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 22.39 53.94 -4.99 20.71 52.72 -4.52 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 122 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 26.58 61.39 -9.58 28.06 60.87 -8.14 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN A 195 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 13.69 55.33 -37.79 12.29 53.74 -37.87 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN A 224 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 35.03 45.63 -39.37 35.20 47.65 -38.71 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 5 1 # 5 A 461 ASN B 117 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 -0.03 56.28 -6.12 -0.62 56.36 -4.07 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 6 1 # 6 A 461 ASN B 122 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 1.60 60.89 -14.49 2.17 58.90 -14.85 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 7 1 # 7 A 461 ASN B 195 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 -23.79 78.19 -16.66 -25.08 78.42 -14.99 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 8 1 # 8 A 461 ASN B 224 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 -29.62 59.26 -28.83 -27.87 60.14 -29.67 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 8 hits 1kbk_p00 naa= 1 ULMN 4 1tp8_p00 AGGLUTININ ALPHA CHAIN user 1 4 # 1 A 78 TYR A 110 TYR.? 1000.00 A 122 TYR A 146 TYR.? 1000.00 A 123 TRP A 148 TRP.? 1000.00 A 125 ASP A 109 ASP^? 1000.00 coo 19.38 49.47 37.63 21.61 48.26 38.74 26.55 44.56 -13.80 26.13 41.81 -13.54 coo 19.98 42.48 34.84 21.41 40.81 36.53 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 14.80 43.87 32.25 16.21 44.40 35.89 26.89 46.71 -20.94 30.78 47.15 -20.58 coo 20.41 51.31 29.99 21.29 49.61 30.88 26.11 51.15 -14.55 28.22 50.86 -14.82 ULMN 4 1tp8_p00 AGGLUTININ ALPHA CHAIN user 2 4 # 2 A 78 TYR B 110 TYR.? 1000.00 A 122 TYR B 146 TYR.? 1000.00 A 123 TRP B 148 TRP.? 1000.00 A 125 ASP B 109 ASP^? 1000.00 coo 19.38 49.47 37.63 21.61 48.26 38.74 -12.51 52.38 -9.11 -14.12 50.95 -7.35 coo 19.98 42.48 34.84 21.41 40.81 36.53 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 14.80 43.87 32.25 16.21 44.40 35.89 -16.31 56.98 -14.06 -15.62 54.26 -16.81 coo 20.41 51.31 29.99 21.29 49.61 30.88 -8.78 56.88 -12.11 -8.97 55.48 -13.69 1tp8_p00 source 1tp8 AGGLUTININ ALPHA CHAIN : 2 hits 1tp8_p00 naa= 4 ULMN 3 2p3i_p00 VP4 user 1 3 # 1 A 101 ARG A 184 ARG~? 1000.00 A 188 TYR A 146 TYR.? 1000.00 A 190 SER A 185 SER~? 1000.00 coo 37.69 7.64 13.51 38.82 8.84 16.11 25.35 39.14 -29.34 25.56 38.90 -26.28 coo 47.14 12.10 13.73 48.75 12.33 16.01 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 43.77 6.93 15.46 45.49 7.21 17.11 24.33 45.74 -27.14 24.89 45.34 -24.82 ULMN 3 2p3i_p00 VP4 user 2 3 # 2 A 101 ARG B 184 ARG~? 1000.00 A 188 TYR B 146 TYR.? 1000.00 A 190 SER B 185 SER~? 1000.00 coo 37.69 7.64 13.51 38.82 8.84 16.11 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo 47.14 12.10 13.73 48.75 12.33 16.01 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 43.77 6.93 15.46 45.49 7.21 17.11 -21.68 60.93 -14.68 -20.41 58.94 -14.15 2p3i_p00 source 2p3i VP4 : 2 hits 2p3i_p00 naa= 3 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 # 1 A 270 ASN A 117 ASN~? 1000.00 A 384 ASN B 122 ASN~? 1000.00 A 385 GLU B 125 GLU~? 1000.00 coo 22.28 63.17 110.61 22.47 65.06 111.53 22.39 53.94 -4.99 20.71 52.72 -4.52 coo 7.06 50.07 96.17 8.50 48.54 96.31 1.60 60.89 -14.49 2.17 58.90 -14.85 coo 11.59 49.83 99.41 10.92 47.97 100.16 7.31 63.46 -12.63 8.49 61.96 -13.60 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 2 3 # 2 A 270 ASN A 122 ASN~? 1000.00 A 384 ASN B 122 ASN~? 1000.00 A 385 GLU B 125 GLU~? 1000.00 coo 22.28 63.17 110.61 22.47 65.06 111.53 26.58 61.39 -9.58 28.06 60.87 -8.14 coo 7.06 50.07 96.17 8.50 48.54 96.31 1.60 60.89 -14.49 2.17 58.90 -14.85 coo 11.59 49.83 99.41 10.92 47.97 100.16 7.31 63.46 -12.63 8.49 61.96 -13.60 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 3 3 # 3 A 270 ASN B 122 ASN~? 1000.00 A 384 ASN A 117 ASN~? 1000.00 A 385 GLU A 120 GLU~? 1000.00 coo 22.28 63.17 110.61 22.47 65.06 111.53 1.60 60.89 -14.49 2.17 58.90 -14.85 coo 7.06 50.07 96.17 8.50 48.54 96.31 22.39 53.94 -4.99 20.71 52.72 -4.52 coo 11.59 49.83 99.41 10.92 47.97 100.16 19.22 58.37 -9.01 17.46 57.61 -9.85 2v3r_p00 source 2v3r EXOGLUCANASE 1 : 3 hits 2v3r_p00 naa= 3 ULMN 3 2vmg_p00 FIBRONECTIN TYPE III DOMAIN PROTEIN user 1 3 # 1 A 82 HIS A 179 HIS~? 1000.00 A 166 SER A 174 SER.? 1000.00 A 168 HIS A 176 HIS~? 1000.00 coo -0.13 -10.57 9.17 -1.77 -11.50 8.23 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -3.43 -11.92 3.54 -4.49 -13.13 1.70 39.69 47.27 -21.33 40.40 49.18 -20.03 coo 1.64 -11.03 4.40 1.43 -13.11 4.63 40.29 42.17 -25.19 41.57 43.60 -26.04 ULMN 3 2vmg_p00 FIBRONECTIN TYPE III DOMAIN PROTEIN user 2 3 # 2 A 82 HIS B 179 HIS~? 1000.00 A 166 SER B 174 SER.? 1000.00 A 168 HIS B 176 HIS~? 1000.00 coo -0.13 -10.57 9.17 -1.77 -11.50 8.23 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -3.43 -11.92 3.54 -4.49 -13.13 1.70 -15.19 48.74 -23.97 -12.89 48.81 -23.13 coo 1.64 -11.03 4.40 1.43 -13.11 4.63 -21.58 46.84 -24.01 -21.23 47.14 -26.06 2vmg_p00 source 2vmg FIBRONECTIN TYPE III DOMAIN PROTEIN : 2 hits 2vmg_p00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 33 TYR^? 1000.00 I 306 VAL A 45 VAL^? 1000.00 I 308 VAL A 47 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 34.59 67.34 -16.12 34.26 67.92 -18.84 coo 23.55 29.53 9.81 23.15 27.39 10.24 30.75 68.78 -12.15 29.65 67.39 -13.46 coo 16.43 30.18 9.35 15.05 30.67 11.01 30.91 63.40 -8.45 30.83 63.01 -10.62 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 2 3 # 2 I 303 TYR A 146 TYR.? 1000.00 I 306 VAL A 144 VAL^? 1000.00 I 308 VAL A 106 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 21.59 47.12 -20.56 21.98 45.80 -22.98 coo 23.55 29.53 9.81 23.15 27.39 10.24 18.44 51.93 -15.57 16.92 51.44 -17.10 coo 16.43 30.18 9.35 15.05 30.67 11.01 19.18 56.95 -20.27 17.68 55.54 -20.93 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 3 3 # 3 I 303 TYR B 146 TYR.? 1000.00 I 306 VAL B 144 VAL^? 1000.00 I 308 VAL B 106 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 23.55 29.53 9.81 23.15 27.39 10.24 -9.77 63.10 -7.30 -11.15 64.76 -6.88 coo 16.43 30.18 9.35 15.05 30.67 11.01 -9.55 67.62 -12.64 -11.10 67.97 -11.11 1cqt_d00 source 1cqt GENE REGULATION/DNA : 3 hits 1cqt_d00 naa= 3 ULMN 3 1emh_d00 HYDROLASE/DNA user 1 3 # 1 A 271 PRO A 75 PRO~? 1000.00 A 272 LEU A 71 LEU~? 1000.00 A 276 ARG A 259 ARG^? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 27.70 72.05 -27.67 27.57 70.08 -28.74 coo 10.97 0.43 16.73 11.31 2.11 18.06 29.60 66.14 -25.23 28.66 64.23 -25.82 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 37.44 62.38 -29.11 38.25 65.13 -30.27 ULMN 3 1emh_d00 HYDROLASE/DNA user 2 3 # 2 A 271 PRO A 145 PRO^? 1000.00 A 272 LEU A 155 LEU~? 1000.00 A 276 ARG A 157 ARG~? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 18.45 47.85 -13.82 19.84 49.21 -14.90 coo 10.97 0.43 16.73 11.31 2.11 18.06 16.57 48.99 -21.16 17.91 50.54 -21.89 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 8.37 47.22 -17.87 10.68 45.40 -16.87 ULMN 3 1emh_d00 HYDROLASE/DNA user 3 3 # 3 A 271 PRO A 152 PRO~? 1000.00 A 272 LEU A 155 LEU~? 1000.00 A 276 ARG A 157 ARG~? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 17.74 45.85 -26.04 16.93 44.84 -24.17 coo 10.97 0.43 16.73 11.31 2.11 18.06 16.57 48.99 -21.16 17.91 50.54 -21.89 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 8.37 47.22 -17.87 10.68 45.40 -16.87 ULMN 3 1emh_d00 HYDROLASE/DNA user 4 3 # 4 A 271 PRO B 152 PRO~? 1000.00 A 272 LEU B 155 LEU~? 1000.00 A 276 ARG B 157 ARG~? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 -21.45 65.48 -8.94 -20.54 63.93 -7.60 coo 10.97 0.43 16.73 11.31 2.11 18.06 -15.71 66.22 -7.97 -15.54 64.63 -9.36 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 -17.32 68.53 0.64 -19.15 66.09 0.17 ULMN 3 1emh_d00 HYDROLASE/DNA user 5 3 # 5 A 271 PRO B 237 PRO^? 1000.00 A 272 LEU B 235 LEU^? 1000.00 A 276 ARG B 261 ARG^? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 -13.43 57.49 -38.63 -12.09 59.09 -37.84 coo 10.97 0.43 16.73 11.31 2.11 18.06 -13.10 64.92 -35.53 -12.53 66.97 -35.04 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 -19.12 67.47 -30.67 -19.76 70.17 -31.94 1emh_d00 source 1emh HYDROLASE/DNA : 5 hits 1emh_d00 naa= 3 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 1 3 # 1 E 40 ARG A 65 ARG~? 1000.00 E 41 TYR A 33 TYR^? 1000.00 E 83 ARG B 259 ARG^? 1000.00 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 39.12 64.28 -16.95 39.71 67.26 -16.39 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 34.59 67.34 -16.12 34.26 67.92 -18.84 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 -10.57 62.34 -33.08 -9.53 63.90 -35.49 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 2 3 # 2 E 40 ARG A 147 ARG.? 1000.00 E 41 TYR A 110 TYR.? 1000.00 E 83 ARG B 138 ARG.? 1000.00 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 24.02 40.19 -18.03 22.48 40.38 -15.40 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 26.55 44.56 -13.80 26.13 41.81 -13.54 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 -3.35 82.04 -12.94 -4.36 84.97 -13.00 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 3 3 # 3 E 40 ARG B 147 ARG.? 1000.00 E 41 TYR B 146 TYR.? 1000.00 E 83 ARG A 184 ARG~? 1000.00 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 -18.58 53.32 -7.29 -16.65 53.40 -4.90 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 -16.21 60.47 -10.06 -18.90 60.67 -10.81 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 25.35 39.14 -29.34 25.56 38.90 -26.28 1id3_d00 source 1id3 STRUCTURAL PROTEIN/DNA : 3 hits 1id3_d00 naa= 3 ULMN 3 1mjo_d00 TRANSCRIPTION/DNA user 1 3 # 1 D 23 LYS A 142 LYS^? 1000.00 D 25 THR A 159 THR~? 1000.00 D 27 SER A 154 SER~? 1000.00 coo 86.60 33.38 44.00 87.05 39.52 42.71 16.76 57.98 -16.13 11.82 58.93 -17.29 coo 81.20 31.58 48.03 79.23 32.24 47.54 12.23 54.48 -20.55 14.17 53.76 -21.00 coo 79.09 29.82 54.20 77.17 28.90 53.05 13.11 45.91 -19.64 15.16 45.40 -18.51 ULMN 3 1mjo_d00 TRANSCRIPTION/DNA user 2 3 # 2 D 23 LYS B 142 LYS^? 1000.00 D 25 THR B 159 THR~? 1000.00 D 27 SER B 154 SER~? 1000.00 coo 86.60 33.38 44.00 87.05 39.52 42.71 -6.19 67.97 -9.05 -7.36 69.51 -3.96 coo 81.20 31.58 48.03 79.23 32.24 47.54 -11.88 71.81 -6.50 -12.42 70.32 -7.96 coo 79.09 29.82 54.20 77.17 28.90 53.05 -16.51 65.30 -3.22 -15.28 63.30 -3.90 1mjo_d00 source 1mjo TRANSCRIPTION/DNA : 2 hits 1mjo_d00 naa= 3 ULMN 3 2bsq_d00 TRANSCRIPTION user 1 3 # 1 E 3 SER B 62 SER~? 1000.00 E 5 VAL B 257 VAL^? 1000.00 E 7 ARG B 259 ARG^? 1000.00 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 -4.51 54.82 -27.89 -5.53 53.13 -29.22 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 -9.87 55.69 -33.32 -8.59 56.26 -31.62 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 -10.57 62.34 -33.08 -9.53 63.90 -35.49 2bsq_d00 source 2bsq TRANSCRIPTION : 1 hits 2bsq_d00 naa= 3 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 B 34 SER B 118 SER~? 1000.00 B 37 ASN B 122 ASN~? 1000.00 B 45 THR A 159 THR~? 1000.00 coo -19.49 41.97 71.08 -17.37 40.80 71.17 0.89 57.06 -10.45 -0.04 55.05 -11.41 coo -23.05 39.62 69.74 -22.86 39.59 67.61 1.60 60.89 -14.49 2.17 58.90 -14.85 coo -30.87 34.84 80.57 -28.94 34.51 81.49 12.23 54.48 -20.55 14.17 53.76 -21.00 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 B 34 SER B 121 SER~? 1000.00 B 37 ASN B 122 ASN~? 1000.00 B 45 THR A 159 THR~? 1000.00 coo -19.49 41.97 71.08 -17.37 40.80 71.17 3.01 61.33 -9.81 4.05 59.21 -10.36 coo -23.05 39.62 69.74 -22.86 39.59 67.61 1.60 60.89 -14.49 2.17 58.90 -14.85 coo -30.87 34.84 80.57 -28.94 34.51 81.49 12.23 54.48 -20.55 14.17 53.76 -21.00 2z3x_d00 source 2z3x DNA BINDING PROTEIN/DNA : 2 hits 2z3x_d00 naa= 3 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 18 SER A 121 SER~? 1000.00 A 20 HIS A 126 HIS.? 1000.00 A 22 LEU A 92 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 22.74 60.44 -6.78 23.90 60.97 -4.72 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 25.67 67.75 -11.18 27.28 67.54 -9.86 coo -14.55 2.62 13.63 -14.94 2.66 11.50 31.41 62.38 -16.09 32.69 64.16 -16.06 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 A 18 SER A 121 SER~? 1000.00 A 20 HIS A 126 HIS.? 1000.00 A 22 LEU A 99 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 22.74 60.44 -6.78 23.90 60.97 -4.72 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 25.67 67.75 -11.18 27.28 67.54 -9.86 coo -14.55 2.62 13.63 -14.94 2.66 11.50 24.59 70.17 -19.15 24.91 70.36 -17.00 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 A 18 SER A 174 SER.? 1000.00 A 20 HIS A 176 HIS~? 1000.00 A 22 LEU A 222 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 39.69 47.27 -21.33 40.40 49.18 -20.03 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -14.55 2.62 13.63 -14.94 2.66 11.50 35.17 42.19 -32.48 34.13 40.55 -31.45 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 4 3 # 4 A 18 SER A 174 SER.? 1000.00 A 20 HIS A 179 HIS~? 1000.00 A 22 LEU A 183 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 39.69 47.27 -21.33 40.40 49.18 -20.03 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -14.55 2.62 13.63 -14.94 2.66 11.50 29.64 43.85 -30.74 29.46 43.52 -32.88 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 5 3 # 5 A 18 SER A 174 SER.? 1000.00 A 20 HIS A 179 HIS~? 1000.00 A 22 LEU A 222 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 39.69 47.27 -21.33 40.40 49.18 -20.03 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -14.55 2.62 13.63 -14.94 2.66 11.50 35.17 42.19 -32.48 34.13 40.55 -31.45 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 6 3 # 6 A 18 SER A 236 SER.? 1000.00 A 20 HIS A 258 HIS^? 1000.00 A 22 LEU A 217 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 41.86 63.23 -33.55 42.01 65.65 -33.24 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 43.13 56.70 -29.91 45.18 56.51 -30.28 coo -14.55 2.62 13.63 -14.94 2.66 11.50 42.27 48.72 -32.53 43.23 50.66 -32.76 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 7 3 # 7 A 18 SER B 121 SER~? 1000.00 A 20 HIS B 126 HIS.? 1000.00 A 22 LEU B 92 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 3.01 61.33 -9.81 4.05 59.21 -10.36 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 4.52 66.06 -17.34 5.49 64.29 -17.91 coo -14.55 2.62 13.63 -14.94 2.66 11.50 -1.66 60.87 -21.72 -0.51 61.33 -23.50 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 8 3 # 8 A 18 SER B 121 SER~? 1000.00 A 20 HIS B 126 HIS.? 1000.00 A 22 LEU B 99 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 3.01 61.33 -9.81 4.05 59.21 -10.36 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 4.52 66.06 -17.34 5.49 64.29 -17.91 coo -14.55 2.62 13.63 -14.94 2.66 11.50 0.53 71.36 -21.75 2.20 70.37 -20.78 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 9 3 # 9 A 18 SER B 174 SER.? 1000.00 A 20 HIS B 176 HIS~? 1000.00 A 22 LEU B 222 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 -15.19 48.74 -23.97 -12.89 48.81 -23.13 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -14.55 2.62 13.63 -14.94 2.66 11.50 -27.11 54.03 -24.09 -27.52 53.16 -22.14 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 10 3 # 10 A 18 SER B 174 SER.? 1000.00 A 20 HIS B 179 HIS~? 1000.00 A 22 LEU B 183 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 -15.19 48.74 -23.97 -12.89 48.81 -23.13 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -14.55 2.62 13.63 -14.94 2.66 11.50 -25.16 57.93 -19.54 -26.74 58.95 -20.62 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 11 3 # 11 A 18 SER B 174 SER.? 1000.00 A 20 HIS B 179 HIS~? 1000.00 A 22 LEU B 222 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 -15.19 48.74 -23.97 -12.89 48.81 -23.13 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -14.55 2.62 13.63 -14.94 2.66 11.50 -27.11 54.03 -24.09 -27.52 53.16 -22.14 ULMN 3 3gxq_d00 DNA BINDING PROTEIN/DNA user 12 3 # 12 A 18 SER B 236 SER^? 1000.00 A 20 HIS B 258 HIS^? 1000.00 A 22 LEU B 217 LEU~? 1000.00 coo -2.78 -5.11 11.04 -4.18 -3.84 9.51 -13.40 61.82 -38.71 -11.69 62.84 -40.02 coo -8.47 -0.77 9.86 -9.21 0.76 8.62 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo -14.55 2.62 13.63 -14.94 2.66 11.50 -22.84 53.06 -32.28 -21.99 53.94 -34.08 3gxq_d00 source 3gxq DNA BINDING PROTEIN/DNA : 12 hits 3gxq_d00 naa= 3 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 G 386 ARG B 215 ARG~? 1000.00 G 387 HIS B 176 HIS~? 1000.00 G 390 SER B 174 SER.? 1000.00 coo 93.17 52.97 31.81 95.66 54.71 32.14 -20.00 45.16 -30.78 -18.84 42.81 -32.44 coo 95.60 53.07 40.31 97.10 52.52 41.67 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 93.25 46.91 38.79 94.12 47.43 36.62 -15.19 48.74 -23.97 -12.89 48.81 -23.13 3qrf_d00 source 3qrf DNA BINDING PROTEIN/DNA : 1 hits 3qrf_d00 naa= 3 ULMN 3 3s57_d00 OXIDOREDUCTASE/DNA user 1 3 # 1 A 101 VAL A 96 VAL~? 1000.00 A 102 PHE A 98 PHE~? 1000.00 A 169 CYH A 84 CYH^? 1000.00 coo -0.48 2.03 12.21 0.64 0.32 12.97 27.09 66.59 -19.78 29.15 66.98 -20.39 coo 0.51 5.20 15.97 0.26 4.09 18.50 20.41 66.79 -18.28 18.29 68.29 -17.20 coo 4.56 -7.03 18.26 5.32 -4.76 16.88 21.98 56.01 -24.01 21.70 53.26 -23.68 ULMN 3 3s57_d00 OXIDOREDUCTASE/DNA user 2 3 # 2 A 101 VAL B 96 VAL~? 1000.00 A 102 PHE B 98 PHE~? 1000.00 A 169 CYH B 84 CYH^? 1000.00 coo -0.48 2.03 12.21 0.64 0.32 12.97 -2.20 67.80 -22.30 -2.07 66.83 -24.25 coo 0.51 5.20 15.97 0.26 4.09 18.50 -1.57 71.96 -16.72 0.00 73.74 -15.26 coo 4.56 -7.03 18.26 5.32 -4.76 16.88 -12.63 67.19 -16.08 -14.23 65.55 -14.52 3s57_d00 source 3s57 OXIDOREDUCTASE/DNA : 2 hits 3s57_d00 naa= 3 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 78 ARG A 184 ARG~? 1000.00 A 82 LYS A 187 LYS~? 1000.00 A 97 ARG A 147 ARG.? 1000.00 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 25.35 39.14 -29.34 25.56 38.90 -26.28 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 23.37 46.40 -32.46 25.34 41.04 -34.48 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 24.02 40.19 -18.03 22.48 40.38 -15.40 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 A 78 ARG B 184 ARG~? 1000.00 A 82 LYS B 187 LYS~? 1000.00 A 97 ARG B 147 ARG.? 1000.00 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 -27.45 56.94 -13.67 -25.49 55.61 -11.69 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 -25.11 64.37 -17.06 -29.98 61.05 -17.38 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 -18.58 53.32 -7.29 -16.65 53.40 -4.90 4er8_d00 source 4er8 DNA BINDING PROTEIN/DNA : 2 hits 4er8_d00 naa= 3 ULMN 3 2odj_o00 PORIN D user 1 3 # 1 A 156 HIS A 176 HIS~? 1000.00 A 208 ASP A 171 ASP.? 1000.00 A 296 SER A 151 SER.? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 18.47 29.19 29.68 19.30 29.17 27.75 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 6.89 17.22 46.63 5.08 16.21 47.91 17.70 41.87 -24.64 15.49 41.01 -23.98 ULMN 3 2odj_o00 PORIN D user 2 3 # 2 A 156 HIS A 176 HIS~? 1000.00 A 208 ASP A 226 ASP~? 1000.00 A 296 SER A 236 SER.? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 40.29 42.17 -25.19 41.57 43.60 -26.04 coo 18.47 29.19 29.68 19.30 29.17 27.75 30.12 41.11 -36.46 28.02 41.19 -36.22 coo 6.89 17.22 46.63 5.08 16.21 47.91 41.86 63.23 -33.55 42.01 65.65 -33.24 ULMN 3 2odj_o00 PORIN D user 3 3 # 3 A 156 HIS A 179 HIS~? 1000.00 A 208 ASP A 171 ASP.? 1000.00 A 296 SER A 154 SER~? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 18.47 29.19 29.68 19.30 29.17 27.75 36.72 54.39 -20.35 38.41 55.64 -20.64 coo 6.89 17.22 46.63 5.08 16.21 47.91 13.11 45.91 -19.64 15.16 45.40 -18.51 ULMN 3 2odj_o00 PORIN D user 4 3 # 4 A 156 HIS A 258 HIS^? 1000.00 A 208 ASP A 69 ASP~? 1000.00 A 296 SER A 185 SER~? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 43.13 56.70 -29.91 45.18 56.51 -30.28 coo 18.47 29.19 29.68 19.30 29.17 27.75 36.79 67.01 -23.90 37.87 67.50 -22.12 coo 6.89 17.22 46.63 5.08 16.21 47.91 24.33 45.74 -27.14 24.89 45.34 -24.82 ULMN 3 2odj_o00 PORIN D user 5 3 # 5 A 156 HIS B 176 HIS~? 1000.00 A 208 ASP B 171 ASP.? 1000.00 A 296 SER B 151 SER.? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 18.47 29.19 29.68 19.30 29.17 27.75 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 6.89 17.22 46.63 5.08 16.21 47.91 -22.74 61.81 -6.90 -22.89 62.92 -4.74 ULMN 3 2odj_o00 PORIN D user 6 3 # 6 A 156 HIS B 176 HIS~? 1000.00 A 208 ASP B 226 ASP~? 1000.00 A 296 SER B 236 SER^? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo 18.47 29.19 29.68 19.30 29.17 27.75 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo 6.89 17.22 46.63 5.08 16.21 47.91 -13.40 61.82 -38.71 -11.69 62.84 -40.02 ULMN 3 2odj_o00 PORIN D user 7 3 # 7 A 156 HIS B 179 HIS~? 1000.00 A 208 ASP B 171 ASP.? 1000.00 A 296 SER B 154 SER~? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 18.47 29.19 29.68 19.30 29.17 27.75 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 6.89 17.22 46.63 5.08 16.21 47.91 -16.51 65.30 -3.22 -15.28 63.30 -3.90 ULMN 3 2odj_o00 PORIN D user 8 3 # 8 A 156 HIS B 258 HIS^? 1000.00 A 208 ASP B 69 ASP~? 1000.00 A 296 SER B 185 SER~? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 -14.61 55.49 -34.67 -14.73 54.17 -36.30 coo 18.47 29.19 29.68 19.30 29.17 27.75 -3.24 63.62 -31.80 -1.56 62.34 -31.63 coo 6.89 17.22 46.63 5.08 16.21 47.91 -21.68 60.93 -14.68 -20.41 58.94 -14.15 2odj_o00 source 2ODJ PORIN D : 8 hits 2odj_o00 naa= 3 ULMN 3 2odj_o01 PORIN D user 1 3 # 1 B 156 HIS A 176 HIS~? 1000.00 B 208 ASP A 171 ASP.? 1000.00 B 296 SER A 151 SER.? 1000.00 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 36.72 54.39 -20.35 38.41 55.64 -20.64 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 17.70 41.87 -24.64 15.49 41.01 -23.98 ULMN 3 2odj_o01 PORIN D user 2 3 # 2 B 156 HIS A 176 HIS~? 1000.00 B 208 ASP A 226 ASP~? 1000.00 B 296 SER A 236 SER.? 1000.00 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 40.29 42.17 -25.19 41.57 43.60 -26.04 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 30.12 41.11 -36.46 28.02 41.19 -36.22 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 41.86 63.23 -33.55 42.01 65.65 -33.24 ULMN 3 2odj_o01 PORIN D user 3 3 # 3 B 156 HIS A 179 HIS~? 1000.00 B 208 ASP A 171 ASP.? 1000.00 B 296 SER A 154 SER~? 1000.00 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 36.72 54.39 -20.35 38.41 55.64 -20.64 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 13.11 45.91 -19.64 15.16 45.40 -18.51 ULMN 3 2odj_o01 PORIN D user 4 3 # 4 B 156 HIS A 258 HIS^? 1000.00 B 208 ASP A 69 ASP~? 1000.00 B 296 SER A 185 SER~? 1000.00 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 43.13 56.70 -29.91 45.18 56.51 -30.28 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 36.79 67.01 -23.90 37.87 67.50 -22.12 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 24.33 45.74 -27.14 24.89 45.34 -24.82 ULMN 3 2odj_o01 PORIN D user 5 3 # 5 B 156 HIS B 126 HIS.? 1000.00 B 208 ASP A 103 ASP.? 1000.00 B 296 SER A 121 SER~? 1000.00 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 4.52 66.06 -17.34 5.49 64.29 -17.91 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 14.64 65.30 -26.26 14.43 63.48 -27.31 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 22.74 60.44 -6.78 23.90 60.97 -4.72 ULMN 3 2odj_o01 PORIN D user 6 3 # 6 B 156 HIS B 176 HIS~? 1000.00 B 208 ASP B 171 ASP.? 1000.00 B 296 SER B 151 SER.? 1000.00 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 -22.74 61.81 -6.90 -22.89 62.92 -4.74 ULMN 3 2odj_o01 PORIN D user 7 3 # 7 B 156 HIS B 176 HIS~? 1000.00 B 208 ASP B 226 ASP~? 1000.00 B 296 SER B 236 SER^? 1000.00 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 -21.58 46.84 -24.01 -21.23 47.14 -26.06 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 -31.03 58.88 -21.73 -30.98 60.38 -20.22 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 -13.40 61.82 -38.71 -11.69 62.84 -40.02 ULMN 3 2odj_o01 PORIN D user 8 3 # 8 B 156 HIS B 179 HIS~? 1000.00 B 208 ASP B 171 ASP.? 1000.00 B 296 SER B 154 SER~? 1000.00 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 -16.51 65.30 -3.22 -15.28 63.30 -3.90 2odj_o01 source 2ODJ PORIN D : 8 hits 2odj_o01 naa= 3 ULMN 3 2qs9_o01 RETINOBLASTOMA-BINDING PROTEIN 9 user 1 3 # 1 B 75 SER A 174 SER.? 1000.00 B 138 ASP A 216 ASP.? 1000.00 B 165 HIS A 176 HIS~? 1000.00 coo 6.59 48.30 3.28 6.43 48.98 5.63 39.69 47.27 -21.33 40.40 49.18 -20.03 coo 13.13 55.06 6.15 11.38 53.90 6.43 44.82 46.44 -29.25 46.02 48.15 -29.05 coo 7.83 53.78 5.96 7.73 51.68 6.00 40.29 42.17 -25.19 41.57 43.60 -26.04 2qs9_o01 source 2QS9 RETINOBLASTOMA-BINDING PROTEIN 9 : 1 hits 2qs9_o01 naa= 3 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 1 3 # 1 A 130 SER A 174 SER.? 1000.00 A 166 PHE A 205 PHE^? 1000.00 A 182 PHE A 220 PHE~? 1000.00 coo -46.28 37.24 81.97 -44.96 39.32 82.40 39.69 47.27 -21.33 40.40 49.18 -20.03 coo -36.62 39.62 84.60 -38.76 41.24 85.25 39.74 53.37 -27.06 40.86 53.29 -29.62 coo -36.55 45.66 79.22 -38.34 43.94 80.53 37.14 49.75 -33.03 36.85 51.68 -31.02 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 2 3 # 2 A 130 SER A 236 SER.? 1000.00 A 166 PHE A 205 PHE^? 1000.00 A 182 PHE A 220 PHE~? 1000.00 coo -46.28 37.24 81.97 -44.96 39.32 82.40 41.86 63.23 -33.55 42.01 65.65 -33.24 coo -36.62 39.62 84.60 -38.76 41.24 85.25 39.74 53.37 -27.06 40.86 53.29 -29.62 coo -36.55 45.66 79.22 -38.34 43.94 80.53 37.14 49.75 -33.03 36.85 51.68 -31.02 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 3 3 # 3 A 130 SER B 236 SER^? 1000.00 A 166 PHE B 205 PHE^? 1000.00 A 182 PHE B 220 PHE~? 1000.00 coo -46.28 37.24 81.97 -44.96 39.32 82.40 -13.40 61.82 -38.71 -11.69 62.84 -40.02 coo -36.62 39.62 84.60 -38.76 41.24 85.25 -15.10 54.57 -29.64 -16.85 54.62 -31.84 coo -36.55 45.66 79.22 -38.34 43.94 80.53 -21.98 57.13 -29.07 -19.25 57.39 -28.59 2r11_o00 source 2R11 CARBOXYLESTERASE NP : 3 hits 2r11_o00 naa= 3 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 1 3 # 1 B 130 SER A 174 SER.? 1000.00 B 166 PHE A 205 PHE^? 1000.00 B 182 PHE A 220 PHE~? 1000.00 coo -19.94 46.29 97.83 -22.38 46.56 97.60 39.69 47.27 -21.33 40.40 49.18 -20.03 coo -29.59 43.40 95.66 -28.22 45.54 94.50 39.74 53.37 -27.06 40.86 53.29 -29.62 coo -32.72 50.15 98.46 -30.32 48.85 97.77 37.14 49.75 -33.03 36.85 51.68 -31.02 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 2 3 # 2 B 130 SER A 236 SER.? 1000.00 B 166 PHE A 205 PHE^? 1000.00 B 182 PHE A 220 PHE~? 1000.00 coo -19.94 46.29 97.83 -22.38 46.56 97.60 41.86 63.23 -33.55 42.01 65.65 -33.24 coo -29.59 43.40 95.66 -28.22 45.54 94.50 39.74 53.37 -27.06 40.86 53.29 -29.62 coo -32.72 50.15 98.46 -30.32 48.85 97.77 37.14 49.75 -33.03 36.85 51.68 -31.02 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 3 3 # 3 B 130 SER B 236 SER^? 1000.00 B 166 PHE B 205 PHE^? 1000.00 B 182 PHE B 220 PHE~? 1000.00 coo -19.94 46.29 97.83 -22.38 46.56 97.60 -13.40 61.82 -38.71 -11.69 62.84 -40.02 coo -29.59 43.40 95.66 -28.22 45.54 94.50 -15.10 54.57 -29.64 -16.85 54.62 -31.84 coo -32.72 50.15 98.46 -30.32 48.85 97.77 -21.98 57.13 -29.07 -19.25 57.39 -28.59 2r11_o01 source 2R11 CARBOXYLESTERASE NP : 3 hits 2r11_o01 naa= 3 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 1 3 # 1 C 130 SER A 174 SER.? 1000.00 C 166 PHE A 205 PHE^? 1000.00 C 182 PHE A 220 PHE~? 1000.00 coo -2.19 64.27 51.12 -3.34 62.10 50.60 39.69 47.27 -21.33 40.40 49.18 -20.03 coo -11.14 61.91 46.89 -9.88 60.30 48.76 39.74 53.37 -27.06 40.86 53.29 -29.62 coo -7.71 55.92 42.70 -7.18 57.60 44.85 37.14 49.75 -33.03 36.85 51.68 -31.02 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 2 3 # 2 C 130 SER A 236 SER.? 1000.00 C 166 PHE A 205 PHE^? 1000.00 C 182 PHE A 220 PHE~? 1000.00 coo -2.19 64.27 51.12 -3.34 62.10 50.60 41.86 63.23 -33.55 42.01 65.65 -33.24 coo -11.14 61.91 46.89 -9.88 60.30 48.76 39.74 53.37 -27.06 40.86 53.29 -29.62 coo -7.71 55.92 42.70 -7.18 57.60 44.85 37.14 49.75 -33.03 36.85 51.68 -31.02 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 3 3 # 3 C 130 SER B 236 SER^? 1000.00 C 166 PHE B 205 PHE^? 1000.00 C 182 PHE B 220 PHE~? 1000.00 coo -2.19 64.27 51.12 -3.34 62.10 50.60 -13.40 61.82 -38.71 -11.69 62.84 -40.02 coo -11.14 61.91 46.89 -9.88 60.30 48.76 -15.10 54.57 -29.64 -16.85 54.62 -31.84 coo -7.71 55.92 42.70 -7.18 57.60 44.85 -21.98 57.13 -29.07 -19.25 57.39 -28.59 2r11_o02 source 2R11 CARBOXYLESTERASE NP : 3 hits 2r11_o02 naa= 3 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 1 3 # 1 D 130 SER A 236 SER.? 1000.00 D 166 PHE A 205 PHE^? 1000.00 D 182 PHE A 220 PHE~? 1000.00 coo -32.42 55.27 46.18 -30.51 54.94 47.67 41.86 63.23 -33.55 42.01 65.65 -33.24 coo -23.62 58.20 50.84 -23.76 56.14 48.96 39.74 53.37 -27.06 40.86 53.29 -29.62 coo -23.08 51.44 54.96 -24.43 52.71 52.88 37.14 49.75 -33.03 36.85 51.68 -31.02 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 2 3 # 2 D 130 SER B 236 SER^? 1000.00 D 166 PHE B 205 PHE^? 1000.00 D 182 PHE B 220 PHE~? 1000.00 coo -32.42 55.27 46.18 -30.51 54.94 47.67 -13.40 61.82 -38.71 -11.69 62.84 -40.02 coo -23.62 58.20 50.84 -23.76 56.14 48.96 -15.10 54.57 -29.64 -16.85 54.62 -31.84 coo -23.08 51.44 54.96 -24.43 52.71 52.88 -21.98 57.13 -29.07 -19.25 57.39 -28.59 2r11_o03 source 2R11 CARBOXYLESTERASE NP : 2 hits 2r11_o03 naa= 3 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 180 ASP~? 1000.00 A 86 HIS A 179 HIS~? 1000.00 A 250 ALA A 218 ALA~? 1000.00 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 40.41 44.46 -31.53 40.92 43.32 -30.64 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP B 180 ASP~? 1000.00 A 86 HIS B 179 HIS~? 1000.00 A 250 ALA B 218 ALA~? 1000.00 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 -24.24 51.06 -28.15 -23.94 49.76 -27.45 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o00 naa= 3 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 B 49 ASP A 180 ASP~? 1000.00 B 86 HIS A 179 HIS~? 1000.00 B 250 ALA A 218 ALA~? 1000.00 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 40.41 44.46 -31.53 40.92 43.32 -30.64 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 B 49 ASP B 180 ASP~? 1000.00 B 86 HIS B 179 HIS~? 1000.00 B 250 ALA B 218 ALA~? 1000.00 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 -24.24 51.06 -28.15 -23.94 49.76 -27.45 2wwt_o01 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o01 naa= 3 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 C 49 ASP A 180 ASP~? 1000.00 C 86 HIS A 179 HIS~? 1000.00 C 250 ALA A 218 ALA~? 1000.00 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 40.41 44.46 -31.53 40.92 43.32 -30.64 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 C 49 ASP B 180 ASP~? 1000.00 C 86 HIS B 179 HIS~? 1000.00 C 250 ALA B 218 ALA~? 1000.00 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 -24.24 51.06 -28.15 -23.94 49.76 -27.45 2wwt_o02 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o02 naa= 3 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 D 49 ASP A 180 ASP~? 1000.00 D 86 HIS A 179 HIS~? 1000.00 D 250 ALA A 218 ALA~? 1000.00 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 31.16 39.15 -28.07 29.29 38.21 -28.51 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 36.05 43.80 -26.83 37.70 44.95 -26.27 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 40.41 44.46 -31.53 40.92 43.32 -30.64 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 D 49 ASP B 180 ASP~? 1000.00 D 86 HIS B 179 HIS~? 1000.00 D 250 ALA B 218 ALA~? 1000.00 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 -24.24 51.06 -28.15 -23.94 49.76 -27.45 2wwt_o03 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o03 naa= 3 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 E 49 ASP A 180 ASP~? 1000.00 E 86 HIS A 179 HIS~? 1000.00 E 250 ALA A 218 ALA~? 1000.00 coo -36.18 24.97 18.78 -36.93 26.11 17.11 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -36.85 29.32 15.06 -38.90 29.14 15.48 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -44.49 29.68 13.98 -43.47 28.67 13.52 40.41 44.46 -31.53 40.92 43.32 -30.64 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 E 49 ASP B 180 ASP~? 1000.00 E 86 HIS B 179 HIS~? 1000.00 E 250 ALA B 218 ALA~? 1000.00 coo -36.18 24.97 18.78 -36.93 26.11 17.11 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -36.85 29.32 15.06 -38.90 29.14 15.48 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -44.49 29.68 13.98 -43.47 28.67 13.52 -24.24 51.06 -28.15 -23.94 49.76 -27.45 2wwt_o04 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o04 naa= 3 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 F 49 ASP A 180 ASP~? 1000.00 F 86 HIS A 179 HIS~? 1000.00 F 250 ALA A 218 ALA~? 1000.00 coo -82.12 8.55 35.60 -81.93 9.84 37.19 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -84.21 11.81 39.90 -82.43 12.70 39.26 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -78.49 17.13 41.31 -79.25 15.85 41.61 40.41 44.46 -31.53 40.92 43.32 -30.64 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 F 49 ASP B 180 ASP~? 1000.00 F 86 HIS B 179 HIS~? 1000.00 F 250 ALA B 218 ALA~? 1000.00 coo -82.12 8.55 35.60 -81.93 9.84 37.19 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -84.21 11.81 39.90 -82.43 12.70 39.26 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -78.49 17.13 41.31 -79.25 15.85 41.61 -24.24 51.06 -28.15 -23.94 49.76 -27.45 2wwt_o05 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o05 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 85 GLU^? 1000.00 A 44 ASP A 171 ASP.? 1000.00 A 50 THR A 204 THR^? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 27.14 56.96 -21.30 28.32 57.46 -19.62 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 36.72 54.39 -20.35 38.41 55.64 -20.64 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 36.15 56.61 -26.72 36.22 58.33 -25.43 ULMN 3 3hde_o00 LYSOZYME user 2 3 # 2 A 35 GLU A 120 GLU~? 1000.00 A 44 ASP A 109 ASP^? 1000.00 A 50 THR A 108 THR^? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 19.22 58.37 -9.01 17.46 57.61 -9.85 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 26.11 51.15 -14.55 28.22 50.86 -14.82 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 22.95 52.60 -17.54 22.34 51.73 -19.44 ULMN 3 3hde_o00 LYSOZYME user 3 3 # 3 A 35 GLU B 85 GLU^? 1000.00 A 44 ASP B 171 ASP.? 1000.00 A 50 THR B 204 THR^? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 -12.74 58.88 -28.08 -10.74 59.59 -28.28 ULMN 3 3hde_o00 LYSOZYME user 4 3 # 4 A 35 GLU B 120 GLU~? 1000.00 A 44 ASP B 109 ASP^? 1000.00 A 50 THR B 108 THR^? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -1.89 62.61 -7.03 -2.47 61.78 -5.12 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 -10.25 61.25 -11.92 -12.28 61.95 -12.25 3hde_o00 source 3HDE LYSOZYME : 4 hits 3hde_o00 naa= 3 ULMN 3 3hde_o01 LYSOZYME user 1 3 # 1 B 35 GLU A 85 GLU^? 1000.00 B 44 ASP A 171 ASP.? 1000.00 B 50 THR A 204 THR^? 1000.00 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 27.14 56.96 -21.30 28.32 57.46 -19.62 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 36.72 54.39 -20.35 38.41 55.64 -20.64 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 36.15 56.61 -26.72 36.22 58.33 -25.43 ULMN 3 3hde_o01 LYSOZYME user 2 3 # 2 B 35 GLU A 120 GLU~? 1000.00 B 44 ASP A 109 ASP^? 1000.00 B 50 THR A 108 THR^? 1000.00 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 19.22 58.37 -9.01 17.46 57.61 -9.85 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 26.11 51.15 -14.55 28.22 50.86 -14.82 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 22.95 52.60 -17.54 22.34 51.73 -19.44 ULMN 3 3hde_o01 LYSOZYME user 3 3 # 3 B 35 GLU B 85 GLU^? 1000.00 B 44 ASP B 171 ASP.? 1000.00 B 50 THR B 204 THR^? 1000.00 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 -12.74 58.88 -28.08 -10.74 59.59 -28.28 ULMN 3 3hde_o01 LYSOZYME user 4 3 # 4 B 35 GLU B 120 GLU~? 1000.00 B 44 ASP B 109 ASP^? 1000.00 B 50 THR B 108 THR^? 1000.00 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -1.89 62.61 -7.03 -2.47 61.78 -5.12 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 -10.25 61.25 -11.92 -12.28 61.95 -12.25 3hde_o01 source 3HDE LYSOZYME : 4 hits 3hde_o01 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU A 120 GLU~? 1000.00 C 44 ASP A 109 ASP^? 1000.00 C 50 THR A 108 THR^? 1000.00 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 19.22 58.37 -9.01 17.46 57.61 -9.85 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 26.11 51.15 -14.55 28.22 50.86 -14.82 coo 25.48 4.87 1.60 23.90 4.95 0.15 22.95 52.60 -17.54 22.34 51.73 -19.44 ULMN 3 3hde_o02 LYSOZYME user 2 3 # 2 C 35 GLU B 85 GLU^? 1000.00 C 44 ASP B 171 ASP.? 1000.00 C 50 THR B 204 THR^? 1000.00 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 -9.78 62.16 -18.27 -7.90 61.87 -19.25 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -10.01 54.17 -24.64 -9.83 53.41 -26.64 coo 25.48 4.87 1.60 23.90 4.95 0.15 -12.74 58.88 -28.08 -10.74 59.59 -28.28 ULMN 3 3hde_o02 LYSOZYME user 3 3 # 3 C 35 GLU B 120 GLU~? 1000.00 C 44 ASP B 109 ASP^? 1000.00 C 50 THR B 108 THR^? 1000.00 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 -1.89 62.61 -7.03 -2.47 61.78 -5.12 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -8.78 56.88 -12.11 -8.97 55.48 -13.69 coo 25.48 4.87 1.60 23.90 4.95 0.15 -10.25 61.25 -11.92 -12.28 61.95 -12.25 3hde_o02 source 3HDE LYSOZYME : 3 hits 3hde_o02 naa= 3 ULMN 3 3nwu_o00 SERINE PROTEASE HTRA1 user 1 3 # 1 A 220 HIS B 207 HIS.? 1000.00 A 250 ASP B 216 ASP~? 1000.00 A 328 SER B 174 SER.? 1000.00 coo -31.63 42.33 -9.10 -32.09 43.47 -7.39 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -28.83 47.26 -8.07 -29.71 45.89 -9.37 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -31.38 44.75 -19.08 -33.61 43.88 -19.06 -15.19 48.74 -23.97 -12.89 48.81 -23.13 3nwu_o00 source 3NWU SERINE PROTEASE HTRA1 : 1 hits 3nwu_o00 naa= 3 ULMN 3 3nwu_o01 SERINE PROTEASE HTRA1 user 1 3 # 1 B 220 HIS A 179 HIS~? 1000.00 B 250 ASP A 180 ASP~? 1000.00 B 328 SER A 185 SER~? 1000.00 coo -60.95 64.74 -17.31 -62.53 64.43 -18.66 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -61.22 67.85 -22.15 -60.12 66.82 -20.67 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -50.80 64.58 -18.50 -51.05 62.31 -17.80 24.33 45.74 -27.14 24.89 45.34 -24.82 ULMN 3 3nwu_o01 SERINE PROTEASE HTRA1 user 2 3 # 2 B 220 HIS B 179 HIS~? 1000.00 B 250 ASP B 180 ASP~? 1000.00 B 328 SER B 185 SER~? 1000.00 coo -60.95 64.74 -17.31 -62.53 64.43 -18.66 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -61.22 67.85 -22.15 -60.12 66.82 -20.67 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -50.80 64.58 -18.50 -51.05 62.31 -17.80 -21.68 60.93 -14.68 -20.41 58.94 -14.15 ULMN 3 3nwu_o01 SERINE PROTEASE HTRA1 user 3 3 # 3 B 220 HIS B 207 HIS.? 1000.00 B 250 ASP B 216 ASP~? 1000.00 B 328 SER B 174 SER.? 1000.00 coo -60.95 64.74 -17.31 -62.53 64.43 -18.66 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -61.22 67.85 -22.15 -60.12 66.82 -20.67 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -50.80 64.58 -18.50 -51.05 62.31 -17.80 -15.19 48.74 -23.97 -12.89 48.81 -23.13 3nwu_o01 source 3NWU SERINE PROTEASE HTRA1 : 3 hits 3nwu_o01 naa= 3 ULMN 3 3nwu_o02 SERINE PROTEASE HTRA1 user 1 3 # 1 C 220 HIS A 179 HIS~? 1000.00 C 250 ASP A 180 ASP~? 1000.00 C 328 SER A 185 SER~? 1000.00 coo -51.93 36.48 -40.55 -50.74 34.79 -40.19 36.05 43.80 -26.83 37.70 44.95 -26.27 coo -46.79 36.05 -43.01 -48.32 37.22 -42.10 31.16 39.15 -28.07 29.29 38.21 -28.51 coo -50.01 46.48 -39.48 -50.98 46.14 -37.32 24.33 45.74 -27.14 24.89 45.34 -24.82 ULMN 3 3nwu_o02 SERINE PROTEASE HTRA1 user 2 3 # 2 C 220 HIS B 179 HIS~? 1000.00 C 250 ASP B 180 ASP~? 1000.00 C 328 SER B 185 SER~? 1000.00 coo -51.93 36.48 -40.55 -50.74 34.79 -40.19 -21.96 51.60 -22.33 -20.77 50.80 -23.86 coo -46.79 36.05 -43.01 -48.32 37.22 -42.10 -26.29 53.00 -17.37 -27.58 54.12 -16.14 coo -50.01 46.48 -39.48 -50.98 46.14 -37.32 -21.68 60.93 -14.68 -20.41 58.94 -14.15 ULMN 3 3nwu_o02 SERINE PROTEASE HTRA1 user 3 3 # 3 C 220 HIS B 207 HIS.? 1000.00 C 250 ASP B 216 ASP~? 1000.00 C 328 SER B 174 SER.? 1000.00 coo -51.93 36.48 -40.55 -50.74 34.79 -40.19 -14.18 49.88 -34.42 -15.60 48.73 -35.45 coo -46.79 36.05 -43.01 -48.32 37.22 -42.10 -19.23 49.40 -32.78 -18.00 47.70 -33.08 coo -50.01 46.48 -39.48 -50.98 46.14 -37.32 -15.19 48.74 -23.97 -12.89 48.81 -23.13 3nwu_o02 source 3NWU SERINE PROTEASE HTRA1 : 3 hits 3nwu_o02 naa= 3 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 1 3 # 1 H 28 VAL A 105 VAL^? 1000.00 H 117 LYS A 81 LYS.? 1000.00 H 150 CYH A 84 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 19.35 60.54 -21.42 21.17 61.62 -20.93 coo 38.01 32.08 28.20 39.46 29.85 23.57 18.76 63.56 -29.56 21.14 63.10 -34.87 coo 41.19 29.62 18.76 39.21 28.51 20.32 21.98 56.01 -24.01 21.70 53.26 -23.68 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 2 3 # 2 H 28 VAL B 30 VAL^? 1000.00 H 117 LYS A 142 LYS^? 1000.00 H 150 CYH A 158 CYH~? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 6.89 54.25 -19.46 8.36 55.73 -18.79 coo 38.01 32.08 28.20 39.46 29.85 23.57 16.76 57.98 -16.13 11.82 58.93 -17.29 coo 41.19 29.62 18.76 39.21 28.51 20.32 11.39 51.64 -18.24 12.62 50.20 -16.29 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 3 3 # 3 H 28 VAL B 105 VAL^? 1000.00 H 117 LYS B 81 LYS.? 1000.00 H 150 CYH B 84 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 -8.18 70.46 -14.81 -6.94 69.66 -16.47 coo 38.01 32.08 28.20 39.46 29.85 23.57 -11.97 76.30 -19.94 -15.62 76.75 -24.03 coo 41.19 29.62 18.76 39.21 28.51 20.32 -12.63 67.19 -16.08 -14.23 65.55 -14.52 3uao_o07 source 3UAO PUTATIVE ISOCHORISMATASE : 3 hits 3uao_o07 naa= 3