*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 86 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 68.86 12.45 19.04 67.57 12.48 20.71 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 64.74 13.84 22.58 64.60 13.48 24.65 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 68.63 22.07 21.16 67.50 22.56 22.86 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 65.85 25.32 24.26 66.00 24.92 26.31 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 # 3 A 49 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 86 HIS A 76 HIS^? 9.12 O1 EDO A 189 A 250 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 63.41 29.58 11.55 64.59 31.41 11.51 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 65.00 24.12 7.67 66.83 23.12 7.94 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 4 3 # 4 A 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 60.01 27.52 25.19 61.63 28.83 24.67 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 65.85 25.32 24.26 66.00 24.92 26.31 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 # 5 A 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 60.01 27.52 25.19 61.63 28.83 24.67 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 65.85 25.32 24.26 66.00 24.92 26.31 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 6 3 # 6 A 49 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 86 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 # 7 A 49 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 48.58 -0.77 -33.67 48.18 -1.29 -35.04 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 8 3 # 8 A 49 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 86 HIS B 76 HIS^? 9.10 C1 EDO B 189 A 250 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 9 3 # 9 A 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 10 3 # 10 A 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 48.58 -0.77 -33.67 48.18 -1.29 -35.04 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 10 hits 2wwt_o00 naa= 3 ULMN 5 2dln_c00 D-ALANINE--D-ALANINE LIGASE user 1 5 # 1 15 GLU B 69 GLU.? -7.04 C2 EDO B 191s 150 SER B 68 SER^? -5.55 O2 EDO B 191s 216 TYR B 45 TYR^? 7.97 C2 EDO A 190 255 ARG B 40 ARG.? -5.91 C2 EDO B 188s 276 GLY B 42 GLY.? 7.35 O1 EDO B 191 coo 18.72 1.95 50.27 17.22 2.99 49.29 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 20.89 3.58 46.02 20.41 4.18 48.30 47.96 6.58 -6.86 46.83 4.83 -8.08 coo 25.64 7.68 49.08 22.95 7.02 48.68 44.36 10.34 -9.27 42.37 11.49 -10.86 coo 15.80 13.82 43.70 16.77 10.99 44.40 35.46 3.15 -9.11 34.69 4.91 -11.54 coo 18.03 11.13 50.74 17.53 11.78 50.39 38.20 8.45 -1.85 38.82 8.13 -2.23 2dln_c00 source 2dln D-ALANINE--D-ALANINE LIGASE : 1 hits 2dln_c00 naa= 5 ULMN 4 1a7u_c04 CHLOROPEROXIDASE T user 1 4 # 1 A 140 ALA A 137 ALA.? 12.86 O4 MPD A 191 A 141 PRO A 136 PRO.? 12.80 C5 MPD A 191 A 228 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 257 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo -3.17 33.71 41.15 -2.19 32.81 40.39 49.24 26.05 6.15 48.26 26.83 6.95 coo -4.29 30.56 43.91 -3.25 32.54 44.01 46.46 23.22 3.29 48.00 22.47 4.76 coo 2.03 38.95 28.44 3.60 38.60 29.83 63.41 29.58 11.55 64.59 31.41 11.51 coo 6.85 37.62 29.99 7.50 38.47 31.78 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 4 1a7u_c04 CHLOROPEROXIDASE T user 2 4 # 2 A 140 ALA B 137 ALA.? 6.78 O2 EDO B 191 A 141 PRO B 136 PRO.? 5.70 O2 EDO B 191 A 228 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 257 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo -3.17 33.71 41.15 -2.19 32.81 40.39 42.66 4.25 -14.83 41.35 3.51 -14.95 coo -4.29 30.56 43.91 -3.25 32.54 44.01 42.15 6.73 -10.98 42.45 7.79 -12.95 coo 2.03 38.95 28.44 3.60 38.60 29.83 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 6.85 37.62 29.99 7.50 38.47 31.78 54.34 6.71 -25.28 55.69 7.78 -26.49 1a7u_c04 source 1a7u CHLOROPEROXIDASE T : 2 hits 1a7u_c04 naa= 4 ULMN 4 1a7u_c05 CHLOROPEROXIDASE T user 1 4 # 1 B 140 ALA A 36 ALA^? 9.26 O2 EDO A 190 B 141 PRO A 37 PRO^? 11.02 O2 EDO A 190 B 228 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 257 HIS A 65 HIS^? 6.20 C1 EDO A 189 coo 25.73 54.94 3.35 27.07 55.54 3.80 45.24 15.21 0.88 45.56 15.37 2.38 coo 25.81 51.10 5.29 24.88 53.11 5.69 41.00 15.98 1.31 42.78 17.08 0.49 coo 31.11 65.98 -3.92 31.07 66.41 -1.82 57.58 16.65 0.08 56.71 16.10 -1.78 coo 32.76 68.02 0.70 31.21 68.44 2.05 58.30 21.39 -1.16 58.14 22.03 -3.16 ULMN 4 1a7u_c05 CHLOROPEROXIDASE T user 2 4 # 2 B 140 ALA A 137 ALA.? 12.86 O4 MPD A 191 B 141 PRO A 136 PRO.? 12.80 C5 MPD A 191 B 228 ASP A 87 ASP^? 16.43 O1 EDO A 189 B 257 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 25.73 54.94 3.35 27.07 55.54 3.80 49.24 26.05 6.15 48.26 26.83 6.95 coo 25.81 51.10 5.29 24.88 53.11 5.69 46.46 23.22 3.29 48.00 22.47 4.76 coo 31.11 65.98 -3.92 31.07 66.41 -1.82 63.41 29.58 11.55 64.59 31.41 11.51 coo 32.76 68.02 0.70 31.21 68.44 2.05 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 4 1a7u_c05 CHLOROPEROXIDASE T user 3 4 # 3 B 140 ALA B 36 ALA^? 10.06 O2 EDO B 188 B 141 PRO B 37 PRO^? 9.96 O2 EDO B 188 B 228 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 257 HIS B 65 HIS^? -5.26 O1 EDO B 189s coo 25.73 54.94 3.35 27.07 55.54 3.80 42.34 14.94 -8.03 41.67 14.78 -9.42 coo 25.81 51.10 5.29 24.88 53.11 5.69 38.66 14.02 -5.77 40.65 13.02 -6.27 coo 31.11 65.98 -3.92 31.07 66.41 -1.82 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 32.76 68.02 0.70 31.21 68.44 2.05 54.13 9.12 -14.50 55.15 8.45 -12.80 ULMN 4 1a7u_c05 CHLOROPEROXIDASE T user 4 4 # 4 B 140 ALA B 137 ALA.? 6.78 O2 EDO B 191 B 141 PRO B 136 PRO.? 5.70 O2 EDO B 191 B 228 ASP B 87 ASP^? 16.44 C1 EDO B 189 B 257 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 25.73 54.94 3.35 27.07 55.54 3.80 42.66 4.25 -14.83 41.35 3.51 -14.95 coo 25.81 51.10 5.29 24.88 53.11 5.69 42.15 6.73 -10.98 42.45 7.79 -12.95 coo 31.11 65.98 -3.92 31.07 66.41 -1.82 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 32.76 68.02 0.70 31.21 68.44 2.05 54.34 6.71 -25.28 55.69 7.78 -26.49 1a7u_c05 source 1a7u CHLOROPEROXIDASE T : 4 hits 1a7u_c05 naa= 4 ULMN 4 1apt_c06 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 4 # 1 E 33 ASP A 151 ASP^? 20.35 CM MPD A 191 E 36 SER A 153 SER.? 20.01 CM MPD A 191 E 75 TYR A 155 TYR^? 14.94 CM MPD A 191 E 213 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 26.30 12.96 16.78 25.46 12.99 18.72 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 28.33 15.15 21.27 28.70 13.12 19.97 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 26.74 7.85 22.76 28.93 8.53 21.17 50.44 4.00 23.33 52.91 2.96 24.17 coo 20.15 16.04 19.79 21.65 14.49 19.86 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 1apt_c06 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 2 4 # 2 E 33 ASP B 151 ASP^? -3.26 O1 EDO B 192s E 36 SER B 153 SER.? -3.11 C2 EDO B 192s E 75 TYR B 155 TYR^? 6.08 O1 EDO B 193 E 213 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 26.30 12.96 16.78 25.46 12.99 18.72 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 28.33 15.15 21.27 28.70 13.12 19.97 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 26.74 7.85 22.76 28.93 8.53 21.17 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 20.15 16.04 19.79 21.65 14.49 19.86 28.45 32.01 -35.99 29.78 33.29 -34.96 1apt_c06 source 1apt ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET (LYSTA IS : 2 hits 1apt_c06 naa= 4 ULMN 4 1avf_c06 GASTRICSIN user 1 4 # 1 J 32 ASP A 151 ASP^? 20.35 CM MPD A 191 J 35 SER A 153 SER.? 20.01 CM MPD A 191 J 75 TYR A 147 TYR^? 9.49 CM MPD A 191 J 217 ASP A 122 ASP.? 22.97 CM MPD A 191 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 48.38 -3.74 26.58 47.39 -3.82 24.70 coo -40.93 -20.91 21.81 -38.85 -21.36 20.65 50.18 -2.46 21.39 48.57 -4.23 21.02 coo -41.81 -30.90 17.10 -43.71 -28.85 16.83 50.88 9.76 23.94 51.01 10.64 21.28 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 51.13 -1.78 31.54 51.32 -3.14 29.91 1avf_c06 source 1avf GASTRICSIN : 1 hits 1avf_c06 naa= 4 ULMN 4 1bbs_c02 RENIN user 1 4 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 218 ALA A 121 ALA.? 23.17 O2 MPD A 191 coo 61.19 45.85 78.73 62.86 45.48 77.48 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 66.00 46.17 80.29 64.31 47.92 79.91 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 63.61 40.10 74.06 64.05 42.07 74.70 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 61.04 42.48 71.22 62.11 41.40 71.19 55.03 1.03 31.09 55.51 0.72 32.45 ULMN 4 1bbs_c02 RENIN user 2 4 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 218 ALA B 121 ALA.? 10.61 O2 EDO B 193 coo 61.19 45.85 78.73 62.86 45.48 77.48 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 66.00 46.17 80.29 64.31 47.92 79.91 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 63.61 40.10 74.06 64.05 42.07 74.70 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 61.04 42.48 71.22 62.11 41.40 71.19 31.28 28.91 -38.38 30.52 28.99 -39.66 1bbs_c02 source 1bbs RENIN : 2 hits 1bbs_c02 naa= 4 ULMN 4 1bbs_c03 RENIN user 1 4 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 218 ALA A 121 ALA.? 23.17 O2 MPD A 191 coo 61.19 45.85 78.73 62.86 45.48 77.48 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 66.00 46.17 80.29 64.31 47.92 79.91 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 63.61 40.10 74.06 64.05 42.07 74.70 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 61.04 42.48 71.22 62.11 41.40 71.19 55.03 1.03 31.09 55.51 0.72 32.45 ULMN 4 1bbs_c03 RENIN user 2 4 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 218 ALA B 121 ALA.? 10.61 O2 EDO B 193 coo 61.19 45.85 78.73 62.86 45.48 77.48 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 66.00 46.17 80.29 64.31 47.92 79.91 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 63.61 40.10 74.06 64.05 42.07 74.70 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 61.04 42.48 71.22 62.11 41.40 71.19 31.28 28.91 -38.38 30.52 28.99 -39.66 1bbs_c03 source 1bbs RENIN : 2 hits 1bbs_c03 naa= 4 ULMN 4 1bbs_c08 RENIN user 1 4 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 75 TYR A 155 TYR^? 14.94 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 61.19 45.85 78.73 62.86 45.48 77.48 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 66.00 46.17 80.29 64.31 47.92 79.91 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 65.68 50.76 74.77 64.63 51.40 77.28 50.44 4.00 23.33 52.91 2.96 24.17 coo 63.61 40.10 74.06 64.05 42.07 74.70 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 1bbs_c08 RENIN user 2 4 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 75 TYR B 155 TYR^? 6.08 O1 EDO B 193 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 61.19 45.85 78.73 62.86 45.48 77.48 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 66.00 46.17 80.29 64.31 47.92 79.91 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 65.68 50.76 74.77 64.63 51.40 77.28 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 63.61 40.10 74.06 64.05 42.07 74.70 28.45 32.01 -35.99 29.78 33.29 -34.96 1bbs_c08 source 1bbs RENIN : 2 hits 1bbs_c08 naa= 4 ULMN 4 1bbs_c09 RENIN user 1 4 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 75 TYR A 155 TYR^? 14.94 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 61.19 45.85 78.73 62.86 45.48 77.48 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 66.00 46.17 80.29 64.31 47.92 79.91 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 65.68 50.76 74.77 64.63 51.40 77.28 50.44 4.00 23.33 52.91 2.96 24.17 coo 63.61 40.10 74.06 64.05 42.07 74.70 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 1bbs_c09 RENIN user 2 4 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 75 TYR B 155 TYR^? 6.08 O1 EDO B 193 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 61.19 45.85 78.73 62.86 45.48 77.48 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 66.00 46.17 80.29 64.31 47.92 79.91 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 65.68 50.76 74.77 64.63 51.40 77.28 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 63.61 40.10 74.06 64.05 42.07 74.70 28.45 32.01 -35.99 29.78 33.29 -34.96 1bbs_c09 source 1bbs RENIN : 2 hits 1bbs_c09 naa= 4 ULMN 4 1bzc_c01 PROTEIN-TYROSINE-PHOSPHATASE user 1 4 # 1 A 181 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 215 CYH A 99 CYH.? 13.00 O4 MPD A 191 A 221 ARG A 129 ARG^? 14.04 O2 MPD A 191 A 222 SER A 142 SER^? 11.36 O4 MPD A 191 coo -20.67 62.35 15.68 -20.16 63.09 17.59 60.01 27.52 25.19 61.63 28.83 24.67 coo -17.06 60.65 8.77 -19.43 59.04 8.89 58.08 21.10 22.79 55.99 22.56 21.69 coo -21.54 63.29 10.68 -19.32 62.77 12.69 54.99 23.34 25.48 52.76 24.40 27.34 coo -21.55 58.95 5.40 -19.23 58.44 5.94 52.28 24.44 20.99 51.62 26.22 22.49 ULMN 4 1bzc_c01 PROTEIN-TYROSINE-PHOSPHATASE user 2 4 # 2 A 181 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 215 CYH B 99 CYH.? 13.42 O2 MPD B 194 A 221 ARG B 129 ARG^? 16.59 O2 MPD B 194 A 222 SER B 142 SER^? 12.79 C3 MPD B 194 coo -20.67 62.35 15.68 -20.16 63.09 17.59 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -17.06 60.65 8.77 -19.43 59.04 8.89 39.68 9.38 -33.42 38.76 7.79 -31.29 coo -21.54 63.29 10.68 -19.32 62.77 12.69 35.59 7.18 -33.96 34.54 5.79 -36.47 coo -21.55 58.95 5.40 -19.23 58.44 5.94 36.25 6.04 -28.61 35.21 4.32 -29.92 1bzc_c01 source 1bzc PROTEIN-TYROSINE-PHOSPHATASE : 2 hits 1bzc_c01 naa= 4 ULMN 4 1cd5_c00 GLUCOSAMINE 6-PHOSPHATE DEAMINASE user 1 4 # 1 A 72 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 141 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 143 HIS A 76 HIS^? 9.12 O1 EDO A 189 A 148 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo 86.21 51.78 11.27 86.87 50.27 12.61 57.58 16.65 0.08 56.71 16.10 -1.78 coo 77.92 48.13 25.32 78.70 49.17 23.61 63.41 29.58 11.55 64.59 31.41 11.51 coo 79.83 48.98 19.95 81.76 49.72 20.33 65.00 24.12 7.67 66.83 23.12 7.94 coo 76.11 54.71 19.44 77.75 55.81 18.59 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 4 1cd5_c00 GLUCOSAMINE 6-PHOSPHATE DEAMINASE user 2 4 # 2 A 72 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 141 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 143 HIS B 76 HIS^? 9.10 C1 EDO B 189 A 148 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo 86.21 51.78 11.27 86.87 50.27 12.61 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 77.92 48.13 25.32 78.70 49.17 23.61 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 79.83 48.98 19.95 81.76 49.72 20.33 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 76.11 54.71 19.44 77.75 55.81 18.59 53.85 11.48 -28.30 55.92 11.40 -28.71 1cd5_c00 source 1cd5 GLUCOSAMINE 6-PHOSPHATE DEAMINASE : 2 hits 1cd5_c00 naa= 4 ULMN 4 1d1q_c00 TYROSINE PHOSPHATASE (E.C.3.1.3.48) user 1 4 # 1 A 13 ALA A 30 ALA^? 9.64 O2 EDO A 189 A 19 ARG A 24 ARG^? 7.27 O2 EDO A 189 A 20 SER A 32 SER^? 8.67 O2 EDO A 189 A 132 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 4.53 4.32 26.47 3.96 3.36 27.51 61.95 9.56 7.70 60.62 9.31 8.43 coo 2.60 -1.55 27.54 1.76 0.32 25.25 63.21 5.10 1.62 63.59 8.06 0.82 coo 6.18 2.66 31.27 5.30 4.91 30.67 57.30 11.17 3.38 55.16 10.90 4.47 coo -1.40 -1.52 24.89 -2.64 -0.24 26.07 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 4 1d1q_c00 TYROSINE PHOSPHATASE (E.C.3.1.3.48) user 2 4 # 2 A 13 ALA A 152 ALA.? 22.18 CM MPD A 191 A 19 ARG A 149 ARG^? 22.01 CM MPD A 191 A 20 SER A 153 SER.? 20.01 CM MPD A 191 A 132 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 4.53 4.32 26.47 3.96 3.36 27.51 52.26 -3.04 24.50 53.03 -4.31 24.24 coo 2.60 -1.55 27.54 1.76 0.32 25.25 53.15 0.69 27.47 54.83 -1.87 27.18 coo 6.18 2.66 31.27 5.30 4.91 30.67 50.18 -2.46 21.39 48.57 -4.23 21.02 coo -1.40 -1.52 24.89 -2.64 -0.24 26.07 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 1d1q_c00 TYROSINE PHOSPHATASE (E.C.3.1.3.48) user 3 4 # 3 A 13 ALA B 152 ALA.? 3.42 O2 EDO B 192s A 19 ARG B 149 ARG^? 5.09 O2 EDO B 193 A 20 SER B 153 SER.? -3.11 C2 EDO B 192s A 132 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 4.53 4.32 26.47 3.96 3.36 27.51 33.73 32.96 -31.05 34.52 34.22 -31.37 coo 2.60 -1.55 27.54 1.76 0.32 25.25 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 6.18 2.66 31.27 5.30 4.91 30.67 33.75 32.64 -27.23 32.53 34.50 -26.24 coo -1.40 -1.52 24.89 -2.64 -0.24 26.07 28.45 32.01 -35.99 29.78 33.29 -34.96 1d1q_c00 source 1d1q TYROSINE PHOSPHATASE (E.C.3.1.3.48) : 3 hits 1d1q_c00 naa= 4 ULMN 4 1d1q_c01 TYROSINE PHOSPHATASE (E.C.3.1.3.48) user 1 4 # 1 B 13 ALA A 152 ALA.? 22.18 CM MPD A 191 B 19 ARG A 149 ARG^? 22.01 CM MPD A 191 B 20 SER A 153 SER.? 20.01 CM MPD A 191 B 132 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 38.65 2.95 14.51 39.11 4.15 13.64 52.26 -3.04 24.50 53.03 -4.31 24.24 coo 42.92 5.91 10.91 43.29 4.74 13.73 53.15 0.69 27.47 54.83 -1.87 27.18 coo 36.38 5.51 10.33 35.80 5.67 12.73 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 45.55 7.51 14.40 44.23 8.91 15.26 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 1d1q_c01 TYROSINE PHOSPHATASE (E.C.3.1.3.48) user 2 4 # 2 B 13 ALA B 152 ALA.? 3.42 O2 EDO B 192s B 19 ARG B 149 ARG^? 5.09 O2 EDO B 193 B 20 SER B 153 SER.? -3.11 C2 EDO B 192s B 132 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 38.65 2.95 14.51 39.11 4.15 13.64 33.73 32.96 -31.05 34.52 34.22 -31.37 coo 42.92 5.91 10.91 43.29 4.74 13.73 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 36.38 5.51 10.33 35.80 5.67 12.73 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 45.55 7.51 14.40 44.23 8.91 15.26 28.45 32.01 -35.99 29.78 33.29 -34.96 1d1q_c01 source 1d1q TYROSINE PHOSPHATASE (E.C.3.1.3.48) : 2 hits 1d1q_c01 naa= 4 ULMN 4 1ddj_c02 PLASMINOGEN user 1 4 # 1 C 603 HIS A 84 HIS.? 23.86 O4 MPD A 191 C 646 ASP A 97 ASP~? 21.13 O4 MPD A 191 C 739 GLY A 90 GLY.? 17.99 O1 EDO A 189 C 741 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo 15.33 59.81 59.60 13.98 60.99 60.69 65.85 25.32 24.26 66.00 24.92 26.31 coo 16.06 55.72 54.73 15.97 56.49 56.70 60.01 27.52 25.19 61.63 28.83 24.67 coo 9.38 49.29 65.28 9.01 50.03 65.31 68.99 30.23 13.11 68.36 30.72 12.94 coo 13.55 54.01 62.74 13.86 55.50 62.79 65.16 31.38 17.96 65.64 31.84 19.31 1ddj_c02 source 1ddj PLASMINOGEN : 1 hits 1ddj_c02 naa= 4 ULMN 4 1ddj_c03 PLASMINOGEN user 1 4 # 1 D 603 HIS A 84 HIS.? 23.86 O4 MPD A 191 D 646 ASP A 97 ASP~? 21.13 O4 MPD A 191 D 739 GLY A 90 GLY.? 17.99 O1 EDO A 189 D 741 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo -30.51 33.83 43.05 -30.50 33.12 45.03 65.85 25.32 24.26 66.00 24.92 26.31 coo -25.73 33.05 39.28 -27.50 34.05 39.88 60.01 27.52 25.19 61.63 28.83 24.67 coo -27.66 47.32 40.66 -27.81 47.01 41.41 68.99 30.23 13.11 68.36 30.72 12.94 coo -29.58 40.72 40.37 -30.29 39.69 41.25 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 4 1ddj_c03 PLASMINOGEN user 2 4 # 2 D 603 HIS B 84 HIS.? 24.24 O2 MPD B 194 D 646 ASP B 97 ASP~? 21.83 C3 MPD B 194 D 739 GLY B 90 GLY.? 18.17 C1 EDO B 189 D 741 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo -30.51 33.83 43.05 -30.50 33.12 45.03 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -25.73 33.05 39.28 -27.50 34.05 39.88 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -27.66 47.32 40.66 -27.81 47.01 41.41 54.47 0.76 -32.31 54.10 0.32 -31.77 coo -29.58 40.72 40.37 -30.29 39.69 41.25 48.58 -0.77 -33.67 48.18 -1.29 -35.04 1ddj_c03 source 1ddj PLASMINOGEN : 2 hits 1ddj_c03 naa= 4 ULMN 4 1dio_c00 DIOL DEHYDRATASE user 1 4 # 1 A 143 HIS A 65 HIS^? 6.20 C1 EDO A 189 A 170 GLU A 67 GLU^? 10.03 C1 EDO A 189 A 296 GLN A 33 GLN^? 7.13 C1 EDO A 190 A 335 ASP A 48 ASP^? -5.54 C1 EDO A 189s coo 76.90 -1.10 170.49 78.48 0.25 170.69 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 76.45 1.78 165.92 77.83 2.80 167.12 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 80.50 8.33 170.46 80.05 6.58 169.34 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 79.61 2.57 174.02 81.25 3.85 173.48 57.58 16.65 0.08 56.71 16.10 -1.78 ULMN 4 1dio_c00 DIOL DEHYDRATASE user 2 4 # 2 A 143 HIS A 76 HIS^? 9.12 O1 EDO A 189 A 170 GLU A 61 GLU^? 10.22 O1 EDO A 189 A 296 GLN A 86 GLN^? 18.78 O1 EDO A 189 A 335 ASP A 87 ASP^? 16.43 O1 EDO A 189 coo 76.90 -1.10 170.49 78.48 0.25 170.69 65.00 24.12 7.67 66.83 23.12 7.94 coo 76.45 1.78 165.92 77.83 2.80 167.12 66.46 19.59 10.29 68.35 19.61 9.28 coo 80.50 8.33 170.46 80.05 6.58 169.34 67.23 27.16 15.62 69.12 27.87 16.28 coo 79.61 2.57 174.02 81.25 3.85 173.48 63.41 29.58 11.55 64.59 31.41 11.51 ULMN 4 1dio_c00 DIOL DEHYDRATASE user 3 4 # 3 A 143 HIS B 65 HIS^? -5.26 O1 EDO B 189s A 170 GLU B 67 GLU^? -5.72 C1 EDO A 190s A 296 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 335 ASP B 48 ASP^? 5.72 O1 EDO B 189 coo 76.90 -1.10 170.49 78.48 0.25 170.69 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 76.45 1.78 165.92 77.83 2.80 167.12 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 80.50 8.33 170.46 80.05 6.58 169.34 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 79.61 2.57 174.02 81.25 3.85 173.48 52.60 14.13 -14.82 53.00 14.96 -12.94 1dio_c00 source 1dio DIOL DEHYDRATASE : 3 hits 1dio_c00 naa= 4 ULMN 4 1dio_c01 DIOL DEHYDRATASE user 1 4 # 1 L 143 HIS A 65 HIS^? 6.20 C1 EDO A 189 L 170 GLU A 67 GLU^? 10.03 C1 EDO A 189 L 296 GLN A 33 GLN^? 7.13 C1 EDO A 190 L 335 ASP A 48 ASP^? -5.54 C1 EDO A 189s coo 82.46 -3.64 210.53 80.56 -2.84 210.31 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 82.52 -1.49 215.66 80.77 -0.71 214.69 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 77.25 4.69 212.00 77.71 2.78 212.89 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 79.03 -0.23 207.82 77.25 0.67 208.50 57.58 16.65 0.08 56.71 16.10 -1.78 ULMN 4 1dio_c01 DIOL DEHYDRATASE user 2 4 # 2 L 143 HIS A 76 HIS^? 9.12 O1 EDO A 189 L 170 GLU A 61 GLU^? 10.22 O1 EDO A 189 L 296 GLN A 86 GLN^? 18.78 O1 EDO A 189 L 335 ASP A 87 ASP^? 16.43 O1 EDO A 189 coo 82.46 -3.64 210.53 80.56 -2.84 210.31 65.00 24.12 7.67 66.83 23.12 7.94 coo 82.52 -1.49 215.66 80.77 -0.71 214.69 66.46 19.59 10.29 68.35 19.61 9.28 coo 77.25 4.69 212.00 77.71 2.78 212.89 67.23 27.16 15.62 69.12 27.87 16.28 coo 79.03 -0.23 207.82 77.25 0.67 208.50 63.41 29.58 11.55 64.59 31.41 11.51 ULMN 4 1dio_c01 DIOL DEHYDRATASE user 3 4 # 3 L 143 HIS B 65 HIS^? -5.26 O1 EDO B 189s L 170 GLU B 67 GLU^? -5.72 C1 EDO A 190s L 296 GLN B 33 GLN^? 9.24 C2 EDO B 189 L 335 ASP B 48 ASP^? 5.72 O1 EDO B 189 coo 82.46 -3.64 210.53 80.56 -2.84 210.31 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 82.52 -1.49 215.66 80.77 -0.71 214.69 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 77.25 4.69 212.00 77.71 2.78 212.89 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 79.03 -0.23 207.82 77.25 0.67 208.50 52.60 14.13 -14.82 53.00 14.96 -12.94 1dio_c01 source 1dio DIOL DEHYDRATASE : 3 hits 1dio_c01 naa= 4 ULMN 4 1e6e_c00 ADRENODOXIN user 1 4 # 1 A 55 HIS A 154 HIS^? 17.90 CM MPD A 191 A 159 ASP A 151 ASP^? 20.35 CM MPD A 191 A 376 ILE A 115 ILE~? 14.42 CM MPD A 191 A 377 THR A 112 THR~? 15.04 CM MPD A 191 coo 17.95 58.52 112.81 17.29 59.41 111.03 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 11.32 57.46 110.35 12.85 58.48 111.39 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 15.00 65.23 121.40 15.42 63.95 122.00 54.87 5.50 21.15 53.81 4.69 20.75 coo 15.65 69.77 121.40 17.38 70.64 120.41 55.36 7.21 17.13 56.15 5.85 15.65 ULMN 4 1e6e_c00 ADRENODOXIN user 2 4 # 2 A 55 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 159 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 376 ILE B 115 ILE~? 5.13 C1 EDO B 193 A 377 THR B 112 THR~? 7.30 C1 EDO B 193 coo 17.95 58.52 112.81 17.29 59.41 111.03 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 11.32 57.46 110.35 12.85 58.48 111.39 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 15.00 65.23 121.40 15.42 63.95 122.00 37.50 24.83 -29.84 36.97 25.68 -28.85 coo 15.65 69.77 121.40 17.38 70.64 120.41 40.35 23.17 -26.98 41.74 24.62 -26.32 1e6e_c00 source 1e6e ADRENODOXIN : 2 hits 1e6e_c00 naa= 4 ULMN 4 1e6e_c01 ADRENODOXIN user 1 4 # 1 C 55 HIS A 154 HIS^? 17.90 CM MPD A 191 C 159 ASP A 151 ASP^? 20.35 CM MPD A 191 C 376 ILE A 115 ILE~? 14.42 CM MPD A 191 C 377 THR A 112 THR~? 15.04 CM MPD A 191 coo -29.07 40.56 142.27 -27.79 41.91 141.29 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -23.44 38.39 138.46 -25.44 39.03 138.64 48.38 -3.74 26.58 47.39 -3.82 24.70 coo -37.08 37.01 134.95 -37.09 36.11 136.10 54.87 5.50 21.15 53.81 4.69 20.75 coo -39.65 39.67 132.35 -40.33 41.62 133.03 55.36 7.21 17.13 56.15 5.85 15.65 1e6e_c01 source 1e6e ADRENODOXIN : 1 hits 1e6e_c01 naa= 4 ULMN 4 1eag_c05 PEPTIDE INHIBITOR user 1 4 # 1 A 32 ASP A 151 ASP^? 20.35 CM MPD A 191 A 35 SER A 153 SER.? 20.01 CM MPD A 191 A 84 TYR A 155 TYR^? 14.94 CM MPD A 191 A 218 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 47.22 22.34 8.57 45.16 22.02 9.13 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 43.58 20.85 5.15 44.62 23.01 5.76 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 40.49 26.39 8.83 42.48 26.82 6.92 50.44 4.00 23.33 52.91 2.96 24.17 coo 44.05 16.99 12.67 44.05 18.89 11.74 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 1eag_c05 PEPTIDE INHIBITOR user 2 4 # 2 A 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 35 SER B 153 SER.? -3.11 C2 EDO B 192s A 84 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 218 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 47.22 22.34 8.57 45.16 22.02 9.13 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 43.58 20.85 5.15 44.62 23.01 5.76 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 40.49 26.39 8.83 42.48 26.82 6.92 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 44.05 16.99 12.67 44.05 18.89 11.74 28.45 32.01 -35.99 29.78 33.29 -34.96 1eag_c05 source 1eag PEPTIDE INHIBITOR : 2 hits 1eag_c05 naa= 4 ULMN 4 1f75_c00 UNDECAPRENYL PYROPHOSPHATE SYNTHETASuser 1 4 # 1 A 33 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 42 ARG A 116 ARG~? 15.92 O1 EDO B 190 A 197 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 203 ARG A 82 ARG.? 24.76 O1 EDO A 189 coo 23.24 19.51 21.94 24.57 16.76 21.61 61.14 12.50 23.45 58.83 13.31 25.34 coo 16.08 17.48 28.78 19.09 16.85 28.49 59.64 3.34 19.37 61.78 2.26 17.40 coo 28.26 9.63 19.68 28.71 10.56 22.55 67.94 16.79 18.42 70.70 18.25 18.48 coo 33.62 12.31 23.18 30.84 12.90 24.36 69.47 19.71 26.08 71.03 22.01 24.70 ULMN 4 1f75_c00 UNDECAPRENYL PYROPHOSPHATE SYNTHETASuser 2 4 # 2 A 33 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 42 ARG B 116 ARG~? 5.91 C2 EDO B 193 A 197 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 203 ARG B 82 ARG.? 22.52 O2 EDO B 193 coo 23.24 19.51 21.94 24.57 16.76 21.61 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 16.08 17.48 28.78 19.09 16.85 28.49 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 28.26 9.63 19.68 28.71 10.56 22.55 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 33.62 12.31 23.18 30.84 12.90 24.36 46.69 11.07 -43.02 44.95 12.59 -45.09 1f75_c00 source 1f75 UNDECAPRENYL PYROPHOSPHATE SYNTHETASE : 2 hits 1f75_c00 naa= 4 ULMN 4 1f75_c01 UNDECAPRENYL PYROPHOSPHATE SYNTHETASuser 1 4 # 1 B 33 ARG B 116 ARG~? 5.91 C2 EDO B 193 B 42 ARG B 117 ARG~? 13.46 O2 EDO B 193 B 197 ARG A 5 ARG^? -3.94 O1 EDO A 188s B 203 ARG B 186 ARG^? -4.10 O2 EDO A 188s coo 42.69 1.07 -0.40 42.64 1.65 2.61 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 53.37 -3.67 -3.96 53.38 -5.27 -1.33 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 40.75 3.79 10.50 41.03 0.76 9.97 49.47 32.83 -21.72 46.80 34.39 -21.91 coo 36.15 -1.87 10.26 38.18 -1.23 8.01 42.31 29.46 -17.08 41.98 30.89 -19.84 1f75_c01 source 1f75 UNDECAPRENYL PYROPHOSPHATE SYNTHETASE : 1 hits 1f75_c01 naa= 4 ULMN 4 1i8t_c02 UDP-GALACTOPYRANOSE MUTASE user 1 4 # 1 A 170 ARG B 116 ARG~? 5.91 C2 EDO B 193 A 278 ARG B 52 ARG^? 13.54 O2 EDO B 189 A 298 GLU B 61 GLU^? 10.17 C1 EDO B 189 A 348 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo -23.99 -12.72 0.77 -26.03 -13.46 2.92 42.21 27.31 -31.29 45.12 28.46 -31.33 coo -18.98 -3.88 -14.05 -18.01 -5.56 -11.69 55.40 16.98 -30.43 55.13 14.61 -32.43 coo -18.09 -5.55 -18.88 -17.66 -5.99 -16.85 53.85 11.48 -28.30 55.92 11.40 -28.71 coo -11.04 -13.38 -5.15 -13.10 -12.92 -5.14 55.32 27.50 -21.80 56.24 27.40 -19.90 1i8t_c02 source 1i8t UDP-GALACTOPYRANOSE MUTASE : 1 hits 1i8t_c02 naa= 4 ULMN 4 1mpp_c05 PEPSIN (RENIN) (E.C.3.4.23.23) user 1 4 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 75 TYR A 155 TYR^? 14.94 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 20.97 14.47 32.28 19.66 15.96 31.62 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 16.04 14.72 33.82 17.27 13.71 31.95 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 15.29 15.16 26.38 15.79 12.61 27.66 50.44 4.00 23.33 52.91 2.96 24.17 coo 20.65 22.00 33.80 20.06 20.56 32.39 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 1mpp_c05 PEPSIN (RENIN) (E.C.3.4.23.23) user 2 4 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 75 TYR B 155 TYR^? 6.08 O1 EDO B 193 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 20.97 14.47 32.28 19.66 15.96 31.62 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 16.04 14.72 33.82 17.27 13.71 31.95 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 15.29 15.16 26.38 15.79 12.61 27.66 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 20.65 22.00 33.80 20.06 20.56 32.39 28.45 32.01 -35.99 29.78 33.29 -34.96 1mpp_c05 source 1mpp PEPSIN (RENIN) (E.C.3.4.23.23) : 2 hits 1mpp_c05 naa= 4 ULMN 4 1nlu_c00 PSEUDO-IODOTYROSTATIN user 1 4 # 1 A 80 GLU A 173 GLU.? 15.20 O1 EDO B 190 A 84 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 170 ASP A 151 ASP^? 20.35 CM MPD A 191 A 287 SER A 153 SER.? 20.01 CM MPD A 191 coo 23.89 18.61 12.79 25.29 17.35 13.81 56.04 -5.91 18.03 55.52 -6.78 16.19 coo 27.00 22.87 14.47 26.64 20.92 13.76 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 27.92 8.51 14.90 28.11 10.58 15.35 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 29.00 16.00 15.34 27.04 15.11 14.25 50.18 -2.46 21.39 48.57 -4.23 21.02 1nlu_c00 source 1nlu PSEUDO-IODOTYROSTATIN : 1 hits 1nlu_c00 naa= 4 ULMN 4 1og1_c00 T-CELL ECTO-ADP-RIBOSYLTRANSFERASE 2user 1 4 # 1 A 147 SER A 32 SER^? 8.67 O2 EDO A 189 A 159 GLU A 67 GLU^? 10.03 C1 EDO A 189 A 184 ARG A 35 ARG^? -3.68 C1 EDO A 190s A 189 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 53.09 24.63 27.00 51.51 25.19 25.28 57.30 11.17 3.38 55.16 10.90 4.47 coo 52.64 14.17 18.05 51.99 14.09 16.04 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 45.78 18.05 21.49 44.51 17.88 18.72 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 49.07 22.26 28.01 48.95 23.27 26.11 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 4 1og1_c00 T-CELL ECTO-ADP-RIBOSYLTRANSFERASE 2user 2 4 # 2 A 147 SER A 32 SER^? 8.67 O2 EDO A 189 A 159 GLU B 67 GLU^? -5.72 C1 EDO A 190s A 184 ARG A 35 ARG^? -3.68 C1 EDO A 190s A 189 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 53.09 24.63 27.00 51.51 25.19 25.28 57.30 11.17 3.38 55.16 10.90 4.47 coo 52.64 14.17 18.05 51.99 14.09 16.04 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 45.78 18.05 21.49 44.51 17.88 18.72 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 49.07 22.26 28.01 48.95 23.27 26.11 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 4 1og1_c00 T-CELL ECTO-ADP-RIBOSYLTRANSFERASE 2user 3 4 # 3 A 147 SER B 32 SER^? 8.66 C2 EDO B 189 A 159 GLU A 67 GLU^? 10.03 C1 EDO A 189 A 184 ARG B 35 ARG^? 10.43 C2 EDO A 190 A 189 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 53.09 24.63 27.00 51.51 25.19 25.28 50.26 19.40 -17.21 47.97 19.77 -16.73 coo 52.64 14.17 18.05 51.99 14.09 16.04 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 45.78 18.05 21.49 44.51 17.88 18.72 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 49.07 22.26 28.01 48.95 23.27 26.11 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 4 1og1_c00 T-CELL ECTO-ADP-RIBOSYLTRANSFERASE 2user 4 4 # 4 A 147 SER B 32 SER^? 8.66 C2 EDO B 189 A 159 GLU B 67 GLU^? -5.72 C1 EDO A 190s A 184 ARG B 35 ARG^? 10.43 C2 EDO A 190 A 189 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 53.09 24.63 27.00 51.51 25.19 25.28 50.26 19.40 -17.21 47.97 19.77 -16.73 coo 52.64 14.17 18.05 51.99 14.09 16.04 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 45.78 18.05 21.49 44.51 17.88 18.72 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 49.07 22.26 28.01 48.95 23.27 26.11 45.31 20.78 -15.22 44.37 19.83 -16.87 1og1_c00 source 1og1 T-CELL ECTO-ADP-RIBOSYLTRANSFERASE 2 : 4 hits 1og1_c00 naa= 4 ULMN 4 1qrz_c03 PLASMINOGEN user 1 4 # 1 D 603 HIS A 154 HIS^? 17.90 CM MPD A 191 D 646 ASP A 122 ASP.? 22.97 CM MPD A 191 D 739 GLY A 175 GLY.? 16.97 O1 EDO B 190 D 741 SER A 153 SER.? 20.01 CM MPD A 191 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 51.13 -1.78 31.54 51.32 -3.14 29.91 coo -45.82 1.31 41.67 -46.38 1.39 42.31 55.47 1.95 17.71 55.53 1.72 16.92 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 50.18 -2.46 21.39 48.57 -4.23 21.02 1qrz_c03 source 1qrz PLASMINOGEN : 1 hits 1qrz_c03 naa= 4 ULMN 4 1qtn_c00 ACETYL-ILE-GLU-THR-ASP-ALDEHYDE user 1 4 # 1 A 258 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 317 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 318 GLY A 98 GLY.? 17.64 O2 MPD A 191 A 360 CYH A 99 CYH.? 13.00 O4 MPD A 191 coo -8.98 40.59 45.04 -10.51 39.37 47.39 67.94 16.79 18.42 70.70 18.25 18.48 coo -8.43 39.80 36.26 -8.18 39.59 38.31 65.85 25.32 24.26 66.00 24.92 26.31 coo -11.14 38.10 31.61 -11.46 38.10 32.37 59.27 22.98 25.86 59.28 23.02 25.07 coo -11.95 34.09 34.07 -11.89 34.73 36.80 58.08 21.10 22.79 55.99 22.56 21.69 1qtn_c00 source 1qtn ACETYL-ILE-GLU-THR-ASP-ALDEHYDE : 1 hits 1qtn_c00 naa= 4 ULMN 4 1r4f_c01 IAG-NUCLEOSIDE HYDROLASE user 1 4 # 1 B 10 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 83 TRP A 13 TRP.? 7.37 O2 EDO B 188 B 186 ASN B 111 ASN~? 7.23 CM MPD B 194 B 260 ALA B 167 ALA^? 7.55 CM MPD B 194 coo 32.41 24.46 38.87 30.66 25.57 39.24 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 21.58 23.61 33.02 20.95 24.04 36.89 35.01 18.42 -11.27 36.57 15.33 -9.40 coo 27.66 25.11 45.19 28.06 26.34 43.52 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 25.52 34.62 42.47 24.97 33.24 42.72 27.16 22.24 -21.69 28.37 21.86 -20.85 1r4f_c01 source 1r4f IAG-NUCLEOSIDE HYDROLASE : 1 hits 1r4f_c01 naa= 4 ULMN 4 1rne_c02 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 4 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 218 ALA A 121 ALA.? 23.17 O2 MPD A 191 coo 11.85 17.24 72.81 11.09 15.37 72.36 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 12.20 12.71 75.45 13.69 13.84 74.03 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 5.22 15.03 71.43 7.19 14.88 70.83 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 6.97 16.73 67.05 5.86 15.77 67.41 55.03 1.03 31.09 55.51 0.72 32.45 ULMN 4 1rne_c02 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 4 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 218 ALA B 121 ALA.? 10.61 O2 EDO B 193 coo 11.85 17.24 72.81 11.09 15.37 72.36 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 12.20 12.71 75.45 13.69 13.84 74.03 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 5.22 15.03 71.43 7.19 14.88 70.83 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 6.97 16.73 67.05 5.86 15.77 67.41 31.28 28.91 -38.38 30.52 28.99 -39.66 1rne_c02 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 2 hits 1rne_c02 naa= 4 ULMN 4 1rne_c05 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 4 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 75 TYR A 155 TYR^? 14.94 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 11.85 17.24 72.81 11.09 15.37 72.36 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 12.20 12.71 75.45 13.69 13.84 74.03 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 15.08 11.29 68.68 16.45 12.70 70.65 50.44 4.00 23.33 52.91 2.96 24.17 coo 5.22 15.03 71.43 7.19 14.88 70.83 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 1rne_c05 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 4 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 75 TYR B 155 TYR^? 6.08 O1 EDO B 193 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 11.85 17.24 72.81 11.09 15.37 72.36 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 12.20 12.71 75.45 13.69 13.84 74.03 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 15.08 11.29 68.68 16.45 12.70 70.65 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 5.22 15.03 71.43 7.19 14.88 70.83 28.45 32.01 -35.99 29.78 33.29 -34.96 1rne_c05 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 2 hits 1rne_c05 naa= 4 ULMN 4 1rne_c06 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 4 # 1 32 ASP B 103 ASP^? 5.57 C5 MPD B 194 33 THR B 110 THR~? 9.89 C5 MPD B 194 215 ASP B 101 ASP^? 13.71 C2 EDO B 193 218 ALA B 130 ALA^? 8.48 O2 MPD B 194 coo 11.85 17.24 72.81 11.09 15.37 72.36 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 8.33 16.80 75.95 6.64 18.11 76.07 41.08 19.02 -24.12 41.28 17.07 -23.15 coo 5.22 15.03 71.43 7.19 14.88 70.83 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 6.97 16.73 67.05 5.86 15.77 67.41 36.89 11.57 -29.50 36.35 12.45 -28.44 1rne_c06 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 1 hits 1rne_c06 naa= 4 ULMN 4 1sme_c06 PLASMEPSIN II user 1 4 # 1 A 34 ASP A 151 ASP^? 20.35 CM MPD A 191 A 37 SER A 153 SER.? 20.01 CM MPD A 191 A 77 TYR A 155 TYR^? 14.94 CM MPD A 191 A 214 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 51.75 60.57 19.10 52.05 60.90 21.19 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 51.10 65.11 20.73 52.62 63.74 19.42 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 58.03 63.52 22.21 57.19 63.97 19.60 50.44 4.00 23.33 52.91 2.96 24.17 coo 48.59 58.89 25.78 50.13 59.74 24.61 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 1sme_c06 PLASMEPSIN II user 2 4 # 2 A 34 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 37 SER B 153 SER.? -3.11 C2 EDO B 192s A 77 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 214 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 51.75 60.57 19.10 52.05 60.90 21.19 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 51.10 65.11 20.73 52.62 63.74 19.42 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 58.03 63.52 22.21 57.19 63.97 19.60 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 48.59 58.89 25.78 50.13 59.74 24.61 28.45 32.01 -35.99 29.78 33.29 -34.96 1sme_c06 source 1sme PLASMEPSIN II : 2 hits 1sme_c06 naa= 4 ULMN 4 1sme_c07 PLASMEPSIN II user 1 4 # 1 B 34 ASP A 151 ASP^? 20.35 CM MPD A 191 B 37 SER A 153 SER.? 20.01 CM MPD A 191 B 77 TYR A 155 TYR^? 14.94 CM MPD A 191 B 214 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 17.69 97.58 52.73 17.33 97.19 54.77 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 20.67 100.44 55.84 20.21 98.51 54.45 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 21.97 93.33 56.91 23.11 94.24 54.54 50.44 4.00 23.33 52.91 2.96 24.17 coo 12.41 98.71 58.47 14.37 98.17 58.05 51.13 -1.78 31.54 51.32 -3.14 29.91 1sme_c07 source 1sme PLASMEPSIN II : 1 hits 1sme_c07 naa= 4 ULMN 4 1tml_c00 ENDO-1,4-BETA-D-GLUCANASE (E.C.3.2.1user 1 4 # 1 73 TYR B 7 TYR^? 8.72 O1 EDO B 190 78 ARG A 186 ARG^? 11.98 O1 EDO B 190 79 ASP A 179 ASP^? 16.86 CM MPD A 191 117 ASP A 172 ASP.? 13.07 O1 EDO B 190 coo 10.99 48.36 -19.15 9.49 50.64 -18.98 55.88 2.21 7.80 57.52 0.60 9.42 coo 5.43 50.57 -21.55 6.80 47.80 -21.46 51.29 1.08 9.05 52.68 -0.95 10.91 coo 3.03 55.03 -27.07 4.16 56.12 -25.64 43.85 0.70 13.63 43.61 -0.87 12.28 coo 3.35 49.90 -16.55 3.54 50.44 -14.49 53.63 -2.61 14.65 54.96 -1.14 13.93 1tml_c00 source 1tml ENDO-1,4-BETA-D-GLUCANASE (E.C.3.2.1.4) : 1 hits 1tml_c00 naa= 4 ULMN 4 1x9h_c00 GLUCOSE-6-PHOSPHATE ISOMERASE user 1 4 # 1 A 135 ARG A 50 ARG^? 6.80 C2 EDO A 189 A 203 GLU A 31 GLU^? -3.45 O2 EDO A 189s A 219 HIS A 154 HIS^? 17.90 CM MPD A 191 A 298 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 46.78 3.24 25.36 49.46 4.02 24.06 65.37 14.47 5.23 66.89 16.94 6.37 coo 45.62 7.41 24.38 46.18 6.66 26.27 61.87 12.13 2.43 62.94 11.86 0.64 coo 17.74 16.81 28.99 16.41 15.60 30.09 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 54.03 15.54 30.62 51.73 9.72 31.19 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 4 1x9h_c00 GLUCOSE-6-PHOSPHATE ISOMERASE user 2 4 # 2 A 135 ARG B 50 ARG^? -6.93 O2 EDO B 189s A 203 GLU B 31 GLU^? -3.64 O2 EDO B 189s A 219 HIS A 76 HIS^? 9.12 O1 EDO A 189 A 298 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 46.78 3.24 25.36 49.46 4.02 24.06 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 45.62 7.41 24.38 46.18 6.66 26.27 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 17.74 16.81 28.99 16.41 15.60 30.09 65.00 24.12 7.67 66.83 23.12 7.94 coo 54.03 15.54 30.62 51.73 9.72 31.19 51.85 4.84 -17.64 57.80 3.80 -15.89 1x9h_c00 source 1x9h GLUCOSE-6-PHOSPHATE ISOMERASE : 2 hits 1x9h_c00 naa= 4 ULMN 4 1xqw_c01 PROLINE IMINOPEPTIDASE user 1 4 # 1 A 105 ALA A 62 ALA^? 8.76 O1 EDO A 189 A 106 TYR A 49 TYR^? 7.66 O1 EDO A 189 A 244 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 271 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 15.05 3.71 6.93 14.58 4.88 7.78 62.10 18.98 10.31 60.83 19.17 11.13 coo 19.84 3.34 10.90 21.84 1.93 12.24 56.86 15.30 6.36 55.58 13.13 7.63 coo 9.85 8.15 0.76 10.61 7.04 2.39 63.41 29.58 11.55 64.59 31.41 11.51 coo 10.61 7.65 6.01 12.39 6.55 6.23 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 4 1xqw_c01 PROLINE IMINOPEPTIDASE user 2 4 # 2 A 105 ALA B 62 ALA^? 8.92 C1 EDO B 189 A 106 TYR B 49 TYR^? -7.47 C2 EDO B 189s A 244 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 271 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 15.05 3.71 6.93 14.58 4.88 7.78 50.28 11.76 -25.69 48.75 11.59 -25.62 coo 19.84 3.34 10.90 21.84 1.93 12.24 48.23 15.25 -19.35 46.43 17.40 -19.57 coo 9.85 8.15 0.76 10.61 7.04 2.39 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 10.61 7.65 6.01 12.39 6.55 6.23 54.34 6.71 -25.28 55.69 7.78 -26.49 1xqw_c01 source 1xqw PROLINE IMINOPEPTIDASE : 2 hits 1xqw_c01 naa= 4 ULMN 4 2apr_c05 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 1 4 # 1 35 ASP A 151 ASP^? 20.35 CM MPD A 191 38 SER A 153 SER.? 20.01 CM MPD A 191 77 TYR A 155 TYR^? 14.94 CM MPD A 191 218 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 41.14 58.72 105.19 42.39 59.85 103.92 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 46.04 57.35 103.96 44.97 58.52 105.78 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 47.21 64.36 106.26 46.67 62.33 108.12 50.44 4.00 23.33 52.91 2.96 24.17 coo 41.33 60.20 97.63 42.00 60.96 99.49 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 2apr_c05 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 2 4 # 2 35 ASP B 151 ASP^? -3.26 O1 EDO B 192s 38 SER B 153 SER.? -3.11 C2 EDO B 192s 77 TYR B 155 TYR^? 6.08 O1 EDO B 193 218 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 41.14 58.72 105.19 42.39 59.85 103.92 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 46.04 57.35 103.96 44.97 58.52 105.78 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 47.21 64.36 106.26 46.67 62.33 108.12 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 41.33 60.20 97.63 42.00 60.96 99.49 28.45 32.01 -35.99 29.78 33.29 -34.96 2apr_c05 source 2apr ACID PROTEINASE (RHIZOPUSPEPSIN) (E.C.3.4.23.6: 2 hits 2apr_c05 naa= 4 ULMN 4 2jxr_c05 LIGAND CP-081282 user 1 4 # 1 A 32 ASP A 151 ASP^? 20.35 CM MPD A 191 A 35 SER A 153 SER.? 20.01 CM MPD A 191 A 75 TYR A 155 TYR^? 14.94 CM MPD A 191 A 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo -14.00 61.45 43.99 -14.19 63.14 42.84 48.38 -3.74 26.58 47.39 -3.82 24.70 coo -13.21 66.21 45.84 -15.49 65.90 45.84 50.18 -2.46 21.39 48.57 -4.23 21.02 coo -20.05 66.65 43.47 -19.36 65.65 45.97 50.44 4.00 23.33 52.91 2.96 24.17 coo -10.72 64.19 37.77 -12.20 64.43 39.15 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 4 2jxr_c05 LIGAND CP-081282 user 2 4 # 2 A 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 35 SER B 153 SER.? -3.11 C2 EDO B 192s A 75 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo -14.00 61.45 43.99 -14.19 63.14 42.84 29.45 33.81 -30.55 29.73 34.07 -28.42 coo -13.21 66.21 45.84 -15.49 65.90 45.84 33.75 32.64 -27.23 32.53 34.50 -26.24 coo -20.05 66.65 43.47 -19.36 65.65 45.97 32.75 26.18 -29.08 34.17 27.29 -31.19 coo -10.72 64.19 37.77 -12.20 64.43 39.15 28.45 32.01 -35.99 29.78 33.29 -34.96 2jxr_c05 source 2jxr LIGAND CP-081282 : 2 hits 2jxr_c05 naa= 4 ULMN 4 2tpl_c02 TYROSINE PHENOL-LYASE user 1 4 # 1 A 71 TYR A 45 TYR^? 11.90 O2 EDO A 190 A 123 PHE B 113 PHE~? 12.33 C1 EDO B 193 A 214 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 381 ARG B 60 ARG^? 18.79 C1 EDO B 189 coo -18.26 14.59 1.38 -20.32 13.94 3.12 47.53 19.92 0.67 46.95 18.68 3.19 coo -30.08 -12.81 5.71 -28.04 -12.05 7.46 43.08 19.13 -28.69 45.51 19.27 -27.36 coo -29.95 -11.32 -1.46 -28.83 -11.55 0.31 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -28.50 -18.89 13.52 -29.04 -16.11 14.56 50.13 14.01 -35.69 52.36 12.88 -37.47 ULMN 4 2tpl_c02 TYROSINE PHENOL-LYASE user 2 4 # 2 A 71 TYR B 45 TYR^? 7.97 C2 EDO A 190 A 123 PHE A 113 PHE~? 14.88 O1 EDO A 189 A 214 ASP A 103 ASP^? 5.49 CM MPD A 191 A 381 ARG A 60 ARG^? 18.80 O1 EDO A 189 coo -18.26 14.59 1.38 -20.32 13.94 3.12 44.36 10.34 -9.27 42.37 11.49 -10.86 coo -30.08 -12.81 5.71 -28.04 -12.05 7.46 58.33 11.41 16.78 59.51 11.35 14.22 coo -29.95 -11.32 -1.46 -28.83 -11.55 0.31 51.58 16.40 16.66 49.70 15.49 16.18 coo -28.50 -18.89 13.52 -29.04 -16.11 14.56 67.94 16.79 18.42 70.70 18.25 18.48 2tpl_c02 source 2tpl TYROSINE PHENOL-LYASE : 2 hits 2tpl_c02 naa= 4 ULMN 4 2tpl_c03 TYROSINE PHENOL-LYASE user 1 4 # 1 B 71 TYR A 45 TYR^? 11.90 O2 EDO A 190 B 123 PHE B 113 PHE~? 12.33 C1 EDO B 193 B 214 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 381 ARG B 60 ARG^? 18.79 C1 EDO B 189 coo -20.85 -10.53 13.88 -22.65 -9.60 11.98 47.53 19.92 0.67 46.95 18.68 3.19 coo -26.81 18.98 9.83 -25.06 17.93 7.94 43.08 19.13 -28.69 45.51 19.27 -27.36 coo -26.88 17.61 16.89 -26.08 17.11 15.00 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -23.89 24.28 2.03 -24.86 21.74 0.63 50.13 14.01 -35.69 52.36 12.88 -37.47 ULMN 4 2tpl_c03 TYROSINE PHENOL-LYASE user 2 4 # 2 B 71 TYR B 45 TYR^? 7.97 C2 EDO A 190 B 123 PHE A 113 PHE~? 14.88 O1 EDO A 189 B 214 ASP A 103 ASP^? 5.49 CM MPD A 191 B 381 ARG A 60 ARG^? 18.80 O1 EDO A 189 coo -20.85 -10.53 13.88 -22.65 -9.60 11.98 44.36 10.34 -9.27 42.37 11.49 -10.86 coo -26.81 18.98 9.83 -25.06 17.93 7.94 58.33 11.41 16.78 59.51 11.35 14.22 coo -26.88 17.61 16.89 -26.08 17.11 15.00 51.58 16.40 16.66 49.70 15.49 16.18 coo -23.89 24.28 2.03 -24.86 21.74 0.63 67.94 16.79 18.42 70.70 18.25 18.48 2tpl_c03 source 2tpl TYROSINE PHENOL-LYASE : 2 hits 2tpl_c03 naa= 4 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 1 3 # 1 B 46 ASP A 101 ASP^? 14.06 CM MPD A 191 B 100 ARG A 129 ARG^? 14.04 O2 MPD A 191 B 116 GLN A 145 GLN^? 5.80 O2 MPD A 191 coo 32.18 48.37 12.48 33.96 49.46 12.97 57.05 15.04 20.11 57.86 14.10 21.77 coo 39.04 43.25 11.37 38.30 45.35 13.56 54.99 23.34 25.48 52.76 24.40 27.34 coo 37.43 42.63 19.41 36.76 44.08 17.97 49.04 16.64 22.28 49.83 15.93 20.47 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 2 3 # 2 B 46 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 100 ARG B 129 ARG^? 16.59 O2 MPD B 194 B 116 GLN B 145 GLN^? 5.59 O2 MPD B 194 coo 32.18 48.37 12.48 33.96 49.46 12.97 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 39.04 43.25 11.37 38.30 45.35 13.56 35.59 7.18 -33.96 34.54 5.79 -36.47 coo 37.43 42.63 19.41 36.76 44.08 17.97 32.37 13.58 -27.30 34.23 14.31 -26.47 12as_c01 source 12as ASPARAGINE SYNTHETASE : 2 hits 12as_c01 naa= 3 ULMN 3 1a0j_c12 TRYPSIN user 1 3 # 1 A 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 25.57 41.22 61.68 24.18 39.98 62.50 64.74 13.84 22.58 64.60 13.48 24.65 coo 22.33 45.48 59.73 23.35 43.67 60.06 68.86 12.45 19.04 67.57 12.48 20.71 coo 22.57 32.23 64.13 21.98 32.82 64.22 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1a0j_c12 TRYPSIN user 2 3 # 2 A 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 25.57 41.22 61.68 24.18 39.98 62.50 64.74 13.84 22.58 64.60 13.48 24.65 coo 22.33 45.48 59.73 23.35 43.67 60.06 68.86 12.45 19.04 67.57 12.48 20.71 coo 22.57 32.23 64.13 21.98 32.82 64.22 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1a0j_c12 TRYPSIN user 3 3 # 3 A 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 25.57 41.22 61.68 24.18 39.98 62.50 64.74 13.84 22.58 64.60 13.48 24.65 coo 22.33 45.48 59.73 23.35 43.67 60.06 66.73 9.65 23.28 68.51 8.93 24.16 coo 22.57 32.23 64.13 21.98 32.82 64.22 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1a0j_c12 TRYPSIN user 4 3 # 4 A 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 25.57 41.22 61.68 24.18 39.98 62.50 64.74 13.84 22.58 64.60 13.48 24.65 coo 22.33 45.48 59.73 23.35 43.67 60.06 66.73 9.65 23.28 68.51 8.93 24.16 coo 22.57 32.23 64.13 21.98 32.82 64.22 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1a0j_c12 TRYPSIN user 5 3 # 5 A 57 HIS A 65 HIS^? 6.20 C1 EDO A 189 A 102 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 193 GLY A 71 GLY^? 15.15 O2 EDO A 188 coo 25.57 41.22 61.68 24.18 39.98 62.50 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 22.33 45.48 59.73 23.35 43.67 60.06 57.58 16.65 0.08 56.71 16.10 -1.78 coo 22.57 32.23 64.13 21.98 32.82 64.22 51.64 28.27 -4.12 51.34 27.67 -3.59 ULMN 3 1a0j_c12 TRYPSIN user 6 3 # 6 A 57 HIS A 154 HIS^? 17.90 CM MPD A 191 A 102 ASP A 151 ASP^? 20.35 CM MPD A 191 A 193 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo 25.57 41.22 61.68 24.18 39.98 62.50 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 22.33 45.48 59.73 23.35 43.67 60.06 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 22.57 32.23 64.13 21.98 32.82 64.22 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 1a0j_c12 TRYPSIN user 7 3 # 7 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 25.57 41.22 61.68 24.18 39.98 62.50 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 22.33 45.48 59.73 23.35 43.67 60.06 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 22.57 32.23 64.13 21.98 32.82 64.22 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1a0j_c12 TRYPSIN user 8 3 # 8 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 25.57 41.22 61.68 24.18 39.98 62.50 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 22.33 45.48 59.73 23.35 43.67 60.06 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 22.57 32.23 64.13 21.98 32.82 64.22 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1a0j_c12 TRYPSIN user 9 3 # 9 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 193 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 25.57 41.22 61.68 24.18 39.98 62.50 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 22.33 45.48 59.73 23.35 43.67 60.06 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 22.57 32.23 64.13 21.98 32.82 64.22 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1a0j_c12 TRYPSIN user 10 3 # 10 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 A 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 25.57 41.22 61.68 24.18 39.98 62.50 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 22.33 45.48 59.73 23.35 43.67 60.06 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 22.57 32.23 64.13 21.98 32.82 64.22 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1a0j_c12 TRYPSIN user 11 3 # 11 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 A 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 25.57 41.22 61.68 24.18 39.98 62.50 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 22.33 45.48 59.73 23.35 43.67 60.06 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 22.57 32.23 64.13 21.98 32.82 64.22 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1a0j_c12 TRYPSIN user 12 3 # 12 A 57 HIS B 65 HIS^? -5.26 O1 EDO B 189s A 102 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 193 GLY B 71 GLY^? 6.08 O1 EDO A 190 coo 25.57 41.22 61.68 24.18 39.98 62.50 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 22.33 45.48 59.73 23.35 43.67 60.06 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 22.57 32.23 64.13 21.98 32.82 64.22 50.84 2.27 -7.92 50.26 2.83 -8.18 ULMN 3 1a0j_c12 TRYPSIN user 13 3 # 13 A 57 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 102 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 193 GLY B 175 GLY.? -3.40 C1 EDO B 193s coo 25.57 41.22 61.68 24.18 39.98 62.50 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 22.33 45.48 59.73 23.35 43.67 60.06 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 22.57 32.23 64.13 21.98 32.82 64.22 39.99 28.43 -27.51 40.50 28.66 -26.90 1a0j_c12 source 1a0j TRYPSIN : 13 hits 1a0j_c12 naa= 3 ULMN 3 1a0j_c13 TRYPSIN user 1 3 # 1 B 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 44.08 45.58 52.81 45.86 46.55 52.85 64.74 13.84 22.58 64.60 13.48 24.65 coo 43.04 44.75 47.18 43.31 45.51 49.13 68.86 12.45 19.04 67.57 12.48 20.71 coo 50.46 51.91 56.90 50.65 51.62 56.14 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1a0j_c13 TRYPSIN user 2 3 # 2 B 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 44.08 45.58 52.81 45.86 46.55 52.85 64.74 13.84 22.58 64.60 13.48 24.65 coo 43.04 44.75 47.18 43.31 45.51 49.13 68.86 12.45 19.04 67.57 12.48 20.71 coo 50.46 51.91 56.90 50.65 51.62 56.14 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1a0j_c13 TRYPSIN user 3 3 # 3 B 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 193 GLY A 119 GLY~? 20.44 CM MPD A 191 coo 44.08 45.58 52.81 45.86 46.55 52.85 64.74 13.84 22.58 64.60 13.48 24.65 coo 43.04 44.75 47.18 43.31 45.51 49.13 68.86 12.45 19.04 67.57 12.48 20.71 coo 50.46 51.91 56.90 50.65 51.62 56.14 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1a0j_c13 TRYPSIN user 4 3 # 4 B 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 B 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 44.08 45.58 52.81 45.86 46.55 52.85 64.74 13.84 22.58 64.60 13.48 24.65 coo 43.04 44.75 47.18 43.31 45.51 49.13 66.73 9.65 23.28 68.51 8.93 24.16 coo 50.46 51.91 56.90 50.65 51.62 56.14 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1a0j_c13 TRYPSIN user 5 3 # 5 B 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 B 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 44.08 45.58 52.81 45.86 46.55 52.85 64.74 13.84 22.58 64.60 13.48 24.65 coo 43.04 44.75 47.18 43.31 45.51 49.13 66.73 9.65 23.28 68.51 8.93 24.16 coo 50.46 51.91 56.90 50.65 51.62 56.14 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1a0j_c13 TRYPSIN user 6 3 # 6 B 57 HIS A 65 HIS^? 6.20 C1 EDO A 189 B 102 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 193 GLY A 71 GLY^? 15.15 O2 EDO A 188 coo 44.08 45.58 52.81 45.86 46.55 52.85 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 43.04 44.75 47.18 43.31 45.51 49.13 57.58 16.65 0.08 56.71 16.10 -1.78 coo 50.46 51.91 56.90 50.65 51.62 56.14 51.64 28.27 -4.12 51.34 27.67 -3.59 ULMN 3 1a0j_c13 TRYPSIN user 7 3 # 7 B 57 HIS A 154 HIS^? 17.90 CM MPD A 191 B 102 ASP A 151 ASP^? 20.35 CM MPD A 191 B 193 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo 44.08 45.58 52.81 45.86 46.55 52.85 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 43.04 44.75 47.18 43.31 45.51 49.13 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 50.46 51.91 56.90 50.65 51.62 56.14 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 1a0j_c13 TRYPSIN user 8 3 # 8 B 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 44.08 45.58 52.81 45.86 46.55 52.85 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 43.04 44.75 47.18 43.31 45.51 49.13 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 50.46 51.91 56.90 50.65 51.62 56.14 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1a0j_c13 TRYPSIN user 9 3 # 9 B 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 44.08 45.58 52.81 45.86 46.55 52.85 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 43.04 44.75 47.18 43.31 45.51 49.13 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 50.46 51.91 56.90 50.65 51.62 56.14 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1a0j_c13 TRYPSIN user 10 3 # 10 B 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 193 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 44.08 45.58 52.81 45.86 46.55 52.85 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 43.04 44.75 47.18 43.31 45.51 49.13 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 50.46 51.91 56.90 50.65 51.62 56.14 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1a0j_c13 TRYPSIN user 11 3 # 11 B 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 B 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 44.08 45.58 52.81 45.86 46.55 52.85 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 43.04 44.75 47.18 43.31 45.51 49.13 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 50.46 51.91 56.90 50.65 51.62 56.14 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1a0j_c13 TRYPSIN user 12 3 # 12 B 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 B 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 44.08 45.58 52.81 45.86 46.55 52.85 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 43.04 44.75 47.18 43.31 45.51 49.13 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 50.46 51.91 56.90 50.65 51.62 56.14 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1a0j_c13 TRYPSIN user 13 3 # 13 B 57 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 102 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 193 GLY B 71 GLY^? 6.08 O1 EDO A 190 coo 44.08 45.58 52.81 45.86 46.55 52.85 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 43.04 44.75 47.18 43.31 45.51 49.13 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 50.46 51.91 56.90 50.65 51.62 56.14 50.84 2.27 -7.92 50.26 2.83 -8.18 ULMN 3 1a0j_c13 TRYPSIN user 14 3 # 14 B 57 HIS B 154 HIS^? 5.27 C1 EDO B 192 B 102 ASP B 151 ASP^? -3.26 O1 EDO B 192s B 193 GLY B 175 GLY.? -3.40 C1 EDO B 193s coo 44.08 45.58 52.81 45.86 46.55 52.85 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 43.04 44.75 47.18 43.31 45.51 49.13 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 50.46 51.91 56.90 50.65 51.62 56.14 39.99 28.43 -27.51 40.50 28.66 -26.90 1a0j_c13 source 1a0j TRYPSIN : 14 hits 1a0j_c13 naa= 3 ULMN 3 1a0j_c14 TRYPSIN user 1 3 # 1 C 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 C 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 C 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 34.37 41.18 73.21 34.04 43.09 73.87 64.74 13.84 22.58 64.60 13.48 24.65 coo 34.89 38.34 78.12 35.11 39.59 76.42 68.86 12.45 19.04 67.57 12.48 20.71 coo 35.43 51.03 72.12 35.20 50.72 72.87 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1a0j_c14 TRYPSIN user 2 3 # 2 C 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 C 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 C 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 34.37 41.18 73.21 34.04 43.09 73.87 64.74 13.84 22.58 64.60 13.48 24.65 coo 34.89 38.34 78.12 35.11 39.59 76.42 68.86 12.45 19.04 67.57 12.48 20.71 coo 35.43 51.03 72.12 35.20 50.72 72.87 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1a0j_c14 TRYPSIN user 3 3 # 3 C 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 C 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 C 193 GLY A 119 GLY~? 20.44 CM MPD A 191 coo 34.37 41.18 73.21 34.04 43.09 73.87 64.74 13.84 22.58 64.60 13.48 24.65 coo 34.89 38.34 78.12 35.11 39.59 76.42 68.86 12.45 19.04 67.57 12.48 20.71 coo 35.43 51.03 72.12 35.20 50.72 72.87 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1a0j_c14 TRYPSIN user 4 3 # 4 C 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 C 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 C 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 34.37 41.18 73.21 34.04 43.09 73.87 64.74 13.84 22.58 64.60 13.48 24.65 coo 34.89 38.34 78.12 35.11 39.59 76.42 66.73 9.65 23.28 68.51 8.93 24.16 coo 35.43 51.03 72.12 35.20 50.72 72.87 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1a0j_c14 TRYPSIN user 5 3 # 5 C 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 C 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 C 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 34.37 41.18 73.21 34.04 43.09 73.87 64.74 13.84 22.58 64.60 13.48 24.65 coo 34.89 38.34 78.12 35.11 39.59 76.42 66.73 9.65 23.28 68.51 8.93 24.16 coo 35.43 51.03 72.12 35.20 50.72 72.87 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1a0j_c14 TRYPSIN user 6 3 # 6 C 57 HIS A 65 HIS^? 6.20 C1 EDO A 189 C 102 ASP A 48 ASP^? -5.54 C1 EDO A 189s C 193 GLY A 71 GLY^? 15.15 O2 EDO A 188 coo 34.37 41.18 73.21 34.04 43.09 73.87 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 34.89 38.34 78.12 35.11 39.59 76.42 57.58 16.65 0.08 56.71 16.10 -1.78 coo 35.43 51.03 72.12 35.20 50.72 72.87 51.64 28.27 -4.12 51.34 27.67 -3.59 ULMN 3 1a0j_c14 TRYPSIN user 7 3 # 7 C 57 HIS A 154 HIS^? 17.90 CM MPD A 191 C 102 ASP A 151 ASP^? 20.35 CM MPD A 191 C 193 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo 34.37 41.18 73.21 34.04 43.09 73.87 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 34.89 38.34 78.12 35.11 39.59 76.42 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 35.43 51.03 72.12 35.20 50.72 72.87 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 1a0j_c14 TRYPSIN user 8 3 # 8 C 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 C 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 C 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 34.37 41.18 73.21 34.04 43.09 73.87 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 34.89 38.34 78.12 35.11 39.59 76.42 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 35.43 51.03 72.12 35.20 50.72 72.87 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1a0j_c14 TRYPSIN user 9 3 # 9 C 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 C 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 C 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 34.37 41.18 73.21 34.04 43.09 73.87 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 34.89 38.34 78.12 35.11 39.59 76.42 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 35.43 51.03 72.12 35.20 50.72 72.87 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1a0j_c14 TRYPSIN user 10 3 # 10 C 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 C 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 C 193 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 34.37 41.18 73.21 34.04 43.09 73.87 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 34.89 38.34 78.12 35.11 39.59 76.42 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 35.43 51.03 72.12 35.20 50.72 72.87 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1a0j_c14 TRYPSIN user 11 3 # 11 C 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 C 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 C 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 34.37 41.18 73.21 34.04 43.09 73.87 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 34.89 38.34 78.12 35.11 39.59 76.42 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 35.43 51.03 72.12 35.20 50.72 72.87 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1a0j_c14 TRYPSIN user 12 3 # 12 C 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 C 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 C 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 34.37 41.18 73.21 34.04 43.09 73.87 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 34.89 38.34 78.12 35.11 39.59 76.42 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 35.43 51.03 72.12 35.20 50.72 72.87 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1a0j_c14 TRYPSIN user 13 3 # 13 C 57 HIS B 65 HIS^? -5.26 O1 EDO B 189s C 102 ASP B 48 ASP^? 5.72 O1 EDO B 189 C 193 GLY B 71 GLY^? 6.08 O1 EDO A 190 coo 34.37 41.18 73.21 34.04 43.09 73.87 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 34.89 38.34 78.12 35.11 39.59 76.42 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 35.43 51.03 72.12 35.20 50.72 72.87 50.84 2.27 -7.92 50.26 2.83 -8.18 ULMN 3 1a0j_c14 TRYPSIN user 14 3 # 14 C 57 HIS B 154 HIS^? 5.27 C1 EDO B 192 C 102 ASP B 151 ASP^? -3.26 O1 EDO B 192s C 193 GLY B 175 GLY.? -3.40 C1 EDO B 193s coo 34.37 41.18 73.21 34.04 43.09 73.87 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 34.89 38.34 78.12 35.11 39.59 76.42 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 35.43 51.03 72.12 35.20 50.72 72.87 39.99 28.43 -27.51 40.50 28.66 -26.90 1a0j_c14 source 1a0j TRYPSIN : 14 hits 1a0j_c14 naa= 3 ULMN 3 1a0j_c15 TRYPSIN user 1 3 # 1 D 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 D 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 D 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 8.19 15.01 95.72 7.78 16.53 97.01 64.74 13.84 22.58 64.60 13.48 24.65 coo 13.53 16.28 93.98 11.45 16.21 94.40 68.86 12.45 19.04 67.57 12.48 20.71 coo 1.80 21.25 100.04 2.61 21.42 100.18 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1a0j_c15 TRYPSIN user 2 3 # 2 D 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 D 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 D 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 8.19 15.01 95.72 7.78 16.53 97.01 64.74 13.84 22.58 64.60 13.48 24.65 coo 13.53 16.28 93.98 11.45 16.21 94.40 68.86 12.45 19.04 67.57 12.48 20.71 coo 1.80 21.25 100.04 2.61 21.42 100.18 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1a0j_c15 TRYPSIN user 3 3 # 3 D 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 D 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 D 193 GLY A 119 GLY~? 20.44 CM MPD A 191 coo 8.19 15.01 95.72 7.78 16.53 97.01 64.74 13.84 22.58 64.60 13.48 24.65 coo 13.53 16.28 93.98 11.45 16.21 94.40 68.86 12.45 19.04 67.57 12.48 20.71 coo 1.80 21.25 100.04 2.61 21.42 100.18 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1a0j_c15 TRYPSIN user 4 3 # 4 D 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 D 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 D 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 8.19 15.01 95.72 7.78 16.53 97.01 64.74 13.84 22.58 64.60 13.48 24.65 coo 13.53 16.28 93.98 11.45 16.21 94.40 66.73 9.65 23.28 68.51 8.93 24.16 coo 1.80 21.25 100.04 2.61 21.42 100.18 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1a0j_c15 TRYPSIN user 5 3 # 5 D 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 D 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 D 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 8.19 15.01 95.72 7.78 16.53 97.01 64.74 13.84 22.58 64.60 13.48 24.65 coo 13.53 16.28 93.98 11.45 16.21 94.40 66.73 9.65 23.28 68.51 8.93 24.16 coo 1.80 21.25 100.04 2.61 21.42 100.18 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1a0j_c15 TRYPSIN user 6 3 # 6 D 57 HIS A 65 HIS^? 6.20 C1 EDO A 189 D 102 ASP A 48 ASP^? -5.54 C1 EDO A 189s D 193 GLY A 71 GLY^? 15.15 O2 EDO A 188 coo 8.19 15.01 95.72 7.78 16.53 97.01 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 13.53 16.28 93.98 11.45 16.21 94.40 57.58 16.65 0.08 56.71 16.10 -1.78 coo 1.80 21.25 100.04 2.61 21.42 100.18 51.64 28.27 -4.12 51.34 27.67 -3.59 ULMN 3 1a0j_c15 TRYPSIN user 7 3 # 7 D 57 HIS A 154 HIS^? 17.90 CM MPD A 191 D 102 ASP A 151 ASP^? 20.35 CM MPD A 191 D 193 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo 8.19 15.01 95.72 7.78 16.53 97.01 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 13.53 16.28 93.98 11.45 16.21 94.40 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 1.80 21.25 100.04 2.61 21.42 100.18 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 1a0j_c15 TRYPSIN user 8 3 # 8 D 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 D 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 D 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 8.19 15.01 95.72 7.78 16.53 97.01 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 13.53 16.28 93.98 11.45 16.21 94.40 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 1.80 21.25 100.04 2.61 21.42 100.18 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1a0j_c15 TRYPSIN user 9 3 # 9 D 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 D 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 D 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 8.19 15.01 95.72 7.78 16.53 97.01 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 13.53 16.28 93.98 11.45 16.21 94.40 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 1.80 21.25 100.04 2.61 21.42 100.18 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1a0j_c15 TRYPSIN user 10 3 # 10 D 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 D 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 D 193 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 8.19 15.01 95.72 7.78 16.53 97.01 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 13.53 16.28 93.98 11.45 16.21 94.40 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 1.80 21.25 100.04 2.61 21.42 100.18 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1a0j_c15 TRYPSIN user 11 3 # 11 D 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 D 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 D 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 8.19 15.01 95.72 7.78 16.53 97.01 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 13.53 16.28 93.98 11.45 16.21 94.40 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 1.80 21.25 100.04 2.61 21.42 100.18 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1a0j_c15 TRYPSIN user 12 3 # 12 D 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 D 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 D 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 8.19 15.01 95.72 7.78 16.53 97.01 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 13.53 16.28 93.98 11.45 16.21 94.40 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 1.80 21.25 100.04 2.61 21.42 100.18 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1a0j_c15 TRYPSIN user 13 3 # 13 D 57 HIS B 65 HIS^? -5.26 O1 EDO B 189s D 102 ASP B 48 ASP^? 5.72 O1 EDO B 189 D 193 GLY B 71 GLY^? 6.08 O1 EDO A 190 coo 8.19 15.01 95.72 7.78 16.53 97.01 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 13.53 16.28 93.98 11.45 16.21 94.40 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 1.80 21.25 100.04 2.61 21.42 100.18 50.84 2.27 -7.92 50.26 2.83 -8.18 ULMN 3 1a0j_c15 TRYPSIN user 14 3 # 14 D 57 HIS B 154 HIS^? 5.27 C1 EDO B 192 D 102 ASP B 151 ASP^? -3.26 O1 EDO B 192s D 193 GLY B 175 GLY.? -3.40 C1 EDO B 193s coo 8.19 15.01 95.72 7.78 16.53 97.01 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 13.53 16.28 93.98 11.45 16.21 94.40 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 1.80 21.25 100.04 2.61 21.42 100.18 39.99 28.43 -27.51 40.50 28.66 -26.90 1a0j_c15 source 1a0j TRYPSIN : 14 hits 1a0j_c15 naa= 3 ULMN 3 1a41_c01 TOPOISOMERASE I user 1 3 # 1 223 ARG A 116 ARG~? 15.92 O1 EDO B 190 265 HIS A 58 HIS.? 21.11 O2 MPD A 191 274 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo -15.18 55.46 8.55 -14.82 52.98 10.38 59.64 3.34 19.37 61.78 2.26 17.40 coo -14.48 45.59 11.18 -14.02 47.49 10.42 64.74 13.84 22.58 64.60 13.48 24.65 coo 0.94 52.26 9.16 1.95 54.78 9.91 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 1a41_c01 TOPOISOMERASE I user 2 3 # 2 223 ARG A 116 ARG~? 15.92 O1 EDO B 190 265 HIS A 58 HIS.? 21.11 O2 MPD A 191 274 TYR A 157 TYR^? -4.51 CM MPD A 191s coo -15.18 55.46 8.55 -14.82 52.98 10.38 59.64 3.34 19.37 61.78 2.26 17.40 coo -14.48 45.59 11.18 -14.02 47.49 10.42 64.74 13.84 22.58 64.60 13.48 24.65 coo 0.94 52.26 9.16 1.95 54.78 9.91 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 1a41_c01 TOPOISOMERASE I user 3 3 # 3 223 ARG B 73 ARG^? 12.39 O2 EDO B 191 265 HIS B 76 HIS^? 9.10 C1 EDO B 189 274 TYR B 132 TYR^? 4.23 O4 MPD B 194s coo -15.18 55.46 8.55 -14.82 52.98 10.38 48.25 3.22 -16.58 47.20 1.81 -19.15 coo -14.48 45.59 11.18 -14.02 47.49 10.42 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 0.94 52.26 9.16 1.95 54.78 9.91 36.28 9.60 -22.40 35.59 10.15 -19.78 1a41_c01 source 1a41 TOPOISOMERASE I : 3 hits 1a41_c01 naa= 3 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 # 1 A 49 GLU A 21 GLU^? 11.03 O2 EDO A 190 A 60 ASP A 103 ASP^? 5.49 CM MPD A 191 A 175 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo 46.10 28.27 19.27 45.48 26.99 20.84 52.20 9.76 4.74 52.41 10.59 6.66 coo 56.42 28.06 12.93 55.01 27.92 14.50 51.58 16.40 16.66 49.70 15.49 16.18 coo 45.02 22.04 15.38 46.16 24.00 13.76 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 2 3 # 2 A 49 GLU A 31 GLU^? -3.45 O2 EDO A 189s A 60 ASP A 28 ASP.? 17.25 C2 EDO A 189 A 175 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo 46.10 28.27 19.27 45.48 26.99 20.84 61.87 12.13 2.43 62.94 11.86 0.64 coo 56.42 28.06 12.93 55.01 27.92 14.50 68.65 8.60 12.81 69.48 7.64 14.53 coo 45.02 22.04 15.38 46.16 24.00 13.76 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 3 3 # 3 A 49 GLU B 21 GLU^? 11.62 C2 EDO B 189 A 60 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 175 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 46.10 28.27 19.27 45.48 26.99 20.84 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 56.42 28.06 12.93 55.01 27.92 14.50 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 45.02 22.04 15.38 46.16 24.00 13.76 48.23 15.25 -19.35 46.43 17.40 -19.57 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 4 3 # 4 A 49 GLU B 21 GLU^? 11.62 C2 EDO B 189 A 60 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 175 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 46.10 28.27 19.27 45.48 26.99 20.84 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 56.42 28.06 12.93 55.01 27.92 14.50 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 45.02 22.04 15.38 46.16 24.00 13.76 48.23 15.25 -19.35 46.43 17.40 -19.57 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 5 3 # 5 A 49 GLU B 31 GLU^? -3.64 O2 EDO B 189s A 60 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 175 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 46.10 28.27 19.27 45.48 26.99 20.84 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 56.42 28.06 12.93 55.01 27.92 14.50 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 45.02 22.04 15.38 46.16 24.00 13.76 48.23 15.25 -19.35 46.43 17.40 -19.57 1a50_c03 source 1a50 TRYPTOPHAN SYNTHASE : 5 hits 1a50_c03 naa= 3 ULMN 3 1ab4_c00 GYRASE A user 1 3 # 1 32 ARG A 73 ARG^? 12.55 O1 EDO A 189 78 HIS A 65 HIS^? 6.20 C1 EDO A 189 122 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 48.32 72.26 30.89 48.69 69.28 31.53 53.52 27.95 4.31 55.34 28.60 6.78 coo 53.63 68.24 34.99 53.08 69.10 33.16 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 75.01 61.87 32.93 75.34 59.26 31.96 48.23 15.25 -19.35 46.43 17.40 -19.57 ULMN 3 1ab4_c00 GYRASE A user 2 3 # 2 32 ARG A 82 ARG.? 24.76 O1 EDO A 189 78 HIS A 58 HIS.? 21.11 O2 MPD A 191 122 TYR A 180 TYR^? 6.78 CM MPD A 191 coo 48.32 72.26 30.89 48.69 69.28 31.53 69.47 19.71 26.08 71.03 22.01 24.70 coo 53.63 68.24 34.99 53.08 69.10 33.16 64.74 13.84 22.58 64.60 13.48 24.65 coo 75.01 61.87 32.93 75.34 59.26 31.96 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 1ab4_c00 GYRASE A user 3 3 # 3 32 ARG A 82 ARG.? 24.76 O1 EDO A 189 78 HIS A 58 HIS.? 21.11 O2 MPD A 191 122 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 48.32 72.26 30.89 48.69 69.28 31.53 69.47 19.71 26.08 71.03 22.01 24.70 coo 53.63 68.24 34.99 53.08 69.10 33.16 64.74 13.84 22.58 64.60 13.48 24.65 coo 75.01 61.87 32.93 75.34 59.26 31.96 55.88 2.21 7.80 57.52 0.60 9.42 ULMN 3 1ab4_c00 GYRASE A user 4 3 # 4 32 ARG B 73 ARG^? 12.39 O2 EDO B 191 78 HIS B 65 HIS^? -5.26 O1 EDO B 189s 122 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo 48.32 72.26 30.89 48.69 69.28 31.53 48.25 3.22 -16.58 47.20 1.81 -19.15 coo 53.63 68.24 34.99 53.08 69.10 33.16 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 75.01 61.87 32.93 75.34 59.26 31.96 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 1ab4_c00 GYRASE A user 5 3 # 5 32 ARG B 82 ARG.? 22.52 O2 EDO B 193 78 HIS B 58 HIS.? 15.15 C2 EDO B 193 122 TYR A 7 TYR^? -3.69 C1 EDO A 188s coo 48.32 72.26 30.89 48.69 69.28 31.53 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 53.63 68.24 34.99 53.08 69.10 33.16 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 75.01 61.87 32.93 75.34 59.26 31.96 46.26 28.35 -19.62 46.61 30.00 -21.81 ULMN 3 1ab4_c00 GYRASE A user 6 3 # 6 32 ARG B 82 ARG.? 22.52 O2 EDO B 193 78 HIS B 58 HIS.? 15.15 C2 EDO B 193 122 TYR B 180 TYR^? 6.70 CM MPD B 194 coo 48.32 72.26 30.89 48.69 69.28 31.53 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 53.63 68.24 34.99 53.08 69.10 33.16 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 75.01 61.87 32.93 75.34 59.26 31.96 33.32 22.60 -18.62 32.30 20.35 -20.02 1ab4_c00 source 1ab4 GYRASE A : 6 hits 1ab4_c00 naa= 3 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 1 3 # 1 22 ASN A 159 ASN^? -4.07 O2 MPD A 191s 63 ARG A 144 ARG^? 11.59 O2 MPD A 191 255 ARG A 141 ARG^? 4.89 O4 MPD A 191 coo 42.10 13.02 11.14 41.85 11.12 10.23 42.89 17.02 22.62 43.08 19.17 22.53 coo 44.36 11.24 3.39 41.81 12.78 4.00 48.95 22.48 28.26 46.62 21.31 29.92 coo 38.40 3.83 10.26 40.02 6.30 9.25 47.94 26.40 17.24 45.84 24.19 17.73 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 2 3 # 2 22 ASN B 159 ASN^? -3.69 O2 MPD B 194s 63 ARG B 144 ARG^? 12.29 O2 MPD B 194 255 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 42.10 13.02 11.14 41.85 11.12 10.23 27.54 13.31 -23.84 27.90 11.24 -23.52 coo 44.36 11.24 3.39 41.81 12.78 4.00 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 38.40 3.83 10.26 40.02 6.30 9.25 34.68 4.05 -23.26 33.98 5.70 -20.76 1aj0_c00 source 1aj0 DIHYDROPTEROATE SYNTHASE : 2 hits 1aj0_c00 naa= 3 ULMN 3 1am5_c04 PEPSIN user 1 3 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo -7.18 8.92 145.10 -8.77 8.81 143.59 48.38 -3.74 26.58 47.39 -3.82 24.70 coo -12.30 10.35 145.24 -10.75 8.55 145.88 50.18 -2.46 21.39 48.57 -4.23 21.02 coo -8.20 12.64 138.30 -8.86 10.97 139.38 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1am5_c04 PEPSIN user 2 3 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo -7.18 8.92 145.10 -8.77 8.81 143.59 29.45 33.81 -30.55 29.73 34.07 -28.42 coo -12.30 10.35 145.24 -10.75 8.55 145.88 33.75 32.64 -27.23 32.53 34.50 -26.24 coo -8.20 12.64 138.30 -8.86 10.97 139.38 28.45 32.01 -35.99 29.78 33.29 -34.96 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 4 ASP.? 9.87 O1 EDO A 188 214 ASP B 97 ASP~? 21.83 C3 MPD B 194 289 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo -0.62 65.95 29.97 0.31 67.47 31.05 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 26.86 59.76 46.36 25.42 58.23 45.92 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 9.42 68.07 30.27 7.35 68.27 30.10 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 4 ASP.? 9.87 O1 EDO A 188 214 ASP B 122 ASP.? 7.15 O2 EDO B 192 289 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo -0.62 65.95 29.97 0.31 67.47 31.05 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 26.86 59.76 46.36 25.42 58.23 45.92 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 9.42 68.07 30.27 7.35 68.27 30.10 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 27 ASP.? 13.04 O1 EDO B 190 214 ASP B 38 ASP.? -2.58 O1 EDO B 191s 289 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo -0.62 65.95 29.97 0.31 67.47 31.05 68.29 3.95 12.18 68.54 1.87 11.74 coo 26.86 59.76 46.36 25.42 58.23 45.92 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 9.42 68.07 30.27 7.35 68.27 30.10 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP A 27 ASP.? 13.04 O1 EDO B 190 214 ASP B 48 ASP^? 5.72 O1 EDO B 189 289 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo -0.62 65.95 29.97 0.31 67.47 31.05 68.29 3.95 12.18 68.54 1.87 11.74 coo 26.86 59.76 46.36 25.42 58.23 45.92 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 9.42 68.07 30.27 7.35 68.27 30.10 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 # 5 179 ASP A 28 ASP.? 17.25 C2 EDO A 189 214 ASP B 38 ASP.? -2.58 O1 EDO B 191s 289 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo -0.62 65.95 29.97 0.31 67.47 31.05 68.65 8.60 12.81 69.48 7.64 14.53 coo 26.86 59.76 46.36 25.42 58.23 45.92 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 9.42 68.07 30.27 7.35 68.27 30.10 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 6 3 # 6 179 ASP A 28 ASP.? 17.25 C2 EDO A 189 214 ASP B 48 ASP^? 5.72 O1 EDO B 189 289 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo -0.62 65.95 29.97 0.31 67.47 31.05 68.65 8.60 12.81 69.48 7.64 14.53 coo 26.86 59.76 46.36 25.42 58.23 45.92 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 9.42 68.07 30.27 7.35 68.27 30.10 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 # 7 179 ASP A 54 ASP.? 20.27 C2 EDO A 189 214 ASP A 38 ASP.? 14.66 C5 MPD A 191 289 ASP A 101 ASP^? 14.06 CM MPD A 191 coo -0.62 65.95 29.97 0.31 67.47 31.05 68.86 12.45 19.04 67.57 12.48 20.71 coo 26.86 59.76 46.36 25.42 58.23 45.92 42.66 22.43 1.00 42.54 24.24 2.16 coo 9.42 68.07 30.27 7.35 68.27 30.10 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 8 3 # 8 179 ASP A 80 ASP.? 21.91 O1 EDO A 189 214 ASP A 122 ASP.? 22.97 CM MPD A 191 289 ASP A 54 ASP.? 20.27 C2 EDO A 189 coo -0.62 65.95 29.97 0.31 67.47 31.05 68.63 22.07 21.16 67.50 22.56 22.86 coo 26.86 59.76 46.36 25.42 58.23 45.92 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 9.42 68.07 30.27 7.35 68.27 30.10 68.86 12.45 19.04 67.57 12.48 20.71 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 9 3 # 9 179 ASP A 97 ASP~? 21.13 O4 MPD A 191 214 ASP B 4 ASP.? -7.27 O2 EDO B 190s 289 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo -0.62 65.95 29.97 0.31 67.47 31.05 60.01 27.52 25.19 61.63 28.83 24.67 coo 26.86 59.76 46.36 25.42 58.23 45.92 64.75 2.11 3.69 66.46 3.28 4.11 coo 9.42 68.07 30.27 7.35 68.27 30.10 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 10 3 # 10 179 ASP B 4 ASP.? -7.27 O2 EDO B 190s 214 ASP A 89 ASP.? 15.93 O1 EDO A 189 289 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo -0.62 65.95 29.97 0.31 67.47 31.05 64.75 2.11 3.69 66.46 3.28 4.11 coo 26.86 59.76 46.36 25.42 58.23 45.92 67.25 32.32 9.27 66.30 32.35 7.40 coo 9.42 68.07 30.27 7.35 68.27 30.10 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 11 3 # 11 179 ASP B 4 ASP.? -7.27 O2 EDO B 190s 214 ASP A 97 ASP~? 21.13 O4 MPD A 191 289 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo -0.62 65.95 29.97 0.31 67.47 31.05 64.75 2.11 3.69 66.46 3.28 4.11 coo 26.86 59.76 46.36 25.42 58.23 45.92 60.01 27.52 25.19 61.63 28.83 24.67 coo 9.42 68.07 30.27 7.35 68.27 30.10 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 12 3 # 12 179 ASP B 4 ASP.? -7.27 O2 EDO B 190s 214 ASP A 122 ASP.? 22.97 CM MPD A 191 289 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo -0.62 65.95 29.97 0.31 67.47 31.05 64.75 2.11 3.69 66.46 3.28 4.11 coo 26.86 59.76 46.36 25.42 58.23 45.92 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 9.42 68.07 30.27 7.35 68.27 30.10 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 13 3 # 13 179 ASP B 27 ASP.? 13.66 O1 EDO A 188 214 ASP A 38 ASP.? 14.66 C5 MPD A 191 289 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo -0.62 65.95 29.97 0.31 67.47 31.05 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 26.86 59.76 46.36 25.42 58.23 45.92 42.66 22.43 1.00 42.54 24.24 2.16 coo 9.42 68.07 30.27 7.35 68.27 30.10 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 14 3 # 14 179 ASP B 27 ASP.? 13.66 O1 EDO A 188 214 ASP A 48 ASP^? -5.54 C1 EDO A 189s 289 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo -0.62 65.95 29.97 0.31 67.47 31.05 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 26.86 59.76 46.36 25.42 58.23 45.92 57.58 16.65 0.08 56.71 16.10 -1.78 coo 9.42 68.07 30.27 7.35 68.27 30.10 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 15 3 # 15 179 ASP B 28 ASP.? 13.72 O2 EDO B 189 214 ASP A 38 ASP.? 14.66 C5 MPD A 191 289 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo -0.62 65.95 29.97 0.31 67.47 31.05 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 26.86 59.76 46.36 25.42 58.23 45.92 42.66 22.43 1.00 42.54 24.24 2.16 coo 9.42 68.07 30.27 7.35 68.27 30.10 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 16 3 # 16 179 ASP B 28 ASP.? 13.72 O2 EDO B 189 214 ASP A 48 ASP^? -5.54 C1 EDO A 189s 289 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo -0.62 65.95 29.97 0.31 67.47 31.05 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 26.86 59.76 46.36 25.42 58.23 45.92 57.58 16.65 0.08 56.71 16.10 -1.78 coo 9.42 68.07 30.27 7.35 68.27 30.10 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 17 3 # 17 179 ASP B 80 ASP.? 22.03 C1 EDO B 189 214 ASP B 122 ASP.? 7.15 O2 EDO B 192 289 ASP B 54 ASP.? 15.81 C2 EDO B 193 coo -0.62 65.95 29.97 0.31 67.47 31.05 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 26.86 59.76 46.36 25.42 58.23 45.92 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 9.42 68.07 30.27 7.35 68.27 30.10 50.24 18.54 -36.80 48.17 18.09 -37.17 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 18 3 # 18 179 ASP B 80 ASP.? 22.03 C1 EDO B 189 214 ASP B 151 ASP^? -3.26 O1 EDO B 192s 289 ASP B 54 ASP.? 15.81 C2 EDO B 193 coo -0.62 65.95 29.97 0.31 67.47 31.05 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 26.86 59.76 46.36 25.42 58.23 45.92 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 9.42 68.07 30.27 7.35 68.27 30.10 50.24 18.54 -36.80 48.17 18.09 -37.17 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 19 3 # 19 179 ASP B 97 ASP~? 21.83 C3 MPD B 194 214 ASP A 4 ASP.? 9.87 O1 EDO A 188 289 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo -0.62 65.95 29.97 0.31 67.47 31.05 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 26.86 59.76 46.36 25.42 58.23 45.92 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 9.42 68.07 30.27 7.35 68.27 30.10 49.28 8.80 -38.48 47.34 8.18 -39.14 1amy_c01 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 19 hits 1amy_c01 naa= 3 ULMN 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP B 4 ASP.? -7.27 O2 EDO B 190s 204 GLU A 26 GLU.? 10.86 O2 EDO A 189 289 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo -0.62 65.95 29.97 0.31 67.47 31.05 64.75 2.11 3.69 66.46 3.28 4.11 coo 4.34 62.44 32.05 4.22 64.48 32.53 66.27 6.09 6.28 67.77 7.37 5.57 coo 9.42 68.07 30.27 7.35 68.27 30.10 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP B 4 ASP.? -7.27 O2 EDO B 190s 204 GLU A 26 GLU.? 10.86 O2 EDO A 189 289 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo -0.62 65.95 29.97 0.31 67.47 31.05 64.75 2.11 3.69 66.46 3.28 4.11 coo 4.34 62.44 32.05 4.22 64.48 32.53 66.27 6.09 6.28 67.77 7.37 5.57 coo 9.42 68.07 30.27 7.35 68.27 30.10 68.65 8.60 12.81 69.48 7.64 14.53 1amy_c05 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 2 hits 1amy_c05 naa= 3 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 4 ASP.? 9.87 O1 EDO A 188 227 GLU B 61 GLU^? 10.17 C1 EDO B 189 289 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo -0.62 65.95 29.97 0.31 67.47 31.05 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 3.96 55.76 41.24 4.83 57.69 41.17 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 9.42 68.07 30.27 7.35 68.27 30.10 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 27 ASP.? 13.04 O1 EDO B 190 227 GLU A 31 GLU^? -3.45 O2 EDO A 189s 289 ASP A 54 ASP.? 20.27 C2 EDO A 189 coo -0.62 65.95 29.97 0.31 67.47 31.05 68.29 3.95 12.18 68.54 1.87 11.74 coo 3.96 55.76 41.24 4.83 57.69 41.17 61.87 12.13 2.43 62.94 11.86 0.64 coo 9.42 68.07 30.27 7.35 68.27 30.10 68.86 12.45 19.04 67.57 12.48 20.71 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 27 ASP.? 13.04 O1 EDO B 190 227 GLU A 61 GLU^? 10.22 O1 EDO A 189 289 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo -0.62 65.95 29.97 0.31 67.47 31.05 68.29 3.95 12.18 68.54 1.87 11.74 coo 3.96 55.76 41.24 4.83 57.69 41.17 66.46 19.59 10.29 68.35 19.61 9.28 coo 9.42 68.07 30.27 7.35 68.27 30.10 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP A 27 ASP.? 13.04 O1 EDO B 190 227 GLU A 173 GLU.? 15.20 O1 EDO B 190 289 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo -0.62 65.95 29.97 0.31 67.47 31.05 68.29 3.95 12.18 68.54 1.87 11.74 coo 3.96 55.76 41.24 4.83 57.69 41.17 56.04 -5.91 18.03 55.52 -6.78 16.19 coo 9.42 68.07 30.27 7.35 68.27 30.10 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 # 5 179 ASP A 54 ASP.? 20.27 C2 EDO A 189 227 GLU A 26 GLU.? 10.86 O2 EDO A 189 289 ASP A 101 ASP^? 14.06 CM MPD A 191 coo -0.62 65.95 29.97 0.31 67.47 31.05 68.86 12.45 19.04 67.57 12.48 20.71 coo 3.96 55.76 41.24 4.83 57.69 41.17 66.27 6.09 6.28 67.77 7.37 5.57 coo 9.42 68.07 30.27 7.35 68.27 30.10 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 6 3 # 6 179 ASP A 56 ASP.? 24.62 C2 EDO A 189 227 GLU A 26 GLU.? 10.86 O2 EDO A 189 289 ASP A 101 ASP^? 14.06 CM MPD A 191 coo -0.62 65.95 29.97 0.31 67.47 31.05 66.73 9.65 23.28 68.51 8.93 24.16 coo 3.96 55.76 41.24 4.83 57.69 41.17 66.27 6.09 6.28 67.77 7.37 5.57 coo 9.42 68.07 30.27 7.35 68.27 30.10 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 # 7 179 ASP A 80 ASP.? 21.91 O1 EDO A 189 227 GLU A 91 GLU.? 21.73 O1 EDO A 189 289 ASP A 97 ASP~? 21.13 O4 MPD A 191 coo -0.62 65.95 29.97 0.31 67.47 31.05 68.63 22.07 21.16 67.50 22.56 22.86 coo 3.96 55.76 41.24 4.83 57.69 41.17 66.09 34.28 12.66 67.33 35.85 13.37 coo 9.42 68.07 30.27 7.35 68.27 30.10 60.01 27.52 25.19 61.63 28.83 24.67 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 8 3 # 8 179 ASP A 101 ASP^? 14.06 CM MPD A 191 227 GLU A 61 GLU^? 10.22 O1 EDO A 189 289 ASP A 56 ASP.? 24.62 C2 EDO A 189 coo -0.62 65.95 29.97 0.31 67.47 31.05 57.05 15.04 20.11 57.86 14.10 21.77 coo 3.96 55.76 41.24 4.83 57.69 41.17 66.46 19.59 10.29 68.35 19.61 9.28 coo 9.42 68.07 30.27 7.35 68.27 30.10 66.73 9.65 23.28 68.51 8.93 24.16 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 9 3 # 9 179 ASP A 179 ASP^? 16.86 CM MPD A 191 227 GLU A 21 GLU^? 11.03 O2 EDO A 190 289 ASP A 172 ASP.? 13.07 O1 EDO B 190 coo -0.62 65.95 29.97 0.31 67.47 31.05 43.85 0.70 13.63 43.61 -0.87 12.28 coo 3.96 55.76 41.24 4.83 57.69 41.17 52.20 9.76 4.74 52.41 10.59 6.66 coo 9.42 68.07 30.27 7.35 68.27 30.10 53.63 -2.61 14.65 54.96 -1.14 13.93 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 10 3 # 10 179 ASP A 179 ASP^? 16.86 CM MPD A 191 227 GLU B 69 GLU.? -7.04 C2 EDO B 191s 289 ASP A 172 ASP.? 13.07 O1 EDO B 190 coo -0.62 65.95 29.97 0.31 67.47 31.05 43.85 0.70 13.63 43.61 -0.87 12.28 coo 3.96 55.76 41.24 4.83 57.69 41.17 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 9.42 68.07 30.27 7.35 68.27 30.10 53.63 -2.61 14.65 54.96 -1.14 13.93 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 11 3 # 11 179 ASP B 4 ASP.? -7.27 O2 EDO B 190s 227 GLU A 21 GLU^? 11.03 O2 EDO A 190 289 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo -0.62 65.95 29.97 0.31 67.47 31.05 64.75 2.11 3.69 66.46 3.28 4.11 coo 3.96 55.76 41.24 4.83 57.69 41.17 52.20 9.76 4.74 52.41 10.59 6.66 coo 9.42 68.07 30.27 7.35 68.27 30.10 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 12 3 # 12 179 ASP B 4 ASP.? -7.27 O2 EDO B 190s 227 GLU A 21 GLU^? 11.03 O2 EDO A 190 289 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo -0.62 65.95 29.97 0.31 67.47 31.05 64.75 2.11 3.69 66.46 3.28 4.11 coo 3.96 55.76 41.24 4.83 57.69 41.17 52.20 9.76 4.74 52.41 10.59 6.66 coo 9.42 68.07 30.27 7.35 68.27 30.10 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 13 3 # 13 179 ASP B 27 ASP.? 13.66 O1 EDO A 188 227 GLU B 31 GLU^? -3.64 O2 EDO B 189s 289 ASP B 54 ASP.? 15.81 C2 EDO B 193 coo -0.62 65.95 29.97 0.31 67.47 31.05 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 3.96 55.76 41.24 4.83 57.69 41.17 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 9.42 68.07 30.27 7.35 68.27 30.10 50.24 18.54 -36.80 48.17 18.09 -37.17 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 14 3 # 14 179 ASP B 27 ASP.? 13.66 O1 EDO A 188 227 GLU B 61 GLU^? 10.17 C1 EDO B 189 289 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo -0.62 65.95 29.97 0.31 67.47 31.05 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 3.96 55.76 41.24 4.83 57.69 41.17 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 9.42 68.07 30.27 7.35 68.27 30.10 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 15 3 # 15 179 ASP B 27 ASP.? 13.66 O1 EDO A 188 227 GLU B 173 GLU.? 7.59 O1 EDO B 193 289 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo -0.62 65.95 29.97 0.31 67.47 31.05 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 3.96 55.76 41.24 4.83 57.69 41.17 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 9.42 68.07 30.27 7.35 68.27 30.10 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 16 3 # 16 179 ASP B 56 ASP.? 14.25 C2 EDO B 193 227 GLU B 26 GLU.? 11.31 O2 EDO B 189 289 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo -0.62 65.95 29.97 0.31 67.47 31.05 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 3.96 55.76 41.24 4.83 57.69 41.17 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 9.42 68.07 30.27 7.35 68.27 30.10 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 17 3 # 17 179 ASP B 101 ASP^? 13.71 C2 EDO B 193 227 GLU B 61 GLU^? 10.17 C1 EDO B 189 289 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo -0.62 65.95 29.97 0.31 67.47 31.05 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 3.96 55.76 41.24 4.83 57.69 41.17 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 9.42 68.07 30.27 7.35 68.27 30.10 45.79 20.82 -38.80 46.38 21.52 -40.72 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 18 3 # 18 179 ASP B 179 ASP^? 11.34 O2 EDO A 188 227 GLU B 21 GLU^? 11.62 C2 EDO B 189 289 ASP B 172 ASP.? 7.16 C1 EDO B 193 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 3.96 55.76 41.24 4.83 57.69 41.17 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 9.42 68.07 30.27 7.35 68.27 30.10 40.45 32.96 -23.62 41.93 31.48 -23.99 1amy_c06 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 18 hits 1amy_c06 naa= 3 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 3 # 1 E 33 ASP A 151 ASP^? 20.35 CM MPD A 191 E 36 SER A 153 SER.? 20.01 CM MPD A 191 E 213 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 26.30 12.96 16.78 25.46 12.99 18.72 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 28.33 15.15 21.27 28.70 13.12 19.97 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 20.15 16.04 19.79 21.65 14.49 19.86 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 2 3 # 2 E 33 ASP B 151 ASP^? -3.26 O1 EDO B 192s E 36 SER B 153 SER.? -3.11 C2 EDO B 192s E 213 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 26.30 12.96 16.78 25.46 12.99 18.72 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 28.33 15.15 21.27 28.70 13.12 19.97 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 20.15 16.04 19.79 21.65 14.49 19.86 28.45 32.01 -35.99 29.78 33.29 -34.96 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 32 SER^? 8.67 O2 EDO A 189 A 292 ASP B 38 ASP.? -2.58 O1 EDO B 191s A 322 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 36.34 32.23 39.60 36.43 34.62 39.93 57.30 11.17 3.38 55.16 10.90 4.47 coo 19.73 19.18 41.39 21.50 18.65 40.34 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 41.69 45.14 46.60 41.78 47.19 46.18 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 2 3 # 2 A 194 SER A 142 SER^? 11.36 O4 MPD A 191 A 292 ASP A 38 ASP.? 14.66 C5 MPD A 191 A 322 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 36.34 32.23 39.60 36.43 34.62 39.93 52.28 24.44 20.99 51.62 26.22 22.49 coo 19.73 19.18 41.39 21.50 18.65 40.34 42.66 22.43 1.00 42.54 24.24 2.16 coo 41.69 45.14 46.60 41.78 47.19 46.18 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 3 3 # 3 A 194 SER B 32 SER^? 8.66 C2 EDO B 189 A 292 ASP A 38 ASP.? 14.66 C5 MPD A 191 A 322 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 36.34 32.23 39.60 36.43 34.62 39.93 50.26 19.40 -17.21 47.97 19.77 -16.73 coo 19.73 19.18 41.39 21.50 18.65 40.34 42.66 22.43 1.00 42.54 24.24 2.16 coo 41.69 45.14 46.60 41.78 47.19 46.18 54.34 6.71 -25.28 55.69 7.78 -26.49 ULMN 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 4 3 # 4 A 194 SER B 142 SER^? 12.79 C3 MPD B 194 A 292 ASP B 38 ASP.? -2.58 O1 EDO B 191s A 322 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 36.34 32.23 39.60 36.43 34.62 39.93 36.25 6.04 -28.61 35.21 4.32 -29.92 coo 19.73 19.18 41.39 21.50 18.65 40.34 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 41.69 45.14 46.60 41.78 47.19 46.18 45.35 5.36 -39.37 44.27 5.71 -41.13 1aql_c02 source 1aql BILE-SALT ACTIVATED LIPASE : 4 hits 1aql_c02 naa= 3 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 # 1 B 194 SER A 32 SER^? 8.67 O2 EDO A 189 B 292 ASP B 38 ASP.? -2.58 O1 EDO B 191s B 322 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 35.42 71.28 22.94 36.24 69.06 22.37 57.30 11.17 3.38 55.16 10.90 4.47 coo 24.74 78.07 5.59 24.32 79.03 7.46 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 48.81 64.16 26.34 49.30 62.16 26.73 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 2 3 # 2 B 194 SER A 142 SER^? 11.36 O4 MPD A 191 B 292 ASP A 38 ASP.? 14.66 C5 MPD A 191 B 322 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 35.42 71.28 22.94 36.24 69.06 22.37 52.28 24.44 20.99 51.62 26.22 22.49 coo 24.74 78.07 5.59 24.32 79.03 7.46 42.66 22.43 1.00 42.54 24.24 2.16 coo 48.81 64.16 26.34 49.30 62.16 26.73 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 3 3 # 3 B 194 SER B 32 SER^? 8.66 C2 EDO B 189 B 292 ASP A 38 ASP.? 14.66 C5 MPD A 191 B 322 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 35.42 71.28 22.94 36.24 69.06 22.37 50.26 19.40 -17.21 47.97 19.77 -16.73 coo 24.74 78.07 5.59 24.32 79.03 7.46 42.66 22.43 1.00 42.54 24.24 2.16 coo 48.81 64.16 26.34 49.30 62.16 26.73 54.34 6.71 -25.28 55.69 7.78 -26.49 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 4 3 # 4 B 194 SER B 142 SER^? 12.79 C3 MPD B 194 B 292 ASP B 38 ASP.? -2.58 O1 EDO B 191s B 322 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 35.42 71.28 22.94 36.24 69.06 22.37 36.25 6.04 -28.61 35.21 4.32 -29.92 coo 24.74 78.07 5.59 24.32 79.03 7.46 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 48.81 64.16 26.34 49.30 62.16 26.73 45.35 5.36 -39.37 44.27 5.71 -41.13 1aql_c03 source 1aql BILE-SALT ACTIVATED LIPASE : 4 hits 1aql_c03 naa= 3 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 B 325 ARG A 3 ARG.? 17.14 O2 EDO B 189 B 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 B 531 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 62.07 28.45 -23.10 65.03 28.89 -22.09 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 B 325 ARG A 3 ARG.? 17.14 O2 EDO B 189 B 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 B 531 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 62.07 28.45 -23.10 65.03 28.89 -22.09 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 B 325 ARG A 5 ARG^? -3.94 O1 EDO A 188s B 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 B 531 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 49.47 32.83 -21.72 46.80 34.39 -21.91 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 B 325 ARG A 14 ARG.? 14.51 O2 EDO B 188 B 342 ASP A 38 ASP.? 14.66 C5 MPD A 191 B 531 ARG B 14 ARG.? 10.57 O1 EDO B 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 34.22 19.89 -3.86 35.36 22.47 -5.15 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 42.66 22.43 1.00 42.54 24.24 2.16 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 36.61 9.98 2.38 38.30 7.40 2.59 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 5 3 # 5 B 325 ARG A 24 ARG^? 7.27 O2 EDO A 189 B 342 ASP A 27 ASP.? 13.04 O1 EDO B 190 B 531 ARG A 50 ARG^? 6.80 C2 EDO A 189 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 63.21 5.10 1.62 63.59 8.06 0.82 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 68.29 3.95 12.18 68.54 1.87 11.74 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 65.37 14.47 5.23 66.89 16.94 6.37 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 6 3 # 6 B 325 ARG A 50 ARG^? 6.80 C2 EDO A 189 B 342 ASP A 28 ASP.? 17.25 C2 EDO A 189 B 531 ARG A 24 ARG^? 7.27 O2 EDO A 189 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 65.37 14.47 5.23 66.89 16.94 6.37 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 68.65 8.60 12.81 69.48 7.64 14.53 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 63.21 5.10 1.62 63.59 8.06 0.82 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 7 3 # 7 B 325 ARG A 60 ARG^? 18.80 O1 EDO A 189 B 342 ASP A 28 ASP.? 17.25 C2 EDO A 189 B 531 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 67.94 16.79 18.42 70.70 18.25 18.48 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 68.65 8.60 12.81 69.48 7.64 14.53 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 8 3 # 8 B 325 ARG A 82 ARG.? 24.76 O1 EDO A 189 B 342 ASP A 97 ASP~? 21.13 O4 MPD A 191 B 531 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 69.47 19.71 26.08 71.03 22.01 24.70 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 60.01 27.52 25.19 61.63 28.83 24.67 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 9 3 # 9 B 325 ARG A 116 ARG~? 15.92 O1 EDO B 190 B 342 ASP A 27 ASP.? 13.04 O1 EDO B 190 B 531 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 59.64 3.34 19.37 61.78 2.26 17.40 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 68.29 3.95 12.18 68.54 1.87 11.74 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 10 3 # 10 B 325 ARG A 116 ARG~? 15.92 O1 EDO B 190 B 342 ASP A 28 ASP.? 17.25 C2 EDO A 189 B 531 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 59.64 3.34 19.37 61.78 2.26 17.40 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 68.65 8.60 12.81 69.48 7.64 14.53 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 11 3 # 11 B 325 ARG A 116 ARG~? 15.92 O1 EDO B 190 B 342 ASP A 101 ASP^? 14.06 CM MPD A 191 B 531 ARG A 149 ARG^? 22.01 CM MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 59.64 3.34 19.37 61.78 2.26 17.40 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 57.05 15.04 20.11 57.86 14.10 21.77 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 53.15 0.69 27.47 54.83 -1.87 27.18 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 12 3 # 12 B 325 ARG A 117 ARG~? 16.06 O2 MPD A 191 B 342 ASP A 80 ASP.? 21.91 O1 EDO A 189 B 531 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 61.14 12.50 23.45 58.83 13.31 25.34 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 68.63 22.07 21.16 67.50 22.56 22.86 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 13 3 # 13 B 325 ARG A 117 ARG~? 16.06 O2 MPD A 191 B 342 ASP A 103 ASP^? 5.49 CM MPD A 191 B 531 ARG A 60 ARG^? 18.80 O1 EDO A 189 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 61.14 12.50 23.45 58.83 13.31 25.34 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 51.58 16.40 16.66 49.70 15.49 16.18 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 67.94 16.79 18.42 70.70 18.25 18.48 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 14 3 # 14 B 325 ARG A 117 ARG~? 16.06 O2 MPD A 191 B 342 ASP A 103 ASP^? 5.49 CM MPD A 191 B 531 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 61.14 12.50 23.45 58.83 13.31 25.34 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 51.58 16.40 16.66 49.70 15.49 16.18 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 15 3 # 15 B 325 ARG A 129 ARG^? 14.04 O2 MPD A 191 B 342 ASP A 101 ASP^? 14.06 CM MPD A 191 B 531 ARG A 141 ARG^? 4.89 O4 MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 54.99 23.34 25.48 52.76 24.40 27.34 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 57.05 15.04 20.11 57.86 14.10 21.77 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 47.94 26.40 17.24 45.84 24.19 17.73 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 16 3 # 16 B 325 ARG A 141 ARG^? 4.89 O4 MPD A 191 B 342 ASP A 103 ASP^? 5.49 CM MPD A 191 B 531 ARG A 144 ARG^? 11.59 O2 MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 47.94 26.40 17.24 45.84 24.19 17.73 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 51.58 16.40 16.66 49.70 15.49 16.18 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 48.95 22.48 28.26 46.62 21.31 29.92 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 17 3 # 17 B 325 ARG A 144 ARG^? 11.59 O2 MPD A 191 B 342 ASP A 97 ASP~? 21.13 O4 MPD A 191 B 531 ARG A 141 ARG^? 4.89 O4 MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 48.95 22.48 28.26 46.62 21.31 29.92 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 60.01 27.52 25.19 61.63 28.83 24.67 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 47.94 26.40 17.24 45.84 24.19 17.73 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 18 3 # 18 B 325 ARG A 144 ARG^? 11.59 O2 MPD A 191 B 342 ASP A 101 ASP^? 14.06 CM MPD A 191 B 531 ARG A 125 ARG^? 12.17 O2 MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 48.95 22.48 28.26 46.62 21.31 29.92 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 57.05 15.04 20.11 57.86 14.10 21.77 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 47.67 10.86 32.86 45.58 12.34 31.13 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 19 3 # 19 B 325 ARG A 144 ARG^? 11.59 O2 MPD A 191 B 342 ASP A 101 ASP^? 14.06 CM MPD A 191 B 531 ARG A 141 ARG^? 4.89 O4 MPD A 191 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 48.95 22.48 28.26 46.62 21.31 29.92 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 57.05 15.04 20.11 57.86 14.10 21.77 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 47.94 26.40 17.24 45.84 24.19 17.73 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 20 3 # 20 B 325 ARG B 14 ARG.? 10.57 O1 EDO B 191 B 342 ASP B 38 ASP.? -2.58 O1 EDO B 191s B 531 ARG A 14 ARG.? 14.51 O2 EDO B 188 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 36.61 9.98 2.38 38.30 7.40 2.59 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 34.22 19.89 -3.86 35.36 22.47 -5.15 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 21 3 # 21 B 325 ARG B 50 ARG^? -6.93 O2 EDO B 189s B 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 B 531 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 22 3 # 22 B 325 ARG B 50 ARG^? -6.93 O2 EDO B 189s B 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 B 531 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 23 3 # 23 B 325 ARG B 60 ARG^? 18.79 C1 EDO B 189 B 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 B 531 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 24 3 # 24 B 325 ARG B 82 ARG.? 22.52 O2 EDO B 193 B 342 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 531 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 25 3 # 25 B 325 ARG B 116 ARG~? 5.91 C2 EDO B 193 B 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 B 531 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 26 3 # 26 B 325 ARG B 116 ARG~? 5.91 C2 EDO B 193 B 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 B 531 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 27 3 # 27 B 325 ARG B 116 ARG~? 5.91 C2 EDO B 193 B 342 ASP B 56 ASP.? 14.25 C2 EDO B 193 B 531 ARG B 149 ARG^? 5.09 O2 EDO B 193 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 32.58 29.52 -34.06 34.17 32.07 -34.76 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 28 3 # 28 B 325 ARG B 116 ARG~? 5.91 C2 EDO B 193 B 342 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 531 ARG B 149 ARG^? 5.09 O2 EDO B 193 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 32.58 29.52 -34.06 34.17 32.07 -34.76 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 29 3 # 29 B 325 ARG B 117 ARG~? 13.46 O2 EDO B 193 B 342 ASP B 80 ASP.? 22.03 C1 EDO B 189 B 531 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 35.59 7.18 -33.96 34.54 5.79 -36.47 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 30 3 # 30 B 325 ARG B 117 ARG~? 13.46 O2 EDO B 193 B 342 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 531 ARG B 60 ARG^? 18.79 C1 EDO B 189 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 50.13 14.01 -35.69 52.36 12.88 -37.47 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 31 3 # 31 B 325 ARG B 117 ARG~? 13.46 O2 EDO B 193 B 342 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 531 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 32 3 # 32 B 325 ARG B 129 ARG^? 16.59 O2 MPD B 194 B 342 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 531 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 35.59 7.18 -33.96 34.54 5.79 -36.47 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 34.68 4.05 -23.26 33.98 5.70 -20.76 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 33 3 # 33 B 325 ARG B 141 ARG^? 5.70 O4 MPD B 194 B 342 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 531 ARG B 144 ARG^? 12.29 O2 MPD B 194 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 28.02 7.86 -31.66 25.29 9.13 -32.53 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 34 3 # 34 B 325 ARG B 144 ARG^? 12.29 O2 MPD B 194 B 342 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 531 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 34.68 4.05 -23.26 33.98 5.70 -20.76 1asy_c00 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 34 hits 1asy_c00 naa= 3 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 A 325 ARG A 3 ARG.? 17.14 O2 EDO B 189 A 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 531 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 62.07 28.45 -23.10 65.03 28.89 -22.09 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 A 325 ARG A 3 ARG.? 17.14 O2 EDO B 189 A 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 531 ARG B 50 ARG^? -6.93 O2 EDO B 189s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 62.07 28.45 -23.10 65.03 28.89 -22.09 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 55.72 16.68 -23.20 56.85 15.32 -25.75 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 A 325 ARG A 3 ARG.? 17.14 O2 EDO B 189 A 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 531 ARG A 5 ARG^? -3.94 O1 EDO A 188s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 62.07 28.45 -23.10 65.03 28.89 -22.09 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 49.47 32.83 -21.72 46.80 34.39 -21.91 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 A 325 ARG A 3 ARG.? 17.14 O2 EDO B 189 A 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 531 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 62.07 28.45 -23.10 65.03 28.89 -22.09 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 5 3 # 5 A 325 ARG A 5 ARG^? -3.94 O1 EDO A 188s A 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 531 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 49.47 32.83 -21.72 46.80 34.39 -21.91 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 6 3 # 6 A 325 ARG A 5 ARG^? -3.94 O1 EDO A 188s A 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 531 ARG A 3 ARG.? 17.14 O2 EDO B 189 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 49.47 32.83 -21.72 46.80 34.39 -21.91 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 62.07 28.45 -23.10 65.03 28.89 -22.09 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 7 3 # 7 A 325 ARG A 5 ARG^? -3.94 O1 EDO A 188s A 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 531 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 49.47 32.83 -21.72 46.80 34.39 -21.91 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 8 3 # 8 A 325 ARG A 24 ARG^? 7.27 O2 EDO A 189 A 342 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 531 ARG A 50 ARG^? 6.80 C2 EDO A 189 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 63.21 5.10 1.62 63.59 8.06 0.82 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 68.29 3.95 12.18 68.54 1.87 11.74 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 65.37 14.47 5.23 66.89 16.94 6.37 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 9 3 # 9 A 325 ARG A 50 ARG^? 6.80 C2 EDO A 189 A 342 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 531 ARG A 60 ARG^? 18.80 O1 EDO A 189 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 65.37 14.47 5.23 66.89 16.94 6.37 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 68.29 3.95 12.18 68.54 1.87 11.74 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 67.94 16.79 18.42 70.70 18.25 18.48 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 10 3 # 10 A 325 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 342 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 531 ARG A 50 ARG^? 6.80 C2 EDO A 189 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 67.94 16.79 18.42 70.70 18.25 18.48 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 68.29 3.95 12.18 68.54 1.87 11.74 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 65.37 14.47 5.23 66.89 16.94 6.37 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 11 3 # 11 A 325 ARG A 82 ARG.? 24.76 O1 EDO A 189 A 342 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 531 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 69.47 19.71 26.08 71.03 22.01 24.70 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 60.01 27.52 25.19 61.63 28.83 24.67 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 12 3 # 12 A 325 ARG A 116 ARG~? 15.92 O1 EDO B 190 A 342 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 531 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 59.64 3.34 19.37 61.78 2.26 17.40 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 68.29 3.95 12.18 68.54 1.87 11.74 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 13 3 # 13 A 325 ARG A 116 ARG~? 15.92 O1 EDO B 190 A 342 ASP A 28 ASP.? 17.25 C2 EDO A 189 A 531 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 59.64 3.34 19.37 61.78 2.26 17.40 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 68.65 8.60 12.81 69.48 7.64 14.53 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 14 3 # 14 A 325 ARG A 116 ARG~? 15.92 O1 EDO B 190 A 342 ASP A 101 ASP^? 14.06 CM MPD A 191 A 531 ARG A 149 ARG^? 22.01 CM MPD A 191 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 59.64 3.34 19.37 61.78 2.26 17.40 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 57.05 15.04 20.11 57.86 14.10 21.77 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 53.15 0.69 27.47 54.83 -1.87 27.18 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 15 3 # 15 A 325 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 342 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 531 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 61.14 12.50 23.45 58.83 13.31 25.34 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 68.63 22.07 21.16 67.50 22.56 22.86 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 16 3 # 16 A 325 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 342 ASP A 103 ASP^? 5.49 CM MPD A 191 A 531 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 61.14 12.50 23.45 58.83 13.31 25.34 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 51.58 16.40 16.66 49.70 15.49 16.18 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 17 3 # 17 A 325 ARG A 141 ARG^? 4.89 O4 MPD A 191 A 342 ASP A 101 ASP^? 14.06 CM MPD A 191 A 531 ARG A 144 ARG^? 11.59 O2 MPD A 191 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 47.94 26.40 17.24 45.84 24.19 17.73 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 57.05 15.04 20.11 57.86 14.10 21.77 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 48.95 22.48 28.26 46.62 21.31 29.92 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 18 3 # 18 A 325 ARG A 144 ARG^? 11.59 O2 MPD A 191 A 342 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 531 ARG A 141 ARG^? 4.89 O4 MPD A 191 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 48.95 22.48 28.26 46.62 21.31 29.92 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 60.01 27.52 25.19 61.63 28.83 24.67 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 47.94 26.40 17.24 45.84 24.19 17.73 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 19 3 # 19 A 325 ARG A 144 ARG^? 11.59 O2 MPD A 191 A 342 ASP A 101 ASP^? 14.06 CM MPD A 191 A 531 ARG A 125 ARG^? 12.17 O2 MPD A 191 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 48.95 22.48 28.26 46.62 21.31 29.92 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 57.05 15.04 20.11 57.86 14.10 21.77 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 47.67 10.86 32.86 45.58 12.34 31.13 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 20 3 # 20 A 325 ARG A 144 ARG^? 11.59 O2 MPD A 191 A 342 ASP A 101 ASP^? 14.06 CM MPD A 191 A 531 ARG A 141 ARG^? 4.89 O4 MPD A 191 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 48.95 22.48 28.26 46.62 21.31 29.92 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 57.05 15.04 20.11 57.86 14.10 21.77 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 47.94 26.40 17.24 45.84 24.19 17.73 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 21 3 # 21 A 325 ARG A 186 ARG^? 11.98 O1 EDO B 190 A 342 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 531 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 51.29 1.08 9.05 52.68 -0.95 10.91 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 64.75 2.11 3.69 66.46 3.28 4.11 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 22 3 # 22 A 325 ARG B 24 ARG^? 8.74 O1 EDO A 188 A 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 531 ARG B 50 ARG^? -6.93 O2 EDO B 189s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 55.72 16.68 -23.20 56.85 15.32 -25.75 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 23 3 # 23 A 325 ARG B 24 ARG^? 8.74 O1 EDO A 188 A 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 531 ARG A 3 ARG.? 17.14 O2 EDO B 189 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 62.07 28.45 -23.10 65.03 28.89 -22.09 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 24 3 # 24 A 325 ARG B 24 ARG^? 8.74 O1 EDO A 188 A 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 531 ARG A 5 ARG^? -3.94 O1 EDO A 188s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 49.47 32.83 -21.72 46.80 34.39 -21.91 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 25 3 # 25 A 325 ARG B 50 ARG^? -6.93 O2 EDO B 189s A 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 531 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 26 3 # 26 A 325 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 531 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 27 3 # 27 A 325 ARG B 82 ARG.? 22.52 O2 EDO B 193 A 342 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 531 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 28 3 # 28 A 325 ARG B 116 ARG~? 5.91 C2 EDO B 193 A 342 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 531 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 29 3 # 29 A 325 ARG B 116 ARG~? 5.91 C2 EDO B 193 A 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 531 ARG A 5 ARG^? -3.94 O1 EDO A 188s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 49.47 32.83 -21.72 46.80 34.39 -21.91 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 30 3 # 30 A 325 ARG B 116 ARG~? 5.91 C2 EDO B 193 A 342 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 531 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 31 3 # 31 A 325 ARG B 116 ARG~? 5.91 C2 EDO B 193 A 342 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 531 ARG B 149 ARG^? 5.09 O2 EDO B 193 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 32.58 29.52 -34.06 34.17 32.07 -34.76 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 32 3 # 32 A 325 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 342 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 531 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 35.59 7.18 -33.96 34.54 5.79 -36.47 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 33 3 # 33 A 325 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 342 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 531 ARG B 60 ARG^? 18.79 C1 EDO B 189 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 50.13 14.01 -35.69 52.36 12.88 -37.47 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 34 3 # 34 A 325 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 342 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 531 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 35 3 # 35 A 325 ARG B 141 ARG^? 5.70 O4 MPD B 194 A 342 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 531 ARG B 144 ARG^? 12.29 O2 MPD B 194 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 28.02 7.86 -31.66 25.29 9.13 -32.53 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 36 3 # 36 A 325 ARG B 141 ARG^? 5.70 O4 MPD B 194 A 342 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 531 ARG B 144 ARG^? 12.29 O2 MPD B 194 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 28.02 7.86 -31.66 25.29 9.13 -32.53 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 37 3 # 37 A 325 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 342 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 531 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 34.68 4.05 -23.26 33.98 5.70 -20.76 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 38 3 # 38 A 325 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 342 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 531 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 24.74 19.51 -33.91 24.95 16.46 -33.56 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 39 3 # 39 A 325 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 342 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 531 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 34.68 4.05 -23.26 33.98 5.70 -20.76 1asy_c01 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 39 hits 1asy_c01 naa= 3 ULMN 3 1avf_c05 GASTRICSIN user 1 3 # 1 J 32 ASP A 151 ASP^? 20.35 CM MPD A 191 J 35 SER A 153 SER.? 20.01 CM MPD A 191 J 217 ASP A 122 ASP.? 22.97 CM MPD A 191 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 48.38 -3.74 26.58 47.39 -3.82 24.70 coo -40.93 -20.91 21.81 -38.85 -21.36 20.65 50.18 -2.46 21.39 48.57 -4.23 21.02 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 51.13 -1.78 31.54 51.32 -3.14 29.91 1avf_c05 source 1avf GASTRICSIN : 1 hits 1avf_c05 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 109 PHE~? 13.06 O2 EDO A 189 A 223 ASP A 103 ASP^? 5.49 CM MPD A 191 A 265 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 39.74 52.86 65.74 41.15 55.14 66.52 55.71 9.08 10.99 58.41 8.70 11.58 coo 30.70 47.50 67.53 29.83 49.47 67.39 51.58 16.40 16.66 49.70 15.49 16.18 coo 19.99 54.53 64.11 20.55 58.78 68.33 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ax4_c04 TRYPTOPHANASE user 2 3 # 2 A 130 PHE B 109 PHE~? 11.60 C1 EDO A 188 A 223 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 265 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 39.74 52.86 65.74 41.15 55.14 66.52 44.45 21.45 -22.32 46.25 21.85 -24.45 coo 30.70 47.50 67.53 29.83 49.47 67.39 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 19.99 54.53 64.11 20.55 58.78 68.33 25.14 19.21 -22.67 21.76 17.11 -26.55 1ax4_c04 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 109 PHE~? 13.06 O2 EDO A 189 B 223 ASP A 103 ASP^? 5.49 CM MPD A 191 B 265 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 7.48 54.94 99.62 7.67 52.27 100.42 55.71 9.08 10.99 58.41 8.70 11.58 coo 10.43 61.66 91.81 9.80 60.04 90.61 51.58 16.40 16.66 49.70 15.49 16.18 coo 5.43 58.06 80.08 8.57 53.00 79.37 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ax4_c05 TRYPTOPHANASE user 2 3 # 2 B 130 PHE B 109 PHE~? 11.60 C1 EDO A 188 B 223 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 265 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 7.48 54.94 99.62 7.67 52.27 100.42 44.45 21.45 -22.32 46.25 21.85 -24.45 coo 10.43 61.66 91.81 9.80 60.04 90.61 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 5.43 58.06 80.08 8.57 53.00 79.37 25.14 19.21 -22.67 21.76 17.11 -26.55 1ax4_c05 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 109 PHE~? 13.06 O2 EDO A 189 C 223 ASP A 103 ASP^? 5.49 CM MPD A 191 C 265 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -6.55 73.45 23.60 -6.77 71.48 21.66 55.71 9.08 10.99 58.41 8.70 11.58 coo -9.52 75.74 33.62 -8.85 73.74 33.93 51.58 16.40 16.66 49.70 15.49 16.18 coo -4.44 67.20 42.32 -7.50 62.41 40.49 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ax4_c06 TRYPTOPHANASE user 2 3 # 2 C 130 PHE B 109 PHE~? 11.60 C1 EDO A 188 C 223 ASP B 103 ASP^? 5.57 C5 MPD B 194 C 265 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -6.55 73.45 23.60 -6.77 71.48 21.66 44.45 21.45 -22.32 46.25 21.85 -24.45 coo -9.52 75.74 33.62 -8.85 73.74 33.93 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -4.44 67.20 42.32 -7.50 62.41 40.49 25.14 19.21 -22.67 21.76 17.11 -26.55 1ax4_c06 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 109 PHE~? 13.06 O2 EDO A 189 D 223 ASP A 103 ASP^? 5.49 CM MPD A 191 D 265 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -38.60 55.38 52.70 -40.06 57.72 53.04 55.71 9.08 10.99 58.41 8.70 11.58 coo -29.46 51.67 48.51 -28.63 53.31 49.56 51.58 16.40 16.66 49.70 15.49 16.18 coo -18.87 56.53 54.79 -19.47 62.22 53.03 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ax4_c07 TRYPTOPHANASE user 2 3 # 2 D 130 PHE B 109 PHE~? 11.60 C1 EDO A 188 D 223 ASP B 103 ASP^? 5.57 C5 MPD B 194 D 265 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -38.60 55.38 52.70 -40.06 57.72 53.04 44.45 21.45 -22.32 46.25 21.85 -24.45 coo -29.46 51.67 48.51 -28.63 53.31 49.56 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -18.87 56.53 54.79 -19.47 62.22 53.03 25.14 19.21 -22.67 21.76 17.11 -26.55 1ax4_c07 source 1ax4 TRYPTOPHANASE : 2 hits 1ax4_c07 naa= 3 ULMN 3 1b5d_c00 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 1 3 # 1 A 148 CYH A 99 CYH.? 13.00 O4 MPD A 191 A 179 ASP A 103 ASP^? 5.49 CM MPD A 191 A 183 GLN A 145 GLN^? 5.80 O2 MPD A 191 coo 21.87 3.71 21.27 20.32 3.55 23.64 58.08 21.10 22.79 55.99 22.56 21.69 coo 17.09 11.24 20.19 17.85 10.05 21.76 51.58 16.40 16.66 49.70 15.49 16.18 coo 19.54 13.23 15.90 21.64 12.89 15.61 49.04 16.64 22.28 49.83 15.93 20.47 ULMN 3 1b5d_c00 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 2 3 # 2 A 148 CYH B 99 CYH.? 13.42 O2 MPD B 194 A 179 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 183 GLN B 145 GLN^? 5.59 O2 MPD B 194 coo 21.87 3.71 21.27 20.32 3.55 23.64 39.68 9.38 -33.42 38.76 7.79 -31.29 coo 17.09 11.24 20.19 17.85 10.05 21.76 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 19.54 13.23 15.90 21.64 12.89 15.61 32.37 13.58 -27.30 34.23 14.31 -26.47 1b5d_c00 source 1b5d DEOXYCYTIDYLATE HYDROXYMETHYLASE : 2 hits 1b5d_c00 naa= 3 ULMN 3 1b5d_c01 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 1 3 # 1 B 148 CYH A 99 CYH.? 13.00 O4 MPD A 191 B 179 ASP A 103 ASP^? 5.49 CM MPD A 191 B 183 GLN A 145 GLN^? 5.80 O2 MPD A 191 coo 30.30 0.93 3.58 31.01 1.18 0.88 58.08 21.10 22.79 55.99 22.56 21.69 coo 26.42 -6.51 0.59 28.13 -5.32 0.24 51.58 16.40 16.66 49.70 15.49 16.18 coo 24.68 -8.53 5.16 25.68 -8.09 7.00 49.04 16.64 22.28 49.83 15.93 20.47 ULMN 3 1b5d_c01 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 2 3 # 2 B 148 CYH B 99 CYH.? 13.42 O2 MPD B 194 B 179 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 183 GLN B 145 GLN^? 5.59 O2 MPD B 194 coo 30.30 0.93 3.58 31.01 1.18 0.88 39.68 9.38 -33.42 38.76 7.79 -31.29 coo 26.42 -6.51 0.59 28.13 -5.32 0.24 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 24.68 -8.53 5.16 25.68 -8.09 7.00 32.37 13.58 -27.30 34.23 14.31 -26.47 1b5d_c01 source 1b5d DEOXYCYTIDYLATE HYDROXYMETHYLASE : 2 hits 1b5d_c01 naa= 3 ULMN 3 1b5d_c04 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 1 3 # 1 A 60 GLU A 161 GLU.? 9.37 O2 MPD A 191 A 148 CYH A 99 CYH.? 13.00 O4 MPD A 191 A 179 ASP A 103 ASP^? 5.49 CM MPD A 191 coo 20.47 15.77 27.32 19.04 14.27 26.94 45.67 22.34 23.77 46.84 23.71 24.88 coo 21.87 3.71 21.27 20.32 3.55 23.64 58.08 21.10 22.79 55.99 22.56 21.69 coo 17.09 11.24 20.19 17.85 10.05 21.76 51.58 16.40 16.66 49.70 15.49 16.18 ULMN 3 1b5d_c04 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 2 3 # 2 A 60 GLU B 161 GLU.? 9.05 O2 MPD B 194 A 148 CYH B 99 CYH.? 13.42 O2 MPD B 194 A 179 ASP B 103 ASP^? 5.57 C5 MPD B 194 coo 20.47 15.77 27.32 19.04 14.27 26.94 28.86 7.94 -26.27 29.12 6.39 -27.73 coo 21.87 3.71 21.27 20.32 3.55 23.64 39.68 9.38 -33.42 38.76 7.79 -31.29 coo 17.09 11.24 20.19 17.85 10.05 21.76 37.95 13.84 -24.45 36.74 14.66 -22.84 1b5d_c04 source 1b5d DEOXYCYTIDYLATE HYDROXYMETHYLASE : 2 hits 1b5d_c04 naa= 3 ULMN 3 1b5d_c05 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 1 3 # 1 B 60 GLU A 161 GLU.? 9.37 O2 MPD A 191 B 148 CYH A 99 CYH.? 13.00 O4 MPD A 191 B 179 ASP A 103 ASP^? 5.49 CM MPD A 191 coo 34.11 -11.05 -1.22 32.89 -9.54 -2.05 45.67 22.34 23.77 46.84 23.71 24.88 coo 30.30 0.93 3.58 31.01 1.18 0.88 58.08 21.10 22.79 55.99 22.56 21.69 coo 26.42 -6.51 0.59 28.13 -5.32 0.24 51.58 16.40 16.66 49.70 15.49 16.18 ULMN 3 1b5d_c05 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 2 3 # 2 B 60 GLU B 161 GLU.? 9.05 O2 MPD B 194 B 148 CYH B 99 CYH.? 13.42 O2 MPD B 194 B 179 ASP B 103 ASP^? 5.57 C5 MPD B 194 coo 34.11 -11.05 -1.22 32.89 -9.54 -2.05 28.86 7.94 -26.27 29.12 6.39 -27.73 coo 30.30 0.93 3.58 31.01 1.18 0.88 39.68 9.38 -33.42 38.76 7.79 -31.29 coo 26.42 -6.51 0.59 28.13 -5.32 0.24 37.95 13.84 -24.45 36.74 14.66 -22.84 1b5d_c05 source 1b5d DEOXYCYTIDYLATE HYDROXYMETHYLASE : 2 hits 1b5d_c05 naa= 3 ULMN 3 1b66_c00 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASEuser 1 3 # 1 A 133 GLU A 91 GLU.? 21.73 O1 EDO A 189 B 88 ASP B 80 ASP.? 22.03 C1 EDO B 189 B 89 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 44.53 38.98 5.35 43.53 40.60 6.22 66.09 34.28 12.66 67.33 35.85 13.37 coo 58.74 13.49 55.78 58.72 14.38 57.67 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 60.89 12.20 60.42 60.43 13.81 61.68 45.35 5.36 -39.37 44.27 5.71 -41.13 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 A 91 GLU.? 21.73 O1 EDO A 189 B 88 ASP B 80 ASP.? 22.03 C1 EDO B 189 B 89 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 44.53 38.98 5.35 43.53 40.60 6.22 66.09 34.28 12.66 67.33 35.85 13.37 coo 58.74 13.49 55.78 58.72 14.38 57.67 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 60.89 12.20 60.42 60.43 13.81 61.68 45.35 5.36 -39.37 44.27 5.71 -41.13 1b66_c02 source 1b66 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASE : 1 hits 1b66_c02 naa= 3 ULMN 3 1b6g_c00 HALOALKANE DEHALOGENASE user 1 3 # 1 124 ASP A 80 ASP.? 21.91 O1 EDO A 189 260 ASP A 97 ASP~? 21.13 O4 MPD A 191 289 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 30.43 27.27 28.31 29.04 28.69 29.00 68.63 22.07 21.16 67.50 22.56 22.86 coo 34.79 33.03 22.11 33.47 32.83 23.76 60.01 27.52 25.19 61.63 28.83 24.67 coo 30.83 30.57 23.91 30.62 30.06 25.92 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1b6g_c00 HALOALKANE DEHALOGENASE user 2 3 # 2 124 ASP A 97 ASP~? 21.13 O4 MPD A 191 260 ASP A 80 ASP.? 21.91 O1 EDO A 189 289 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 30.43 27.27 28.31 29.04 28.69 29.00 60.01 27.52 25.19 61.63 28.83 24.67 coo 34.79 33.03 22.11 33.47 32.83 23.76 68.63 22.07 21.16 67.50 22.56 22.86 coo 30.83 30.57 23.91 30.62 30.06 25.92 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1b6g_c00 HALOALKANE DEHALOGENASE user 3 3 # 3 124 ASP B 80 ASP.? 22.03 C1 EDO B 189 260 ASP B 97 ASP~? 21.83 C3 MPD B 194 289 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 30.43 27.27 28.31 29.04 28.69 29.00 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 34.79 33.03 22.11 33.47 32.83 23.76 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 30.83 30.57 23.91 30.62 30.06 25.92 45.35 5.36 -39.37 44.27 5.71 -41.13 ULMN 3 1b6g_c00 HALOALKANE DEHALOGENASE user 4 3 # 4 124 ASP B 97 ASP~? 21.83 C3 MPD B 194 260 ASP B 80 ASP.? 22.03 C1 EDO B 189 289 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 30.43 27.27 28.31 29.04 28.69 29.00 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 34.79 33.03 22.11 33.47 32.83 23.76 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 30.83 30.57 23.91 30.62 30.06 25.92 45.35 5.36 -39.37 44.27 5.71 -41.13 1b6g_c00 source 1b6g HALOALKANE DEHALOGENASE : 4 hits 1b6g_c00 naa= 3 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 A 145 TYR A 147 TYR^? 9.49 CM MPD A 191 A 230 ASP A 103 ASP^? 5.49 CM MPD A 191 A 273 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 9.23 21.44 106.88 10.18 19.34 105.31 50.88 9.76 23.94 51.01 10.64 21.28 coo 1.45 22.80 104.16 2.58 21.02 104.01 51.58 16.40 16.66 49.70 15.49 16.18 coo 2.97 11.64 107.87 6.59 15.13 107.03 40.42 10.96 22.74 39.85 13.02 27.76 1b8g_c04 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 1 hits 1b8g_c04 naa= 3 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 B 145 TYR A 147 TYR^? 9.49 CM MPD A 191 B 230 ASP A 103 ASP^? 5.49 CM MPD A 191 B 273 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 11.81 13.41 73.03 10.00 13.03 75.12 50.88 9.76 23.94 51.01 10.64 21.28 coo 19.17 11.01 76.14 17.26 10.42 76.77 51.58 16.40 16.66 49.70 15.49 16.18 coo 11.10 2.31 76.60 10.24 7.24 75.62 40.42 10.96 22.74 39.85 13.02 27.76 1b8g_c05 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 1 hits 1b8g_c05 naa= 3 ULMN 3 1bbs_c06 RENIN user 1 3 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 61.19 45.85 78.73 62.86 45.48 77.48 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 66.00 46.17 80.29 64.31 47.92 79.91 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 63.61 40.10 74.06 64.05 42.07 74.70 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1bbs_c06 RENIN user 2 3 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 61.19 45.85 78.73 62.86 45.48 77.48 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 66.00 46.17 80.29 64.31 47.92 79.91 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 63.61 40.10 74.06 64.05 42.07 74.70 28.45 32.01 -35.99 29.78 33.29 -34.96 1bbs_c06 source 1bbs RENIN : 2 hits 1bbs_c06 naa= 3 ULMN 3 1bbs_c07 RENIN user 1 3 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 61.19 45.85 78.73 62.86 45.48 77.48 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 66.00 46.17 80.29 64.31 47.92 79.91 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 63.61 40.10 74.06 64.05 42.07 74.70 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1bbs_c07 RENIN user 2 3 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 61.19 45.85 78.73 62.86 45.48 77.48 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 66.00 46.17 80.29 64.31 47.92 79.91 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 63.61 40.10 74.06 64.05 42.07 74.70 28.45 32.01 -35.99 29.78 33.29 -34.96 1bbs_c07 source 1bbs RENIN : 2 hits 1bbs_c07 naa= 3 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 A 137 ARG A 73 ARG^? 12.55 O1 EDO A 189 A 141 THR A 70 THR.? 16.47 O2 EDO A 188 A 235 ASP A 87 ASP^? 16.43 O1 EDO A 189 coo 6.21 93.81 36.58 4.58 96.33 37.17 53.52 27.95 4.31 55.34 28.60 6.78 coo 6.80 92.87 28.33 4.91 92.74 27.40 48.03 28.89 -3.16 47.24 28.55 -1.16 coo 12.98 90.36 47.57 11.26 89.62 46.62 63.41 29.58 11.55 64.59 31.41 11.51 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 A 137 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 141 THR A 112 THR~? 15.04 CM MPD A 191 A 235 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 6.21 93.81 36.58 4.58 96.33 37.17 61.14 12.50 23.45 58.83 13.31 25.34 coo 6.80 92.87 28.33 4.91 92.74 27.40 55.36 7.21 17.13 56.15 5.85 15.65 coo 12.98 90.36 47.57 11.26 89.62 46.62 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 A 137 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 141 THR A 112 THR~? 15.04 CM MPD A 191 A 235 ASP A 97 ASP~? 21.13 O4 MPD A 191 coo 6.21 93.81 36.58 4.58 96.33 37.17 61.14 12.50 23.45 58.83 13.31 25.34 coo 6.80 92.87 28.33 4.91 92.74 27.40 55.36 7.21 17.13 56.15 5.85 15.65 coo 12.98 90.36 47.57 11.26 89.62 46.62 60.01 27.52 25.19 61.63 28.83 24.67 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 A 137 ARG B 24 ARG^? 8.74 O1 EDO A 188 A 141 THR A 8 THR^? 7.16 O2 EDO A 188 A 235 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 6.21 93.81 36.58 4.58 96.33 37.17 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 6.80 92.87 28.33 4.91 92.74 27.40 45.31 26.69 -14.00 46.39 27.17 -12.13 coo 12.98 90.36 47.57 11.26 89.62 46.62 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 A 137 ARG B 24 ARG^? 8.74 O1 EDO A 188 A 141 THR A 8 THR^? 7.16 O2 EDO A 188 A 235 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo 6.21 93.81 36.58 4.58 96.33 37.17 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 6.80 92.87 28.33 4.91 92.74 27.40 45.31 26.69 -14.00 46.39 27.17 -12.13 coo 12.98 90.36 47.57 11.26 89.62 46.62 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 A 137 ARG B 73 ARG^? 12.39 O2 EDO B 191 A 141 THR B 70 THR.? 4.22 O2 EDO B 191 A 235 ASP B 87 ASP^? 16.44 C1 EDO B 189 coo 6.21 93.81 36.58 4.58 96.33 37.17 48.25 3.22 -16.58 47.20 1.81 -19.15 coo 6.80 92.87 28.33 4.91 92.74 27.40 47.36 1.42 -6.55 45.59 1.83 -7.73 coo 12.98 90.36 47.57 11.26 89.62 46.62 51.11 1.31 -27.58 52.14 -0.39 -28.24 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 7 3 # 7 A 137 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 141 THR B 112 THR~? 7.30 C1 EDO B 193 A 235 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 6.21 93.81 36.58 4.58 96.33 37.17 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 6.80 92.87 28.33 4.91 92.74 27.40 40.35 23.17 -26.98 41.74 24.62 -26.32 coo 12.98 90.36 47.57 11.26 89.62 46.62 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 8 3 # 8 A 137 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 141 THR B 112 THR~? 7.30 C1 EDO B 193 A 235 ASP B 97 ASP~? 21.83 C3 MPD B 194 coo 6.21 93.81 36.58 4.58 96.33 37.17 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 6.80 92.87 28.33 4.91 92.74 27.40 40.35 23.17 -26.98 41.74 24.62 -26.32 coo 12.98 90.36 47.57 11.26 89.62 46.62 39.93 2.83 -36.24 41.54 1.65 -37.01 1bd3_c00 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 8 hits 1bd3_c00 naa= 3 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 D 137 ARG A 5 ARG^? -3.94 O1 EDO A 188s D 141 THR A 8 THR^? 7.16 O2 EDO A 188 D 235 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo -8.33 92.80 100.06 -7.71 95.33 98.44 49.47 32.83 -21.72 46.80 34.39 -21.91 coo -9.24 93.49 108.77 -7.37 94.21 109.61 45.31 26.69 -14.00 46.39 27.17 -12.13 coo -14.64 87.74 89.51 -12.89 87.43 90.65 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 D 137 ARG A 73 ARG^? 12.55 O1 EDO A 189 D 141 THR A 70 THR.? 16.47 O2 EDO A 188 D 235 ASP A 87 ASP^? 16.43 O1 EDO A 189 coo -8.33 92.80 100.06 -7.71 95.33 98.44 53.52 27.95 4.31 55.34 28.60 6.78 coo -9.24 93.49 108.77 -7.37 94.21 109.61 48.03 28.89 -3.16 47.24 28.55 -1.16 coo -14.64 87.74 89.51 -12.89 87.43 90.65 63.41 29.58 11.55 64.59 31.41 11.51 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 D 137 ARG A 117 ARG~? 16.06 O2 MPD A 191 D 141 THR A 112 THR~? 15.04 CM MPD A 191 D 235 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo -8.33 92.80 100.06 -7.71 95.33 98.44 61.14 12.50 23.45 58.83 13.31 25.34 coo -9.24 93.49 108.77 -7.37 94.21 109.61 55.36 7.21 17.13 56.15 5.85 15.65 coo -14.64 87.74 89.51 -12.89 87.43 90.65 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 D 137 ARG A 117 ARG~? 16.06 O2 MPD A 191 D 141 THR A 112 THR~? 15.04 CM MPD A 191 D 235 ASP A 97 ASP~? 21.13 O4 MPD A 191 coo -8.33 92.80 100.06 -7.71 95.33 98.44 61.14 12.50 23.45 58.83 13.31 25.34 coo -9.24 93.49 108.77 -7.37 94.21 109.61 55.36 7.21 17.13 56.15 5.85 15.65 coo -14.64 87.74 89.51 -12.89 87.43 90.65 60.01 27.52 25.19 61.63 28.83 24.67 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 D 137 ARG B 24 ARG^? 8.74 O1 EDO A 188 D 141 THR A 8 THR^? 7.16 O2 EDO A 188 D 235 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo -8.33 92.80 100.06 -7.71 95.33 98.44 54.81 25.46 -16.99 55.14 28.36 -15.99 coo -9.24 93.49 108.77 -7.37 94.21 109.61 45.31 26.69 -14.00 46.39 27.17 -12.13 coo -14.64 87.74 89.51 -12.89 87.43 90.65 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 D 137 ARG B 73 ARG^? 12.39 O2 EDO B 191 D 141 THR B 70 THR.? 4.22 O2 EDO B 191 D 235 ASP B 87 ASP^? 16.44 C1 EDO B 189 coo -8.33 92.80 100.06 -7.71 95.33 98.44 48.25 3.22 -16.58 47.20 1.81 -19.15 coo -9.24 93.49 108.77 -7.37 94.21 109.61 47.36 1.42 -6.55 45.59 1.83 -7.73 coo -14.64 87.74 89.51 -12.89 87.43 90.65 51.11 1.31 -27.58 52.14 -0.39 -28.24 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 7 3 # 7 D 137 ARG B 117 ARG~? 13.46 O2 EDO B 193 D 141 THR B 112 THR~? 7.30 C1 EDO B 193 D 235 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo -8.33 92.80 100.06 -7.71 95.33 98.44 41.12 18.08 -35.59 38.25 17.08 -35.73 coo -9.24 93.49 108.77 -7.37 94.21 109.61 40.35 23.17 -26.98 41.74 24.62 -26.32 coo -14.64 87.74 89.51 -12.89 87.43 90.65 49.28 8.80 -38.48 47.34 8.18 -39.14 1bd3_c01 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 7 hits 1bd3_c01 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG A 73 ARG^? 12.55 O1 EDO A 189 C 141 THR A 70 THR.? 16.47 O2 EDO A 188 C 235 ASP A 87 ASP^? 16.43 O1 EDO A 189 coo -5.79 67.26 36.83 -4.57 64.58 37.74 53.52 27.95 4.31 55.34 28.60 6.78 coo -6.81 68.31 28.28 -4.82 68.47 27.57 48.03 28.89 -3.16 47.24 28.55 -1.16 coo -13.01 70.96 47.58 -11.44 71.65 46.34 63.41 29.58 11.55 64.59 31.41 11.51 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 C 137 ARG A 117 ARG~? 16.06 O2 MPD A 191 C 141 THR A 112 THR~? 15.04 CM MPD A 191 C 235 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo -5.79 67.26 36.83 -4.57 64.58 37.74 61.14 12.50 23.45 58.83 13.31 25.34 coo -6.81 68.31 28.28 -4.82 68.47 27.57 55.36 7.21 17.13 56.15 5.85 15.65 coo -13.01 70.96 47.58 -11.44 71.65 46.34 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 C 137 ARG A 117 ARG~? 16.06 O2 MPD A 191 C 141 THR A 112 THR~? 15.04 CM MPD A 191 C 235 ASP A 97 ASP~? 21.13 O4 MPD A 191 coo -5.79 67.26 36.83 -4.57 64.58 37.74 61.14 12.50 23.45 58.83 13.31 25.34 coo -6.81 68.31 28.28 -4.82 68.47 27.57 55.36 7.21 17.13 56.15 5.85 15.65 coo -13.01 70.96 47.58 -11.44 71.65 46.34 60.01 27.52 25.19 61.63 28.83 24.67 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 C 137 ARG B 24 ARG^? 8.74 O1 EDO A 188 C 141 THR A 8 THR^? 7.16 O2 EDO A 188 C 235 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo -5.79 67.26 36.83 -4.57 64.58 37.74 54.81 25.46 -16.99 55.14 28.36 -15.99 coo -6.81 68.31 28.28 -4.82 68.47 27.57 45.31 26.69 -14.00 46.39 27.17 -12.13 coo -13.01 70.96 47.58 -11.44 71.65 46.34 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 C 137 ARG B 24 ARG^? 8.74 O1 EDO A 188 C 141 THR A 8 THR^? 7.16 O2 EDO A 188 C 235 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo -5.79 67.26 36.83 -4.57 64.58 37.74 54.81 25.46 -16.99 55.14 28.36 -15.99 coo -6.81 68.31 28.28 -4.82 68.47 27.57 45.31 26.69 -14.00 46.39 27.17 -12.13 coo -13.01 70.96 47.58 -11.44 71.65 46.34 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 C 137 ARG B 73 ARG^? 12.39 O2 EDO B 191 C 141 THR B 70 THR.? 4.22 O2 EDO B 191 C 235 ASP B 87 ASP^? 16.44 C1 EDO B 189 coo -5.79 67.26 36.83 -4.57 64.58 37.74 48.25 3.22 -16.58 47.20 1.81 -19.15 coo -6.81 68.31 28.28 -4.82 68.47 27.57 47.36 1.42 -6.55 45.59 1.83 -7.73 coo -13.01 70.96 47.58 -11.44 71.65 46.34 51.11 1.31 -27.58 52.14 -0.39 -28.24 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 7 3 # 7 C 137 ARG B 117 ARG~? 13.46 O2 EDO B 193 C 141 THR B 112 THR~? 7.30 C1 EDO B 193 C 235 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo -5.79 67.26 36.83 -4.57 64.58 37.74 41.12 18.08 -35.59 38.25 17.08 -35.73 coo -6.81 68.31 28.28 -4.82 68.47 27.57 40.35 23.17 -26.98 41.74 24.62 -26.32 coo -13.01 70.96 47.58 -11.44 71.65 46.34 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 8 3 # 8 C 137 ARG B 117 ARG~? 13.46 O2 EDO B 193 C 141 THR B 112 THR~? 7.30 C1 EDO B 193 C 235 ASP B 97 ASP~? 21.83 C3 MPD B 194 coo -5.79 67.26 36.83 -4.57 64.58 37.74 41.12 18.08 -35.59 38.25 17.08 -35.73 coo -6.81 68.31 28.28 -4.82 68.47 27.57 40.35 23.17 -26.98 41.74 24.62 -26.32 coo -13.01 70.96 47.58 -11.44 71.65 46.34 39.93 2.83 -36.24 41.54 1.65 -37.01 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 8 hits 1bd3_c02 naa= 3 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 B 137 ARG A 73 ARG^? 12.55 O1 EDO A 189 B 141 THR A 70 THR.? 16.47 O2 EDO A 188 B 235 ASP A 87 ASP^? 16.43 O1 EDO A 189 coo 8.13 67.41 100.27 7.18 68.35 97.45 53.52 27.95 4.31 55.34 28.60 6.78 coo 8.28 67.78 108.81 6.22 67.65 109.43 48.03 28.89 -3.16 47.24 28.55 -1.16 coo 14.55 73.52 89.47 12.81 73.95 90.56 63.41 29.58 11.55 64.59 31.41 11.51 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 B 137 ARG A 117 ARG~? 16.06 O2 MPD A 191 B 141 THR A 112 THR~? 15.04 CM MPD A 191 B 235 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 8.13 67.41 100.27 7.18 68.35 97.45 61.14 12.50 23.45 58.83 13.31 25.34 coo 8.28 67.78 108.81 6.22 67.65 109.43 55.36 7.21 17.13 56.15 5.85 15.65 coo 14.55 73.52 89.47 12.81 73.95 90.56 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 B 137 ARG A 117 ARG~? 16.06 O2 MPD A 191 B 141 THR A 112 THR~? 15.04 CM MPD A 191 B 235 ASP A 97 ASP~? 21.13 O4 MPD A 191 coo 8.13 67.41 100.27 7.18 68.35 97.45 61.14 12.50 23.45 58.83 13.31 25.34 coo 8.28 67.78 108.81 6.22 67.65 109.43 55.36 7.21 17.13 56.15 5.85 15.65 coo 14.55 73.52 89.47 12.81 73.95 90.56 60.01 27.52 25.19 61.63 28.83 24.67 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 B 137 ARG B 24 ARG^? 8.74 O1 EDO A 188 B 141 THR A 8 THR^? 7.16 O2 EDO A 188 B 235 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo 8.13 67.41 100.27 7.18 68.35 97.45 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 8.28 67.78 108.81 6.22 67.65 109.43 45.31 26.69 -14.00 46.39 27.17 -12.13 coo 14.55 73.52 89.47 12.81 73.95 90.56 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 B 137 ARG B 117 ARG~? 13.46 O2 EDO B 193 B 141 THR B 112 THR~? 7.30 C1 EDO B 193 B 235 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 8.13 67.41 100.27 7.18 68.35 97.45 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 8.28 67.78 108.81 6.22 67.65 109.43 40.35 23.17 -26.98 41.74 24.62 -26.32 coo 14.55 73.52 89.47 12.81 73.95 90.56 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 B 137 ARG B 117 ARG~? 13.46 O2 EDO B 193 B 141 THR B 112 THR~? 7.30 C1 EDO B 193 B 235 ASP B 97 ASP~? 21.83 C3 MPD B 194 coo 8.13 67.41 100.27 7.18 68.35 97.45 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 8.28 67.78 108.81 6.22 67.65 109.43 40.35 23.17 -26.98 41.74 24.62 -26.32 coo 14.55 73.52 89.47 12.81 73.95 90.56 39.93 2.83 -36.24 41.54 1.65 -37.01 1bd3_c03 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 6 hits 1bd3_c03 naa= 3 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 1 3 # 1 14 ASP A 48 ASP^? -5.54 C1 EDO A 189s 16 HIS A 65 HIS^? 6.20 C1 EDO A 189 67 GLY A 42 GLY.? 16.43 O2 EDO A 190 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 57.58 16.65 0.08 56.71 16.10 -1.78 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 38.18 21.47 -1.45 38.85 21.88 -1.59 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 2 3 # 2 14 ASP A 48 ASP^? -5.54 C1 EDO A 189s 16 HIS A 65 HIS^? 6.20 C1 EDO A 189 67 GLY A 90 GLY.? 17.99 O1 EDO A 189 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 57.58 16.65 0.08 56.71 16.10 -1.78 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 68.99 30.23 13.11 68.36 30.72 12.94 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 3 3 # 3 14 ASP A 56 ASP.? 24.62 C2 EDO A 189 16 HIS A 58 HIS.? 21.11 O2 MPD A 191 67 GLY A 88 GLY.? 12.79 O1 EDO A 189 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 66.73 9.65 23.28 68.51 8.93 24.16 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 64.74 13.84 22.58 64.60 13.48 24.65 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 66.43 27.54 9.22 66.36 28.23 9.60 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 4 3 # 4 14 ASP A 56 ASP.? 24.62 C2 EDO A 189 16 HIS A 58 HIS.? 21.11 O2 MPD A 191 67 GLY A 90 GLY.? 17.99 O1 EDO A 189 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 66.73 9.65 23.28 68.51 8.93 24.16 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 64.74 13.84 22.58 64.60 13.48 24.65 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 68.99 30.23 13.11 68.36 30.72 12.94 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 5 3 # 5 14 ASP A 101 ASP^? 14.06 CM MPD A 191 16 HIS A 58 HIS.? 21.11 O2 MPD A 191 67 GLY A 90 GLY.? 17.99 O1 EDO A 189 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 57.05 15.04 20.11 57.86 14.10 21.77 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 64.74 13.84 22.58 64.60 13.48 24.65 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 68.99 30.23 13.11 68.36 30.72 12.94 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 6 3 # 6 14 ASP B 48 ASP^? 5.72 O1 EDO B 189 16 HIS B 65 HIS^? -5.26 O1 EDO B 189s 67 GLY B 42 GLY.? 7.35 O1 EDO B 191 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 52.60 14.13 -14.82 53.00 14.96 -12.94 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 38.20 8.45 -1.85 38.82 8.13 -2.23 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 7 3 # 7 14 ASP B 48 ASP^? 5.72 O1 EDO B 189 16 HIS B 65 HIS^? -5.26 O1 EDO B 189s 67 GLY B 90 GLY.? 18.17 C1 EDO B 189 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 52.60 14.13 -14.82 53.00 14.96 -12.94 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 54.47 0.76 -32.31 54.10 0.32 -31.77 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 8 3 # 8 14 ASP B 80 ASP.? 22.03 C1 EDO B 189 16 HIS B 84 HIS.? 24.24 O2 MPD B 194 67 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 49.28 8.80 -38.48 47.34 8.18 -39.14 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 9 3 # 9 14 ASP B 89 ASP.? 15.59 O1 EDO B 189 16 HIS B 76 HIS^? 9.10 C1 EDO B 189 67 GLY B 71 GLY^? 6.08 O1 EDO A 190 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 50.84 2.27 -7.92 50.26 2.83 -8.18 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 10 3 # 10 14 ASP B 89 ASP.? 15.59 O1 EDO B 189 16 HIS B 76 HIS^? 9.10 C1 EDO B 189 67 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 11 3 # 11 14 ASP B 97 ASP~? 21.83 C3 MPD B 194 16 HIS B 84 HIS.? 24.24 O2 MPD B 194 67 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 12 3 # 12 14 ASP B 101 ASP^? 13.71 C2 EDO B 193 16 HIS B 58 HIS.? 15.15 C2 EDO B 193 67 GLY B 90 GLY.? 18.17 C1 EDO B 189 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 40.06 15.30 -30.43 39.63 16.39 -32.22 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 54.47 0.76 -32.31 54.10 0.32 -31.77 1be1_c02 source 1be1 GLUTAMATE MUTASE : 12 hits 1be1_c02 naa= 3 ULMN 3 1bf2_c00 ISOAMYLASE user 1 3 # 1 375 ASP B 4 ASP.? -7.27 O2 EDO B 190s 435 GLU A 26 GLU.? 10.86 O2 EDO A 189 510 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 88.62 69.90 41.16 89.05 70.67 43.04 64.75 2.11 3.69 66.46 3.28 4.11 coo 89.52 76.11 40.17 89.01 75.16 41.97 66.27 6.09 6.28 67.77 7.37 5.57 coo 84.89 77.60 46.67 85.63 75.79 46.03 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1bf2_c00 ISOAMYLASE user 2 3 # 2 375 ASP B 4 ASP.? -7.27 O2 EDO B 190s 435 GLU A 26 GLU.? 10.86 O2 EDO A 189 510 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 88.62 69.90 41.16 89.05 70.67 43.04 64.75 2.11 3.69 66.46 3.28 4.11 coo 89.52 76.11 40.17 89.01 75.16 41.97 66.27 6.09 6.28 67.77 7.37 5.57 coo 84.89 77.60 46.67 85.63 75.79 46.03 68.65 8.60 12.81 69.48 7.64 14.53 1bf2_c00 source 1bf2 ISOAMYLASE : 2 hits 1bf2_c00 naa= 3 ULMN 3 1bfd_c00 BENZOYLFORMATE DECARBOXYLASE user 1 3 # 1 28 GLU A 67 GLU^? 10.03 C1 EDO A 189 70 HIS A 65 HIS^? 6.20 C1 EDO A 189 281 HIS A 154 HIS^? 17.90 CM MPD A 191 coo 66.09 46.17 155.81 66.77 48.19 155.70 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 69.05 50.55 157.03 68.00 52.29 156.51 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 100.93 36.73 156.02 100.47 38.42 157.18 45.67 -1.54 22.26 44.90 -3.17 21.19 ULMN 3 1bfd_c00 BENZOYLFORMATE DECARBOXYLASE user 2 3 # 2 28 GLU B 67 GLU^? -5.72 C1 EDO A 190s 70 HIS B 65 HIS^? -5.26 O1 EDO B 189s 281 HIS B 154 HIS^? 5.27 C1 EDO B 192 coo 66.09 46.17 155.81 66.77 48.19 155.70 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 69.05 50.55 157.03 68.00 52.29 156.51 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 100.93 36.73 156.02 100.47 38.42 157.18 29.58 31.84 -25.39 29.63 33.61 -24.25 1bfd_c00 source 1bfd BENZOYLFORMATE DECARBOXYLASE : 2 hits 1bfd_c00 naa= 3 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 # 1 A 461 GLU A 127 GLU^? 13.22 O2 MPD A 191 A 503 TYR A 147 TYR^? 9.49 CM MPD A 191 A 537 GLU A 158 GLU^? 10.31 O2 MPD A 191 coo 24.06 146.21 11.09 22.89 146.18 9.36 49.68 14.95 31.31 48.32 16.27 32.27 coo 15.91 140.69 8.32 15.71 143.39 9.13 50.88 9.76 23.94 51.01 10.64 21.28 coo 16.65 144.44 13.24 18.34 145.22 12.33 43.36 11.29 26.55 43.12 11.25 28.63 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 2 3 # 2 A 461 GLU A 127 GLU^? 13.22 O2 MPD A 191 A 503 TYR A 157 TYR^? -4.51 CM MPD A 191s A 537 GLU A 158 GLU^? 10.31 O2 MPD A 191 coo 24.06 146.21 11.09 22.89 146.18 9.36 49.68 14.95 31.31 48.32 16.27 32.27 coo 15.91 140.69 8.32 15.71 143.39 9.13 46.12 11.16 21.21 46.22 13.94 20.83 coo 16.65 144.44 13.24 18.34 145.22 12.33 43.36 11.29 26.55 43.12 11.25 28.63 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 3 3 # 3 A 461 GLU A 139 GLU.? 13.74 O4 MPD A 191 A 503 TYR A 132 TYR^? -3.92 O4 MPD A 191s A 537 GLU A 134 GLU^? 6.11 C5 MPD A 191 coo 24.06 146.21 11.09 22.89 146.18 9.36 50.77 29.24 9.79 48.92 30.09 9.22 coo 15.91 140.69 8.32 15.71 143.39 9.13 48.86 20.67 16.01 46.69 20.01 14.37 coo 16.65 144.44 13.24 18.34 145.22 12.33 46.05 21.45 10.47 44.38 22.44 11.35 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 4 3 # 4 A 461 GLU B 127 GLU^? 12.59 O2 MPD B 194 A 503 TYR B 147 TYR^? 9.73 O2 MPD B 194 A 537 GLU B 158 GLU^? 10.92 O2 MPD B 194 coo 24.06 146.21 11.09 22.89 146.18 9.36 29.39 12.97 -34.29 27.94 11.43 -34.46 coo 15.91 140.69 8.32 15.71 143.39 9.13 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 16.65 144.44 13.24 18.34 145.22 12.33 25.38 18.84 -27.67 24.06 18.79 -29.34 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 5 3 # 5 A 461 GLU B 127 GLU^? 12.59 O2 MPD B 194 A 503 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 537 GLU B 158 GLU^? 10.92 O2 MPD B 194 coo 24.06 146.21 11.09 22.89 146.18 9.36 29.39 12.97 -34.29 27.94 11.43 -34.46 coo 15.91 140.69 8.32 15.71 143.39 9.13 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 16.65 144.44 13.24 18.34 145.22 12.33 25.38 18.84 -27.67 24.06 18.79 -29.34 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 6 3 # 6 A 461 GLU B 139 GLU.? 9.67 O2 EDO B 191 A 503 TYR B 132 TYR^? 4.23 O4 MPD B 194s A 537 GLU B 134 GLU^? -3.38 C2 EDO B 188s coo 24.06 146.21 11.09 22.89 146.18 9.36 41.80 1.11 -18.67 40.76 -0.16 -17.27 coo 15.91 140.69 8.32 15.71 143.39 9.13 36.28 9.60 -22.40 35.59 10.15 -19.78 coo 16.65 144.44 13.24 18.34 145.22 12.33 37.37 8.74 -16.44 35.46 7.85 -16.33 1bgl_c08 source 1bgl BETA-GALACTOSIDASE : 6 hits 1bgl_c08 naa= 3 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 1 3 # 1 A 451 GLU A 127 GLU^? 13.22 O2 MPD A 191 A 504 TYR A 157 TYR^? -4.51 CM MPD A 191s A 540 GLU A 158 GLU^? 10.31 O2 MPD A 191 coo 81.34 87.29 87.22 82.36 86.09 88.61 49.68 14.95 31.31 48.32 16.27 32.27 coo 80.85 81.34 94.77 81.70 80.16 92.41 46.12 11.16 21.21 46.22 13.94 20.83 coo 79.94 80.46 88.84 81.11 81.36 87.27 43.36 11.29 26.55 43.12 11.25 28.63 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 2 3 # 2 A 451 GLU A 139 GLU.? 13.74 O4 MPD A 191 A 504 TYR A 132 TYR^? -3.92 O4 MPD A 191s A 540 GLU A 134 GLU^? 6.11 C5 MPD A 191 coo 81.34 87.29 87.22 82.36 86.09 88.61 50.77 29.24 9.79 48.92 30.09 9.22 coo 80.85 81.34 94.77 81.70 80.16 92.41 48.86 20.67 16.01 46.69 20.01 14.37 coo 79.94 80.46 88.84 81.11 81.36 87.27 46.05 21.45 10.47 44.38 22.44 11.35 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 3 3 # 3 A 451 GLU B 139 GLU.? 9.67 O2 EDO B 191 A 504 TYR B 132 TYR^? 4.23 O4 MPD B 194s A 540 GLU B 134 GLU^? -3.38 C2 EDO B 188s coo 81.34 87.29 87.22 82.36 86.09 88.61 41.80 1.11 -18.67 40.76 -0.16 -17.27 coo 80.85 81.34 94.77 81.70 80.16 92.41 36.28 9.60 -22.40 35.59 10.15 -19.78 coo 79.94 80.46 88.84 81.11 81.36 87.27 37.37 8.74 -16.44 35.46 7.85 -16.33 1bhg_c02 source 1bhg BETA-GLUCURONIDASE : 3 hits 1bhg_c02 naa= 3 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 1 3 # 1 B 451 GLU A 134 GLU^? 6.11 C5 MPD A 191 B 504 TYR A 45 TYR^? 11.90 O2 EDO A 190 B 540 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 86.52 35.28 112.74 87.08 36.38 110.99 46.05 21.45 10.47 44.38 22.44 11.35 coo 84.93 40.21 105.31 85.72 41.45 107.72 47.53 19.92 0.67 46.95 18.68 3.19 coo 83.38 41.19 112.55 85.47 40.59 112.72 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 2 3 # 2 B 451 GLU B 134 GLU^? -3.38 C2 EDO B 188s B 504 TYR B 45 TYR^? 7.97 C2 EDO A 190 B 540 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo 86.52 35.28 112.74 87.08 36.38 110.99 37.37 8.74 -16.44 35.46 7.85 -16.33 coo 84.93 40.21 105.31 85.72 41.45 107.72 44.36 10.34 -9.27 42.37 11.49 -10.86 coo 83.38 41.19 112.55 85.47 40.59 112.72 35.53 10.88 -8.90 35.33 11.18 -11.01 1bhg_c03 source 1bhg BETA-GLUCURONIDASE : 2 hits 1bhg_c03 naa= 3 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 1 3 # 1 A 382 ARG A 40 ARG.? 16.02 C5 MPD A 191 A 451 GLU A 39 GLU.? 8.26 C5 MPD A 191 A 540 GLU A 134 GLU^? 6.11 C5 MPD A 191 coo 79.04 80.20 80.81 79.58 81.40 83.63 39.30 26.84 6.37 36.68 28.27 5.45 coo 81.34 87.29 87.22 82.36 86.09 88.61 40.24 18.97 5.60 41.21 18.63 7.48 coo 79.94 80.46 88.84 81.11 81.36 87.27 46.05 21.45 10.47 44.38 22.44 11.35 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 2 3 # 2 A 382 ARG A 40 ARG.? 16.02 C5 MPD A 191 A 451 GLU A 134 GLU^? 6.11 C5 MPD A 191 A 540 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 79.04 80.20 80.81 79.58 81.40 83.63 39.30 26.84 6.37 36.68 28.27 5.45 coo 81.34 87.29 87.22 82.36 86.09 88.61 46.05 21.45 10.47 44.38 22.44 11.35 coo 79.94 80.46 88.84 81.11 81.36 87.27 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 3 3 # 3 A 382 ARG A 52 ARG^? 13.70 C2 EDO A 189 A 451 GLU A 31 GLU^? -3.45 O2 EDO A 189s A 540 GLU A 26 GLU.? 10.86 O2 EDO A 189 coo 79.04 80.20 80.81 79.58 81.40 83.63 69.17 14.29 10.90 69.97 16.58 12.80 coo 81.34 87.29 87.22 82.36 86.09 88.61 61.87 12.13 2.43 62.94 11.86 0.64 coo 79.94 80.46 88.84 81.11 81.36 87.27 66.27 6.09 6.28 67.77 7.37 5.57 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 4 3 # 4 A 382 ARG A 73 ARG^? 12.55 O1 EDO A 189 A 451 GLU A 134 GLU^? 6.11 C5 MPD A 191 A 540 GLU A 139 GLU.? 13.74 O4 MPD A 191 coo 79.04 80.20 80.81 79.58 81.40 83.63 53.52 27.95 4.31 55.34 28.60 6.78 coo 81.34 87.29 87.22 82.36 86.09 88.61 46.05 21.45 10.47 44.38 22.44 11.35 coo 79.94 80.46 88.84 81.11 81.36 87.27 50.77 29.24 9.79 48.92 30.09 9.22 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 5 3 # 5 A 382 ARG A 141 ARG^? 4.89 O4 MPD A 191 A 451 GLU A 134 GLU^? 6.11 C5 MPD A 191 A 540 GLU A 139 GLU.? 13.74 O4 MPD A 191 coo 79.04 80.20 80.81 79.58 81.40 83.63 47.94 26.40 17.24 45.84 24.19 17.73 coo 81.34 87.29 87.22 82.36 86.09 88.61 46.05 21.45 10.47 44.38 22.44 11.35 coo 79.94 80.46 88.84 81.11 81.36 87.27 50.77 29.24 9.79 48.92 30.09 9.22 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 6 3 # 6 A 382 ARG A 141 ARG^? 4.89 O4 MPD A 191 A 451 GLU A 139 GLU.? 13.74 O4 MPD A 191 A 540 GLU A 134 GLU^? 6.11 C5 MPD A 191 coo 79.04 80.20 80.81 79.58 81.40 83.63 47.94 26.40 17.24 45.84 24.19 17.73 coo 81.34 87.29 87.22 82.36 86.09 88.61 50.77 29.24 9.79 48.92 30.09 9.22 coo 79.94 80.46 88.84 81.11 81.36 87.27 46.05 21.45 10.47 44.38 22.44 11.35 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 7 3 # 7 A 382 ARG B 40 ARG.? -5.91 C2 EDO B 188s A 451 GLU B 134 GLU^? -3.38 C2 EDO B 188s A 540 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo 79.04 80.20 80.81 79.58 81.40 83.63 35.46 3.15 -9.11 34.69 4.91 -11.54 coo 81.34 87.29 87.22 82.36 86.09 88.61 37.37 8.74 -16.44 35.46 7.85 -16.33 coo 79.94 80.46 88.84 81.11 81.36 87.27 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 8 3 # 8 A 382 ARG B 40 ARG.? -5.91 C2 EDO B 188s A 451 GLU B 139 GLU.? 9.67 O2 EDO B 191 A 540 GLU B 134 GLU^? -3.38 C2 EDO B 188s coo 79.04 80.20 80.81 79.58 81.40 83.63 35.46 3.15 -9.11 34.69 4.91 -11.54 coo 81.34 87.29 87.22 82.36 86.09 88.61 41.80 1.11 -18.67 40.76 -0.16 -17.27 coo 79.94 80.46 88.84 81.11 81.36 87.27 37.37 8.74 -16.44 35.46 7.85 -16.33 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 9 3 # 9 A 382 ARG B 141 ARG^? 5.70 O4 MPD B 194 A 451 GLU B 134 GLU^? -3.38 C2 EDO B 188s A 540 GLU B 139 GLU.? 9.67 O2 EDO B 191 coo 79.04 80.20 80.81 79.58 81.40 83.63 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 81.34 87.29 87.22 82.36 86.09 88.61 37.37 8.74 -16.44 35.46 7.85 -16.33 coo 79.94 80.46 88.84 81.11 81.36 87.27 41.80 1.11 -18.67 40.76 -0.16 -17.27 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 10 3 # 10 A 382 ARG B 141 ARG^? 5.70 O4 MPD B 194 A 451 GLU B 139 GLU.? 9.67 O2 EDO B 191 A 540 GLU B 134 GLU^? -3.38 C2 EDO B 188s coo 79.04 80.20 80.81 79.58 81.40 83.63 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 81.34 87.29 87.22 82.36 86.09 88.61 41.80 1.11 -18.67 40.76 -0.16 -17.27 coo 79.94 80.46 88.84 81.11 81.36 87.27 37.37 8.74 -16.44 35.46 7.85 -16.33 1bhg_c04 source 1bhg BETA-GLUCURONIDASE : 10 hits 1bhg_c04 naa= 3 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 # 1 B 382 ARG A 40 ARG.? 16.02 C5 MPD A 191 B 451 GLU A 134 GLU^? 6.11 C5 MPD A 191 B 540 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 82.21 41.07 119.14 83.95 40.66 116.59 39.30 26.84 6.37 36.68 28.27 5.45 coo 86.52 35.28 112.74 87.08 36.38 110.99 46.05 21.45 10.47 44.38 22.44 11.35 coo 83.38 41.19 112.55 85.47 40.59 112.72 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 2 3 # 2 B 382 ARG A 50 ARG^? 6.80 C2 EDO A 189 B 451 GLU A 26 GLU.? 10.86 O2 EDO A 189 B 540 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 82.21 41.07 119.14 83.95 40.66 116.59 65.37 14.47 5.23 66.89 16.94 6.37 coo 86.52 35.28 112.74 87.08 36.38 110.99 66.27 6.09 6.28 67.77 7.37 5.57 coo 83.38 41.19 112.55 85.47 40.59 112.72 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 3 3 # 3 B 382 ARG B 40 ARG.? -5.91 C2 EDO B 188s B 451 GLU B 134 GLU^? -3.38 C2 EDO B 188s B 540 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo 82.21 41.07 119.14 83.95 40.66 116.59 35.46 3.15 -9.11 34.69 4.91 -11.54 coo 86.52 35.28 112.74 87.08 36.38 110.99 37.37 8.74 -16.44 35.46 7.85 -16.33 coo 83.38 41.19 112.55 85.47 40.59 112.72 35.53 10.88 -8.90 35.33 11.18 -11.01 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 3 hits 1bhg_c05 naa= 3 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 1 3 # 1 118 ARG A 125 ARG^? 12.17 O2 MPD A 191 183 LYS A 166 LYS^? 9.67 O2 MPD A 191 317 ARG A 141 ARG^? 4.89 O4 MPD A 191 coo 76.57 109.19 73.41 73.86 110.26 72.16 47.67 10.86 32.86 45.58 12.34 31.13 coo 82.09 117.51 66.37 80.60 114.32 71.44 40.42 10.96 22.74 39.85 13.02 27.76 coo 65.21 120.62 58.76 63.62 123.14 59.66 47.94 26.40 17.24 45.84 24.19 17.73 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 2 3 # 2 118 ARG B 125 ARG^? 12.90 O2 MPD B 194 183 LYS B 166 LYS^? 10.40 O2 MPD B 194 317 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 76.57 109.19 73.41 73.86 110.26 72.16 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 82.09 117.51 66.37 80.60 114.32 71.44 25.14 19.21 -22.67 21.76 17.11 -26.55 coo 65.21 120.62 58.76 63.62 123.14 59.66 34.68 4.05 -23.26 33.98 5.70 -20.76 1bib_c00 source 1bib BIRA BIFUNCTIONAL PROTEIN (ACTS AS BIOTIN OPER: 2 hits 1bib_c00 naa= 3 ULMN 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 # 1 A 757 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 759 HIS A 65 HIS^? 6.20 C1 EDO A 189 A 810 SER A 32 SER^? 8.67 O2 EDO A 189 coo 30.11 61.02 29.12 29.36 59.77 27.63 57.58 16.65 0.08 56.71 16.10 -1.78 coo 30.94 56.62 25.28 29.94 54.94 26.14 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 25.05 62.74 29.97 26.88 61.45 29.19 57.30 11.17 3.38 55.16 10.90 4.47 ULMN 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 2 3 # 2 A 757 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 759 HIS B 65 HIS^? -5.26 O1 EDO B 189s A 810 SER B 32 SER^? 8.66 C2 EDO B 189 coo 30.11 61.02 29.12 29.36 59.77 27.63 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 30.94 56.62 25.28 29.94 54.94 26.14 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 25.05 62.74 29.97 26.88 61.45 29.19 50.26 19.40 -17.21 47.97 19.77 -16.73 1bmt_c04 source 1bmt METHIONINE SYNTHASE (B12-BINDING DOMAINS) (E.C: 2 hits 1bmt_c04 naa= 3 ULMN 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 # 1 B 757 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 759 HIS A 65 HIS^? 6.20 C1 EDO A 189 B 810 SER A 32 SER^? 8.67 O2 EDO A 189 coo -2.30 64.08 6.41 -0.36 64.72 6.26 57.58 16.65 0.08 56.71 16.10 -1.78 coo 1.96 66.39 3.07 2.10 68.48 3.58 58.30 21.39 -1.16 58.14 22.03 -3.16 coo -1.50 63.90 11.86 -1.31 64.33 9.52 57.30 11.17 3.38 55.16 10.90 4.47 ULMN 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 2 3 # 2 B 757 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 759 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 810 SER B 32 SER^? 8.66 C2 EDO B 189 coo -2.30 64.08 6.41 -0.36 64.72 6.26 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 1.96 66.39 3.07 2.10 68.48 3.58 54.13 9.12 -14.50 55.15 8.45 -12.80 coo -1.50 63.90 11.86 -1.31 64.33 9.52 50.26 19.40 -17.21 47.97 19.77 -16.73 1bmt_c05 source 1bmt METHIONINE SYNTHASE (B12-BINDING DOMAINS) (E.C: 2 hits 1bmt_c05 naa= 3 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 1 3 # 1 30 GLY A 71 GLY^? 15.15 O2 EDO A 188 48 HIS A 65 HIS^? 6.20 C1 EDO A 189 99 ASP A 48 ASP^? -5.54 C1 EDO A 189s coo 12.38 5.55 24.25 13.27 5.59 24.39 51.64 28.27 -4.12 51.34 27.67 -3.59 coo 18.80 12.68 24.53 17.69 13.54 26.08 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 17.07 18.51 26.62 16.67 17.07 28.09 57.58 16.65 0.08 56.71 16.10 -1.78 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 2 3 # 2 30 GLY A 83 GLY.? 19.80 C3 MPD A 191 48 HIS A 58 HIS.? 21.11 O2 MPD A 191 99 ASP A 54 ASP.? 20.27 C2 EDO A 189 coo 12.38 5.55 24.25 13.27 5.59 24.39 62.79 21.97 24.03 63.48 22.23 23.74 coo 18.80 12.68 24.53 17.69 13.54 26.08 64.74 13.84 22.58 64.60 13.48 24.65 coo 17.07 18.51 26.62 16.67 17.07 28.09 68.86 12.45 19.04 67.57 12.48 20.71 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 3 3 # 3 30 GLY A 83 GLY.? 19.80 C3 MPD A 191 48 HIS A 58 HIS.? 21.11 O2 MPD A 191 99 ASP A 56 ASP.? 24.62 C2 EDO A 189 coo 12.38 5.55 24.25 13.27 5.59 24.39 62.79 21.97 24.03 63.48 22.23 23.74 coo 18.80 12.68 24.53 17.69 13.54 26.08 64.74 13.84 22.58 64.60 13.48 24.65 coo 17.07 18.51 26.62 16.67 17.07 28.09 66.73 9.65 23.28 68.51 8.93 24.16 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 4 3 # 4 30 GLY A 98 GLY.? 17.64 O2 MPD A 191 48 HIS A 58 HIS.? 21.11 O2 MPD A 191 99 ASP A 54 ASP.? 20.27 C2 EDO A 189 coo 12.38 5.55 24.25 13.27 5.59 24.39 59.27 22.98 25.86 59.28 23.02 25.07 coo 18.80 12.68 24.53 17.69 13.54 26.08 64.74 13.84 22.58 64.60 13.48 24.65 coo 17.07 18.51 26.62 16.67 17.07 28.09 68.86 12.45 19.04 67.57 12.48 20.71 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 5 3 # 5 30 GLY A 98 GLY.? 17.64 O2 MPD A 191 48 HIS A 58 HIS.? 21.11 O2 MPD A 191 99 ASP A 56 ASP.? 24.62 C2 EDO A 189 coo 12.38 5.55 24.25 13.27 5.59 24.39 59.27 22.98 25.86 59.28 23.02 25.07 coo 18.80 12.68 24.53 17.69 13.54 26.08 64.74 13.84 22.58 64.60 13.48 24.65 coo 17.07 18.51 26.62 16.67 17.07 28.09 66.73 9.65 23.28 68.51 8.93 24.16 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 6 3 # 6 30 GLY A 175 GLY.? 16.97 O1 EDO B 190 48 HIS A 154 HIS^? 17.90 CM MPD A 191 99 ASP A 151 ASP^? 20.35 CM MPD A 191 coo 12.38 5.55 24.25 13.27 5.59 24.39 55.47 1.95 17.71 55.53 1.72 16.92 coo 18.80 12.68 24.53 17.69 13.54 26.08 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 17.07 18.51 26.62 16.67 17.07 28.09 48.38 -3.74 26.58 47.39 -3.82 24.70 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 7 3 # 7 30 GLY B 71 GLY^? 6.08 O1 EDO A 190 48 HIS B 65 HIS^? -5.26 O1 EDO B 189s 99 ASP B 48 ASP^? 5.72 O1 EDO B 189 coo 12.38 5.55 24.25 13.27 5.59 24.39 50.84 2.27 -7.92 50.26 2.83 -8.18 coo 18.80 12.68 24.53 17.69 13.54 26.08 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 17.07 18.51 26.62 16.67 17.07 28.09 52.60 14.13 -14.82 53.00 14.96 -12.94 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 8 3 # 8 30 GLY B 81 GLY.? 19.64 C2 EDO B 193 48 HIS B 84 HIS.? 24.24 O2 MPD B 194 99 ASP B 97 ASP~? 21.83 C3 MPD B 194 coo 12.38 5.55 24.25 13.27 5.59 24.39 46.71 12.75 -37.37 46.59 12.01 -37.69 coo 18.80 12.68 24.53 17.69 13.54 26.08 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 17.07 18.51 26.62 16.67 17.07 28.09 39.93 2.83 -36.24 41.54 1.65 -37.01 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 9 3 # 9 30 GLY B 83 GLY.? 19.88 O2 MPD B 194 48 HIS B 58 HIS.? 15.15 C2 EDO B 193 99 ASP B 54 ASP.? 15.81 C2 EDO B 193 coo 12.38 5.55 24.25 13.27 5.59 24.39 42.83 8.47 -37.13 43.54 8.24 -37.38 coo 18.80 12.68 24.53 17.69 13.54 26.08 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 17.07 18.51 26.62 16.67 17.07 28.09 50.24 18.54 -36.80 48.17 18.09 -37.17 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 10 3 # 10 30 GLY B 83 GLY.? 19.88 O2 MPD B 194 48 HIS B 58 HIS.? 15.15 C2 EDO B 193 99 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo 12.38 5.55 24.25 13.27 5.59 24.39 42.83 8.47 -37.13 43.54 8.24 -37.38 coo 18.80 12.68 24.53 17.69 13.54 26.08 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 17.07 18.51 26.62 16.67 17.07 28.09 45.79 20.82 -38.80 46.38 21.52 -40.72 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 11 3 # 11 30 GLY B 98 GLY.? 17.68 O2 MPD B 194 48 HIS B 58 HIS.? 15.15 C2 EDO B 193 99 ASP B 54 ASP.? 15.81 C2 EDO B 193 coo 12.38 5.55 24.25 13.27 5.59 24.39 39.01 7.37 -36.59 39.44 7.37 -35.92 coo 18.80 12.68 24.53 17.69 13.54 26.08 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 17.07 18.51 26.62 16.67 17.07 28.09 50.24 18.54 -36.80 48.17 18.09 -37.17 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 12 3 # 12 30 GLY B 98 GLY.? 17.68 O2 MPD B 194 48 HIS B 58 HIS.? 15.15 C2 EDO B 193 99 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo 12.38 5.55 24.25 13.27 5.59 24.39 39.01 7.37 -36.59 39.44 7.37 -35.92 coo 18.80 12.68 24.53 17.69 13.54 26.08 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 17.07 18.51 26.62 16.67 17.07 28.09 45.79 20.82 -38.80 46.38 21.52 -40.72 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 13 3 # 13 30 GLY B 175 GLY.? -3.40 C1 EDO B 193s 48 HIS B 154 HIS^? 5.27 C1 EDO B 192 99 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 12.38 5.55 24.25 13.27 5.59 24.39 39.99 28.43 -27.51 40.50 28.66 -26.90 coo 18.80 12.68 24.53 17.69 13.54 26.08 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 17.07 18.51 26.62 16.67 17.07 28.09 29.45 33.81 -30.55 29.73 34.07 -28.42 1bp2_c00 source 1bp2 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSPHATIDE AC: 13 hits 1bp2_c00 naa= 3 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 # 1 B1082 HIS A 65 HIS^? 6.20 C1 EDO A 189 B1168 ARG A 50 ARG^? 6.80 C2 EDO A 189 B1187 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 35.03 5.72 103.61 36.82 5.00 102.79 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 41.91 5.48 91.85 40.59 6.81 94.28 65.37 14.47 5.23 66.89 16.94 6.37 coo 32.93 -0.12 99.60 37.71 2.39 99.23 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 2 3 # 2 B1082 HIS B 65 HIS^? -5.26 O1 EDO B 189s B1168 ARG B 50 ARG^? -6.93 O2 EDO B 189s B1187 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 35.03 5.72 103.61 36.82 5.00 102.79 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 41.91 5.48 91.85 40.59 6.81 94.28 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 32.93 -0.12 99.60 37.71 2.39 99.23 51.85 4.84 -17.64 57.80 3.80 -15.89 1brw_c01 source 1brw PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE : 2 hits 1brw_c01 naa= 3 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 1 3 # 1 A 109 PHE A 96 PHE~? 14.81 O4 MPD A 191 A 205 ASP A 89 ASP.? 15.93 O1 EDO A 189 A 236 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 4.14 2.10 36.34 6.69 3.08 36.92 57.59 26.72 18.48 56.37 27.80 16.21 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 67.25 32.32 9.27 66.30 32.35 7.40 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 2 3 # 2 A 109 PHE B 96 PHE~? 15.57 O4 MPD B 194 A 205 ASP B 89 ASP.? 15.59 O1 EDO B 189 A 236 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 4.14 2.10 36.34 6.69 3.08 36.92 42.14 3.81 -29.42 42.55 2.56 -26.95 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 51.85 4.84 -17.64 57.80 3.80 -15.89 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 29 GLN^? 9.33 C2 EDO A 189 A 91 LEU A 25 LEU^? 10.43 O1 EDO B 190 A 133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 43.58 43.67 66.73 42.32 42.78 68.15 66.72 9.95 7.95 67.95 11.27 6.82 coo 38.58 45.09 70.44 38.28 45.21 72.59 60.88 4.33 8.47 60.95 4.72 10.61 coo 44.05 36.87 70.65 43.15 38.64 69.97 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 29 GLN^? 9.33 C2 EDO A 189 A 91 LEU A 51 LEU^? 9.38 O1 EDO A 189 A 133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 43.58 43.67 66.73 42.32 42.78 68.15 66.72 9.95 7.95 67.95 11.27 6.82 coo 38.58 45.09 70.44 38.28 45.21 72.59 60.95 13.93 10.88 59.04 14.94 11.05 coo 44.05 36.87 70.65 43.15 38.64 69.97 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 3 3 # 3 A 50 GLN A 33 GLN^? 7.13 C1 EDO A 190 A 91 LEU A 23 LEU^? 10.78 O2 EDO A 189 A 133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 43.58 43.67 66.73 42.32 42.78 68.15 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 38.58 45.09 70.44 38.28 45.21 72.59 56.24 7.35 5.52 57.26 7.53 7.41 coo 44.05 36.87 70.65 43.15 38.64 69.97 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 4 3 # 4 A 50 GLN A 33 GLN^? 7.13 C1 EDO A 190 A 91 LEU A 34 LEU^? 9.26 O2 EDO A 190 A 133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 43.58 43.67 66.73 42.32 42.78 68.15 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 38.58 45.09 70.44 38.28 45.21 72.59 51.42 13.55 3.24 49.84 14.38 4.49 coo 44.05 36.87 70.65 43.15 38.64 69.97 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 5 3 # 5 A 50 GLN A 33 GLN^? 7.13 C1 EDO A 190 A 91 LEU A 47 LEU^? 8.05 O1 EDO A 189 A 133 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 43.58 43.67 66.73 42.32 42.78 68.15 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 38.58 45.09 70.44 38.28 45.21 72.59 52.48 17.67 2.84 53.43 18.52 4.62 coo 44.05 36.87 70.65 43.15 38.64 69.97 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 6 3 # 6 A 50 GLN A 33 GLN^? 7.13 C1 EDO A 190 A 91 LEU A 47 LEU^? 8.05 O1 EDO A 189 A 133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 43.58 43.67 66.73 42.32 42.78 68.15 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 38.58 45.09 70.44 38.28 45.21 72.59 52.48 17.67 2.84 53.43 18.52 4.62 coo 44.05 36.87 70.65 43.15 38.64 69.97 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 7 3 # 7 A 50 GLN A 46 GLN^? 7.01 C1 EDO A 190 A 91 LEU A 34 LEU^? 9.26 O2 EDO A 190 A 133 GLU A 67 GLU^? 10.03 C1 EDO A 189 coo 43.58 43.67 66.73 42.32 42.78 68.15 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 38.58 45.09 70.44 38.28 45.21 72.59 51.42 13.55 3.24 49.84 14.38 4.49 coo 44.05 36.87 70.65 43.15 38.64 69.97 54.47 21.64 -4.11 55.33 21.19 -6.01 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 8 3 # 8 A 50 GLN A 46 GLN^? 7.01 C1 EDO A 190 A 91 LEU A 47 LEU^? 8.05 O1 EDO A 189 A 133 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 43.58 43.67 66.73 42.32 42.78 68.15 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 38.58 45.09 70.44 38.28 45.21 72.59 52.48 17.67 2.84 53.43 18.52 4.62 coo 44.05 36.87 70.65 43.15 38.64 69.97 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 9 3 # 9 A 50 GLN A 46 GLN^? 7.01 C1 EDO A 190 A 91 LEU A 47 LEU^? 8.05 O1 EDO A 189 A 133 GLU A 67 GLU^? 10.03 C1 EDO A 189 coo 43.58 43.67 66.73 42.32 42.78 68.15 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 38.58 45.09 70.44 38.28 45.21 72.59 52.48 17.67 2.84 53.43 18.52 4.62 coo 44.05 36.87 70.65 43.15 38.64 69.97 54.47 21.64 -4.11 55.33 21.19 -6.01 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 10 3 # 10 A 50 GLN A 86 GLN^? 18.78 O1 EDO A 189 A 91 LEU A 77 LEU^? 11.79 O1 EDO A 189 A 133 GLU A 91 GLU.? 21.73 O1 EDO A 189 coo 43.58 43.67 66.73 42.32 42.78 68.15 67.23 27.16 15.62 69.12 27.87 16.28 coo 38.58 45.09 70.44 38.28 45.21 72.59 61.40 23.35 12.59 59.60 24.52 12.87 coo 44.05 36.87 70.65 43.15 38.64 69.97 66.09 34.28 12.66 67.33 35.85 13.37 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 11 3 # 11 A 50 GLN A 86 GLN^? 18.78 O1 EDO A 189 A 91 LEU A 93 LEU~? 17.77 O1 EDO A 189 A 133 GLU A 91 GLU.? 21.73 O1 EDO A 189 coo 43.58 43.67 66.73 42.32 42.78 68.15 67.23 27.16 15.62 69.12 27.87 16.28 coo 38.58 45.09 70.44 38.28 45.21 72.59 60.93 29.43 17.24 60.83 29.61 15.05 coo 44.05 36.87 70.65 43.15 38.64 69.97 66.09 34.28 12.66 67.33 35.85 13.37 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 12 3 # 12 A 50 GLN A 174 GLN.? 12.38 O1 EDO B 190 A 91 LEU A 176 LEU.? 12.93 O1 EDO B 190 A 133 GLU A 173 GLU.? 15.20 O1 EDO B 190 coo 43.58 43.67 66.73 42.32 42.78 68.15 59.85 -1.54 14.90 58.95 -3.48 14.67 coo 38.58 45.09 70.44 38.28 45.21 72.59 54.79 2.12 12.89 56.72 3.17 12.76 coo 44.05 36.87 70.65 43.15 38.64 69.97 56.04 -5.91 18.03 55.52 -6.78 16.19 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 13 3 # 13 A 50 GLN B 29 GLN^? 9.88 O2 EDO B 189 A 91 LEU B 25 LEU^? 8.43 C1 EDO A 188 A 133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 43.58 43.67 66.73 42.32 42.78 68.15 54.95 21.24 -26.60 56.82 20.31 -27.04 coo 38.58 45.09 70.44 38.28 45.21 72.59 49.81 26.40 -23.16 48.48 26.10 -24.87 coo 44.05 36.87 70.65 43.15 38.64 69.97 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 14 3 # 14 A 50 GLN B 29 GLN^? 9.88 O2 EDO B 189 A 91 LEU B 51 LEU^? 9.21 C2 EDO B 189 A 133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 43.58 43.67 66.73 42.32 42.78 68.15 54.95 21.24 -26.60 56.82 20.31 -27.04 coo 38.58 45.09 70.44 38.28 45.21 72.59 48.82 16.73 -25.34 47.22 15.53 -24.50 coo 44.05 36.87 70.65 43.15 38.64 69.97 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 15 3 # 15 A 50 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 91 LEU B 34 LEU^? 11.05 C2 EDO B 189 A 133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 43.58 43.67 66.73 42.32 42.78 68.15 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 38.58 45.09 70.44 38.28 45.21 72.59 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 44.05 36.87 70.65 43.15 38.64 69.97 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 16 3 # 16 A 50 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 91 LEU B 34 LEU^? 11.05 C2 EDO B 189 A 133 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 43.58 43.67 66.73 42.32 42.78 68.15 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 38.58 45.09 70.44 38.28 45.21 72.59 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 44.05 36.87 70.65 43.15 38.64 69.97 52.81 8.90 -9.47 54.54 9.74 -8.49 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 17 3 # 17 A 50 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 91 LEU B 47 LEU^? 8.42 C1 EDO B 189 A 133 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 43.58 43.67 66.73 42.32 42.78 68.15 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 38.58 45.09 70.44 38.28 45.21 72.59 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 44.05 36.87 70.65 43.15 38.64 69.97 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 18 3 # 18 A 50 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 91 LEU B 47 LEU^? 8.42 C1 EDO B 189 A 133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 43.58 43.67 66.73 42.32 42.78 68.15 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 38.58 45.09 70.44 38.28 45.21 72.59 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 44.05 36.87 70.65 43.15 38.64 69.97 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 19 3 # 19 A 50 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 91 LEU B 47 LEU^? 8.42 C1 EDO B 189 A 133 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 43.58 43.67 66.73 42.32 42.78 68.15 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 38.58 45.09 70.44 38.28 45.21 72.59 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 44.05 36.87 70.65 43.15 38.64 69.97 52.81 8.90 -9.47 54.54 9.74 -8.49 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 20 3 # 20 A 50 GLN B 46 GLN^? 7.98 C2 EDO A 190 A 91 LEU B 34 LEU^? 11.05 C2 EDO B 189 A 133 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 43.58 43.67 66.73 42.32 42.78 68.15 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 38.58 45.09 70.44 38.28 45.21 72.59 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 44.05 36.87 70.65 43.15 38.64 69.97 52.81 8.90 -9.47 54.54 9.74 -8.49 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 21 3 # 21 A 50 GLN B 46 GLN^? 7.98 C2 EDO A 190 A 91 LEU B 47 LEU^? 8.42 C1 EDO B 189 A 133 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 43.58 43.67 66.73 42.32 42.78 68.15 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 38.58 45.09 70.44 38.28 45.21 72.59 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 44.05 36.87 70.65 43.15 38.64 69.97 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 22 3 # 22 A 50 GLN B 46 GLN^? 7.98 C2 EDO A 190 A 91 LEU B 47 LEU^? 8.42 C1 EDO B 189 A 133 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 43.58 43.67 66.73 42.32 42.78 68.15 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 38.58 45.09 70.44 38.28 45.21 72.59 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 44.05 36.87 70.65 43.15 38.64 69.97 52.81 8.90 -9.47 54.54 9.74 -8.49 1bs4_c00 source 1bs4 PEPTIDE DEFORMYLASE : 22 hits 1bs4_c00 naa= 3 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 # 1 B 550 GLN A 29 GLN^? 9.33 C2 EDO A 189 B 591 LEU A 25 LEU^? 10.43 O1 EDO B 190 B 633 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 88.06 44.34 57.19 89.06 45.53 55.74 66.72 9.95 7.95 67.95 11.27 6.82 coo 86.70 48.66 52.61 87.15 48.69 50.51 60.88 4.33 8.47 60.95 4.72 10.61 coo 95.42 44.52 54.43 93.46 45.31 54.70 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 2 3 # 2 B 550 GLN A 29 GLN^? 9.33 C2 EDO A 189 B 591 LEU A 51 LEU^? 9.38 O1 EDO A 189 B 633 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 88.06 44.34 57.19 89.06 45.53 55.74 66.72 9.95 7.95 67.95 11.27 6.82 coo 86.70 48.66 52.61 87.15 48.69 50.51 60.95 13.93 10.88 59.04 14.94 11.05 coo 95.42 44.52 54.43 93.46 45.31 54.70 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 3 3 # 3 B 550 GLN A 33 GLN^? 7.13 C1 EDO A 190 B 591 LEU A 23 LEU^? 10.78 O2 EDO A 189 B 633 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 88.06 44.34 57.19 89.06 45.53 55.74 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 86.70 48.66 52.61 87.15 48.69 50.51 56.24 7.35 5.52 57.26 7.53 7.41 coo 95.42 44.52 54.43 93.46 45.31 54.70 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 4 3 # 4 B 550 GLN A 33 GLN^? 7.13 C1 EDO A 190 B 591 LEU A 34 LEU^? 9.26 O2 EDO A 190 B 633 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 88.06 44.34 57.19 89.06 45.53 55.74 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 86.70 48.66 52.61 87.15 48.69 50.51 51.42 13.55 3.24 49.84 14.38 4.49 coo 95.42 44.52 54.43 93.46 45.31 54.70 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 5 3 # 5 B 550 GLN A 33 GLN^? 7.13 C1 EDO A 190 B 591 LEU A 47 LEU^? 8.05 O1 EDO A 189 B 633 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 88.06 44.34 57.19 89.06 45.53 55.74 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 86.70 48.66 52.61 87.15 48.69 50.51 52.48 17.67 2.84 53.43 18.52 4.62 coo 95.42 44.52 54.43 93.46 45.31 54.70 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 6 3 # 6 B 550 GLN A 33 GLN^? 7.13 C1 EDO A 190 B 591 LEU A 47 LEU^? 8.05 O1 EDO A 189 B 633 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 88.06 44.34 57.19 89.06 45.53 55.74 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 86.70 48.66 52.61 87.15 48.69 50.51 52.48 17.67 2.84 53.43 18.52 4.62 coo 95.42 44.52 54.43 93.46 45.31 54.70 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 7 3 # 7 B 550 GLN A 46 GLN^? 7.01 C1 EDO A 190 B 591 LEU A 34 LEU^? 9.26 O2 EDO A 190 B 633 GLU A 67 GLU^? 10.03 C1 EDO A 189 coo 88.06 44.34 57.19 89.06 45.53 55.74 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 86.70 48.66 52.61 87.15 48.69 50.51 51.42 13.55 3.24 49.84 14.38 4.49 coo 95.42 44.52 54.43 93.46 45.31 54.70 54.47 21.64 -4.11 55.33 21.19 -6.01 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 8 3 # 8 B 550 GLN A 46 GLN^? 7.01 C1 EDO A 190 B 591 LEU A 47 LEU^? 8.05 O1 EDO A 189 B 633 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 88.06 44.34 57.19 89.06 45.53 55.74 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 86.70 48.66 52.61 87.15 48.69 50.51 52.48 17.67 2.84 53.43 18.52 4.62 coo 95.42 44.52 54.43 93.46 45.31 54.70 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 9 3 # 9 B 550 GLN A 46 GLN^? 7.01 C1 EDO A 190 B 591 LEU A 47 LEU^? 8.05 O1 EDO A 189 B 633 GLU A 67 GLU^? 10.03 C1 EDO A 189 coo 88.06 44.34 57.19 89.06 45.53 55.74 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 86.70 48.66 52.61 87.15 48.69 50.51 52.48 17.67 2.84 53.43 18.52 4.62 coo 95.42 44.52 54.43 93.46 45.31 54.70 54.47 21.64 -4.11 55.33 21.19 -6.01 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 10 3 # 10 B 550 GLN A 86 GLN^? 18.78 O1 EDO A 189 B 591 LEU A 93 LEU~? 17.77 O1 EDO A 189 B 633 GLU A 91 GLU.? 21.73 O1 EDO A 189 coo 88.06 44.34 57.19 89.06 45.53 55.74 67.23 27.16 15.62 69.12 27.87 16.28 coo 86.70 48.66 52.61 87.15 48.69 50.51 60.93 29.43 17.24 60.83 29.61 15.05 coo 95.42 44.52 54.43 93.46 45.31 54.70 66.09 34.28 12.66 67.33 35.85 13.37 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 11 3 # 11 B 550 GLN A 174 GLN.? 12.38 O1 EDO B 190 B 591 LEU A 176 LEU.? 12.93 O1 EDO B 190 B 633 GLU A 173 GLU.? 15.20 O1 EDO B 190 coo 88.06 44.34 57.19 89.06 45.53 55.74 59.85 -1.54 14.90 58.95 -3.48 14.67 coo 86.70 48.66 52.61 87.15 48.69 50.51 54.79 2.12 12.89 56.72 3.17 12.76 coo 95.42 44.52 54.43 93.46 45.31 54.70 56.04 -5.91 18.03 55.52 -6.78 16.19 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 12 3 # 12 B 550 GLN B 29 GLN^? 9.88 O2 EDO B 189 B 591 LEU B 25 LEU^? 8.43 C1 EDO A 188 B 633 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 88.06 44.34 57.19 89.06 45.53 55.74 54.95 21.24 -26.60 56.82 20.31 -27.04 coo 86.70 48.66 52.61 87.15 48.69 50.51 49.81 26.40 -23.16 48.48 26.10 -24.87 coo 95.42 44.52 54.43 93.46 45.31 54.70 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 13 3 # 13 B 550 GLN B 29 GLN^? 9.88 O2 EDO B 189 B 591 LEU B 51 LEU^? 9.21 C2 EDO B 189 B 633 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 88.06 44.34 57.19 89.06 45.53 55.74 54.95 21.24 -26.60 56.82 20.31 -27.04 coo 86.70 48.66 52.61 87.15 48.69 50.51 48.82 16.73 -25.34 47.22 15.53 -24.50 coo 95.42 44.52 54.43 93.46 45.31 54.70 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 14 3 # 14 B 550 GLN B 33 GLN^? 9.24 C2 EDO B 189 B 591 LEU B 34 LEU^? 11.05 C2 EDO B 189 B 633 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 88.06 44.34 57.19 89.06 45.53 55.74 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 86.70 48.66 52.61 87.15 48.69 50.51 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 95.42 44.52 54.43 93.46 45.31 54.70 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 15 3 # 15 B 550 GLN B 33 GLN^? 9.24 C2 EDO B 189 B 591 LEU B 34 LEU^? 11.05 C2 EDO B 189 B 633 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 88.06 44.34 57.19 89.06 45.53 55.74 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 86.70 48.66 52.61 87.15 48.69 50.51 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 95.42 44.52 54.43 93.46 45.31 54.70 52.81 8.90 -9.47 54.54 9.74 -8.49 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 16 3 # 16 B 550 GLN B 33 GLN^? 9.24 C2 EDO B 189 B 591 LEU B 47 LEU^? 8.42 C1 EDO B 189 B 633 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 88.06 44.34 57.19 89.06 45.53 55.74 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 86.70 48.66 52.61 87.15 48.69 50.51 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 95.42 44.52 54.43 93.46 45.31 54.70 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 17 3 # 17 B 550 GLN B 33 GLN^? 9.24 C2 EDO B 189 B 591 LEU B 47 LEU^? 8.42 C1 EDO B 189 B 633 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 88.06 44.34 57.19 89.06 45.53 55.74 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 86.70 48.66 52.61 87.15 48.69 50.51 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 95.42 44.52 54.43 93.46 45.31 54.70 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 18 3 # 18 B 550 GLN B 33 GLN^? 9.24 C2 EDO B 189 B 591 LEU B 47 LEU^? 8.42 C1 EDO B 189 B 633 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 88.06 44.34 57.19 89.06 45.53 55.74 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 86.70 48.66 52.61 87.15 48.69 50.51 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 95.42 44.52 54.43 93.46 45.31 54.70 52.81 8.90 -9.47 54.54 9.74 -8.49 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 19 3 # 19 B 550 GLN B 46 GLN^? 7.98 C2 EDO A 190 B 591 LEU B 34 LEU^? 11.05 C2 EDO B 189 B 633 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 88.06 44.34 57.19 89.06 45.53 55.74 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 86.70 48.66 52.61 87.15 48.69 50.51 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 95.42 44.52 54.43 93.46 45.31 54.70 52.81 8.90 -9.47 54.54 9.74 -8.49 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 20 3 # 20 B 550 GLN B 46 GLN^? 7.98 C2 EDO A 190 B 591 LEU B 47 LEU^? 8.42 C1 EDO B 189 B 633 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 88.06 44.34 57.19 89.06 45.53 55.74 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 86.70 48.66 52.61 87.15 48.69 50.51 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 95.42 44.52 54.43 93.46 45.31 54.70 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 21 3 # 21 B 550 GLN B 46 GLN^? 7.98 C2 EDO A 190 B 591 LEU B 47 LEU^? 8.42 C1 EDO B 189 B 633 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 88.06 44.34 57.19 89.06 45.53 55.74 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 86.70 48.66 52.61 87.15 48.69 50.51 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 95.42 44.52 54.43 93.46 45.31 54.70 52.81 8.90 -9.47 54.54 9.74 -8.49 1bs4_c01 source 1bs4 PEPTIDE DEFORMYLASE : 21 hits 1bs4_c01 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 29 GLN^? 9.33 C2 EDO A 189 C1091 LEU A 25 LEU^? 10.43 O1 EDO B 190 C1133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 68.29 34.44 43.03 66.67 34.74 44.37 66.72 9.95 7.95 67.95 11.27 6.82 coo 65.83 38.95 47.05 65.46 38.90 49.20 60.88 4.33 8.47 60.95 4.72 10.61 coo 63.14 29.39 46.25 63.84 31.31 45.74 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 # 2 C1050 GLN A 29 GLN^? 9.33 C2 EDO A 189 C1091 LEU A 51 LEU^? 9.38 O1 EDO A 189 C1133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 68.29 34.44 43.03 66.67 34.74 44.37 66.72 9.95 7.95 67.95 11.27 6.82 coo 65.83 38.95 47.05 65.46 38.90 49.20 60.95 13.93 10.88 59.04 14.94 11.05 coo 63.14 29.39 46.25 63.84 31.31 45.74 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 3 3 # 3 C1050 GLN A 33 GLN^? 7.13 C1 EDO A 190 C1091 LEU A 23 LEU^? 10.78 O2 EDO A 189 C1133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 68.29 34.44 43.03 66.67 34.74 44.37 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 65.83 38.95 47.05 65.46 38.90 49.20 56.24 7.35 5.52 57.26 7.53 7.41 coo 63.14 29.39 46.25 63.84 31.31 45.74 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 4 3 # 4 C1050 GLN A 33 GLN^? 7.13 C1 EDO A 190 C1091 LEU A 34 LEU^? 9.26 O2 EDO A 190 C1133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 68.29 34.44 43.03 66.67 34.74 44.37 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 65.83 38.95 47.05 65.46 38.90 49.20 51.42 13.55 3.24 49.84 14.38 4.49 coo 63.14 29.39 46.25 63.84 31.31 45.74 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 5 3 # 5 C1050 GLN A 33 GLN^? 7.13 C1 EDO A 190 C1091 LEU A 47 LEU^? 8.05 O1 EDO A 189 C1133 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 68.29 34.44 43.03 66.67 34.74 44.37 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 65.83 38.95 47.05 65.46 38.90 49.20 52.48 17.67 2.84 53.43 18.52 4.62 coo 63.14 29.39 46.25 63.84 31.31 45.74 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 6 3 # 6 C1050 GLN A 33 GLN^? 7.13 C1 EDO A 190 C1091 LEU A 47 LEU^? 8.05 O1 EDO A 189 C1133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 68.29 34.44 43.03 66.67 34.74 44.37 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 65.83 38.95 47.05 65.46 38.90 49.20 52.48 17.67 2.84 53.43 18.52 4.62 coo 63.14 29.39 46.25 63.84 31.31 45.74 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 7 3 # 7 C1050 GLN A 46 GLN^? 7.01 C1 EDO A 190 C1091 LEU A 34 LEU^? 9.26 O2 EDO A 190 C1133 GLU A 67 GLU^? 10.03 C1 EDO A 189 coo 68.29 34.44 43.03 66.67 34.74 44.37 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 65.83 38.95 47.05 65.46 38.90 49.20 51.42 13.55 3.24 49.84 14.38 4.49 coo 63.14 29.39 46.25 63.84 31.31 45.74 54.47 21.64 -4.11 55.33 21.19 -6.01 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 8 3 # 8 C1050 GLN A 46 GLN^? 7.01 C1 EDO A 190 C1091 LEU A 47 LEU^? 8.05 O1 EDO A 189 C1133 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 68.29 34.44 43.03 66.67 34.74 44.37 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 65.83 38.95 47.05 65.46 38.90 49.20 52.48 17.67 2.84 53.43 18.52 4.62 coo 63.14 29.39 46.25 63.84 31.31 45.74 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 9 3 # 9 C1050 GLN A 46 GLN^? 7.01 C1 EDO A 190 C1091 LEU A 47 LEU^? 8.05 O1 EDO A 189 C1133 GLU A 67 GLU^? 10.03 C1 EDO A 189 coo 68.29 34.44 43.03 66.67 34.74 44.37 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 65.83 38.95 47.05 65.46 38.90 49.20 52.48 17.67 2.84 53.43 18.52 4.62 coo 63.14 29.39 46.25 63.84 31.31 45.74 54.47 21.64 -4.11 55.33 21.19 -6.01 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 10 3 # 10 C1050 GLN A 86 GLN^? 18.78 O1 EDO A 189 C1091 LEU A 77 LEU^? 11.79 O1 EDO A 189 C1133 GLU A 91 GLU.? 21.73 O1 EDO A 189 coo 68.29 34.44 43.03 66.67 34.74 44.37 67.23 27.16 15.62 69.12 27.87 16.28 coo 65.83 38.95 47.05 65.46 38.90 49.20 61.40 23.35 12.59 59.60 24.52 12.87 coo 63.14 29.39 46.25 63.84 31.31 45.74 66.09 34.28 12.66 67.33 35.85 13.37 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 11 3 # 11 C1050 GLN A 86 GLN^? 18.78 O1 EDO A 189 C1091 LEU A 93 LEU~? 17.77 O1 EDO A 189 C1133 GLU A 91 GLU.? 21.73 O1 EDO A 189 coo 68.29 34.44 43.03 66.67 34.74 44.37 67.23 27.16 15.62 69.12 27.87 16.28 coo 65.83 38.95 47.05 65.46 38.90 49.20 60.93 29.43 17.24 60.83 29.61 15.05 coo 63.14 29.39 46.25 63.84 31.31 45.74 66.09 34.28 12.66 67.33 35.85 13.37 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 12 3 # 12 C1050 GLN A 174 GLN.? 12.38 O1 EDO B 190 C1091 LEU A 176 LEU.? 12.93 O1 EDO B 190 C1133 GLU A 173 GLU.? 15.20 O1 EDO B 190 coo 68.29 34.44 43.03 66.67 34.74 44.37 59.85 -1.54 14.90 58.95 -3.48 14.67 coo 65.83 38.95 47.05 65.46 38.90 49.20 54.79 2.12 12.89 56.72 3.17 12.76 coo 63.14 29.39 46.25 63.84 31.31 45.74 56.04 -5.91 18.03 55.52 -6.78 16.19 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 13 3 # 13 C1050 GLN B 29 GLN^? 9.88 O2 EDO B 189 C1091 LEU B 25 LEU^? 8.43 C1 EDO A 188 C1133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 68.29 34.44 43.03 66.67 34.74 44.37 54.95 21.24 -26.60 56.82 20.31 -27.04 coo 65.83 38.95 47.05 65.46 38.90 49.20 49.81 26.40 -23.16 48.48 26.10 -24.87 coo 63.14 29.39 46.25 63.84 31.31 45.74 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 14 3 # 14 C1050 GLN B 29 GLN^? 9.88 O2 EDO B 189 C1091 LEU B 51 LEU^? 9.21 C2 EDO B 189 C1133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 68.29 34.44 43.03 66.67 34.74 44.37 54.95 21.24 -26.60 56.82 20.31 -27.04 coo 65.83 38.95 47.05 65.46 38.90 49.20 48.82 16.73 -25.34 47.22 15.53 -24.50 coo 63.14 29.39 46.25 63.84 31.31 45.74 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 15 3 # 15 C1050 GLN B 33 GLN^? 9.24 C2 EDO B 189 C1091 LEU B 34 LEU^? 11.05 C2 EDO B 189 C1133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 68.29 34.44 43.03 66.67 34.74 44.37 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 65.83 38.95 47.05 65.46 38.90 49.20 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 63.14 29.39 46.25 63.84 31.31 45.74 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 16 3 # 16 C1050 GLN B 33 GLN^? 9.24 C2 EDO B 189 C1091 LEU B 34 LEU^? 11.05 C2 EDO B 189 C1133 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 68.29 34.44 43.03 66.67 34.74 44.37 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 65.83 38.95 47.05 65.46 38.90 49.20 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 63.14 29.39 46.25 63.84 31.31 45.74 52.81 8.90 -9.47 54.54 9.74 -8.49 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 17 3 # 17 C1050 GLN B 33 GLN^? 9.24 C2 EDO B 189 C1091 LEU B 47 LEU^? 8.42 C1 EDO B 189 C1133 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 68.29 34.44 43.03 66.67 34.74 44.37 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 65.83 38.95 47.05 65.46 38.90 49.20 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 63.14 29.39 46.25 63.84 31.31 45.74 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 18 3 # 18 C1050 GLN B 33 GLN^? 9.24 C2 EDO B 189 C1091 LEU B 47 LEU^? 8.42 C1 EDO B 189 C1133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 68.29 34.44 43.03 66.67 34.74 44.37 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 65.83 38.95 47.05 65.46 38.90 49.20 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 63.14 29.39 46.25 63.84 31.31 45.74 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 19 3 # 19 C1050 GLN B 33 GLN^? 9.24 C2 EDO B 189 C1091 LEU B 47 LEU^? 8.42 C1 EDO B 189 C1133 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 68.29 34.44 43.03 66.67 34.74 44.37 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 65.83 38.95 47.05 65.46 38.90 49.20 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 63.14 29.39 46.25 63.84 31.31 45.74 52.81 8.90 -9.47 54.54 9.74 -8.49 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 20 3 # 20 C1050 GLN B 46 GLN^? 7.98 C2 EDO A 190 C1091 LEU B 34 LEU^? 11.05 C2 EDO B 189 C1133 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 68.29 34.44 43.03 66.67 34.74 44.37 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 65.83 38.95 47.05 65.46 38.90 49.20 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 63.14 29.39 46.25 63.84 31.31 45.74 52.81 8.90 -9.47 54.54 9.74 -8.49 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 21 3 # 21 C1050 GLN B 46 GLN^? 7.98 C2 EDO A 190 C1091 LEU B 47 LEU^? 8.42 C1 EDO B 189 C1133 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 68.29 34.44 43.03 66.67 34.74 44.37 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 65.83 38.95 47.05 65.46 38.90 49.20 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 63.14 29.39 46.25 63.84 31.31 45.74 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 22 3 # 22 C1050 GLN B 46 GLN^? 7.98 C2 EDO A 190 C1091 LEU B 47 LEU^? 8.42 C1 EDO B 189 C1133 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 68.29 34.44 43.03 66.67 34.74 44.37 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 65.83 38.95 47.05 65.46 38.90 49.20 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 63.14 29.39 46.25 63.84 31.31 45.74 52.81 8.90 -9.47 54.54 9.74 -8.49 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 22 hits 1bs4_c02 naa= 3 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 29 GLN^? 9.33 C2 EDO A 189 A 91 LEU A 25 LEU^? 10.43 O1 EDO B 190 A 133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 38.23 53.34 67.59 38.84 53.87 69.56 66.72 9.95 7.95 67.95 11.27 6.82 coo 35.40 53.22 73.30 35.37 54.87 74.74 60.88 4.33 8.47 60.95 4.72 10.61 coo 45.08 56.04 70.60 43.15 55.19 70.77 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 29 GLN^? 9.33 C2 EDO A 189 A 91 LEU A 51 LEU^? 9.38 O1 EDO A 189 A 133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 38.23 53.34 67.59 38.84 53.87 69.56 66.72 9.95 7.95 67.95 11.27 6.82 coo 35.40 53.22 73.30 35.37 54.87 74.74 60.95 13.93 10.88 59.04 14.94 11.05 coo 45.08 56.04 70.60 43.15 55.19 70.77 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 3 3 # 3 A 50 GLN A 33 GLN^? 7.13 C1 EDO A 190 A 91 LEU A 34 LEU^? 9.26 O2 EDO A 190 A 133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 38.23 53.34 67.59 38.84 53.87 69.56 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 35.40 53.22 73.30 35.37 54.87 74.74 51.42 13.55 3.24 49.84 14.38 4.49 coo 45.08 56.04 70.60 43.15 55.19 70.77 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 4 3 # 4 A 50 GLN A 33 GLN^? 7.13 C1 EDO A 190 A 91 LEU A 47 LEU^? 8.05 O1 EDO A 189 A 133 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 38.23 53.34 67.59 38.84 53.87 69.56 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 35.40 53.22 73.30 35.37 54.87 74.74 52.48 17.67 2.84 53.43 18.52 4.62 coo 45.08 56.04 70.60 43.15 55.19 70.77 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 5 3 # 5 A 50 GLN A 46 GLN^? 7.01 C1 EDO A 190 A 91 LEU A 34 LEU^? 9.26 O2 EDO A 190 A 133 GLU A 67 GLU^? 10.03 C1 EDO A 189 coo 38.23 53.34 67.59 38.84 53.87 69.56 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 35.40 53.22 73.30 35.37 54.87 74.74 51.42 13.55 3.24 49.84 14.38 4.49 coo 45.08 56.04 70.60 43.15 55.19 70.77 54.47 21.64 -4.11 55.33 21.19 -6.01 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 6 3 # 6 A 50 GLN A 86 GLN^? 18.78 O1 EDO A 189 A 91 LEU A 77 LEU^? 11.79 O1 EDO A 189 A 133 GLU A 91 GLU.? 21.73 O1 EDO A 189 coo 38.23 53.34 67.59 38.84 53.87 69.56 67.23 27.16 15.62 69.12 27.87 16.28 coo 35.40 53.22 73.30 35.37 54.87 74.74 61.40 23.35 12.59 59.60 24.52 12.87 coo 45.08 56.04 70.60 43.15 55.19 70.77 66.09 34.28 12.66 67.33 35.85 13.37 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 7 3 # 7 A 50 GLN A 86 GLN^? 18.78 O1 EDO A 189 A 91 LEU A 93 LEU~? 17.77 O1 EDO A 189 A 133 GLU A 91 GLU.? 21.73 O1 EDO A 189 coo 38.23 53.34 67.59 38.84 53.87 69.56 67.23 27.16 15.62 69.12 27.87 16.28 coo 35.40 53.22 73.30 35.37 54.87 74.74 60.93 29.43 17.24 60.83 29.61 15.05 coo 45.08 56.04 70.60 43.15 55.19 70.77 66.09 34.28 12.66 67.33 35.85 13.37 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 8 3 # 8 A 50 GLN A 174 GLN.? 12.38 O1 EDO B 190 A 91 LEU A 176 LEU.? 12.93 O1 EDO B 190 A 133 GLU A 173 GLU.? 15.20 O1 EDO B 190 coo 38.23 53.34 67.59 38.84 53.87 69.56 59.85 -1.54 14.90 58.95 -3.48 14.67 coo 35.40 53.22 73.30 35.37 54.87 74.74 54.79 2.12 12.89 56.72 3.17 12.76 coo 45.08 56.04 70.60 43.15 55.19 70.77 56.04 -5.91 18.03 55.52 -6.78 16.19 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 9 3 # 9 A 50 GLN B 29 GLN^? 9.88 O2 EDO B 189 A 91 LEU B 25 LEU^? 8.43 C1 EDO A 188 A 133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 38.23 53.34 67.59 38.84 53.87 69.56 54.95 21.24 -26.60 56.82 20.31 -27.04 coo 35.40 53.22 73.30 35.37 54.87 74.74 49.81 26.40 -23.16 48.48 26.10 -24.87 coo 45.08 56.04 70.60 43.15 55.19 70.77 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 10 3 # 10 A 50 GLN B 29 GLN^? 9.88 O2 EDO B 189 A 91 LEU B 51 LEU^? 9.21 C2 EDO B 189 A 133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 38.23 53.34 67.59 38.84 53.87 69.56 54.95 21.24 -26.60 56.82 20.31 -27.04 coo 35.40 53.22 73.30 35.37 54.87 74.74 48.82 16.73 -25.34 47.22 15.53 -24.50 coo 45.08 56.04 70.60 43.15 55.19 70.77 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 11 3 # 11 A 50 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 91 LEU B 34 LEU^? 11.05 C2 EDO B 189 A 133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 38.23 53.34 67.59 38.84 53.87 69.56 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 35.40 53.22 73.30 35.37 54.87 74.74 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 45.08 56.04 70.60 43.15 55.19 70.77 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 12 3 # 12 A 50 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 91 LEU B 34 LEU^? 11.05 C2 EDO B 189 A 133 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 38.23 53.34 67.59 38.84 53.87 69.56 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 35.40 53.22 73.30 35.37 54.87 74.74 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 45.08 56.04 70.60 43.15 55.19 70.77 52.81 8.90 -9.47 54.54 9.74 -8.49 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 13 3 # 13 A 50 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 91 LEU B 47 LEU^? 8.42 C1 EDO B 189 A 133 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 38.23 53.34 67.59 38.84 53.87 69.56 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 35.40 53.22 73.30 35.37 54.87 74.74 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 45.08 56.04 70.60 43.15 55.19 70.77 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 14 3 # 14 A 50 GLN B 46 GLN^? 7.98 C2 EDO A 190 A 91 LEU B 34 LEU^? 11.05 C2 EDO B 189 A 133 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 38.23 53.34 67.59 38.84 53.87 69.56 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 35.40 53.22 73.30 35.37 54.87 74.74 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 45.08 56.04 70.60 43.15 55.19 70.77 52.81 8.90 -9.47 54.54 9.74 -8.49 1bsj_c00 source 1bsj PEPTIDE DEFORMYLASE : 14 hits 1bsj_c00 naa= 3 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 # 1 B 325 ASP A 172 ASP.? 13.07 O1 EDO B 190 B 354 GLU A 173 GLU.? 15.20 O1 EDO B 190 B 421 ASP A 151 ASP^? 20.35 CM MPD A 191 coo 25.90 8.19 53.87 25.36 6.97 52.29 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 27.87 10.66 47.95 27.82 8.60 48.27 56.04 -5.91 18.03 55.52 -6.78 16.19 coo 26.02 1.87 43.38 25.90 1.97 45.49 48.38 -3.74 26.58 47.39 -3.82 24.70 1bvz_c09 source 1bvz ALPHA-AMYLASE II : 1 hits 1bvz_c09 naa= 3 ULMN 3 1bwd_c02 INOSAMINE-PHOSPHATE AMIDINOTRANSFERAuser 1 3 # 1 A 179 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 227 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 332 CYH A 99 CYH.? 13.00 O4 MPD A 191 coo 123.98 30.59 1.90 124.68 28.67 1.28 68.63 22.07 21.16 67.50 22.56 22.86 coo 119.16 28.51 2.63 120.67 28.31 1.13 65.85 25.32 24.26 66.00 24.92 26.31 coo 114.70 31.13 -3.42 115.96 29.28 -1.69 58.08 21.10 22.79 55.99 22.56 21.69 ULMN 3 1bwd_c02 INOSAMINE-PHOSPHATE AMIDINOTRANSFERAuser 2 3 # 2 A 179 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 227 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 332 CYH B 99 CYH.? 13.42 O2 MPD B 194 coo 123.98 30.59 1.90 124.68 28.67 1.28 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 119.16 28.51 2.63 120.67 28.31 1.13 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 114.70 31.13 -3.42 115.96 29.28 -1.69 39.68 9.38 -33.42 38.76 7.79 -31.29 1bwd_c02 source 1bwd INOSAMINE-PHOSPHATE AMIDINOTRANSFERASE : 2 hits 1bwd_c02 naa= 3 ULMN 3 1bwd_c03 INOSAMINE-PHOSPHATE AMIDINOTRANSFERAuser 1 3 # 1 B 179 ASP A 80 ASP.? 21.91 O1 EDO A 189 B 227 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 332 CYH A 99 CYH.? 13.00 O4 MPD A 191 coo 94.18 76.57 24.23 93.74 77.97 22.66 68.63 22.07 21.16 67.50 22.56 22.86 coo 89.34 74.44 23.40 90.11 76.41 23.55 65.85 25.32 24.26 66.00 24.92 26.31 coo 85.03 76.39 29.77 85.85 76.14 27.06 58.08 21.10 22.79 55.99 22.56 21.69 ULMN 3 1bwd_c03 INOSAMINE-PHOSPHATE AMIDINOTRANSFERAuser 2 3 # 2 B 179 ASP B 80 ASP.? 22.03 C1 EDO B 189 B 227 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 332 CYH B 99 CYH.? 13.42 O2 MPD B 194 coo 94.18 76.57 24.23 93.74 77.97 22.66 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 89.34 74.44 23.40 90.11 76.41 23.55 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 85.03 76.39 29.77 85.85 76.14 27.06 39.68 9.38 -33.42 38.76 7.79 -31.29 1bwd_c03 source 1bwd INOSAMINE-PHOSPHATE AMIDINOTRANSFERASE : 2 hits 1bwd_c03 naa= 3 ULMN 3 1bzc_c00 PROTEIN-TYROSINE-PHOSPHATASE user 1 3 # 1 A 181 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 215 CYH A 99 CYH.? 13.00 O4 MPD A 191 A 221 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo -20.67 62.35 15.68 -20.16 63.09 17.59 60.01 27.52 25.19 61.63 28.83 24.67 coo -17.06 60.65 8.77 -19.43 59.04 8.89 58.08 21.10 22.79 55.99 22.56 21.69 coo -21.54 63.29 10.68 -19.32 62.77 12.69 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1bzc_c00 PROTEIN-TYROSINE-PHOSPHATASE user 2 3 # 2 A 181 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 215 CYH B 99 CYH.? 13.42 O2 MPD B 194 A 221 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo -20.67 62.35 15.68 -20.16 63.09 17.59 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -17.06 60.65 8.77 -19.43 59.04 8.89 39.68 9.38 -33.42 38.76 7.79 -31.29 coo -21.54 63.29 10.68 -19.32 62.77 12.69 35.59 7.18 -33.96 34.54 5.79 -36.47 1bzc_c00 source 1bzc PROTEIN-TYROSINE-PHOSPHATASE : 2 hits 1bzc_c00 naa= 3 ULMN 3 1c54_c00 RIBONUCLEASE SA user 1 3 # 1 A 54 GLU A 173 GLU.? 15.20 O1 EDO B 190 A 65 ARG A 149 ARG^? 22.01 CM MPD A 191 A 85 HIS A 154 HIS^? 17.90 CM MPD A 191 coo -3.75 5.08 -16.45 -4.49 7.03 -16.67 56.04 -5.91 18.03 55.52 -6.78 16.19 coo -11.31 0.89 -21.51 -13.74 2.37 -20.15 53.15 0.69 27.47 54.83 -1.87 27.18 coo -11.98 -0.40 -12.41 -12.65 1.37 -13.15 45.67 -1.54 22.26 44.90 -3.17 21.19 1c54_c00 source 1c54 RIBONUCLEASE SA : 1 hits 1c54_c00 naa= 3 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 # 1 A 14 ASP A 151 ASP^? 20.35 CM MPD A 191 A 16 HIS A 154 HIS^? 17.90 CM MPD A 191 A 67 GLY A 123 GLY.? 20.10 O2 MPD A 191 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 49.15 2.03 32.88 49.82 2.35 32.50 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 2 3 # 2 A 14 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 16 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 67 GLY B 123 GLY.? 12.15 O1 EDO B 192 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 25.82 28.20 -35.50 26.56 27.90 -35.68 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 151 ASP^? 20.35 CM MPD A 191 C 16 HIS A 154 HIS^? 17.90 CM MPD A 191 C 67 GLY A 123 GLY.? 20.10 O2 MPD A 191 coo 10.04 44.27 88.44 9.47 42.32 89.03 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 6.38 39.80 88.71 6.88 38.89 86.87 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 17.63 42.50 89.25 18.11 42.29 88.64 49.15 2.03 32.88 49.82 2.35 32.50 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 2 3 # 2 C 14 ASP B 151 ASP^? -3.26 O1 EDO B 192s C 16 HIS B 154 HIS^? 5.27 C1 EDO B 192 C 67 GLY B 123 GLY.? 12.15 O1 EDO B 192 coo 10.04 44.27 88.44 9.47 42.32 89.03 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 6.38 39.80 88.71 6.88 38.89 86.87 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 17.63 42.50 89.25 18.11 42.29 88.64 25.82 28.20 -35.50 26.56 27.90 -35.68 1cb7_c07 source 1cb7 GLUTAMATE MUTASE : 2 hits 1cb7_c07 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 4 ASP.? 9.87 O1 EDO A 188 264 GLU B 61 GLU^? 10.17 C1 EDO B 189 328 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 45.62 80.42 43.69 45.65 82.01 45.07 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 59.69 92.71 39.85 58.53 92.03 41.47 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 45.39 90.72 40.63 45.07 89.14 41.90 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP A 4 ASP.? 9.87 O1 EDO A 188 264 GLU B 173 GLU.? 7.59 O1 EDO B 193 328 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 45.62 80.42 43.69 45.65 82.01 45.07 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 59.69 92.71 39.85 58.53 92.03 41.47 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 45.39 90.72 40.63 45.07 89.14 41.90 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 # 3 229 ASP A 27 ASP.? 13.04 O1 EDO B 190 264 GLU A 21 GLU^? 11.03 O2 EDO A 190 328 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 45.62 80.42 43.69 45.65 82.01 45.07 68.29 3.95 12.18 68.54 1.87 11.74 coo 59.69 92.71 39.85 58.53 92.03 41.47 52.20 9.76 4.74 52.41 10.59 6.66 coo 45.39 90.72 40.63 45.07 89.14 41.90 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 # 4 229 ASP A 28 ASP.? 17.25 C2 EDO A 189 264 GLU A 21 GLU^? 11.03 O2 EDO A 190 328 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 45.62 80.42 43.69 45.65 82.01 45.07 68.65 8.60 12.81 69.48 7.64 14.53 coo 59.69 92.71 39.85 58.53 92.03 41.47 52.20 9.76 4.74 52.41 10.59 6.66 coo 45.39 90.72 40.63 45.07 89.14 41.90 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 5 3 # 5 229 ASP A 54 ASP.? 20.27 C2 EDO A 189 264 GLU A 31 GLU^? -3.45 O2 EDO A 189s 328 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 45.62 80.42 43.69 45.65 82.01 45.07 68.86 12.45 19.04 67.57 12.48 20.71 coo 59.69 92.71 39.85 58.53 92.03 41.47 61.87 12.13 2.43 62.94 11.86 0.64 coo 45.39 90.72 40.63 45.07 89.14 41.90 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 6 3 # 6 229 ASP A 56 ASP.? 24.62 C2 EDO A 189 264 GLU A 127 GLU^? 13.22 O2 MPD A 191 328 ASP A 101 ASP^? 14.06 CM MPD A 191 coo 45.62 80.42 43.69 45.65 82.01 45.07 66.73 9.65 23.28 68.51 8.93 24.16 coo 59.69 92.71 39.85 58.53 92.03 41.47 49.68 14.95 31.31 48.32 16.27 32.27 coo 45.39 90.72 40.63 45.07 89.14 41.90 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 7 3 # 7 229 ASP A 101 ASP^? 14.06 CM MPD A 191 264 GLU A 26 GLU.? 10.86 O2 EDO A 189 328 ASP A 54 ASP.? 20.27 C2 EDO A 189 coo 45.62 80.42 43.69 45.65 82.01 45.07 57.05 15.04 20.11 57.86 14.10 21.77 coo 59.69 92.71 39.85 58.53 92.03 41.47 66.27 6.09 6.28 67.77 7.37 5.57 coo 45.39 90.72 40.63 45.07 89.14 41.90 68.86 12.45 19.04 67.57 12.48 20.71 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 8 3 # 8 229 ASP A 172 ASP.? 13.07 O1 EDO B 190 264 GLU B 69 GLU.? -7.04 C2 EDO B 191s 328 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 45.62 80.42 43.69 45.65 82.01 45.07 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 59.69 92.71 39.85 58.53 92.03 41.47 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 45.39 90.72 40.63 45.07 89.14 41.90 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 9 3 # 9 229 ASP B 4 ASP.? -7.27 O2 EDO B 190s 264 GLU A 61 GLU^? 10.22 O1 EDO A 189 328 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 45.62 80.42 43.69 45.65 82.01 45.07 64.75 2.11 3.69 66.46 3.28 4.11 coo 59.69 92.71 39.85 58.53 92.03 41.47 66.46 19.59 10.29 68.35 19.61 9.28 coo 45.39 90.72 40.63 45.07 89.14 41.90 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 10 3 # 10 229 ASP B 27 ASP.? 13.66 O1 EDO A 188 264 GLU B 21 GLU^? 11.62 C2 EDO B 189 328 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 45.62 80.42 43.69 45.65 82.01 45.07 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 59.69 92.71 39.85 58.53 92.03 41.47 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 45.39 90.72 40.63 45.07 89.14 41.90 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 11 3 # 11 229 ASP B 28 ASP.? 13.72 O2 EDO B 189 264 GLU B 21 GLU^? 11.62 C2 EDO B 189 328 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 45.62 80.42 43.69 45.65 82.01 45.07 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 59.69 92.71 39.85 58.53 92.03 41.47 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 45.39 90.72 40.63 45.07 89.14 41.90 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 12 3 # 12 229 ASP B 54 ASP.? 15.81 C2 EDO B 193 264 GLU B 31 GLU^? -3.64 O2 EDO B 189s 328 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 45.62 80.42 43.69 45.65 82.01 45.07 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 59.69 92.71 39.85 58.53 92.03 41.47 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 45.39 90.72 40.63 45.07 89.14 41.90 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 13 3 # 13 229 ASP B 54 ASP.? 15.81 C2 EDO B 193 264 GLU B 173 GLU.? 7.59 O1 EDO B 193 328 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 45.62 80.42 43.69 45.65 82.01 45.07 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 59.69 92.71 39.85 58.53 92.03 41.47 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 45.39 90.72 40.63 45.07 89.14 41.90 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 14 3 # 14 229 ASP B 80 ASP.? 22.03 C1 EDO B 189 264 GLU B 127 GLU^? 12.59 O2 MPD B 194 328 ASP B 97 ASP~? 21.83 C3 MPD B 194 coo 45.62 80.42 43.69 45.65 82.01 45.07 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 59.69 92.71 39.85 58.53 92.03 41.47 29.39 12.97 -34.29 27.94 11.43 -34.46 coo 45.39 90.72 40.63 45.07 89.14 41.90 39.93 2.83 -36.24 41.54 1.65 -37.01 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 15 3 # 15 229 ASP B 101 ASP^? 13.71 C2 EDO B 193 264 GLU B 26 GLU.? 11.31 O2 EDO B 189 328 ASP B 54 ASP.? 15.81 C2 EDO B 193 coo 45.62 80.42 43.69 45.65 82.01 45.07 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 59.69 92.71 39.85 58.53 92.03 41.47 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 45.39 90.72 40.63 45.07 89.14 41.90 50.24 18.54 -36.80 48.17 18.09 -37.17 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 15 hits 1cdg_c00 naa= 3 ULMN 3 1cdg_c04 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 27 ASP.? 13.04 O1 EDO B 190 257 GLU A 26 GLU.? 10.86 O2 EDO A 189 328 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 45.62 80.42 43.69 45.65 82.01 45.07 68.29 3.95 12.18 68.54 1.87 11.74 coo 48.97 85.16 40.39 47.18 86.25 40.47 66.27 6.09 6.28 67.77 7.37 5.57 coo 45.39 90.72 40.63 45.07 89.14 41.90 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1cdg_c04 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP A 28 ASP.? 17.25 C2 EDO A 189 257 GLU A 26 GLU.? 10.86 O2 EDO A 189 328 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 45.62 80.42 43.69 45.65 82.01 45.07 68.65 8.60 12.81 69.48 7.64 14.53 coo 48.97 85.16 40.39 47.18 86.25 40.47 66.27 6.09 6.28 67.77 7.37 5.57 coo 45.39 90.72 40.63 45.07 89.14 41.90 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1cdg_c04 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 # 3 229 ASP B 4 ASP.? -7.27 O2 EDO B 190s 257 GLU A 26 GLU.? 10.86 O2 EDO A 189 328 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 45.62 80.42 43.69 45.65 82.01 45.07 64.75 2.11 3.69 66.46 3.28 4.11 coo 48.97 85.16 40.39 47.18 86.25 40.47 66.27 6.09 6.28 67.77 7.37 5.57 coo 45.39 90.72 40.63 45.07 89.14 41.90 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1cdg_c04 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 # 4 229 ASP B 4 ASP.? -7.27 O2 EDO B 190s 257 GLU A 26 GLU.? 10.86 O2 EDO A 189 328 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 45.62 80.42 43.69 45.65 82.01 45.07 64.75 2.11 3.69 66.46 3.28 4.11 coo 48.97 85.16 40.39 47.18 86.25 40.47 66.27 6.09 6.28 67.77 7.37 5.57 coo 45.39 90.72 40.63 45.07 89.14 41.90 68.65 8.60 12.81 69.48 7.64 14.53 1cdg_c04 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 4 hits 1cdg_c04 naa= 3 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 A 198 GLY A 71 GLY^? 15.15 O2 EDO A 188 A 228 SER A 68 SER^? 14.83 O1 EDO A 189 A 549 ASP A 38 ASP.? 14.66 C5 MPD A 191 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 51.64 28.27 -4.12 51.34 27.67 -3.59 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 48.79 23.73 -3.35 48.63 25.48 -1.65 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 42.66 22.43 1.00 42.54 24.24 2.16 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 # 2 A 198 GLY B 71 GLY^? 6.08 O1 EDO A 190 A 228 SER B 68 SER^? -5.55 O2 EDO B 191s A 549 ASP B 38 ASP.? -2.58 O1 EDO B 191s coo 43.62 -9.31 54.06 43.04 -9.29 54.58 50.84 2.27 -7.92 50.26 2.83 -8.18 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 47.96 6.58 -6.86 46.83 4.83 -8.08 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 40.43 7.67 -6.71 39.74 5.84 -7.58 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 71 GLY^? 15.15 O2 EDO A 188 B1228 SER A 68 SER^? 14.83 O1 EDO A 189 B1549 ASP A 38 ASP.? 14.66 C5 MPD A 191 coo 126.34 72.75 125.66 125.95 73.27 126.11 51.64 28.27 -4.12 51.34 27.67 -3.59 coo 131.65 74.68 129.41 130.31 72.73 128.82 48.79 23.73 -3.35 48.63 25.48 -1.65 coo 134.72 69.43 130.42 133.03 70.65 130.08 42.66 22.43 1.00 42.54 24.24 2.16 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 # 2 B1198 GLY B 71 GLY^? 6.08 O1 EDO A 190 B1228 SER B 68 SER^? -5.55 O2 EDO B 191s B1549 ASP B 38 ASP.? -2.58 O1 EDO B 191s coo 126.34 72.75 125.66 125.95 73.27 126.11 50.84 2.27 -7.92 50.26 2.83 -8.18 coo 131.65 74.68 129.41 130.31 72.73 128.82 47.96 6.58 -6.86 46.83 4.83 -8.08 coo 134.72 69.43 130.42 133.03 70.65 130.08 40.43 7.67 -6.71 39.74 5.84 -7.58 1cjy_c01 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 2 hits 1cjy_c01 naa= 3 ULMN 3 1cms_c04 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 1 3 # 1 34 ASP A 151 ASP^? 20.35 CM MPD A 191 37 SER A 153 SER.? 20.01 CM MPD A 191 216 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 16.90 26.20 29.49 16.22 24.50 28.41 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 12.23 24.31 30.40 14.55 23.96 31.03 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 13.93 25.52 22.10 14.75 24.44 23.75 51.13 -1.78 31.54 51.32 -3.14 29.91 1cms_c04 source 1cms CHYMOSIN B (FORMERLY KNOWN AS RENNIN) (E.C.3.4: 1 hits 1cms_c04 naa= 3 ULMN 3 1cns_c00 CHITINASE user 1 3 # 1 A 67 GLU A 158 GLU^? 10.31 O2 MPD A 191 A 89 GLU A 161 GLU.? 9.37 O2 MPD A 191 A 120 SER A 163 SER.? 4.62 C1 MPD A 191 coo -24.35 9.53 67.64 -25.07 11.29 68.60 43.36 11.29 26.55 43.12 11.25 28.63 coo -31.18 6.91 75.60 -32.39 8.51 74.91 45.67 22.34 23.77 46.84 23.71 24.88 coo -34.73 8.57 68.21 -33.63 9.08 70.28 38.30 19.59 22.49 40.04 18.18 21.65 ULMN 3 1cns_c00 CHITINASE user 2 3 # 2 A 67 GLU B 69 GLU.? -7.04 C2 EDO B 191s A 89 GLU A 21 GLU^? 11.03 O2 EDO A 190 A 120 SER A 19 SER.? 9.58 O2 EDO A 190 coo -24.35 9.53 67.64 -25.07 11.29 68.60 46.74 3.18 -1.73 46.16 1.22 -2.29 coo -31.18 6.91 75.60 -32.39 8.51 74.91 52.20 9.76 4.74 52.41 10.59 6.66 coo -34.73 8.57 68.21 -33.63 9.08 70.28 44.74 11.50 2.76 44.85 11.11 5.15 ULMN 3 1cns_c00 CHITINASE user 3 3 # 3 A 67 GLU B 127 GLU^? 12.59 O2 MPD B 194 A 89 GLU B 161 GLU.? 9.05 O2 MPD B 194 A 120 SER B 142 SER^? 12.79 C3 MPD B 194 coo -24.35 9.53 67.64 -25.07 11.29 68.60 29.39 12.97 -34.29 27.94 11.43 -34.46 coo -31.18 6.91 75.60 -32.39 8.51 74.91 28.86 7.94 -26.27 29.12 6.39 -27.73 coo -34.73 8.57 68.21 -33.63 9.08 70.28 36.25 6.04 -28.61 35.21 4.32 -29.92 ULMN 3 1cns_c00 CHITINASE user 4 3 # 4 A 67 GLU B 158 GLU^? 10.92 O2 MPD B 194 A 89 GLU B 161 GLU.? 9.05 O2 MPD B 194 A 120 SER B 163 SER.? 4.72 C1 MPD B 194 coo -24.35 9.53 67.64 -25.07 11.29 68.60 25.38 18.84 -27.67 24.06 18.79 -29.34 coo -31.18 6.91 75.60 -32.39 8.51 74.91 28.86 7.94 -26.27 29.12 6.39 -27.73 coo -34.73 8.57 68.21 -33.63 9.08 70.28 23.32 10.61 -21.24 25.38 11.94 -21.19 1cns_c00 source 1cns CHITINASE : 4 hits 1cns_c00 naa= 3 ULMN 3 1cns_c01 CHITINASE user 1 3 # 1 B 67 GLU A 69 GLU.? 15.47 O2 EDO A 188 B 89 GLU A 39 GLU.? 8.26 C5 MPD A 191 B 120 SER B 17 SER^? 11.80 O2 EDO A 190 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 44.88 26.70 -3.49 42.93 26.42 -2.77 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 40.24 18.97 5.60 41.21 18.63 7.48 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 37.24 17.60 -2.91 38.85 15.70 -2.91 ULMN 3 1cns_c01 CHITINASE user 2 3 # 2 B 67 GLU A 69 GLU.? 15.47 O2 EDO A 188 B 89 GLU B 21 GLU^? 11.62 C2 EDO B 189 B 120 SER B 19 SER.? 10.72 O2 EDO B 188 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 44.88 26.70 -3.49 42.93 26.42 -2.77 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 40.65 18.63 -9.19 39.36 19.17 -11.21 ULMN 3 1cns_c01 CHITINASE user 3 3 # 3 B 67 GLU A 134 GLU^? 6.11 C5 MPD A 191 B 89 GLU A 161 GLU.? 9.37 O2 MPD A 191 B 120 SER A 142 SER^? 11.36 O4 MPD A 191 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 46.05 21.45 10.47 44.38 22.44 11.35 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 45.67 22.34 23.77 46.84 23.71 24.88 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 52.28 24.44 20.99 51.62 26.22 22.49 ULMN 3 1cns_c01 CHITINASE user 4 3 # 4 B 67 GLU A 158 GLU^? 10.31 O2 MPD A 191 B 89 GLU A 161 GLU.? 9.37 O2 MPD A 191 B 120 SER A 163 SER.? 4.62 C1 MPD A 191 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 43.36 11.29 26.55 43.12 11.25 28.63 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 45.67 22.34 23.77 46.84 23.71 24.88 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 38.30 19.59 22.49 40.04 18.18 21.65 ULMN 3 1cns_c01 CHITINASE user 5 3 # 5 B 67 GLU B 69 GLU.? -7.04 C2 EDO B 191s B 89 GLU A 21 GLU^? 11.03 O2 EDO A 190 B 120 SER A 19 SER.? 9.58 O2 EDO A 190 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 52.20 9.76 4.74 52.41 10.59 6.66 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 44.74 11.50 2.76 44.85 11.11 5.15 ULMN 3 1cns_c01 CHITINASE user 6 3 # 6 B 67 GLU B 134 GLU^? -3.38 C2 EDO B 188s B 89 GLU B 161 GLU.? 9.05 O2 MPD B 194 B 120 SER B 142 SER^? 12.79 C3 MPD B 194 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 37.37 8.74 -16.44 35.46 7.85 -16.33 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 28.86 7.94 -26.27 29.12 6.39 -27.73 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 36.25 6.04 -28.61 35.21 4.32 -29.92 ULMN 3 1cns_c01 CHITINASE user 7 3 # 7 B 67 GLU B 158 GLU^? 10.92 O2 MPD B 194 B 89 GLU B 161 GLU.? 9.05 O2 MPD B 194 B 120 SER B 163 SER.? 4.72 C1 MPD B 194 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 28.86 7.94 -26.27 29.12 6.39 -27.73 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 23.32 10.61 -21.24 25.38 11.94 -21.19 1cns_c01 source 1cns CHITINASE : 7 hits 1cns_c01 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 155 TYR^? 14.94 CM MPD A 191 A 173 ASP A 151 ASP^? 20.35 CM MPD A 191 C 48 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 50.44 4.00 23.33 52.91 2.96 24.17 coo 24.35 4.55 25.11 25.94 3.23 25.53 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 101 TYR B 147 TYR^? 9.73 O2 MPD B 194 A 173 ASP B 101 ASP^? 13.71 C2 EDO B 193 C 48 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 24.35 4.55 25.11 25.94 3.23 25.53 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 24.74 19.51 -33.91 24.95 16.46 -33.56 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 101 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 173 ASP B 151 ASP^? -3.26 O1 EDO B 192s C 48 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 24.35 4.55 25.11 25.94 3.23 25.53 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 101 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 173 ASP B 151 ASP^? -3.26 O1 EDO B 192s C 48 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 24.35 4.55 25.11 25.94 3.23 25.53 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 24.74 19.51 -33.91 24.95 16.46 -33.56 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 4 hits 1cs1_c00 naa= 3 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 48 ARG A 116 ARG~? 15.92 O1 EDO B 190 C 101 TYR A 155 TYR^? 14.94 CM MPD A 191 C 173 ASP A 151 ASP^? 20.35 CM MPD A 191 coo 32.27 5.62 48.15 31.93 6.48 51.06 59.64 3.34 19.37 61.78 2.26 17.40 coo 29.64 3.64 57.39 31.22 5.14 55.65 50.44 4.00 23.33 52.91 2.96 24.17 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 48.38 -3.74 26.58 47.39 -3.82 24.70 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 48 ARG B 116 ARG~? 5.91 C2 EDO B 193 C 101 TYR B 147 TYR^? 9.73 O2 MPD B 194 C 173 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 32.27 5.62 48.15 31.93 6.48 51.06 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 29.64 3.64 57.39 31.22 5.14 55.65 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 48 ARG B 116 ARG~? 5.91 C2 EDO B 193 C 101 TYR B 155 TYR^? 6.08 O1 EDO B 193 C 173 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 32.27 5.62 48.15 31.93 6.48 51.06 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 29.64 3.64 57.39 31.22 5.14 55.65 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 29.45 33.81 -30.55 29.73 34.07 -28.42 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 48 ARG B 125 ARG^? 12.90 O2 MPD B 194 C 101 TYR B 155 TYR^? 6.08 O1 EDO B 193 C 173 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 32.27 5.62 48.15 31.93 6.48 51.06 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 29.64 3.64 57.39 31.22 5.14 55.65 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 29.45 33.81 -30.55 29.73 34.07 -28.42 1cs1_c01 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 4 hits 1cs1_c01 naa= 3 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 48 ARG A 116 ARG~? 15.92 O1 EDO B 190 D 101 TYR A 155 TYR^? 14.94 CM MPD A 191 D 173 ASP A 151 ASP^? 20.35 CM MPD A 191 coo 69.08 8.58 32.60 69.70 10.81 30.58 59.64 3.34 19.37 61.78 2.26 17.40 coo 71.77 11.86 24.26 70.23 12.22 26.56 50.44 4.00 23.33 52.91 2.96 24.17 coo 71.60 6.14 19.25 70.26 6.87 20.69 48.38 -3.74 26.58 47.39 -3.82 24.70 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 48 ARG B 116 ARG~? 5.91 C2 EDO B 193 D 101 TYR B 155 TYR^? 6.08 O1 EDO B 193 D 173 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 69.08 8.58 32.60 69.70 10.81 30.58 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 71.77 11.86 24.26 70.23 12.22 26.56 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 71.60 6.14 19.25 70.26 6.87 20.69 29.45 33.81 -30.55 29.73 34.07 -28.42 1cs1_c02 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1cs1_c02 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 155 TYR^? 14.94 CM MPD A 191 B 173 ASP A 151 ASP^? 20.35 CM MPD A 191 D 48 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 50.44 4.00 23.33 52.91 2.96 24.17 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 101 TYR B 147 TYR^? 9.73 O2 MPD B 194 B 173 ASP B 101 ASP^? 13.71 C2 EDO B 193 D 48 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 101 TYR B 155 TYR^? 6.08 O1 EDO B 193 B 173 ASP B 151 ASP^? -3.26 O1 EDO B 192s D 48 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 101 TYR B 155 TYR^? 6.08 O1 EDO B 193 B 173 ASP B 151 ASP^? -3.26 O1 EDO B 192s D 48 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 24.74 19.51 -33.91 24.95 16.46 -33.56 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 4 hits 1cs1_c03 naa= 3 ULMN 3 1ctn_c00 CHITINASE A (E.C.3.2.1.14) (PH 5.5, user 1 3 # 1 313 ASP A 27 ASP.? 13.04 O1 EDO B 190 315 GLU A 26 GLU.? 10.86 O2 EDO A 189 390 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 32.46 99.13 19.34 30.94 100.38 20.07 68.29 3.95 12.18 68.54 1.87 11.74 coo 32.04 94.22 18.23 30.57 94.75 16.88 66.27 6.09 6.28 67.77 7.37 5.57 coo 21.10 94.74 18.36 23.09 96.71 18.59 55.88 2.21 7.80 57.52 0.60 9.42 ULMN 3 1ctn_c00 CHITINASE A (E.C.3.2.1.14) (PH 5.5, user 2 3 # 2 313 ASP A 172 ASP.? 13.07 O1 EDO B 190 315 GLU A 173 GLU.? 15.20 O1 EDO B 190 390 TYR A 155 TYR^? 14.94 CM MPD A 191 coo 32.46 99.13 19.34 30.94 100.38 20.07 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 32.04 94.22 18.23 30.57 94.75 16.88 56.04 -5.91 18.03 55.52 -6.78 16.19 coo 21.10 94.74 18.36 23.09 96.71 18.59 50.44 4.00 23.33 52.91 2.96 24.17 ULMN 3 1ctn_c00 CHITINASE A (E.C.3.2.1.14) (PH 5.5, user 3 3 # 3 313 ASP B 27 ASP.? 13.66 O1 EDO A 188 315 GLU B 26 GLU.? 11.31 O2 EDO B 189 390 TYR A 7 TYR^? -3.69 C1 EDO A 188s coo 32.46 99.13 19.34 30.94 100.38 20.07 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 32.04 94.22 18.23 30.57 94.75 16.88 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 21.10 94.74 18.36 23.09 96.71 18.59 46.26 28.35 -19.62 46.61 30.00 -21.81 ULMN 3 1ctn_c00 CHITINASE A (E.C.3.2.1.14) (PH 5.5, user 4 3 # 4 313 ASP B 172 ASP.? 7.16 C1 EDO B 193 315 GLU B 173 GLU.? 7.59 O1 EDO B 193 390 TYR B 155 TYR^? 6.08 O1 EDO B 193 coo 32.46 99.13 19.34 30.94 100.38 20.07 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 32.04 94.22 18.23 30.57 94.75 16.88 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 21.10 94.74 18.36 23.09 96.71 18.59 32.75 26.18 -29.08 34.17 27.29 -31.19 1ctn_c00 source 1ctn CHITINASE A (E.C.3.2.1.14) (PH 5.5, 4 DEGREES : 4 hits 1ctn_c00 naa= 3 ULMN 3 1cwy_c00 AMYLOMALTASE user 1 3 # 1 A 293 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 340 GLU B 26 GLU.? 11.31 O2 EDO B 189 A 395 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo -48.00 -26.48 6.86 -46.51 -25.94 5.49 55.32 27.50 -21.80 56.24 27.40 -19.90 coo -43.58 -29.03 7.13 -42.45 -27.34 7.75 55.48 25.40 -24.73 57.31 24.35 -24.78 coo -42.28 -26.47 -1.32 -44.06 -25.60 -0.58 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1cwy_c00 AMYLOMALTASE user 2 3 # 2 A 293 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 340 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 395 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo -48.00 -26.48 6.86 -46.51 -25.94 5.49 64.75 2.11 3.69 66.46 3.28 4.11 coo -43.58 -29.03 7.13 -42.45 -27.34 7.75 66.27 6.09 6.28 67.77 7.37 5.57 coo -42.28 -26.47 -1.32 -44.06 -25.60 -0.58 68.65 8.60 12.81 69.48 7.64 14.53 1cwy_c00 source 1cwy AMYLOMALTASE : 2 hits 1cwy_c00 naa= 3 ULMN 3 1d5r_c00 PHOSPHOINOSITIDE PHOSPHOTASE PTEN user 1 3 # 1 A 92 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 124 CYH A 99 CYH.? 13.00 O4 MPD A 191 A 130 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo 38.50 84.15 22.11 36.72 85.12 21.46 60.01 27.52 25.19 61.63 28.83 24.67 coo 39.50 92.46 25.29 36.94 91.57 26.24 58.08 21.10 22.79 55.99 22.56 21.69 coo 39.28 86.97 26.61 39.95 87.60 23.68 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1d5r_c00 PHOSPHOINOSITIDE PHOSPHOTASE PTEN user 2 3 # 2 A 92 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 124 CYH B 99 CYH.? 13.42 O2 MPD B 194 A 130 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 38.50 84.15 22.11 36.72 85.12 21.46 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 39.50 92.46 25.29 36.94 91.57 26.24 39.68 9.38 -33.42 38.76 7.79 -31.29 coo 39.28 86.97 26.61 39.95 87.60 23.68 35.59 7.18 -33.96 34.54 5.79 -36.47 1d5r_c00 source 1d5r PHOSPHOINOSITIDE PHOSPHOTASE PTEN : 2 hits 1d5r_c00 naa= 3 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 # 1 A 37 ASP A 101 ASP^? 14.06 CM MPD A 191 A 56 ILE A 104 ILE^? 10.70 C5 MPD A 191 A 82 TYR A 132 TYR^? -3.92 O4 MPD A 191s coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 57.05 15.04 20.11 57.86 14.10 21.77 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 52.63 16.20 10.71 53.57 16.16 9.77 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 48.86 20.67 16.01 46.69 20.01 14.37 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 # 2 A 37 ASP A 101 ASP^? 14.06 CM MPD A 191 A 56 ILE A 115 ILE~? 14.42 CM MPD A 191 A 82 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 57.05 15.04 20.11 57.86 14.10 21.77 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 54.87 5.50 21.15 53.81 4.69 20.75 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 3 3 # 3 A 37 ASP A 101 ASP^? 14.06 CM MPD A 191 A 56 ILE A 133 ILE^? 10.97 O4 MPD A 191 A 82 TYR A 132 TYR^? -3.92 O4 MPD A 191s coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 57.05 15.04 20.11 57.86 14.10 21.77 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 53.18 21.34 11.97 54.52 21.71 11.65 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 48.86 20.67 16.01 46.69 20.01 14.37 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 4 3 # 4 A 37 ASP A 103 ASP^? 5.49 CM MPD A 191 A 56 ILE A 115 ILE~? 14.42 CM MPD A 191 A 82 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 51.58 16.40 16.66 49.70 15.49 16.18 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 54.87 5.50 21.15 53.81 4.69 20.75 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 5 3 # 5 A 37 ASP A 122 ASP.? 22.97 CM MPD A 191 A 56 ILE A 115 ILE~? 14.42 CM MPD A 191 A 82 TYR A 155 TYR^? 14.94 CM MPD A 191 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 54.87 5.50 21.15 53.81 4.69 20.75 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 50.44 4.00 23.33 52.91 2.96 24.17 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 6 3 # 6 A 37 ASP A 151 ASP^? 20.35 CM MPD A 191 A 56 ILE A 115 ILE~? 14.42 CM MPD A 191 A 82 TYR A 155 TYR^? 14.94 CM MPD A 191 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 54.87 5.50 21.15 53.81 4.69 20.75 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 50.44 4.00 23.33 52.91 2.96 24.17 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 7 3 # 7 A 37 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 56 ILE A 115 ILE~? 14.42 CM MPD A 191 A 82 TYR A 155 TYR^? 14.94 CM MPD A 191 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 54.87 5.50 21.15 53.81 4.69 20.75 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 50.44 4.00 23.33 52.91 2.96 24.17 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 8 3 # 8 A 37 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 56 ILE B 104 ILE^? 9.74 C5 MPD B 194 A 82 TYR B 132 TYR^? 4.23 O4 MPD B 194s coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 42.29 14.26 -20.36 43.70 14.23 -20.11 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 36.28 9.60 -22.40 35.59 10.15 -19.78 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 9 3 # 9 A 37 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 56 ILE B 115 ILE~? 5.13 C1 EDO B 193 A 82 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 37.50 24.83 -29.84 36.97 25.68 -28.85 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 10 3 # 10 A 37 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 56 ILE B 133 ILE^? 10.78 C5 MPD B 194 A 82 TYR B 132 TYR^? 4.23 O4 MPD B 194s coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 42.19 9.10 -21.83 43.43 8.71 -22.39 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 36.28 9.60 -22.40 35.59 10.15 -19.78 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 11 3 # 11 A 37 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 56 ILE B 115 ILE~? 5.13 C1 EDO B 193 A 82 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 37.50 24.83 -29.84 36.97 25.68 -28.85 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 12 3 # 12 A 37 ASP B 122 ASP.? 7.15 O2 EDO B 192 A 56 ILE B 115 ILE~? 5.13 C1 EDO B 193 A 82 TYR B 155 TYR^? 6.08 O1 EDO B 193 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 37.50 24.83 -29.84 36.97 25.68 -28.85 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 32.75 26.18 -29.08 34.17 27.29 -31.19 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 13 3 # 13 A 37 ASP B 172 ASP.? 7.16 C1 EDO B 193 A 56 ILE B 115 ILE~? 5.13 C1 EDO B 193 A 82 TYR B 155 TYR^? 6.08 O1 EDO B 193 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 37.50 24.83 -29.84 36.97 25.68 -28.85 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 32.75 26.18 -29.08 34.17 27.29 -31.19 1d6o_c00 source 1d6o FK506-BINDING PROTEIN : 13 hits 1d6o_c00 naa= 3 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 # 1 B 37 ASP A 101 ASP^? 14.06 CM MPD A 191 B 56 ILE A 104 ILE^? 10.70 C5 MPD A 191 B 82 TYR A 132 TYR^? -3.92 O4 MPD A 191s coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 57.05 15.04 20.11 57.86 14.10 21.77 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 52.63 16.20 10.71 53.57 16.16 9.77 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 48.86 20.67 16.01 46.69 20.01 14.37 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 # 2 B 37 ASP A 101 ASP^? 14.06 CM MPD A 191 B 56 ILE A 115 ILE~? 14.42 CM MPD A 191 B 82 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 57.05 15.04 20.11 57.86 14.10 21.77 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 54.87 5.50 21.15 53.81 4.69 20.75 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 3 3 # 3 B 37 ASP A 101 ASP^? 14.06 CM MPD A 191 B 56 ILE A 133 ILE^? 10.97 O4 MPD A 191 B 82 TYR A 132 TYR^? -3.92 O4 MPD A 191s coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 57.05 15.04 20.11 57.86 14.10 21.77 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 53.18 21.34 11.97 54.52 21.71 11.65 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 48.86 20.67 16.01 46.69 20.01 14.37 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 4 3 # 4 B 37 ASP A 103 ASP^? 5.49 CM MPD A 191 B 56 ILE A 115 ILE~? 14.42 CM MPD A 191 B 82 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 51.58 16.40 16.66 49.70 15.49 16.18 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 54.87 5.50 21.15 53.81 4.69 20.75 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 5 3 # 5 B 37 ASP A 122 ASP.? 22.97 CM MPD A 191 B 56 ILE A 115 ILE~? 14.42 CM MPD A 191 B 82 TYR A 155 TYR^? 14.94 CM MPD A 191 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 54.87 5.50 21.15 53.81 4.69 20.75 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 50.44 4.00 23.33 52.91 2.96 24.17 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 6 3 # 6 B 37 ASP A 151 ASP^? 20.35 CM MPD A 191 B 56 ILE A 115 ILE~? 14.42 CM MPD A 191 B 82 TYR A 155 TYR^? 14.94 CM MPD A 191 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 54.87 5.50 21.15 53.81 4.69 20.75 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 50.44 4.00 23.33 52.91 2.96 24.17 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 7 3 # 7 B 37 ASP A 172 ASP.? 13.07 O1 EDO B 190 B 56 ILE A 115 ILE~? 14.42 CM MPD A 191 B 82 TYR A 155 TYR^? 14.94 CM MPD A 191 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 54.87 5.50 21.15 53.81 4.69 20.75 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 50.44 4.00 23.33 52.91 2.96 24.17 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 8 3 # 8 B 37 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 56 ILE B 104 ILE^? 9.74 C5 MPD B 194 B 82 TYR B 132 TYR^? 4.23 O4 MPD B 194s coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 42.29 14.26 -20.36 43.70 14.23 -20.11 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 36.28 9.60 -22.40 35.59 10.15 -19.78 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 9 3 # 9 B 37 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 56 ILE B 115 ILE~? 5.13 C1 EDO B 193 B 82 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 37.50 24.83 -29.84 36.97 25.68 -28.85 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 10 3 # 10 B 37 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 56 ILE B 133 ILE^? 10.78 C5 MPD B 194 B 82 TYR B 132 TYR^? 4.23 O4 MPD B 194s coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 42.19 9.10 -21.83 43.43 8.71 -22.39 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 36.28 9.60 -22.40 35.59 10.15 -19.78 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 11 3 # 11 B 37 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 56 ILE B 115 ILE~? 5.13 C1 EDO B 193 B 82 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 37.50 24.83 -29.84 36.97 25.68 -28.85 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 12 3 # 12 B 37 ASP B 122 ASP.? 7.15 O2 EDO B 192 B 56 ILE B 115 ILE~? 5.13 C1 EDO B 193 B 82 TYR B 155 TYR^? 6.08 O1 EDO B 193 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 37.50 24.83 -29.84 36.97 25.68 -28.85 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 32.75 26.18 -29.08 34.17 27.29 -31.19 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 13 3 # 13 B 37 ASP B 172 ASP.? 7.16 C1 EDO B 193 B 56 ILE B 115 ILE~? 5.13 C1 EDO B 193 B 82 TYR B 155 TYR^? 6.08 O1 EDO B 193 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 37.50 24.83 -29.84 36.97 25.68 -28.85 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 32.75 26.18 -29.08 34.17 27.29 -31.19 1d6o_c01 source 1d6o FK506-BINDING PROTEIN : 13 hits 1d6o_c01 naa= 3 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 1 3 # 1 A 173 TYR A 49 TYR^? 7.66 O1 EDO A 189 A 243 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 272 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 2.03 68.31 21.46 0.66 68.36 23.90 56.86 15.30 6.36 55.58 13.13 7.63 coo 16.93 55.67 9.65 17.16 54.23 11.19 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 14.13 45.79 13.40 14.25 49.41 18.30 51.85 4.84 -17.64 57.80 3.80 -15.89 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 2 3 # 2 A 173 TYR A 157 TYR^? -4.51 CM MPD A 191s A 243 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 272 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 2.03 68.31 21.46 0.66 68.36 23.90 46.12 11.16 21.21 46.22 13.94 20.83 coo 16.93 55.67 9.65 17.16 54.23 11.19 57.58 16.65 0.08 56.71 16.10 -1.78 coo 14.13 45.79 13.40 14.25 49.41 18.30 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 3 3 # 3 A 173 TYR A 180 TYR^? 6.78 CM MPD A 191 A 243 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 272 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 2.03 68.31 21.46 0.66 68.36 23.90 44.70 7.55 14.68 44.63 9.72 16.45 coo 16.93 55.67 9.65 17.16 54.23 11.19 57.58 16.65 0.08 56.71 16.10 -1.78 coo 14.13 45.79 13.40 14.25 49.41 18.30 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 4 3 # 4 A 173 TYR B 49 TYR^? -7.47 C2 EDO B 189s A 243 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 272 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 2.03 68.31 21.46 0.66 68.36 23.90 48.23 15.25 -19.35 46.43 17.40 -19.57 coo 16.93 55.67 9.65 17.16 54.23 11.19 57.58 16.65 0.08 56.71 16.10 -1.78 coo 14.13 45.79 13.40 14.25 49.41 18.30 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 5 3 # 5 A 173 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 243 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 272 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 2.03 68.31 21.46 0.66 68.36 23.90 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 16.93 55.67 9.65 17.16 54.23 11.19 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 14.13 45.79 13.40 14.25 49.41 18.30 51.85 4.84 -17.64 57.80 3.80 -15.89 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 6 3 # 6 A 173 TYR B 180 TYR^? 6.70 CM MPD B 194 A 243 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 272 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 2.03 68.31 21.46 0.66 68.36 23.90 33.32 22.60 -18.62 32.30 20.35 -20.02 coo 16.93 55.67 9.65 17.16 54.23 11.19 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 14.13 45.79 13.40 14.25 49.41 18.30 51.85 4.84 -17.64 57.80 3.80 -15.89 1d7r_c02 source 1d7r 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYRUVATE) : 6 hits 1d7r_c02 naa= 3 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 A 145 LYS A 74 LYS^? 9.41 O1 EDO A 189 A 177 GLU A 139 GLU.? 13.74 O4 MPD A 191 A 201 LEU A 138 LEU.? 10.11 O1 EDO A 189 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 58.34 25.75 2.84 62.12 26.28 -2.26 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 50.77 29.24 9.79 48.92 30.09 9.22 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 53.25 24.44 7.22 53.61 22.61 6.19 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 2 3 # 2 A 145 LYS B 74 LYS^? 9.11 O1 EDO B 189 A 177 GLU B 139 GLU.? 9.67 O2 EDO B 191 A 201 LEU B 138 LEU.? 10.66 C1 EDO B 189 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 41.80 1.11 -18.67 40.76 -0.16 -17.27 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 45.17 5.96 -18.11 45.96 7.86 -17.37 1daa_c00 source 1daa D-AMINO ACID AMINOTRANSFERASE : 2 hits 1daa_c00 naa= 3 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 B 145 LYS A 74 LYS^? 9.41 O1 EDO A 189 B 177 GLU A 139 GLU.? 13.74 O4 MPD A 191 B 201 LEU A 138 LEU.? 10.11 O1 EDO A 189 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 58.34 25.75 2.84 62.12 26.28 -2.26 coo 27.00 6.35 51.01 26.30 4.53 50.18 50.77 29.24 9.79 48.92 30.09 9.22 coo 23.74 1.68 49.50 22.87 -0.24 49.97 53.25 24.44 7.22 53.61 22.61 6.19 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 2 3 # 2 B 145 LYS B 74 LYS^? 9.11 O1 EDO B 189 B 177 GLU B 139 GLU.? 9.67 O2 EDO B 191 B 201 LEU B 138 LEU.? 10.66 C1 EDO B 189 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 27.00 6.35 51.01 26.30 4.53 50.18 41.80 1.11 -18.67 40.76 -0.16 -17.27 coo 23.74 1.68 49.50 22.87 -0.24 49.97 45.17 5.96 -18.11 45.96 7.86 -17.37 1daa_c01 source 1daa D-AMINO ACID AMINOTRANSFERASE : 2 hits 1daa_c01 naa= 3 ULMN 3 1ddj_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 646 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 739 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 64.74 13.84 22.58 64.60 13.48 24.65 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 68.86 12.45 19.04 67.57 12.48 20.71 coo 11.37 50.89 2.29 11.05 51.63 2.25 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1ddj_c12 PLASMINOGEN user 2 3 # 2 A 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 646 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 739 GLY A 119 GLY~? 20.44 CM MPD A 191 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 64.74 13.84 22.58 64.60 13.48 24.65 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 68.86 12.45 19.04 67.57 12.48 20.71 coo 11.37 50.89 2.29 11.05 51.63 2.25 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1ddj_c12 PLASMINOGEN user 3 3 # 3 A 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 646 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 739 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 64.74 13.84 22.58 64.60 13.48 24.65 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 66.73 9.65 23.28 68.51 8.93 24.16 coo 11.37 50.89 2.29 11.05 51.63 2.25 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1ddj_c12 PLASMINOGEN user 4 3 # 4 A 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 646 ASP A 101 ASP^? 14.06 CM MPD A 191 A 739 GLY A 119 GLY~? 20.44 CM MPD A 191 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 64.74 13.84 22.58 64.60 13.48 24.65 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 57.05 15.04 20.11 57.86 14.10 21.77 coo 11.37 50.89 2.29 11.05 51.63 2.25 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1ddj_c12 PLASMINOGEN user 5 3 # 5 A 603 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 646 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 739 GLY A 90 GLY.? 17.99 O1 EDO A 189 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 65.85 25.32 24.26 66.00 24.92 26.31 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 60.01 27.52 25.19 61.63 28.83 24.67 coo 11.37 50.89 2.29 11.05 51.63 2.25 68.99 30.23 13.11 68.36 30.72 12.94 ULMN 3 1ddj_c12 PLASMINOGEN user 6 3 # 6 A 603 HIS A 154 HIS^? 17.90 CM MPD A 191 A 646 ASP A 151 ASP^? 20.35 CM MPD A 191 A 739 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 11.37 50.89 2.29 11.05 51.63 2.25 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 1ddj_c12 PLASMINOGEN user 7 3 # 7 A 603 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 646 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 739 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 11.37 50.89 2.29 11.05 51.63 2.25 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1ddj_c12 PLASMINOGEN user 8 3 # 8 A 603 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 646 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 739 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 11.37 50.89 2.29 11.05 51.63 2.25 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1ddj_c12 PLASMINOGEN user 9 3 # 9 A 603 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 646 ASP B 56 ASP.? 14.25 C2 EDO B 193 A 739 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 11.37 50.89 2.29 11.05 51.63 2.25 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1ddj_c12 PLASMINOGEN user 10 3 # 10 A 603 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 646 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 739 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 11.37 50.89 2.29 11.05 51.63 2.25 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1ddj_c12 PLASMINOGEN user 11 3 # 11 A 603 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 646 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 739 GLY B 90 GLY.? 18.17 C1 EDO B 189 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 11.37 50.89 2.29 11.05 51.63 2.25 54.47 0.76 -32.31 54.10 0.32 -31.77 ULMN 3 1ddj_c12 PLASMINOGEN user 12 3 # 12 A 603 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 646 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 739 GLY B 175 GLY.? -3.40 C1 EDO B 193s coo 17.92 60.45 -3.51 16.63 61.88 -2.68 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 11.37 50.89 2.29 11.05 51.63 2.25 39.99 28.43 -27.51 40.50 28.66 -26.90 1ddj_c12 source 1ddj PLASMINOGEN : 12 hits 1ddj_c12 naa= 3 ULMN 3 1ddj_c13 PLASMINOGEN user 1 3 # 1 B 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 646 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 739 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 64.74 13.84 22.58 64.60 13.48 24.65 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 68.86 12.45 19.04 67.57 12.48 20.71 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1ddj_c13 PLASMINOGEN user 2 3 # 2 B 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 646 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 739 GLY A 119 GLY~? 20.44 CM MPD A 191 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 64.74 13.84 22.58 64.60 13.48 24.65 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 68.86 12.45 19.04 67.57 12.48 20.71 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1ddj_c13 PLASMINOGEN user 3 3 # 3 B 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 646 ASP A 56 ASP.? 24.62 C2 EDO A 189 B 739 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 64.74 13.84 22.58 64.60 13.48 24.65 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 66.73 9.65 23.28 68.51 8.93 24.16 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1ddj_c13 PLASMINOGEN user 4 3 # 4 B 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 646 ASP A 101 ASP^? 14.06 CM MPD A 191 B 739 GLY A 119 GLY~? 20.44 CM MPD A 191 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 64.74 13.84 22.58 64.60 13.48 24.65 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 57.05 15.04 20.11 57.86 14.10 21.77 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1ddj_c13 PLASMINOGEN user 5 3 # 5 B 603 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 646 ASP A 97 ASP~? 21.13 O4 MPD A 191 B 739 GLY A 90 GLY.? 17.99 O1 EDO A 189 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 65.85 25.32 24.26 66.00 24.92 26.31 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 60.01 27.52 25.19 61.63 28.83 24.67 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 68.99 30.23 13.11 68.36 30.72 12.94 ULMN 3 1ddj_c13 PLASMINOGEN user 6 3 # 6 B 603 HIS A 154 HIS^? 17.90 CM MPD A 191 B 646 ASP A 151 ASP^? 20.35 CM MPD A 191 B 739 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 48.38 -3.74 26.58 47.39 -3.82 24.70 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 1ddj_c13 PLASMINOGEN user 7 3 # 7 B 603 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 646 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 739 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 50.24 18.54 -36.80 48.17 18.09 -37.17 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1ddj_c13 PLASMINOGEN user 8 3 # 8 B 603 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 646 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 739 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 40.06 15.30 -30.43 39.63 16.39 -32.22 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1ddj_c13 PLASMINOGEN user 9 3 # 9 B 603 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 646 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 739 GLY B 90 GLY.? 18.17 C1 EDO B 189 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 54.47 0.76 -32.31 54.10 0.32 -31.77 1ddj_c13 source 1ddj PLASMINOGEN : 9 hits 1ddj_c13 naa= 3 ULMN 3 1ddj_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 C 646 ASP A 54 ASP.? 20.27 C2 EDO A 189 C 739 GLY A 119 GLY~? 20.44 CM MPD A 191 coo 15.33 59.81 59.60 13.98 60.99 60.69 64.74 13.84 22.58 64.60 13.48 24.65 coo 16.06 55.72 54.73 15.97 56.49 56.70 68.86 12.45 19.04 67.57 12.48 20.71 coo 9.38 49.29 65.28 9.01 50.03 65.31 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1ddj_c14 PLASMINOGEN user 2 3 # 2 C 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 C 646 ASP A 101 ASP^? 14.06 CM MPD A 191 C 739 GLY A 119 GLY~? 20.44 CM MPD A 191 coo 15.33 59.81 59.60 13.98 60.99 60.69 64.74 13.84 22.58 64.60 13.48 24.65 coo 16.06 55.72 54.73 15.97 56.49 56.70 57.05 15.04 20.11 57.86 14.10 21.77 coo 9.38 49.29 65.28 9.01 50.03 65.31 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1ddj_c14 PLASMINOGEN user 3 3 # 3 C 603 HIS A 84 HIS.? 23.86 O4 MPD A 191 C 646 ASP A 80 ASP.? 21.91 O1 EDO A 189 C 739 GLY A 88 GLY.? 12.79 O1 EDO A 189 coo 15.33 59.81 59.60 13.98 60.99 60.69 65.85 25.32 24.26 66.00 24.92 26.31 coo 16.06 55.72 54.73 15.97 56.49 56.70 68.63 22.07 21.16 67.50 22.56 22.86 coo 9.38 49.29 65.28 9.01 50.03 65.31 66.43 27.54 9.22 66.36 28.23 9.60 ULMN 3 1ddj_c14 PLASMINOGEN user 4 3 # 4 C 603 HIS A 84 HIS.? 23.86 O4 MPD A 191 C 646 ASP A 97 ASP~? 21.13 O4 MPD A 191 C 739 GLY A 90 GLY.? 17.99 O1 EDO A 189 coo 15.33 59.81 59.60 13.98 60.99 60.69 65.85 25.32 24.26 66.00 24.92 26.31 coo 16.06 55.72 54.73 15.97 56.49 56.70 60.01 27.52 25.19 61.63 28.83 24.67 coo 9.38 49.29 65.28 9.01 50.03 65.31 68.99 30.23 13.11 68.36 30.72 12.94 ULMN 3 1ddj_c14 PLASMINOGEN user 5 3 # 5 C 603 HIS B 58 HIS.? 15.15 C2 EDO B 193 C 646 ASP B 54 ASP.? 15.81 C2 EDO B 193 C 739 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 15.33 59.81 59.60 13.98 60.99 60.69 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 16.06 55.72 54.73 15.97 56.49 56.70 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 9.38 49.29 65.28 9.01 50.03 65.31 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1ddj_c14 PLASMINOGEN user 6 3 # 6 C 603 HIS B 58 HIS.? 15.15 C2 EDO B 193 C 646 ASP B 101 ASP^? 13.71 C2 EDO B 193 C 739 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 15.33 59.81 59.60 13.98 60.99 60.69 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 16.06 55.72 54.73 15.97 56.49 56.70 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 9.38 49.29 65.28 9.01 50.03 65.31 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1ddj_c14 PLASMINOGEN user 7 3 # 7 C 603 HIS B 84 HIS.? 24.24 O2 MPD B 194 C 646 ASP B 80 ASP.? 22.03 C1 EDO B 189 C 739 GLY B 88 GLY.? 12.78 C1 EDO B 189 coo 15.33 59.81 59.60 13.98 60.99 60.69 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 16.06 55.72 54.73 15.97 56.49 56.70 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 9.38 49.29 65.28 9.01 50.03 65.31 54.76 3.63 -27.59 54.55 2.90 -27.91 ULMN 3 1ddj_c14 PLASMINOGEN user 8 3 # 8 C 603 HIS B 84 HIS.? 24.24 O2 MPD B 194 C 646 ASP B 97 ASP~? 21.83 C3 MPD B 194 C 739 GLY B 90 GLY.? 18.17 C1 EDO B 189 coo 15.33 59.81 59.60 13.98 60.99 60.69 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 16.06 55.72 54.73 15.97 56.49 56.70 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 9.38 49.29 65.28 9.01 50.03 65.31 54.47 0.76 -32.31 54.10 0.32 -31.77 1ddj_c14 source 1ddj PLASMINOGEN : 8 hits 1ddj_c14 naa= 3 ULMN 3 1ddj_c15 PLASMINOGEN user 1 3 # 1 D 603 HIS A 58 HIS.? 21.11 O2 MPD A 191 D 646 ASP A 56 ASP.? 24.62 C2 EDO A 189 D 739 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo -30.51 33.83 43.05 -30.50 33.12 45.03 64.74 13.84 22.58 64.60 13.48 24.65 coo -25.73 33.05 39.28 -27.50 34.05 39.88 66.73 9.65 23.28 68.51 8.93 24.16 coo -27.66 47.32 40.66 -27.81 47.01 41.41 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 1ddj_c15 PLASMINOGEN user 2 3 # 2 D 603 HIS A 76 HIS^? 9.12 O1 EDO A 189 D 646 ASP A 87 ASP^? 16.43 O1 EDO A 189 D 739 GLY A 81 GLY.? 20.02 O1 EDO A 189 coo -30.51 33.83 43.05 -30.50 33.12 45.03 65.00 24.12 7.67 66.83 23.12 7.94 coo -25.73 33.05 39.28 -27.50 34.05 39.88 63.41 29.58 11.55 64.59 31.41 11.51 coo -27.66 47.32 40.66 -27.81 47.01 41.41 66.26 17.90 21.72 66.27 18.63 22.08 ULMN 3 1ddj_c15 PLASMINOGEN user 3 3 # 3 D 603 HIS A 84 HIS.? 23.86 O4 MPD A 191 D 646 ASP A 80 ASP.? 21.91 O1 EDO A 189 D 739 GLY A 88 GLY.? 12.79 O1 EDO A 189 coo -30.51 33.83 43.05 -30.50 33.12 45.03 65.85 25.32 24.26 66.00 24.92 26.31 coo -25.73 33.05 39.28 -27.50 34.05 39.88 68.63 22.07 21.16 67.50 22.56 22.86 coo -27.66 47.32 40.66 -27.81 47.01 41.41 66.43 27.54 9.22 66.36 28.23 9.60 ULMN 3 1ddj_c15 PLASMINOGEN user 4 3 # 4 D 603 HIS A 84 HIS.? 23.86 O4 MPD A 191 D 646 ASP A 97 ASP~? 21.13 O4 MPD A 191 D 739 GLY A 90 GLY.? 17.99 O1 EDO A 189 coo -30.51 33.83 43.05 -30.50 33.12 45.03 65.85 25.32 24.26 66.00 24.92 26.31 coo -25.73 33.05 39.28 -27.50 34.05 39.88 60.01 27.52 25.19 61.63 28.83 24.67 coo -27.66 47.32 40.66 -27.81 47.01 41.41 68.99 30.23 13.11 68.36 30.72 12.94 ULMN 3 1ddj_c15 PLASMINOGEN user 5 3 # 5 D 603 HIS A 154 HIS^? 17.90 CM MPD A 191 D 646 ASP A 151 ASP^? 20.35 CM MPD A 191 D 739 GLY A 119 GLY~? 20.44 CM MPD A 191 coo -30.51 33.83 43.05 -30.50 33.12 45.03 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -25.73 33.05 39.28 -27.50 34.05 39.88 48.38 -3.74 26.58 47.39 -3.82 24.70 coo -27.66 47.32 40.66 -27.81 47.01 41.41 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1ddj_c15 PLASMINOGEN user 6 3 # 6 D 603 HIS B 58 HIS.? 15.15 C2 EDO B 193 D 646 ASP B 56 ASP.? 14.25 C2 EDO B 193 D 739 GLY B 175 GLY.? -3.40 C1 EDO B 193s coo -30.51 33.83 43.05 -30.50 33.12 45.03 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -25.73 33.05 39.28 -27.50 34.05 39.88 45.79 20.82 -38.80 46.38 21.52 -40.72 coo -27.66 47.32 40.66 -27.81 47.01 41.41 39.99 28.43 -27.51 40.50 28.66 -26.90 ULMN 3 1ddj_c15 PLASMINOGEN user 7 3 # 7 D 603 HIS B 76 HIS^? 9.10 C1 EDO B 189 D 646 ASP B 87 ASP^? 16.44 C1 EDO B 189 D 739 GLY B 81 GLY.? 19.64 C2 EDO B 193 coo -30.51 33.83 43.05 -30.50 33.12 45.03 54.34 6.71 -25.28 55.69 7.78 -26.49 coo -25.73 33.05 39.28 -27.50 34.05 39.88 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo -27.66 47.32 40.66 -27.81 47.01 41.41 46.71 12.75 -37.37 46.59 12.01 -37.69 ULMN 3 1ddj_c15 PLASMINOGEN user 8 3 # 8 D 603 HIS B 84 HIS.? 24.24 O2 MPD B 194 D 646 ASP B 80 ASP.? 22.03 C1 EDO B 189 D 739 GLY B 88 GLY.? 12.78 C1 EDO B 189 coo -30.51 33.83 43.05 -30.50 33.12 45.03 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -25.73 33.05 39.28 -27.50 34.05 39.88 49.28 8.80 -38.48 47.34 8.18 -39.14 coo -27.66 47.32 40.66 -27.81 47.01 41.41 54.76 3.63 -27.59 54.55 2.90 -27.91 ULMN 3 1ddj_c15 PLASMINOGEN user 9 3 # 9 D 603 HIS B 84 HIS.? 24.24 O2 MPD B 194 D 646 ASP B 97 ASP~? 21.83 C3 MPD B 194 D 739 GLY B 90 GLY.? 18.17 C1 EDO B 189 coo -30.51 33.83 43.05 -30.50 33.12 45.03 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -25.73 33.05 39.28 -27.50 34.05 39.88 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -27.66 47.32 40.66 -27.81 47.01 41.41 54.47 0.76 -32.31 54.10 0.32 -31.77 ULMN 3 1ddj_c15 PLASMINOGEN user 10 3 # 10 D 603 HIS B 154 HIS^? 5.27 C1 EDO B 192 D 646 ASP B 151 ASP^? -3.26 O1 EDO B 192s D 739 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo -30.51 33.83 43.05 -30.50 33.12 45.03 29.58 31.84 -25.39 29.63 33.61 -24.25 coo -25.73 33.05 39.28 -27.50 34.05 39.88 29.45 33.81 -30.55 29.73 34.07 -28.42 coo -27.66 47.32 40.66 -27.81 47.01 41.41 37.07 25.75 -37.87 36.45 25.24 -37.59 1ddj_c15 source 1ddj PLASMINOGEN : 10 hits 1ddj_c15 naa= 3 ULMN 3 1de6_c00 L-RHAMNOSE ISOMERASE user 1 3 # 1 A 236 LYS A 74 LYS^? 9.41 O1 EDO A 189 A 270 HIS A 65 HIS^? 6.20 C1 EDO A 189 A 302 ASP A 48 ASP^? -5.54 C1 EDO A 189s coo 31.95 29.75 57.34 28.52 26.19 61.27 58.34 25.75 2.84 62.12 26.28 -2.26 coo 33.21 25.89 58.06 33.02 25.68 60.13 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 28.85 22.90 58.20 30.22 22.78 59.84 57.58 16.65 0.08 56.71 16.10 -1.78 1de6_c00 source 1de6 L-RHAMNOSE ISOMERASE : 1 hits 1de6_c00 naa= 3 ULMN 3 1de6_c02 L-RHAMNOSE ISOMERASE user 1 3 # 1 C 236 LYS A 74 LYS^? 9.41 O1 EDO A 189 C 270 HIS A 65 HIS^? 6.20 C1 EDO A 189 C 302 ASP A 48 ASP^? -5.54 C1 EDO A 189s coo 14.14 13.22 49.33 13.72 16.13 54.74 58.34 25.75 2.84 62.12 26.28 -2.26 coo 12.62 17.05 49.17 11.38 17.06 50.85 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 15.59 19.87 52.59 13.47 19.78 52.76 57.58 16.65 0.08 56.71 16.10 -1.78 1de6_c02 source 1de6 L-RHAMNOSE ISOMERASE : 1 hits 1de6_c02 naa= 3 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 123 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 200 ASP A 89 ASP.? 15.93 O1 EDO A 189 A 229 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 1.13 77.49 40.64 0.62 75.57 39.98 65.85 25.32 24.26 66.00 24.92 26.31 coo 0.84 91.24 49.01 2.91 91.61 49.23 67.25 32.32 9.27 66.30 32.35 7.40 coo 10.53 97.56 43.71 9.33 93.71 47.17 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 A 123 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 200 ASP B 89 ASP.? 15.59 O1 EDO B 189 A 229 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 1.13 77.49 40.64 0.62 75.57 39.98 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 0.84 91.24 49.01 2.91 91.61 49.23 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo 10.53 97.56 43.71 9.33 93.71 47.17 51.85 4.84 -17.64 57.80 3.80 -15.89 1dfo_c12 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 2 hits 1dfo_c12 naa= 3 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 123 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 200 ASP A 89 ASP.? 15.93 O1 EDO A 189 B 229 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 9.24 94.26 88.22 8.02 94.07 89.92 65.85 25.32 24.26 66.00 24.92 26.31 coo 17.54 90.31 75.01 17.17 92.01 73.80 67.25 32.32 9.27 66.30 32.35 7.40 coo 22.32 101.61 71.64 17.89 98.63 71.55 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 B 123 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 200 ASP B 89 ASP.? 15.59 O1 EDO B 189 B 229 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 9.24 94.26 88.22 8.02 94.07 89.92 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 17.54 90.31 75.01 17.17 92.01 73.80 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo 22.32 101.61 71.64 17.89 98.63 71.55 51.85 4.84 -17.64 57.80 3.80 -15.89 1dfo_c13 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 2 hits 1dfo_c13 naa= 3 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 123 HIS A 84 HIS.? 23.86 O4 MPD A 191 C 200 ASP A 89 ASP.? 15.93 O1 EDO A 189 C 229 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 26.77 65.84 83.49 27.06 67.76 84.27 65.85 25.32 24.26 66.00 24.92 26.31 coo 19.52 52.01 79.59 20.28 51.65 77.65 67.25 32.32 9.27 66.30 32.35 7.40 coo 28.90 45.91 73.55 25.22 49.72 72.97 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 C 123 HIS B 84 HIS.? 24.24 O2 MPD B 194 C 200 ASP B 89 ASP.? 15.59 O1 EDO B 189 C 229 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 26.77 65.84 83.49 27.06 67.76 84.27 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 19.52 52.01 79.59 20.28 51.65 77.65 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo 28.90 45.91 73.55 25.22 49.72 72.97 51.85 4.84 -17.64 57.80 3.80 -15.89 1dfo_c14 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 2 hits 1dfo_c14 naa= 3 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 123 HIS A 84 HIS.? 23.86 O4 MPD A 191 D 200 ASP A 89 ASP.? 15.93 O1 EDO A 189 D 229 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo -10.90 48.74 53.41 -12.98 48.90 53.67 65.85 25.32 24.26 66.00 24.92 26.31 coo 4.60 52.95 52.50 5.57 51.29 53.40 67.25 32.32 9.27 66.30 32.35 7.40 coo 10.05 41.79 49.80 7.94 44.71 53.76 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 D 123 HIS B 84 HIS.? 24.24 O2 MPD B 194 D 200 ASP B 89 ASP.? 15.59 O1 EDO B 189 D 229 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo -10.90 48.74 53.41 -12.98 48.90 53.67 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 4.60 52.95 52.50 5.57 51.29 53.40 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo 10.05 41.79 49.80 7.94 44.71 53.76 51.85 4.84 -17.64 57.80 3.80 -15.89 1dfo_c15 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 2 hits 1dfo_c15 naa= 3 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 1 3 # 1 A 48 ALA A 62 ALA^? 8.76 O1 EDO A 189 A 52 HIS A 76 HIS^? 9.12 O1 EDO A 189 A 191 TRP A 53 TRP^? 14.51 C2 EDO A 189 coo 0.32 19.13 2.10 -0.45 20.12 1.22 62.10 18.98 10.31 60.83 19.17 11.13 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 65.00 24.12 7.67 66.83 23.12 7.94 coo -12.27 21.19 4.26 -8.94 21.66 2.22 64.80 9.35 15.81 62.74 9.19 12.46 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 2 3 # 2 A 48 ALA B 62 ALA^? 8.92 C1 EDO B 189 A 52 HIS B 76 HIS^? 9.10 C1 EDO B 189 A 191 TRP B 53 TRP^? 12.96 C2 EDO B 193 coo 0.32 19.13 2.10 -0.45 20.12 1.22 50.28 11.76 -25.69 48.75 11.59 -25.62 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 54.34 6.71 -25.28 55.69 7.78 -26.49 coo -12.27 21.19 4.26 -8.94 21.66 2.22 48.80 21.45 -31.66 49.10 21.58 -27.72 1dj1_c00 source 1dj1 CYTOCHROME C PEROXIDASE : 2 hits 1dj1_c00 naa= 3 ULMN 3 1dnp_c00 DNA PHOTOLYASE user 1 3 # 1 A 306 TRP A 105 TRP^? 5.54 C5 MPD A 191 A 359 TRP B 13 TRP.? 10.17 C5 MPD A 191 A 382 TRP B 9 TRP^? 13.11 O2 EDO A 190 coo 31.27 39.47 20.74 28.54 37.06 22.19 45.15 18.09 9.42 43.12 14.86 10.40 coo 30.66 36.51 25.88 33.61 35.64 28.35 41.35 11.54 7.77 41.53 14.66 5.39 coo 29.03 37.53 34.46 26.37 39.52 32.35 49.15 4.48 8.87 52.91 5.73 8.86 ULMN 3 1dnp_c00 DNA PHOTOLYASE user 2 3 # 2 A 306 TRP B 105 TRP^? 3.96 C1 EDO B 188 A 359 TRP A 13 TRP.? 7.37 O2 EDO B 188 A 382 TRP A 9 TRP^? 7.49 O2 EDO A 188 coo 31.27 39.47 20.74 28.54 37.06 22.19 37.28 12.07 -14.92 34.92 15.15 -14.25 coo 30.66 36.51 25.88 33.61 35.64 28.35 35.01 18.42 -11.27 36.57 15.33 -9.40 coo 29.03 37.53 34.46 26.37 39.52 32.35 40.33 25.82 -16.58 43.34 24.62 -18.77 1dnp_c00 source 1dnp DNA PHOTOLYASE : 2 hits 1dnp_c00 naa= 3 ULMN 3 1dnp_c01 DNA PHOTOLYASE user 1 3 # 1 B 306 TRP A 105 TRP^? 5.54 C5 MPD A 191 B 359 TRP B 13 TRP.? 10.17 C5 MPD A 191 B 382 TRP B 9 TRP^? 13.11 O2 EDO A 190 coo 46.11 60.68 29.45 45.44 64.17 31.12 45.15 18.09 9.42 43.12 14.86 10.40 coo 42.23 65.07 28.50 40.25 65.66 25.15 41.35 11.54 7.77 41.53 14.66 5.39 coo 33.75 67.27 29.24 35.04 65.70 32.64 49.15 4.48 8.87 52.91 5.73 8.86 ULMN 3 1dnp_c01 DNA PHOTOLYASE user 2 3 # 2 B 306 TRP B 105 TRP^? 3.96 C1 EDO B 188 B 359 TRP A 13 TRP.? 7.37 O2 EDO B 188 B 382 TRP A 9 TRP^? 7.49 O2 EDO A 188 coo 46.11 60.68 29.45 45.44 64.17 31.12 37.28 12.07 -14.92 34.92 15.15 -14.25 coo 42.23 65.07 28.50 40.25 65.66 25.15 35.01 18.42 -11.27 36.57 15.33 -9.40 coo 33.75 67.27 29.24 35.04 65.70 32.64 40.33 25.82 -16.58 43.34 24.62 -18.77 1dnp_c01 source 1dnp DNA PHOTOLYASE : 2 hits 1dnp_c01 naa= 3 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 # 1 E 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 E 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 E 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 11.39 26.86 25.95 9.85 26.64 27.36 64.74 13.84 22.58 64.60 13.48 24.65 coo 10.90 32.83 25.96 10.83 30.68 25.98 68.86 12.45 19.04 67.57 12.48 20.71 coo 4.57 20.60 30.29 4.74 21.36 30.66 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 2 3 # 2 E 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 E 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 E 193 GLY A 119 GLY~? 20.44 CM MPD A 191 coo 11.39 26.86 25.95 9.85 26.64 27.36 64.74 13.84 22.58 64.60 13.48 24.65 coo 10.90 32.83 25.96 10.83 30.68 25.98 68.86 12.45 19.04 67.57 12.48 20.71 coo 4.57 20.60 30.29 4.74 21.36 30.66 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 3 3 # 3 E 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 E 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 E 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 11.39 26.86 25.95 9.85 26.64 27.36 64.74 13.84 22.58 64.60 13.48 24.65 coo 10.90 32.83 25.96 10.83 30.68 25.98 66.73 9.65 23.28 68.51 8.93 24.16 coo 4.57 20.60 30.29 4.74 21.36 30.66 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 4 3 # 4 E 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 E 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 E 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 11.39 26.86 25.95 9.85 26.64 27.36 64.74 13.84 22.58 64.60 13.48 24.65 coo 10.90 32.83 25.96 10.83 30.68 25.98 66.73 9.65 23.28 68.51 8.93 24.16 coo 4.57 20.60 30.29 4.74 21.36 30.66 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 5 3 # 5 E 57 HIS A 65 HIS^? 6.20 C1 EDO A 189 E 102 ASP A 48 ASP^? -5.54 C1 EDO A 189s E 193 GLY A 71 GLY^? 15.15 O2 EDO A 188 coo 11.39 26.86 25.95 9.85 26.64 27.36 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 10.90 32.83 25.96 10.83 30.68 25.98 57.58 16.65 0.08 56.71 16.10 -1.78 coo 4.57 20.60 30.29 4.74 21.36 30.66 51.64 28.27 -4.12 51.34 27.67 -3.59 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 6 3 # 6 E 57 HIS A 154 HIS^? 17.90 CM MPD A 191 E 102 ASP A 151 ASP^? 20.35 CM MPD A 191 E 193 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo 11.39 26.86 25.95 9.85 26.64 27.36 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 10.90 32.83 25.96 10.83 30.68 25.98 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 4.57 20.60 30.29 4.74 21.36 30.66 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 7 3 # 7 E 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 E 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 E 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 11.39 26.86 25.95 9.85 26.64 27.36 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 10.90 32.83 25.96 10.83 30.68 25.98 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 4.57 20.60 30.29 4.74 21.36 30.66 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 8 3 # 8 E 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 E 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 E 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 11.39 26.86 25.95 9.85 26.64 27.36 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 10.90 32.83 25.96 10.83 30.68 25.98 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 4.57 20.60 30.29 4.74 21.36 30.66 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 9 3 # 9 E 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 E 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 E 193 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 11.39 26.86 25.95 9.85 26.64 27.36 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 10.90 32.83 25.96 10.83 30.68 25.98 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 4.57 20.60 30.29 4.74 21.36 30.66 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 10 3 # 10 E 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 E 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 E 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 11.39 26.86 25.95 9.85 26.64 27.36 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 10.90 32.83 25.96 10.83 30.68 25.98 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 4.57 20.60 30.29 4.74 21.36 30.66 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 11 3 # 11 E 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 E 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 E 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 11.39 26.86 25.95 9.85 26.64 27.36 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 10.90 32.83 25.96 10.83 30.68 25.98 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 4.57 20.60 30.29 4.74 21.36 30.66 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 12 3 # 12 E 57 HIS B 65 HIS^? -5.26 O1 EDO B 189s E 102 ASP B 48 ASP^? 5.72 O1 EDO B 189 E 193 GLY B 71 GLY^? 6.08 O1 EDO A 190 coo 11.39 26.86 25.95 9.85 26.64 27.36 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 10.90 32.83 25.96 10.83 30.68 25.98 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 4.57 20.60 30.29 4.74 21.36 30.66 50.84 2.27 -7.92 50.26 2.83 -8.18 1ds2_c02 source 1ds2 PROTEINASE B (SGPB : 12 hits 1ds2_c02 naa= 3 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 132 TYR^? -3.92 O4 MPD A 191s A 40 ASP A 101 ASP^? 14.06 CM MPD A 191 A 103 ASP A 103 ASP^? 5.49 CM MPD A 191 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 48.86 20.67 16.01 46.69 20.01 14.37 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 57.05 15.04 20.11 57.86 14.10 21.77 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 51.58 16.40 16.66 49.70 15.49 16.18 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR A 147 TYR^? 9.49 CM MPD A 191 A 40 ASP A 103 ASP^? 5.49 CM MPD A 191 A 103 ASP A 101 ASP^? 14.06 CM MPD A 191 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 50.88 9.76 23.94 51.01 10.64 21.28 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 51.58 16.40 16.66 49.70 15.49 16.18 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 3 3 # 3 A 16 TYR A 157 TYR^? -4.51 CM MPD A 191s A 40 ASP A 101 ASP^? 14.06 CM MPD A 191 A 103 ASP A 103 ASP^? 5.49 CM MPD A 191 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 46.12 11.16 21.21 46.22 13.94 20.83 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 57.05 15.04 20.11 57.86 14.10 21.77 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 51.58 16.40 16.66 49.70 15.49 16.18 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 4 3 # 4 A 16 TYR B 147 TYR^? 9.73 O2 MPD B 194 A 40 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 103 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 5 3 # 5 A 16 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 40 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 103 ASP B 103 ASP^? 5.57 C5 MPD B 194 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 37.95 13.84 -24.45 36.74 14.66 -22.84 1e3v_c02 source 1e3v STEROID DELTA-ISOMERASE : 5 hits 1e3v_c02 naa= 3 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 132 TYR^? -3.92 O4 MPD A 191s B 40 ASP A 101 ASP^? 14.06 CM MPD A 191 B 103 ASP A 103 ASP^? 5.49 CM MPD A 191 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 48.86 20.67 16.01 46.69 20.01 14.37 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 57.05 15.04 20.11 57.86 14.10 21.77 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 51.58 16.40 16.66 49.70 15.49 16.18 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR A 147 TYR^? 9.49 CM MPD A 191 B 40 ASP A 103 ASP^? 5.49 CM MPD A 191 B 103 ASP A 101 ASP^? 14.06 CM MPD A 191 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 50.88 9.76 23.94 51.01 10.64 21.28 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 51.58 16.40 16.66 49.70 15.49 16.18 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 3 3 # 3 B 16 TYR A 157 TYR^? -4.51 CM MPD A 191s B 40 ASP A 101 ASP^? 14.06 CM MPD A 191 B 103 ASP A 103 ASP^? 5.49 CM MPD A 191 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 46.12 11.16 21.21 46.22 13.94 20.83 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 57.05 15.04 20.11 57.86 14.10 21.77 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 51.58 16.40 16.66 49.70 15.49 16.18 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 4 3 # 4 B 16 TYR B 147 TYR^? 9.73 O2 MPD B 194 B 40 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 103 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 5 3 # 5 B 16 TYR B 157 TYR^? -4.69 O2 MPD B 194s B 40 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 103 ASP B 103 ASP^? 5.57 C5 MPD B 194 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 37.95 13.84 -24.45 36.74 14.66 -22.84 1e3v_c03 source 1e3v STEROID DELTA-ISOMERASE : 5 hits 1e3v_c03 naa= 3 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 1 3 # 1 A 107 ALA A 146 ALA^? 9.66 O2 MPD A 191 A 136 TYR A 157 TYR^? -4.51 CM MPD A 191s A 140 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 55.90 7.49 23.83 56.71 8.23 22.76 48.53 13.09 26.87 47.62 13.02 28.09 coo 59.38 10.02 17.51 59.95 9.89 20.21 46.12 11.16 21.21 46.22 13.94 20.83 coo 59.52 3.69 18.67 62.31 6.19 22.58 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 2 3 # 2 A 107 ALA B 146 ALA^? 9.91 O2 MPD B 194 A 136 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 140 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 55.90 7.49 23.83 56.71 8.23 22.76 29.33 17.08 -30.73 27.86 17.06 -31.19 coo 59.38 10.02 17.51 59.95 9.89 20.21 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 59.52 3.69 18.67 62.31 6.19 22.58 25.14 19.21 -22.67 21.76 17.11 -26.55 1e7q_c01 source 1e7q GDP-FUCOSE SYNTHETASE : 2 hits 1e7q_c01 naa= 3 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 # 1 A 32 ASP A 151 ASP^? 20.35 CM MPD A 191 A 35 SER A 153 SER.? 20.01 CM MPD A 191 A 218 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 47.22 22.34 8.57 45.16 22.02 9.13 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 43.58 20.85 5.15 44.62 23.01 5.76 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 44.05 16.99 12.67 44.05 18.89 11.74 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 2 3 # 2 A 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 35 SER B 153 SER.? -3.11 C2 EDO B 192s A 218 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 47.22 22.34 8.57 45.16 22.02 9.13 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 43.58 20.85 5.15 44.62 23.01 5.76 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 44.05 16.99 12.67 44.05 18.89 11.74 28.45 32.01 -35.99 29.78 33.29 -34.96 1eag_c04 source 1eag PEPTIDE INHIBITOR : 2 hits 1eag_c04 naa= 3 ULMN 3 1ecx_c02 AMINOTRANSFERASE user 1 3 # 1 A 99 HIS A 154 HIS^? 17.90 CM MPD A 191 A 177 ASP A 179 ASP^? 16.86 CM MPD A 191 A 203 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 8.74 45.76 47.19 9.33 46.93 45.56 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 11.68 42.31 52.96 12.05 43.92 51.65 43.85 0.70 13.63 43.61 -0.87 12.28 coo 18.07 52.81 49.62 14.17 49.99 48.07 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ecx_c02 AMINOTRANSFERASE user 2 3 # 2 A 99 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 177 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 203 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 8.74 45.76 47.19 9.33 46.93 45.56 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 11.68 42.31 52.96 12.05 43.92 51.65 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 18.07 52.81 49.62 14.17 49.99 48.07 25.14 19.21 -22.67 21.76 17.11 -26.55 1ecx_c02 source 1ecx AMINOTRANSFERASE : 2 hits 1ecx_c02 naa= 3 ULMN 3 1ecx_c03 AMINOTRANSFERASE user 1 3 # 1 B 99 HIS A 154 HIS^? 17.90 CM MPD A 191 B 177 ASP A 179 ASP^? 16.86 CM MPD A 191 B 203 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 14.87 88.04 21.51 13.64 87.90 19.81 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 15.87 92.46 27.37 14.46 91.76 25.94 43.85 0.70 13.63 43.61 -0.87 12.28 coo 3.60 91.42 23.52 8.20 89.55 22.63 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ecx_c03 AMINOTRANSFERASE user 2 3 # 2 B 99 HIS B 154 HIS^? 5.27 C1 EDO B 192 B 177 ASP B 179 ASP^? 11.34 O2 EDO A 188 B 203 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 14.87 88.04 21.51 13.64 87.90 19.81 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 15.87 92.46 27.37 14.46 91.76 25.94 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 3.60 91.42 23.52 8.20 89.55 22.63 25.14 19.21 -22.67 21.76 17.11 -26.55 1ecx_c03 source 1ecx AMINOTRANSFERASE : 2 hits 1ecx_c03 naa= 3 ULMN 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 1 3 # 1 P 32 ASP A 151 ASP^? 20.35 CM MPD A 191 P 35 SER A 153 SER.? 20.01 CM MPD A 191 P 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 10.15 33.41 11.98 7.98 33.66 12.07 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 7.57 37.60 10.00 8.86 37.02 12.03 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 4.04 29.97 8.82 4.78 31.15 10.46 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 2 3 # 2 P 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s P 35 SER B 153 SER.? -3.11 C2 EDO B 192s P 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 10.15 33.41 11.98 7.98 33.66 12.07 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 7.57 37.60 10.00 8.86 37.02 12.03 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 4.04 29.97 8.82 4.78 31.15 10.46 28.45 32.01 -35.99 29.78 33.29 -34.96 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 151 ASP^? 20.35 CM MPD A 191 A 246 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 275 HIS A 154 HIS^? 17.90 CM MPD A 191 coo 28.44 37.56 46.79 26.87 37.11 48.10 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 22.84 50.35 52.24 23.24 48.32 52.90 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 26.67 42.94 48.26 27.49 41.07 48.73 45.67 -1.54 22.26 44.90 -3.17 21.19 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 A 107 ASP A 151 ASP^? 20.35 CM MPD A 191 A 246 ASP A 179 ASP^? 16.86 CM MPD A 191 A 275 HIS A 154 HIS^? 17.90 CM MPD A 191 coo 28.44 37.56 46.79 26.87 37.11 48.10 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 22.84 50.35 52.24 23.24 48.32 52.90 43.85 0.70 13.63 43.61 -0.87 12.28 coo 26.67 42.94 48.26 27.49 41.07 48.73 45.67 -1.54 22.26 44.90 -3.17 21.19 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 A 107 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 246 ASP B 172 ASP.? 7.16 C1 EDO B 193 A 275 HIS B 154 HIS^? 5.27 C1 EDO B 192 coo 28.44 37.56 46.79 26.87 37.11 48.10 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 22.84 50.35 52.24 23.24 48.32 52.90 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 26.67 42.94 48.26 27.49 41.07 48.73 29.58 31.84 -25.39 29.63 33.61 -24.25 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 4 3 # 4 A 107 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 246 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 275 HIS B 154 HIS^? 5.27 C1 EDO B 192 coo 28.44 37.56 46.79 26.87 37.11 48.10 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 22.84 50.35 52.24 23.24 48.32 52.90 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 26.67 42.94 48.26 27.49 41.07 48.73 29.58 31.84 -25.39 29.63 33.61 -24.25 1ehy_c00 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 4 hits 1ehy_c00 naa= 3 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 B 107 ASP A 87 ASP^? 16.43 O1 EDO A 189 B 246 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 275 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 34.84 56.77 81.62 34.95 54.74 82.03 63.41 29.58 11.55 64.59 31.41 11.51 coo 43.18 49.30 68.39 44.75 49.87 69.78 57.58 16.65 0.08 56.71 16.10 -1.78 coo 38.73 55.10 77.62 36.80 55.01 78.46 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 B 107 ASP B 87 ASP^? 16.44 C1 EDO B 189 B 246 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 275 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 34.84 56.77 81.62 34.95 54.74 82.03 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 43.18 49.30 68.39 44.75 49.87 69.78 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 38.73 55.10 77.62 36.80 55.01 78.46 54.34 6.71 -25.28 55.69 7.78 -26.49 1ehy_c01 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 2 hits 1ehy_c01 naa= 3 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 C 107 ASP A 87 ASP^? 16.43 O1 EDO A 189 C 246 ASP A 48 ASP^? -5.54 C1 EDO A 189s C 275 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 1.90 35.26 72.76 3.20 35.74 71.18 63.41 29.58 11.55 64.59 31.41 11.51 coo 12.03 20.33 71.56 10.48 19.25 70.56 57.58 16.65 0.08 56.71 16.10 -1.78 coo 3.92 29.96 71.75 4.22 31.96 72.31 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 C 107 ASP A 97 ASP~? 21.13 O4 MPD A 191 C 246 ASP A 54 ASP.? 20.27 C2 EDO A 189 C 275 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 1.90 35.26 72.76 3.20 35.74 71.18 60.01 27.52 25.19 61.63 28.83 24.67 coo 12.03 20.33 71.56 10.48 19.25 70.56 68.86 12.45 19.04 67.57 12.48 20.71 coo 3.92 29.96 71.75 4.22 31.96 72.31 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 C 107 ASP B 87 ASP^? 16.44 C1 EDO B 189 C 246 ASP B 48 ASP^? 5.72 O1 EDO B 189 C 275 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 1.90 35.26 72.76 3.20 35.74 71.18 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 12.03 20.33 71.56 10.48 19.25 70.56 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 3.92 29.96 71.75 4.22 31.96 72.31 54.34 6.71 -25.28 55.69 7.78 -26.49 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 4 3 # 4 C 107 ASP B 97 ASP~? 21.83 C3 MPD B 194 C 246 ASP B 54 ASP.? 15.81 C2 EDO B 193 C 275 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 1.90 35.26 72.76 3.20 35.74 71.18 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 12.03 20.33 71.56 10.48 19.25 70.56 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 3.92 29.96 71.75 4.22 31.96 72.31 45.35 5.36 -39.37 44.27 5.71 -41.13 1ehy_c02 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 4 hits 1ehy_c02 naa= 3 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 D 107 ASP A 87 ASP^? 16.43 O1 EDO A 189 D 246 ASP A 48 ASP^? -5.54 C1 EDO A 189s D 275 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 37.41 19.89 81.58 37.64 21.98 81.53 63.41 29.58 11.55 64.59 31.41 11.51 coo 23.50 26.43 88.52 24.76 26.47 90.29 57.58 16.65 0.08 56.71 16.10 -1.78 coo 33.16 21.44 85.29 34.07 21.53 83.40 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 D 107 ASP B 87 ASP^? 16.44 C1 EDO B 189 D 246 ASP B 48 ASP^? 5.72 O1 EDO B 189 D 275 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 37.41 19.89 81.58 37.64 21.98 81.53 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 23.50 26.43 88.52 24.76 26.47 90.29 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 33.16 21.44 85.29 34.07 21.53 83.40 54.34 6.71 -25.28 55.69 7.78 -26.49 1ehy_c03 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 2 hits 1ehy_c03 naa= 3 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 1 3 # 1 A 114 HIS A 154 HIS^? 17.90 CM MPD A 191 A 197 ASP A 179 ASP^? 16.86 CM MPD A 191 A 223 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 43.85 0.70 13.63 43.61 -0.87 12.28 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 2 3 # 2 A 114 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 197 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 223 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 29.58 31.84 -25.39 29.63 33.61 -24.25 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 25.14 19.21 -22.67 21.76 17.11 -26.55 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 154 HIS^? 17.90 CM MPD A 191 B 197 ASP A 179 ASP^? 16.86 CM MPD A 191 B 223 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 43.85 0.70 13.63 43.61 -0.87 12.28 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1elq_c03 L-CYSTEINE/L-CYSTINE C-S LYASE user 2 3 # 2 B 114 HIS B 154 HIS^? 5.27 C1 EDO B 192 B 197 ASP B 179 ASP^? 11.34 O2 EDO A 188 B 223 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 29.58 31.84 -25.39 29.63 33.61 -24.25 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 25.14 19.21 -22.67 21.76 17.11 -26.55 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 80 ASP.? 21.91 O1 EDO A 189 153 ARG A 60 ARG^? 18.80 O1 EDO A 189 177 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 6.83 2.75 19.17 7.40 0.75 19.11 68.63 22.07 21.16 67.50 22.56 22.86 coo 1.78 0.50 17.43 2.55 -2.31 16.44 67.94 16.79 18.42 70.70 18.25 18.48 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 2 3 # 2 150 ASP A 80 ASP.? 21.91 O1 EDO A 189 153 ARG A 82 ARG.? 24.76 O1 EDO A 189 177 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 6.83 2.75 19.17 7.40 0.75 19.11 68.63 22.07 21.16 67.50 22.56 22.86 coo 1.78 0.50 17.43 2.55 -2.31 16.44 69.47 19.71 26.08 71.03 22.01 24.70 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 3 3 # 3 150 ASP A 151 ASP^? 20.35 CM MPD A 191 153 ARG A 149 ARG^? 22.01 CM MPD A 191 177 HIS A 154 HIS^? 17.90 CM MPD A 191 coo 6.83 2.75 19.17 7.40 0.75 19.11 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 1.78 0.50 17.43 2.55 -2.31 16.44 53.15 0.69 27.47 54.83 -1.87 27.18 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 45.67 -1.54 22.26 44.90 -3.17 21.19 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 4 3 # 4 150 ASP B 80 ASP.? 22.03 C1 EDO B 189 153 ARG B 60 ARG^? 18.79 C1 EDO B 189 177 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 6.83 2.75 19.17 7.40 0.75 19.11 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 1.78 0.50 17.43 2.55 -2.31 16.44 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 45.35 5.36 -39.37 44.27 5.71 -41.13 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 5 3 # 5 150 ASP B 80 ASP.? 22.03 C1 EDO B 189 153 ARG B 82 ARG.? 22.52 O2 EDO B 193 177 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 6.83 2.75 19.17 7.40 0.75 19.11 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 1.78 0.50 17.43 2.55 -2.31 16.44 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 45.35 5.36 -39.37 44.27 5.71 -41.13 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 6 3 # 6 150 ASP B 151 ASP^? -3.26 O1 EDO B 192s 153 ARG B 149 ARG^? 5.09 O2 EDO B 193 177 HIS B 154 HIS^? 5.27 C1 EDO B 192 coo 6.83 2.75 19.17 7.40 0.75 19.11 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 1.78 0.50 17.43 2.55 -2.31 16.44 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 29.58 31.84 -25.39 29.63 33.61 -24.25 1emd_c01 source 1emd MALATE DEHYDROGENASE (E.C.1.1.1.37) : 6 hits 1emd_c01 naa= 3 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 # 1 A 229 ALA A 135 ALA.? 11.13 C5 MPD A 191 A 257 ALA A 137 ALA.? 12.86 O4 MPD A 191 A 328 ASP A 38 ASP.? 14.66 C5 MPD A 191 coo 39.84 24.12 8.44 38.50 24.23 9.11 48.96 21.01 6.70 49.44 19.78 5.90 coo 43.22 26.73 5.37 41.81 27.09 5.79 49.24 26.05 6.15 48.26 26.83 6.95 coo 38.17 34.10 6.67 37.72 32.06 6.84 42.66 22.43 1.00 42.54 24.24 2.16 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 # 2 A 229 ALA A 137 ALA.? 12.86 O4 MPD A 191 A 257 ALA A 135 ALA.? 11.13 C5 MPD A 191 A 328 ASP A 38 ASP.? 14.66 C5 MPD A 191 coo 39.84 24.12 8.44 38.50 24.23 9.11 49.24 26.05 6.15 48.26 26.83 6.95 coo 43.22 26.73 5.37 41.81 27.09 5.79 48.96 21.01 6.70 49.44 19.78 5.90 coo 38.17 34.10 6.67 37.72 32.06 6.84 42.66 22.43 1.00 42.54 24.24 2.16 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 # 3 A 229 ALA B 126 ALA^? 13.52 O2 EDO B 193 A 257 ALA B 146 ALA^? 9.91 O2 MPD B 194 A 328 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 39.84 24.12 8.44 38.50 24.23 9.11 29.97 18.92 -35.95 31.38 19.24 -36.38 coo 43.22 26.73 5.37 41.81 27.09 5.79 29.33 17.08 -30.73 27.86 17.06 -31.19 coo 38.17 34.10 6.67 37.72 32.06 6.84 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 # 4 A 229 ALA B 135 ALA.? 9.12 C2 EDO B 188 A 257 ALA B 137 ALA.? 6.78 O2 EDO B 191 A 328 ASP B 38 ASP.? -2.58 O1 EDO B 191s coo 39.84 24.12 8.44 38.50 24.23 9.11 41.94 9.33 -15.05 42.81 10.57 -14.76 coo 43.22 26.73 5.37 41.81 27.09 5.79 42.66 4.25 -14.83 41.35 3.51 -14.95 coo 38.17 34.10 6.67 37.72 32.06 6.84 40.43 7.67 -6.71 39.74 5.84 -7.58 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 5 3 # 5 A 229 ALA B 137 ALA.? 6.78 O2 EDO B 191 A 257 ALA B 135 ALA.? 9.12 C2 EDO B 188 A 328 ASP B 38 ASP.? -2.58 O1 EDO B 191s coo 39.84 24.12 8.44 38.50 24.23 9.11 42.66 4.25 -14.83 41.35 3.51 -14.95 coo 43.22 26.73 5.37 41.81 27.09 5.79 41.94 9.33 -15.05 42.81 10.57 -14.76 coo 38.17 34.10 6.67 37.72 32.06 6.84 40.43 7.67 -6.71 39.74 5.84 -7.58 1eo7_c00 source 1eo7 CYCLODEXTRIN GLYCOSYLTRANSFERASE : 5 hits 1eo7_c00 naa= 3 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 159 LYS A 74 LYS^? 9.41 O1 EDO A 189 A 193 GLU A 61 GLU^? 10.22 O1 EDO A 189 A 217 VAL A 63 VAL^? -4.52 O1 EDO A 189s coo 2.10 10.68 61.44 -2.14 13.16 60.61 58.34 25.75 2.84 62.12 26.28 -2.26 coo -5.33 11.71 69.72 -4.62 11.92 67.73 66.46 19.59 10.29 68.35 19.61 9.28 coo 0.07 12.29 66.53 -0.24 11.95 64.38 61.76 20.12 6.66 63.59 20.32 5.47 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 2 3 # 2 A 159 LYS B 74 LYS^? 9.11 O1 EDO B 189 A 193 GLU B 61 GLU^? 10.17 C1 EDO B 189 A 217 VAL B 63 VAL^? 4.70 C1 EDO B 189 coo 2.10 10.68 61.44 -2.14 13.16 60.61 51.85 4.84 -17.64 57.80 3.80 -15.89 coo -5.33 11.71 69.72 -4.62 11.92 67.73 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 0.07 12.29 66.53 -0.24 11.95 64.38 52.18 10.61 -22.65 54.36 10.43 -22.77 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 148 THR^? 14.42 O2 MPD A 191 A 159 LYS A 166 LYS^? 9.67 O2 MPD A 191 A 193 GLU A 161 GLU.? 9.37 O2 MPD A 191 coo -2.58 16.31 54.79 -4.02 14.93 55.64 48.73 6.54 28.33 47.39 6.78 29.99 coo 2.10 10.68 61.44 -2.14 13.16 60.61 40.42 10.96 22.74 39.85 13.02 27.76 coo -5.33 11.71 69.72 -4.62 11.92 67.73 45.67 22.34 23.77 46.84 23.71 24.88 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 2 3 # 2 A 38 THR B 148 THR^? 13.69 O2 EDO B 193 A 159 LYS B 166 LYS^? 10.40 O2 MPD B 194 A 193 GLU B 161 GLU.? 9.05 O2 MPD B 194 coo -2.58 16.31 54.79 -4.02 14.93 55.64 28.54 23.73 -31.92 26.40 23.60 -32.23 coo 2.10 10.68 61.44 -2.14 13.16 60.61 25.14 19.21 -22.67 21.76 17.11 -26.55 coo -5.33 11.71 69.72 -4.62 11.92 67.73 28.86 7.94 -26.27 29.12 6.39 -27.73 1et0_c02 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 2 hits 1et0_c02 naa= 3 ULMN 3 1eyi_c00 FRUCTOSE-1,6-BISPHOSPHATASE user 1 3 # 1 A 68 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 74 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 98 GLU A 26 GLU.? 10.86 O2 EDO A 189 coo 17.19 9.05 25.28 15.77 9.98 26.53 68.29 3.95 12.18 68.54 1.87 11.74 coo 15.99 8.54 17.36 14.96 7.80 19.05 64.75 2.11 3.69 66.46 3.28 4.11 coo 16.31 12.85 18.11 16.71 11.79 19.90 66.27 6.09 6.28 67.77 7.37 5.57 ULMN 3 1eyi_c00 FRUCTOSE-1,6-BISPHOSPHATASE user 2 3 # 2 A 68 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 74 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 98 GLU B 26 GLU.? 11.31 O2 EDO B 189 coo 17.19 9.05 25.28 15.77 9.98 26.53 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 15.99 8.54 17.36 14.96 7.80 19.05 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 16.31 12.85 18.11 16.71 11.79 19.90 55.48 25.40 -24.73 57.31 24.35 -24.78 1eyi_c00 source 1eyi FRUCTOSE-1,6-BISPHOSPHATASE : 2 hits 1eyi_c00 naa= 3 ULMN 3 1ez2_c00 PHOSPHOTRIESTERASE user 1 3 # 1 A 233 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 254 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 301 ASP A 97 ASP~? 21.13 O4 MPD A 191 coo 54.85 -0.50 33.94 53.35 -1.92 34.23 68.63 22.07 21.16 67.50 22.56 22.86 coo 49.60 -2.04 34.84 49.44 -3.48 33.35 65.85 25.32 24.26 66.00 24.92 26.31 coo 45.28 -3.05 33.32 45.60 -4.40 31.72 60.01 27.52 25.19 61.63 28.83 24.67 ULMN 3 1ez2_c00 PHOSPHOTRIESTERASE user 2 3 # 2 A 233 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 254 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 301 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 54.85 -0.50 33.94 53.35 -1.92 34.23 60.01 27.52 25.19 61.63 28.83 24.67 coo 49.60 -2.04 34.84 49.44 -3.48 33.35 65.85 25.32 24.26 66.00 24.92 26.31 coo 45.28 -3.05 33.32 45.60 -4.40 31.72 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1ez2_c00 PHOSPHOTRIESTERASE user 3 3 # 3 A 233 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 254 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 301 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 54.85 -0.50 33.94 53.35 -1.92 34.23 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 49.60 -2.04 34.84 49.44 -3.48 33.35 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 45.28 -3.05 33.32 45.60 -4.40 31.72 49.28 8.80 -38.48 47.34 8.18 -39.14 1ez2_c00 source 1ez2 PHOSPHOTRIESTERASE : 3 hits 1ez2_c00 naa= 3 ULMN 3 1ez2_c01 PHOSPHOTRIESTERASE user 1 3 # 1 B 233 ASP A 80 ASP.? 21.91 O1 EDO A 189 B 254 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 301 ASP A 97 ASP~? 21.13 O4 MPD A 191 coo 56.25 -34.15 2.23 54.65 -32.85 1.82 68.63 22.07 21.16 67.50 22.56 22.86 coo 50.90 -32.78 1.00 50.77 -31.41 2.56 65.85 25.32 24.26 66.00 24.92 26.31 coo 46.50 -31.79 2.21 46.79 -30.43 3.83 60.01 27.52 25.19 61.63 28.83 24.67 ULMN 3 1ez2_c01 PHOSPHOTRIESTERASE user 2 3 # 2 B 233 ASP A 97 ASP~? 21.13 O4 MPD A 191 B 254 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 301 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 56.25 -34.15 2.23 54.65 -32.85 1.82 60.01 27.52 25.19 61.63 28.83 24.67 coo 50.90 -32.78 1.00 50.77 -31.41 2.56 65.85 25.32 24.26 66.00 24.92 26.31 coo 46.50 -31.79 2.21 46.79 -30.43 3.83 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1ez2_c01 PHOSPHOTRIESTERASE user 3 3 # 3 B 233 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 254 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 301 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 56.25 -34.15 2.23 54.65 -32.85 1.82 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 50.90 -32.78 1.00 50.77 -31.41 2.56 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 46.50 -31.79 2.21 46.79 -30.43 3.83 49.28 8.80 -38.48 47.34 8.18 -39.14 1ez2_c01 source 1ez2 PHOSPHOTRIESTERASE : 3 hits 1ez2_c01 naa= 3 ULMN 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 1 3 # 1 C 95 ASP A 38 ASP.? 14.66 C5 MPD A 191 C 117 GLU A 69 GLU.? 15.47 O2 EDO A 188 C 131 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 68.01 56.37 72.57 68.42 56.10 70.51 42.66 22.43 1.00 42.54 24.24 2.16 coo 66.59 62.50 67.44 67.57 60.64 67.12 44.88 26.70 -3.49 42.93 26.42 -2.77 coo 69.24 52.27 71.96 69.91 50.26 71.89 40.24 18.97 5.60 41.21 18.63 7.48 1f6d_c02 source 1f6d UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE : 1 hits 1f6d_c02 naa= 3 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 1 3 # 1 A 105 HIS A 154 HIS^? 17.90 CM MPD A 191 C 62 LYS A 166 LYS^? 9.67 O2 MPD A 191 F 35 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 15.40 22.79 16.66 13.93 24.10 15.98 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 19.95 18.98 4.81 18.82 20.94 10.49 40.42 10.96 22.74 39.85 13.02 27.76 coo 16.32 15.30 17.19 17.71 14.73 18.69 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 2 3 # 2 A 105 HIS B 154 HIS^? 5.27 C1 EDO B 192 C 62 LYS B 166 LYS^? 10.40 O2 MPD B 194 F 35 ASP B 179 ASP^? 11.34 O2 EDO A 188 coo 15.40 22.79 16.66 13.93 24.10 15.98 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 19.95 18.98 4.81 18.82 20.94 10.49 25.14 19.21 -22.67 21.76 17.11 -26.55 coo 16.32 15.30 17.19 17.71 14.73 18.69 33.06 29.40 -17.37 33.45 31.08 -16.20 1f80_c03 source 1f80 ACYL CARRIER PROTEIN : 2 hits 1f80_c03 naa= 3 ULMN 3 1f80_c04 ACYL CARRIER PROTEIN user 1 3 # 1 B 62 LYS A 166 LYS^? 9.67 O2 MPD A 191 C 105 HIS A 154 HIS^? 17.90 CM MPD A 191 D 35 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 38.76 28.25 7.87 36.33 26.41 13.58 40.42 10.96 22.74 39.85 13.02 27.76 coo 34.93 19.72 17.37 34.72 18.17 15.98 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 41.01 23.02 20.83 40.65 24.26 22.55 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1f80_c04 ACYL CARRIER PROTEIN user 2 3 # 2 B 62 LYS B 166 LYS^? 10.40 O2 MPD B 194 C 105 HIS B 154 HIS^? 5.27 C1 EDO B 192 D 35 ASP B 179 ASP^? 11.34 O2 EDO A 188 coo 38.76 28.25 7.87 36.33 26.41 13.58 25.14 19.21 -22.67 21.76 17.11 -26.55 coo 34.93 19.72 17.37 34.72 18.17 15.98 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 41.01 23.02 20.83 40.65 24.26 22.55 33.06 29.40 -17.37 33.45 31.08 -16.20 1f80_c04 source 1f80 ACYL CARRIER PROTEIN : 2 hits 1f80_c04 naa= 3 ULMN 3 1f80_c05 ACYL CARRIER PROTEIN user 1 3 # 1 A 62 LYS A 166 LYS^? 9.67 O2 MPD A 191 B 105 HIS A 154 HIS^? 17.90 CM MPD A 191 E 35 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 20.51 39.76 8.83 21.23 37.38 14.18 40.42 10.96 22.74 39.85 13.02 27.76 coo 27.18 37.56 20.68 29.07 38.28 20.13 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 19.97 40.39 22.03 18.53 39.30 23.18 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1f80_c05 ACYL CARRIER PROTEIN user 2 3 # 2 A 62 LYS B 166 LYS^? 10.40 O2 MPD B 194 B 105 HIS B 154 HIS^? 5.27 C1 EDO B 192 E 35 ASP B 179 ASP^? 11.34 O2 EDO A 188 coo 20.51 39.76 8.83 21.23 37.38 14.18 25.14 19.21 -22.67 21.76 17.11 -26.55 coo 27.18 37.56 20.68 29.07 38.28 20.13 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 19.97 40.39 22.03 18.53 39.30 23.18 33.06 29.40 -17.37 33.45 31.08 -16.20 1f80_c05 source 1f80 ACYL CARRIER PROTEIN : 2 hits 1f80_c05 naa= 3 ULMN 3 1f8m_c00 ISOCITRATE LYASE user 1 3 # 1 A 180 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 191 CYH A 99 CYH.? 13.00 O4 MPD A 191 A 228 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 26.35 46.39 51.64 24.52 45.66 52.39 64.74 13.84 22.58 64.60 13.48 24.65 coo 16.62 40.80 48.93 16.46 38.74 50.82 58.08 21.10 22.79 55.99 22.56 21.69 coo 24.60 42.24 47.99 21.60 41.75 48.44 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1f8m_c00 ISOCITRATE LYASE user 2 3 # 2 A 180 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 191 CYH B 99 CYH.? 13.42 O2 MPD B 194 A 228 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 26.35 46.39 51.64 24.52 45.66 52.39 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 16.62 40.80 48.93 16.46 38.74 50.82 39.68 9.38 -33.42 38.76 7.79 -31.29 coo 24.60 42.24 47.99 21.60 41.75 48.44 41.12 18.08 -35.59 38.25 17.08 -35.73 1f8m_c00 source 1f8m ISOCITRATE LYASE : 2 hits 1f8m_c00 naa= 3 ULMN 3 1f8m_c01 ISOCITRATE LYASE user 1 3 # 1 B 180 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 191 CYH A 99 CYH.? 13.00 O4 MPD A 191 B 228 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo -1.29 58.02 79.43 0.64 57.19 79.31 64.74 13.84 22.58 64.60 13.48 24.65 coo 8.78 59.01 84.54 9.56 56.29 85.16 58.08 21.10 22.79 55.99 22.56 21.69 coo 0.68 59.10 84.66 3.77 58.91 84.59 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1f8m_c01 ISOCITRATE LYASE user 2 3 # 2 B 180 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 191 CYH B 99 CYH.? 13.42 O2 MPD B 194 B 228 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo -1.29 58.02 79.43 0.64 57.19 79.31 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 8.78 59.01 84.54 9.56 56.29 85.16 39.68 9.38 -33.42 38.76 7.79 -31.29 coo 0.68 59.10 84.66 3.77 58.91 84.59 41.12 18.08 -35.59 38.25 17.08 -35.73 1f8m_c01 source 1f8m ISOCITRATE LYASE : 2 hits 1f8m_c01 naa= 3 ULMN 3 1f8m_c02 ISOCITRATE LYASE user 1 3 # 1 C 180 HIS A 58 HIS.? 21.11 O2 MPD A 191 C 191 CYH A 99 CYH.? 13.00 O4 MPD A 191 C 228 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 2.43 65.34 36.80 3.92 66.76 37.21 64.74 13.84 22.58 64.60 13.48 24.65 coo 13.01 68.26 34.18 13.01 71.04 33.71 58.08 21.10 22.79 55.99 22.56 21.69 coo 5.82 65.41 32.29 8.60 66.57 33.01 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1f8m_c02 ISOCITRATE LYASE user 2 3 # 2 C 180 HIS B 58 HIS.? 15.15 C2 EDO B 193 C 191 CYH B 99 CYH.? 13.42 O2 MPD B 194 C 228 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 2.43 65.34 36.80 3.92 66.76 37.21 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 13.01 68.26 34.18 13.01 71.04 33.71 39.68 9.38 -33.42 38.76 7.79 -31.29 coo 5.82 65.41 32.29 8.60 66.57 33.01 41.12 18.08 -35.59 38.25 17.08 -35.73 1f8m_c02 source 1f8m ISOCITRATE LYASE : 2 hits 1f8m_c02 naa= 3 ULMN 3 1f8m_c03 ISOCITRATE LYASE user 1 3 # 1 D 180 HIS A 58 HIS.? 21.11 O2 MPD A 191 D 191 CYH A 99 CYH.? 13.00 O4 MPD A 191 D 228 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 17.18 84.74 69.76 15.58 84.83 68.40 64.74 13.84 22.58 64.60 13.48 24.65 coo 5.89 86.47 69.92 5.21 88.39 67.91 58.08 21.10 22.79 55.99 22.56 21.69 coo 13.48 87.80 72.67 10.60 87.44 71.57 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1f8m_c03 ISOCITRATE LYASE user 2 3 # 2 D 180 HIS B 58 HIS.? 15.15 C2 EDO B 193 D 191 CYH B 99 CYH.? 13.42 O2 MPD B 194 D 228 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 17.18 84.74 69.76 15.58 84.83 68.40 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 5.89 86.47 69.92 5.21 88.39 67.91 39.68 9.38 -33.42 38.76 7.79 -31.29 coo 13.48 87.80 72.67 10.60 87.44 71.57 41.12 18.08 -35.59 38.25 17.08 -35.73 1f8m_c03 source 1f8m ISOCITRATE LYASE : 2 hits 1f8m_c03 naa= 3 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 112 PHE A 184 PHE^? 9.57 CM MPD A 191 A 210 ASP A 103 ASP^? 5.49 CM MPD A 191 A 244 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 9.23 46.77 25.11 11.48 48.39 24.76 45.19 8.41 9.80 45.30 11.23 9.69 coo 10.51 37.86 19.71 9.07 39.38 20.04 51.58 16.40 16.66 49.70 15.49 16.18 coo -1.20 42.34 17.67 3.19 45.13 19.06 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 112 PHE A 184 PHE^? 9.57 CM MPD A 191 A 210 ASP A 179 ASP^? 16.86 CM MPD A 191 A 244 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 9.23 46.77 25.11 11.48 48.39 24.76 45.19 8.41 9.80 45.30 11.23 9.69 coo 10.51 37.86 19.71 9.07 39.38 20.04 43.85 0.70 13.63 43.61 -0.87 12.28 coo -1.20 42.34 17.67 3.19 45.13 19.06 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 3 3 # 3 A 112 PHE B 184 PHE^? 8.87 C5 MPD B 194 A 210 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 244 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 9.23 46.77 25.11 11.48 48.39 24.76 36.81 21.73 -15.10 37.09 18.98 -15.09 coo 10.51 37.86 19.71 9.07 39.38 20.04 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -1.20 42.34 17.67 3.19 45.13 19.06 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 4 3 # 4 A 112 PHE B 184 PHE^? 8.87 C5 MPD B 194 A 210 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 244 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 9.23 46.77 25.11 11.48 48.39 24.76 36.81 21.73 -15.10 37.09 18.98 -15.09 coo 10.51 37.86 19.71 9.07 39.38 20.04 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -1.20 42.34 17.67 3.19 45.13 19.06 25.14 19.21 -22.67 21.76 17.11 -26.55 1fc4_c02 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 4 hits 1fc4_c02 naa= 3 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 112 PHE A 184 PHE^? 9.57 CM MPD A 191 B 210 ASP A 103 ASP^? 5.49 CM MPD A 191 B 244 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 8.76 47.85 34.91 11.08 46.36 35.41 45.19 8.41 9.80 45.30 11.23 9.69 coo 9.06 56.85 40.30 7.71 55.27 39.90 51.58 16.40 16.66 49.70 15.49 16.18 coo -2.38 51.82 41.62 2.07 49.19 40.42 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 112 PHE A 184 PHE^? 9.57 CM MPD A 191 B 210 ASP A 179 ASP^? 16.86 CM MPD A 191 B 244 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 8.76 47.85 34.91 11.08 46.36 35.41 45.19 8.41 9.80 45.30 11.23 9.69 coo 9.06 56.85 40.30 7.71 55.27 39.90 43.85 0.70 13.63 43.61 -0.87 12.28 coo -2.38 51.82 41.62 2.07 49.19 40.42 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 3 3 # 3 B 112 PHE B 184 PHE^? 8.87 C5 MPD B 194 B 210 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 244 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 8.76 47.85 34.91 11.08 46.36 35.41 36.81 21.73 -15.10 37.09 18.98 -15.09 coo 9.06 56.85 40.30 7.71 55.27 39.90 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -2.38 51.82 41.62 2.07 49.19 40.42 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 4 3 # 4 B 112 PHE B 184 PHE^? 8.87 C5 MPD B 194 B 210 ASP B 179 ASP^? 11.34 O2 EDO A 188 B 244 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 8.76 47.85 34.91 11.08 46.36 35.41 36.81 21.73 -15.10 37.09 18.98 -15.09 coo 9.06 56.85 40.30 7.71 55.27 39.90 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -2.38 51.82 41.62 2.07 49.19 40.42 25.14 19.21 -22.67 21.76 17.11 -26.55 1fc4_c03 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 4 hits 1fc4_c03 naa= 3 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 137 TYR A 157 TYR^? -4.51 CM MPD A 191s A 142 LEU A 183 LEU.? 7.84 CM MPD A 191 A 165 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 46.12 11.16 21.21 46.22 13.94 20.83 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 41.64 9.27 12.13 40.79 11.07 12.86 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 137 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 142 LEU B 183 LEU.? 7.58 CM MPD B 194 A 165 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 32.43 20.86 -14.78 31.52 18.88 -15.00 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 25.14 19.21 -22.67 21.76 17.11 -26.55 1fdy_c00 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c00 naa= 3 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 47 SER A 68 SER^? 14.83 O1 EDO A 189 A 48 THR A 70 THR.? 16.47 O2 EDO A 188 A 165 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 48.79 23.73 -3.35 48.63 25.48 -1.65 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 48.03 28.89 -3.16 47.24 28.55 -1.16 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 47 SER B 68 SER^? -5.55 O2 EDO B 191s A 48 THR B 70 THR.? 4.22 O2 EDO B 191 A 165 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 47.96 6.58 -6.86 46.83 4.83 -8.08 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 47.36 1.42 -6.55 45.59 1.83 -7.73 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 51.85 4.84 -17.64 57.80 3.80 -15.89 1fdy_c04 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c04 naa= 3 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 47 SER A 68 SER^? 14.83 O1 EDO A 189 B 48 THR A 70 THR.? 16.47 O2 EDO A 188 B 165 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 48.79 23.73 -3.35 48.63 25.48 -1.65 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 48.03 28.89 -3.16 47.24 28.55 -1.16 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 47 SER B 68 SER^? -5.55 O2 EDO B 191s B 48 THR B 70 THR.? 4.22 O2 EDO B 191 B 165 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 47.96 6.58 -6.86 46.83 4.83 -8.08 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 47.36 1.42 -6.55 45.59 1.83 -7.73 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 51.85 4.84 -17.64 57.80 3.80 -15.89 1fdy_c05 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c05 naa= 3 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 47 SER A 68 SER^? 14.83 O1 EDO A 189 C 48 THR A 70 THR.? 16.47 O2 EDO A 188 C 165 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 48.79 23.73 -3.35 48.63 25.48 -1.65 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 48.03 28.89 -3.16 47.24 28.55 -1.16 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 C 47 SER B 68 SER^? -5.55 O2 EDO B 191s C 48 THR B 70 THR.? 4.22 O2 EDO B 191 C 165 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 47.96 6.58 -6.86 46.83 4.83 -8.08 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 47.36 1.42 -6.55 45.59 1.83 -7.73 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 51.85 4.84 -17.64 57.80 3.80 -15.89 1fdy_c06 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c06 naa= 3 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 D 47 SER A 68 SER^? 14.83 O1 EDO A 189 D 48 THR A 70 THR.? 16.47 O2 EDO A 188 D 165 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 48.79 23.73 -3.35 48.63 25.48 -1.65 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 48.03 28.89 -3.16 47.24 28.55 -1.16 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 47 SER B 68 SER^? -5.55 O2 EDO B 191s D 48 THR B 70 THR.? 4.22 O2 EDO B 191 D 165 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 47.96 6.58 -6.86 46.83 4.83 -8.08 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 47.36 1.42 -6.55 45.59 1.83 -7.73 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 51.85 4.84 -17.64 57.80 3.80 -15.89 1fdy_c07 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c07 naa= 3 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 50 ARG^? 6.80 C2 EDO A 189 A 136 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 246 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 13.48 30.30 107.06 11.75 30.99 109.44 65.37 14.47 5.23 66.89 16.94 6.37 coo 9.46 32.37 115.82 8.50 34.20 115.47 66.27 6.09 6.28 67.77 7.37 5.57 coo 11.99 34.33 109.92 10.08 34.19 110.77 61.87 12.13 2.43 62.94 11.86 0.64 1fhl_c00 source 1fhl BETA-1,4-GALACTANASE : 1 hits 1fhl_c00 naa= 3 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 50 ARG^? 6.80 C2 EDO A 189 A 136 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 246 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 13.94 29.84 106.80 11.67 30.40 108.79 65.37 14.47 5.23 66.89 16.94 6.37 coo 9.52 31.97 115.23 8.45 33.74 114.72 66.27 6.09 6.28 67.77 7.37 5.57 coo 11.92 33.82 109.35 10.10 33.50 110.39 61.87 12.13 2.43 62.94 11.86 0.64 1fob_c00 source 1fob BETA-1,4-GALACTANASE : 1 hits 1fob_c00 naa= 3 ULMN 3 1foh_c00 PHENOL HYDROXYLASE user 1 3 # 1 A 54 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 281 ARG B 24 ARG^? 8.74 O1 EDO A 188 A 289 TYR A 7 TYR^? -3.69 C1 EDO A 188s coo 54.86 40.00 47.23 55.57 38.60 48.67 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 52.08 40.18 50.14 50.83 38.93 47.73 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 57.82 31.70 50.73 57.94 34.00 49.17 46.26 28.35 -19.62 46.61 30.00 -21.81 ULMN 3 1foh_c00 PHENOL HYDROXYLASE user 2 3 # 2 A 54 ASP A 101 ASP^? 14.06 CM MPD A 191 A 281 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 289 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 54.86 40.00 47.23 55.57 38.60 48.67 57.05 15.04 20.11 57.86 14.10 21.77 coo 52.08 40.18 50.14 50.83 38.93 47.73 61.14 12.50 23.45 58.83 13.31 25.34 coo 57.82 31.70 50.73 57.94 34.00 49.17 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1foh_c00 PHENOL HYDROXYLASE user 3 3 # 3 A 54 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 281 ARG A 24 ARG^? 7.27 O2 EDO A 189 A 289 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 54.86 40.00 47.23 55.57 38.60 48.67 64.75 2.11 3.69 66.46 3.28 4.11 coo 52.08 40.18 50.14 50.83 38.93 47.73 63.21 5.10 1.62 63.59 8.06 0.82 coo 57.82 31.70 50.73 57.94 34.00 49.17 55.88 2.21 7.80 57.52 0.60 9.42 ULMN 3 1foh_c00 PHENOL HYDROXYLASE user 4 3 # 4 A 54 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 281 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 289 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 54.86 40.00 47.23 55.57 38.60 48.67 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 52.08 40.18 50.14 50.83 38.93 47.73 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 57.82 31.70 50.73 57.94 34.00 49.17 32.90 20.52 -29.81 34.48 19.65 -27.74 1foh_c00 source 1foh PHENOL HYDROXYLASE : 4 hits 1foh_c00 naa= 3 ULMN 3 1foh_c01 PHENOL HYDROXYLASE user 1 3 # 1 B 54 ASP A 4 ASP.? 9.87 O1 EDO A 188 B 281 ARG B 24 ARG^? 8.74 O1 EDO A 188 B 289 TYR A 7 TYR^? -3.69 C1 EDO A 188s coo 90.56 80.24 98.04 90.36 81.53 96.34 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 86.62 80.67 97.51 87.37 82.00 100.10 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 91.83 88.28 92.88 92.60 85.93 94.14 46.26 28.35 -19.62 46.61 30.00 -21.81 ULMN 3 1foh_c01 PHENOL HYDROXYLASE user 2 3 # 2 B 54 ASP A 101 ASP^? 14.06 CM MPD A 191 B 281 ARG A 117 ARG~? 16.06 O2 MPD A 191 B 289 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 90.56 80.24 98.04 90.36 81.53 96.34 57.05 15.04 20.11 57.86 14.10 21.77 coo 86.62 80.67 97.51 87.37 82.00 100.10 61.14 12.50 23.45 58.83 13.31 25.34 coo 91.83 88.28 92.88 92.60 85.93 94.14 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1foh_c01 PHENOL HYDROXYLASE user 3 3 # 3 B 54 ASP B 4 ASP.? -7.27 O2 EDO B 190s B 281 ARG A 24 ARG^? 7.27 O2 EDO A 189 B 289 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 90.56 80.24 98.04 90.36 81.53 96.34 64.75 2.11 3.69 66.46 3.28 4.11 coo 86.62 80.67 97.51 87.37 82.00 100.10 63.21 5.10 1.62 63.59 8.06 0.82 coo 91.83 88.28 92.88 92.60 85.93 94.14 55.88 2.21 7.80 57.52 0.60 9.42 ULMN 3 1foh_c01 PHENOL HYDROXYLASE user 4 3 # 4 B 54 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 281 ARG B 117 ARG~? 13.46 O2 EDO B 193 B 289 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 90.56 80.24 98.04 90.36 81.53 96.34 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 86.62 80.67 97.51 87.37 82.00 100.10 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 91.83 88.28 92.88 92.60 85.93 94.14 32.90 20.52 -29.81 34.48 19.65 -27.74 1foh_c01 source 1foh PHENOL HYDROXYLASE : 4 hits 1foh_c01 naa= 3 ULMN 3 1foh_c02 PHENOL HYDROXYLASE user 1 3 # 1 C 54 ASP A 4 ASP.? 9.87 O1 EDO A 188 C 281 ARG B 24 ARG^? 8.74 O1 EDO A 188 C 289 TYR A 7 TYR^? -3.69 C1 EDO A 188s coo 42.34 76.83 49.10 43.06 78.59 50.01 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 46.12 77.15 48.13 44.44 77.61 45.70 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 42.69 86.18 51.69 41.59 83.63 51.54 46.26 28.35 -19.62 46.61 30.00 -21.81 ULMN 3 1foh_c02 PHENOL HYDROXYLASE user 2 3 # 2 C 54 ASP A 101 ASP^? 14.06 CM MPD A 191 C 281 ARG A 117 ARG~? 16.06 O2 MPD A 191 C 289 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 42.34 76.83 49.10 43.06 78.59 50.01 57.05 15.04 20.11 57.86 14.10 21.77 coo 46.12 77.15 48.13 44.44 77.61 45.70 61.14 12.50 23.45 58.83 13.31 25.34 coo 42.69 86.18 51.69 41.59 83.63 51.54 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1foh_c02 PHENOL HYDROXYLASE user 3 3 # 3 C 54 ASP B 4 ASP.? -7.27 O2 EDO B 190s C 281 ARG A 24 ARG^? 7.27 O2 EDO A 189 C 289 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 42.34 76.83 49.10 43.06 78.59 50.01 64.75 2.11 3.69 66.46 3.28 4.11 coo 46.12 77.15 48.13 44.44 77.61 45.70 63.21 5.10 1.62 63.59 8.06 0.82 coo 42.69 86.18 51.69 41.59 83.63 51.54 55.88 2.21 7.80 57.52 0.60 9.42 1foh_c02 source 1foh PHENOL HYDROXYLASE : 3 hits 1foh_c02 naa= 3 ULMN 3 1foh_c03 PHENOL HYDROXYLASE user 1 3 # 1 D 54 ASP A 4 ASP.? 9.87 O1 EDO A 188 D 281 ARG B 24 ARG^? 8.74 O1 EDO A 188 D 289 TYR A 7 TYR^? -3.69 C1 EDO A 188s coo 75.05 45.80 106.18 74.73 43.88 105.51 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 78.52 44.93 104.78 78.72 44.49 107.76 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 72.35 36.51 104.82 72.00 39.20 105.46 46.26 28.35 -19.62 46.61 30.00 -21.81 ULMN 3 1foh_c03 PHENOL HYDROXYLASE user 2 3 # 2 D 54 ASP B 4 ASP.? -7.27 O2 EDO B 190s D 281 ARG A 24 ARG^? 7.27 O2 EDO A 189 D 289 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 75.05 45.80 106.18 74.73 43.88 105.51 64.75 2.11 3.69 66.46 3.28 4.11 coo 78.52 44.93 104.78 78.72 44.49 107.76 63.21 5.10 1.62 63.59 8.06 0.82 coo 72.35 36.51 104.82 72.00 39.20 105.46 55.88 2.21 7.80 57.52 0.60 9.42 1foh_c03 source 1foh PHENOL HYDROXYLASE : 2 hits 1foh_c03 naa= 3 ULMN 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 A 317 GLU B 31 GLU^? -3.64 O2 EDO B 189s A 319 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 359 ARG A 3 ARG.? 17.14 O2 EDO B 189 coo 14.41 12.40 16.42 12.92 13.74 15.71 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 12.25 13.04 23.85 11.56 15.02 23.93 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 10.89 14.95 28.28 12.39 12.53 29.31 62.07 28.45 -23.10 65.03 28.89 -22.09 1fr8_c00 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 1 hits 1fr8_c00 naa= 3 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 B 317 GLU A 69 GLU.? 15.47 O2 EDO A 188 B 319 ASP A 38 ASP.? 14.66 C5 MPD A 191 B 359 ARG A 40 ARG.? 16.02 C5 MPD A 191 coo 10.77 13.13 40.94 11.03 14.73 39.51 44.88 26.70 -3.49 42.93 26.42 -2.77 coo 3.77 12.64 38.21 3.35 14.53 37.39 42.66 22.43 1.00 42.54 24.24 2.16 coo -1.16 15.32 35.60 -3.32 13.56 36.98 39.30 26.84 6.37 36.68 28.27 5.45 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 # 2 B 317 GLU B 31 GLU^? -3.64 O2 EDO B 189s B 319 ASP A 4 ASP.? 9.87 O1 EDO A 188 B 359 ARG A 3 ARG.? 17.14 O2 EDO B 189 coo 10.77 13.13 40.94 11.03 14.73 39.51 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 3.77 12.64 38.21 3.35 14.53 37.39 55.32 27.50 -21.80 56.24 27.40 -19.90 coo -1.16 15.32 35.60 -3.32 13.56 36.98 62.07 28.45 -23.10 65.03 28.89 -22.09 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 3 3 # 3 B 317 GLU B 69 GLU.? -7.04 C2 EDO B 191s B 319 ASP B 38 ASP.? -2.58 O1 EDO B 191s B 359 ARG B 40 ARG.? -5.91 C2 EDO B 188s coo 10.77 13.13 40.94 11.03 14.73 39.51 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 3.77 12.64 38.21 3.35 14.53 37.39 40.43 7.67 -6.71 39.74 5.84 -7.58 coo -1.16 15.32 35.60 -3.32 13.56 36.98 35.46 3.15 -9.11 34.69 4.91 -11.54 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 4 3 # 4 B 317 GLU B 173 GLU.? 7.59 O1 EDO B 193 B 319 ASP B 172 ASP.? 7.16 C1 EDO B 193 B 359 ARG B 186 ARG^? -4.10 O2 EDO A 188s coo 10.77 13.13 40.94 11.03 14.73 39.51 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 3.77 12.64 38.21 3.35 14.53 37.39 40.45 32.96 -23.62 41.93 31.48 -23.99 coo -1.16 15.32 35.60 -3.32 13.56 36.98 42.31 29.46 -17.08 41.98 30.89 -19.84 1fr8_c01 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 4 hits 1fr8_c01 naa= 3 ULMN 3 1fuq_c00 FUMARASE C user 1 3 # 1 A 324 LYS A 74 LYS^? 9.41 O1 EDO A 189 A 331 GLU A 61 GLU^? 10.22 O1 EDO A 189 B 188 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 130.22 155.23 83.49 125.21 153.71 84.04 58.34 25.75 2.84 62.12 26.28 -2.26 coo 120.90 152.23 75.28 120.94 153.09 77.19 66.46 19.59 10.29 68.35 19.61 9.28 coo 122.04 152.80 81.06 120.71 154.37 81.46 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 3 1fuq_c00 FUMARASE C user 2 3 # 2 A 324 LYS B 74 LYS^? 9.11 O1 EDO B 189 A 331 GLU B 61 GLU^? 10.17 C1 EDO B 189 B 188 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 130.22 155.23 83.49 125.21 153.71 84.04 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 120.90 152.23 75.28 120.94 153.09 77.19 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 122.04 152.80 81.06 120.71 154.37 81.46 54.34 6.71 -25.28 55.69 7.78 -26.49 1fuq_c00 source 1fuq FUMARASE C : 2 hits 1fuq_c00 naa= 3 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 1 3 # 1 A 314 TRP A 9 TRP^? 7.49 O2 EDO A 188 A 317 GLU B 21 GLU^? 11.62 C2 EDO B 189 A 365 ARG A 5 ARG^? -3.94 O1 EDO A 188s coo 79.91 26.87 38.77 78.95 23.18 37.81 40.33 25.82 -16.58 43.34 24.62 -18.77 coo 85.55 26.30 41.25 85.59 24.97 39.65 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 83.47 25.30 27.10 83.44 27.82 25.29 49.47 32.83 -21.72 46.80 34.39 -21.91 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 2 3 # 2 A 314 TRP A 13 TRP.? 7.37 O2 EDO B 188 A 317 GLU B 39 GLU.? -2.97 O2 EDO B 188s A 365 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 79.91 26.87 38.77 78.95 23.18 37.81 35.01 18.42 -11.27 36.57 15.33 -9.40 coo 85.55 26.30 41.25 85.59 24.97 39.65 35.53 10.88 -8.90 35.33 11.18 -11.01 coo 83.47 25.30 27.10 83.44 27.82 25.29 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 3 3 # 3 A 314 TRP A 20 TRP^? -3.03 O2 EDO A 190s A 317 GLU A 21 GLU^? 11.03 O2 EDO A 190 A 365 ARG B 14 ARG.? 10.57 O1 EDO B 191 coo 79.91 26.87 38.77 78.95 23.18 37.81 48.15 6.40 -0.61 51.40 8.36 -1.66 coo 85.55 26.30 41.25 85.59 24.97 39.65 52.20 9.76 4.74 52.41 10.59 6.66 coo 83.47 25.30 27.10 83.44 27.82 25.29 36.61 9.98 2.38 38.30 7.40 2.59 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 4 3 # 4 A 314 TRP A 20 TRP^? -3.03 O2 EDO A 190s A 317 GLU A 21 GLU^? 11.03 O2 EDO A 190 A 365 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 79.91 26.87 38.77 78.95 23.18 37.81 48.15 6.40 -0.61 51.40 8.36 -1.66 coo 85.55 26.30 41.25 85.59 24.97 39.65 52.20 9.76 4.74 52.41 10.59 6.66 coo 83.47 25.30 27.10 83.44 27.82 25.29 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 5 3 # 5 A 314 TRP A 105 TRP^? 5.54 C5 MPD A 191 A 317 GLU A 39 GLU.? 8.26 C5 MPD A 191 A 365 ARG A 73 ARG^? 12.55 O1 EDO A 189 coo 79.91 26.87 38.77 78.95 23.18 37.81 45.15 18.09 9.42 43.12 14.86 10.40 coo 85.55 26.30 41.25 85.59 24.97 39.65 40.24 18.97 5.60 41.21 18.63 7.48 coo 83.47 25.30 27.10 83.44 27.82 25.29 53.52 27.95 4.31 55.34 28.60 6.78 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 6 3 # 6 A 314 TRP A 105 TRP^? 5.54 C5 MPD A 191 A 317 GLU A 39 GLU.? 8.26 C5 MPD A 191 A 365 ARG A 141 ARG^? 4.89 O4 MPD A 191 coo 79.91 26.87 38.77 78.95 23.18 37.81 45.15 18.09 9.42 43.12 14.86 10.40 coo 85.55 26.30 41.25 85.59 24.97 39.65 40.24 18.97 5.60 41.21 18.63 7.48 coo 83.47 25.30 27.10 83.44 27.82 25.29 47.94 26.40 17.24 45.84 24.19 17.73 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 7 3 # 7 A 314 TRP B 20 TRP^? 12.78 O2 EDO A 188 A 317 GLU A 69 GLU.? 15.47 O2 EDO A 188 A 365 ARG A 14 ARG.? 14.51 O2 EDO B 188 coo 79.91 26.87 38.77 78.95 23.18 37.81 45.29 23.67 -9.14 48.56 22.72 -7.16 coo 85.55 26.30 41.25 85.59 24.97 39.65 44.88 26.70 -3.49 42.93 26.42 -2.77 coo 83.47 25.30 27.10 83.44 27.82 25.29 34.22 19.89 -3.86 35.36 22.47 -5.15 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 8 3 # 8 A 314 TRP B 20 TRP^? 12.78 O2 EDO A 188 A 317 GLU A 69 GLU.? 15.47 O2 EDO A 188 A 365 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 79.91 26.87 38.77 78.95 23.18 37.81 45.29 23.67 -9.14 48.56 22.72 -7.16 coo 85.55 26.30 41.25 85.59 24.97 39.65 44.88 26.70 -3.49 42.93 26.42 -2.77 coo 83.47 25.30 27.10 83.44 27.82 25.29 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 9 3 # 9 A 314 TRP B 20 TRP^? 12.78 O2 EDO A 188 A 317 GLU B 21 GLU^? 11.62 C2 EDO B 189 A 365 ARG A 14 ARG.? 14.51 O2 EDO B 188 coo 79.91 26.87 38.77 78.95 23.18 37.81 45.29 23.67 -9.14 48.56 22.72 -7.16 coo 85.55 26.30 41.25 85.59 24.97 39.65 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 83.47 25.30 27.10 83.44 27.82 25.29 34.22 19.89 -3.86 35.36 22.47 -5.15 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 10 3 # 10 A 314 TRP B 20 TRP^? 12.78 O2 EDO A 188 A 317 GLU B 21 GLU^? 11.62 C2 EDO B 189 A 365 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 79.91 26.87 38.77 78.95 23.18 37.81 45.29 23.67 -9.14 48.56 22.72 -7.16 coo 85.55 26.30 41.25 85.59 24.97 39.65 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 83.47 25.30 27.10 83.44 27.82 25.29 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 11 3 # 11 A 314 TRP B 105 TRP^? 3.96 C1 EDO B 188 A 317 GLU B 39 GLU.? -2.97 O2 EDO B 188s A 365 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 79.91 26.87 38.77 78.95 23.18 37.81 37.28 12.07 -14.92 34.92 15.15 -14.25 coo 85.55 26.30 41.25 85.59 24.97 39.65 35.53 10.88 -8.90 35.33 11.18 -11.01 coo 83.47 25.30 27.10 83.44 27.82 25.29 34.68 4.05 -23.26 33.98 5.70 -20.76 1g8o_c01 source 1g8o N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALACTOSYLTRA: 11 hits 1g8o_c01 naa= 3 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 A 36 GLU A 21 GLU^? 11.03 O2 EDO A 190 A 47 ASP A 103 ASP^? 5.49 CM MPD A 191 A 161 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo 37.12 18.35 73.76 37.09 16.69 72.44 52.20 9.76 4.74 52.41 10.59 6.66 coo 29.81 8.06 73.13 30.21 10.11 72.95 51.58 16.40 16.66 49.70 15.49 16.18 coo 37.29 15.56 67.90 37.37 13.79 70.08 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 2 3 # 2 A 36 GLU A 158 GLU^? 10.31 O2 MPD A 191 A 47 ASP A 103 ASP^? 5.49 CM MPD A 191 A 161 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 37.12 18.35 73.76 37.09 16.69 72.44 43.36 11.29 26.55 43.12 11.25 28.63 coo 29.81 8.06 73.13 30.21 10.11 72.95 51.58 16.40 16.66 49.70 15.49 16.18 coo 37.29 15.56 67.90 37.37 13.79 70.08 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 3 3 # 3 A 36 GLU B 21 GLU^? 11.62 C2 EDO B 189 A 47 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 161 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 37.12 18.35 73.76 37.09 16.69 72.44 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 29.81 8.06 73.13 30.21 10.11 72.95 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 37.29 15.56 67.90 37.37 13.79 70.08 48.23 15.25 -19.35 46.43 17.40 -19.57 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 4 3 # 4 A 36 GLU B 158 GLU^? 10.92 O2 MPD B 194 A 47 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 161 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 37.12 18.35 73.76 37.09 16.69 72.44 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 29.81 8.06 73.13 30.21 10.11 72.95 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 37.29 15.56 67.90 37.37 13.79 70.08 32.90 20.52 -29.81 34.48 19.65 -27.74 1geq_c02 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 4 hits 1geq_c02 naa= 3 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 B 36 GLU A 21 GLU^? 11.03 O2 EDO A 190 B 47 ASP A 103 ASP^? 5.49 CM MPD A 191 B 161 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo 53.87 35.49 53.22 55.44 35.72 54.61 52.20 9.76 4.74 52.41 10.59 6.66 coo 63.47 43.65 53.95 61.45 43.07 54.06 51.58 16.40 16.66 49.70 15.49 16.18 coo 56.38 35.81 59.19 58.25 35.77 57.10 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 2 3 # 2 B 36 GLU A 158 GLU^? 10.31 O2 MPD A 191 B 47 ASP A 103 ASP^? 5.49 CM MPD A 191 B 161 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 53.87 35.49 53.22 55.44 35.72 54.61 43.36 11.29 26.55 43.12 11.25 28.63 coo 63.47 43.65 53.95 61.45 43.07 54.06 51.58 16.40 16.66 49.70 15.49 16.18 coo 56.38 35.81 59.19 58.25 35.77 57.10 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 3 3 # 3 B 36 GLU B 21 GLU^? 11.62 C2 EDO B 189 B 47 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 161 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 53.87 35.49 53.22 55.44 35.72 54.61 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 63.47 43.65 53.95 61.45 43.07 54.06 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 56.38 35.81 59.19 58.25 35.77 57.10 48.23 15.25 -19.35 46.43 17.40 -19.57 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 4 3 # 4 B 36 GLU B 158 GLU^? 10.92 O2 MPD B 194 B 47 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 161 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 53.87 35.49 53.22 55.44 35.72 54.61 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 63.47 43.65 53.95 61.45 43.07 54.06 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 56.38 35.81 59.19 58.25 35.77 57.10 32.90 20.52 -29.81 34.48 19.65 -27.74 1geq_c03 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 4 hits 1geq_c03 naa= 3 ULMN 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 1 3 # 1 13 ASP A 89 ASP.? 15.93 O1 EDO A 189 41 HIS A 76 HIS^? 9.12 O1 EDO A 189 224 GLN A 86 GLN^? 18.78 O1 EDO A 189 coo -3.80 50.71 49.48 -5.59 51.85 49.27 67.25 32.32 9.27 66.30 32.35 7.40 coo -6.45 47.32 41.99 -8.32 46.87 42.83 65.00 24.12 7.67 66.83 23.12 7.94 coo -12.35 49.13 49.89 -13.38 48.89 48.03 67.23 27.16 15.62 69.12 27.87 16.28 ULMN 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 2 3 # 2 13 ASP B 87 ASP^? 16.44 C1 EDO B 189 41 HIS B 76 HIS^? 9.10 C1 EDO B 189 224 GLN B 86 GLN^? 19.45 C1 EDO B 189 coo -3.80 50.71 49.48 -5.59 51.85 49.27 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo -6.45 47.32 41.99 -8.32 46.87 42.83 54.34 6.71 -25.28 55.69 7.78 -26.49 coo -12.35 49.13 49.89 -13.38 48.89 48.03 50.80 2.74 -34.24 52.56 2.92 -35.40 ULMN 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 3 3 # 3 13 ASP B 89 ASP.? 15.59 O1 EDO B 189 41 HIS B 76 HIS^? 9.10 C1 EDO B 189 224 GLN B 86 GLN^? 19.45 C1 EDO B 189 coo -3.80 50.71 49.48 -5.59 51.85 49.27 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo -6.45 47.32 41.99 -8.32 46.87 42.83 54.34 6.71 -25.28 55.69 7.78 -26.49 coo -12.35 49.13 49.89 -13.38 48.89 48.03 50.80 2.74 -34.24 52.56 2.92 -35.40 1gim_c00 source 1gim ADENYLOSUCCINATE SYNTHETASE : 3 hits 1gim_c00 naa= 3 ULMN 3 1gns_c00 SUBTILISIN BPN' user 1 3 # 1 A 32 ASP A 151 ASP^? 20.35 CM MPD A 191 A 64 HIS A 154 HIS^? 17.90 CM MPD A 191 A 155 ASN A 111 ASN~? 7.14 CM MPD A 191 coo 3.12 38.70 24.20 3.24 38.59 26.33 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 1.90 38.00 29.77 3.91 38.35 29.95 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 9.89 36.55 37.38 9.27 37.99 36.08 50.97 8.64 17.05 49.29 9.91 16.73 ULMN 3 1gns_c00 SUBTILISIN BPN' user 2 3 # 2 A 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 64 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 155 ASN B 111 ASN~? 7.23 CM MPD B 194 coo 3.12 38.70 24.20 3.24 38.59 26.33 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 1.90 38.00 29.77 3.91 38.35 29.95 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 9.89 36.55 37.38 9.27 37.99 36.08 36.94 21.70 -24.36 35.87 20.37 -23.07 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 74 LYS^? 9.41 O1 EDO A 189 210 ARG A 35 ARG^? -3.68 C1 EDO A 190s 225 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 17.51 28.50 73.42 17.24 23.02 75.86 58.34 25.75 2.84 62.12 26.28 -2.26 coo 24.74 11.56 73.05 25.29 14.32 71.80 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 27.81 15.44 77.10 25.66 16.50 75.19 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 2 3 # 2 160 LYS A 74 LYS^? 9.41 O1 EDO A 189 210 ARG A 60 ARG^? 18.80 O1 EDO A 189 225 ARG A 52 ARG^? 13.70 C2 EDO A 189 coo 17.51 28.50 73.42 17.24 23.02 75.86 58.34 25.75 2.84 62.12 26.28 -2.26 coo 24.74 11.56 73.05 25.29 14.32 71.80 67.94 16.79 18.42 70.70 18.25 18.48 coo 27.81 15.44 77.10 25.66 16.50 75.19 69.17 14.29 10.90 69.97 16.58 12.80 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 3 3 # 3 160 LYS A 166 LYS^? 9.67 O2 MPD A 191 210 ARG A 129 ARG^? 14.04 O2 MPD A 191 225 ARG A 144 ARG^? 11.59 O2 MPD A 191 coo 17.51 28.50 73.42 17.24 23.02 75.86 40.42 10.96 22.74 39.85 13.02 27.76 coo 24.74 11.56 73.05 25.29 14.32 71.80 54.99 23.34 25.48 52.76 24.40 27.34 coo 27.81 15.44 77.10 25.66 16.50 75.19 48.95 22.48 28.26 46.62 21.31 29.92 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 4 3 # 4 160 LYS B 74 LYS^? 9.11 O1 EDO B 189 210 ARG B 35 ARG^? 10.43 C2 EDO A 190 225 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 17.51 28.50 73.42 17.24 23.02 75.86 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 24.74 11.56 73.05 25.29 14.32 71.80 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 27.81 15.44 77.10 25.66 16.50 75.19 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 5 3 # 5 160 LYS B 74 LYS^? 9.11 O1 EDO B 189 210 ARG B 60 ARG^? 18.79 C1 EDO B 189 225 ARG B 52 ARG^? 13.54 O2 EDO B 189 coo 17.51 28.50 73.42 17.24 23.02 75.86 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 24.74 11.56 73.05 25.29 14.32 71.80 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 27.81 15.44 77.10 25.66 16.50 75.19 55.40 16.98 -30.43 55.13 14.61 -32.43 1gsa_c00 source 1gsa GLUTATHIONE SYNTHETASE : 5 hits 1gsa_c00 naa= 3 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 1 3 # 1 A 271 GLN A 29 GLN^? 9.33 C2 EDO A 189 A 296 GLU A 31 GLU^? -3.45 O2 EDO A 189s A 383 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 66.72 9.95 7.95 67.95 11.27 6.82 coo 40.93 4.45 2.36 38.91 3.75 2.26 61.87 12.13 2.43 62.94 11.86 0.64 coo 30.54 7.22 6.23 31.38 5.79 3.97 55.88 2.21 7.80 57.52 0.60 9.42 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 2 3 # 2 A 271 GLN A 33 GLN^? 7.13 C1 EDO A 190 A 296 GLU A 21 GLU^? 11.03 O2 EDO A 190 A 383 TYR A 45 TYR^? 11.90 O2 EDO A 190 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 40.93 4.45 2.36 38.91 3.75 2.26 52.20 9.76 4.74 52.41 10.59 6.66 coo 30.54 7.22 6.23 31.38 5.79 3.97 47.53 19.92 0.67 46.95 18.68 3.19 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 3 3 # 3 A 271 GLN A 33 GLN^? 7.13 C1 EDO A 190 A 296 GLU A 31 GLU^? -3.45 O2 EDO A 189s A 383 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 56.51 11.95 -1.39 56.41 12.02 -3.57 coo 40.93 4.45 2.36 38.91 3.75 2.26 61.87 12.13 2.43 62.94 11.86 0.64 coo 30.54 7.22 6.23 31.38 5.79 3.97 55.88 2.21 7.80 57.52 0.60 9.42 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 4 3 # 4 A 271 GLN A 46 GLN^? 7.01 C1 EDO A 190 A 296 GLU A 67 GLU^? 10.03 C1 EDO A 189 A 383 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 40.93 4.45 2.36 38.91 3.75 2.26 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 30.54 7.22 6.23 31.38 5.79 3.97 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 5 3 # 5 A 271 GLN A 174 GLN.? 12.38 O1 EDO B 190 A 296 GLU A 173 GLU.? 15.20 O1 EDO B 190 A 383 TYR A 155 TYR^? 14.94 CM MPD A 191 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 59.85 -1.54 14.90 58.95 -3.48 14.67 coo 40.93 4.45 2.36 38.91 3.75 2.26 56.04 -5.91 18.03 55.52 -6.78 16.19 coo 30.54 7.22 6.23 31.38 5.79 3.97 50.44 4.00 23.33 52.91 2.96 24.17 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 6 3 # 6 A 271 GLN B 29 GLN^? 9.88 O2 EDO B 189 A 296 GLU B 31 GLU^? -3.64 O2 EDO B 189s A 383 TYR A 7 TYR^? -3.69 C1 EDO A 188s coo 38.07 -1.37 3.28 36.21 -0.34 2.92 54.95 21.24 -26.60 56.82 20.31 -27.04 coo 40.93 4.45 2.36 38.91 3.75 2.26 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 30.54 7.22 6.23 31.38 5.79 3.97 46.26 28.35 -19.62 46.61 30.00 -21.81 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 7 3 # 7 A 271 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 296 GLU B 21 GLU^? 11.62 C2 EDO B 189 A 383 TYR B 45 TYR^? 7.97 C2 EDO A 190 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 51.15 18.18 -11.32 53.04 18.44 -10.42 coo 40.93 4.45 2.36 38.91 3.75 2.26 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 30.54 7.22 6.23 31.38 5.79 3.97 44.36 10.34 -9.27 42.37 11.49 -10.86 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 8 3 # 8 A 271 GLN B 46 GLN^? 7.98 C2 EDO A 190 A 296 GLU B 67 GLU^? -5.72 C1 EDO A 190s A 383 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 38.07 -1.37 3.28 36.21 -0.34 2.92 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 40.93 4.45 2.36 38.91 3.75 2.26 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 30.54 7.22 6.23 31.38 5.79 3.97 48.23 15.25 -19.35 46.43 17.40 -19.57 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 9 3 # 9 A 271 GLN B 174 GLN.? 7.74 C1 EDO B 193 A 296 GLU B 173 GLU.? 7.59 O1 EDO B 193 A 383 TYR B 155 TYR^? 6.08 O1 EDO B 193 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 45.10 31.98 -27.69 44.64 33.91 -26.89 coo 40.93 4.45 2.36 38.91 3.75 2.26 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 30.54 7.22 6.23 31.38 5.79 3.97 32.75 26.18 -29.08 34.17 27.29 -31.19 1h19_c00 source 1h19 LEUKOTRIENE A-4 HYDROLASE : 9 hits 1h19_c00 naa= 3 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 1 3 # 1 A 50 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 327 GLU B 26 GLU.? 11.31 O2 EDO B 189 A 339 ARG A 3 ARG.? 17.14 O2 EDO B 189 coo 85.81 57.99 116.01 86.03 55.86 115.89 68.86 12.45 19.04 67.57 12.48 20.71 coo 75.11 41.01 160.30 76.65 40.06 161.41 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 82.23 40.35 159.87 85.09 40.67 161.01 62.07 28.45 -23.10 65.03 28.89 -22.09 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 2 3 # 2 A 50 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 327 GLU B 26 GLU.? 11.31 O2 EDO B 189 A 339 ARG B 50 ARG^? -6.93 O2 EDO B 189s coo 85.81 57.99 116.01 86.03 55.86 115.89 68.63 22.07 21.16 67.50 22.56 22.86 coo 75.11 41.01 160.30 76.65 40.06 161.41 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 82.23 40.35 159.87 85.09 40.67 161.01 55.72 16.68 -23.20 56.85 15.32 -25.75 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 3 3 # 3 A 50 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 327 GLU B 173 GLU.? 7.59 O1 EDO B 193 A 339 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 85.81 57.99 116.01 86.03 55.86 115.89 63.41 29.58 11.55 64.59 31.41 11.51 coo 75.11 41.01 160.30 76.65 40.06 161.41 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 82.23 40.35 159.87 85.09 40.67 161.01 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 4 3 # 4 A 50 ASP A 89 ASP.? 15.93 O1 EDO A 189 A 327 GLU B 173 GLU.? 7.59 O1 EDO B 193 A 339 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 85.81 57.99 116.01 86.03 55.86 115.89 67.25 32.32 9.27 66.30 32.35 7.40 coo 75.11 41.01 160.30 76.65 40.06 161.41 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 82.23 40.35 159.87 85.09 40.67 161.01 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 5 3 # 5 A 50 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 327 GLU B 26 GLU.? 11.31 O2 EDO B 189 A 339 ARG A 3 ARG.? 17.14 O2 EDO B 189 coo 85.81 57.99 116.01 86.03 55.86 115.89 60.01 27.52 25.19 61.63 28.83 24.67 coo 75.11 41.01 160.30 76.65 40.06 161.41 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 82.23 40.35 159.87 85.09 40.67 161.01 62.07 28.45 -23.10 65.03 28.89 -22.09 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 6 3 # 6 A 50 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 327 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 339 ARG A 50 ARG^? 6.80 C2 EDO A 189 coo 85.81 57.99 116.01 86.03 55.86 115.89 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 75.11 41.01 160.30 76.65 40.06 161.41 66.27 6.09 6.28 67.77 7.37 5.57 coo 82.23 40.35 159.87 85.09 40.67 161.01 65.37 14.47 5.23 66.89 16.94 6.37 1hto_c00 source 1hto GLUTAMINE SYNTHETASE : 6 hits 1hto_c00 naa= 3 ULMN 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 1 3 # 1 A 267 GLU A 134 GLU^? 6.11 C5 MPD A 191 A 369 ARG A 141 ARG^? 4.89 O4 MPD A 191 A 372 TYR A 132 TYR^? -3.92 O4 MPD A 191s coo 16.47 7.99 31.03 17.36 6.90 32.63 46.05 21.45 10.47 44.38 22.44 11.35 coo 18.73 -1.52 28.96 15.88 -0.55 29.44 47.94 26.40 17.24 45.84 24.19 17.73 coo 16.01 4.58 27.39 13.82 5.38 28.94 48.86 20.67 16.01 46.69 20.01 14.37 ULMN 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 2 3 # 2 A 267 GLU B 134 GLU^? -3.38 C2 EDO B 188s A 369 ARG B 141 ARG^? 5.70 O4 MPD B 194 A 372 TYR B 132 TYR^? 4.23 O4 MPD B 194s coo 16.47 7.99 31.03 17.36 6.90 32.63 37.37 8.74 -16.44 35.46 7.85 -16.33 coo 18.73 -1.52 28.96 15.88 -0.55 29.44 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 16.01 4.58 27.39 13.82 5.38 28.94 36.28 9.60 -22.40 35.59 10.15 -19.78 1i1e_c00 source 1i1e BOTULINUM NEUROTOXIN TYPE B : 2 hits 1i1e_c00 naa= 3 ULMN 3 1i29_c01 CSDB user 1 3 # 1 A 123 HIS A 154 HIS^? 17.90 CM MPD A 191 A 200 ASP A 179 ASP^? 16.86 CM MPD A 191 A 226 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 23.24 46.58 4.39 24.43 46.59 2.66 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 24.51 43.28 11.18 25.17 44.50 9.58 43.85 0.70 13.63 43.61 -0.87 12.28 coo 34.47 51.09 7.19 28.58 51.18 7.53 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1i29_c01 CSDB user 2 3 # 2 A 123 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 200 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 226 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 23.24 46.58 4.39 24.43 46.59 2.66 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 24.51 43.28 11.18 25.17 44.50 9.58 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 34.47 51.09 7.19 28.58 51.18 7.53 25.14 19.21 -22.67 21.76 17.11 -26.55 1i29_c01 source 1i29 CSDB : 2 hits 1i29_c01 naa= 3 ULMN 3 1ig8_c00 HEXOKINASE PII user 1 3 # 1 A 158 SER A 32 SER^? 8.67 O2 EDO A 189 A 173 ARG A 186 ARG^? 11.98 O1 EDO B 190 A 211 ASP A 48 ASP^? -5.54 C1 EDO A 189s coo 22.72 76.24 0.23 24.60 76.86 -1.25 57.30 11.17 3.38 55.16 10.90 4.47 coo 18.77 77.82 11.69 20.55 80.22 10.73 51.29 1.08 9.05 52.68 -0.95 10.91 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 57.58 16.65 0.08 56.71 16.10 -1.78 ULMN 3 1ig8_c00 HEXOKINASE PII user 2 3 # 2 A 158 SER A 153 SER.? 20.01 CM MPD A 191 A 173 ARG A 186 ARG^? 11.98 O1 EDO B 190 A 211 ASP A 151 ASP^? 20.35 CM MPD A 191 coo 22.72 76.24 0.23 24.60 76.86 -1.25 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 18.77 77.82 11.69 20.55 80.22 10.73 51.29 1.08 9.05 52.68 -0.95 10.91 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 48.38 -3.74 26.58 47.39 -3.82 24.70 ULMN 3 1ig8_c00 HEXOKINASE PII user 3 3 # 3 A 158 SER B 32 SER^? 8.66 C2 EDO B 189 A 173 ARG B 186 ARG^? -4.10 O2 EDO A 188s A 211 ASP B 48 ASP^? 5.72 O1 EDO B 189 coo 22.72 76.24 0.23 24.60 76.86 -1.25 50.26 19.40 -17.21 47.97 19.77 -16.73 coo 18.77 77.82 11.69 20.55 80.22 10.73 42.31 29.46 -17.08 41.98 30.89 -19.84 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 52.60 14.13 -14.82 53.00 14.96 -12.94 ULMN 3 1ig8_c00 HEXOKINASE PII user 4 3 # 4 A 158 SER B 153 SER.? -3.11 C2 EDO B 192s A 173 ARG B 186 ARG^? -4.10 O2 EDO A 188s A 211 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 22.72 76.24 0.23 24.60 76.86 -1.25 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 18.77 77.82 11.69 20.55 80.22 10.73 42.31 29.46 -17.08 41.98 30.89 -19.84 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 29.45 33.81 -30.55 29.73 34.07 -28.42 1ig8_c00 source 1ig8 HEXOKINASE PII : 4 hits 1ig8_c00 naa= 3 ULMN 3 1itx_c00 GLYCOSYL HYDROLASE user 1 3 # 1 A 202 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 204 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 279 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 5.85 5.60 30.32 5.00 7.49 29.88 68.29 3.95 12.18 68.54 1.87 11.74 coo 7.79 1.83 27.81 9.08 3.25 26.92 66.27 6.09 6.28 67.77 7.37 5.57 coo 8.22 7.77 18.64 7.58 8.47 21.28 55.88 2.21 7.80 57.52 0.60 9.42 ULMN 3 1itx_c00 GLYCOSYL HYDROLASE user 2 3 # 2 A 202 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 204 GLU A 173 GLU.? 15.20 O1 EDO B 190 A 279 TYR A 155 TYR^? 14.94 CM MPD A 191 coo 5.85 5.60 30.32 5.00 7.49 29.88 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 7.79 1.83 27.81 9.08 3.25 26.92 56.04 -5.91 18.03 55.52 -6.78 16.19 coo 8.22 7.77 18.64 7.58 8.47 21.28 50.44 4.00 23.33 52.91 2.96 24.17 ULMN 3 1itx_c00 GLYCOSYL HYDROLASE user 3 3 # 3 A 202 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 204 GLU B 26 GLU.? 11.31 O2 EDO B 189 A 279 TYR A 7 TYR^? -3.69 C1 EDO A 188s coo 5.85 5.60 30.32 5.00 7.49 29.88 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 7.79 1.83 27.81 9.08 3.25 26.92 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 8.22 7.77 18.64 7.58 8.47 21.28 46.26 28.35 -19.62 46.61 30.00 -21.81 1itx_c00 source 1itx GLYCOSYL HYDROLASE : 3 hits 1itx_c00 naa= 3 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 1 3 # 1 A 14 GLU B 67 GLU^? -5.72 C1 EDO A 190s A 61 GLU B 31 GLU^? -3.64 O2 EDO B 189s A 162 HIS B 65 HIS^? -5.26 O1 EDO B 189s coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 52.81 8.90 -9.47 54.54 9.74 -8.49 coo -4.89 20.85 5.22 -3.95 21.69 6.91 54.51 18.58 -19.03 56.60 18.34 -19.10 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 54.13 9.12 -14.50 55.15 8.45 -12.80 1j53_c00 source 1j53 DNA POLYMERASE III, EPSILON CHAIN : 1 hits 1j53_c00 naa= 3 ULMN 3 1jdw_c01 L-ARGININE-GLYCINE AMIDINOTRANSFERASuser 1 3 # 1 254 ASP A 80 ASP.? 21.91 O1 EDO A 189 303 HIS A 84 HIS.? 23.86 O4 MPD A 191 407 CYH A 99 CYH.? 13.00 O4 MPD A 191 coo 49.08 66.55 9.14 50.71 67.89 8.88 68.63 22.07 21.16 67.50 22.56 22.86 coo 47.11 68.57 13.19 49.07 68.74 12.45 65.85 25.32 24.26 66.00 24.92 26.31 coo 49.32 64.84 19.61 47.95 67.13 18.88 58.08 21.10 22.79 55.99 22.56 21.69 ULMN 3 1jdw_c01 L-ARGININE-GLYCINE AMIDINOTRANSFERASuser 2 3 # 2 254 ASP B 80 ASP.? 22.03 C1 EDO B 189 303 HIS B 84 HIS.? 24.24 O2 MPD B 194 407 CYH B 99 CYH.? 13.42 O2 MPD B 194 coo 49.08 66.55 9.14 50.71 67.89 8.88 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 47.11 68.57 13.19 49.07 68.74 12.45 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 49.32 64.84 19.61 47.95 67.13 18.88 39.68 9.38 -33.42 38.76 7.79 -31.29 1jdw_c01 source 1jdw L-ARGININE-GLYCINE AMIDINOTRANSFERASE : 2 hits 1jdw_c01 naa= 3 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 1 3 # 1 A 396 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 581 ARG A 82 ARG.? 24.76 O1 EDO A 189 A 713 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 67.94 16.79 18.42 70.70 18.25 18.48 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 69.47 19.71 26.08 71.03 22.01 24.70 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 2 3 # 2 A 396 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 581 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 713 ARG A 82 ARG.? 24.76 O1 EDO A 189 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 67.94 16.79 18.42 70.70 18.25 18.48 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 61.14 12.50 23.45 58.83 13.31 25.34 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 69.47 19.71 26.08 71.03 22.01 24.70 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 3 3 # 3 A 396 ARG A 82 ARG.? 24.76 O1 EDO A 189 A 581 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 713 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 69.47 19.71 26.08 71.03 22.01 24.70 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 67.94 16.79 18.42 70.70 18.25 18.48 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 4 3 # 4 A 396 ARG A 82 ARG.? 24.76 O1 EDO A 189 A 581 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 713 ARG A 60 ARG^? 18.80 O1 EDO A 189 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 69.47 19.71 26.08 71.03 22.01 24.70 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 61.14 12.50 23.45 58.83 13.31 25.34 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 67.94 16.79 18.42 70.70 18.25 18.48 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 5 3 # 5 A 396 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 581 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 713 ARG A 82 ARG.? 24.76 O1 EDO A 189 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 61.14 12.50 23.45 58.83 13.31 25.34 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 67.94 16.79 18.42 70.70 18.25 18.48 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 69.47 19.71 26.08 71.03 22.01 24.70 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 6 3 # 6 A 396 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 581 ARG A 82 ARG.? 24.76 O1 EDO A 189 A 713 ARG A 60 ARG^? 18.80 O1 EDO A 189 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 61.14 12.50 23.45 58.83 13.31 25.34 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 69.47 19.71 26.08 71.03 22.01 24.70 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 67.94 16.79 18.42 70.70 18.25 18.48 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 7 3 # 7 A 396 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 581 ARG B 82 ARG.? 22.52 O2 EDO B 193 A 713 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 8 3 # 8 A 396 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 581 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 713 ARG B 82 ARG.? 22.52 O2 EDO B 193 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 46.69 11.07 -43.02 44.95 12.59 -45.09 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 9 3 # 9 A 396 ARG B 82 ARG.? 22.52 O2 EDO B 193 A 581 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 713 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 10 3 # 10 A 396 ARG B 82 ARG.? 22.52 O2 EDO B 193 A 581 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 713 ARG B 60 ARG^? 18.79 C1 EDO B 189 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 50.13 14.01 -35.69 52.36 12.88 -37.47 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 11 3 # 11 A 396 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 581 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 713 ARG B 82 ARG.? 22.52 O2 EDO B 193 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 46.69 11.07 -43.02 44.95 12.59 -45.09 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 12 3 # 12 A 396 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 581 ARG B 82 ARG.? 22.52 O2 EDO B 193 A 713 ARG B 60 ARG^? 18.79 C1 EDO B 189 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 50.13 14.01 -35.69 52.36 12.88 -37.47 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 13 3 # 13 A 396 ARG B 129 ARG^? 16.59 O2 MPD B 194 A 581 ARG B 141 ARG^? 5.70 O4 MPD B 194 A 713 ARG B 144 ARG^? 12.29 O2 MPD B 194 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 35.59 7.18 -33.96 34.54 5.79 -36.47 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 28.02 7.86 -31.66 25.29 9.13 -32.53 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 14 3 # 14 A 396 ARG B 129 ARG^? 16.59 O2 MPD B 194 A 581 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 713 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 35.59 7.18 -33.96 34.54 5.79 -36.47 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 34.68 4.05 -23.26 33.98 5.70 -20.76 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 15 3 # 15 A 396 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 581 ARG B 129 ARG^? 16.59 O2 MPD B 194 A 713 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 35.59 7.18 -33.96 34.54 5.79 -36.47 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 34.68 4.05 -23.26 33.98 5.70 -20.76 ULMN 3 1jqn_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 16 3 # 16 A 396 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 581 ARG B 141 ARG^? 5.70 O4 MPD B 194 A 713 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 23.87 26.44 -10.48 23.95 28.93 -12.26 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 27.15 35.19 -13.19 28.74 37.24 -14.84 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 23.13 28.56 -19.97 22.88 27.45 -17.11 35.59 7.18 -33.96 34.54 5.79 -36.47 1jqn_c01 source 1jqn PHOSPHOENOLPYRUVATE CARBOXYLASE : 16 hits 1jqn_c01 naa= 3 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 # 1 B 55 ASP A 28 ASP.? 17.25 C2 EDO A 189 B 58 ASP A 27 ASP.? 13.04 O1 EDO B 190 B 424 GLU A 26 GLU.? 10.86 O2 EDO A 189 coo 112.10 61.46 19.99 111.82 60.65 18.07 68.65 8.60 12.81 69.48 7.64 14.53 coo 117.85 63.62 21.08 115.96 63.25 20.18 68.29 3.95 12.18 68.54 1.87 11.74 coo 118.47 57.23 15.57 119.32 58.77 16.73 66.27 6.09 6.28 67.77 7.37 5.57 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 2 3 # 2 B 55 ASP B 28 ASP.? 13.72 O2 EDO B 189 B 58 ASP B 27 ASP.? 13.66 O1 EDO A 188 B 424 GLU B 26 GLU.? 11.31 O2 EDO B 189 coo 112.10 61.46 19.99 111.82 60.65 18.07 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 117.85 63.62 21.08 115.96 63.25 20.18 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 118.47 57.23 15.57 119.32 58.77 16.73 55.48 25.40 -24.73 57.31 24.35 -24.78 1js4_c01 source 1js4 ENDO-EXOCELLULASE E4 : 2 hits 1js4_c01 naa= 3 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 A 2 GLU A 67 GLU^? 10.03 C1 EDO A 189 A 56 LYS A 74 LYS^? 9.41 O1 EDO A 189 A 258 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 42.33 1.56 26.99 42.38 2.91 28.66 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 38.45 -0.44 19.89 37.36 0.90 25.90 58.34 25.75 2.84 62.12 26.28 -2.26 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 A 2 GLU B 67 GLU^? -5.72 C1 EDO A 190s A 56 LYS B 74 LYS^? 9.11 O1 EDO B 189 A 258 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 42.33 1.56 26.99 42.38 2.91 28.66 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 38.45 -0.44 19.89 37.36 0.90 25.90 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 48.60 18.31 -7.03 51.67 18.96 -6.78 1k82_c00 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 2 hits 1k82_c00 naa= 3 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 B 2 GLU A 67 GLU^? 10.03 C1 EDO A 189 B 56 LYS A 74 LYS^? 9.41 O1 EDO A 189 B 258 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 58.34 25.75 2.84 62.12 26.28 -2.26 coo 2.64 1.83 34.81 1.56 1.13 32.02 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 B 2 GLU B 67 GLU^? -5.72 C1 EDO A 190s B 56 LYS B 74 LYS^? 9.11 O1 EDO B 189 B 258 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 2.64 1.83 34.81 1.56 1.13 32.02 48.60 18.31 -7.03 51.67 18.96 -6.78 1k82_c01 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 2 hits 1k82_c01 naa= 3 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 C 2 GLU A 67 GLU^? 10.03 C1 EDO A 189 C 56 LYS A 74 LYS^? 9.41 O1 EDO A 189 C 258 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 58.34 25.75 2.84 62.12 26.28 -2.26 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 C 2 GLU B 67 GLU^? -5.72 C1 EDO A 190s C 56 LYS B 74 LYS^? 9.11 O1 EDO B 189 C 258 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 48.60 18.31 -7.03 51.67 18.96 -6.78 1k82_c02 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 2 hits 1k82_c02 naa= 3 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 D 2 GLU A 67 GLU^? 10.03 C1 EDO A 189 D 56 LYS A 74 LYS^? 9.41 O1 EDO A 189 D 258 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 58.34 25.75 2.84 62.12 26.28 -2.26 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 D 2 GLU B 67 GLU^? -5.72 C1 EDO A 190s D 56 LYS B 74 LYS^? 9.11 O1 EDO B 189 D 258 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 48.60 18.31 -7.03 51.67 18.96 -6.78 1k82_c03 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 2 hits 1k82_c03 naa= 3 ULMN 3 1kim_c00 THYMIDINE KINASE user 1 3 # 1 A 83 GLU A 31 GLU^? -3.45 O2 EDO A 189s A 163 ARG A 50 ARG^? 6.80 C2 EDO A 189 A 222 ARG A 24 ARG^? 7.27 O2 EDO A 189 coo 51.27 81.34 48.31 51.67 80.79 50.28 61.87 12.13 2.43 62.94 11.86 0.64 coo 48.06 78.22 50.94 48.51 78.27 53.98 65.37 14.47 5.23 66.89 16.94 6.37 coo 54.85 84.16 52.60 54.26 81.23 53.34 63.21 5.10 1.62 63.59 8.06 0.82 ULMN 3 1kim_c00 THYMIDINE KINASE user 2 3 # 2 A 83 GLU B 31 GLU^? -3.64 O2 EDO B 189s A 163 ARG B 24 ARG^? 8.74 O1 EDO A 188 A 222 ARG B 50 ARG^? -6.93 O2 EDO B 189s coo 51.27 81.34 48.31 51.67 80.79 50.28 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 48.06 78.22 50.94 48.51 78.27 53.98 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 54.85 84.16 52.60 54.26 81.23 53.34 55.72 16.68 -23.20 56.85 15.32 -25.75 ULMN 3 1kim_c00 THYMIDINE KINASE user 3 3 # 3 A 83 GLU B 31 GLU^? -3.64 O2 EDO B 189s A 163 ARG B 50 ARG^? -6.93 O2 EDO B 189s A 222 ARG B 24 ARG^? 8.74 O1 EDO A 188 coo 51.27 81.34 48.31 51.67 80.79 50.28 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 48.06 78.22 50.94 48.51 78.27 53.98 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 54.85 84.16 52.60 54.26 81.23 53.34 54.81 25.46 -16.99 55.14 28.36 -15.99 ULMN 3 1kim_c00 THYMIDINE KINASE user 4 3 # 4 A 83 GLU B 61 GLU^? 10.17 C1 EDO B 189 A 163 ARG B 52 ARG^? 13.54 O2 EDO B 189 A 222 ARG B 50 ARG^? -6.93 O2 EDO B 189s coo 51.27 81.34 48.31 51.67 80.79 50.28 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 48.06 78.22 50.94 48.51 78.27 53.98 55.40 16.98 -30.43 55.13 14.61 -32.43 coo 54.85 84.16 52.60 54.26 81.23 53.34 55.72 16.68 -23.20 56.85 15.32 -25.75 1kim_c00 source 1kim THYMIDINE KINASE : 4 hits 1kim_c00 naa= 3 ULMN 3 1knp_c00 L-ASPARTATE OXIDASE user 1 3 # 1 A 290 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 351 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 386 LEU A 59 LEU^? 13.44 O1 EDO A 189 coo 57.36 53.34 128.83 58.45 50.56 128.34 67.94 16.79 18.42 70.70 18.25 18.48 coo 60.60 50.64 133.59 60.63 48.82 132.56 64.74 13.84 22.58 64.60 13.48 24.65 coo 63.28 54.23 126.45 63.53 52.07 126.70 61.94 16.27 16.74 61.27 16.69 14.73 ULMN 3 1knp_c00 L-ASPARTATE OXIDASE user 2 3 # 2 A 290 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 351 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 386 LEU B 59 LEU^? 13.53 C1 EDO B 189 coo 57.36 53.34 128.83 58.45 50.56 128.34 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 60.60 50.64 133.59 60.63 48.82 132.56 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 63.28 54.23 126.45 63.53 52.07 126.70 46.10 14.41 -30.73 47.37 13.70 -29.11 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 48 ASP^? -5.54 C1 EDO A 189s 262 LYS A 74 LYS^? 9.41 O1 EDO A 189 336 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 61.88 50.78 12.96 63.84 50.60 13.71 57.58 16.65 0.08 56.71 16.10 -1.78 coo 63.59 44.40 18.32 63.20 49.74 17.95 58.34 25.75 2.84 62.12 26.28 -2.26 coo 72.60 57.42 15.86 71.61 56.68 18.70 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP B 48 ASP^? 5.72 O1 EDO B 189 262 LYS B 74 LYS^? 9.11 O1 EDO B 189 336 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 61.88 50.78 12.96 63.84 50.60 13.71 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 63.59 44.40 18.32 63.20 49.74 17.95 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 72.60 57.42 15.86 71.61 56.68 18.70 49.65 12.45 -3.94 51.87 11.63 -5.97 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 2 hits 1lam_c00 naa= 3 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 1 3 # 1 166 ASP A 80 ASP.? 21.91 O1 EDO A 189 169 ARG A 60 ARG^? 18.80 O1 EDO A 189 193 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 20.88 15.91 3.60 20.25 17.72 4.50 68.63 22.07 21.16 67.50 22.56 22.86 coo 17.70 17.91 -0.80 15.74 19.74 0.84 67.94 16.79 18.42 70.70 18.25 18.48 coo 18.81 19.85 7.63 17.55 19.89 5.97 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 2 3 # 2 166 ASP A 80 ASP.? 21.91 O1 EDO A 189 169 ARG A 82 ARG.? 24.76 O1 EDO A 189 193 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 20.88 15.91 3.60 20.25 17.72 4.50 68.63 22.07 21.16 67.50 22.56 22.86 coo 17.70 17.91 -0.80 15.74 19.74 0.84 69.47 19.71 26.08 71.03 22.01 24.70 coo 18.81 19.85 7.63 17.55 19.89 5.97 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 3 3 # 3 166 ASP A 151 ASP^? 20.35 CM MPD A 191 169 ARG A 149 ARG^? 22.01 CM MPD A 191 193 HIS A 154 HIS^? 17.90 CM MPD A 191 coo 20.88 15.91 3.60 20.25 17.72 4.50 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 17.70 17.91 -0.80 15.74 19.74 0.84 53.15 0.69 27.47 54.83 -1.87 27.18 coo 18.81 19.85 7.63 17.55 19.89 5.97 45.67 -1.54 22.26 44.90 -3.17 21.19 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 4 3 # 4 166 ASP B 80 ASP.? 22.03 C1 EDO B 189 169 ARG B 60 ARG^? 18.79 C1 EDO B 189 193 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 20.88 15.91 3.60 20.25 17.72 4.50 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 17.70 17.91 -0.80 15.74 19.74 0.84 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 18.81 19.85 7.63 17.55 19.89 5.97 45.35 5.36 -39.37 44.27 5.71 -41.13 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 5 3 # 5 166 ASP B 80 ASP.? 22.03 C1 EDO B 189 169 ARG B 82 ARG.? 22.52 O2 EDO B 193 193 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 20.88 15.91 3.60 20.25 17.72 4.50 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 17.70 17.91 -0.80 15.74 19.74 0.84 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 18.81 19.85 7.63 17.55 19.89 5.97 45.35 5.36 -39.37 44.27 5.71 -41.13 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 6 3 # 6 166 ASP B 151 ASP^? -3.26 O1 EDO B 192s 169 ARG B 149 ARG^? 5.09 O2 EDO B 193 193 HIS B 154 HIS^? 5.27 C1 EDO B 192 coo 20.88 15.91 3.60 20.25 17.72 4.50 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 17.70 17.91 -0.80 15.74 19.74 0.84 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 18.81 19.85 7.63 17.55 19.89 5.97 29.58 31.84 -25.39 29.63 33.61 -24.25 1ldm_c01 source 1ldm M4 LACTATE DEHYDROGENASE : 6 hits 1ldm_c01 naa= 3 ULMN 3 1lij_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 79 ALA^? 16.03 O1 EDO A 189 A 317 GLY A 81 GLY.? 20.02 O1 EDO A 189 A 318 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 65.24 21.66 17.68 64.04 20.76 17.95 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 66.26 17.90 21.72 66.27 18.63 22.08 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1lij_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA B 79 ALA^? 16.25 C1 EDO B 189 A 317 GLY B 81 GLY.? 19.64 C2 EDO B 193 A 318 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 46.71 12.75 -37.37 46.59 12.01 -37.69 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 49.28 8.80 -38.48 47.34 8.18 -39.14 1lij_c01 source 1lij ADENOSINE KINASE : 2 hits 1lij_c01 naa= 3 ULMN 3 1lio_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 79 ALA^? 16.03 O1 EDO A 189 A 317 GLY A 81 GLY.? 20.02 O1 EDO A 189 A 318 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 27.04 23.54 41.85 25.72 24.19 42.18 65.24 21.66 17.68 64.04 20.76 17.95 coo 27.87 23.16 38.17 28.43 22.97 38.87 66.26 17.90 21.72 66.27 18.63 22.08 coo 32.11 22.71 40.58 33.42 24.22 39.78 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1lio_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA B 79 ALA^? 16.25 C1 EDO B 189 A 317 GLY B 81 GLY.? 19.64 C2 EDO B 193 A 318 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 27.04 23.54 41.85 25.72 24.19 42.18 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 27.87 23.16 38.17 28.43 22.97 38.87 46.71 12.75 -37.37 46.59 12.01 -37.69 coo 32.11 22.71 40.58 33.42 24.22 39.78 49.28 8.80 -38.48 47.34 8.18 -39.14 1lio_c01 source 1lio ADENOSINE KINASE : 2 hits 1lio_c01 naa= 3 ULMN 3 1m53_c03 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 295 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 369 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 11.74 38.14 80.19 10.63 36.40 80.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 16.11 33.72 80.99 14.10 33.54 81.63 66.27 6.09 6.28 67.77 7.37 5.57 coo 12.19 31.08 87.29 11.13 32.66 86.38 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1m53_c03 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 295 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 369 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 11.74 38.14 80.19 10.63 36.40 80.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 16.11 33.72 80.99 14.10 33.54 81.63 66.27 6.09 6.28 67.77 7.37 5.57 coo 12.19 31.08 87.29 11.13 32.66 86.38 68.65 8.60 12.81 69.48 7.64 14.53 1m53_c03 source 1m53 ISOMALTULOSE SYNTHASE : 2 hits 1m53_c03 naa= 3 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 265 GLU B 61 GLU^? 10.17 C1 EDO B 189 A 369 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 11.74 38.14 80.19 10.63 36.40 80.65 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 17.36 23.57 72.04 18.68 21.92 71.98 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 12.19 31.08 87.29 11.13 32.66 86.38 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 265 GLU B 173 GLU.? 7.59 O1 EDO B 193 A 369 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo 11.74 38.14 80.19 10.63 36.40 80.65 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 17.36 23.57 72.04 18.68 21.92 71.98 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 12.19 31.08 87.29 11.13 32.66 86.38 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 265 GLU A 61 GLU^? 10.22 O1 EDO A 189 A 369 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 11.74 38.14 80.19 10.63 36.40 80.65 68.29 3.95 12.18 68.54 1.87 11.74 coo 17.36 23.57 72.04 18.68 21.92 71.98 66.46 19.59 10.29 68.35 19.61 9.28 coo 12.19 31.08 87.29 11.13 32.66 86.38 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 4 3 # 4 A 241 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 265 GLU A 173 GLU.? 15.20 O1 EDO B 190 A 369 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 11.74 38.14 80.19 10.63 36.40 80.65 68.29 3.95 12.18 68.54 1.87 11.74 coo 17.36 23.57 72.04 18.68 21.92 71.98 56.04 -5.91 18.03 55.52 -6.78 16.19 coo 12.19 31.08 87.29 11.13 32.66 86.38 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 5 3 # 5 A 241 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 265 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 369 ASP A 101 ASP^? 14.06 CM MPD A 191 coo 11.74 38.14 80.19 10.63 36.40 80.65 66.73 9.65 23.28 68.51 8.93 24.16 coo 17.36 23.57 72.04 18.68 21.92 71.98 66.27 6.09 6.28 67.77 7.37 5.57 coo 12.19 31.08 87.29 11.13 32.66 86.38 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 6 3 # 6 A 241 ASP A 101 ASP^? 14.06 CM MPD A 191 A 265 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 369 ASP A 56 ASP.? 24.62 C2 EDO A 189 coo 11.74 38.14 80.19 10.63 36.40 80.65 57.05 15.04 20.11 57.86 14.10 21.77 coo 17.36 23.57 72.04 18.68 21.92 71.98 66.27 6.09 6.28 67.77 7.37 5.57 coo 12.19 31.08 87.29 11.13 32.66 86.38 66.73 9.65 23.28 68.51 8.93 24.16 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 7 3 # 7 A 241 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 265 GLU B 69 GLU.? -7.04 C2 EDO B 191s A 369 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 11.74 38.14 80.19 10.63 36.40 80.65 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 17.36 23.57 72.04 18.68 21.92 71.98 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 12.19 31.08 87.29 11.13 32.66 86.38 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 8 3 # 8 A 241 ASP A 179 ASP^? 16.86 CM MPD A 191 A 265 GLU B 69 GLU.? -7.04 C2 EDO B 191s A 369 ASP A 172 ASP.? 13.07 O1 EDO B 190 coo 11.74 38.14 80.19 10.63 36.40 80.65 43.85 0.70 13.63 43.61 -0.87 12.28 coo 17.36 23.57 72.04 18.68 21.92 71.98 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 12.19 31.08 87.29 11.13 32.66 86.38 53.63 -2.61 14.65 54.96 -1.14 13.93 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 9 3 # 9 A 241 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 265 GLU A 61 GLU^? 10.22 O1 EDO A 189 A 369 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 11.74 38.14 80.19 10.63 36.40 80.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 17.36 23.57 72.04 18.68 21.92 71.98 66.46 19.59 10.29 68.35 19.61 9.28 coo 12.19 31.08 87.29 11.13 32.66 86.38 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 10 3 # 10 A 241 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 265 GLU A 173 GLU.? 15.20 O1 EDO B 190 A 369 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 11.74 38.14 80.19 10.63 36.40 80.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 17.36 23.57 72.04 18.68 21.92 71.98 56.04 -5.91 18.03 55.52 -6.78 16.19 coo 12.19 31.08 87.29 11.13 32.66 86.38 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 11 3 # 11 A 241 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 265 GLU B 61 GLU^? 10.17 C1 EDO B 189 A 369 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 11.74 38.14 80.19 10.63 36.40 80.65 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 17.36 23.57 72.04 18.68 21.92 71.98 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 12.19 31.08 87.29 11.13 32.66 86.38 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 12 3 # 12 A 241 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 265 GLU B 173 GLU.? 7.59 O1 EDO B 193 A 369 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 11.74 38.14 80.19 10.63 36.40 80.65 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 17.36 23.57 72.04 18.68 21.92 71.98 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 12.19 31.08 87.29 11.13 32.66 86.38 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 13 3 # 13 A 241 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 265 GLU B 173 GLU.? 7.59 O1 EDO B 193 A 369 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo 11.74 38.14 80.19 10.63 36.40 80.65 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 17.36 23.57 72.04 18.68 21.92 71.98 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 12.19 31.08 87.29 11.13 32.66 86.38 45.79 20.82 -38.80 46.38 21.52 -40.72 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 14 3 # 14 A 241 ASP B 56 ASP.? 14.25 C2 EDO B 193 A 265 GLU B 26 GLU.? 11.31 O2 EDO B 189 A 369 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 11.74 38.14 80.19 10.63 36.40 80.65 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 17.36 23.57 72.04 18.68 21.92 71.98 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 12.19 31.08 87.29 11.13 32.66 86.38 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 15 3 # 15 A 241 ASP B 56 ASP.? 14.25 C2 EDO B 193 A 265 GLU B 173 GLU.? 7.59 O1 EDO B 193 A 369 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo 11.74 38.14 80.19 10.63 36.40 80.65 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 17.36 23.57 72.04 18.68 21.92 71.98 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 12.19 31.08 87.29 11.13 32.66 86.38 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 16 3 # 16 A 241 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 265 GLU B 26 GLU.? 11.31 O2 EDO B 189 A 369 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo 11.74 38.14 80.19 10.63 36.40 80.65 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 17.36 23.57 72.04 18.68 21.92 71.98 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 12.19 31.08 87.29 11.13 32.66 86.38 45.79 20.82 -38.80 46.38 21.52 -40.72 1m53_c05 source 1m53 ISOMALTULOSE SYNTHASE : 16 hits 1m53_c05 naa= 3 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 279 GLU A 67 GLU^? 10.03 C1 EDO A 189 A 369 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 11.74 38.14 80.19 10.63 36.40 80.65 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 16.54 46.37 63.94 14.77 45.79 62.95 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 12.19 31.08 87.29 11.13 32.66 86.38 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 279 GLU A 67 GLU^? 10.03 C1 EDO A 189 A 369 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo 11.74 38.14 80.19 10.63 36.40 80.65 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 16.54 46.37 63.94 14.77 45.79 62.95 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 12.19 31.08 87.29 11.13 32.66 86.38 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 279 GLU A 127 GLU^? 13.22 O2 MPD A 191 A 369 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 11.74 38.14 80.19 10.63 36.40 80.65 66.73 9.65 23.28 68.51 8.93 24.16 coo 16.54 46.37 63.94 14.77 45.79 62.95 49.68 14.95 31.31 48.32 16.27 32.27 coo 12.19 31.08 87.29 11.13 32.66 86.38 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 4 3 # 4 A 241 ASP A 101 ASP^? 14.06 CM MPD A 191 A 279 GLU A 139 GLU.? 13.74 O4 MPD A 191 A 369 ASP A 56 ASP.? 24.62 C2 EDO A 189 coo 11.74 38.14 80.19 10.63 36.40 80.65 57.05 15.04 20.11 57.86 14.10 21.77 coo 16.54 46.37 63.94 14.77 45.79 62.95 50.77 29.24 9.79 48.92 30.09 9.22 coo 12.19 31.08 87.29 11.13 32.66 86.38 66.73 9.65 23.28 68.51 8.93 24.16 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 5 3 # 5 A 241 ASP A 179 ASP^? 16.86 CM MPD A 191 A 279 GLU A 39 GLU.? 8.26 C5 MPD A 191 A 369 ASP A 172 ASP.? 13.07 O1 EDO B 190 coo 11.74 38.14 80.19 10.63 36.40 80.65 43.85 0.70 13.63 43.61 -0.87 12.28 coo 16.54 46.37 63.94 14.77 45.79 62.95 40.24 18.97 5.60 41.21 18.63 7.48 coo 12.19 31.08 87.29 11.13 32.66 86.38 53.63 -2.61 14.65 54.96 -1.14 13.93 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 6 3 # 6 A 241 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 279 GLU B 67 GLU^? -5.72 C1 EDO A 190s A 369 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 11.74 38.14 80.19 10.63 36.40 80.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 16.54 46.37 63.94 14.77 45.79 62.95 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 12.19 31.08 87.29 11.13 32.66 86.38 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 7 3 # 7 A 241 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 279 GLU B 67 GLU^? -5.72 C1 EDO A 190s A 369 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 11.74 38.14 80.19 10.63 36.40 80.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 16.54 46.37 63.94 14.77 45.79 62.95 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 12.19 31.08 87.29 11.13 32.66 86.38 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 8 3 # 8 A 241 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 279 GLU B 69 GLU.? -7.04 C2 EDO B 191s A 369 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 11.74 38.14 80.19 10.63 36.40 80.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 16.54 46.37 63.94 14.77 45.79 62.95 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 12.19 31.08 87.29 11.13 32.66 86.38 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 9 3 # 9 A 241 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 279 GLU B 173 GLU.? 7.59 O1 EDO B 193 A 369 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 11.74 38.14 80.19 10.63 36.40 80.65 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 16.54 46.37 63.94 14.77 45.79 62.95 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 12.19 31.08 87.29 11.13 32.66 86.38 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 10 3 # 10 A 241 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 279 GLU B 139 GLU.? 9.67 O2 EDO B 191 A 369 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo 11.74 38.14 80.19 10.63 36.40 80.65 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 16.54 46.37 63.94 14.77 45.79 62.95 41.80 1.11 -18.67 40.76 -0.16 -17.27 coo 12.19 31.08 87.29 11.13 32.66 86.38 45.79 20.82 -38.80 46.38 21.52 -40.72 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 11 3 # 11 A 241 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 279 GLU B 39 GLU.? -2.97 O2 EDO B 188s A 369 ASP B 172 ASP.? 7.16 C1 EDO B 193 coo 11.74 38.14 80.19 10.63 36.40 80.65 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 16.54 46.37 63.94 14.77 45.79 62.95 35.53 10.88 -8.90 35.33 11.18 -11.01 coo 12.19 31.08 87.29 11.13 32.66 86.38 40.45 32.96 -23.62 41.93 31.48 -23.99 1m53_c06 source 1m53 ISOMALTULOSE SYNTHASE : 11 hits 1m53_c06 naa= 3 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 # 1 159 ARG A 50 ARG^? 6.80 C2 EDO A 189 229 SER A 32 SER^? 8.67 O2 EDO A 189 325 GLU A 31 GLU^? -3.45 O2 EDO A 189s coo 2.54 15.84 18.57 3.24 17.85 16.30 65.37 14.47 5.23 66.89 16.94 6.37 coo 10.17 13.48 15.92 9.61 15.76 15.27 57.30 11.17 3.38 55.16 10.90 4.47 coo 5.42 13.04 19.75 5.74 13.81 17.79 61.87 12.13 2.43 62.94 11.86 0.64 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 2 3 # 2 159 ARG A 144 ARG^? 11.59 O2 MPD A 191 229 SER A 142 SER^? 11.36 O4 MPD A 191 325 GLU A 161 GLU.? 9.37 O2 MPD A 191 coo 2.54 15.84 18.57 3.24 17.85 16.30 48.95 22.48 28.26 46.62 21.31 29.92 coo 10.17 13.48 15.92 9.61 15.76 15.27 52.28 24.44 20.99 51.62 26.22 22.49 coo 5.42 13.04 19.75 5.74 13.81 17.79 45.67 22.34 23.77 46.84 23.71 24.88 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 3 3 # 3 159 ARG B 50 ARG^? -6.93 O2 EDO B 189s 229 SER B 32 SER^? 8.66 C2 EDO B 189 325 GLU B 31 GLU^? -3.64 O2 EDO B 189s coo 2.54 15.84 18.57 3.24 17.85 16.30 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 10.17 13.48 15.92 9.61 15.76 15.27 50.26 19.40 -17.21 47.97 19.77 -16.73 coo 5.42 13.04 19.75 5.74 13.81 17.79 54.51 18.58 -19.03 56.60 18.34 -19.10 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 4 3 # 4 159 ARG B 144 ARG^? 12.29 O2 MPD B 194 229 SER B 142 SER^? 12.79 C3 MPD B 194 325 GLU B 161 GLU.? 9.05 O2 MPD B 194 coo 2.54 15.84 18.57 3.24 17.85 16.30 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 10.17 13.48 15.92 9.61 15.76 15.27 36.25 6.04 -28.61 35.21 4.32 -29.92 coo 5.42 13.04 19.75 5.74 13.81 17.79 28.86 7.94 -26.27 29.12 6.39 -27.73 1mbb_c00 source 1mbb URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMI: 4 hits 1mbb_c00 naa= 3 ULMN 3 1mpp_c04 PEPSIN (RENIN) (E.C.3.4.23.23) user 1 3 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 20.97 14.47 32.28 19.66 15.96 31.62 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 16.04 14.72 33.82 17.27 13.71 31.95 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 20.65 22.00 33.80 20.06 20.56 32.39 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1mpp_c04 PEPSIN (RENIN) (E.C.3.4.23.23) user 2 3 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 20.97 14.47 32.28 19.66 15.96 31.62 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 16.04 14.72 33.82 17.27 13.71 31.95 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 20.65 22.00 33.80 20.06 20.56 32.39 28.45 32.01 -35.99 29.78 33.29 -34.96 1mpp_c04 source 1mpp PEPSIN (RENIN) (E.C.3.4.23.23) : 2 hits 1mpp_c04 naa= 3 ULMN 3 1mpy_c01 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 B 199 HIS B 76 HIS^? 9.10 C1 EDO B 189 B 246 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 255 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 53.99 30.51 -6.27 55.94 30.59 -7.04 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 63.25 31.40 -4.63 63.50 32.04 -6.62 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 65.74 33.16 -11.89 63.54 33.33 -10.19 48.23 15.25 -19.35 46.43 17.40 -19.57 1mpy_c01 source 1mpy CATECHOL 2,3-DIOXYGENASE : 1 hits 1mpy_c01 naa= 3 ULMN 3 1mpy_c02 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 C 199 HIS A 76 HIS^? 9.12 O1 EDO A 189 C 246 HIS A 65 HIS^? 6.20 C1 EDO A 189 C 255 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo 88.23 -2.44 -2.31 86.28 -2.49 -3.06 65.00 24.12 7.67 66.83 23.12 7.94 coo 79.18 -3.01 0.51 78.86 -4.28 -1.13 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 76.37 -6.84 -5.95 78.54 -6.39 -4.23 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 1mpy_c02 CATECHOL 2,3-DIOXYGENASE user 2 3 # 2 C 199 HIS B 76 HIS^? 9.10 C1 EDO B 189 C 246 HIS B 65 HIS^? -5.26 O1 EDO B 189s C 255 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 88.23 -2.44 -2.31 86.28 -2.49 -3.06 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 79.18 -3.01 0.51 78.86 -4.28 -1.13 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 76.37 -6.84 -5.95 78.54 -6.39 -4.23 48.23 15.25 -19.35 46.43 17.40 -19.57 1mpy_c02 source 1mpy CATECHOL 2,3-DIOXYGENASE : 2 hits 1mpy_c02 naa= 3 ULMN 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 D 199 HIS A 76 HIS^? 9.12 O1 EDO A 189 D 246 HIS A 65 HIS^? 6.20 C1 EDO A 189 D 255 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo 48.45 6.59 -2.19 50.13 5.63 -1.41 65.00 24.12 7.67 66.83 23.12 7.94 coo 56.33 1.43 -3.93 56.30 0.87 -1.91 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 57.78 -0.98 3.43 55.81 -0.18 1.59 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 2 3 # 2 D 199 HIS B 76 HIS^? 9.10 C1 EDO B 189 D 246 HIS B 65 HIS^? -5.26 O1 EDO B 189s D 255 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 48.45 6.59 -2.19 50.13 5.63 -1.41 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 56.33 1.43 -3.93 56.30 0.87 -1.91 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 57.78 -0.98 3.43 55.81 -0.18 1.59 48.23 15.25 -19.35 46.43 17.40 -19.57 1mpy_c03 source 1mpy CATECHOL 2,3-DIOXYGENASE : 2 hits 1mpy_c03 naa= 3 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 # 1 A 465 GLY A 42 GLY.? 16.43 O2 EDO A 190 A 501 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 367 TYR A 157 TYR^? -4.51 CM MPD A 191s coo 4.40 25.46 -23.33 5.00 25.87 -23.68 38.18 21.47 -1.45 38.85 21.88 -1.59 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 2 3 # 2 A 465 GLY A 42 GLY.? 16.43 O2 EDO A 190 A 501 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 367 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 38.18 21.47 -1.45 38.85 21.88 -1.59 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 55.88 2.21 7.80 57.52 0.60 9.42 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 3 3 # 3 A 465 GLY B 42 GLY.? 7.35 O1 EDO B 191 A 501 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 367 TYR B 157 TYR^? -4.69 O2 MPD B 194s coo 4.40 25.46 -23.33 5.00 25.87 -23.68 38.20 8.45 -1.85 38.82 8.13 -2.23 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 57.58 16.65 0.08 56.71 16.10 -1.78 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 30.68 18.93 -24.72 31.20 16.23 -24.55 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 4 3 # 4 A 465 GLY B 42 GLY.? 7.35 O1 EDO B 191 A 501 ASP A 103 ASP^? 5.49 CM MPD A 191 B 367 TYR A 7 TYR^? -3.69 C1 EDO A 188s coo 4.40 25.46 -23.33 5.00 25.87 -23.68 38.20 8.45 -1.85 38.82 8.13 -2.23 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 51.58 16.40 16.66 49.70 15.49 16.18 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 46.26 28.35 -19.62 46.61 30.00 -21.81 1mro_c00 source 1mro METHYL-COENZYME M REDUCTASE : 4 hits 1mro_c00 naa= 3 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 # 1 D 465 GLY A 42 GLY.? 16.43 O2 EDO A 190 D 501 ASP B 48 ASP^? 5.72 O1 EDO B 189 E 367 TYR A 157 TYR^? -4.51 CM MPD A 191s coo 21.60 60.44 -42.77 21.61 59.72 -42.40 38.18 21.47 -1.45 38.85 21.88 -1.59 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 2 3 # 2 D 465 GLY A 42 GLY.? 16.43 O2 EDO A 190 D 501 ASP B 103 ASP^? 5.57 C5 MPD B 194 E 367 TYR B 7 TYR^? 8.72 O1 EDO B 190 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 38.18 21.47 -1.45 38.85 21.88 -1.59 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 55.88 2.21 7.80 57.52 0.60 9.42 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 3 3 # 3 D 465 GLY B 42 GLY.? 7.35 O1 EDO B 191 D 501 ASP A 48 ASP^? -5.54 C1 EDO A 189s E 367 TYR B 157 TYR^? -4.69 O2 MPD B 194s coo 21.60 60.44 -42.77 21.61 59.72 -42.40 38.20 8.45 -1.85 38.82 8.13 -2.23 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 57.58 16.65 0.08 56.71 16.10 -1.78 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 30.68 18.93 -24.72 31.20 16.23 -24.55 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 4 3 # 4 D 465 GLY B 42 GLY.? 7.35 O1 EDO B 191 D 501 ASP A 103 ASP^? 5.49 CM MPD A 191 E 367 TYR A 7 TYR^? -3.69 C1 EDO A 188s coo 21.60 60.44 -42.77 21.61 59.72 -42.40 38.20 8.45 -1.85 38.82 8.13 -2.23 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 51.58 16.40 16.66 49.70 15.49 16.18 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 46.26 28.35 -19.62 46.61 30.00 -21.81 1mro_c01 source 1mro METHYL-COENZYME M REDUCTASE : 4 hits 1mro_c01 naa= 3 ULMN 3 1myr_c00 MYROSINASE user 1 3 # 1 187 GLN A 145 GLN^? 5.80 O2 MPD A 191 328 ASN A 159 ASN^? -4.07 O2 MPD A 191s 409 GLU A 161 GLU.? 9.37 O2 MPD A 191 coo 45.09 114.33 52.30 45.59 116.18 51.29 49.04 16.64 22.28 49.83 15.93 20.47 coo 41.10 116.46 52.80 42.09 116.00 54.64 42.89 17.02 22.62 43.08 19.17 22.53 coo 42.69 118.64 56.27 44.58 118.34 55.45 45.67 22.34 23.77 46.84 23.71 24.88 ULMN 3 1myr_c00 MYROSINASE user 2 3 # 2 187 GLN B 145 GLN^? 5.59 O2 MPD B 194 328 ASN B 159 ASN^? -3.69 O2 MPD B 194s 409 GLU B 161 GLU.? 9.05 O2 MPD B 194 coo 45.09 114.33 52.30 45.59 116.18 51.29 32.37 13.58 -27.30 34.23 14.31 -26.47 coo 41.10 116.46 52.80 42.09 116.00 54.64 27.54 13.31 -23.84 27.90 11.24 -23.52 coo 42.69 118.64 56.27 44.58 118.34 55.45 28.86 7.94 -26.27 29.12 6.39 -27.73 1myr_c00 source 1myr MYROSINASE : 2 hits 1myr_c00 naa= 3 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 A 114 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 197 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 223 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 64.74 13.84 22.58 64.60 13.48 24.65 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 68.86 12.45 19.04 67.57 12.48 20.71 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 A 114 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 197 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 223 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 64.74 13.84 22.58 64.60 13.48 24.65 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 68.63 22.07 21.16 67.50 22.56 22.86 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 # 3 A 114 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 197 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 223 ALA A 130 ALA^? 8.62 C3 MPD A 191 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 64.74 13.84 22.58 64.60 13.48 24.65 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 68.63 22.07 21.16 67.50 22.56 22.86 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 53.71 18.81 21.19 52.67 17.80 20.63 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 4 3 # 4 A 114 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 197 ASP A 101 ASP^? 14.06 CM MPD A 191 A 223 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 64.74 13.84 22.58 64.60 13.48 24.65 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 57.05 15.04 20.11 57.86 14.10 21.77 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 5 3 # 5 A 114 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 197 ASP A 101 ASP^? 14.06 CM MPD A 191 A 223 ALA A 126 ALA^? 14.80 O2 MPD A 191 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 64.74 13.84 22.58 64.60 13.48 24.65 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 57.05 15.04 20.11 57.86 14.10 21.77 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 52.47 11.24 30.35 53.72 10.92 29.58 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 6 3 # 6 A 114 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 197 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 223 ALA A 130 ALA^? 8.62 C3 MPD A 191 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 65.85 25.32 24.26 66.00 24.92 26.31 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 60.01 27.52 25.19 61.63 28.83 24.67 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 53.71 18.81 21.19 52.67 17.80 20.63 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 7 3 # 7 A 114 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 197 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 223 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 50.24 18.54 -36.80 48.17 18.09 -37.17 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 8 3 # 8 A 114 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 197 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 223 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 49.28 8.80 -38.48 47.34 8.18 -39.14 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 9 3 # 9 A 114 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 197 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 223 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 40.06 15.30 -30.43 39.63 16.39 -32.22 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 10 3 # 10 A 114 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 197 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 223 ALA B 126 ALA^? 13.52 O2 EDO B 193 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 40.06 15.30 -30.43 39.63 16.39 -32.22 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 29.97 18.92 -35.95 31.38 19.24 -36.38 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 11 3 # 11 A 114 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 197 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 223 ALA B 130 ALA^? 8.48 O2 MPD B 194 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 36.89 11.57 -29.50 36.35 12.45 -28.44 1n2t_c02 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 11 hits 1n2t_c02 naa= 3 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 B 114 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 197 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 223 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 64.74 13.84 22.58 64.60 13.48 24.65 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 68.86 12.45 19.04 67.57 12.48 20.71 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 B 114 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 197 ASP A 80 ASP.? 21.91 O1 EDO A 189 B 223 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 64.74 13.84 22.58 64.60 13.48 24.65 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 68.63 22.07 21.16 67.50 22.56 22.86 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 # 3 B 114 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 197 ASP A 80 ASP.? 21.91 O1 EDO A 189 B 223 ALA A 130 ALA^? 8.62 C3 MPD A 191 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 64.74 13.84 22.58 64.60 13.48 24.65 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 68.63 22.07 21.16 67.50 22.56 22.86 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 53.71 18.81 21.19 52.67 17.80 20.63 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 4 3 # 4 B 114 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 197 ASP A 101 ASP^? 14.06 CM MPD A 191 B 223 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 64.74 13.84 22.58 64.60 13.48 24.65 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 57.05 15.04 20.11 57.86 14.10 21.77 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 5 3 # 5 B 114 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 197 ASP A 101 ASP^? 14.06 CM MPD A 191 B 223 ALA A 126 ALA^? 14.80 O2 MPD A 191 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 64.74 13.84 22.58 64.60 13.48 24.65 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 57.05 15.04 20.11 57.86 14.10 21.77 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 52.47 11.24 30.35 53.72 10.92 29.58 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 6 3 # 6 B 114 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 197 ASP A 97 ASP~? 21.13 O4 MPD A 191 B 223 ALA A 130 ALA^? 8.62 C3 MPD A 191 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 65.85 25.32 24.26 66.00 24.92 26.31 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 60.01 27.52 25.19 61.63 28.83 24.67 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 53.71 18.81 21.19 52.67 17.80 20.63 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 7 3 # 7 B 114 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 197 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 223 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 50.24 18.54 -36.80 48.17 18.09 -37.17 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 8 3 # 8 B 114 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 197 ASP B 80 ASP.? 22.03 C1 EDO B 189 B 223 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 49.28 8.80 -38.48 47.34 8.18 -39.14 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 9 3 # 9 B 114 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 197 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 223 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 40.06 15.30 -30.43 39.63 16.39 -32.22 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 10 3 # 10 B 114 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 197 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 223 ALA B 126 ALA^? 13.52 O2 EDO B 193 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 40.06 15.30 -30.43 39.63 16.39 -32.22 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 29.97 18.92 -35.95 31.38 19.24 -36.38 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 11 3 # 11 B 114 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 197 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 223 ALA B 130 ALA^? 8.48 O2 MPD B 194 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 36.89 11.57 -29.50 36.35 12.45 -28.44 1n2t_c03 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 11 hits 1n2t_c03 naa= 3 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 1 3 # 1 B 59 GLU A 31 GLU^? -3.45 O2 EDO A 189s B 128 HIS A 65 HIS^? 6.20 C1 EDO A 189 C 263 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 6.12 5.94 82.00 7.16 6.32 83.81 61.87 12.13 2.43 62.94 11.86 0.64 coo 12.51 16.35 80.99 13.16 14.90 82.37 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 11.58 14.94 93.26 12.25 14.03 91.50 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 2 3 # 2 B 59 GLU A 61 GLU^? 10.22 O1 EDO A 189 B 128 HIS A 58 HIS.? 21.11 O2 MPD A 191 C 263 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 6.12 5.94 82.00 7.16 6.32 83.81 66.46 19.59 10.29 68.35 19.61 9.28 coo 12.51 16.35 80.99 13.16 14.90 82.37 64.74 13.84 22.58 64.60 13.48 24.65 coo 11.58 14.94 93.26 12.25 14.03 91.50 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 3 3 # 3 B 59 GLU B 31 GLU^? -3.64 O2 EDO B 189s B 128 HIS B 65 HIS^? -5.26 O1 EDO B 189s C 263 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 6.12 5.94 82.00 7.16 6.32 83.81 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 12.51 16.35 80.99 13.16 14.90 82.37 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 11.58 14.94 93.26 12.25 14.03 91.50 54.34 6.71 -25.28 55.69 7.78 -26.49 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 4 3 # 4 B 59 GLU B 61 GLU^? 10.17 C1 EDO B 189 B 128 HIS B 58 HIS.? 15.15 C2 EDO B 193 C 263 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 6.12 5.94 82.00 7.16 6.32 83.81 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 12.51 16.35 80.99 13.16 14.90 82.37 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 11.58 14.94 93.26 12.25 14.03 91.50 45.35 5.36 -39.37 44.27 5.71 -41.13 1ni4_c00 source 1ni4 PYRUVATE DEHYDROGENASE E1 COMPONENT: ALPHA SUB: 4 hits 1ni4_c00 naa= 3 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 1 3 # 1 A 263 HIS A 76 HIS^? 9.12 O1 EDO A 189 D 59 GLU A 31 GLU^? -3.45 O2 EDO A 189s D 128 HIS A 65 HIS^? 6.20 C1 EDO A 189 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 65.00 24.12 7.67 66.83 23.12 7.94 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 61.87 12.13 2.43 62.94 11.86 0.64 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 58.30 21.39 -1.16 58.14 22.03 -3.16 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 2 3 # 2 A 263 HIS A 84 HIS.? 23.86 O4 MPD A 191 D 59 GLU A 61 GLU^? 10.22 O1 EDO A 189 D 128 HIS A 58 HIS.? 21.11 O2 MPD A 191 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 65.85 25.32 24.26 66.00 24.92 26.31 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 66.46 19.59 10.29 68.35 19.61 9.28 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 64.74 13.84 22.58 64.60 13.48 24.65 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 3 3 # 3 A 263 HIS B 76 HIS^? 9.10 C1 EDO B 189 D 59 GLU B 31 GLU^? -3.64 O2 EDO B 189s D 128 HIS B 65 HIS^? -5.26 O1 EDO B 189s coo 8.65 -19.64 67.59 7.76 -17.92 68.39 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 54.13 9.12 -14.50 55.15 8.45 -12.80 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 4 3 # 4 A 263 HIS B 84 HIS.? 24.24 O2 MPD B 194 D 59 GLU B 61 GLU^? 10.17 C1 EDO B 189 D 128 HIS B 58 HIS.? 15.15 C2 EDO B 193 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 44.68 16.85 -37.12 43.29 17.21 -38.66 1ni4_c01 source 1ni4 PYRUVATE DEHYDROGENASE E1 COMPONENT: ALPHA SUB: 4 hits 1ni4_c01 naa= 3 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 52 ARG^? 13.70 C2 EDO A 189 A 101 ASP A 28 ASP.? 17.25 C2 EDO A 189 A 132 ASP A 54 ASP.? 20.27 C2 EDO A 189 coo 11.61 22.83 17.30 14.06 21.71 15.78 69.17 14.29 10.90 69.97 16.58 12.80 coo 11.37 24.94 11.48 12.48 24.45 13.28 68.65 8.60 12.81 69.48 7.64 14.53 coo 16.14 18.17 13.37 15.92 19.81 14.71 68.86 12.45 19.04 67.57 12.48 20.71 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 101 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 132 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 11.61 22.83 17.30 14.06 21.71 15.78 67.94 16.79 18.42 70.70 18.25 18.48 coo 11.37 24.94 11.48 12.48 24.45 13.28 68.86 12.45 19.04 67.57 12.48 20.71 coo 16.14 18.17 13.37 15.92 19.81 14.71 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 A 99 ARG A 186 ARG^? 11.98 O1 EDO B 190 A 101 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 132 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 11.61 22.83 17.30 14.06 21.71 15.78 51.29 1.08 9.05 52.68 -0.95 10.91 coo 11.37 24.94 11.48 12.48 24.45 13.28 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 16.14 18.17 13.37 15.92 19.81 14.71 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 A 99 ARG B 52 ARG^? 13.54 O2 EDO B 189 A 101 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 132 ASP B 54 ASP.? 15.81 C2 EDO B 193 coo 11.61 22.83 17.30 14.06 21.71 15.78 55.40 16.98 -30.43 55.13 14.61 -32.43 coo 11.37 24.94 11.48 12.48 24.45 13.28 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 16.14 18.17 13.37 15.92 19.81 14.71 50.24 18.54 -36.80 48.17 18.09 -37.17 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 A 99 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 101 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 132 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 11.61 22.83 17.30 14.06 21.71 15.78 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 11.37 24.94 11.48 12.48 24.45 13.28 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 16.14 18.17 13.37 15.92 19.81 14.71 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 A 99 ARG B 186 ARG^? -4.10 O2 EDO A 188s A 101 ASP B 172 ASP.? 7.16 C1 EDO B 193 A 132 ASP B 179 ASP^? 11.34 O2 EDO A 188 coo 11.61 22.83 17.30 14.06 21.71 15.78 42.31 29.46 -17.08 41.98 30.89 -19.84 coo 11.37 24.94 11.48 12.48 24.45 13.28 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 16.14 18.17 13.37 15.92 19.81 14.71 33.06 29.40 -17.37 33.45 31.08 -16.20 1nu3_c00 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 6 hits 1nu3_c00 naa= 3 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 52 ARG^? 13.70 C2 EDO A 189 B 101 ASP A 28 ASP.? 17.25 C2 EDO A 189 B 132 ASP A 54 ASP.? 20.27 C2 EDO A 189 coo 11.61 3.43 18.38 9.11 4.29 16.86 69.17 14.29 10.90 69.97 16.58 12.80 coo 11.74 0.51 12.98 10.75 1.32 14.67 68.65 8.60 12.81 69.48 7.64 14.53 coo 6.93 7.52 14.08 7.18 6.08 15.65 68.86 12.45 19.04 67.57 12.48 20.71 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG A 60 ARG^? 18.80 O1 EDO A 189 B 101 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 132 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 11.61 3.43 18.38 9.11 4.29 16.86 67.94 16.79 18.42 70.70 18.25 18.48 coo 11.74 0.51 12.98 10.75 1.32 14.67 68.86 12.45 19.04 67.57 12.48 20.71 coo 6.93 7.52 14.08 7.18 6.08 15.65 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 B 99 ARG A 186 ARG^? 11.98 O1 EDO B 190 B 101 ASP A 172 ASP.? 13.07 O1 EDO B 190 B 132 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 11.61 3.43 18.38 9.11 4.29 16.86 51.29 1.08 9.05 52.68 -0.95 10.91 coo 11.74 0.51 12.98 10.75 1.32 14.67 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 6.93 7.52 14.08 7.18 6.08 15.65 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 B 99 ARG B 52 ARG^? 13.54 O2 EDO B 189 B 101 ASP B 28 ASP.? 13.72 O2 EDO B 189 B 132 ASP B 54 ASP.? 15.81 C2 EDO B 193 coo 11.61 3.43 18.38 9.11 4.29 16.86 55.40 16.98 -30.43 55.13 14.61 -32.43 coo 11.74 0.51 12.98 10.75 1.32 14.67 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 6.93 7.52 14.08 7.18 6.08 15.65 50.24 18.54 -36.80 48.17 18.09 -37.17 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 B 99 ARG B 60 ARG^? 18.79 C1 EDO B 189 B 101 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 132 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 11.61 3.43 18.38 9.11 4.29 16.86 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 11.74 0.51 12.98 10.75 1.32 14.67 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 6.93 7.52 14.08 7.18 6.08 15.65 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 B 99 ARG B 186 ARG^? -4.10 O2 EDO A 188s B 101 ASP B 172 ASP.? 7.16 C1 EDO B 193 B 132 ASP B 179 ASP^? 11.34 O2 EDO A 188 coo 11.61 3.43 18.38 9.11 4.29 16.86 42.31 29.46 -17.08 41.98 30.89 -19.84 coo 11.74 0.51 12.98 10.75 1.32 14.67 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 6.93 7.52 14.08 7.18 6.08 15.65 33.06 29.40 -17.37 33.45 31.08 -16.20 1nu3_c01 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 6 hits 1nu3_c01 naa= 3 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 52 ARG^? 13.70 C2 EDO A 189 A 101 ASP A 28 ASP.? 17.25 C2 EDO A 189 A 132 ASP A 54 ASP.? 20.27 C2 EDO A 189 coo 11.50 22.77 17.24 14.00 21.62 15.86 69.17 14.29 10.90 69.97 16.58 12.80 coo 11.19 25.00 11.76 12.16 24.45 13.59 68.65 8.60 12.81 69.48 7.64 14.53 coo 16.04 18.11 13.43 15.88 19.70 14.83 68.86 12.45 19.04 67.57 12.48 20.71 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 101 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 132 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 11.50 22.77 17.24 14.00 21.62 15.86 67.94 16.79 18.42 70.70 18.25 18.48 coo 11.19 25.00 11.76 12.16 24.45 13.59 68.86 12.45 19.04 67.57 12.48 20.71 coo 16.04 18.11 13.43 15.88 19.70 14.83 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 A 99 ARG A 186 ARG^? 11.98 O1 EDO B 190 A 101 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 132 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 11.50 22.77 17.24 14.00 21.62 15.86 51.29 1.08 9.05 52.68 -0.95 10.91 coo 11.19 25.00 11.76 12.16 24.45 13.59 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 16.04 18.11 13.43 15.88 19.70 14.83 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 A 99 ARG B 52 ARG^? 13.54 O2 EDO B 189 A 101 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 132 ASP B 54 ASP.? 15.81 C2 EDO B 193 coo 11.50 22.77 17.24 14.00 21.62 15.86 55.40 16.98 -30.43 55.13 14.61 -32.43 coo 11.19 25.00 11.76 12.16 24.45 13.59 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 16.04 18.11 13.43 15.88 19.70 14.83 50.24 18.54 -36.80 48.17 18.09 -37.17 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 A 99 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 101 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 132 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 11.50 22.77 17.24 14.00 21.62 15.86 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 11.19 25.00 11.76 12.16 24.45 13.59 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 16.04 18.11 13.43 15.88 19.70 14.83 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 A 99 ARG B 186 ARG^? -4.10 O2 EDO A 188s A 101 ASP B 172 ASP.? 7.16 C1 EDO B 193 A 132 ASP B 179 ASP^? 11.34 O2 EDO A 188 coo 11.50 22.77 17.24 14.00 21.62 15.86 42.31 29.46 -17.08 41.98 30.89 -19.84 coo 11.19 25.00 11.76 12.16 24.45 13.59 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 16.04 18.11 13.43 15.88 19.70 14.83 33.06 29.40 -17.37 33.45 31.08 -16.20 1nww_c02 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 6 hits 1nww_c02 naa= 3 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 52 ARG^? 13.70 C2 EDO A 189 B 101 ASP A 28 ASP.? 17.25 C2 EDO A 189 B 132 ASP A 54 ASP.? 20.27 C2 EDO A 189 coo 11.48 3.09 18.25 9.01 4.07 16.77 69.17 14.29 10.90 69.97 16.58 12.80 coo 11.83 0.33 13.01 10.88 1.04 14.81 68.65 8.60 12.81 69.48 7.64 14.53 coo 6.85 7.33 14.07 7.10 5.88 15.60 68.86 12.45 19.04 67.57 12.48 20.71 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG A 60 ARG^? 18.80 O1 EDO A 189 B 101 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 132 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 11.48 3.09 18.25 9.01 4.07 16.77 67.94 16.79 18.42 70.70 18.25 18.48 coo 11.83 0.33 13.01 10.88 1.04 14.81 68.86 12.45 19.04 67.57 12.48 20.71 coo 6.85 7.33 14.07 7.10 5.88 15.60 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 B 99 ARG A 186 ARG^? 11.98 O1 EDO B 190 B 101 ASP A 172 ASP.? 13.07 O1 EDO B 190 B 132 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 11.48 3.09 18.25 9.01 4.07 16.77 51.29 1.08 9.05 52.68 -0.95 10.91 coo 11.83 0.33 13.01 10.88 1.04 14.81 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 6.85 7.33 14.07 7.10 5.88 15.60 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 B 99 ARG B 52 ARG^? 13.54 O2 EDO B 189 B 101 ASP B 28 ASP.? 13.72 O2 EDO B 189 B 132 ASP B 54 ASP.? 15.81 C2 EDO B 193 coo 11.48 3.09 18.25 9.01 4.07 16.77 55.40 16.98 -30.43 55.13 14.61 -32.43 coo 11.83 0.33 13.01 10.88 1.04 14.81 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 6.85 7.33 14.07 7.10 5.88 15.60 50.24 18.54 -36.80 48.17 18.09 -37.17 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 B 99 ARG B 60 ARG^? 18.79 C1 EDO B 189 B 101 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 132 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 11.48 3.09 18.25 9.01 4.07 16.77 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 11.83 0.33 13.01 10.88 1.04 14.81 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 6.85 7.33 14.07 7.10 5.88 15.60 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 B 99 ARG B 186 ARG^? -4.10 O2 EDO A 188s B 101 ASP B 172 ASP.? 7.16 C1 EDO B 193 B 132 ASP B 179 ASP^? 11.34 O2 EDO A 188 coo 11.48 3.09 18.25 9.01 4.07 16.77 42.31 29.46 -17.08 41.98 30.89 -19.84 coo 11.83 0.33 13.01 10.88 1.04 14.81 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 6.85 7.33 14.07 7.10 5.88 15.60 33.06 29.40 -17.37 33.45 31.08 -16.20 1nww_c03 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 6 hits 1nww_c03 naa= 3 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 # 1 A 62 SER A 15 SER^? 6.97 O2 EDO B 188 A 154 ASP A 38 ASP.? 14.66 C5 MPD A 191 A 261 ARG A 14 ARG.? 14.51 O2 EDO B 188 coo 16.10 74.10 3.11 17.18 73.52 5.20 33.69 13.90 -4.39 33.67 12.71 -6.50 coo 16.07 84.71 8.14 15.20 82.81 8.14 42.66 22.43 1.00 42.54 24.24 2.16 coo 10.59 77.85 4.81 13.09 76.36 5.76 34.22 19.89 -3.86 35.36 22.47 -5.15 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 2 3 # 2 A 62 SER A 19 SER.? 9.58 O2 EDO A 190 A 154 ASP B 38 ASP.? -2.58 O1 EDO B 191s A 261 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 16.10 74.10 3.11 17.18 73.52 5.20 44.74 11.50 2.76 44.85 11.11 5.15 coo 16.07 84.71 8.14 15.20 82.81 8.14 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 10.59 77.85 4.81 13.09 76.36 5.76 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 3 3 # 3 A 62 SER A 19 SER.? 9.58 O2 EDO A 190 A 154 ASP B 38 ASP.? -2.58 O1 EDO B 191s A 261 ARG B 14 ARG.? 10.57 O1 EDO B 191 coo 16.10 74.10 3.11 17.18 73.52 5.20 44.74 11.50 2.76 44.85 11.11 5.15 coo 16.07 84.71 8.14 15.20 82.81 8.14 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 10.59 77.85 4.81 13.09 76.36 5.76 36.61 9.98 2.38 38.30 7.40 2.59 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 4 3 # 4 A 62 SER A 142 SER^? 11.36 O4 MPD A 191 A 154 ASP A 101 ASP^? 14.06 CM MPD A 191 A 261 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo 16.10 74.10 3.11 17.18 73.52 5.20 52.28 24.44 20.99 51.62 26.22 22.49 coo 16.07 84.71 8.14 15.20 82.81 8.14 57.05 15.04 20.11 57.86 14.10 21.77 coo 10.59 77.85 4.81 13.09 76.36 5.76 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 5 3 # 5 A 62 SER B 15 SER^? 13.53 C5 MPD A 191 A 154 ASP B 38 ASP.? -2.58 O1 EDO B 191s A 261 ARG B 14 ARG.? 10.57 O1 EDO B 191 coo 16.10 74.10 3.11 17.18 73.52 5.20 36.05 15.84 3.08 36.92 18.05 3.63 coo 16.07 84.71 8.14 15.20 82.81 8.14 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 10.59 77.85 4.81 13.09 76.36 5.76 36.61 9.98 2.38 38.30 7.40 2.59 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 6 3 # 6 A 62 SER B 18 SER.? 10.56 O2 EDO B 188 A 154 ASP A 38 ASP.? 14.66 C5 MPD A 191 A 261 ARG A 14 ARG.? 14.51 O2 EDO B 188 coo 16.10 74.10 3.11 17.18 73.52 5.20 38.02 18.18 -6.54 36.77 19.25 -8.29 coo 16.07 84.71 8.14 15.20 82.81 8.14 42.66 22.43 1.00 42.54 24.24 2.16 coo 10.59 77.85 4.81 13.09 76.36 5.76 34.22 19.89 -3.86 35.36 22.47 -5.15 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 7 3 # 7 A 62 SER B 19 SER.? 10.72 O2 EDO B 188 A 154 ASP A 38 ASP.? 14.66 C5 MPD A 191 A 261 ARG A 14 ARG.? 14.51 O2 EDO B 188 coo 16.10 74.10 3.11 17.18 73.52 5.20 40.65 18.63 -9.19 39.36 19.17 -11.21 coo 16.07 84.71 8.14 15.20 82.81 8.14 42.66 22.43 1.00 42.54 24.24 2.16 coo 10.59 77.85 4.81 13.09 76.36 5.76 34.22 19.89 -3.86 35.36 22.47 -5.15 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 8 3 # 8 A 62 SER B 19 SER.? 10.72 O2 EDO B 188 A 154 ASP A 38 ASP.? 14.66 C5 MPD A 191 A 261 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 16.10 74.10 3.11 17.18 73.52 5.20 40.65 18.63 -9.19 39.36 19.17 -11.21 coo 16.07 84.71 8.14 15.20 82.81 8.14 42.66 22.43 1.00 42.54 24.24 2.16 coo 10.59 77.85 4.81 13.09 76.36 5.76 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 9 3 # 9 A 62 SER B 32 SER^? 8.66 C2 EDO B 189 A 154 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 261 ARG B 50 ARG^? -6.93 O2 EDO B 189s coo 16.10 74.10 3.11 17.18 73.52 5.20 50.26 19.40 -17.21 47.97 19.77 -16.73 coo 16.07 84.71 8.14 15.20 82.81 8.14 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 10.59 77.85 4.81 13.09 76.36 5.76 55.72 16.68 -23.20 56.85 15.32 -25.75 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 10 3 # 10 A 62 SER B 68 SER^? -5.55 O2 EDO B 191s A 154 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 261 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 16.10 74.10 3.11 17.18 73.52 5.20 47.96 6.58 -6.86 46.83 4.83 -8.08 coo 16.07 84.71 8.14 15.20 82.81 8.14 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 10.59 77.85 4.81 13.09 76.36 5.76 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 11 3 # 11 A 62 SER B 142 SER^? 12.79 C3 MPD B 194 A 154 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 261 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 16.10 74.10 3.11 17.18 73.52 5.20 36.25 6.04 -28.61 35.21 4.32 -29.92 coo 16.07 84.71 8.14 15.20 82.81 8.14 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 10.59 77.85 4.81 13.09 76.36 5.76 35.59 7.18 -33.96 34.54 5.79 -36.47 1o98_c00 source 1o98 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT PHOSPHOGLY: 11 hits 1o98_c00 naa= 3 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 A 24 ASP A 179 ASP^? 16.86 CM MPD A 191 A 146 TYR A 157 TYR^? -4.51 CM MPD A 191s A 177 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -3.50 124.89 25.05 -2.25 124.77 23.26 43.85 0.70 13.63 43.61 -0.87 12.28 coo 1.87 119.38 16.45 1.41 122.11 16.84 46.12 11.16 21.21 46.22 13.94 20.83 coo -2.59 124.07 12.67 -0.91 126.17 18.42 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 A 24 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 146 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 177 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -3.50 124.89 25.05 -2.25 124.77 23.26 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 1.87 119.38 16.45 1.41 122.11 16.84 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -2.59 124.07 12.67 -0.91 126.17 18.42 25.14 19.21 -22.67 21.76 17.11 -26.55 1ok4_c00 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c00 naa= 3 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 B 24 ASP A 179 ASP^? 16.86 CM MPD A 191 B 146 TYR A 157 TYR^? -4.51 CM MPD A 191s B 177 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -7.43 109.06 51.23 -5.84 110.54 50.86 43.85 0.70 13.63 43.61 -0.87 12.28 coo 0.22 114.56 44.62 -0.76 115.18 47.18 46.12 11.16 21.21 46.22 13.94 20.83 coo -4.18 120.17 46.85 -4.02 115.31 51.00 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 B 24 ASP B 179 ASP^? 11.34 O2 EDO A 188 B 146 TYR B 157 TYR^? -4.69 O2 MPD B 194s B 177 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -7.43 109.06 51.23 -5.84 110.54 50.86 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 0.22 114.56 44.62 -0.76 115.18 47.18 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -4.18 120.17 46.85 -4.02 115.31 51.00 25.14 19.21 -22.67 21.76 17.11 -26.55 1ok4_c01 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c01 naa= 3 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 C 24 ASP A 179 ASP^? 16.86 CM MPD A 191 C 146 TYR A 157 TYR^? -4.51 CM MPD A 191s C 177 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -13.49 79.65 43.90 -12.13 80.29 45.45 43.85 0.70 13.63 43.61 -0.87 12.28 coo -5.65 86.78 48.49 -7.16 84.72 49.65 46.12 11.16 21.21 46.22 13.94 20.83 coo -11.22 87.18 53.49 -10.94 81.64 50.31 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 C 24 ASP B 179 ASP^? 11.34 O2 EDO A 188 C 146 TYR B 157 TYR^? -4.69 O2 MPD B 194s C 177 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -13.49 79.65 43.90 -12.13 80.29 45.45 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -5.65 86.78 48.49 -7.16 84.72 49.65 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -11.22 87.18 53.49 -10.94 81.64 50.31 25.14 19.21 -22.67 21.76 17.11 -26.55 1ok4_c02 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c02 naa= 3 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 D 24 ASP A 179 ASP^? 16.86 CM MPD A 191 D 146 TYR A 157 TYR^? -4.51 CM MPD A 191s D 177 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -13.44 77.36 13.12 -12.53 75.97 14.48 43.85 0.70 13.63 43.61 -0.87 12.28 coo -7.85 74.44 22.75 -9.22 72.86 20.89 46.12 11.16 21.21 46.22 13.94 20.83 coo -14.24 70.61 23.48 -12.55 71.73 17.42 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 D 24 ASP B 179 ASP^? 11.34 O2 EDO A 188 D 146 TYR B 157 TYR^? -4.69 O2 MPD B 194s D 177 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -13.44 77.36 13.12 -12.53 75.97 14.48 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -7.85 74.44 22.75 -9.22 72.86 20.89 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -14.24 70.61 23.48 -12.55 71.73 17.42 25.14 19.21 -22.67 21.76 17.11 -26.55 1ok4_c03 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c03 naa= 3 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 E 24 ASP A 179 ASP^? 16.86 CM MPD A 191 E 146 TYR A 157 TYR^? -4.51 CM MPD A 191s E 177 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -7.12 105.25 1.43 -6.30 103.34 0.77 43.85 0.70 13.63 43.61 -0.87 12.28 coo -3.11 94.55 3.01 -3.83 95.92 0.66 46.12 11.16 21.21 46.22 13.94 20.83 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 E 24 ASP B 179 ASP^? 11.34 O2 EDO A 188 E 146 TYR B 157 TYR^? -4.69 O2 MPD B 194s E 177 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -7.12 105.25 1.43 -6.30 103.34 0.77 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -3.11 94.55 3.01 -3.83 95.92 0.66 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 25.14 19.21 -22.67 21.76 17.11 -26.55 1ok4_c04 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c04 naa= 3 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 F 24 ASP A 179 ASP^? 16.86 CM MPD A 191 F 146 TYR A 157 TYR^? -4.51 CM MPD A 191s F 177 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -44.75 128.15 10.28 -45.68 129.67 11.55 43.85 0.70 13.63 43.61 -0.87 12.28 coo -50.43 131.90 19.60 -49.04 133.31 17.60 46.12 11.16 21.21 46.22 13.94 20.83 coo -44.10 135.86 19.99 -45.67 134.21 14.07 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 F 24 ASP B 179 ASP^? 11.34 O2 EDO A 188 F 146 TYR B 157 TYR^? -4.69 O2 MPD B 194s F 177 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -44.75 128.15 10.28 -45.68 129.67 11.55 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -50.43 131.90 19.60 -49.04 133.31 17.60 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -44.10 135.86 19.99 -45.67 134.21 14.07 25.14 19.21 -22.67 21.76 17.11 -26.55 1ok4_c05 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c05 naa= 3 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 G 24 ASP A 179 ASP^? 16.86 CM MPD A 191 G 146 TYR A 157 TYR^? -4.51 CM MPD A 191s G 177 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -44.97 128.78 41.20 -46.32 128.26 42.83 43.85 0.70 13.63 43.61 -0.87 12.28 coo -52.83 122.13 46.42 -51.31 124.30 47.39 46.12 11.16 21.21 46.22 13.94 20.83 coo -47.30 122.24 51.49 -47.46 127.44 47.81 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 G 24 ASP B 179 ASP^? 11.34 O2 EDO A 188 G 146 TYR B 157 TYR^? -4.69 O2 MPD B 194s G 177 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -44.97 128.78 41.20 -46.32 128.26 42.83 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -52.83 122.13 46.42 -51.31 124.30 47.39 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -47.30 122.24 51.49 -47.46 127.44 47.81 25.14 19.21 -22.67 21.76 17.11 -26.55 1ok4_c06 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c06 naa= 3 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 H 24 ASP A 179 ASP^? 16.86 CM MPD A 191 H 146 TYR A 157 TYR^? -4.51 CM MPD A 191s H 177 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -51.11 100.30 51.41 -52.67 98.82 51.12 43.85 0.70 13.63 43.61 -0.87 12.28 coo -58.70 94.17 45.32 -57.76 93.82 47.92 46.12 11.16 21.21 46.22 13.94 20.83 coo -54.32 88.79 48.13 -54.61 94.04 51.74 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 H 24 ASP B 179 ASP^? 11.34 O2 EDO A 188 H 146 TYR B 157 TYR^? -4.69 O2 MPD B 194s H 177 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -51.11 100.30 51.41 -52.67 98.82 51.12 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -58.70 94.17 45.32 -57.76 93.82 47.92 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -54.32 88.79 48.13 -54.61 94.04 51.74 25.14 19.21 -22.67 21.76 17.11 -26.55 1ok4_c07 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c07 naa= 3 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 I 24 ASP A 179 ASP^? 16.86 CM MPD A 191 I 146 TYR A 157 TYR^? -4.51 CM MPD A 191s I 177 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -54.65 81.97 26.87 -55.88 81.89 25.07 43.85 0.70 13.63 43.61 -0.87 12.28 coo -59.92 86.62 17.74 -59.42 83.94 18.40 46.12 11.16 21.21 46.22 13.94 20.83 coo -55.38 81.61 14.50 -57.11 80.05 20.41 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 I 24 ASP B 179 ASP^? 11.34 O2 EDO A 188 I 146 TYR B 157 TYR^? -4.69 O2 MPD B 194s I 177 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -54.65 81.97 26.87 -55.88 81.89 25.07 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -59.92 86.62 17.74 -59.42 83.94 18.40 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -55.38 81.61 14.50 -57.11 80.05 20.41 25.14 19.21 -22.67 21.76 17.11 -26.55 1ok4_c08 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c08 naa= 3 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 J 24 ASP A 179 ASP^? 16.86 CM MPD A 191 J 146 TYR A 157 TYR^? -4.51 CM MPD A 191s J 177 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo -50.64 99.08 1.52 -51.52 100.83 0.67 43.85 0.70 13.63 43.61 -0.87 12.28 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 46.12 11.16 21.21 46.22 13.94 20.83 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 J 24 ASP B 179 ASP^? 11.34 O2 EDO A 188 J 146 TYR B 157 TYR^? -4.69 O2 MPD B 194s J 177 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo -50.64 99.08 1.52 -51.52 100.83 0.67 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 30.68 18.93 -24.72 31.20 16.23 -24.55 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 25.14 19.21 -22.67 21.76 17.11 -26.55 1ok4_c09 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c09 naa= 3 ULMN 3 1onr_c00 TRANSALDOLASE B user 1 3 # 1 A 17 ASP A 103 ASP^? 5.49 CM MPD A 191 A 96 GLU A 158 GLU^? 10.31 O2 MPD A 191 A 132 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 31.23 12.29 16.44 30.82 11.56 18.39 51.58 16.40 16.66 49.70 15.49 16.18 coo 26.82 3.20 24.36 27.99 4.86 24.98 43.36 11.29 26.55 43.12 11.25 28.63 coo 29.99 0.62 22.18 30.38 6.69 20.81 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1onr_c00 TRANSALDOLASE B user 2 3 # 2 A 17 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 96 GLU B 158 GLU^? 10.92 O2 MPD B 194 A 132 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 31.23 12.29 16.44 30.82 11.56 18.39 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 26.82 3.20 24.36 27.99 4.86 24.98 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 29.99 0.62 22.18 30.38 6.69 20.81 25.14 19.21 -22.67 21.76 17.11 -26.55 1onr_c00 source 1onr TRANSALDOLASE B : 2 hits 1onr_c00 naa= 3 ULMN 3 1onr_c01 TRANSALDOLASE B user 1 3 # 1 B 17 ASP A 103 ASP^? 5.49 CM MPD A 191 B 96 GLU A 158 GLU^? 10.31 O2 MPD A 191 B 132 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 31.16 57.31 -0.94 30.73 56.64 1.01 51.58 16.40 16.66 49.70 15.49 16.18 coo 26.69 48.45 7.18 27.85 50.13 7.74 43.36 11.29 26.55 43.12 11.25 28.63 coo 29.82 45.80 5.07 30.26 51.81 3.56 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1onr_c01 TRANSALDOLASE B user 2 3 # 2 B 17 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 96 GLU B 158 GLU^? 10.92 O2 MPD B 194 B 132 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 31.16 57.31 -0.94 30.73 56.64 1.01 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 26.69 48.45 7.18 27.85 50.13 7.74 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 29.82 45.80 5.07 30.26 51.81 3.56 25.14 19.21 -22.67 21.76 17.11 -26.55 1onr_c01 source 1onr TRANSALDOLASE B : 2 hits 1onr_c01 naa= 3 ULMN 3 1p7m_c00 DNA-3-METHYLADENINE GLYCOSYLASE I user 1 3 # 1 A 16 TYR B 7 TYR^? 8.72 O1 EDO B 190 A 38 GLU B 69 GLU.? -7.04 C2 EDO B 191s A 46 TRP B 9 TRP^? 13.11 O2 EDO A 190 coo 141.05 24.62 -1.85 142.62 22.60 -2.97 55.88 2.21 7.80 57.52 0.60 9.42 coo 142.20 14.40 -6.46 142.04 16.49 -6.62 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 137.32 22.45 -5.52 140.17 20.39 -3.63 49.15 4.48 8.87 52.91 5.73 8.86 1p7m_c00 source 1p7m DNA-3-METHYLADENINE GLYCOSYLASE I : 1 hits 1p7m_c00 naa= 3 ULMN 3 1pd2_c02 HEMATOPOIETIC PROSTAGLADIN D SYNTHASuser 1 3 # 1 1 8 TYR A 45 TYR^? 11.90 O2 EDO A 190 1 14 ARG A 35 ARG^? -3.68 C1 EDO A 190s 1 104 TRP A 20 TRP^? -3.03 O2 EDO A 190s coo -6.26 36.66 22.35 -5.62 38.66 24.20 47.53 19.92 0.67 46.95 18.68 3.19 coo -1.84 42.97 23.45 -1.37 45.90 22.68 49.65 12.45 -3.94 51.87 11.63 -5.97 coo -2.17 45.44 30.78 -5.80 46.76 31.55 48.15 6.40 -0.61 51.40 8.36 -1.66 ULMN 3 1pd2_c02 HEMATOPOIETIC PROSTAGLADIN D SYNTHASuser 2 3 # 2 1 8 TYR B 45 TYR^? 7.97 C2 EDO A 190 1 14 ARG B 35 ARG^? 10.43 C2 EDO A 190 1 104 TRP B 20 TRP^? 12.78 O2 EDO A 188 coo -6.26 36.66 22.35 -5.62 38.66 24.20 44.36 10.34 -9.27 42.37 11.49 -10.86 coo -1.84 42.97 23.45 -1.37 45.90 22.68 48.60 18.31 -7.03 51.67 18.96 -6.78 coo -2.17 45.44 30.78 -5.80 46.76 31.55 45.29 23.67 -9.14 48.56 22.72 -7.16 1pd2_c02 source 1pd2 HEMATOPOIETIC PROSTAGLADIN D SYNTHASE : 2 hits 1pd2_c02 naa= 3 ULMN 3 1pd2_c03 HEMATOPOIETIC PROSTAGLADIN D SYNTHASuser 1 3 # 1 2 8 TYR A 45 TYR^? 11.90 O2 EDO A 190 2 14 ARG A 35 ARG^? -3.68 C1 EDO A 190s 2 104 TRP A 20 TRP^? -3.03 O2 EDO A 190s coo 14.82 62.39 20.28 14.73 60.21 22.02 47.53 19.92 0.67 46.95 18.68 3.19 coo 10.81 55.96 22.08 10.04 53.12 21.26 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 13.42 52.88 28.75 17.04 51.48 28.24 48.15 6.40 -0.61 51.40 8.36 -1.66 ULMN 3 1pd2_c03 HEMATOPOIETIC PROSTAGLADIN D SYNTHASuser 2 3 # 2 2 8 TYR B 45 TYR^? 7.97 C2 EDO A 190 2 14 ARG B 35 ARG^? 10.43 C2 EDO A 190 2 104 TRP B 20 TRP^? 12.78 O2 EDO A 188 coo 14.82 62.39 20.28 14.73 60.21 22.02 44.36 10.34 -9.27 42.37 11.49 -10.86 coo 10.81 55.96 22.08 10.04 53.12 21.26 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 13.42 52.88 28.75 17.04 51.48 28.24 45.29 23.67 -9.14 48.56 22.72 -7.16 1pd2_c03 source 1pd2 HEMATOPOIETIC PROSTAGLADIN D SYNTHASE : 2 hits 1pd2_c03 naa= 3 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 1 3 # 1 A 225 HIS A 154 HIS^? 17.90 CM MPD A 191 A 259 TYR A 155 TYR^? 14.94 CM MPD A 191 A 552 ASP B 48 ASP^? 5.72 O1 EDO B 189 coo 11.34 95.90 25.54 12.13 96.42 23.67 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 14.91 97.39 18.63 13.39 95.60 20.20 50.44 4.00 23.33 52.91 2.96 24.17 coo 46.37 82.54 38.83 45.97 84.66 38.77 52.60 14.13 -14.82 53.00 14.96 -12.94 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 2 3 # 2 A 225 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 259 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 552 ASP A 48 ASP^? -5.54 C1 EDO A 189s coo 11.34 95.90 25.54 12.13 96.42 23.67 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 14.91 97.39 18.63 13.39 95.60 20.20 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 46.37 82.54 38.83 45.97 84.66 38.77 57.58 16.65 0.08 56.71 16.10 -1.78 1pj5_c00 source 1pj5 N,N-DIMETHYLGLYCINE OXIDASE : 2 hits 1pj5_c00 naa= 3 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 A 70 ALA A 10 ALA^? 11.42 O2 EDO A 188 A 126 LEU A 43 LEU.? 15.31 O2 EDO A 188 A 158 GLU A 69 GLU.? 15.47 O2 EDO A 188 coo -2.29 37.66 144.73 -1.46 37.12 145.87 39.96 24.34 -10.37 39.71 25.41 -9.28 coo -4.62 32.83 147.14 -5.50 32.85 149.12 41.78 22.81 -4.26 40.57 23.92 -5.70 coo -0.83 29.57 149.77 -0.39 31.47 148.95 44.88 26.70 -3.49 42.93 26.42 -2.77 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA A 30 ALA^? 9.64 O2 EDO A 189 A 126 LEU A 23 LEU^? 10.78 O2 EDO A 189 A 158 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo -2.29 37.66 144.73 -1.46 37.12 145.87 61.95 9.56 7.70 60.62 9.31 8.43 coo -4.62 32.83 147.14 -5.50 32.85 149.12 56.24 7.35 5.52 57.26 7.53 7.41 coo -0.83 29.57 149.77 -0.39 31.47 148.95 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 A 70 ALA A 36 ALA^? 9.26 O2 EDO A 190 A 126 LEU A 34 LEU^? 9.26 O2 EDO A 190 A 158 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo -2.29 37.66 144.73 -1.46 37.12 145.87 45.24 15.21 0.88 45.56 15.37 2.38 coo -4.62 32.83 147.14 -5.50 32.85 149.12 51.42 13.55 3.24 49.84 14.38 4.49 coo -0.83 29.57 149.77 -0.39 31.47 148.95 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 A 70 ALA A 79 ALA^? 16.03 O1 EDO A 189 A 126 LEU A 77 LEU^? 11.79 O1 EDO A 189 A 158 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo -2.29 37.66 144.73 -1.46 37.12 145.87 65.24 21.66 17.68 64.04 20.76 17.95 coo -4.62 32.83 147.14 -5.50 32.85 149.12 61.40 23.35 12.59 59.60 24.52 12.87 coo -0.83 29.57 149.77 -0.39 31.47 148.95 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 5 3 # 5 A 70 ALA A 79 ALA^? 16.03 O1 EDO A 189 A 126 LEU A 78 LEU^? 13.24 O1 EDO A 189 A 158 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo -2.29 37.66 144.73 -1.46 37.12 145.87 65.24 21.66 17.68 64.04 20.76 17.95 coo -4.62 32.83 147.14 -5.50 32.85 149.12 66.97 23.68 13.93 67.17 23.54 11.72 coo -0.83 29.57 149.77 -0.39 31.47 148.95 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 6 3 # 6 A 70 ALA A 135 ALA.? 11.13 C5 MPD A 191 A 126 LEU A 138 LEU.? 10.11 O1 EDO A 189 A 158 GLU A 139 GLU.? 13.74 O4 MPD A 191 coo -2.29 37.66 144.73 -1.46 37.12 145.87 48.96 21.01 6.70 49.44 19.78 5.90 coo -4.62 32.83 147.14 -5.50 32.85 149.12 53.25 24.44 7.22 53.61 22.61 6.19 coo -0.83 29.57 149.77 -0.39 31.47 148.95 50.77 29.24 9.79 48.92 30.09 9.22 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 7 3 # 7 A 70 ALA A 146 ALA^? 9.66 O2 MPD A 191 A 126 LEU A 160 LEU.? 8.58 O2 MPD A 191 A 158 GLU A 161 GLU.? 9.37 O2 MPD A 191 coo -2.29 37.66 144.73 -1.46 37.12 145.87 48.53 13.09 26.87 47.62 13.02 28.09 coo -4.62 32.83 147.14 -5.50 32.85 149.12 45.77 18.41 27.43 46.23 16.63 28.63 coo -0.83 29.57 149.77 -0.39 31.47 148.95 45.67 22.34 23.77 46.84 23.71 24.88 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 8 3 # 8 A 70 ALA B 30 ALA^? 9.68 C2 EDO B 189 A 126 LEU B 23 LEU^? 9.11 C1 EDO A 188 A 158 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo -2.29 37.66 144.73 -1.46 37.12 145.87 51.24 21.16 -23.43 49.76 21.37 -23.35 coo -4.62 32.83 147.14 -5.50 32.85 149.12 47.94 23.18 -18.28 47.78 22.93 -20.49 coo -0.83 29.57 149.77 -0.39 31.47 148.95 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 9 3 # 9 A 70 ALA B 36 ALA^? 10.06 O2 EDO B 188 A 126 LEU B 34 LEU^? 11.05 C2 EDO B 189 A 158 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo -2.29 37.66 144.73 -1.46 37.12 145.87 42.34 14.94 -8.03 41.67 14.78 -9.42 coo -4.62 32.83 147.14 -5.50 32.85 149.12 45.81 16.83 -13.57 43.83 16.06 -13.74 coo -0.83 29.57 149.77 -0.39 31.47 148.95 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 10 3 # 10 A 70 ALA B 79 ALA^? 16.25 C1 EDO B 189 A 126 LEU B 77 LEU^? 12.06 C1 EDO B 189 A 158 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo -2.29 37.66 144.73 -1.46 37.12 145.87 48.62 9.08 -33.69 47.43 9.95 -33.20 coo -4.62 32.83 147.14 -5.50 32.85 149.12 48.54 7.42 -27.24 46.85 6.23 -26.42 coo -0.83 29.57 149.77 -0.39 31.47 148.95 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 11 3 # 11 A 70 ALA B 79 ALA^? 16.25 C1 EDO B 189 A 126 LEU B 78 LEU^? 13.86 C1 EDO B 189 A 158 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo -2.29 37.66 144.73 -1.46 37.12 145.87 48.62 9.08 -33.69 47.43 9.95 -33.20 coo -4.62 32.83 147.14 -5.50 32.85 149.12 52.17 7.14 -31.62 54.24 7.37 -31.17 coo -0.83 29.57 149.77 -0.39 31.47 148.95 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 12 3 # 12 A 70 ALA B 135 ALA.? 9.12 C2 EDO B 188 A 126 LEU B 138 LEU.? 10.66 C1 EDO B 189 A 158 GLU B 139 GLU.? 9.67 O2 EDO B 191 coo -2.29 37.66 144.73 -1.46 37.12 145.87 41.94 9.33 -15.05 42.81 10.57 -14.76 coo -4.62 32.83 147.14 -5.50 32.85 149.12 45.17 5.96 -18.11 45.96 7.86 -17.37 coo -0.83 29.57 149.77 -0.39 31.47 148.95 41.80 1.11 -18.67 40.76 -0.16 -17.27 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 13 3 # 13 A 70 ALA B 146 ALA^? 9.91 O2 MPD B 194 A 126 LEU B 160 LEU.? 8.80 O2 MPD B 194 A 158 GLU B 161 GLU.? 9.05 O2 MPD B 194 coo -2.29 37.66 144.73 -1.46 37.12 145.87 29.33 17.08 -30.73 27.86 17.06 -31.19 coo -4.62 32.83 147.14 -5.50 32.85 149.12 26.54 11.74 -29.48 26.25 13.58 -30.58 coo -0.83 29.57 149.77 -0.39 31.47 148.95 28.86 7.94 -26.27 29.12 6.39 -27.73 1pjh_c00 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 13 hits 1pjh_c00 naa= 3 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 B 70 ALA A 10 ALA^? 11.42 O2 EDO A 188 B 126 LEU A 43 LEU.? 15.31 O2 EDO A 188 B 158 GLU A 69 GLU.? 15.47 O2 EDO A 188 coo -39.79 4.61 147.27 -39.61 5.56 148.47 39.96 24.34 -10.37 39.71 25.41 -9.28 coo -34.22 5.06 149.25 -33.65 4.24 151.15 41.78 22.81 -4.26 40.57 23.92 -5.70 coo -33.03 9.93 151.71 -34.98 9.38 151.11 44.88 26.70 -3.49 42.93 26.42 -2.77 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA A 30 ALA^? 9.64 O2 EDO A 189 B 126 LEU A 23 LEU^? 10.78 O2 EDO A 189 B 158 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo -39.79 4.61 147.27 -39.61 5.56 148.47 61.95 9.56 7.70 60.62 9.31 8.43 coo -34.22 5.06 149.25 -33.65 4.24 151.15 56.24 7.35 5.52 57.26 7.53 7.41 coo -33.03 9.93 151.71 -34.98 9.38 151.11 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 B 70 ALA A 36 ALA^? 9.26 O2 EDO A 190 B 126 LEU A 34 LEU^? 9.26 O2 EDO A 190 B 158 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo -39.79 4.61 147.27 -39.61 5.56 148.47 45.24 15.21 0.88 45.56 15.37 2.38 coo -34.22 5.06 149.25 -33.65 4.24 151.15 51.42 13.55 3.24 49.84 14.38 4.49 coo -33.03 9.93 151.71 -34.98 9.38 151.11 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 B 70 ALA A 79 ALA^? 16.03 O1 EDO A 189 B 126 LEU A 77 LEU^? 11.79 O1 EDO A 189 B 158 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo -39.79 4.61 147.27 -39.61 5.56 148.47 65.24 21.66 17.68 64.04 20.76 17.95 coo -34.22 5.06 149.25 -33.65 4.24 151.15 61.40 23.35 12.59 59.60 24.52 12.87 coo -33.03 9.93 151.71 -34.98 9.38 151.11 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 5 3 # 5 B 70 ALA A 79 ALA^? 16.03 O1 EDO A 189 B 126 LEU A 78 LEU^? 13.24 O1 EDO A 189 B 158 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo -39.79 4.61 147.27 -39.61 5.56 148.47 65.24 21.66 17.68 64.04 20.76 17.95 coo -34.22 5.06 149.25 -33.65 4.24 151.15 66.97 23.68 13.93 67.17 23.54 11.72 coo -33.03 9.93 151.71 -34.98 9.38 151.11 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 6 3 # 6 B 70 ALA A 135 ALA.? 11.13 C5 MPD A 191 B 126 LEU A 138 LEU.? 10.11 O1 EDO A 189 B 158 GLU A 139 GLU.? 13.74 O4 MPD A 191 coo -39.79 4.61 147.27 -39.61 5.56 148.47 48.96 21.01 6.70 49.44 19.78 5.90 coo -34.22 5.06 149.25 -33.65 4.24 151.15 53.25 24.44 7.22 53.61 22.61 6.19 coo -33.03 9.93 151.71 -34.98 9.38 151.11 50.77 29.24 9.79 48.92 30.09 9.22 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 7 3 # 7 B 70 ALA A 146 ALA^? 9.66 O2 MPD A 191 B 126 LEU A 160 LEU.? 8.58 O2 MPD A 191 B 158 GLU A 161 GLU.? 9.37 O2 MPD A 191 coo -39.79 4.61 147.27 -39.61 5.56 148.47 48.53 13.09 26.87 47.62 13.02 28.09 coo -34.22 5.06 149.25 -33.65 4.24 151.15 45.77 18.41 27.43 46.23 16.63 28.63 coo -33.03 9.93 151.71 -34.98 9.38 151.11 45.67 22.34 23.77 46.84 23.71 24.88 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 8 3 # 8 B 70 ALA B 30 ALA^? 9.68 C2 EDO B 189 B 126 LEU B 23 LEU^? 9.11 C1 EDO A 188 B 158 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo -39.79 4.61 147.27 -39.61 5.56 148.47 51.24 21.16 -23.43 49.76 21.37 -23.35 coo -34.22 5.06 149.25 -33.65 4.24 151.15 47.94 23.18 -18.28 47.78 22.93 -20.49 coo -33.03 9.93 151.71 -34.98 9.38 151.11 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 9 3 # 9 B 70 ALA B 36 ALA^? 10.06 O2 EDO B 188 B 126 LEU B 34 LEU^? 11.05 C2 EDO B 189 B 158 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo -39.79 4.61 147.27 -39.61 5.56 148.47 42.34 14.94 -8.03 41.67 14.78 -9.42 coo -34.22 5.06 149.25 -33.65 4.24 151.15 45.81 16.83 -13.57 43.83 16.06 -13.74 coo -33.03 9.93 151.71 -34.98 9.38 151.11 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 10 3 # 10 B 70 ALA B 79 ALA^? 16.25 C1 EDO B 189 B 126 LEU B 77 LEU^? 12.06 C1 EDO B 189 B 158 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo -39.79 4.61 147.27 -39.61 5.56 148.47 48.62 9.08 -33.69 47.43 9.95 -33.20 coo -34.22 5.06 149.25 -33.65 4.24 151.15 48.54 7.42 -27.24 46.85 6.23 -26.42 coo -33.03 9.93 151.71 -34.98 9.38 151.11 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 11 3 # 11 B 70 ALA B 79 ALA^? 16.25 C1 EDO B 189 B 126 LEU B 78 LEU^? 13.86 C1 EDO B 189 B 158 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo -39.79 4.61 147.27 -39.61 5.56 148.47 48.62 9.08 -33.69 47.43 9.95 -33.20 coo -34.22 5.06 149.25 -33.65 4.24 151.15 52.17 7.14 -31.62 54.24 7.37 -31.17 coo -33.03 9.93 151.71 -34.98 9.38 151.11 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 12 3 # 12 B 70 ALA B 135 ALA.? 9.12 C2 EDO B 188 B 126 LEU B 138 LEU.? 10.66 C1 EDO B 189 B 158 GLU B 139 GLU.? 9.67 O2 EDO B 191 coo -39.79 4.61 147.27 -39.61 5.56 148.47 41.94 9.33 -15.05 42.81 10.57 -14.76 coo -34.22 5.06 149.25 -33.65 4.24 151.15 45.17 5.96 -18.11 45.96 7.86 -17.37 coo -33.03 9.93 151.71 -34.98 9.38 151.11 41.80 1.11 -18.67 40.76 -0.16 -17.27 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 13 3 # 13 B 70 ALA B 146 ALA^? 9.91 O2 MPD B 194 B 126 LEU B 160 LEU.? 8.80 O2 MPD B 194 B 158 GLU B 161 GLU.? 9.05 O2 MPD B 194 coo -39.79 4.61 147.27 -39.61 5.56 148.47 29.33 17.08 -30.73 27.86 17.06 -31.19 coo -34.22 5.06 149.25 -33.65 4.24 151.15 26.54 11.74 -29.48 26.25 13.58 -30.58 coo -33.03 9.93 151.71 -34.98 9.38 151.11 28.86 7.94 -26.27 29.12 6.39 -27.73 1pjh_c01 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 13 hits 1pjh_c01 naa= 3 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 C 70 ALA A 10 ALA^? 11.42 O2 EDO A 188 C 126 LEU A 43 LEU.? 15.31 O2 EDO A 188 C 158 GLU A 69 GLU.? 15.47 O2 EDO A 188 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 39.96 24.34 -10.37 39.71 25.41 -9.28 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 41.78 22.81 -4.26 40.57 23.92 -5.70 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 44.88 26.70 -3.49 42.93 26.42 -2.77 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA A 30 ALA^? 9.64 O2 EDO A 189 C 126 LEU A 23 LEU^? 10.78 O2 EDO A 189 C 158 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 61.95 9.56 7.70 60.62 9.31 8.43 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 56.24 7.35 5.52 57.26 7.53 7.41 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 C 70 ALA A 36 ALA^? 9.26 O2 EDO A 190 C 126 LEU A 34 LEU^? 9.26 O2 EDO A 190 C 158 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 45.24 15.21 0.88 45.56 15.37 2.38 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 51.42 13.55 3.24 49.84 14.38 4.49 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 C 70 ALA A 79 ALA^? 16.03 O1 EDO A 189 C 126 LEU A 77 LEU^? 11.79 O1 EDO A 189 C 158 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 65.24 21.66 17.68 64.04 20.76 17.95 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 61.40 23.35 12.59 59.60 24.52 12.87 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 5 3 # 5 C 70 ALA A 79 ALA^? 16.03 O1 EDO A 189 C 126 LEU A 78 LEU^? 13.24 O1 EDO A 189 C 158 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 65.24 21.66 17.68 64.04 20.76 17.95 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 66.97 23.68 13.93 67.17 23.54 11.72 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 6 3 # 6 C 70 ALA A 135 ALA.? 11.13 C5 MPD A 191 C 126 LEU A 138 LEU.? 10.11 O1 EDO A 189 C 158 GLU A 139 GLU.? 13.74 O4 MPD A 191 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 48.96 21.01 6.70 49.44 19.78 5.90 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 53.25 24.44 7.22 53.61 22.61 6.19 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 50.77 29.24 9.79 48.92 30.09 9.22 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 7 3 # 7 C 70 ALA A 146 ALA^? 9.66 O2 MPD A 191 C 126 LEU A 160 LEU.? 8.58 O2 MPD A 191 C 158 GLU A 161 GLU.? 9.37 O2 MPD A 191 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 48.53 13.09 26.87 47.62 13.02 28.09 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 45.77 18.41 27.43 46.23 16.63 28.63 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 45.67 22.34 23.77 46.84 23.71 24.88 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 8 3 # 8 C 70 ALA B 30 ALA^? 9.68 C2 EDO B 189 C 126 LEU B 23 LEU^? 9.11 C1 EDO A 188 C 158 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 51.24 21.16 -23.43 49.76 21.37 -23.35 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 47.94 23.18 -18.28 47.78 22.93 -20.49 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 9 3 # 9 C 70 ALA B 36 ALA^? 10.06 O2 EDO B 188 C 126 LEU B 34 LEU^? 11.05 C2 EDO B 189 C 158 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 42.34 14.94 -8.03 41.67 14.78 -9.42 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 10 3 # 10 C 70 ALA B 79 ALA^? 16.25 C1 EDO B 189 C 126 LEU B 77 LEU^? 12.06 C1 EDO B 189 C 158 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 48.54 7.42 -27.24 46.85 6.23 -26.42 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 11 3 # 11 C 70 ALA B 79 ALA^? 16.25 C1 EDO B 189 C 126 LEU B 78 LEU^? 13.86 C1 EDO B 189 C 158 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 52.17 7.14 -31.62 54.24 7.37 -31.17 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 12 3 # 12 C 70 ALA B 135 ALA.? 9.12 C2 EDO B 188 C 126 LEU B 138 LEU.? 10.66 C1 EDO B 189 C 158 GLU B 139 GLU.? 9.67 O2 EDO B 191 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 41.94 9.33 -15.05 42.81 10.57 -14.76 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 45.17 5.96 -18.11 45.96 7.86 -17.37 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 41.80 1.11 -18.67 40.76 -0.16 -17.27 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 13 3 # 13 C 70 ALA B 146 ALA^? 9.91 O2 MPD B 194 C 126 LEU B 160 LEU.? 8.80 O2 MPD B 194 C 158 GLU B 161 GLU.? 9.05 O2 MPD B 194 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 29.33 17.08 -30.73 27.86 17.06 -31.19 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 26.54 11.74 -29.48 26.25 13.58 -30.58 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 28.86 7.94 -26.27 29.12 6.39 -27.73 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 13 hits 1pjh_c02 naa= 3 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 1 3 # 1 111 GLN A 29 GLN^? 9.33 C2 EDO A 189 294 GLU A 61 GLU^? 10.22 O1 EDO A 189 304 ARG A 24 ARG^? 7.27 O2 EDO A 189 coo 15.89 18.45 46.53 15.82 16.91 48.02 66.72 9.95 7.95 67.95 11.27 6.82 coo 22.84 13.44 52.91 20.84 13.18 52.38 66.46 19.59 10.29 68.35 19.61 9.28 coo 8.71 17.11 46.51 7.23 17.64 49.20 63.21 5.10 1.62 63.59 8.06 0.82 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 2 3 # 2 111 GLN A 46 GLN^? 7.01 C1 EDO A 190 294 GLU A 21 GLU^? 11.03 O2 EDO A 190 304 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 15.89 18.45 46.53 15.82 16.91 48.02 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 22.84 13.44 52.91 20.84 13.18 52.38 52.20 9.76 4.74 52.41 10.59 6.66 coo 8.71 17.11 46.51 7.23 17.64 49.20 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 3 3 # 3 111 GLN A 46 GLN^? 7.01 C1 EDO A 190 294 GLU A 31 GLU^? -3.45 O2 EDO A 189s 304 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 15.89 18.45 46.53 15.82 16.91 48.02 52.63 15.98 -2.49 53.32 14.80 -4.13 coo 22.84 13.44 52.91 20.84 13.18 52.38 61.87 12.13 2.43 62.94 11.86 0.64 coo 8.71 17.11 46.51 7.23 17.64 49.20 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 4 3 # 4 111 GLN A 124 GLN.? 20.70 O2 MPD A 191 294 GLU A 127 GLU^? 13.22 O2 MPD A 191 304 ARG A 149 ARG^? 22.01 CM MPD A 191 coo 15.89 18.45 46.53 15.82 16.91 48.02 53.95 5.81 33.11 56.04 5.53 32.71 coo 22.84 13.44 52.91 20.84 13.18 52.38 49.68 14.95 31.31 48.32 16.27 32.27 coo 8.71 17.11 46.51 7.23 17.64 49.20 53.15 0.69 27.47 54.83 -1.87 27.18 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 5 3 # 5 111 GLN B 46 GLN^? 7.98 C2 EDO A 190 294 GLU B 21 GLU^? 11.62 C2 EDO B 189 304 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 15.89 18.45 46.53 15.82 16.91 48.02 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 22.84 13.44 52.91 20.84 13.18 52.38 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 8.71 17.11 46.51 7.23 17.64 49.20 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 6 3 # 6 111 GLN B 46 GLN^? 7.98 C2 EDO A 190 294 GLU B 31 GLU^? -3.64 O2 EDO B 189s 304 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 15.89 18.45 46.53 15.82 16.91 48.02 50.22 14.36 -9.72 51.79 15.35 -8.77 coo 22.84 13.44 52.91 20.84 13.18 52.38 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 8.71 17.11 46.51 7.23 17.64 49.20 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 7 3 # 7 111 GLN B 124 GLN.? 12.28 O2 EDO B 193 294 GLU B 127 GLU^? 12.59 O2 MPD B 194 304 ARG B 149 ARG^? 5.09 O2 EDO B 193 coo 15.89 18.45 46.53 15.82 16.91 48.02 29.09 24.21 -38.79 30.63 24.36 -40.19 coo 22.84 13.44 52.91 20.84 13.18 52.38 29.39 12.97 -34.29 27.94 11.43 -34.46 coo 8.71 17.11 46.51 7.23 17.64 49.20 32.58 29.52 -34.06 34.17 32.07 -34.76 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 8 3 # 8 111 GLN B 174 GLN.? 7.74 C1 EDO B 193 294 GLU B 26 GLU.? 11.31 O2 EDO B 189 304 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 15.89 18.45 46.53 15.82 16.91 48.02 45.10 31.98 -27.69 44.64 33.91 -26.89 coo 22.84 13.44 52.91 20.84 13.18 52.38 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 8.71 17.11 46.51 7.23 17.64 49.20 42.21 27.31 -31.29 45.12 28.46 -31.33 1pmi_c00 source 1pmi PHOSPHOMANNOSE ISOMERASE : 8 hits 1pmi_c00 naa= 3 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 A 48 LEU A 47 LEU^? 8.05 O1 EDO A 189 A 58 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 120 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 34.02 69.29 75.26 34.82 67.82 76.74 52.48 17.67 2.84 53.43 18.52 4.62 coo 34.46 72.45 78.57 32.82 72.75 77.28 57.58 16.65 0.08 56.71 16.10 -1.78 coo 28.96 77.64 81.19 29.05 74.53 77.51 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 2 3 # 2 A 48 LEU B 47 LEU^? 8.42 C1 EDO B 189 A 58 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 120 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 34.02 69.29 75.26 34.82 67.82 76.74 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 34.46 72.45 78.57 32.82 72.75 77.28 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 28.96 77.64 81.19 29.05 74.53 77.51 51.85 4.84 -17.64 57.80 3.80 -15.89 1pym_c00 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 2 hits 1pym_c00 naa= 3 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 B 48 LEU A 47 LEU^? 8.05 O1 EDO A 189 B 58 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 120 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 54.50 104.32 58.69 55.83 105.69 59.81 52.48 17.67 2.84 53.43 18.52 4.62 coo 57.63 101.19 59.83 56.60 100.89 57.99 57.58 16.65 0.08 56.71 16.10 -1.78 coo 61.58 95.88 55.22 58.18 99.30 54.71 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 2 3 # 2 B 48 LEU B 47 LEU^? 8.42 C1 EDO B 189 B 58 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 120 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 54.50 104.32 58.69 55.83 105.69 59.81 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 57.63 101.19 59.83 56.60 100.89 57.99 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 61.58 95.88 55.22 58.18 99.30 54.71 51.85 4.84 -17.64 57.80 3.80 -15.89 1pym_c01 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 2 hits 1pym_c01 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 68 ALA A 79 ALA^? 16.03 O1 EDO A 189 A 72 LEU A 59 LEU^? 13.44 O1 EDO A 189 coo 46.76 7.59 18.65 45.27 6.01 18.52 68.63 22.07 21.16 67.50 22.56 22.86 coo 48.88 4.35 16.59 48.73 5.09 15.20 65.24 21.66 17.68 64.04 20.76 17.95 coo 53.89 6.25 15.09 52.88 7.92 14.14 61.94 16.27 16.74 61.27 16.69 14.73 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 68 ALA A 79 ALA^? 16.03 O1 EDO A 189 A 72 LEU A 78 LEU^? 13.24 O1 EDO A 189 coo 46.76 7.59 18.65 45.27 6.01 18.52 68.63 22.07 21.16 67.50 22.56 22.86 coo 48.88 4.35 16.59 48.73 5.09 15.20 65.24 21.66 17.68 64.04 20.76 17.95 coo 53.89 6.25 15.09 52.88 7.92 14.14 66.97 23.68 13.93 67.17 23.54 11.72 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 3 3 # 3 A 67 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 68 ALA A 95 ALA~? 16.69 O4 MPD A 191 A 72 LEU A 93 LEU~? 17.77 O1 EDO A 189 coo 46.76 7.59 18.65 45.27 6.01 18.52 60.01 27.52 25.19 61.63 28.83 24.67 coo 48.88 4.35 16.59 48.73 5.09 15.20 56.91 30.38 21.40 56.04 30.98 20.28 coo 53.89 6.25 15.09 52.88 7.92 14.14 60.93 29.43 17.24 60.83 29.61 15.05 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 4 3 # 4 A 67 ASP A 101 ASP^? 14.06 CM MPD A 191 A 68 ALA A 130 ALA^? 8.62 C3 MPD A 191 A 72 LEU A 131 LEU^? 12.33 O4 MPD A 191 coo 46.76 7.59 18.65 45.27 6.01 18.52 57.05 15.04 20.11 57.86 14.10 21.77 coo 48.88 4.35 16.59 48.73 5.09 15.20 53.71 18.81 21.19 52.67 17.80 20.63 coo 53.89 6.25 15.09 52.88 7.92 14.14 55.99 21.56 17.89 56.54 23.45 17.02 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 5 3 # 5 A 67 ASP A 103 ASP^? 5.49 CM MPD A 191 A 68 ALA A 130 ALA^? 8.62 C3 MPD A 191 A 72 LEU A 131 LEU^? 12.33 O4 MPD A 191 coo 46.76 7.59 18.65 45.27 6.01 18.52 51.58 16.40 16.66 49.70 15.49 16.18 coo 48.88 4.35 16.59 48.73 5.09 15.20 53.71 18.81 21.19 52.67 17.80 20.63 coo 53.89 6.25 15.09 52.88 7.92 14.14 55.99 21.56 17.89 56.54 23.45 17.02 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 6 3 # 6 A 67 ASP A 122 ASP.? 22.97 CM MPD A 191 A 68 ALA A 121 ALA.? 23.17 O2 MPD A 191 A 72 LEU A 120 LEU.? 17.29 O2 MPD A 191 coo 46.76 7.59 18.65 45.27 6.01 18.52 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 48.88 4.35 16.59 48.73 5.09 15.20 55.03 1.03 31.09 55.51 0.72 32.45 coo 53.89 6.25 15.09 52.88 7.92 14.14 54.69 4.72 28.64 54.09 6.84 28.79 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 7 3 # 7 A 67 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 68 ALA B 79 ALA^? 16.25 C1 EDO B 189 A 72 LEU B 59 LEU^? 13.53 C1 EDO B 189 coo 46.76 7.59 18.65 45.27 6.01 18.52 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 48.88 4.35 16.59 48.73 5.09 15.20 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 53.89 6.25 15.09 52.88 7.92 14.14 46.10 14.41 -30.73 47.37 13.70 -29.11 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 8 3 # 8 A 67 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 68 ALA B 79 ALA^? 16.25 C1 EDO B 189 A 72 LEU B 78 LEU^? 13.86 C1 EDO B 189 coo 46.76 7.59 18.65 45.27 6.01 18.52 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 48.88 4.35 16.59 48.73 5.09 15.20 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 53.89 6.25 15.09 52.88 7.92 14.14 52.17 7.14 -31.62 54.24 7.37 -31.17 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 9 3 # 9 A 67 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 68 ALA B 95 ALA~? 17.43 O4 MPD B 194 A 72 LEU B 93 LEU~? 17.97 C1 EDO B 189 coo 46.76 7.59 18.65 45.27 6.01 18.52 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 48.88 4.35 16.59 48.73 5.09 15.20 39.98 0.12 -31.29 40.06 -0.39 -29.86 coo 53.89 6.25 15.09 52.88 7.92 14.14 45.63 1.18 -30.57 46.85 1.04 -28.81 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 10 3 # 10 A 67 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 68 ALA B 130 ALA^? 8.48 O2 MPD B 194 A 72 LEU B 131 LEU^? 12.70 C3 MPD B 194 coo 46.76 7.59 18.65 45.27 6.01 18.52 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 48.88 4.35 16.59 48.73 5.09 15.20 36.89 11.57 -29.50 36.35 12.45 -28.44 coo 53.89 6.25 15.09 52.88 7.92 14.14 40.82 9.00 -28.22 41.89 7.18 -27.82 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 11 3 # 11 A 67 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 68 ALA B 130 ALA^? 8.48 O2 MPD B 194 A 72 LEU B 131 LEU^? 12.70 C3 MPD B 194 coo 46.76 7.59 18.65 45.27 6.01 18.52 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 48.88 4.35 16.59 48.73 5.09 15.20 36.89 11.57 -29.50 36.35 12.45 -28.44 coo 53.89 6.25 15.09 52.88 7.92 14.14 40.82 9.00 -28.22 41.89 7.18 -27.82 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 12 3 # 12 A 67 ASP B 122 ASP.? 7.15 O2 EDO B 192 A 68 ALA B 121 ALA.? 10.61 O2 EDO B 193 A 72 LEU B 120 LEU.? 8.93 O2 EDO B 193 coo 46.76 7.59 18.65 45.27 6.01 18.52 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 48.88 4.35 16.59 48.73 5.09 15.20 31.28 28.91 -38.38 30.52 28.99 -39.66 coo 53.89 6.25 15.09 52.88 7.92 14.14 32.65 25.36 -35.99 32.22 23.26 -35.57 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 12 hits 1q6l_c05 naa= 3 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 1 3 # 1 A 396 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 581 ARG A 82 ARG.? 24.76 O1 EDO A 189 A 713 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 67.94 16.79 18.42 70.70 18.25 18.48 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 69.47 19.71 26.08 71.03 22.01 24.70 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 2 3 # 2 A 396 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 581 ARG A 117 ARG~? 16.06 O2 MPD A 191 A 713 ARG A 82 ARG.? 24.76 O1 EDO A 189 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 67.94 16.79 18.42 70.70 18.25 18.48 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 61.14 12.50 23.45 58.83 13.31 25.34 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 69.47 19.71 26.08 71.03 22.01 24.70 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 3 3 # 3 A 396 ARG A 82 ARG.? 24.76 O1 EDO A 189 A 581 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 713 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 69.47 19.71 26.08 71.03 22.01 24.70 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 67.94 16.79 18.42 70.70 18.25 18.48 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 4 3 # 4 A 396 ARG A 129 ARG^? 14.04 O2 MPD A 191 A 581 ARG A 144 ARG^? 11.59 O2 MPD A 191 A 713 ARG A 141 ARG^? 4.89 O4 MPD A 191 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 54.99 23.34 25.48 52.76 24.40 27.34 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 48.95 22.48 28.26 46.62 21.31 29.92 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 47.94 26.40 17.24 45.84 24.19 17.73 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 5 3 # 5 A 396 ARG A 144 ARG^? 11.59 O2 MPD A 191 A 581 ARG A 129 ARG^? 14.04 O2 MPD A 191 A 713 ARG A 141 ARG^? 4.89 O4 MPD A 191 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 48.95 22.48 28.26 46.62 21.31 29.92 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 54.99 23.34 25.48 52.76 24.40 27.34 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 47.94 26.40 17.24 45.84 24.19 17.73 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 6 3 # 6 A 396 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 581 ARG B 82 ARG.? 22.52 O2 EDO B 193 A 713 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 7 3 # 7 A 396 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 581 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 713 ARG B 82 ARG.? 22.52 O2 EDO B 193 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 46.69 11.07 -43.02 44.95 12.59 -45.09 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 8 3 # 8 A 396 ARG B 82 ARG.? 22.52 O2 EDO B 193 A 581 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 713 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 9 3 # 9 A 396 ARG B 117 ARG~? 13.46 O2 EDO B 193 A 581 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 713 ARG B 82 ARG.? 22.52 O2 EDO B 193 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 46.69 11.07 -43.02 44.95 12.59 -45.09 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 10 3 # 10 A 396 ARG B 129 ARG^? 16.59 O2 MPD B 194 A 581 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 713 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 35.59 7.18 -33.96 34.54 5.79 -36.47 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 34.68 4.05 -23.26 33.98 5.70 -20.76 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 11 3 # 11 A 396 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 581 ARG B 129 ARG^? 16.59 O2 MPD B 194 A 713 ARG B 141 ARG^? 5.70 O4 MPD B 194 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 35.59 7.18 -33.96 34.54 5.79 -36.47 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 34.68 4.05 -23.26 33.98 5.70 -20.76 1qb4_c01 source 1qb4 PHOSPHOENOLPYRUVATE CARBOXYLASE : 11 hits 1qb4_c01 naa= 3 ULMN 3 1qfe_c00 3-DEHYDROQUINATE DEHYDRATASE user 1 3 # 1 A 86 GLU A 61 GLU^? 10.22 O1 EDO A 189 A 143 HIS A 76 HIS^? 9.12 O1 EDO A 189 A 170 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo -2.40 27.37 52.92 -1.22 29.09 52.71 66.46 19.59 10.29 68.35 19.61 9.28 coo 1.36 26.79 49.43 3.17 26.89 50.50 65.00 24.12 7.67 66.83 23.12 7.94 coo 7.24 31.80 48.14 6.27 25.92 49.70 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1qfe_c00 3-DEHYDROQUINATE DEHYDRATASE user 2 3 # 2 A 86 GLU B 61 GLU^? 10.17 C1 EDO B 189 A 143 HIS B 76 HIS^? 9.10 C1 EDO B 189 A 170 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo -2.40 27.37 52.92 -1.22 29.09 52.71 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 1.36 26.79 49.43 3.17 26.89 50.50 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 7.24 31.80 48.14 6.27 25.92 49.70 51.85 4.84 -17.64 57.80 3.80 -15.89 1qfe_c00 source 1qfe 3-DEHYDROQUINATE DEHYDRATASE : 2 hits 1qfe_c00 naa= 3 ULMN 3 1qfe_c01 3-DEHYDROQUINATE DEHYDRATASE user 1 3 # 1 B 86 GLU A 61 GLU^? 10.22 O1 EDO A 189 B 143 HIS A 76 HIS^? 9.12 O1 EDO A 189 B 170 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 13.90 37.16 5.96 12.00 36.26 6.12 66.46 19.59 10.29 68.35 19.61 9.28 coo 13.52 33.69 9.79 13.20 31.83 8.88 65.00 24.12 7.67 66.83 23.12 7.94 coo 7.52 28.83 11.02 13.59 28.74 9.95 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 1qfe_c01 3-DEHYDROQUINATE DEHYDRATASE user 2 3 # 2 B 86 GLU B 61 GLU^? 10.17 C1 EDO B 189 B 143 HIS B 76 HIS^? 9.10 C1 EDO B 189 B 170 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 13.90 37.16 5.96 12.00 36.26 6.12 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 13.52 33.69 9.79 13.20 31.83 8.88 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 7.52 28.83 11.02 13.59 28.74 9.95 51.85 4.84 -17.64 57.80 3.80 -15.89 1qfe_c01 source 1qfe 3-DEHYDROQUINATE DEHYDRATASE : 2 hits 1qfe_c01 naa= 3 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 155 HIS A 65 HIS^? 6.20 C1 EDO A 189 A 236 ASP A 103 ASP^? 5.49 CM MPD A 191 A 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 55.45 46.76 42.08 57.34 46.16 42.75 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 48.87 29.19 44.63 49.10 27.34 43.63 51.58 16.40 16.66 49.70 15.49 16.18 coo 47.58 17.35 41.83 51.40 20.85 40.83 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 155 HIS A 76 HIS^? 9.12 O1 EDO A 189 A 236 ASP A 103 ASP^? 5.49 CM MPD A 191 A 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 55.45 46.76 42.08 57.34 46.16 42.75 65.00 24.12 7.67 66.83 23.12 7.94 coo 48.87 29.19 44.63 49.10 27.34 43.63 51.58 16.40 16.66 49.70 15.49 16.18 coo 47.58 17.35 41.83 51.40 20.85 40.83 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 155 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 236 ASP A 103 ASP^? 5.49 CM MPD A 191 A 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 55.45 46.76 42.08 57.34 46.16 42.75 65.85 25.32 24.26 66.00 24.92 26.31 coo 48.87 29.19 44.63 49.10 27.34 43.63 51.58 16.40 16.66 49.70 15.49 16.18 coo 47.58 17.35 41.83 51.40 20.85 40.83 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 155 HIS B 65 HIS^? -5.26 O1 EDO B 189s A 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 55.45 46.76 42.08 57.34 46.16 42.75 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 48.87 29.19 44.63 49.10 27.34 43.63 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 47.58 17.35 41.83 51.40 20.85 40.83 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 155 HIS B 76 HIS^? 9.10 C1 EDO B 189 A 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 55.45 46.76 42.08 57.34 46.16 42.75 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 48.87 29.19 44.63 49.10 27.34 43.63 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 47.58 17.35 41.83 51.40 20.85 40.83 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 A 155 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 55.45 46.76 42.08 57.34 46.16 42.75 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 48.87 29.19 44.63 49.10 27.34 43.63 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 47.58 17.35 41.83 51.40 20.85 40.83 25.14 19.21 -22.67 21.76 17.11 -26.55 1qgn_c00 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1qgn_c00 naa= 3 ULMN 3 1qgn_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 155 HIS A 65 HIS^? 6.20 C1 EDO A 189 B 236 ASP A 103 ASP^? 5.49 CM MPD A 191 B 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 17.23 -29.05 11.63 18.63 -29.78 10.25 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 51.58 16.40 16.66 49.70 15.49 16.18 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c01 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 155 HIS A 76 HIS^? 9.12 O1 EDO A 189 B 236 ASP A 103 ASP^? 5.49 CM MPD A 191 B 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 17.23 -29.05 11.63 18.63 -29.78 10.25 65.00 24.12 7.67 66.83 23.12 7.94 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 51.58 16.40 16.66 49.70 15.49 16.18 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c01 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 155 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 236 ASP A 103 ASP^? 5.49 CM MPD A 191 B 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 17.23 -29.05 11.63 18.63 -29.78 10.25 65.85 25.32 24.26 66.00 24.92 26.31 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 51.58 16.40 16.66 49.70 15.49 16.18 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c01 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 155 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 17.23 -29.05 11.63 18.63 -29.78 10.25 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c01 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 155 HIS B 76 HIS^? 9.10 C1 EDO B 189 B 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 17.23 -29.05 11.63 18.63 -29.78 10.25 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c01 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 B 155 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 17.23 -29.05 11.63 18.63 -29.78 10.25 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 25.14 19.21 -22.67 21.76 17.11 -26.55 1qgn_c01 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1qgn_c01 naa= 3 ULMN 3 1qgn_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 C 155 HIS A 65 HIS^? 6.20 C1 EDO A 189 C 236 ASP A 103 ASP^? 5.49 CM MPD A 191 C 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 55.11 47.10 12.61 53.44 47.85 11.58 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 45.78 31.11 9.51 44.25 30.06 10.53 51.58 16.40 16.66 49.70 15.49 16.18 coo 37.54 22.37 12.10 37.83 27.55 13.24 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c02 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 C 155 HIS A 76 HIS^? 9.12 O1 EDO A 189 C 236 ASP A 103 ASP^? 5.49 CM MPD A 191 C 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 55.11 47.10 12.61 53.44 47.85 11.58 65.00 24.12 7.67 66.83 23.12 7.94 coo 45.78 31.11 9.51 44.25 30.06 10.53 51.58 16.40 16.66 49.70 15.49 16.18 coo 37.54 22.37 12.10 37.83 27.55 13.24 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c02 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 C 155 HIS A 84 HIS.? 23.86 O4 MPD A 191 C 236 ASP A 103 ASP^? 5.49 CM MPD A 191 C 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 55.11 47.10 12.61 53.44 47.85 11.58 65.85 25.32 24.26 66.00 24.92 26.31 coo 45.78 31.11 9.51 44.25 30.06 10.53 51.58 16.40 16.66 49.70 15.49 16.18 coo 37.54 22.37 12.10 37.83 27.55 13.24 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c02 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 C 155 HIS B 65 HIS^? -5.26 O1 EDO B 189s C 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 C 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 55.11 47.10 12.61 53.44 47.85 11.58 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 45.78 31.11 9.51 44.25 30.06 10.53 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 37.54 22.37 12.10 37.83 27.55 13.24 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c02 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 C 155 HIS B 76 HIS^? 9.10 C1 EDO B 189 C 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 C 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 55.11 47.10 12.61 53.44 47.85 11.58 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 45.78 31.11 9.51 44.25 30.06 10.53 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 37.54 22.37 12.10 37.83 27.55 13.24 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c02 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 C 155 HIS B 84 HIS.? 24.24 O2 MPD B 194 C 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 C 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 55.11 47.10 12.61 53.44 47.85 11.58 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 45.78 31.11 9.51 44.25 30.06 10.53 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 37.54 22.37 12.10 37.83 27.55 13.24 25.14 19.21 -22.67 21.76 17.11 -26.55 1qgn_c02 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1qgn_c02 naa= 3 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 155 HIS A 65 HIS^? 6.20 C1 EDO A 189 D 236 ASP A 103 ASP^? 5.49 CM MPD A 191 D 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 51.58 16.40 16.66 49.70 15.49 16.18 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 D 155 HIS A 76 HIS^? 9.12 O1 EDO A 189 D 236 ASP A 103 ASP^? 5.49 CM MPD A 191 D 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 65.00 24.12 7.67 66.83 23.12 7.94 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 51.58 16.40 16.66 49.70 15.49 16.18 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 D 155 HIS A 84 HIS.? 23.86 O4 MPD A 191 D 236 ASP A 103 ASP^? 5.49 CM MPD A 191 D 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 65.85 25.32 24.26 66.00 24.92 26.31 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 51.58 16.40 16.66 49.70 15.49 16.18 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 D 155 HIS B 65 HIS^? -5.26 O1 EDO B 189s D 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 D 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 D 155 HIS B 76 HIS^? 9.10 C1 EDO B 189 D 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 D 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 D 155 HIS B 84 HIS.? 24.24 O2 MPD B 194 D 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 D 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 25.14 19.21 -22.67 21.76 17.11 -26.55 1qgn_c03 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1qgn_c03 naa= 3 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 155 HIS A 65 HIS^? 6.20 C1 EDO A 189 E 236 ASP A 103 ASP^? 5.49 CM MPD A 191 E 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 51.58 16.40 16.66 49.70 15.49 16.18 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 155 HIS A 76 HIS^? 9.12 O1 EDO A 189 E 236 ASP A 103 ASP^? 5.49 CM MPD A 191 E 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 65.00 24.12 7.67 66.83 23.12 7.94 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 51.58 16.40 16.66 49.70 15.49 16.18 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 E 155 HIS A 84 HIS.? 23.86 O4 MPD A 191 E 236 ASP A 103 ASP^? 5.49 CM MPD A 191 E 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 65.85 25.32 24.26 66.00 24.92 26.31 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 51.58 16.40 16.66 49.70 15.49 16.18 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 E 155 HIS B 65 HIS^? -5.26 O1 EDO B 189s E 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 E 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 E 155 HIS B 76 HIS^? 9.10 C1 EDO B 189 E 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 E 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 E 155 HIS B 84 HIS.? 24.24 O2 MPD B 194 E 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 E 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 25.14 19.21 -22.67 21.76 17.11 -26.55 1qgn_c04 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1qgn_c04 naa= 3 ULMN 3 1qgn_c05 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 155 HIS A 65 HIS^? 6.20 C1 EDO A 189 F 236 ASP A 103 ASP^? 5.49 CM MPD A 191 F 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 3.13 15.54 -65.72 2.08 14.15 -66.89 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 51.58 16.40 16.66 49.70 15.49 16.18 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c05 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 155 HIS A 76 HIS^? 9.12 O1 EDO A 189 F 236 ASP A 103 ASP^? 5.49 CM MPD A 191 F 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 3.13 15.54 -65.72 2.08 14.15 -66.89 65.00 24.12 7.67 66.83 23.12 7.94 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 51.58 16.40 16.66 49.70 15.49 16.18 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c05 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 F 155 HIS A 84 HIS.? 23.86 O4 MPD A 191 F 236 ASP A 103 ASP^? 5.49 CM MPD A 191 F 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 3.13 15.54 -65.72 2.08 14.15 -66.89 65.85 25.32 24.26 66.00 24.92 26.31 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 51.58 16.40 16.66 49.70 15.49 16.18 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c05 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 F 155 HIS B 65 HIS^? -5.26 O1 EDO B 189s F 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 F 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 3.13 15.54 -65.72 2.08 14.15 -66.89 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c05 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 F 155 HIS B 76 HIS^? 9.10 C1 EDO B 189 F 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 F 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 3.13 15.54 -65.72 2.08 14.15 -66.89 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c05 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 F 155 HIS B 84 HIS.? 24.24 O2 MPD B 194 F 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 F 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 3.13 15.54 -65.72 2.08 14.15 -66.89 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 25.14 19.21 -22.67 21.76 17.11 -26.55 1qgn_c05 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1qgn_c05 naa= 3 ULMN 3 1qgn_c06 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 G 155 HIS A 65 HIS^? 6.20 C1 EDO A 189 G 236 ASP A 103 ASP^? 5.49 CM MPD A 191 G 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 76.68 -27.27 -65.07 77.71 -25.72 -66.04 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 51.58 16.40 16.66 49.70 15.49 16.18 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c06 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 G 155 HIS A 76 HIS^? 9.12 O1 EDO A 189 G 236 ASP A 103 ASP^? 5.49 CM MPD A 191 G 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 76.68 -27.27 -65.07 77.71 -25.72 -66.04 65.00 24.12 7.67 66.83 23.12 7.94 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 51.58 16.40 16.66 49.70 15.49 16.18 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c06 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 G 155 HIS A 84 HIS.? 23.86 O4 MPD A 191 G 236 ASP A 103 ASP^? 5.49 CM MPD A 191 G 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 76.68 -27.27 -65.07 77.71 -25.72 -66.04 65.85 25.32 24.26 66.00 24.92 26.31 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 51.58 16.40 16.66 49.70 15.49 16.18 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c06 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 G 155 HIS B 65 HIS^? -5.26 O1 EDO B 189s G 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 G 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 76.68 -27.27 -65.07 77.71 -25.72 -66.04 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c06 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 G 155 HIS B 76 HIS^? 9.10 C1 EDO B 189 G 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 G 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 76.68 -27.27 -65.07 77.71 -25.72 -66.04 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c06 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 G 155 HIS B 84 HIS.? 24.24 O2 MPD B 194 G 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 G 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 76.68 -27.27 -65.07 77.71 -25.72 -66.04 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 25.14 19.21 -22.67 21.76 17.11 -26.55 1qgn_c06 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1qgn_c06 naa= 3 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 155 HIS A 65 HIS^? 6.20 C1 EDO A 189 H 236 ASP A 103 ASP^? 5.49 CM MPD A 191 H 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 51.58 16.40 16.66 49.70 15.49 16.18 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 H 155 HIS A 76 HIS^? 9.12 O1 EDO A 189 H 236 ASP A 103 ASP^? 5.49 CM MPD A 191 H 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 65.00 24.12 7.67 66.83 23.12 7.94 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 51.58 16.40 16.66 49.70 15.49 16.18 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 H 155 HIS A 84 HIS.? 23.86 O4 MPD A 191 H 236 ASP A 103 ASP^? 5.49 CM MPD A 191 H 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 65.85 25.32 24.26 66.00 24.92 26.31 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 51.58 16.40 16.66 49.70 15.49 16.18 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 H 155 HIS B 65 HIS^? -5.26 O1 EDO B 189s H 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 H 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 H 155 HIS B 76 HIS^? 9.10 C1 EDO B 189 H 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 H 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 25.14 19.21 -22.67 21.76 17.11 -26.55 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 H 155 HIS B 84 HIS.? 24.24 O2 MPD B 194 H 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 H 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 25.14 19.21 -22.67 21.76 17.11 -26.55 1qgn_c07 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1qgn_c07 naa= 3 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 147 TYR^? 9.49 CM MPD A 191 A 236 ASP A 103 ASP^? 5.49 CM MPD A 191 A 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 55.48 26.51 40.65 55.39 23.99 39.43 50.88 9.76 23.94 51.01 10.64 21.28 coo 48.87 29.19 44.63 49.10 27.34 43.63 51.58 16.40 16.66 49.70 15.49 16.18 coo 47.58 17.35 41.83 51.40 20.85 40.83 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 A 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 55.48 26.51 40.65 55.39 23.99 39.43 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 48.87 29.19 44.63 49.10 27.34 43.63 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 47.58 17.35 41.83 51.40 20.85 40.83 25.14 19.21 -22.67 21.76 17.11 -26.55 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 147 TYR^? 9.49 CM MPD A 191 B 236 ASP A 103 ASP^? 5.49 CM MPD A 191 B 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 50.88 9.76 23.94 51.01 10.64 21.28 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 51.58 16.40 16.66 49.70 15.49 16.18 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 B 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 25.14 19.21 -22.67 21.76 17.11 -26.55 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 147 TYR^? 9.49 CM MPD A 191 C 236 ASP A 103 ASP^? 5.49 CM MPD A 191 C 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 39.51 34.34 13.63 37.63 32.61 14.79 50.88 9.76 23.94 51.01 10.64 21.28 coo 45.78 31.11 9.51 44.25 30.06 10.53 51.58 16.40 16.66 49.70 15.49 16.18 coo 37.54 22.37 12.10 37.83 27.55 13.24 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 C 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 C 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 C 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 39.51 34.34 13.63 37.63 32.61 14.79 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 45.78 31.11 9.51 44.25 30.06 10.53 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 37.54 22.37 12.10 37.83 27.55 13.24 25.14 19.21 -22.67 21.76 17.11 -26.55 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 147 TYR^? 9.49 CM MPD A 191 D 236 ASP A 103 ASP^? 5.49 CM MPD A 191 D 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 50.88 9.76 23.94 51.01 10.64 21.28 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 51.58 16.40 16.66 49.70 15.49 16.18 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 D 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 D 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 D 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 25.14 19.21 -22.67 21.76 17.11 -26.55 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 147 TYR^? 9.49 CM MPD A 191 E 236 ASP A 103 ASP^? 5.49 CM MPD A 191 E 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 50.88 9.76 23.94 51.01 10.64 21.28 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 51.58 16.40 16.66 49.70 15.49 16.18 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 E 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 E 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 25.14 19.21 -22.67 21.76 17.11 -26.55 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 147 TYR^? 9.49 CM MPD A 191 F 236 ASP A 103 ASP^? 5.49 CM MPD A 191 F 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 50.88 9.76 23.94 51.01 10.64 21.28 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 51.58 16.40 16.66 49.70 15.49 16.18 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 F 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 F 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 25.14 19.21 -22.67 21.76 17.11 -26.55 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 147 TYR^? 9.49 CM MPD A 191 G 236 ASP A 103 ASP^? 5.49 CM MPD A 191 G 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 50.88 9.76 23.94 51.01 10.64 21.28 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 51.58 16.40 16.66 49.70 15.49 16.18 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 G 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 G 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 G 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 25.14 19.21 -22.67 21.76 17.11 -26.55 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 147 TYR^? 9.49 CM MPD A 191 H 236 ASP A 103 ASP^? 5.49 CM MPD A 191 H 261 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 50.88 9.76 23.94 51.01 10.64 21.28 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 51.58 16.40 16.66 49.70 15.49 16.18 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 H 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 H 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 H 261 LYS B 166 LYS^? 10.40 O2 MPD B 194 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 25.14 19.21 -22.67 21.76 17.11 -26.55 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 A 116 ARG~? 15.92 O1 EDO B 190 C 163 TYR A 155 TYR^? 14.94 CM MPD A 191 C 236 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 39.01 29.77 22.02 37.48 31.30 19.84 59.64 3.34 19.37 61.78 2.26 17.40 coo 39.51 34.34 13.63 37.63 32.61 14.79 50.44 4.00 23.33 52.91 2.96 24.17 coo 45.78 31.11 9.51 44.25 30.06 10.53 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 C 163 TYR A 155 TYR^? 14.94 CM MPD A 191 C 236 ASP A 151 ASP^? 20.35 CM MPD A 191 coo 39.01 29.77 22.02 37.48 31.30 19.84 59.64 3.34 19.37 61.78 2.26 17.40 coo 39.51 34.34 13.63 37.63 32.61 14.79 50.44 4.00 23.33 52.91 2.96 24.17 coo 45.78 31.11 9.51 44.25 30.06 10.53 48.38 -3.74 26.58 47.39 -3.82 24.70 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 110 ARG A 117 ARG~? 16.06 O2 MPD A 191 C 163 TYR A 147 TYR^? 9.49 CM MPD A 191 C 236 ASP A 103 ASP^? 5.49 CM MPD A 191 coo 39.01 29.77 22.02 37.48 31.30 19.84 61.14 12.50 23.45 58.83 13.31 25.34 coo 39.51 34.34 13.63 37.63 32.61 14.79 50.88 9.76 23.94 51.01 10.64 21.28 coo 45.78 31.11 9.51 44.25 30.06 10.53 51.58 16.40 16.66 49.70 15.49 16.18 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 C 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 C 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 39.01 29.77 22.02 37.48 31.30 19.84 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 39.51 34.34 13.63 37.63 32.61 14.79 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 45.78 31.11 9.51 44.25 30.06 10.53 28.45 32.01 -35.99 29.78 33.29 -34.96 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 C 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 C 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 39.01 29.77 22.02 37.48 31.30 19.84 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 39.51 34.34 13.63 37.63 32.61 14.79 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 45.78 31.11 9.51 44.25 30.06 10.53 29.45 33.81 -30.55 29.73 34.07 -28.42 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 A 110 ARG B 117 ARG~? 13.46 O2 EDO B 193 C 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 C 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 coo 39.01 29.77 22.02 37.48 31.30 19.84 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 39.51 34.34 13.63 37.63 32.61 14.79 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 45.78 31.11 9.51 44.25 30.06 10.53 37.95 13.84 -24.45 36.74 14.66 -22.84 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 # 7 A 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 C 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 C 236 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 39.01 29.77 22.02 37.48 31.30 19.84 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 39.51 34.34 13.63 37.63 32.61 14.79 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 45.78 31.11 9.51 44.25 30.06 10.53 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 # 8 A 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 C 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 C 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 39.01 29.77 22.02 37.48 31.30 19.84 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 39.51 34.34 13.63 37.63 32.61 14.79 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 45.78 31.11 9.51 44.25 30.06 10.53 28.45 32.01 -35.99 29.78 33.29 -34.96 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 # 9 A 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 C 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 C 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 39.01 29.77 22.02 37.48 31.30 19.84 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 39.51 34.34 13.63 37.63 32.61 14.79 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 45.78 31.11 9.51 44.25 30.06 10.53 29.45 33.81 -30.55 29.73 34.07 -28.42 1qgn_c16 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 9 hits 1qgn_c16 naa= 3 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 D 163 TYR A 155 TYR^? 14.94 CM MPD A 191 D 236 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 59.64 3.34 19.37 61.78 2.26 17.40 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 50.44 4.00 23.33 52.91 2.96 24.17 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 D 163 TYR A 155 TYR^? 14.94 CM MPD A 191 D 236 ASP A 151 ASP^? 20.35 CM MPD A 191 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 59.64 3.34 19.37 61.78 2.26 17.40 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 50.44 4.00 23.33 52.91 2.96 24.17 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 48.38 -3.74 26.58 47.39 -3.82 24.70 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 110 ARG A 117 ARG~? 16.06 O2 MPD A 191 D 163 TYR A 147 TYR^? 9.49 CM MPD A 191 D 236 ASP A 103 ASP^? 5.49 CM MPD A 191 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 61.14 12.50 23.45 58.83 13.31 25.34 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 50.88 9.76 23.94 51.01 10.64 21.28 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 51.58 16.40 16.66 49.70 15.49 16.18 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 D 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 D 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 37.95 13.84 -24.45 36.74 14.66 -22.84 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 D 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 D 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 28.45 32.01 -35.99 29.78 33.29 -34.96 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 B 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 D 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 D 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 23.05 -7.35 32.81 21.30 -7.38 35.33 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 29.45 33.81 -30.55 29.73 34.07 -28.42 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 # 7 B 110 ARG B 117 ARG~? 13.46 O2 EDO B 193 D 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 D 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 37.95 13.84 -24.45 36.74 14.66 -22.84 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 # 8 B 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 D 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 D 236 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 # 9 B 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 D 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 D 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 28.45 32.01 -35.99 29.78 33.29 -34.96 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 10 3 # 10 B 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 D 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 D 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 23.05 -7.35 32.81 21.30 -7.38 35.33 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 29.45 33.81 -30.55 29.73 34.07 -28.42 1qgn_c17 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 10 hits 1qgn_c17 naa= 3 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 147 TYR^? 9.49 CM MPD A 191 A 236 ASP A 103 ASP^? 5.49 CM MPD A 191 C 110 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 55.48 26.51 40.65 55.39 23.99 39.43 50.88 9.76 23.94 51.01 10.64 21.28 coo 48.87 29.19 44.63 49.10 27.34 43.63 51.58 16.40 16.66 49.70 15.49 16.18 coo 52.39 23.42 32.10 54.51 23.27 34.29 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR A 155 TYR^? 14.94 CM MPD A 191 A 236 ASP A 122 ASP.? 22.97 CM MPD A 191 C 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 55.48 26.51 40.65 55.39 23.99 39.43 50.44 4.00 23.33 52.91 2.96 24.17 coo 48.87 29.19 44.63 49.10 27.34 43.63 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 52.39 23.42 32.10 54.51 23.27 34.29 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 163 TYR A 155 TYR^? 14.94 CM MPD A 191 A 236 ASP A 151 ASP^? 20.35 CM MPD A 191 C 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 55.48 26.51 40.65 55.39 23.99 39.43 50.44 4.00 23.33 52.91 2.96 24.17 coo 48.87 29.19 44.63 49.10 27.34 43.63 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 52.39 23.42 32.10 54.51 23.27 34.29 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 A 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 C 110 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 55.48 26.51 40.65 55.39 23.99 39.43 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 48.87 29.19 44.63 49.10 27.34 43.63 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 52.39 23.42 32.10 54.51 23.27 34.29 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 C 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 55.48 26.51 40.65 55.39 23.99 39.43 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 48.87 29.19 44.63 49.10 27.34 43.63 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 52.39 23.42 32.10 54.51 23.27 34.29 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 A 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 C 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 55.48 26.51 40.65 55.39 23.99 39.43 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 48.87 29.19 44.63 49.10 27.34 43.63 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 52.39 23.42 32.10 54.51 23.27 34.29 24.74 19.51 -33.91 24.95 16.46 -33.56 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 # 7 A 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s C 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 55.48 26.51 40.65 55.39 23.99 39.43 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 48.87 29.19 44.63 49.10 27.34 43.63 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 52.39 23.42 32.10 54.51 23.27 34.29 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 # 8 A 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s C 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 55.48 26.51 40.65 55.39 23.99 39.43 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 48.87 29.19 44.63 49.10 27.34 43.63 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 52.39 23.42 32.10 54.51 23.27 34.29 24.74 19.51 -33.91 24.95 16.46 -33.56 1qgn_c18 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 8 hits 1qgn_c18 naa= 3 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 147 TYR^? 9.49 CM MPD A 191 B 236 ASP A 103 ASP^? 5.49 CM MPD A 191 D 110 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 50.88 9.76 23.94 51.01 10.64 21.28 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 51.58 16.40 16.66 49.70 15.49 16.18 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR A 155 TYR^? 14.94 CM MPD A 191 B 236 ASP A 122 ASP.? 22.97 CM MPD A 191 D 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 50.44 4.00 23.33 52.91 2.96 24.17 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 163 TYR A 155 TYR^? 14.94 CM MPD A 191 B 236 ASP A 151 ASP^? 20.35 CM MPD A 191 D 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 50.44 4.00 23.33 52.91 2.96 24.17 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 B 236 ASP B 101 ASP^? 13.71 C2 EDO B 193 D 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 24.74 19.51 -33.91 24.95 16.46 -33.56 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 B 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 D 110 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 B 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 B 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 D 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 # 7 B 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 B 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 D 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 24.74 19.51 -33.91 24.95 16.46 -33.56 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 # 8 B 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 B 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s D 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 # 9 B 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 B 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s D 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 24.74 19.51 -33.91 24.95 16.46 -33.56 1qgn_c19 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 9 hits 1qgn_c19 naa= 3 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 G 163 TYR A 155 TYR^? 14.94 CM MPD A 191 G 236 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 59.64 3.34 19.37 61.78 2.26 17.40 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 50.44 4.00 23.33 52.91 2.96 24.17 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 G 163 TYR A 155 TYR^? 14.94 CM MPD A 191 G 236 ASP A 151 ASP^? 20.35 CM MPD A 191 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 59.64 3.34 19.37 61.78 2.26 17.40 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 50.44 4.00 23.33 52.91 2.96 24.17 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 48.38 -3.74 26.58 47.39 -3.82 24.70 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 E 110 ARG A 117 ARG~? 16.06 O2 MPD A 191 G 163 TYR A 147 TYR^? 9.49 CM MPD A 191 G 236 ASP A 103 ASP^? 5.49 CM MPD A 191 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 61.14 12.50 23.45 58.83 13.31 25.34 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 50.88 9.76 23.94 51.01 10.64 21.28 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 51.58 16.40 16.66 49.70 15.49 16.18 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 E 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 G 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 G 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 28.45 32.01 -35.99 29.78 33.29 -34.96 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 E 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 G 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 G 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 29.45 33.81 -30.55 29.73 34.07 -28.42 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 E 110 ARG B 117 ARG~? 13.46 O2 EDO B 193 G 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 G 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 37.95 13.84 -24.45 36.74 14.66 -22.84 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 # 7 E 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 G 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 G 236 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 # 8 E 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 G 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 G 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 28.45 32.01 -35.99 29.78 33.29 -34.96 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 # 9 E 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 G 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 G 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 29.45 33.81 -30.55 29.73 34.07 -28.42 1qgn_c20 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 9 hits 1qgn_c20 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 H 163 TYR A 155 TYR^? 14.94 CM MPD A 191 H 236 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 59.64 3.34 19.37 61.78 2.26 17.40 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 50.44 4.00 23.33 52.91 2.96 24.17 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 H 163 TYR A 155 TYR^? 14.94 CM MPD A 191 H 236 ASP A 151 ASP^? 20.35 CM MPD A 191 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 59.64 3.34 19.37 61.78 2.26 17.40 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 50.44 4.00 23.33 52.91 2.96 24.17 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 48.38 -3.74 26.58 47.39 -3.82 24.70 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 F 110 ARG A 117 ARG~? 16.06 O2 MPD A 191 H 163 TYR A 147 TYR^? 9.49 CM MPD A 191 H 236 ASP A 103 ASP^? 5.49 CM MPD A 191 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 61.14 12.50 23.45 58.83 13.31 25.34 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 50.88 9.76 23.94 51.01 10.64 21.28 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 51.58 16.40 16.66 49.70 15.49 16.18 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 F 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 H 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 H 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 37.95 13.84 -24.45 36.74 14.66 -22.84 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 F 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 H 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 H 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 28.45 32.01 -35.99 29.78 33.29 -34.96 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 F 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 H 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 H 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 24.62 8.71 -44.89 24.77 10.53 -42.42 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 29.45 33.81 -30.55 29.73 34.07 -28.42 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 # 7 F 110 ARG B 117 ARG~? 13.46 O2 EDO B 193 H 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 H 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 37.95 13.84 -24.45 36.74 14.66 -22.84 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 # 8 F 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 H 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 H 236 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 # 9 F 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 H 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 H 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 28.45 32.01 -35.99 29.78 33.29 -34.96 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 10 3 # 10 F 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 H 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 H 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 24.62 8.71 -44.89 24.77 10.53 -42.42 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 29.45 33.81 -30.55 29.73 34.07 -28.42 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 10 hits 1qgn_c21 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 147 TYR^? 9.49 CM MPD A 191 E 236 ASP A 103 ASP^? 5.49 CM MPD A 191 G 110 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 50.88 9.76 23.94 51.01 10.64 21.28 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 51.58 16.40 16.66 49.70 15.49 16.18 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR A 155 TYR^? 14.94 CM MPD A 191 E 236 ASP A 122 ASP.? 22.97 CM MPD A 191 G 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 50.44 4.00 23.33 52.91 2.96 24.17 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 E 163 TYR A 155 TYR^? 14.94 CM MPD A 191 E 236 ASP A 151 ASP^? 20.35 CM MPD A 191 G 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 50.44 4.00 23.33 52.91 2.96 24.17 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 E 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 E 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 G 110 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 E 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 E 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 G 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 E 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 E 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s G 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 42.21 27.31 -31.29 45.12 28.46 -31.33 1qgn_c22 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1qgn_c22 naa= 3 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 147 TYR^? 9.49 CM MPD A 191 F 236 ASP A 103 ASP^? 5.49 CM MPD A 191 H 110 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 50.88 9.76 23.94 51.01 10.64 21.28 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 51.58 16.40 16.66 49.70 15.49 16.18 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR A 155 TYR^? 14.94 CM MPD A 191 F 236 ASP A 122 ASP.? 22.97 CM MPD A 191 H 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 50.44 4.00 23.33 52.91 2.96 24.17 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 F 163 TYR A 155 TYR^? 14.94 CM MPD A 191 F 236 ASP A 151 ASP^? 20.35 CM MPD A 191 H 110 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 50.44 4.00 23.33 52.91 2.96 24.17 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 F 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 F 236 ASP B 101 ASP^? 13.71 C2 EDO B 193 H 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 24.74 19.51 -33.91 24.95 16.46 -33.56 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 F 163 TYR B 147 TYR^? 9.73 O2 MPD B 194 F 236 ASP B 103 ASP^? 5.57 C5 MPD B 194 H 110 ARG B 117 ARG~? 13.46 O2 EDO B 193 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 41.12 18.08 -35.59 38.25 17.08 -35.73 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 F 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 F 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 H 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 7 3 # 7 F 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 F 236 ASP B 122 ASP.? 7.15 O2 EDO B 192 H 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 24.74 19.51 -33.91 24.95 16.46 -33.56 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 8 3 # 8 F 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 F 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s H 110 ARG B 116 ARG~? 5.91 C2 EDO B 193 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 42.21 27.31 -31.29 45.12 28.46 -31.33 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 9 3 # 9 F 163 TYR B 155 TYR^? 6.08 O1 EDO B 193 F 236 ASP B 151 ASP^? -3.26 O1 EDO B 192s H 110 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 24.74 19.51 -33.91 24.95 16.46 -33.56 1qgn_c23 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 9 hits 1qgn_c23 naa= 3 ULMN 3 1qho_c04 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 256 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 329 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 28.46 69.88 26.74 30.40 70.70 26.53 64.75 2.11 3.69 66.46 3.28 4.11 coo 30.54 71.65 32.58 31.73 72.26 30.92 66.27 6.09 6.28 67.77 7.37 5.57 coo 37.87 70.12 31.80 36.61 69.74 30.15 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1qho_c04 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 256 GLU A 26 GLU.? 10.86 O2 EDO A 189 A 329 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 28.46 69.88 26.74 30.40 70.70 26.53 64.75 2.11 3.69 66.46 3.28 4.11 coo 30.54 71.65 32.58 31.73 72.26 30.92 66.27 6.09 6.28 67.77 7.37 5.57 coo 37.87 70.12 31.80 36.61 69.74 30.15 68.65 8.60 12.81 69.48 7.64 14.53 1qho_c04 source 1qho ALPHA-AMYLASE : 2 hits 1qho_c04 naa= 3 ULMN 3 1qho_c05 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 261 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 329 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo 28.46 69.88 26.74 30.40 70.70 26.53 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 34.02 79.89 42.60 34.73 78.01 41.86 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 37.87 70.12 31.80 36.61 69.74 30.15 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1qho_c05 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 261 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 329 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 28.46 69.88 26.74 30.40 70.70 26.53 68.29 3.95 12.18 68.54 1.87 11.74 coo 34.02 79.89 42.60 34.73 78.01 41.86 57.58 16.65 0.08 56.71 16.10 -1.78 coo 37.87 70.12 31.80 36.61 69.74 30.15 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1qho_c05 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP A 28 ASP.? 17.25 C2 EDO A 189 A 261 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 329 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 28.46 69.88 26.74 30.40 70.70 26.53 68.65 8.60 12.81 69.48 7.64 14.53 coo 34.02 79.89 42.60 34.73 78.01 41.86 57.58 16.65 0.08 56.71 16.10 -1.78 coo 37.87 70.12 31.80 36.61 69.74 30.15 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1qho_c05 ALPHA-AMYLASE user 4 3 # 4 A 228 ASP A 28 ASP.? 17.25 C2 EDO A 189 A 261 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 329 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 28.46 69.88 26.74 30.40 70.70 26.53 68.65 8.60 12.81 69.48 7.64 14.53 coo 34.02 79.89 42.60 34.73 78.01 41.86 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 37.87 70.12 31.80 36.61 69.74 30.15 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1qho_c05 ALPHA-AMYLASE user 5 3 # 5 A 228 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 261 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 329 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 28.46 69.88 26.74 30.40 70.70 26.53 68.86 12.45 19.04 67.57 12.48 20.71 coo 34.02 79.89 42.60 34.73 78.01 41.86 63.41 29.58 11.55 64.59 31.41 11.51 coo 37.87 70.12 31.80 36.61 69.74 30.15 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1qho_c05 ALPHA-AMYLASE user 6 3 # 6 A 228 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 261 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 329 ASP A 101 ASP^? 14.06 CM MPD A 191 coo 28.46 69.88 26.74 30.40 70.70 26.53 68.86 12.45 19.04 67.57 12.48 20.71 coo 34.02 79.89 42.60 34.73 78.01 41.86 60.01 27.52 25.19 61.63 28.83 24.67 coo 37.87 70.12 31.80 36.61 69.74 30.15 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1qho_c05 ALPHA-AMYLASE user 7 3 # 7 A 228 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 261 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 329 ASP A 101 ASP^? 14.06 CM MPD A 191 coo 28.46 69.88 26.74 30.40 70.70 26.53 66.73 9.65 23.28 68.51 8.93 24.16 coo 34.02 79.89 42.60 34.73 78.01 41.86 60.01 27.52 25.19 61.63 28.83 24.67 coo 37.87 70.12 31.80 36.61 69.74 30.15 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1qho_c05 ALPHA-AMYLASE user 8 3 # 8 A 228 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 261 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 329 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 28.46 69.88 26.74 30.40 70.70 26.53 66.73 9.65 23.28 68.51 8.93 24.16 coo 34.02 79.89 42.60 34.73 78.01 41.86 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 37.87 70.12 31.80 36.61 69.74 30.15 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1qho_c05 ALPHA-AMYLASE user 9 3 # 9 A 228 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 261 ASP A 103 ASP^? 5.49 CM MPD A 191 A 329 ASP A 97 ASP~? 21.13 O4 MPD A 191 coo 28.46 69.88 26.74 30.40 70.70 26.53 68.63 22.07 21.16 67.50 22.56 22.86 coo 34.02 79.89 42.60 34.73 78.01 41.86 51.58 16.40 16.66 49.70 15.49 16.18 coo 37.87 70.12 31.80 36.61 69.74 30.15 60.01 27.52 25.19 61.63 28.83 24.67 ULMN 3 1qho_c05 ALPHA-AMYLASE user 10 3 # 10 A 228 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 261 ASP A 89 ASP.? 15.93 O1 EDO A 189 A 329 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 28.46 69.88 26.74 30.40 70.70 26.53 60.01 27.52 25.19 61.63 28.83 24.67 coo 34.02 79.89 42.60 34.73 78.01 41.86 67.25 32.32 9.27 66.30 32.35 7.40 coo 37.87 70.12 31.80 36.61 69.74 30.15 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1qho_c05 ALPHA-AMYLASE user 11 3 # 11 A 228 ASP A 179 ASP^? 16.86 CM MPD A 191 A 261 ASP A 122 ASP.? 22.97 CM MPD A 191 A 329 ASP A 172 ASP.? 13.07 O1 EDO B 190 coo 28.46 69.88 26.74 30.40 70.70 26.53 43.85 0.70 13.63 43.61 -0.87 12.28 coo 34.02 79.89 42.60 34.73 78.01 41.86 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 37.87 70.12 31.80 36.61 69.74 30.15 53.63 -2.61 14.65 54.96 -1.14 13.93 ULMN 3 1qho_c05 ALPHA-AMYLASE user 12 3 # 12 A 228 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 261 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 329 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 28.46 69.88 26.74 30.40 70.70 26.53 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 34.02 79.89 42.60 34.73 78.01 41.86 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 37.87 70.12 31.80 36.61 69.74 30.15 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1qho_c05 ALPHA-AMYLASE user 13 3 # 13 A 228 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 261 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 329 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 28.46 69.88 26.74 30.40 70.70 26.53 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 34.02 79.89 42.60 34.73 78.01 41.86 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 37.87 70.12 31.80 36.61 69.74 30.15 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1qho_c05 ALPHA-AMYLASE user 14 3 # 14 A 228 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 261 ASP B 172 ASP.? 7.16 C1 EDO B 193 A 329 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 28.46 69.88 26.74 30.40 70.70 26.53 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 34.02 79.89 42.60 34.73 78.01 41.86 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 37.87 70.12 31.80 36.61 69.74 30.15 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1qho_c05 ALPHA-AMYLASE user 15 3 # 15 A 228 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 261 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 329 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 28.46 69.88 26.74 30.40 70.70 26.53 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 34.02 79.89 42.60 34.73 78.01 41.86 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 37.87 70.12 31.80 36.61 69.74 30.15 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1qho_c05 ALPHA-AMYLASE user 16 3 # 16 A 228 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 261 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 329 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 28.46 69.88 26.74 30.40 70.70 26.53 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 34.02 79.89 42.60 34.73 78.01 41.86 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 37.87 70.12 31.80 36.61 69.74 30.15 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1qho_c05 ALPHA-AMYLASE user 17 3 # 17 A 228 ASP B 56 ASP.? 14.25 C2 EDO B 193 A 261 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 329 ASP B 101 ASP^? 13.71 C2 EDO B 193 coo 28.46 69.88 26.74 30.40 70.70 26.53 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 34.02 79.89 42.60 34.73 78.01 41.86 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 37.87 70.12 31.80 36.61 69.74 30.15 40.06 15.30 -30.43 39.63 16.39 -32.22 ULMN 3 1qho_c05 ALPHA-AMYLASE user 18 3 # 18 A 228 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 261 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 329 ASP B 97 ASP~? 21.83 C3 MPD B 194 coo 28.46 69.88 26.74 30.40 70.70 26.53 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 34.02 79.89 42.60 34.73 78.01 41.86 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 37.87 70.12 31.80 36.61 69.74 30.15 39.93 2.83 -36.24 41.54 1.65 -37.01 ULMN 3 1qho_c05 ALPHA-AMYLASE user 19 3 # 19 A 228 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 261 ASP B 89 ASP.? 15.59 O1 EDO B 189 A 329 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 28.46 69.88 26.74 30.40 70.70 26.53 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 34.02 79.89 42.60 34.73 78.01 41.86 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo 37.87 70.12 31.80 36.61 69.74 30.15 49.28 8.80 -38.48 47.34 8.18 -39.14 1qho_c05 source 1qho ALPHA-AMYLASE : 19 hits 1qho_c05 naa= 3 ULMN 3 1qho_c07 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 260 ASP B 172 ASP.? 7.16 C1 EDO B 193 A 329 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 28.46 69.88 26.74 30.40 70.70 26.53 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 30.73 81.29 37.61 31.23 82.07 35.69 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 37.87 70.12 31.80 36.61 69.74 30.15 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1qho_c07 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 260 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 329 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 28.46 69.88 26.74 30.40 70.70 26.53 68.29 3.95 12.18 68.54 1.87 11.74 coo 30.73 81.29 37.61 31.23 82.07 35.69 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 37.87 70.12 31.80 36.61 69.74 30.15 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1qho_c07 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP A 28 ASP.? 17.25 C2 EDO A 189 A 260 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 329 ASP A 56 ASP.? 24.62 C2 EDO A 189 coo 28.46 69.88 26.74 30.40 70.70 26.53 68.65 8.60 12.81 69.48 7.64 14.53 coo 30.73 81.29 37.61 31.23 82.07 35.69 68.63 22.07 21.16 67.50 22.56 22.86 coo 37.87 70.12 31.80 36.61 69.74 30.15 66.73 9.65 23.28 68.51 8.93 24.16 ULMN 3 1qho_c07 ALPHA-AMYLASE user 4 3 # 4 A 228 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 260 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 329 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 28.46 69.88 26.74 30.40 70.70 26.53 60.01 27.52 25.19 61.63 28.83 24.67 coo 30.73 81.29 37.61 31.23 82.07 35.69 63.41 29.58 11.55 64.59 31.41 11.51 coo 37.87 70.12 31.80 36.61 69.74 30.15 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1qho_c07 ALPHA-AMYLASE user 5 3 # 5 A 228 ASP A 101 ASP^? 14.06 CM MPD A 191 A 260 ASP A 27 ASP.? 13.04 O1 EDO B 190 A 329 ASP A 56 ASP.? 24.62 C2 EDO A 189 coo 28.46 69.88 26.74 30.40 70.70 26.53 57.05 15.04 20.11 57.86 14.10 21.77 coo 30.73 81.29 37.61 31.23 82.07 35.69 68.29 3.95 12.18 68.54 1.87 11.74 coo 37.87 70.12 31.80 36.61 69.74 30.15 66.73 9.65 23.28 68.51 8.93 24.16 ULMN 3 1qho_c07 ALPHA-AMYLASE user 6 3 # 6 A 228 ASP A 179 ASP^? 16.86 CM MPD A 191 A 260 ASP A 151 ASP^? 20.35 CM MPD A 191 A 329 ASP A 172 ASP.? 13.07 O1 EDO B 190 coo 28.46 69.88 26.74 30.40 70.70 26.53 43.85 0.70 13.63 43.61 -0.87 12.28 coo 30.73 81.29 37.61 31.23 82.07 35.69 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 37.87 70.12 31.80 36.61 69.74 30.15 53.63 -2.61 14.65 54.96 -1.14 13.93 ULMN 3 1qho_c07 ALPHA-AMYLASE user 7 3 # 7 A 228 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 260 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 329 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 28.46 69.88 26.74 30.40 70.70 26.53 64.75 2.11 3.69 66.46 3.28 4.11 coo 30.73 81.29 37.61 31.23 82.07 35.69 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 37.87 70.12 31.80 36.61 69.74 30.15 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1qho_c07 ALPHA-AMYLASE user 8 3 # 8 A 228 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 260 ASP B 172 ASP.? 7.16 C1 EDO B 193 A 329 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 28.46 69.88 26.74 30.40 70.70 26.53 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 30.73 81.29 37.61 31.23 82.07 35.69 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 37.87 70.12 31.80 36.61 69.74 30.15 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1qho_c07 ALPHA-AMYLASE user 9 3 # 9 A 228 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 260 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 329 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo 28.46 69.88 26.74 30.40 70.70 26.53 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 30.73 81.29 37.61 31.23 82.07 35.69 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 37.87 70.12 31.80 36.61 69.74 30.15 45.79 20.82 -38.80 46.38 21.52 -40.72 ULMN 3 1qho_c07 ALPHA-AMYLASE user 10 3 # 10 A 228 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 260 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 329 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 28.46 69.88 26.74 30.40 70.70 26.53 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 30.73 81.29 37.61 31.23 82.07 35.69 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 37.87 70.12 31.80 36.61 69.74 30.15 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1qho_c07 ALPHA-AMYLASE user 11 3 # 11 A 228 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 260 ASP B 27 ASP.? 13.66 O1 EDO A 188 A 329 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo 28.46 69.88 26.74 30.40 70.70 26.53 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 30.73 81.29 37.61 31.23 82.07 35.69 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 37.87 70.12 31.80 36.61 69.74 30.15 45.79 20.82 -38.80 46.38 21.52 -40.72 ULMN 3 1qho_c07 ALPHA-AMYLASE user 12 3 # 12 A 228 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 260 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 329 ASP B 172 ASP.? 7.16 C1 EDO B 193 coo 28.46 69.88 26.74 30.40 70.70 26.53 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 30.73 81.29 37.61 31.23 82.07 35.69 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 37.87 70.12 31.80 36.61 69.74 30.15 40.45 32.96 -23.62 41.93 31.48 -23.99 1qho_c07 source 1qho ALPHA-AMYLASE : 12 hits 1qho_c07 naa= 3 ULMN 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 H 51 ALA B 62 ALA^? 8.92 C1 EDO B 189 H 148 HIS B 76 HIS^? 9.10 C1 EDO B 189 H 163 ASP B 87 ASP^? 16.44 C1 EDO B 189 coo -33.97 9.40 -47.46 -34.31 8.55 -46.23 50.28 11.76 -25.69 48.75 11.59 -25.62 coo -35.28 7.86 -41.76 -36.20 9.51 -42.67 54.34 6.71 -25.28 55.69 7.78 -26.49 coo -35.25 15.19 -41.05 -35.81 13.11 -41.05 51.11 1.31 -27.58 52.14 -0.39 -28.24 1qol_c07 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 1 hits 1qol_c07 naa= 3 ULMN 3 1qrz_c15 PLASMINOGEN user 1 3 # 1 D 603 HIS A 154 HIS^? 17.90 CM MPD A 191 D 646 ASP A 122 ASP.? 22.97 CM MPD A 191 D 741 SER A 153 SER.? 20.01 CM MPD A 191 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 51.13 -1.78 31.54 51.32 -3.14 29.91 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 50.18 -2.46 21.39 48.57 -4.23 21.02 ULMN 3 1qrz_c15 PLASMINOGEN user 2 3 # 2 D 603 HIS A 154 HIS^? 17.90 CM MPD A 191 D 646 ASP A 179 ASP^? 16.86 CM MPD A 191 D 741 SER A 153 SER.? 20.01 CM MPD A 191 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 43.85 0.70 13.63 43.61 -0.87 12.28 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 50.18 -2.46 21.39 48.57 -4.23 21.02 ULMN 3 1qrz_c15 PLASMINOGEN user 3 3 # 3 D 603 HIS B 154 HIS^? 5.27 C1 EDO B 192 D 646 ASP B 122 ASP.? 7.15 O2 EDO B 192 D 741 SER B 153 SER.? -3.11 C2 EDO B 192s coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 29.58 31.84 -25.39 29.63 33.61 -24.25 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 28.45 32.01 -35.99 29.78 33.29 -34.96 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 33.75 32.64 -27.23 32.53 34.50 -26.24 ULMN 3 1qrz_c15 PLASMINOGEN user 4 3 # 4 D 603 HIS B 154 HIS^? 5.27 C1 EDO B 192 D 646 ASP B 179 ASP^? 11.34 O2 EDO A 188 D 741 SER B 153 SER.? -3.11 C2 EDO B 192s coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 29.58 31.84 -25.39 29.63 33.61 -24.25 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 33.75 32.64 -27.23 32.53 34.50 -26.24 1qrz_c15 source 1qrz PLASMINOGEN : 4 hits 1qrz_c15 naa= 3 ULMN 3 1qrz_c20 PLASMINOGEN user 1 3 # 1 A 603 HIS A 154 HIS^? 17.90 CM MPD A 191 A 646 ASP A 172 ASP.? 13.07 O1 EDO B 190 A 739 GLY A 182 GLY.? 12.26 CM MPD A 191 coo -20.72 2.99 34.37 -21.94 1.82 35.61 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -18.83 7.68 26.86 -20.89 7.78 26.56 53.63 -2.61 14.65 54.96 -1.14 13.93 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 38.08 6.10 12.27 38.89 6.19 12.24 ULMN 3 1qrz_c20 PLASMINOGEN user 2 3 # 2 A 603 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 646 ASP B 172 ASP.? 7.16 C1 EDO B 193 A 739 GLY B 182 GLY.? 12.00 CM MPD B 194 coo -20.72 2.99 34.37 -21.94 1.82 35.61 29.58 31.84 -25.39 29.63 33.61 -24.25 coo -18.83 7.68 26.86 -20.89 7.78 26.56 40.45 32.96 -23.62 41.93 31.48 -23.99 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 29.38 23.72 -12.73 30.02 23.67 -13.22 1qrz_c20 source 1qrz PLASMINOGEN : 2 hits 1qrz_c20 naa= 3 ULMN 3 1qrz_c21 PLASMINOGEN user 1 3 # 1 B 603 HIS A 76 HIS^? 9.12 O1 EDO A 189 B 646 ASP A 87 ASP^? 16.43 O1 EDO A 189 B 739 GLY A 81 GLY.? 20.02 O1 EDO A 189 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 65.00 24.12 7.67 66.83 23.12 7.94 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 63.41 29.58 11.55 64.59 31.41 11.51 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 66.26 17.90 21.72 66.27 18.63 22.08 ULMN 3 1qrz_c21 PLASMINOGEN user 2 3 # 2 B 603 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 646 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 739 GLY B 88 GLY.? 12.78 C1 EDO B 189 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 54.76 3.63 -27.59 54.55 2.90 -27.91 ULMN 3 1qrz_c21 PLASMINOGEN user 3 3 # 3 B 603 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 646 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 739 GLY B 90 GLY.? 18.17 C1 EDO B 189 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 54.47 0.76 -32.31 54.10 0.32 -31.77 1qrz_c21 source 1qrz PLASMINOGEN : 3 hits 1qrz_c21 naa= 3 ULMN 3 1qrz_c23 PLASMINOGEN user 1 3 # 1 D 603 HIS A 154 HIS^? 17.90 CM MPD A 191 D 646 ASP A 122 ASP.? 22.97 CM MPD A 191 D 739 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 51.13 -1.78 31.54 51.32 -3.14 29.91 coo -45.82 1.31 41.67 -46.38 1.39 42.31 55.47 1.95 17.71 55.53 1.72 16.92 1qrz_c23 source 1qrz PLASMINOGEN : 1 hits 1qrz_c23 naa= 3 ULMN 3 1qtn_c02 ACETYL-ILE-GLU-THR-ASP-ALDEHYDE user 1 3 # 1 A 317 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 318 GLY A 83 GLY.? 19.80 C3 MPD A 191 A 360 CYH A 99 CYH.? 13.00 O4 MPD A 191 coo -8.43 39.80 36.26 -8.18 39.59 38.31 65.85 25.32 24.26 66.00 24.92 26.31 coo -11.14 38.10 31.61 -11.46 38.10 32.37 62.79 21.97 24.03 63.48 22.23 23.74 coo -11.95 34.09 34.07 -11.89 34.73 36.80 58.08 21.10 22.79 55.99 22.56 21.69 ULMN 3 1qtn_c02 ACETYL-ILE-GLU-THR-ASP-ALDEHYDE user 2 3 # 2 A 317 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 318 GLY A 98 GLY.? 17.64 O2 MPD A 191 A 360 CYH A 99 CYH.? 13.00 O4 MPD A 191 coo -8.43 39.80 36.26 -8.18 39.59 38.31 65.85 25.32 24.26 66.00 24.92 26.31 coo -11.14 38.10 31.61 -11.46 38.10 32.37 59.27 22.98 25.86 59.28 23.02 25.07 coo -11.95 34.09 34.07 -11.89 34.73 36.80 58.08 21.10 22.79 55.99 22.56 21.69 1qtn_c02 source 1qtn ACETYL-ILE-GLU-THR-ASP-ALDEHYDE : 2 hits 1qtn_c02 naa= 3 ULMN 3 1qx3_c00 APOPAIN user 1 3 # 1 A 121 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 122 GLY A 83 GLY.? 19.80 C3 MPD A 191 A 163 CYH A 99 CYH.? 13.00 O4 MPD A 191 coo 2.23 29.11 15.20 1.24 27.27 15.13 65.85 25.32 24.26 66.00 24.92 26.31 coo 2.54 34.86 14.60 1.83 34.53 14.82 62.79 21.97 24.03 63.48 22.23 23.74 coo -1.20 35.13 11.95 -2.11 32.67 12.98 58.08 21.10 22.79 55.99 22.56 21.69 ULMN 3 1qx3_c00 APOPAIN user 2 3 # 2 A 121 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 122 GLY A 98 GLY.? 17.64 O2 MPD A 191 A 163 CYH A 99 CYH.? 13.00 O4 MPD A 191 coo 2.23 29.11 15.20 1.24 27.27 15.13 65.85 25.32 24.26 66.00 24.92 26.31 coo 2.54 34.86 14.60 1.83 34.53 14.82 59.27 22.98 25.86 59.28 23.02 25.07 coo -1.20 35.13 11.95 -2.11 32.67 12.98 58.08 21.10 22.79 55.99 22.56 21.69 ULMN 3 1qx3_c00 APOPAIN user 3 3 # 3 A 121 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 122 GLY B 83 GLY.? 19.88 O2 MPD B 194 A 163 CYH B 99 CYH.? 13.42 O2 MPD B 194 coo 2.23 29.11 15.20 1.24 27.27 15.13 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 2.54 34.86 14.60 1.83 34.53 14.82 42.83 8.47 -37.13 43.54 8.24 -37.38 coo -1.20 35.13 11.95 -2.11 32.67 12.98 39.68 9.38 -33.42 38.76 7.79 -31.29 ULMN 3 1qx3_c00 APOPAIN user 4 3 # 4 A 121 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 122 GLY B 98 GLY.? 17.68 O2 MPD B 194 A 163 CYH B 99 CYH.? 13.42 O2 MPD B 194 coo 2.23 29.11 15.20 1.24 27.27 15.13 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 2.54 34.86 14.60 1.83 34.53 14.82 39.01 7.37 -36.59 39.44 7.37 -35.92 coo -1.20 35.13 11.95 -2.11 32.67 12.98 39.68 9.38 -33.42 38.76 7.79 -31.29 1qx3_c00 source 1qx3 APOPAIN : 4 hits 1qx3_c00 naa= 3 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 1 3 # 1 A 10 ASP A 101 ASP^? 14.06 CM MPD A 191 A 186 ASN A 111 ASN~? 7.14 CM MPD A 191 A 260 ALA A 146 ALA^? 9.66 O2 MPD A 191 coo 11.81 33.10 11.71 13.07 31.45 11.40 57.05 15.04 20.11 57.86 14.10 21.77 coo 11.43 26.53 7.41 13.01 27.56 8.43 50.97 8.64 17.05 49.29 9.91 16.73 coo 21.53 26.33 6.96 20.26 25.69 7.52 48.53 13.09 26.87 47.62 13.02 28.09 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 2 3 # 2 A 10 ASP A 103 ASP^? 5.49 CM MPD A 191 A 186 ASN A 111 ASN~? 7.14 CM MPD A 191 A 260 ALA A 146 ALA^? 9.66 O2 MPD A 191 coo 11.81 33.10 11.71 13.07 31.45 11.40 51.58 16.40 16.66 49.70 15.49 16.18 coo 11.43 26.53 7.41 13.01 27.56 8.43 50.97 8.64 17.05 49.29 9.91 16.73 coo 21.53 26.33 6.96 20.26 25.69 7.52 48.53 13.09 26.87 47.62 13.02 28.09 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 3 3 # 3 A 10 ASP A 103 ASP^? 5.49 CM MPD A 191 A 186 ASN A 111 ASN~? 7.14 CM MPD A 191 A 260 ALA A 167 ALA^? 7.37 CM MPD A 191 coo 11.81 33.10 11.71 13.07 31.45 11.40 51.58 16.40 16.66 49.70 15.49 16.18 coo 11.43 26.53 7.41 13.01 27.56 8.43 50.97 8.64 17.05 49.29 9.91 16.73 coo 21.53 26.33 6.96 20.26 25.69 7.52 41.47 7.92 20.75 41.95 8.32 19.34 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 4 3 # 4 A 10 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 186 ASN B 111 ASN~? 7.23 CM MPD B 194 A 260 ALA B 146 ALA^? 9.91 O2 MPD B 194 coo 11.81 33.10 11.71 13.07 31.45 11.40 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 11.43 26.53 7.41 13.01 27.56 8.43 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 21.53 26.33 6.96 20.26 25.69 7.52 29.33 17.08 -30.73 27.86 17.06 -31.19 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 5 3 # 5 A 10 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 186 ASN B 111 ASN~? 7.23 CM MPD B 194 A 260 ALA B 146 ALA^? 9.91 O2 MPD B 194 coo 11.81 33.10 11.71 13.07 31.45 11.40 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 11.43 26.53 7.41 13.01 27.56 8.43 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 21.53 26.33 6.96 20.26 25.69 7.52 29.33 17.08 -30.73 27.86 17.06 -31.19 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 6 3 # 6 A 10 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 186 ASN B 111 ASN~? 7.23 CM MPD B 194 A 260 ALA B 167 ALA^? 7.55 CM MPD B 194 coo 11.81 33.10 11.71 13.07 31.45 11.40 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 11.43 26.53 7.41 13.01 27.56 8.43 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 21.53 26.33 6.96 20.26 25.69 7.52 27.16 22.24 -21.69 28.37 21.86 -20.85 1r4f_c00 source 1r4f IAG-NUCLEOSIDE HYDROLASE : 6 hits 1r4f_c00 naa= 3 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 1 3 # 1 A 608 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 610 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 661 HIS A 58 HIS.? 21.11 O2 MPD A 191 coo 75.99 81.56 1.86 73.91 81.34 2.28 68.63 22.07 21.16 67.50 22.56 22.86 coo 71.04 78.84 0.46 71.54 76.90 1.02 65.85 25.32 24.26 66.00 24.92 26.31 coo 75.40 81.38 12.06 74.88 79.42 12.63 64.74 13.84 22.58 64.60 13.48 24.65 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 2 3 # 2 A 608 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 610 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 661 HIS B 58 HIS.? 15.15 C2 EDO B 193 coo 75.99 81.56 1.86 73.91 81.34 2.28 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 71.04 78.84 0.46 71.54 76.90 1.02 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 75.40 81.38 12.06 74.88 79.42 12.63 44.68 16.85 -37.12 43.29 17.21 -38.66 1req_c10 source 1req METHYLMALONYL-COA MUTASE : 2 hits 1req_c10 naa= 3 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 1 3 # 1 C 608 ASP A 80 ASP.? 21.91 O1 EDO A 189 C 610 HIS A 84 HIS.? 23.86 O4 MPD A 191 C 661 HIS A 58 HIS.? 21.11 O2 MPD A 191 coo -17.65 80.52 58.00 -16.23 80.79 56.41 68.63 22.07 21.16 67.50 22.56 22.86 coo -16.56 83.18 53.03 -16.33 85.18 53.60 65.85 25.32 24.26 66.00 24.92 26.31 coo -8.38 80.78 62.24 -7.53 82.67 62.02 64.74 13.84 22.58 64.60 13.48 24.65 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 2 3 # 2 C 608 ASP B 80 ASP.? 22.03 C1 EDO B 189 C 610 HIS B 84 HIS.? 24.24 O2 MPD B 194 C 661 HIS B 58 HIS.? 15.15 C2 EDO B 193 coo -17.65 80.52 58.00 -16.23 80.79 56.41 49.28 8.80 -38.48 47.34 8.18 -39.14 coo -16.56 83.18 53.03 -16.33 85.18 53.60 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -8.38 80.78 62.24 -7.53 82.67 62.02 44.68 16.85 -37.12 43.29 17.21 -38.66 1req_c11 source 1req METHYLMALONYL-COA MUTASE : 2 hits 1req_c11 naa= 3 ULMN 3 1rgq_c01 NS4A PEPTIDE user 1 3 # 1 B 60 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 84 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 140 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 64.74 13.84 22.58 64.60 13.48 24.65 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 68.86 12.45 19.04 67.57 12.48 20.71 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1rgq_c01 NS4A PEPTIDE user 2 3 # 2 B 60 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 84 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 140 GLY A 119 GLY~? 20.44 CM MPD A 191 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 64.74 13.84 22.58 64.60 13.48 24.65 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 68.86 12.45 19.04 67.57 12.48 20.71 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 59.17 4.30 26.91 58.59 4.80 27.25 ULMN 3 1rgq_c01 NS4A PEPTIDE user 3 3 # 3 B 60 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 84 ASP A 56 ASP.? 24.62 C2 EDO A 189 B 140 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 64.74 13.84 22.58 64.60 13.48 24.65 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 66.73 9.65 23.28 68.51 8.93 24.16 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1rgq_c01 NS4A PEPTIDE user 4 3 # 4 B 60 HIS A 65 HIS^? 6.20 C1 EDO A 189 B 84 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 140 GLY A 71 GLY^? 15.15 O2 EDO A 188 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 57.58 16.65 0.08 56.71 16.10 -1.78 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 51.64 28.27 -4.12 51.34 27.67 -3.59 ULMN 3 1rgq_c01 NS4A PEPTIDE user 5 3 # 5 B 60 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 84 ASP A 97 ASP~? 21.13 O4 MPD A 191 B 140 GLY A 90 GLY.? 17.99 O1 EDO A 189 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 65.85 25.32 24.26 66.00 24.92 26.31 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 60.01 27.52 25.19 61.63 28.83 24.67 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 68.99 30.23 13.11 68.36 30.72 12.94 ULMN 3 1rgq_c01 NS4A PEPTIDE user 6 3 # 6 B 60 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 84 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 140 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1rgq_c01 NS4A PEPTIDE user 7 3 # 7 B 60 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 84 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 140 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 1rgq_c01 NS4A PEPTIDE user 8 3 # 8 B 60 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 84 ASP B 56 ASP.? 14.25 C2 EDO B 193 B 140 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1rgq_c01 NS4A PEPTIDE user 9 3 # 9 B 60 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 84 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 140 GLY B 71 GLY^? 6.08 O1 EDO A 190 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 50.84 2.27 -7.92 50.26 2.83 -8.18 ULMN 3 1rgq_c01 NS4A PEPTIDE user 10 3 # 10 B 60 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 84 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 140 GLY B 90 GLY.? 18.17 C1 EDO B 189 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 54.47 0.76 -32.31 54.10 0.32 -31.77 1rgq_c01 source 1rgq NS4A PEPTIDE : 10 hits 1rgq_c01 naa= 3 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 35 SER A 153 SER.? 20.01 CM MPD A 191 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 11.85 17.24 72.81 11.09 15.37 72.36 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 12.20 12.71 75.45 13.69 13.84 74.03 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 5.22 15.03 71.43 7.19 14.88 70.83 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 3 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 35 SER B 153 SER.? -3.11 C2 EDO B 192s 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 11.85 17.24 72.81 11.09 15.37 72.36 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 12.20 12.71 75.45 13.69 13.84 74.03 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 5.22 15.03 71.43 7.19 14.88 70.83 28.45 32.01 -35.99 29.78 33.29 -34.96 1rne_c04 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 2 hits 1rne_c04 naa= 3 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 # 1 B 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo -4.60 27.52 42.88 -4.63 27.41 40.76 64.74 13.84 22.58 64.60 13.48 24.65 coo -0.27 31.24 43.51 -1.49 29.62 42.98 68.86 12.45 19.04 67.57 12.48 20.71 coo -6.81 22.81 34.74 -6.42 23.54 34.62 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 2 3 # 2 B 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo -4.60 27.52 42.88 -4.63 27.41 40.76 64.74 13.84 22.58 64.60 13.48 24.65 coo -0.27 31.24 43.51 -1.49 29.62 42.98 68.86 12.45 19.04 67.57 12.48 20.71 coo -6.81 22.81 34.74 -6.42 23.54 34.62 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 3 3 # 3 B 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 B 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo -4.60 27.52 42.88 -4.63 27.41 40.76 64.74 13.84 22.58 64.60 13.48 24.65 coo -0.27 31.24 43.51 -1.49 29.62 42.98 66.73 9.65 23.28 68.51 8.93 24.16 coo -6.81 22.81 34.74 -6.42 23.54 34.62 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 4 3 # 4 B 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 B 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo -4.60 27.52 42.88 -4.63 27.41 40.76 64.74 13.84 22.58 64.60 13.48 24.65 coo -0.27 31.24 43.51 -1.49 29.62 42.98 66.73 9.65 23.28 68.51 8.93 24.16 coo -6.81 22.81 34.74 -6.42 23.54 34.62 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 5 3 # 5 B 57 HIS A 65 HIS^? 6.20 C1 EDO A 189 B 102 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 193 GLY A 71 GLY^? 15.15 O2 EDO A 188 coo -4.60 27.52 42.88 -4.63 27.41 40.76 58.30 21.39 -1.16 58.14 22.03 -3.16 coo -0.27 31.24 43.51 -1.49 29.62 42.98 57.58 16.65 0.08 56.71 16.10 -1.78 coo -6.81 22.81 34.74 -6.42 23.54 34.62 51.64 28.27 -4.12 51.34 27.67 -3.59 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 6 3 # 6 B 57 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 102 ASP A 97 ASP~? 21.13 O4 MPD A 191 B 193 GLY A 81 GLY.? 20.02 O1 EDO A 189 coo -4.60 27.52 42.88 -4.63 27.41 40.76 65.85 25.32 24.26 66.00 24.92 26.31 coo -0.27 31.24 43.51 -1.49 29.62 42.98 60.01 27.52 25.19 61.63 28.83 24.67 coo -6.81 22.81 34.74 -6.42 23.54 34.62 66.26 17.90 21.72 66.27 18.63 22.08 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 7 3 # 7 B 57 HIS A 154 HIS^? 17.90 CM MPD A 191 B 102 ASP A 151 ASP^? 20.35 CM MPD A 191 B 193 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo -4.60 27.52 42.88 -4.63 27.41 40.76 45.67 -1.54 22.26 44.90 -3.17 21.19 coo -0.27 31.24 43.51 -1.49 29.62 42.98 48.38 -3.74 26.58 47.39 -3.82 24.70 coo -6.81 22.81 34.74 -6.42 23.54 34.62 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 8 3 # 8 B 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo -4.60 27.52 42.88 -4.63 27.41 40.76 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -0.27 31.24 43.51 -1.49 29.62 42.98 50.24 18.54 -36.80 48.17 18.09 -37.17 coo -6.81 22.81 34.74 -6.42 23.54 34.62 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 9 3 # 9 B 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 B 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo -4.60 27.52 42.88 -4.63 27.41 40.76 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -0.27 31.24 43.51 -1.49 29.62 42.98 45.79 20.82 -38.80 46.38 21.52 -40.72 coo -6.81 22.81 34.74 -6.42 23.54 34.62 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 10 3 # 10 B 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 B 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo -4.60 27.52 42.88 -4.63 27.41 40.76 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -0.27 31.24 43.51 -1.49 29.62 42.98 45.79 20.82 -38.80 46.38 21.52 -40.72 coo -6.81 22.81 34.74 -6.42 23.54 34.62 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 11 3 # 11 B 57 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 102 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 193 GLY B 71 GLY^? 6.08 O1 EDO A 190 coo -4.60 27.52 42.88 -4.63 27.41 40.76 54.13 9.12 -14.50 55.15 8.45 -12.80 coo -0.27 31.24 43.51 -1.49 29.62 42.98 52.60 14.13 -14.82 53.00 14.96 -12.94 coo -6.81 22.81 34.74 -6.42 23.54 34.62 50.84 2.27 -7.92 50.26 2.83 -8.18 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 12 3 # 12 B 57 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 102 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 193 GLY B 81 GLY.? 19.64 C2 EDO B 193 coo -4.60 27.52 42.88 -4.63 27.41 40.76 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -0.27 31.24 43.51 -1.49 29.62 42.98 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -6.81 22.81 34.74 -6.42 23.54 34.62 46.71 12.75 -37.37 46.59 12.01 -37.69 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 13 3 # 13 B 57 HIS B 154 HIS^? 5.27 C1 EDO B 192 B 102 ASP B 151 ASP^? -3.26 O1 EDO B 192s B 193 GLY B 175 GLY.? -3.40 C1 EDO B 193s coo -4.60 27.52 42.88 -4.63 27.41 40.76 29.58 31.84 -25.39 29.63 33.61 -24.25 coo -0.27 31.24 43.51 -1.49 29.62 42.98 29.45 33.81 -30.55 29.73 34.07 -28.42 coo -6.81 22.81 34.74 -6.42 23.54 34.62 39.99 28.43 -27.51 40.50 28.66 -26.90 1rtf_c06 source 1rtf TWO CHAIN TISSUE PLASMINOGEN ACTIVATOR : 13 hits 1rtf_c06 naa= 3 ULMN 3 1sca_c01 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 1 3 # 1 32 ASP A 151 ASP^? 20.35 CM MPD A 191 64 HIS A 154 HIS^? 17.90 CM MPD A 191 155 ASN A 111 ASN~? 7.14 CM MPD A 191 coo 80.16 73.25 62.48 80.01 71.25 61.82 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 78.27 67.69 61.83 79.58 67.76 60.19 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 80.34 61.88 52.75 81.25 63.19 54.35 50.97 8.64 17.05 49.29 9.91 16.73 ULMN 3 1sca_c01 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 2 3 # 2 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s 64 HIS B 154 HIS^? 5.27 C1 EDO B 192 155 ASN B 111 ASN~? 7.23 CM MPD B 194 coo 80.16 73.25 62.48 80.01 71.25 61.82 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 78.27 67.69 61.83 79.58 67.76 60.19 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 80.34 61.88 52.75 81.25 63.19 54.35 36.94 21.70 -24.36 35.87 20.37 -23.07 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 151 ASP^? 20.35 CM MPD A 191 A 37 SER A 153 SER.? 20.01 CM MPD A 191 A 214 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 51.75 60.57 19.10 52.05 60.90 21.19 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 51.10 65.11 20.73 52.62 63.74 19.42 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 48.59 58.89 25.78 50.13 59.74 24.61 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 1sme_c04 PLASMEPSIN II user 2 3 # 2 A 34 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 37 SER B 153 SER.? -3.11 C2 EDO B 192s A 214 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 51.75 60.57 19.10 52.05 60.90 21.19 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 51.10 65.11 20.73 52.62 63.74 19.42 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 48.59 58.89 25.78 50.13 59.74 24.61 28.45 32.01 -35.99 29.78 33.29 -34.96 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 151 ASP^? 20.35 CM MPD A 191 B 37 SER A 153 SER.? 20.01 CM MPD A 191 B 214 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 17.69 97.58 52.73 17.33 97.19 54.77 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 20.67 100.44 55.84 20.21 98.51 54.45 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 12.41 98.71 58.47 14.37 98.17 58.05 51.13 -1.78 31.54 51.32 -3.14 29.91 1sme_c05 source 1sme PLASMEPSIN II : 1 hits 1sme_c05 naa= 3 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 1 3 # 1 A 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 15.02 29.17 19.44 15.63 29.96 17.60 64.74 13.84 22.58 64.60 13.48 24.65 coo 19.67 30.58 22.61 18.30 29.87 21.17 68.86 12.45 19.04 67.57 12.48 20.71 coo 14.52 29.10 10.01 15.08 29.66 10.19 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 2 3 # 2 A 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 15.02 29.17 19.44 15.63 29.96 17.60 64.74 13.84 22.58 64.60 13.48 24.65 coo 19.67 30.58 22.61 18.30 29.87 21.17 66.73 9.65 23.28 68.51 8.93 24.16 coo 14.52 29.10 10.01 15.08 29.66 10.19 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 3 3 # 3 A 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 15.02 29.17 19.44 15.63 29.96 17.60 64.74 13.84 22.58 64.60 13.48 24.65 coo 19.67 30.58 22.61 18.30 29.87 21.17 66.73 9.65 23.28 68.51 8.93 24.16 coo 14.52 29.10 10.01 15.08 29.66 10.19 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 4 3 # 4 A 57 HIS A 65 HIS^? 6.20 C1 EDO A 189 A 102 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 193 GLY A 71 GLY^? 15.15 O2 EDO A 188 coo 15.02 29.17 19.44 15.63 29.96 17.60 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 19.67 30.58 22.61 18.30 29.87 21.17 57.58 16.65 0.08 56.71 16.10 -1.78 coo 14.52 29.10 10.01 15.08 29.66 10.19 51.64 28.27 -4.12 51.34 27.67 -3.59 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 5 3 # 5 A 57 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 102 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 193 GLY A 81 GLY.? 20.02 O1 EDO A 189 coo 15.02 29.17 19.44 15.63 29.96 17.60 65.85 25.32 24.26 66.00 24.92 26.31 coo 19.67 30.58 22.61 18.30 29.87 21.17 60.01 27.52 25.19 61.63 28.83 24.67 coo 14.52 29.10 10.01 15.08 29.66 10.19 66.26 17.90 21.72 66.27 18.63 22.08 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 6 3 # 6 A 57 HIS A 154 HIS^? 17.90 CM MPD A 191 A 102 ASP A 151 ASP^? 20.35 CM MPD A 191 A 193 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo 15.02 29.17 19.44 15.63 29.96 17.60 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 19.67 30.58 22.61 18.30 29.87 21.17 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 14.52 29.10 10.01 15.08 29.66 10.19 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 7 3 # 7 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 15.02 29.17 19.44 15.63 29.96 17.60 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 19.67 30.58 22.61 18.30 29.87 21.17 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 14.52 29.10 10.01 15.08 29.66 10.19 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 8 3 # 8 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 A 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 15.02 29.17 19.44 15.63 29.96 17.60 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 19.67 30.58 22.61 18.30 29.87 21.17 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 14.52 29.10 10.01 15.08 29.66 10.19 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 9 3 # 9 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 A 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 15.02 29.17 19.44 15.63 29.96 17.60 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 19.67 30.58 22.61 18.30 29.87 21.17 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 14.52 29.10 10.01 15.08 29.66 10.19 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 10 3 # 10 A 57 HIS B 65 HIS^? -5.26 O1 EDO B 189s A 102 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 193 GLY B 71 GLY^? 6.08 O1 EDO A 190 coo 15.02 29.17 19.44 15.63 29.96 17.60 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 19.67 30.58 22.61 18.30 29.87 21.17 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 14.52 29.10 10.01 15.08 29.66 10.19 50.84 2.27 -7.92 50.26 2.83 -8.18 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 11 3 # 11 A 57 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 102 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 193 GLY B 81 GLY.? 19.64 C2 EDO B 193 coo 15.02 29.17 19.44 15.63 29.96 17.60 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 19.67 30.58 22.61 18.30 29.87 21.17 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 14.52 29.10 10.01 15.08 29.66 10.19 46.71 12.75 -37.37 46.59 12.01 -37.69 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 12 3 # 12 A 57 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 102 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 193 GLY B 175 GLY.? -3.40 C1 EDO B 193s coo 15.02 29.17 19.44 15.63 29.96 17.60 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 19.67 30.58 22.61 18.30 29.87 21.17 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 14.52 29.10 10.01 15.08 29.66 10.19 39.99 28.43 -27.51 40.50 28.66 -26.90 1ssx_c02 source 1ssx ALPHA-LYTIC PROTEASE : 12 hits 1ssx_c02 naa= 3 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 1 3 # 1 B 8 HIS A 65 HIS^? 6.20 C1 EDO A 189 B 80 GLU A 67 GLU^? 10.03 C1 EDO A 189 B 223 ARG A 144 ARG^? 11.59 O2 MPD A 191 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 58.30 21.39 -1.16 58.14 22.03 -3.16 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 54.47 21.64 -4.11 55.33 21.19 -6.01 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 48.95 22.48 28.26 46.62 21.31 29.92 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 2 3 # 2 B 8 HIS A 76 HIS^? 9.12 O1 EDO A 189 B 80 GLU A 61 GLU^? 10.22 O1 EDO A 189 B 223 ARG B 14 ARG.? 10.57 O1 EDO B 191 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 65.00 24.12 7.67 66.83 23.12 7.94 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 66.46 19.59 10.29 68.35 19.61 9.28 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 36.61 9.98 2.38 38.30 7.40 2.59 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 3 3 # 3 B 8 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 80 GLU B 67 GLU^? -5.72 C1 EDO A 190s B 223 ARG B 144 ARG^? 12.29 O2 MPD B 194 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 54.13 9.12 -14.50 55.15 8.45 -12.80 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 52.81 8.90 -9.47 54.54 9.74 -8.49 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 28.02 7.86 -31.66 25.29 9.13 -32.53 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 4 3 # 4 B 8 HIS B 76 HIS^? 9.10 C1 EDO B 189 B 80 GLU B 61 GLU^? 10.17 C1 EDO B 189 B 223 ARG A 14 ARG.? 14.51 O2 EDO B 188 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 54.34 6.71 -25.28 55.69 7.78 -26.49 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 53.85 11.48 -28.30 55.92 11.40 -28.71 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 34.22 19.89 -3.86 35.36 22.47 -5.15 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 5 3 # 5 B 8 HIS B 76 HIS^? 9.10 C1 EDO B 189 B 80 GLU B 61 GLU^? 10.17 C1 EDO B 189 B 223 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 54.34 6.71 -25.28 55.69 7.78 -26.49 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 53.85 11.48 -28.30 55.92 11.40 -28.71 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 24.74 19.51 -33.91 24.95 16.46 -33.56 1t0u_c01 source 1t0u URIDINE PHOSPHORYLASE : 5 hits 1t0u_c01 naa= 3 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 # 1 A 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 A 251 GLY A 81 GLY.? 20.02 O1 EDO A 189 A 252 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 65.24 21.66 17.68 64.04 20.76 17.95 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 66.26 17.90 21.72 66.27 18.63 22.08 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 # 2 A 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 A 251 GLY B 81 GLY.? 19.64 C2 EDO B 193 A 252 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 46.71 12.75 -37.37 46.59 12.01 -37.69 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 49.28 8.80 -38.48 47.34 8.18 -39.14 1tz3_c02 source 1tz3 PUTATIVE SUGAR KINASE : 2 hits 1tz3_c02 naa= 3 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 # 1 B 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 B 251 GLY A 81 GLY.? 20.02 O1 EDO A 189 B 252 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 65.24 21.66 17.68 64.04 20.76 17.95 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 66.26 17.90 21.72 66.27 18.63 22.08 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 # 2 B 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 B 251 GLY B 81 GLY.? 19.64 C2 EDO B 193 B 252 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 46.71 12.75 -37.37 46.59 12.01 -37.69 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 49.28 8.80 -38.48 47.34 8.18 -39.14 1tz3_c03 source 1tz3 PUTATIVE SUGAR KINASE : 2 hits 1tz3_c03 naa= 3 ULMN 3 1uk7_c00 3.07.01.0009 user 1 3 # 1 A 103 ALA A 62 ALA^? 8.76 O1 EDO A 189 A 224 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 252 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 62.10 18.98 10.31 60.83 19.17 11.13 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 63.41 29.58 11.55 64.59 31.41 11.51 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 3 1uk7_c00 3.07.01.0009 user 2 3 # 2 A 103 ALA A 79 ALA^? 16.03 O1 EDO A 189 A 224 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 252 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 65.24 21.66 17.68 64.04 20.76 17.95 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 60.01 27.52 25.19 61.63 28.83 24.67 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1uk7_c00 3.07.01.0009 user 3 3 # 3 A 103 ALA B 62 ALA^? 8.92 C1 EDO B 189 A 224 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 252 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 50.28 11.76 -25.69 48.75 11.59 -25.62 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 54.34 6.71 -25.28 55.69 7.78 -26.49 ULMN 3 1uk7_c00 3.07.01.0009 user 4 3 # 4 A 103 ALA B 79 ALA^? 16.25 C1 EDO B 189 A 224 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 252 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 45.35 5.36 -39.37 44.27 5.71 -41.13 1uk7_c00 source 1uk7 3.07.01.0009 : 4 hits 1uk7_c00 naa= 3 ULMN 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP B 4 ASP.? -7.27 O2 EDO B 190s 255 GLU A 26 GLU.? 10.86 O2 EDO A 189 329 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 49.16 35.16 15.19 51.08 34.43 15.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 52.57 37.12 10.17 53.37 35.95 11.75 66.27 6.09 6.28 67.77 7.37 5.57 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP B 4 ASP.? -7.27 O2 EDO B 190s 255 GLU A 26 GLU.? 10.86 O2 EDO A 189 329 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 52.57 37.12 10.17 53.37 35.95 11.75 66.27 6.09 6.28 67.77 7.37 5.57 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.65 8.60 12.81 69.48 7.64 14.53 1uok_c03 source 1uok OLIGO-1,6-GLUCOSIDASE : 2 hits 1uok_c03 naa= 3 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 4 ASP.? 9.87 O1 EDO A 188 218 GLU B 127 GLU^? 12.59 O2 MPD B 194 329 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 49.16 35.16 15.19 51.08 34.43 15.65 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 70.09 11.71 8.46 70.56 12.89 6.77 29.39 12.97 -34.29 27.94 11.43 -34.46 coo 59.16 37.82 13.95 57.63 37.03 15.12 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 4 ASP.? 9.87 O1 EDO A 188 218 GLU B 158 GLU^? 10.92 O2 MPD B 194 329 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 49.16 35.16 15.19 51.08 34.43 15.65 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 70.09 11.71 8.46 70.56 12.89 6.77 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 59.16 37.82 13.95 57.63 37.03 15.12 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP A 4 ASP.? 9.87 O1 EDO A 188 218 GLU B 158 GLU^? 10.92 O2 MPD B 194 329 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 70.09 11.71 8.46 70.56 12.89 6.77 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 59.16 37.82 13.95 57.63 37.03 15.12 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP A 4 ASP.? 9.87 O1 EDO A 188 218 GLU B 161 GLU.? 9.05 O2 MPD B 194 329 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 70.09 11.71 8.46 70.56 12.89 6.77 28.86 7.94 -26.27 29.12 6.39 -27.73 coo 59.16 37.82 13.95 57.63 37.03 15.12 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 5 3 # 5 199 ASP A 27 ASP.? 13.04 O1 EDO B 190 218 GLU A 39 GLU.? 8.26 C5 MPD A 191 329 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 49.16 35.16 15.19 51.08 34.43 15.65 68.29 3.95 12.18 68.54 1.87 11.74 coo 70.09 11.71 8.46 70.56 12.89 6.77 40.24 18.97 5.60 41.21 18.63 7.48 coo 59.16 37.82 13.95 57.63 37.03 15.12 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 6 3 # 6 199 ASP A 28 ASP.? 17.25 C2 EDO A 189 218 GLU A 39 GLU.? 8.26 C5 MPD A 191 329 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 49.16 35.16 15.19 51.08 34.43 15.65 68.65 8.60 12.81 69.48 7.64 14.53 coo 70.09 11.71 8.46 70.56 12.89 6.77 40.24 18.97 5.60 41.21 18.63 7.48 coo 59.16 37.82 13.95 57.63 37.03 15.12 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 7 3 # 7 199 ASP A 54 ASP.? 20.27 C2 EDO A 189 218 GLU B 67 GLU^? -5.72 C1 EDO A 190s 329 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 49.16 35.16 15.19 51.08 34.43 15.65 68.86 12.45 19.04 67.57 12.48 20.71 coo 70.09 11.71 8.46 70.56 12.89 6.77 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 8 3 # 8 199 ASP A 54 ASP.? 20.27 C2 EDO A 189 218 GLU B 67 GLU^? -5.72 C1 EDO A 190s 329 ASP A 101 ASP^? 14.06 CM MPD A 191 coo 49.16 35.16 15.19 51.08 34.43 15.65 68.86 12.45 19.04 67.57 12.48 20.71 coo 70.09 11.71 8.46 70.56 12.89 6.77 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 59.16 37.82 13.95 57.63 37.03 15.12 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 9 3 # 9 199 ASP A 54 ASP.? 20.27 C2 EDO A 189 218 GLU B 69 GLU.? -7.04 C2 EDO B 191s 329 ASP A 101 ASP^? 14.06 CM MPD A 191 coo 49.16 35.16 15.19 51.08 34.43 15.65 68.86 12.45 19.04 67.57 12.48 20.71 coo 70.09 11.71 8.46 70.56 12.89 6.77 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 59.16 37.82 13.95 57.63 37.03 15.12 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 10 3 # 10 199 ASP A 56 ASP.? 24.62 C2 EDO A 189 218 GLU B 69 GLU.? -7.04 C2 EDO B 191s 329 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 66.73 9.65 23.28 68.51 8.93 24.16 coo 70.09 11.71 8.46 70.56 12.89 6.77 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 11 3 # 11 199 ASP A 56 ASP.? 24.62 C2 EDO A 189 218 GLU B 69 GLU.? -7.04 C2 EDO B 191s 329 ASP A 101 ASP^? 14.06 CM MPD A 191 coo 49.16 35.16 15.19 51.08 34.43 15.65 66.73 9.65 23.28 68.51 8.93 24.16 coo 70.09 11.71 8.46 70.56 12.89 6.77 46.74 3.18 -1.73 46.16 1.22 -2.29 coo 59.16 37.82 13.95 57.63 37.03 15.12 57.05 15.04 20.11 57.86 14.10 21.77 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 12 3 # 12 199 ASP A 80 ASP.? 21.91 O1 EDO A 189 218 GLU A 39 GLU.? 8.26 C5 MPD A 191 329 ASP A 97 ASP~? 21.13 O4 MPD A 191 coo 49.16 35.16 15.19 51.08 34.43 15.65 68.63 22.07 21.16 67.50 22.56 22.86 coo 70.09 11.71 8.46 70.56 12.89 6.77 40.24 18.97 5.60 41.21 18.63 7.48 coo 59.16 37.82 13.95 57.63 37.03 15.12 60.01 27.52 25.19 61.63 28.83 24.67 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 13 3 # 13 199 ASP A 97 ASP~? 21.13 O4 MPD A 191 218 GLU A 67 GLU^? 10.03 C1 EDO A 189 329 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 60.01 27.52 25.19 61.63 28.83 24.67 coo 70.09 11.71 8.46 70.56 12.89 6.77 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 14 3 # 14 199 ASP A 172 ASP.? 13.07 O1 EDO B 190 218 GLU A 67 GLU^? 10.03 C1 EDO A 189 329 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 49.16 35.16 15.19 51.08 34.43 15.65 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 70.09 11.71 8.46 70.56 12.89 6.77 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 59.16 37.82 13.95 57.63 37.03 15.12 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 15 3 # 15 199 ASP A 172 ASP.? 13.07 O1 EDO B 190 218 GLU A 139 GLU.? 13.74 O4 MPD A 191 329 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 49.16 35.16 15.19 51.08 34.43 15.65 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 70.09 11.71 8.46 70.56 12.89 6.77 50.77 29.24 9.79 48.92 30.09 9.22 coo 59.16 37.82 13.95 57.63 37.03 15.12 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 16 3 # 16 199 ASP B 4 ASP.? -7.27 O2 EDO B 190s 218 GLU A 91 GLU.? 21.73 O1 EDO A 189 329 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 49.16 35.16 15.19 51.08 34.43 15.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 70.09 11.71 8.46 70.56 12.89 6.77 66.09 34.28 12.66 67.33 35.85 13.37 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 17 3 # 17 199 ASP B 4 ASP.? -7.27 O2 EDO B 190s 218 GLU A 127 GLU^? 13.22 O2 MPD A 191 329 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 49.16 35.16 15.19 51.08 34.43 15.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 70.09 11.71 8.46 70.56 12.89 6.77 49.68 14.95 31.31 48.32 16.27 32.27 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 18 3 # 18 199 ASP B 4 ASP.? -7.27 O2 EDO B 190s 218 GLU A 127 GLU^? 13.22 O2 MPD A 191 329 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 70.09 11.71 8.46 70.56 12.89 6.77 49.68 14.95 31.31 48.32 16.27 32.27 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 19 3 # 19 199 ASP B 4 ASP.? -7.27 O2 EDO B 190s 218 GLU A 139 GLU.? 13.74 O4 MPD A 191 329 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 70.09 11.71 8.46 70.56 12.89 6.77 50.77 29.24 9.79 48.92 30.09 9.22 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 20 3 # 20 199 ASP B 4 ASP.? -7.27 O2 EDO B 190s 218 GLU A 158 GLU^? 10.31 O2 MPD A 191 329 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 49.16 35.16 15.19 51.08 34.43 15.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 70.09 11.71 8.46 70.56 12.89 6.77 43.36 11.29 26.55 43.12 11.25 28.63 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 21 3 # 21 199 ASP B 4 ASP.? -7.27 O2 EDO B 190s 218 GLU A 158 GLU^? 10.31 O2 MPD A 191 329 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 64.75 2.11 3.69 66.46 3.28 4.11 coo 70.09 11.71 8.46 70.56 12.89 6.77 43.36 11.29 26.55 43.12 11.25 28.63 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 22 3 # 22 199 ASP B 27 ASP.? 13.66 O1 EDO A 188 218 GLU B 39 GLU.? -2.97 O2 EDO B 188s 329 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 49.16 35.16 15.19 51.08 34.43 15.65 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 70.09 11.71 8.46 70.56 12.89 6.77 35.53 10.88 -8.90 35.33 11.18 -11.01 coo 59.16 37.82 13.95 57.63 37.03 15.12 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 23 3 # 23 199 ASP B 27 ASP.? 13.66 O1 EDO A 188 218 GLU B 139 GLU.? 9.67 O2 EDO B 191 329 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 49.16 35.16 15.19 51.08 34.43 15.65 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 70.09 11.71 8.46 70.56 12.89 6.77 41.80 1.11 -18.67 40.76 -0.16 -17.27 coo 59.16 37.82 13.95 57.63 37.03 15.12 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 24 3 # 24 199 ASP B 28 ASP.? 13.72 O2 EDO B 189 218 GLU B 39 GLU.? -2.97 O2 EDO B 188s 329 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 49.16 35.16 15.19 51.08 34.43 15.65 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 70.09 11.71 8.46 70.56 12.89 6.77 35.53 10.88 -8.90 35.33 11.18 -11.01 coo 59.16 37.82 13.95 57.63 37.03 15.12 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 25 3 # 25 199 ASP B 54 ASP.? 15.81 C2 EDO B 193 218 GLU A 67 GLU^? 10.03 C1 EDO A 189 329 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 49.16 35.16 15.19 51.08 34.43 15.65 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 70.09 11.71 8.46 70.56 12.89 6.77 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 59.16 37.82 13.95 57.63 37.03 15.12 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 26 3 # 26 199 ASP B 80 ASP.? 22.03 C1 EDO B 189 218 GLU B 39 GLU.? -2.97 O2 EDO B 188s 329 ASP B 97 ASP~? 21.83 C3 MPD B 194 coo 49.16 35.16 15.19 51.08 34.43 15.65 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 70.09 11.71 8.46 70.56 12.89 6.77 35.53 10.88 -8.90 35.33 11.18 -11.01 coo 59.16 37.82 13.95 57.63 37.03 15.12 39.93 2.83 -36.24 41.54 1.65 -37.01 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 27 3 # 27 199 ASP B 97 ASP~? 21.83 C3 MPD B 194 218 GLU B 67 GLU^? -5.72 C1 EDO A 190s 329 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 70.09 11.71 8.46 70.56 12.89 6.77 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 59.16 37.82 13.95 57.63 37.03 15.12 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 28 3 # 28 199 ASP B 97 ASP~? 21.83 C3 MPD B 194 218 GLU B 173 GLU.? 7.59 O1 EDO B 193 329 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 70.09 11.71 8.46 70.56 12.89 6.77 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 59.16 37.82 13.95 57.63 37.03 15.12 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 29 3 # 29 199 ASP B 172 ASP.? 7.16 C1 EDO B 193 218 GLU B 67 GLU^? -5.72 C1 EDO A 190s 329 ASP B 179 ASP^? 11.34 O2 EDO A 188 coo 49.16 35.16 15.19 51.08 34.43 15.65 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 70.09 11.71 8.46 70.56 12.89 6.77 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.06 29.40 -17.37 33.45 31.08 -16.20 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 30 3 # 30 199 ASP B 172 ASP.? 7.16 C1 EDO B 193 218 GLU B 139 GLU.? 9.67 O2 EDO B 191 329 ASP B 179 ASP^? 11.34 O2 EDO A 188 coo 49.16 35.16 15.19 51.08 34.43 15.65 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 70.09 11.71 8.46 70.56 12.89 6.77 41.80 1.11 -18.67 40.76 -0.16 -17.27 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.06 29.40 -17.37 33.45 31.08 -16.20 1uok_c04 source 1uok OLIGO-1,6-GLUCOSIDASE : 30 hits 1uok_c04 naa= 3 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 4 ASP.? 9.87 O1 EDO A 188 242 GLU A 69 GLU.? 15.47 O2 EDO A 188 329 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 49.16 35.16 15.19 51.08 34.43 15.65 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 30.42 34.74 5.00 29.09 35.09 3.38 44.88 26.70 -3.49 42.93 26.42 -2.77 coo 59.16 37.82 13.95 57.63 37.03 15.12 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 4 ASP.? 9.87 O1 EDO A 188 242 GLU A 69 GLU.? 15.47 O2 EDO A 188 329 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 30.42 34.74 5.00 29.09 35.09 3.38 44.88 26.70 -3.49 42.93 26.42 -2.77 coo 59.16 37.82 13.95 57.63 37.03 15.12 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP A 54 ASP.? 20.27 C2 EDO A 189 242 GLU A 91 GLU.? 21.73 O1 EDO A 189 329 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 49.16 35.16 15.19 51.08 34.43 15.65 68.86 12.45 19.04 67.57 12.48 20.71 coo 30.42 34.74 5.00 29.09 35.09 3.38 66.09 34.28 12.66 67.33 35.85 13.37 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP A 54 ASP.? 20.27 C2 EDO A 189 242 GLU A 127 GLU^? 13.22 O2 MPD A 191 329 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 49.16 35.16 15.19 51.08 34.43 15.65 68.86 12.45 19.04 67.57 12.48 20.71 coo 30.42 34.74 5.00 29.09 35.09 3.38 49.68 14.95 31.31 48.32 16.27 32.27 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 5 3 # 5 199 ASP A 54 ASP.? 20.27 C2 EDO A 189 242 GLU A 173 GLU.? 15.20 O1 EDO B 190 329 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 68.86 12.45 19.04 67.57 12.48 20.71 coo 30.42 34.74 5.00 29.09 35.09 3.38 56.04 -5.91 18.03 55.52 -6.78 16.19 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 6 3 # 6 199 ASP A 80 ASP.? 21.91 O1 EDO A 189 242 GLU A 26 GLU.? 10.86 O2 EDO A 189 329 ASP A 97 ASP~? 21.13 O4 MPD A 191 coo 49.16 35.16 15.19 51.08 34.43 15.65 68.63 22.07 21.16 67.50 22.56 22.86 coo 30.42 34.74 5.00 29.09 35.09 3.38 66.27 6.09 6.28 67.77 7.37 5.57 coo 59.16 37.82 13.95 57.63 37.03 15.12 60.01 27.52 25.19 61.63 28.83 24.67 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 7 3 # 7 199 ASP A 101 ASP^? 14.06 CM MPD A 191 242 GLU A 39 GLU.? 8.26 C5 MPD A 191 329 ASP A 54 ASP.? 20.27 C2 EDO A 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 57.05 15.04 20.11 57.86 14.10 21.77 coo 30.42 34.74 5.00 29.09 35.09 3.38 40.24 18.97 5.60 41.21 18.63 7.48 coo 59.16 37.82 13.95 57.63 37.03 15.12 68.86 12.45 19.04 67.57 12.48 20.71 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 8 3 # 8 199 ASP B 54 ASP.? 15.81 C2 EDO B 193 242 GLU B 173 GLU.? 7.59 O1 EDO B 193 329 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 49.16 35.16 15.19 51.08 34.43 15.65 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 30.42 34.74 5.00 29.09 35.09 3.38 41.37 35.78 -29.47 41.05 37.86 -29.87 coo 59.16 37.82 13.95 57.63 37.03 15.12 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 9 3 # 9 199 ASP B 80 ASP.? 22.03 C1 EDO B 189 242 GLU B 26 GLU.? 11.31 O2 EDO B 189 329 ASP B 97 ASP~? 21.83 C3 MPD B 194 coo 49.16 35.16 15.19 51.08 34.43 15.65 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 30.42 34.74 5.00 29.09 35.09 3.38 55.48 25.40 -24.73 57.31 24.35 -24.78 coo 59.16 37.82 13.95 57.63 37.03 15.12 39.93 2.83 -36.24 41.54 1.65 -37.01 1uok_c05 source 1uok OLIGO-1,6-GLUCOSIDASE : 9 hits 1uok_c05 naa= 3 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 1 3 # 1 A 581 GLU A 31 GLU^? -3.45 O2 EDO A 189s A 596 ARG A 50 ARG^? 6.80 C2 EDO A 189 A 647 ARG A 52 ARG^? 13.70 C2 EDO A 189 coo 69.13 32.20 28.58 68.39 32.96 30.44 61.87 12.13 2.43 62.94 11.86 0.64 coo 70.89 37.31 29.70 69.54 36.29 32.39 65.37 14.47 5.23 66.89 16.94 6.37 coo 66.09 40.54 34.70 66.92 37.69 35.49 69.17 14.29 10.90 69.97 16.58 12.80 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 2 3 # 2 A 581 GLU A 67 GLU^? 10.03 C1 EDO A 189 A 596 ARG B 35 ARG^? 10.43 C2 EDO A 190 A 647 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 69.13 32.20 28.58 68.39 32.96 30.44 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 70.89 37.31 29.70 69.54 36.29 32.39 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 66.09 40.54 34.70 66.92 37.69 35.49 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 3 3 # 3 A 581 GLU A 161 GLU.? 9.37 O2 MPD A 191 A 596 ARG A 144 ARG^? 11.59 O2 MPD A 191 A 647 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo 69.13 32.20 28.58 68.39 32.96 30.44 45.67 22.34 23.77 46.84 23.71 24.88 coo 70.89 37.31 29.70 69.54 36.29 32.39 48.95 22.48 28.26 46.62 21.31 29.92 coo 66.09 40.54 34.70 66.92 37.69 35.49 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 4 3 # 4 A 581 GLU B 31 GLU^? -3.64 O2 EDO B 189s A 596 ARG B 50 ARG^? -6.93 O2 EDO B 189s A 647 ARG B 52 ARG^? 13.54 O2 EDO B 189 coo 69.13 32.20 28.58 68.39 32.96 30.44 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 70.89 37.31 29.70 69.54 36.29 32.39 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 66.09 40.54 34.70 66.92 37.69 35.49 55.40 16.98 -30.43 55.13 14.61 -32.43 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 5 3 # 5 A 581 GLU B 67 GLU^? -5.72 C1 EDO A 190s A 596 ARG A 35 ARG^? -3.68 C1 EDO A 190s A 647 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 69.13 32.20 28.58 68.39 32.96 30.44 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 70.89 37.31 29.70 69.54 36.29 32.39 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 66.09 40.54 34.70 66.92 37.69 35.49 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 6 3 # 6 A 581 GLU B 161 GLU.? 9.05 O2 MPD B 194 A 596 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 647 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 69.13 32.20 28.58 68.39 32.96 30.44 28.86 7.94 -26.27 29.12 6.39 -27.73 coo 70.89 37.31 29.70 69.54 36.29 32.39 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 66.09 40.54 34.70 66.92 37.69 35.49 35.59 7.18 -33.96 34.54 5.79 -36.47 1v0e_c00 source 1v0e ENDO-ALPHA-SIALIDASE : 6 hits 1v0e_c00 naa= 3 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 1 3 # 1 B 581 GLU A 31 GLU^? -3.45 O2 EDO A 189s B 596 ARG A 50 ARG^? 6.80 C2 EDO A 189 B 647 ARG A 52 ARG^? 13.70 C2 EDO A 189 coo 38.22 57.83 70.36 36.82 56.74 69.18 61.87 12.13 2.43 62.94 11.86 0.64 coo 34.24 60.89 68.08 33.31 57.93 67.63 65.37 14.47 5.23 66.89 16.94 6.37 coo 31.43 57.38 61.97 31.90 55.58 64.41 69.17 14.29 10.90 69.97 16.58 12.80 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 2 3 # 2 B 581 GLU A 67 GLU^? 10.03 C1 EDO A 189 B 596 ARG B 35 ARG^? 10.43 C2 EDO A 190 B 647 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 38.22 57.83 70.36 36.82 56.74 69.18 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 34.24 60.89 68.08 33.31 57.93 67.63 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 31.43 57.38 61.97 31.90 55.58 64.41 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 3 3 # 3 B 581 GLU A 161 GLU.? 9.37 O2 MPD A 191 B 596 ARG A 144 ARG^? 11.59 O2 MPD A 191 B 647 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo 38.22 57.83 70.36 36.82 56.74 69.18 45.67 22.34 23.77 46.84 23.71 24.88 coo 34.24 60.89 68.08 33.31 57.93 67.63 48.95 22.48 28.26 46.62 21.31 29.92 coo 31.43 57.38 61.97 31.90 55.58 64.41 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 4 3 # 4 B 581 GLU B 31 GLU^? -3.64 O2 EDO B 189s B 596 ARG B 50 ARG^? -6.93 O2 EDO B 189s B 647 ARG B 52 ARG^? 13.54 O2 EDO B 189 coo 38.22 57.83 70.36 36.82 56.74 69.18 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 34.24 60.89 68.08 33.31 57.93 67.63 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 31.43 57.38 61.97 31.90 55.58 64.41 55.40 16.98 -30.43 55.13 14.61 -32.43 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 5 3 # 5 B 581 GLU B 67 GLU^? -5.72 C1 EDO A 190s B 596 ARG A 35 ARG^? -3.68 C1 EDO A 190s B 647 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 38.22 57.83 70.36 36.82 56.74 69.18 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 34.24 60.89 68.08 33.31 57.93 67.63 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 31.43 57.38 61.97 31.90 55.58 64.41 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 6 3 # 6 B 581 GLU B 161 GLU.? 9.05 O2 MPD B 194 B 596 ARG B 144 ARG^? 12.29 O2 MPD B 194 B 647 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 38.22 57.83 70.36 36.82 56.74 69.18 28.86 7.94 -26.27 29.12 6.39 -27.73 coo 34.24 60.89 68.08 33.31 57.93 67.63 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 31.43 57.38 61.97 31.90 55.58 64.41 35.59 7.18 -33.96 34.54 5.79 -36.47 1v0e_c01 source 1v0e ENDO-ALPHA-SIALIDASE : 6 hits 1v0e_c01 naa= 3 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 1 3 # 1 C 581 GLU A 31 GLU^? -3.45 O2 EDO A 189s C 596 ARG A 50 ARG^? 6.80 C2 EDO A 189 C 647 ARG A 52 ARG^? 13.70 C2 EDO A 189 coo 11.31 31.26 27.00 13.31 30.71 26.58 61.87 12.13 2.43 62.94 11.86 0.64 coo 13.44 32.78 22.07 15.56 30.91 23.37 65.37 14.47 5.23 66.89 16.94 6.37 coo 21.00 33.35 22.82 19.83 30.82 24.09 69.17 14.29 10.90 69.97 16.58 12.80 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 2 3 # 2 C 581 GLU A 67 GLU^? 10.03 C1 EDO A 189 C 596 ARG B 35 ARG^? 10.43 C2 EDO A 190 C 647 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 11.31 31.26 27.00 13.31 30.71 26.58 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 13.44 32.78 22.07 15.56 30.91 23.37 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 21.00 33.35 22.82 19.83 30.82 24.09 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 3 3 # 3 C 581 GLU A 161 GLU.? 9.37 O2 MPD A 191 C 596 ARG A 144 ARG^? 11.59 O2 MPD A 191 C 647 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo 11.31 31.26 27.00 13.31 30.71 26.58 45.67 22.34 23.77 46.84 23.71 24.88 coo 13.44 32.78 22.07 15.56 30.91 23.37 48.95 22.48 28.26 46.62 21.31 29.92 coo 21.00 33.35 22.82 19.83 30.82 24.09 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 4 3 # 4 C 581 GLU B 31 GLU^? -3.64 O2 EDO B 189s C 596 ARG B 50 ARG^? -6.93 O2 EDO B 189s C 647 ARG B 52 ARG^? 13.54 O2 EDO B 189 coo 11.31 31.26 27.00 13.31 30.71 26.58 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 13.44 32.78 22.07 15.56 30.91 23.37 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 21.00 33.35 22.82 19.83 30.82 24.09 55.40 16.98 -30.43 55.13 14.61 -32.43 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 5 3 # 5 C 581 GLU B 67 GLU^? -5.72 C1 EDO A 190s C 596 ARG A 35 ARG^? -3.68 C1 EDO A 190s C 647 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 11.31 31.26 27.00 13.31 30.71 26.58 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 13.44 32.78 22.07 15.56 30.91 23.37 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 21.00 33.35 22.82 19.83 30.82 24.09 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 6 3 # 6 C 581 GLU B 161 GLU.? 9.05 O2 MPD B 194 C 596 ARG B 144 ARG^? 12.29 O2 MPD B 194 C 647 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 11.31 31.26 27.00 13.31 30.71 26.58 28.86 7.94 -26.27 29.12 6.39 -27.73 coo 13.44 32.78 22.07 15.56 30.91 23.37 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 21.00 33.35 22.82 19.83 30.82 24.09 35.59 7.18 -33.96 34.54 5.79 -36.47 1v0e_c02 source 1v0e ENDO-ALPHA-SIALIDASE : 6 hits 1v0e_c02 naa= 3 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 1 3 # 1 D 581 GLU A 31 GLU^? -3.45 O2 EDO A 189s D 596 ARG A 50 ARG^? 6.80 C2 EDO A 189 D 647 ARG A 52 ARG^? 13.70 C2 EDO A 189 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 61.87 12.13 2.43 62.94 11.86 0.64 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 65.37 14.47 5.23 66.89 16.94 6.37 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 69.17 14.29 10.90 69.97 16.58 12.80 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 2 3 # 2 D 581 GLU A 67 GLU^? 10.03 C1 EDO A 189 D 596 ARG B 35 ARG^? 10.43 C2 EDO A 190 D 647 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 54.47 21.64 -4.11 55.33 21.19 -6.01 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 48.60 18.31 -7.03 51.67 18.96 -6.78 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 3 3 # 3 D 581 GLU A 161 GLU.? 9.37 O2 MPD A 191 D 596 ARG A 144 ARG^? 11.59 O2 MPD A 191 D 647 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 45.67 22.34 23.77 46.84 23.71 24.88 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 48.95 22.48 28.26 46.62 21.31 29.92 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 4 3 # 4 D 581 GLU B 31 GLU^? -3.64 O2 EDO B 189s D 596 ARG B 50 ARG^? -6.93 O2 EDO B 189s D 647 ARG B 52 ARG^? 13.54 O2 EDO B 189 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 54.51 18.58 -19.03 56.60 18.34 -19.10 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 55.72 16.68 -23.20 56.85 15.32 -25.75 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 55.40 16.98 -30.43 55.13 14.61 -32.43 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 5 3 # 5 D 581 GLU B 67 GLU^? -5.72 C1 EDO A 190s D 596 ARG A 35 ARG^? -3.68 C1 EDO A 190s D 647 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 52.81 8.90 -9.47 54.54 9.74 -8.49 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 49.65 12.45 -3.94 51.87 11.63 -5.97 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 6 3 # 6 D 581 GLU B 161 GLU.? 9.05 O2 MPD B 194 D 596 ARG B 144 ARG^? 12.29 O2 MPD B 194 D 647 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 28.86 7.94 -26.27 29.12 6.39 -27.73 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 28.02 7.86 -31.66 25.29 9.13 -32.53 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 35.59 7.18 -33.96 34.54 5.79 -36.47 1v0e_c03 source 1v0e ENDO-ALPHA-SIALIDASE : 6 hits 1v0e_c03 naa= 3 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 1 3 # 1 E 581 GLU A 31 GLU^? -3.45 O2 EDO A 189s E 596 ARG A 50 ARG^? 6.80 C2 EDO A 189 E 647 ARG A 52 ARG^? 13.70 C2 EDO A 189 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 61.87 12.13 2.43 62.94 11.86 0.64 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 65.37 14.47 5.23 66.89 16.94 6.37 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 69.17 14.29 10.90 69.97 16.58 12.80 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 2 3 # 2 E 581 GLU A 61 GLU^? 10.22 O1 EDO A 189 E 596 ARG A 52 ARG^? 13.70 C2 EDO A 189 E 647 ARG A 60 ARG^? 18.80 O1 EDO A 189 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 66.46 19.59 10.29 68.35 19.61 9.28 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 69.17 14.29 10.90 69.97 16.58 12.80 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 67.94 16.79 18.42 70.70 18.25 18.48 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 3 3 # 3 E 581 GLU A 67 GLU^? 10.03 C1 EDO A 189 E 596 ARG B 35 ARG^? 10.43 C2 EDO A 190 E 647 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 13.14 -15.80 20.26 11.08 -15.36 20.42 54.47 21.64 -4.11 55.33 21.19 -6.01 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 4 3 # 4 E 581 GLU A 161 GLU.? 9.37 O2 MPD A 191 E 596 ARG A 144 ARG^? 11.59 O2 MPD A 191 E 647 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 45.67 22.34 23.77 46.84 23.71 24.88 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 48.95 22.48 28.26 46.62 21.31 29.92 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 5 3 # 5 E 581 GLU B 31 GLU^? -3.64 O2 EDO B 189s E 596 ARG B 50 ARG^? -6.93 O2 EDO B 189s E 647 ARG B 52 ARG^? 13.54 O2 EDO B 189 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 55.40 16.98 -30.43 55.13 14.61 -32.43 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 6 3 # 6 E 581 GLU B 67 GLU^? -5.72 C1 EDO A 190s E 596 ARG A 35 ARG^? -3.68 C1 EDO A 190s E 647 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 52.81 8.90 -9.47 54.54 9.74 -8.49 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 7 3 # 7 E 581 GLU B 161 GLU.? 9.05 O2 MPD B 194 E 596 ARG B 144 ARG^? 12.29 O2 MPD B 194 E 647 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 28.86 7.94 -26.27 29.12 6.39 -27.73 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 35.59 7.18 -33.96 34.54 5.79 -36.47 1v0e_c04 source 1v0e ENDO-ALPHA-SIALIDASE : 7 hits 1v0e_c04 naa= 3 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 1 3 # 1 F 581 GLU A 31 GLU^? -3.45 O2 EDO A 189s F 596 ARG A 50 ARG^? 6.80 C2 EDO A 189 F 647 ARG A 52 ARG^? 13.70 C2 EDO A 189 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 61.87 12.13 2.43 62.94 11.86 0.64 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 65.37 14.47 5.23 66.89 16.94 6.37 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 69.17 14.29 10.90 69.97 16.58 12.80 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 2 3 # 2 F 581 GLU A 61 GLU^? 10.22 O1 EDO A 189 F 596 ARG A 52 ARG^? 13.70 C2 EDO A 189 F 647 ARG A 60 ARG^? 18.80 O1 EDO A 189 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 66.46 19.59 10.29 68.35 19.61 9.28 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 69.17 14.29 10.90 69.97 16.58 12.80 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 67.94 16.79 18.42 70.70 18.25 18.48 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 3 3 # 3 F 581 GLU A 161 GLU.? 9.37 O2 MPD A 191 F 596 ARG A 144 ARG^? 11.59 O2 MPD A 191 F 647 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 45.67 22.34 23.77 46.84 23.71 24.88 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 48.95 22.48 28.26 46.62 21.31 29.92 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 4 3 # 4 F 581 GLU B 31 GLU^? -3.64 O2 EDO B 189s F 596 ARG B 50 ARG^? -6.93 O2 EDO B 189s F 647 ARG B 52 ARG^? 13.54 O2 EDO B 189 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 54.51 18.58 -19.03 56.60 18.34 -19.10 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 55.72 16.68 -23.20 56.85 15.32 -25.75 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 55.40 16.98 -30.43 55.13 14.61 -32.43 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 5 3 # 5 F 581 GLU B 67 GLU^? -5.72 C1 EDO A 190s F 596 ARG A 35 ARG^? -3.68 C1 EDO A 190s F 647 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 52.81 8.90 -9.47 54.54 9.74 -8.49 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 49.65 12.45 -3.94 51.87 11.63 -5.97 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 6 3 # 6 F 581 GLU B 161 GLU.? 9.05 O2 MPD B 194 F 596 ARG B 144 ARG^? 12.29 O2 MPD B 194 F 647 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 28.86 7.94 -26.27 29.12 6.39 -27.73 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 28.02 7.86 -31.66 25.29 9.13 -32.53 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 35.59 7.18 -33.96 34.54 5.79 -36.47 1v0e_c05 source 1v0e ENDO-ALPHA-SIALIDASE : 6 hits 1v0e_c05 naa= 3 ULMN 3 1vq1_c00 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 1 3 # 1 A 100 PHE A 109 PHE~? 13.06 O2 EDO A 189 A 197 ASN A 111 ASN~? 7.14 CM MPD A 191 A 198 PRO A 114 PRO~? 12.14 CM MPD A 191 coo 5.24 -2.19 28.74 3.83 -0.30 30.29 55.71 9.08 10.99 58.41 8.70 11.58 coo 6.86 -1.03 36.13 5.08 -0.39 35.24 50.97 8.64 17.05 49.29 9.91 16.73 coo 3.80 -4.83 39.13 4.75 -4.51 37.10 54.42 11.69 21.28 56.11 10.21 21.42 ULMN 3 1vq1_c00 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 2 3 # 2 A 100 PHE A 113 PHE~? 14.88 O1 EDO A 189 A 197 ASN A 111 ASN~? 7.14 CM MPD A 191 A 198 PRO A 108 PRO~? 10.47 CM MPD A 191 coo 5.24 -2.19 28.74 3.83 -0.30 30.29 58.33 11.41 16.78 59.51 11.35 14.22 coo 6.86 -1.03 36.13 5.08 -0.39 35.24 50.97 8.64 17.05 49.29 9.91 16.73 coo 3.80 -4.83 39.13 4.75 -4.51 37.10 48.80 7.64 10.44 49.46 9.47 11.51 ULMN 3 1vq1_c00 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 3 3 # 3 A 100 PHE B 109 PHE~? 11.60 C1 EDO A 188 A 197 ASN B 111 ASN~? 7.23 CM MPD B 194 A 198 PRO B 114 PRO~? 10.61 C1 EDO B 193 coo 5.24 -2.19 28.74 3.83 -0.30 30.29 44.45 21.45 -22.32 46.25 21.85 -24.45 coo 6.86 -1.03 36.13 5.08 -0.39 35.24 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 3.80 -4.83 39.13 4.75 -4.51 37.10 37.28 18.71 -29.88 38.46 20.23 -30.98 ULMN 3 1vq1_c00 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 4 3 # 4 A 100 PHE B 113 PHE~? 12.33 C1 EDO B 193 A 197 ASN B 111 ASN~? 7.23 CM MPD B 194 A 198 PRO B 108 PRO~? 10.40 CM MPD B 194 coo 5.24 -2.19 28.74 3.83 -0.30 30.29 43.08 19.13 -28.69 45.51 19.27 -27.36 coo 6.86 -1.03 36.13 5.08 -0.39 35.24 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 3.80 -4.83 39.13 4.75 -4.51 37.10 39.31 22.65 -17.83 39.12 20.78 -19.01 1vq1_c00 source 1vq1 N5-GLUTAMINE METHYLTRANSFERASE, HEMK : 4 hits 1vq1_c00 naa= 3 ULMN 3 1vq1_c01 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 1 3 # 1 B 100 PHE A 109 PHE~? 13.06 O2 EDO A 189 B 197 ASN A 111 ASN~? 7.14 CM MPD A 191 B 198 PRO A 114 PRO~? 12.14 CM MPD A 191 coo 15.92 -14.38 -0.49 15.85 -16.40 -2.42 55.71 9.08 10.99 58.41 8.70 11.58 coo 21.71 -15.65 -5.30 19.75 -16.44 -5.47 50.97 8.64 17.05 49.29 9.91 16.73 coo 21.24 -11.77 -9.43 20.56 -12.14 -7.31 54.42 11.69 21.28 56.11 10.21 21.42 ULMN 3 1vq1_c01 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 2 3 # 2 B 100 PHE A 113 PHE~? 14.88 O1 EDO A 189 B 197 ASN A 111 ASN~? 7.14 CM MPD A 191 B 198 PRO A 108 PRO~? 10.47 CM MPD A 191 coo 15.92 -14.38 -0.49 15.85 -16.40 -2.42 58.33 11.41 16.78 59.51 11.35 14.22 coo 21.71 -15.65 -5.30 19.75 -16.44 -5.47 50.97 8.64 17.05 49.29 9.91 16.73 coo 21.24 -11.77 -9.43 20.56 -12.14 -7.31 48.80 7.64 10.44 49.46 9.47 11.51 ULMN 3 1vq1_c01 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 3 3 # 3 B 100 PHE B 109 PHE~? 11.60 C1 EDO A 188 B 197 ASN B 111 ASN~? 7.23 CM MPD B 194 B 198 PRO B 114 PRO~? 10.61 C1 EDO B 193 coo 15.92 -14.38 -0.49 15.85 -16.40 -2.42 44.45 21.45 -22.32 46.25 21.85 -24.45 coo 21.71 -15.65 -5.30 19.75 -16.44 -5.47 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 21.24 -11.77 -9.43 20.56 -12.14 -7.31 37.28 18.71 -29.88 38.46 20.23 -30.98 ULMN 3 1vq1_c01 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 4 3 # 4 B 100 PHE B 113 PHE~? 12.33 C1 EDO B 193 B 197 ASN B 111 ASN~? 7.23 CM MPD B 194 B 198 PRO B 108 PRO~? 10.40 CM MPD B 194 coo 15.92 -14.38 -0.49 15.85 -16.40 -2.42 43.08 19.13 -28.69 45.51 19.27 -27.36 coo 21.71 -15.65 -5.30 19.75 -16.44 -5.47 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 21.24 -11.77 -9.43 20.56 -12.14 -7.31 39.31 22.65 -17.83 39.12 20.78 -19.01 1vq1_c01 source 1vq1 N5-GLUTAMINE METHYLTRANSFERASE, HEMK : 4 hits 1vq1_c01 naa= 3 ULMN 3 1vzx_c02 2.04.01.0087 user 1 3 # 1 A 314 TYR A 49 TYR^? 7.66 O1 EDO A 189 A 317 GLU A 31 GLU^? -3.45 O2 EDO A 189s A 365 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 1.77 6.56 57.05 3.05 7.44 59.37 56.86 15.30 6.36 55.58 13.13 7.63 coo 3.06 2.85 52.79 4.83 3.89 53.24 61.87 12.13 2.43 62.94 11.86 0.64 coo 3.82 17.09 49.56 4.09 14.32 50.84 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1vzx_c02 2.04.01.0087 user 2 3 # 2 A 314 TYR A 157 TYR^? -4.51 CM MPD A 191s A 317 GLU A 158 GLU^? 10.31 O2 MPD A 191 A 365 ARG A 144 ARG^? 11.59 O2 MPD A 191 coo 1.77 6.56 57.05 3.05 7.44 59.37 46.12 11.16 21.21 46.22 13.94 20.83 coo 3.06 2.85 52.79 4.83 3.89 53.24 43.36 11.29 26.55 43.12 11.25 28.63 coo 3.82 17.09 49.56 4.09 14.32 50.84 48.95 22.48 28.26 46.62 21.31 29.92 ULMN 3 1vzx_c02 2.04.01.0087 user 3 3 # 3 A 314 TYR A 157 TYR^? -4.51 CM MPD A 191s A 317 GLU A 158 GLU^? 10.31 O2 MPD A 191 A 365 ARG A 149 ARG^? 22.01 CM MPD A 191 coo 1.77 6.56 57.05 3.05 7.44 59.37 46.12 11.16 21.21 46.22 13.94 20.83 coo 3.06 2.85 52.79 4.83 3.89 53.24 43.36 11.29 26.55 43.12 11.25 28.63 coo 3.82 17.09 49.56 4.09 14.32 50.84 53.15 0.69 27.47 54.83 -1.87 27.18 ULMN 3 1vzx_c02 2.04.01.0087 user 4 3 # 4 A 314 TYR B 49 TYR^? -7.47 C2 EDO B 189s A 317 GLU B 31 GLU^? -3.64 O2 EDO B 189s A 365 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 1.77 6.56 57.05 3.05 7.44 59.37 48.23 15.25 -19.35 46.43 17.40 -19.57 coo 3.06 2.85 52.79 4.83 3.89 53.24 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 3.82 17.09 49.56 4.09 14.32 50.84 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1vzx_c02 2.04.01.0087 user 5 3 # 5 A 314 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 317 GLU B 158 GLU^? 10.92 O2 MPD B 194 A 365 ARG B 149 ARG^? 5.09 O2 EDO B 193 coo 1.77 6.56 57.05 3.05 7.44 59.37 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 3.06 2.85 52.79 4.83 3.89 53.24 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 3.82 17.09 49.56 4.09 14.32 50.84 32.58 29.52 -34.06 34.17 32.07 -34.76 1vzx_c02 source 1vzx 2.04.01.0087 : 5 hits 1vzx_c02 naa= 3 ULMN 3 1vzx_c03 2.04.01.0087 user 1 3 # 1 B1314 TYR A 49 TYR^? 7.66 O1 EDO A 189 B1317 GLU A 31 GLU^? -3.45 O2 EDO A 189s B1365 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 13.32 10.15 -9.20 12.07 11.36 -11.38 56.86 15.30 6.36 55.58 13.13 7.63 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 61.87 12.13 2.43 62.94 11.86 0.64 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1vzx_c03 2.04.01.0087 user 2 3 # 2 B1314 TYR A 157 TYR^? -4.51 CM MPD A 191s B1317 GLU A 158 GLU^? 10.31 O2 MPD A 191 B1365 ARG A 149 ARG^? 22.01 CM MPD A 191 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 46.12 11.16 21.21 46.22 13.94 20.83 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 43.36 11.29 26.55 43.12 11.25 28.63 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 53.15 0.69 27.47 54.83 -1.87 27.18 ULMN 3 1vzx_c03 2.04.01.0087 user 3 3 # 3 B1314 TYR B 49 TYR^? -7.47 C2 EDO B 189s B1317 GLU B 31 GLU^? -3.64 O2 EDO B 189s B1365 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 48.23 15.25 -19.35 46.43 17.40 -19.57 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1vzx_c03 2.04.01.0087 user 4 3 # 4 B1314 TYR B 157 TYR^? -4.69 O2 MPD B 194s B1317 GLU B 158 GLU^? 10.92 O2 MPD B 194 B1365 ARG B 149 ARG^? 5.09 O2 EDO B 193 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 32.58 29.52 -34.06 34.17 32.07 -34.76 1vzx_c03 source 1vzx 2.04.01.0087 : 4 hits 1vzx_c03 naa= 3 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 7 TYR^? -3.69 C1 EDO A 188s A 40 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 103 LEU A 6 LEU^? -6.16 O1 EDO A 188s coo 12.09 16.13 10.57 11.28 18.80 10.73 46.26 28.35 -19.62 46.61 30.00 -21.81 coo 7.55 25.51 14.34 9.65 25.73 14.24 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 11.83 18.73 16.99 10.99 19.71 15.26 51.13 29.12 -16.00 50.69 27.88 -14.14 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR A 7 TYR^? -3.69 C1 EDO A 188s A 40 ASP A 4 ASP.? 9.87 O1 EDO A 188 A 103 LEU B 23 LEU^? 9.11 C1 EDO A 188 coo 12.09 16.13 10.57 11.28 18.80 10.73 46.26 28.35 -19.62 46.61 30.00 -21.81 coo 7.55 25.51 14.34 9.65 25.73 14.24 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 11.83 18.73 16.99 10.99 19.71 15.26 47.94 23.18 -18.28 47.78 22.93 -20.49 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 3 3 # 3 A 16 TYR A 45 TYR^? 11.90 O2 EDO A 190 A 40 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 103 LEU A 34 LEU^? 9.26 O2 EDO A 190 coo 12.09 16.13 10.57 11.28 18.80 10.73 47.53 19.92 0.67 46.95 18.68 3.19 coo 7.55 25.51 14.34 9.65 25.73 14.24 57.58 16.65 0.08 56.71 16.10 -1.78 coo 11.83 18.73 16.99 10.99 19.71 15.26 51.42 13.55 3.24 49.84 14.38 4.49 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 4 3 # 4 A 16 TYR A 132 TYR^? -3.92 O4 MPD A 191s A 40 ASP A 101 ASP^? 14.06 CM MPD A 191 A 103 LEU A 131 LEU^? 12.33 O4 MPD A 191 coo 12.09 16.13 10.57 11.28 18.80 10.73 48.86 20.67 16.01 46.69 20.01 14.37 coo 7.55 25.51 14.34 9.65 25.73 14.24 57.05 15.04 20.11 57.86 14.10 21.77 coo 11.83 18.73 16.99 10.99 19.71 15.26 55.99 21.56 17.89 56.54 23.45 17.02 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 5 3 # 5 A 16 TYR A 155 TYR^? 14.94 CM MPD A 191 A 40 ASP A 122 ASP.? 22.97 CM MPD A 191 A 103 LEU A 120 LEU.? 17.29 O2 MPD A 191 coo 12.09 16.13 10.57 11.28 18.80 10.73 50.44 4.00 23.33 52.91 2.96 24.17 coo 7.55 25.51 14.34 9.65 25.73 14.24 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 11.83 18.73 16.99 10.99 19.71 15.26 54.69 4.72 28.64 54.09 6.84 28.79 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 6 3 # 6 A 16 TYR A 155 TYR^? 14.94 CM MPD A 191 A 40 ASP A 122 ASP.? 22.97 CM MPD A 191 A 103 LEU A 150 LEU^? 16.59 CM MPD A 191 coo 12.09 16.13 10.57 11.28 18.80 10.73 50.44 4.00 23.33 52.91 2.96 24.17 coo 7.55 25.51 14.34 9.65 25.73 14.24 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 11.83 18.73 16.99 10.99 19.71 15.26 45.96 0.60 27.10 44.54 2.25 27.14 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 7 3 # 7 A 16 TYR A 155 TYR^? 14.94 CM MPD A 191 A 40 ASP A 179 ASP^? 16.86 CM MPD A 191 A 103 LEU A 169 LEU^? 9.63 CM MPD A 191 coo 12.09 16.13 10.57 11.28 18.80 10.73 50.44 4.00 23.33 52.91 2.96 24.17 coo 7.55 25.51 14.34 9.65 25.73 14.24 43.85 0.70 13.63 43.61 -0.87 12.28 coo 11.83 18.73 16.99 10.99 19.71 15.26 47.03 4.71 18.71 46.73 6.86 18.33 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 8 3 # 8 A 16 TYR B 7 TYR^? 8.72 O1 EDO B 190 A 40 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 103 LEU A 23 LEU^? 10.78 O2 EDO A 189 coo 12.09 16.13 10.57 11.28 18.80 10.73 55.88 2.21 7.80 57.52 0.60 9.42 coo 7.55 25.51 14.34 9.65 25.73 14.24 64.75 2.11 3.69 66.46 3.28 4.11 coo 11.83 18.73 16.99 10.99 19.71 15.26 56.24 7.35 5.52 57.26 7.53 7.41 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 9 3 # 9 A 16 TYR B 7 TYR^? 8.72 O1 EDO B 190 A 40 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 103 LEU A 25 LEU^? 10.43 O1 EDO B 190 coo 12.09 16.13 10.57 11.28 18.80 10.73 55.88 2.21 7.80 57.52 0.60 9.42 coo 7.55 25.51 14.34 9.65 25.73 14.24 64.75 2.11 3.69 66.46 3.28 4.11 coo 11.83 18.73 16.99 10.99 19.71 15.26 60.88 4.33 8.47 60.95 4.72 10.61 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 10 3 # 10 A 16 TYR B 7 TYR^? 8.72 O1 EDO B 190 A 40 ASP B 4 ASP.? -7.27 O2 EDO B 190s A 103 LEU B 6 LEU^? 4.43 O2 EDO B 190 coo 12.09 16.13 10.57 11.28 18.80 10.73 55.88 2.21 7.80 57.52 0.60 9.42 coo 7.55 25.51 14.34 9.65 25.73 14.24 64.75 2.11 3.69 66.46 3.28 4.11 coo 11.83 18.73 16.99 10.99 19.71 15.26 57.79 1.12 2.32 59.09 1.83 0.67 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 11 3 # 11 A 16 TYR B 45 TYR^? 7.97 C2 EDO A 190 A 40 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 103 LEU B 34 LEU^? 11.05 C2 EDO B 189 coo 12.09 16.13 10.57 11.28 18.80 10.73 44.36 10.34 -9.27 42.37 11.49 -10.86 coo 7.55 25.51 14.34 9.65 25.73 14.24 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 11.83 18.73 16.99 10.99 19.71 15.26 45.81 16.83 -13.57 43.83 16.06 -13.74 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 12 3 # 12 A 16 TYR B 132 TYR^? 4.23 O4 MPD B 194s A 40 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 103 LEU B 131 LEU^? 12.70 C3 MPD B 194 coo 12.09 16.13 10.57 11.28 18.80 10.73 36.28 9.60 -22.40 35.59 10.15 -19.78 coo 7.55 25.51 14.34 9.65 25.73 14.24 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 11.83 18.73 16.99 10.99 19.71 15.26 40.82 9.00 -28.22 41.89 7.18 -27.82 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 13 3 # 13 A 16 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 40 ASP B 122 ASP.? 7.15 O2 EDO B 192 A 103 LEU B 120 LEU.? 8.93 O2 EDO B 193 coo 12.09 16.13 10.57 11.28 18.80 10.73 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 7.55 25.51 14.34 9.65 25.73 14.24 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 11.83 18.73 16.99 10.99 19.71 15.26 32.65 25.36 -35.99 32.22 23.26 -35.57 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 14 3 # 14 A 16 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 40 ASP B 122 ASP.? 7.15 O2 EDO B 192 A 103 LEU B 150 LEU^? 9.35 O1 EDO B 192 coo 12.09 16.13 10.57 11.28 18.80 10.73 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 7.55 25.51 14.34 9.65 25.73 14.24 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 11.83 18.73 16.99 10.99 19.71 15.26 27.10 29.49 -29.35 25.88 27.89 -28.60 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 15 3 # 15 A 16 TYR B 155 TYR^? 6.08 O1 EDO B 193 A 40 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 103 LEU B 169 LEU^? 9.73 CM MPD B 194 coo 12.09 16.13 10.57 11.28 18.80 10.73 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 7.55 25.51 14.34 9.65 25.73 14.24 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 11.83 18.73 16.99 10.99 19.71 15.26 32.68 25.45 -23.22 32.83 23.38 -22.74 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 16 3 # 16 A 16 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 40 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 103 LEU B 169 LEU^? 9.73 CM MPD B 194 coo 12.09 16.13 10.57 11.28 18.80 10.73 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 7.55 25.51 14.34 9.65 25.73 14.24 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 11.83 18.73 16.99 10.99 19.71 15.26 32.68 25.45 -23.22 32.83 23.38 -22.74 1vzz_c00 source 1vzz STEROID DELTA-ISOMERASE : 16 hits 1vzz_c00 naa= 3 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 7 TYR^? -3.69 C1 EDO A 188s B 40 ASP A 4 ASP.? 9.87 O1 EDO A 188 B 103 LEU A 6 LEU^? -6.16 O1 EDO A 188s coo 14.25 20.09 37.35 13.48 17.40 37.38 46.26 28.35 -19.62 46.61 30.00 -21.81 coo 9.39 10.77 34.53 11.50 10.63 34.41 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 12.89 17.60 31.13 12.34 16.51 32.90 51.13 29.12 -16.00 50.69 27.88 -14.14 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR A 7 TYR^? -3.69 C1 EDO A 188s B 40 ASP A 4 ASP.? 9.87 O1 EDO A 188 B 103 LEU B 23 LEU^? 9.11 C1 EDO A 188 coo 14.25 20.09 37.35 13.48 17.40 37.38 46.26 28.35 -19.62 46.61 30.00 -21.81 coo 9.39 10.77 34.53 11.50 10.63 34.41 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 12.89 17.60 31.13 12.34 16.51 32.90 47.94 23.18 -18.28 47.78 22.93 -20.49 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 3 3 # 3 B 16 TYR A 45 TYR^? 11.90 O2 EDO A 190 B 40 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 103 LEU A 34 LEU^? 9.26 O2 EDO A 190 coo 14.25 20.09 37.35 13.48 17.40 37.38 47.53 19.92 0.67 46.95 18.68 3.19 coo 9.39 10.77 34.53 11.50 10.63 34.41 57.58 16.65 0.08 56.71 16.10 -1.78 coo 12.89 17.60 31.13 12.34 16.51 32.90 51.42 13.55 3.24 49.84 14.38 4.49 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 4 3 # 4 B 16 TYR A 132 TYR^? -3.92 O4 MPD A 191s B 40 ASP A 101 ASP^? 14.06 CM MPD A 191 B 103 LEU A 131 LEU^? 12.33 O4 MPD A 191 coo 14.25 20.09 37.35 13.48 17.40 37.38 48.86 20.67 16.01 46.69 20.01 14.37 coo 9.39 10.77 34.53 11.50 10.63 34.41 57.05 15.04 20.11 57.86 14.10 21.77 coo 12.89 17.60 31.13 12.34 16.51 32.90 55.99 21.56 17.89 56.54 23.45 17.02 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 5 3 # 5 B 16 TYR A 147 TYR^? 9.49 CM MPD A 191 B 40 ASP A 101 ASP^? 14.06 CM MPD A 191 B 103 LEU A 118 LEU~? 16.17 O2 MPD A 191 coo 14.25 20.09 37.35 13.48 17.40 37.38 50.88 9.76 23.94 51.01 10.64 21.28 coo 9.39 10.77 34.53 11.50 10.63 34.41 57.05 15.04 20.11 57.86 14.10 21.77 coo 12.89 17.60 31.13 12.34 16.51 32.90 57.28 8.39 26.78 56.34 10.34 26.93 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 6 3 # 6 B 16 TYR A 155 TYR^? 14.94 CM MPD A 191 B 40 ASP A 122 ASP.? 22.97 CM MPD A 191 B 103 LEU A 120 LEU.? 17.29 O2 MPD A 191 coo 14.25 20.09 37.35 13.48 17.40 37.38 50.44 4.00 23.33 52.91 2.96 24.17 coo 9.39 10.77 34.53 11.50 10.63 34.41 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 12.89 17.60 31.13 12.34 16.51 32.90 54.69 4.72 28.64 54.09 6.84 28.79 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 7 3 # 7 B 16 TYR A 155 TYR^? 14.94 CM MPD A 191 B 40 ASP A 122 ASP.? 22.97 CM MPD A 191 B 103 LEU A 150 LEU^? 16.59 CM MPD A 191 coo 14.25 20.09 37.35 13.48 17.40 37.38 50.44 4.00 23.33 52.91 2.96 24.17 coo 9.39 10.77 34.53 11.50 10.63 34.41 51.13 -1.78 31.54 51.32 -3.14 29.91 coo 12.89 17.60 31.13 12.34 16.51 32.90 45.96 0.60 27.10 44.54 2.25 27.14 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 8 3 # 8 B 16 TYR A 155 TYR^? 14.94 CM MPD A 191 B 40 ASP A 179 ASP^? 16.86 CM MPD A 191 B 103 LEU A 169 LEU^? 9.63 CM MPD A 191 coo 14.25 20.09 37.35 13.48 17.40 37.38 50.44 4.00 23.33 52.91 2.96 24.17 coo 9.39 10.77 34.53 11.50 10.63 34.41 43.85 0.70 13.63 43.61 -0.87 12.28 coo 12.89 17.60 31.13 12.34 16.51 32.90 47.03 4.71 18.71 46.73 6.86 18.33 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 9 3 # 9 B 16 TYR B 7 TYR^? 8.72 O1 EDO B 190 B 40 ASP B 4 ASP.? -7.27 O2 EDO B 190s B 103 LEU A 23 LEU^? 10.78 O2 EDO A 189 coo 14.25 20.09 37.35 13.48 17.40 37.38 55.88 2.21 7.80 57.52 0.60 9.42 coo 9.39 10.77 34.53 11.50 10.63 34.41 64.75 2.11 3.69 66.46 3.28 4.11 coo 12.89 17.60 31.13 12.34 16.51 32.90 56.24 7.35 5.52 57.26 7.53 7.41 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 10 3 # 10 B 16 TYR B 7 TYR^? 8.72 O1 EDO B 190 B 40 ASP B 4 ASP.? -7.27 O2 EDO B 190s B 103 LEU A 25 LEU^? 10.43 O1 EDO B 190 coo 14.25 20.09 37.35 13.48 17.40 37.38 55.88 2.21 7.80 57.52 0.60 9.42 coo 9.39 10.77 34.53 11.50 10.63 34.41 64.75 2.11 3.69 66.46 3.28 4.11 coo 12.89 17.60 31.13 12.34 16.51 32.90 60.88 4.33 8.47 60.95 4.72 10.61 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 11 3 # 11 B 16 TYR B 7 TYR^? 8.72 O1 EDO B 190 B 40 ASP B 4 ASP.? -7.27 O2 EDO B 190s B 103 LEU B 6 LEU^? 4.43 O2 EDO B 190 coo 14.25 20.09 37.35 13.48 17.40 37.38 55.88 2.21 7.80 57.52 0.60 9.42 coo 9.39 10.77 34.53 11.50 10.63 34.41 64.75 2.11 3.69 66.46 3.28 4.11 coo 12.89 17.60 31.13 12.34 16.51 32.90 57.79 1.12 2.32 59.09 1.83 0.67 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 12 3 # 12 B 16 TYR B 45 TYR^? 7.97 C2 EDO A 190 B 40 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 103 LEU B 34 LEU^? 11.05 C2 EDO B 189 coo 14.25 20.09 37.35 13.48 17.40 37.38 44.36 10.34 -9.27 42.37 11.49 -10.86 coo 9.39 10.77 34.53 11.50 10.63 34.41 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 12.89 17.60 31.13 12.34 16.51 32.90 45.81 16.83 -13.57 43.83 16.06 -13.74 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 13 3 # 13 B 16 TYR B 132 TYR^? 4.23 O4 MPD B 194s B 40 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 103 LEU B 131 LEU^? 12.70 C3 MPD B 194 coo 14.25 20.09 37.35 13.48 17.40 37.38 36.28 9.60 -22.40 35.59 10.15 -19.78 coo 9.39 10.77 34.53 11.50 10.63 34.41 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 12.89 17.60 31.13 12.34 16.51 32.90 40.82 9.00 -28.22 41.89 7.18 -27.82 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 14 3 # 14 B 16 TYR B 155 TYR^? 6.08 O1 EDO B 193 B 40 ASP B 122 ASP.? 7.15 O2 EDO B 192 B 103 LEU B 120 LEU.? 8.93 O2 EDO B 193 coo 14.25 20.09 37.35 13.48 17.40 37.38 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 9.39 10.77 34.53 11.50 10.63 34.41 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 12.89 17.60 31.13 12.34 16.51 32.90 32.65 25.36 -35.99 32.22 23.26 -35.57 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 15 3 # 15 B 16 TYR B 155 TYR^? 6.08 O1 EDO B 193 B 40 ASP B 122 ASP.? 7.15 O2 EDO B 192 B 103 LEU B 150 LEU^? 9.35 O1 EDO B 192 coo 14.25 20.09 37.35 13.48 17.40 37.38 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 9.39 10.77 34.53 11.50 10.63 34.41 28.45 32.01 -35.99 29.78 33.29 -34.96 coo 12.89 17.60 31.13 12.34 16.51 32.90 27.10 29.49 -29.35 25.88 27.89 -28.60 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 16 3 # 16 B 16 TYR B 155 TYR^? 6.08 O1 EDO B 193 B 40 ASP B 179 ASP^? 11.34 O2 EDO A 188 B 103 LEU B 169 LEU^? 9.73 CM MPD B 194 coo 14.25 20.09 37.35 13.48 17.40 37.38 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 9.39 10.77 34.53 11.50 10.63 34.41 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 12.89 17.60 31.13 12.34 16.51 32.90 32.68 25.45 -23.22 32.83 23.38 -22.74 1vzz_c01 source 1vzz STEROID DELTA-ISOMERASE : 16 hits 1vzz_c01 naa= 3 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 1 3 # 1 A 105 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 169 ASP A 28 ASP.? 17.25 C2 EDO A 189 A 288 GLU A 26 GLU.? 10.86 O2 EDO A 189 coo 67.72 35.99 30.87 69.77 36.13 31.33 64.74 13.84 22.58 64.60 13.48 24.65 coo 73.17 30.66 22.56 72.87 30.30 20.46 68.65 8.60 12.81 69.48 7.64 14.53 coo 74.06 28.51 15.92 73.77 29.56 17.73 66.27 6.09 6.28 67.77 7.37 5.57 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 2 3 # 2 A 105 HIS A 76 HIS^? 9.12 O1 EDO A 189 A 169 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 288 GLU A 67 GLU^? 10.03 C1 EDO A 189 coo 67.72 35.99 30.87 69.77 36.13 31.33 65.00 24.12 7.67 66.83 23.12 7.94 coo 73.17 30.66 22.56 72.87 30.30 20.46 57.58 16.65 0.08 56.71 16.10 -1.78 coo 74.06 28.51 15.92 73.77 29.56 17.73 54.47 21.64 -4.11 55.33 21.19 -6.01 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 3 3 # 3 A 105 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 169 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 288 GLU B 26 GLU.? 11.31 O2 EDO B 189 coo 67.72 35.99 30.87 69.77 36.13 31.33 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 73.17 30.66 22.56 72.87 30.30 20.46 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 74.06 28.51 15.92 73.77 29.56 17.73 55.48 25.40 -24.73 57.31 24.35 -24.78 ULMN 3 1w1o_c00 CYTOKININ DEHYDROGENASE 1 user 4 3 # 4 A 105 HIS B 76 HIS^? 9.10 C1 EDO B 189 A 169 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 288 GLU B 67 GLU^? -5.72 C1 EDO A 190s coo 67.72 35.99 30.87 69.77 36.13 31.33 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 73.17 30.66 22.56 72.87 30.30 20.46 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 74.06 28.51 15.92 73.77 29.56 17.73 52.81 8.90 -9.47 54.54 9.74 -8.49 1w1o_c00 source 1w1o CYTOKININ DEHYDROGENASE 1 : 4 hits 1w1o_c00 naa= 3 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 183 GLY A 83 GLY.? 19.80 C3 MPD A 191 B 419 GLY A 81 GLY.? 20.02 O1 EDO A 189 B 420 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 62.79 21.97 24.03 63.48 22.23 23.74 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 66.26 17.90 21.72 66.27 18.63 22.08 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 # 2 A 183 GLY B 83 GLY.? 19.88 O2 MPD B 194 B 419 GLY B 81 GLY.? 19.64 C2 EDO B 193 B 420 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 42.83 8.47 -37.13 43.54 8.24 -37.38 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 46.71 12.75 -37.37 46.59 12.01 -37.69 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 48.62 9.08 -33.69 47.43 9.95 -33.20 1xny_c00 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 2 hits 1xny_c00 naa= 3 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 420 ALA A 79 ALA^? 16.03 O1 EDO A 189 B 182 GLY A 98 GLY.? 17.64 O2 MPD A 191 B 183 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 38.36-101.47-135.52 39.62-101.29-136.35 65.24 21.66 17.68 64.04 20.76 17.95 coo 41.93-102.35-126.87 41.52-101.89-126.30 59.27 22.98 25.86 59.28 23.02 25.07 coo 38.37-101.99-128.11 38.63-102.24-127.37 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 # 2 A 420 ALA A 92 ALA.? 22.21 O1 EDO A 189 B 182 GLY A 88 GLY.? 12.79 O1 EDO A 189 B 183 GLY A 90 GLY.? 17.99 O1 EDO A 189 coo 38.36-101.47-135.52 39.62-101.29-136.35 65.16 31.38 17.96 65.64 31.84 19.31 coo 41.93-102.35-126.87 41.52-101.89-126.30 66.43 27.54 9.22 66.36 28.23 9.60 coo 38.37-101.99-128.11 38.63-102.24-127.37 68.99 30.23 13.11 68.36 30.72 12.94 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 # 3 A 420 ALA A 95 ALA~? 16.69 O4 MPD A 191 B 182 GLY A 83 GLY.? 19.80 C3 MPD A 191 B 183 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 38.36-101.47-135.52 39.62-101.29-136.35 56.91 30.38 21.40 56.04 30.98 20.28 coo 41.93-102.35-126.87 41.52-101.89-126.30 62.79 21.97 24.03 63.48 22.23 23.74 coo 38.37-101.99-128.11 38.63-102.24-127.37 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 # 4 A 420 ALA A 130 ALA^? 8.62 C3 MPD A 191 B 182 GLY A 83 GLY.? 19.80 C3 MPD A 191 B 183 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 38.36-101.47-135.52 39.62-101.29-136.35 53.71 18.81 21.19 52.67 17.80 20.63 coo 41.93-102.35-126.87 41.52-101.89-126.30 62.79 21.97 24.03 63.48 22.23 23.74 coo 38.37-101.99-128.11 38.63-102.24-127.37 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 5 3 # 5 A 420 ALA B 79 ALA^? 16.25 C1 EDO B 189 B 182 GLY B 98 GLY.? 17.68 O2 MPD B 194 B 183 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 38.36-101.47-135.52 39.62-101.29-136.35 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 41.93-102.35-126.87 41.52-101.89-126.30 39.01 7.37 -36.59 39.44 7.37 -35.92 coo 38.37-101.99-128.11 38.63-102.24-127.37 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 6 3 # 6 A 420 ALA B 92 ALA.? 22.43 C1 EDO B 189 B 182 GLY B 88 GLY.? 12.78 C1 EDO B 189 B 183 GLY B 90 GLY.? 18.17 C1 EDO B 189 coo 38.36-101.47-135.52 39.62-101.29-136.35 48.58 -0.77 -33.67 48.18 -1.29 -35.04 coo 41.93-102.35-126.87 41.52-101.89-126.30 54.76 3.63 -27.59 54.55 2.90 -27.91 coo 38.37-101.99-128.11 38.63-102.24-127.37 54.47 0.76 -32.31 54.10 0.32 -31.77 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 7 3 # 7 A 420 ALA B 95 ALA~? 17.43 O4 MPD B 194 B 182 GLY B 83 GLY.? 19.88 O2 MPD B 194 B 183 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 38.36-101.47-135.52 39.62-101.29-136.35 39.98 0.12 -31.29 40.06 -0.39 -29.86 coo 41.93-102.35-126.87 41.52-101.89-126.30 42.83 8.47 -37.13 43.54 8.24 -37.38 coo 38.37-101.99-128.11 38.63-102.24-127.37 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 1xny_c01 PROPIONYL-COA CARBOXYLASE COMPLEX B user 8 3 # 8 A 420 ALA B 130 ALA^? 8.48 O2 MPD B 194 B 182 GLY B 83 GLY.? 19.88 O2 MPD B 194 B 183 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 38.36-101.47-135.52 39.62-101.29-136.35 36.89 11.57 -29.50 36.35 12.45 -28.44 coo 41.93-102.35-126.87 41.52-101.89-126.30 42.83 8.47 -37.13 43.54 8.24 -37.38 coo 38.37-101.99-128.11 38.63-102.24-127.37 39.01 7.37 -36.59 39.44 7.37 -35.92 1xny_c01 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 8 hits 1xny_c01 naa= 3 ULMN 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 1 3 # 1 A 105 ALA A 62 ALA^? 8.76 O1 EDO A 189 A 244 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 271 HIS A 76 HIS^? 9.12 O1 EDO A 189 coo 15.05 3.71 6.93 14.58 4.88 7.78 62.10 18.98 10.31 60.83 19.17 11.13 coo 9.85 8.15 0.76 10.61 7.04 2.39 63.41 29.58 11.55 64.59 31.41 11.51 coo 10.61 7.65 6.01 12.39 6.55 6.23 65.00 24.12 7.67 66.83 23.12 7.94 ULMN 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 2 3 # 2 A 105 ALA A 79 ALA^? 16.03 O1 EDO A 189 A 244 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 271 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 15.05 3.71 6.93 14.58 4.88 7.78 65.24 21.66 17.68 64.04 20.76 17.95 coo 9.85 8.15 0.76 10.61 7.04 2.39 60.01 27.52 25.19 61.63 28.83 24.67 coo 10.61 7.65 6.01 12.39 6.55 6.23 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 3 3 # 3 A 105 ALA B 62 ALA^? 8.92 C1 EDO B 189 A 244 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 271 HIS B 76 HIS^? 9.10 C1 EDO B 189 coo 15.05 3.71 6.93 14.58 4.88 7.78 50.28 11.76 -25.69 48.75 11.59 -25.62 coo 9.85 8.15 0.76 10.61 7.04 2.39 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 10.61 7.65 6.01 12.39 6.55 6.23 54.34 6.71 -25.28 55.69 7.78 -26.49 ULMN 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 4 3 # 4 A 105 ALA B 79 ALA^? 16.25 C1 EDO B 189 A 244 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 271 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 15.05 3.71 6.93 14.58 4.88 7.78 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 9.85 8.15 0.76 10.61 7.04 2.39 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 10.61 7.65 6.01 12.39 6.55 6.23 45.35 5.36 -39.37 44.27 5.71 -41.13 1xqw_c00 source 1xqw PROLINE IMINOPEPTIDASE : 4 hits 1xqw_c00 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 10 ALA^? 11.42 O2 EDO A 188 B 126 ARG A 14 ARG.? 14.51 O2 EDO B 188 B 138 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 2.11 4.00 19.31 3.14 4.86 19.99 39.96 24.34 -10.37 39.71 25.41 -9.28 coo 2.45 5.53 11.28 3.59 7.56 13.29 34.22 19.89 -3.86 35.36 22.47 -5.15 coo 6.10 2.00 25.24 6.12 1.84 23.13 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 B 124 ALA A 10 ALA^? 11.42 O2 EDO A 188 B 126 ARG B 186 ARG^? -4.10 O2 EDO A 188s B 138 GLU A 69 GLU.? 15.47 O2 EDO A 188 coo 2.11 4.00 19.31 3.14 4.86 19.99 39.96 24.34 -10.37 39.71 25.41 -9.28 coo 2.45 5.53 11.28 3.59 7.56 13.29 42.31 29.46 -17.08 41.98 30.89 -19.84 coo 6.10 2.00 25.24 6.12 1.84 23.13 44.88 26.70 -3.49 42.93 26.42 -2.77 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 B 124 ALA A 36 ALA^? 9.26 O2 EDO A 190 B 126 ARG A 35 ARG^? -3.68 C1 EDO A 190s B 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 2.11 4.00 19.31 3.14 4.86 19.99 45.24 15.21 0.88 45.56 15.37 2.38 coo 2.45 5.53 11.28 3.59 7.56 13.29 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 6.10 2.00 25.24 6.12 1.84 23.13 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 B 124 ALA A 36 ALA^? 9.26 O2 EDO A 190 B 126 ARG B 35 ARG^? 10.43 C2 EDO A 190 B 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 2.11 4.00 19.31 3.14 4.86 19.99 45.24 15.21 0.88 45.56 15.37 2.38 coo 2.45 5.53 11.28 3.59 7.56 13.29 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 6.10 2.00 25.24 6.12 1.84 23.13 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 B 124 ALA A 79 ALA^? 16.03 O1 EDO A 189 B 126 ARG A 82 ARG.? 24.76 O1 EDO A 189 B 138 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo 2.11 4.00 19.31 3.14 4.86 19.99 65.24 21.66 17.68 64.04 20.76 17.95 coo 2.45 5.53 11.28 3.59 7.56 13.29 69.47 19.71 26.08 71.03 22.01 24.70 coo 6.10 2.00 25.24 6.12 1.84 23.13 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 B 124 ALA A 135 ALA.? 11.13 C5 MPD A 191 B 126 ARG A 73 ARG^? 12.55 O1 EDO A 189 B 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 2.11 4.00 19.31 3.14 4.86 19.99 48.96 21.01 6.70 49.44 19.78 5.90 coo 2.45 5.53 11.28 3.59 7.56 13.29 53.52 27.95 4.31 55.34 28.60 6.78 coo 6.10 2.00 25.24 6.12 1.84 23.13 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 B 124 ALA B 10 ALA^? 8.89 O2 EDO A 190 B 126 ARG B 14 ARG.? 10.57 O1 EDO B 191 B 138 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 2.11 4.00 19.31 3.14 4.86 19.99 45.05 5.78 4.04 44.25 4.76 3.35 coo 2.45 5.53 11.28 3.59 7.56 13.29 36.61 9.98 2.38 38.30 7.40 2.59 coo 6.10 2.00 25.24 6.12 1.84 23.13 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 8 3 # 8 B 124 ALA B 36 ALA^? 10.06 O2 EDO B 188 B 126 ARG A 35 ARG^? -3.68 C1 EDO A 190s B 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo 2.11 4.00 19.31 3.14 4.86 19.99 42.34 14.94 -8.03 41.67 14.78 -9.42 coo 2.45 5.53 11.28 3.59 7.56 13.29 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 6.10 2.00 25.24 6.12 1.84 23.13 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 9 3 # 9 B 124 ALA B 36 ALA^? 10.06 O2 EDO B 188 B 126 ARG B 35 ARG^? 10.43 C2 EDO A 190 B 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo 2.11 4.00 19.31 3.14 4.86 19.99 42.34 14.94 -8.03 41.67 14.78 -9.42 coo 2.45 5.53 11.28 3.59 7.56 13.29 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 6.10 2.00 25.24 6.12 1.84 23.13 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 10 3 # 10 B 124 ALA B 79 ALA^? 16.25 C1 EDO B 189 B 126 ARG B 82 ARG.? 22.52 O2 EDO B 193 B 138 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo 2.11 4.00 19.31 3.14 4.86 19.99 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 2.45 5.53 11.28 3.59 7.56 13.29 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 6.10 2.00 25.24 6.12 1.84 23.13 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 11 3 # 11 B 124 ALA B 130 ALA^? 8.48 O2 MPD B 194 B 126 ARG B 141 ARG^? 5.70 O4 MPD B 194 B 138 GLU B 127 GLU^? 12.59 O2 MPD B 194 coo 2.11 4.00 19.31 3.14 4.86 19.99 36.89 11.57 -29.50 36.35 12.45 -28.44 coo 2.45 5.53 11.28 3.59 7.56 13.29 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 6.10 2.00 25.24 6.12 1.84 23.13 29.39 12.97 -34.29 27.94 11.43 -34.46 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 12 3 # 12 B 124 ALA B 135 ALA.? 9.12 C2 EDO B 188 B 126 ARG B 73 ARG^? 12.39 O2 EDO B 191 B 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo 2.11 4.00 19.31 3.14 4.86 19.99 41.94 9.33 -15.05 42.81 10.57 -14.76 coo 2.45 5.53 11.28 3.59 7.56 13.29 48.25 3.22 -16.58 47.20 1.81 -19.15 coo 6.10 2.00 25.24 6.12 1.84 23.13 35.53 10.88 -8.90 35.33 11.18 -11.01 1xs1_c07 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 12 hits 1xs1_c07 naa= 3 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 C 124 ALA A 10 ALA^? 11.42 O2 EDO A 188 C 126 ARG A 14 ARG.? 14.51 O2 EDO B 188 C 138 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 39.96 24.34 -10.37 39.71 25.41 -9.28 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 34.22 19.89 -3.86 35.36 22.47 -5.15 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 C 124 ALA A 10 ALA^? 11.42 O2 EDO A 188 C 126 ARG B 186 ARG^? -4.10 O2 EDO A 188s C 138 GLU A 69 GLU.? 15.47 O2 EDO A 188 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 39.96 24.34 -10.37 39.71 25.41 -9.28 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 42.31 29.46 -17.08 41.98 30.89 -19.84 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 44.88 26.70 -3.49 42.93 26.42 -2.77 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 C 124 ALA A 36 ALA^? 9.26 O2 EDO A 190 C 126 ARG A 35 ARG^? -3.68 C1 EDO A 190s C 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 45.24 15.21 0.88 45.56 15.37 2.38 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 49.65 12.45 -3.94 51.87 11.63 -5.97 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 C 124 ALA A 36 ALA^? 9.26 O2 EDO A 190 C 126 ARG B 35 ARG^? 10.43 C2 EDO A 190 C 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 45.24 15.21 0.88 45.56 15.37 2.38 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 48.60 18.31 -7.03 51.67 18.96 -6.78 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 C 124 ALA A 79 ALA^? 16.03 O1 EDO A 189 C 126 ARG A 82 ARG.? 24.76 O1 EDO A 189 C 138 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 65.24 21.66 17.68 64.04 20.76 17.95 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 69.47 19.71 26.08 71.03 22.01 24.70 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 C 124 ALA A 135 ALA.? 11.13 C5 MPD A 191 C 126 ARG A 73 ARG^? 12.55 O1 EDO A 189 C 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 48.96 21.01 6.70 49.44 19.78 5.90 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 53.52 27.95 4.31 55.34 28.60 6.78 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 C 124 ALA B 10 ALA^? 8.89 O2 EDO A 190 C 126 ARG B 14 ARG.? 10.57 O1 EDO B 191 C 138 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 45.05 5.78 4.04 44.25 4.76 3.35 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 36.61 9.98 2.38 38.30 7.40 2.59 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 8 3 # 8 C 124 ALA B 10 ALA^? 8.89 O2 EDO A 190 C 126 ARG B 14 ARG.? 10.57 O1 EDO B 191 C 138 GLU B 69 GLU.? -7.04 C2 EDO B 191s coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 45.05 5.78 4.04 44.25 4.76 3.35 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 36.61 9.98 2.38 38.30 7.40 2.59 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 46.74 3.18 -1.73 46.16 1.22 -2.29 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 9 3 # 9 C 124 ALA B 36 ALA^? 10.06 O2 EDO B 188 C 126 ARG A 35 ARG^? -3.68 C1 EDO A 190s C 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 42.34 14.94 -8.03 41.67 14.78 -9.42 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 49.65 12.45 -3.94 51.87 11.63 -5.97 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 10 3 # 10 C 124 ALA B 36 ALA^? 10.06 O2 EDO B 188 C 126 ARG B 35 ARG^? 10.43 C2 EDO A 190 C 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 42.34 14.94 -8.03 41.67 14.78 -9.42 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 48.60 18.31 -7.03 51.67 18.96 -6.78 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 11 3 # 11 C 124 ALA B 79 ALA^? 16.25 C1 EDO B 189 C 126 ARG B 82 ARG.? 22.52 O2 EDO B 193 C 138 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 48.62 9.08 -33.69 47.43 9.95 -33.20 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 46.69 11.07 -43.02 44.95 12.59 -45.09 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 12 3 # 12 C 124 ALA B 130 ALA^? 8.48 O2 MPD B 194 C 126 ARG B 117 ARG~? 13.46 O2 EDO B 193 C 138 GLU B 127 GLU^? 12.59 O2 MPD B 194 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 36.89 11.57 -29.50 36.35 12.45 -28.44 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 41.12 18.08 -35.59 38.25 17.08 -35.73 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 29.39 12.97 -34.29 27.94 11.43 -34.46 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 # 13 C 124 ALA B 130 ALA^? 8.48 O2 MPD B 194 C 126 ARG B 141 ARG^? 5.70 O4 MPD B 194 C 138 GLU B 127 GLU^? 12.59 O2 MPD B 194 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 36.89 11.57 -29.50 36.35 12.45 -28.44 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 34.68 4.05 -23.26 33.98 5.70 -20.76 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 29.39 12.97 -34.29 27.94 11.43 -34.46 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 13 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 10 ALA^? 11.42 O2 EDO A 188 D 126 ARG A 14 ARG.? 14.51 O2 EDO B 188 D 138 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 39.96 24.34 -10.37 39.71 25.41 -9.28 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 34.22 19.89 -3.86 35.36 22.47 -5.15 coo 6.23 0.50 57.10 5.93 0.72 59.19 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 D 124 ALA A 10 ALA^? 11.42 O2 EDO A 188 D 126 ARG B 186 ARG^? -4.10 O2 EDO A 188s D 138 GLU A 69 GLU.? 15.47 O2 EDO A 188 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 39.96 24.34 -10.37 39.71 25.41 -9.28 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 42.31 29.46 -17.08 41.98 30.89 -19.84 coo 6.23 0.50 57.10 5.93 0.72 59.19 44.88 26.70 -3.49 42.93 26.42 -2.77 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 D 124 ALA A 36 ALA^? 9.26 O2 EDO A 190 D 126 ARG A 35 ARG^? -3.68 C1 EDO A 190s D 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 45.24 15.21 0.88 45.56 15.37 2.38 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 6.23 0.50 57.10 5.93 0.72 59.19 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 D 124 ALA A 36 ALA^? 9.26 O2 EDO A 190 D 126 ARG B 35 ARG^? 10.43 C2 EDO A 190 D 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 45.24 15.21 0.88 45.56 15.37 2.38 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 6.23 0.50 57.10 5.93 0.72 59.19 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 D 124 ALA A 79 ALA^? 16.03 O1 EDO A 189 D 126 ARG A 82 ARG.? 24.76 O1 EDO A 189 D 138 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 65.24 21.66 17.68 64.04 20.76 17.95 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 69.47 19.71 26.08 71.03 22.01 24.70 coo 6.23 0.50 57.10 5.93 0.72 59.19 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 D 124 ALA A 135 ALA.? 11.13 C5 MPD A 191 D 126 ARG A 73 ARG^? 12.55 O1 EDO A 189 D 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 48.96 21.01 6.70 49.44 19.78 5.90 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 53.52 27.95 4.31 55.34 28.60 6.78 coo 6.23 0.50 57.10 5.93 0.72 59.19 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 D 124 ALA B 10 ALA^? 8.89 O2 EDO A 190 D 126 ARG B 14 ARG.? 10.57 O1 EDO B 191 D 138 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 45.05 5.78 4.04 44.25 4.76 3.35 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 36.61 9.98 2.38 38.30 7.40 2.59 coo 6.23 0.50 57.10 5.93 0.72 59.19 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 8 3 # 8 D 124 ALA B 10 ALA^? 8.89 O2 EDO A 190 D 126 ARG B 14 ARG.? 10.57 O1 EDO B 191 D 138 GLU B 69 GLU.? -7.04 C2 EDO B 191s coo 2.08 -1.49 62.94 3.12 -2.39 62.28 45.05 5.78 4.04 44.25 4.76 3.35 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 36.61 9.98 2.38 38.30 7.40 2.59 coo 6.23 0.50 57.10 5.93 0.72 59.19 46.74 3.18 -1.73 46.16 1.22 -2.29 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 9 3 # 9 D 124 ALA B 36 ALA^? 10.06 O2 EDO B 188 D 126 ARG A 35 ARG^? -3.68 C1 EDO A 190s D 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo 2.08 -1.49 62.94 3.12 -2.39 62.28 42.34 14.94 -8.03 41.67 14.78 -9.42 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 6.23 0.50 57.10 5.93 0.72 59.19 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 10 3 # 10 D 124 ALA B 36 ALA^? 10.06 O2 EDO B 188 D 126 ARG B 35 ARG^? 10.43 C2 EDO A 190 D 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo 2.08 -1.49 62.94 3.12 -2.39 62.28 42.34 14.94 -8.03 41.67 14.78 -9.42 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 6.23 0.50 57.10 5.93 0.72 59.19 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 11 3 # 11 D 124 ALA B 79 ALA^? 16.25 C1 EDO B 189 D 126 ARG B 82 ARG.? 22.52 O2 EDO B 193 D 138 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 48.62 9.08 -33.69 47.43 9.95 -33.20 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 6.23 0.50 57.10 5.93 0.72 59.19 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 12 3 # 12 D 124 ALA B 130 ALA^? 8.48 O2 MPD B 194 D 126 ARG B 117 ARG~? 13.46 O2 EDO B 193 D 138 GLU B 127 GLU^? 12.59 O2 MPD B 194 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 36.89 11.57 -29.50 36.35 12.45 -28.44 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 6.23 0.50 57.10 5.93 0.72 59.19 29.39 12.97 -34.29 27.94 11.43 -34.46 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 # 13 D 124 ALA B 130 ALA^? 8.48 O2 MPD B 194 D 126 ARG B 141 ARG^? 5.70 O4 MPD B 194 D 138 GLU B 127 GLU^? 12.59 O2 MPD B 194 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 36.89 11.57 -29.50 36.35 12.45 -28.44 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 6.23 0.50 57.10 5.93 0.72 59.19 29.39 12.97 -34.29 27.94 11.43 -34.46 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 13 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 10 ALA^? 11.42 O2 EDO A 188 E 126 ARG A 14 ARG.? 14.51 O2 EDO B 188 E 138 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo -4.56 10.03 62.36 -4.38 11.31 61.55 39.96 24.34 -10.37 39.71 25.41 -9.28 coo -3.02 12.00 70.07 -1.94 13.84 67.82 34.22 19.89 -3.86 35.36 22.47 -5.15 coo -8.67 12.22 56.54 -8.68 12.09 58.65 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 E 124 ALA A 10 ALA^? 11.42 O2 EDO A 188 E 126 ARG B 186 ARG^? -4.10 O2 EDO A 188s E 138 GLU A 69 GLU.? 15.47 O2 EDO A 188 coo -4.56 10.03 62.36 -4.38 11.31 61.55 39.96 24.34 -10.37 39.71 25.41 -9.28 coo -3.02 12.00 70.07 -1.94 13.84 67.82 42.31 29.46 -17.08 41.98 30.89 -19.84 coo -8.67 12.22 56.54 -8.68 12.09 58.65 44.88 26.70 -3.49 42.93 26.42 -2.77 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 E 124 ALA A 36 ALA^? 9.26 O2 EDO A 190 E 126 ARG A 35 ARG^? -3.68 C1 EDO A 190s E 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo -4.56 10.03 62.36 -4.38 11.31 61.55 45.24 15.21 0.88 45.56 15.37 2.38 coo -3.02 12.00 70.07 -1.94 13.84 67.82 49.65 12.45 -3.94 51.87 11.63 -5.97 coo -8.67 12.22 56.54 -8.68 12.09 58.65 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 E 124 ALA A 36 ALA^? 9.26 O2 EDO A 190 E 126 ARG B 35 ARG^? 10.43 C2 EDO A 190 E 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo -4.56 10.03 62.36 -4.38 11.31 61.55 45.24 15.21 0.88 45.56 15.37 2.38 coo -3.02 12.00 70.07 -1.94 13.84 67.82 48.60 18.31 -7.03 51.67 18.96 -6.78 coo -8.67 12.22 56.54 -8.68 12.09 58.65 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 E 124 ALA A 79 ALA^? 16.03 O1 EDO A 189 E 126 ARG A 82 ARG.? 24.76 O1 EDO A 189 E 138 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo -4.56 10.03 62.36 -4.38 11.31 61.55 65.24 21.66 17.68 64.04 20.76 17.95 coo -3.02 12.00 70.07 -1.94 13.84 67.82 69.47 19.71 26.08 71.03 22.01 24.70 coo -8.67 12.22 56.54 -8.68 12.09 58.65 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 E 124 ALA A 135 ALA.? 11.13 C5 MPD A 191 E 126 ARG A 73 ARG^? 12.55 O1 EDO A 189 E 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo -4.56 10.03 62.36 -4.38 11.31 61.55 48.96 21.01 6.70 49.44 19.78 5.90 coo -3.02 12.00 70.07 -1.94 13.84 67.82 53.52 27.95 4.31 55.34 28.60 6.78 coo -8.67 12.22 56.54 -8.68 12.09 58.65 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 E 124 ALA B 10 ALA^? 8.89 O2 EDO A 190 E 126 ARG B 14 ARG.? 10.57 O1 EDO B 191 E 138 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo -4.56 10.03 62.36 -4.38 11.31 61.55 45.05 5.78 4.04 44.25 4.76 3.35 coo -3.02 12.00 70.07 -1.94 13.84 67.82 36.61 9.98 2.38 38.30 7.40 2.59 coo -8.67 12.22 56.54 -8.68 12.09 58.65 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 8 3 # 8 E 124 ALA B 10 ALA^? 8.89 O2 EDO A 190 E 126 ARG B 14 ARG.? 10.57 O1 EDO B 191 E 138 GLU B 69 GLU.? -7.04 C2 EDO B 191s coo -4.56 10.03 62.36 -4.38 11.31 61.55 45.05 5.78 4.04 44.25 4.76 3.35 coo -3.02 12.00 70.07 -1.94 13.84 67.82 36.61 9.98 2.38 38.30 7.40 2.59 coo -8.67 12.22 56.54 -8.68 12.09 58.65 46.74 3.18 -1.73 46.16 1.22 -2.29 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 9 3 # 9 E 124 ALA B 36 ALA^? 10.06 O2 EDO B 188 E 126 ARG A 35 ARG^? -3.68 C1 EDO A 190s E 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo -4.56 10.03 62.36 -4.38 11.31 61.55 42.34 14.94 -8.03 41.67 14.78 -9.42 coo -3.02 12.00 70.07 -1.94 13.84 67.82 49.65 12.45 -3.94 51.87 11.63 -5.97 coo -8.67 12.22 56.54 -8.68 12.09 58.65 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 10 3 # 10 E 124 ALA B 36 ALA^? 10.06 O2 EDO B 188 E 126 ARG B 35 ARG^? 10.43 C2 EDO A 190 E 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo -4.56 10.03 62.36 -4.38 11.31 61.55 42.34 14.94 -8.03 41.67 14.78 -9.42 coo -3.02 12.00 70.07 -1.94 13.84 67.82 48.60 18.31 -7.03 51.67 18.96 -6.78 coo -8.67 12.22 56.54 -8.68 12.09 58.65 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 11 3 # 11 E 124 ALA B 79 ALA^? 16.25 C1 EDO B 189 E 126 ARG B 82 ARG.? 22.52 O2 EDO B 193 E 138 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo -4.56 10.03 62.36 -4.38 11.31 61.55 48.62 9.08 -33.69 47.43 9.95 -33.20 coo -3.02 12.00 70.07 -1.94 13.84 67.82 46.69 11.07 -43.02 44.95 12.59 -45.09 coo -8.67 12.22 56.54 -8.68 12.09 58.65 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 12 3 # 12 E 124 ALA B 130 ALA^? 8.48 O2 MPD B 194 E 126 ARG B 117 ARG~? 13.46 O2 EDO B 193 E 138 GLU B 127 GLU^? 12.59 O2 MPD B 194 coo -4.56 10.03 62.36 -4.38 11.31 61.55 36.89 11.57 -29.50 36.35 12.45 -28.44 coo -3.02 12.00 70.07 -1.94 13.84 67.82 41.12 18.08 -35.59 38.25 17.08 -35.73 coo -8.67 12.22 56.54 -8.68 12.09 58.65 29.39 12.97 -34.29 27.94 11.43 -34.46 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 # 13 E 124 ALA B 130 ALA^? 8.48 O2 MPD B 194 E 126 ARG B 141 ARG^? 5.70 O4 MPD B 194 E 138 GLU B 127 GLU^? 12.59 O2 MPD B 194 coo -4.56 10.03 62.36 -4.38 11.31 61.55 36.89 11.57 -29.50 36.35 12.45 -28.44 coo -3.02 12.00 70.07 -1.94 13.84 67.82 34.68 4.05 -23.26 33.98 5.70 -20.76 coo -8.67 12.22 56.54 -8.68 12.09 58.65 29.39 12.97 -34.29 27.94 11.43 -34.46 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 13 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 10 ALA^? 11.42 O2 EDO A 188 F 126 ARG A 14 ARG.? 14.51 O2 EDO B 188 F 138 GLU B 21 GLU^? 11.62 C2 EDO B 189 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 39.96 24.34 -10.37 39.71 25.41 -9.28 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 34.22 19.89 -3.86 35.36 22.47 -5.15 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 45.31 20.78 -15.22 44.37 19.83 -16.87 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 F 124 ALA A 10 ALA^? 11.42 O2 EDO A 188 F 126 ARG B 186 ARG^? -4.10 O2 EDO A 188s F 138 GLU A 69 GLU.? 15.47 O2 EDO A 188 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 39.96 24.34 -10.37 39.71 25.41 -9.28 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 42.31 29.46 -17.08 41.98 30.89 -19.84 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 44.88 26.70 -3.49 42.93 26.42 -2.77 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 F 124 ALA A 36 ALA^? 9.26 O2 EDO A 190 F 126 ARG A 35 ARG^? -3.68 C1 EDO A 190s F 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 45.24 15.21 0.88 45.56 15.37 2.38 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 49.65 12.45 -3.94 51.87 11.63 -5.97 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 F 124 ALA A 36 ALA^? 9.26 O2 EDO A 190 F 126 ARG B 35 ARG^? 10.43 C2 EDO A 190 F 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 45.24 15.21 0.88 45.56 15.37 2.38 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 48.60 18.31 -7.03 51.67 18.96 -6.78 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 5 3 # 5 F 124 ALA A 79 ALA^? 16.03 O1 EDO A 189 F 126 ARG A 82 ARG.? 24.76 O1 EDO A 189 F 138 GLU A 61 GLU^? 10.22 O1 EDO A 189 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 65.24 21.66 17.68 64.04 20.76 17.95 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 69.47 19.71 26.08 71.03 22.01 24.70 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 66.46 19.59 10.29 68.35 19.61 9.28 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 6 3 # 6 F 124 ALA A 135 ALA.? 11.13 C5 MPD A 191 F 126 ARG A 73 ARG^? 12.55 O1 EDO A 189 F 138 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 48.96 21.01 6.70 49.44 19.78 5.90 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 53.52 27.95 4.31 55.34 28.60 6.78 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 7 3 # 7 F 124 ALA B 10 ALA^? 8.89 O2 EDO A 190 F 126 ARG B 14 ARG.? 10.57 O1 EDO B 191 F 138 GLU A 21 GLU^? 11.03 O2 EDO A 190 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 45.05 5.78 4.04 44.25 4.76 3.35 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 36.61 9.98 2.38 38.30 7.40 2.59 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 52.20 9.76 4.74 52.41 10.59 6.66 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 8 3 # 8 F 124 ALA B 10 ALA^? 8.89 O2 EDO A 190 F 126 ARG B 14 ARG.? 10.57 O1 EDO B 191 F 138 GLU B 69 GLU.? -7.04 C2 EDO B 191s coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 45.05 5.78 4.04 44.25 4.76 3.35 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 36.61 9.98 2.38 38.30 7.40 2.59 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 46.74 3.18 -1.73 46.16 1.22 -2.29 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 9 3 # 9 F 124 ALA B 36 ALA^? 10.06 O2 EDO B 188 F 126 ARG A 35 ARG^? -3.68 C1 EDO A 190s F 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 42.34 14.94 -8.03 41.67 14.78 -9.42 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 49.65 12.45 -3.94 51.87 11.63 -5.97 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 10 3 # 10 F 124 ALA B 36 ALA^? 10.06 O2 EDO B 188 F 126 ARG B 35 ARG^? 10.43 C2 EDO A 190 F 138 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 42.34 14.94 -8.03 41.67 14.78 -9.42 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 48.60 18.31 -7.03 51.67 18.96 -6.78 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 11 3 # 11 F 124 ALA B 79 ALA^? 16.25 C1 EDO B 189 F 126 ARG B 82 ARG.? 22.52 O2 EDO B 193 F 138 GLU B 61 GLU^? 10.17 C1 EDO B 189 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 48.62 9.08 -33.69 47.43 9.95 -33.20 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 46.69 11.07 -43.02 44.95 12.59 -45.09 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 53.85 11.48 -28.30 55.92 11.40 -28.71 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 12 3 # 12 F 124 ALA B 130 ALA^? 8.48 O2 MPD B 194 F 126 ARG B 117 ARG~? 13.46 O2 EDO B 193 F 138 GLU B 127 GLU^? 12.59 O2 MPD B 194 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 36.89 11.57 -29.50 36.35 12.45 -28.44 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 41.12 18.08 -35.59 38.25 17.08 -35.73 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 29.39 12.97 -34.29 27.94 11.43 -34.46 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 13 3 # 13 F 124 ALA B 130 ALA^? 8.48 O2 MPD B 194 F 126 ARG B 141 ARG^? 5.70 O4 MPD B 194 F 138 GLU B 127 GLU^? 12.59 O2 MPD B 194 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 36.89 11.57 -29.50 36.35 12.45 -28.44 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 34.68 4.05 -23.26 33.98 5.70 -20.76 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 29.39 12.97 -34.29 27.94 11.43 -34.46 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 13 hits 1xs1_c11 naa= 3 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 1 3 # 1 B 137 GLY A 71 GLY^? 15.15 O2 EDO A 188 B 175 ARG B 35 ARG^? 10.43 C2 EDO A 190 B 242 TYR A 45 TYR^? 11.90 O2 EDO A 190 coo 99.45 58.28 3.33 99.57 58.61 4.10 51.64 28.27 -4.12 51.34 27.67 -3.59 coo 106.37 63.53 0.89 108.02 63.40 -1.62 48.60 18.31 -7.03 51.67 18.96 -6.78 coo 100.93 69.04 4.38 99.52 68.48 2.09 47.53 19.92 0.67 46.95 18.68 3.19 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 2 3 # 2 B 137 GLY A 119 GLY~? 20.44 CM MPD A 191 B 175 ARG A 116 ARG~? 15.92 O1 EDO B 190 B 242 TYR A 155 TYR^? 14.94 CM MPD A 191 coo 99.45 58.28 3.33 99.57 58.61 4.10 59.17 4.30 26.91 58.59 4.80 27.25 coo 106.37 63.53 0.89 108.02 63.40 -1.62 59.64 3.34 19.37 61.78 2.26 17.40 coo 100.93 69.04 4.38 99.52 68.48 2.09 50.44 4.00 23.33 52.91 2.96 24.17 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 3 3 # 3 B 137 GLY A 119 GLY~? 20.44 CM MPD A 191 B 175 ARG A 149 ARG^? 22.01 CM MPD A 191 B 242 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 99.45 58.28 3.33 99.57 58.61 4.10 59.17 4.30 26.91 58.59 4.80 27.25 coo 106.37 63.53 0.89 108.02 63.40 -1.62 53.15 0.69 27.47 54.83 -1.87 27.18 coo 100.93 69.04 4.38 99.52 68.48 2.09 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 4 3 # 4 B 137 GLY A 123 GLY.? 20.10 O2 MPD A 191 B 175 ARG A 125 ARG^? 12.17 O2 MPD A 191 B 242 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 99.45 58.28 3.33 99.57 58.61 4.10 49.15 2.03 32.88 49.82 2.35 32.50 coo 106.37 63.53 0.89 108.02 63.40 -1.62 47.67 10.86 32.86 45.58 12.34 31.13 coo 100.93 69.04 4.38 99.52 68.48 2.09 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 5 3 # 5 B 137 GLY A 175 GLY.? 16.97 O1 EDO B 190 B 175 ARG A 149 ARG^? 22.01 CM MPD A 191 B 242 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 99.45 58.28 3.33 99.57 58.61 4.10 55.47 1.95 17.71 55.53 1.72 16.92 coo 106.37 63.53 0.89 108.02 63.40 -1.62 53.15 0.69 27.47 54.83 -1.87 27.18 coo 100.93 69.04 4.38 99.52 68.48 2.09 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 6 3 # 6 B 137 GLY B 71 GLY^? 6.08 O1 EDO A 190 B 175 ARG A 35 ARG^? -3.68 C1 EDO A 190s B 242 TYR B 45 TYR^? 7.97 C2 EDO A 190 coo 99.45 58.28 3.33 99.57 58.61 4.10 50.84 2.27 -7.92 50.26 2.83 -8.18 coo 106.37 63.53 0.89 108.02 63.40 -1.62 49.65 12.45 -3.94 51.87 11.63 -5.97 coo 100.93 69.04 4.38 99.52 68.48 2.09 44.36 10.34 -9.27 42.37 11.49 -10.86 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 7 3 # 7 B 137 GLY B 119 GLY~? 6.97 O2 EDO B 193 B 175 ARG B 116 ARG~? 5.91 C2 EDO B 193 B 242 TYR B 155 TYR^? 6.08 O1 EDO B 193 coo 99.45 58.28 3.33 99.57 58.61 4.10 37.07 25.75 -37.87 36.45 25.24 -37.59 coo 106.37 63.53 0.89 108.02 63.40 -1.62 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 100.93 69.04 4.38 99.52 68.48 2.09 32.75 26.18 -29.08 34.17 27.29 -31.19 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 8 3 # 8 B 137 GLY B 119 GLY~? 6.97 O2 EDO B 193 B 175 ARG B 117 ARG~? 13.46 O2 EDO B 193 B 242 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 99.45 58.28 3.33 99.57 58.61 4.10 37.07 25.75 -37.87 36.45 25.24 -37.59 coo 106.37 63.53 0.89 108.02 63.40 -1.62 41.12 18.08 -35.59 38.25 17.08 -35.73 coo 100.93 69.04 4.38 99.52 68.48 2.09 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 9 3 # 9 B 137 GLY B 123 GLY.? 12.15 O1 EDO B 192 B 175 ARG B 125 ARG^? 12.90 O2 MPD B 194 B 242 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 99.45 58.28 3.33 99.57 58.61 4.10 25.82 28.20 -35.50 26.56 27.90 -35.68 coo 106.37 63.53 0.89 108.02 63.40 -1.62 24.74 19.51 -33.91 24.95 16.46 -33.56 coo 100.93 69.04 4.38 99.52 68.48 2.09 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 10 3 # 10 B 137 GLY B 123 GLY.? 12.15 O1 EDO B 192 B 175 ARG B 149 ARG^? 5.09 O2 EDO B 193 B 242 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 99.45 58.28 3.33 99.57 58.61 4.10 25.82 28.20 -35.50 26.56 27.90 -35.68 coo 106.37 63.53 0.89 108.02 63.40 -1.62 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 100.93 69.04 4.38 99.52 68.48 2.09 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 11 3 # 11 B 137 GLY B 175 GLY.? -3.40 C1 EDO B 193s B 175 ARG B 149 ARG^? 5.09 O2 EDO B 193 B 242 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 99.45 58.28 3.33 99.57 58.61 4.10 39.99 28.43 -27.51 40.50 28.66 -26.90 coo 106.37 63.53 0.89 108.02 63.40 -1.62 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 100.93 69.04 4.38 99.52 68.48 2.09 32.90 20.52 -29.81 34.48 19.65 -27.74 1xva_c03 source 1xva GLYCINE N-METHYLTRANSFERASE : 11 hits 1xva_c03 naa= 3 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 # 1 142 TRP A 53 TRP^? 14.51 C2 EDO A 189 223 ASP A 56 ASP.? 24.62 C2 EDO A 189 258 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 128.40 33.01 26.67 128.12 36.28 28.81 64.80 9.35 15.81 62.74 9.19 12.46 coo 127.91 41.73 23.55 129.18 40.35 24.44 66.73 9.65 23.28 68.51 8.93 24.16 coo 141.00 37.49 25.74 139.80 37.53 24.78 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 # 2 142 TRP A 57 TRP.? 17.86 O1 EDO B 190 223 ASP A 28 ASP.? 17.25 C2 EDO A 189 258 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo 128.40 33.01 26.67 128.12 36.28 28.81 63.65 6.46 19.13 61.56 6.28 15.80 coo 127.91 41.73 23.55 129.18 40.35 24.44 68.65 8.60 12.81 69.48 7.64 14.53 coo 141.00 37.49 25.74 139.80 37.53 24.78 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 3 3 # 3 142 TRP A 57 TRP.? 17.86 O1 EDO B 190 223 ASP A 28 ASP.? 17.25 C2 EDO A 189 258 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 128.40 33.01 26.67 128.12 36.28 28.81 63.65 6.46 19.13 61.56 6.28 15.80 coo 127.91 41.73 23.55 129.18 40.35 24.44 68.65 8.60 12.81 69.48 7.64 14.53 coo 141.00 37.49 25.74 139.80 37.53 24.78 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 4 3 # 4 142 TRP A 57 TRP.? 17.86 O1 EDO B 190 223 ASP A 54 ASP.? 20.27 C2 EDO A 189 258 ALA A 30 ALA^? 9.64 O2 EDO A 189 coo 128.40 33.01 26.67 128.12 36.28 28.81 63.65 6.46 19.13 61.56 6.28 15.80 coo 127.91 41.73 23.55 129.18 40.35 24.44 68.86 12.45 19.04 67.57 12.48 20.71 coo 141.00 37.49 25.74 139.80 37.53 24.78 61.95 9.56 7.70 60.62 9.31 8.43 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 5 3 # 5 142 TRP A 57 TRP.? 17.86 O1 EDO B 190 223 ASP A 54 ASP.? 20.27 C2 EDO A 189 258 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo 128.40 33.01 26.67 128.12 36.28 28.81 63.65 6.46 19.13 61.56 6.28 15.80 coo 127.91 41.73 23.55 129.18 40.35 24.44 68.86 12.45 19.04 67.57 12.48 20.71 coo 141.00 37.49 25.74 139.80 37.53 24.78 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 6 3 # 6 142 TRP A 57 TRP.? 17.86 O1 EDO B 190 223 ASP A 101 ASP^? 14.06 CM MPD A 191 258 ALA A 30 ALA^? 9.64 O2 EDO A 189 coo 128.40 33.01 26.67 128.12 36.28 28.81 63.65 6.46 19.13 61.56 6.28 15.80 coo 127.91 41.73 23.55 129.18 40.35 24.44 57.05 15.04 20.11 57.86 14.10 21.77 coo 141.00 37.49 25.74 139.80 37.53 24.78 61.95 9.56 7.70 60.62 9.31 8.43 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 7 3 # 7 142 TRP B 53 TRP^? 12.96 C2 EDO B 193 223 ASP B 56 ASP.? 14.25 C2 EDO B 193 258 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo 128.40 33.01 26.67 128.12 36.28 28.81 48.80 21.45 -31.66 49.10 21.58 -27.72 coo 127.91 41.73 23.55 129.18 40.35 24.44 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 141.00 37.49 25.74 139.80 37.53 24.78 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 8 3 # 8 142 TRP B 57 TRP.? 8.65 C2 EDO B 193 223 ASP B 28 ASP.? 13.72 O2 EDO B 189 258 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo 128.40 33.01 26.67 128.12 36.28 28.81 45.63 24.11 -33.85 46.13 24.49 -29.99 coo 127.91 41.73 23.55 129.18 40.35 24.44 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 141.00 37.49 25.74 139.80 37.53 24.78 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 9 3 # 9 142 TRP B 57 TRP.? 8.65 C2 EDO B 193 223 ASP B 54 ASP.? 15.81 C2 EDO B 193 258 ALA B 30 ALA^? 9.68 C2 EDO B 189 coo 128.40 33.01 26.67 128.12 36.28 28.81 45.63 24.11 -33.85 46.13 24.49 -29.99 coo 127.91 41.73 23.55 129.18 40.35 24.44 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 141.00 37.49 25.74 139.80 37.53 24.78 51.24 21.16 -23.43 49.76 21.37 -23.35 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 10 3 # 10 142 TRP B 57 TRP.? 8.65 C2 EDO B 193 223 ASP B 101 ASP^? 13.71 C2 EDO B 193 258 ALA B 30 ALA^? 9.68 C2 EDO B 189 coo 128.40 33.01 26.67 128.12 36.28 28.81 45.63 24.11 -33.85 46.13 24.49 -29.99 coo 127.91 41.73 23.55 129.18 40.35 24.44 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 141.00 37.49 25.74 139.80 37.53 24.78 51.24 21.16 -23.43 49.76 21.37 -23.35 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 10 hits 2aat_c01 naa= 3 ULMN 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 1 3 # 1 A 43 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 48 HIS A 76 HIS^? 9.12 O1 EDO A 189 A 77 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 13.04 30.41 72.50 12.95 30.65 70.36 63.41 29.58 11.55 64.59 31.41 11.51 coo 12.77 23.50 68.33 13.58 25.42 68.49 65.00 24.12 7.67 66.83 23.12 7.94 coo 7.53 29.84 65.06 12.29 29.41 67.79 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 2 3 # 2 A 43 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 48 HIS B 76 HIS^? 9.10 C1 EDO B 189 A 77 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 13.04 30.41 72.50 12.95 30.65 70.36 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 12.77 23.50 68.33 13.58 25.42 68.49 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 7.53 29.84 65.06 12.29 29.41 67.79 51.85 4.84 -17.64 57.80 3.80 -15.89 2acu_c01 source 2acu ALDOSE REDUCTASE (E.C.1.1.1.21) MUTANT WITH TY: 2 hits 2acu_c01 naa= 3 ULMN 3 2adm_c00 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 1 3 # 1 A 105 ASN A 111 ASN~? 7.14 CM MPD A 191 A 106 PRO A 108 PRO~? 10.47 CM MPD A 191 A 108 TYR A 180 TYR^? 6.78 CM MPD A 191 coo 34.91 38.94 20.48 33.53 38.20 19.00 50.97 8.64 17.05 49.29 9.91 16.73 coo 36.18 33.51 20.99 37.11 35.33 20.14 48.80 7.64 10.44 49.46 9.47 11.51 coo 33.01 33.46 15.68 31.96 34.97 17.80 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2adm_c00 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 2 3 # 2 A 105 ASN A 111 ASN~? 7.14 CM MPD A 191 A 106 PRO A 114 PRO~? 12.14 CM MPD A 191 A 108 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 34.91 38.94 20.48 33.53 38.20 19.00 50.97 8.64 17.05 49.29 9.91 16.73 coo 36.18 33.51 20.99 37.11 35.33 20.14 54.42 11.69 21.28 56.11 10.21 21.42 coo 33.01 33.46 15.68 31.96 34.97 17.80 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 2adm_c00 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 3 3 # 3 A 105 ASN B 111 ASN~? 7.23 CM MPD B 194 A 106 PRO B 108 PRO~? 10.40 CM MPD B 194 A 108 TYR B 180 TYR^? 6.70 CM MPD B 194 coo 34.91 38.94 20.48 33.53 38.20 19.00 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 36.18 33.51 20.99 37.11 35.33 20.14 39.31 22.65 -17.83 39.12 20.78 -19.01 coo 33.01 33.46 15.68 31.96 34.97 17.80 33.32 22.60 -18.62 32.30 20.35 -20.02 ULMN 3 2adm_c00 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 4 3 # 4 A 105 ASN B 111 ASN~? 7.23 CM MPD B 194 A 106 PRO B 114 PRO~? 10.61 C1 EDO B 193 A 108 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 34.91 38.94 20.48 33.53 38.20 19.00 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 36.18 33.51 20.99 37.11 35.33 20.14 37.28 18.71 -29.88 38.46 20.23 -30.98 coo 33.01 33.46 15.68 31.96 34.97 17.80 32.90 20.52 -29.81 34.48 19.65 -27.74 2adm_c00 source 2adm ADENINE-N6-DNA-METHYLTRANSFERASE TAQI : 4 hits 2adm_c00 naa= 3 ULMN 3 2adm_c01 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 1 3 # 1 B 105 ASN A 111 ASN~? 7.14 CM MPD A 191 B 106 PRO A 108 PRO~? 10.47 CM MPD A 191 B 108 TYR A 180 TYR^? 6.78 CM MPD A 191 coo 5.98 38.14 46.94 7.30 38.92 45.46 50.97 8.64 17.05 49.29 9.91 16.73 coo 4.66 43.53 47.47 3.74 41.73 46.59 48.80 7.64 10.44 49.46 9.47 11.51 coo 7.86 43.80 42.15 8.87 42.26 44.27 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2adm_c01 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 2 3 # 2 B 105 ASN A 111 ASN~? 7.14 CM MPD A 191 B 106 PRO A 114 PRO~? 12.14 CM MPD A 191 B 108 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 5.98 38.14 46.94 7.30 38.92 45.46 50.97 8.64 17.05 49.29 9.91 16.73 coo 4.66 43.53 47.47 3.74 41.73 46.59 54.42 11.69 21.28 56.11 10.21 21.42 coo 7.86 43.80 42.15 8.87 42.26 44.27 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 2adm_c01 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 3 3 # 3 B 105 ASN B 111 ASN~? 7.23 CM MPD B 194 B 106 PRO B 108 PRO~? 10.40 CM MPD B 194 B 108 TYR B 180 TYR^? 6.70 CM MPD B 194 coo 5.98 38.14 46.94 7.30 38.92 45.46 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 4.66 43.53 47.47 3.74 41.73 46.59 39.31 22.65 -17.83 39.12 20.78 -19.01 coo 7.86 43.80 42.15 8.87 42.26 44.27 33.32 22.60 -18.62 32.30 20.35 -20.02 ULMN 3 2adm_c01 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 4 3 # 4 B 105 ASN B 111 ASN~? 7.23 CM MPD B 194 B 106 PRO B 114 PRO~? 10.61 C1 EDO B 193 B 108 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 5.98 38.14 46.94 7.30 38.92 45.46 36.94 21.70 -24.36 35.87 20.37 -23.07 coo 4.66 43.53 47.47 3.74 41.73 46.59 37.28 18.71 -29.88 38.46 20.23 -30.98 coo 7.86 43.80 42.15 8.87 42.26 44.27 32.90 20.52 -29.81 34.48 19.65 -27.74 2adm_c01 source 2adm ADENINE-N6-DNA-METHYLTRANSFERASE TAQI : 4 hits 2adm_c01 naa= 3 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 65 HIS^? 6.20 C1 EDO A 189 B 50 GLU A 31 GLU^? -3.45 O2 EDO A 189s B 113 GLN A 46 GLN^? 7.01 C1 EDO A 190 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 61.87 12.13 2.43 62.94 11.86 0.64 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 52.63 15.98 -2.49 53.32 14.80 -4.13 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 50 GLU B 31 GLU^? -3.64 O2 EDO B 189s B 113 GLN B 46 GLN^? 7.98 C2 EDO A 190 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 50.22 14.36 -9.72 51.79 15.35 -8.77 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 65 HIS^? 6.20 C1 EDO A 189 B 50 GLU A 31 GLU^? -3.45 O2 EDO A 189s B 113 GLN A 46 GLN^? 7.01 C1 EDO A 190 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 61.87 12.13 2.43 62.94 11.86 0.64 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 52.63 15.98 -2.49 53.32 14.80 -4.13 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 50 GLU B 31 GLU^? -3.64 O2 EDO B 189s B 113 GLN B 46 GLN^? 7.98 C2 EDO A 190 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 50.22 14.36 -9.72 51.79 15.35 -8.77 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 65 HIS^? 6.20 C1 EDO A 189 A 50 GLU A 31 GLU^? -3.45 O2 EDO A 189s A 113 GLN A 46 GLN^? 7.01 C1 EDO A 190 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 61.87 12.13 2.43 62.94 11.86 0.64 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 52.63 15.98 -2.49 53.32 14.80 -4.13 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 2 3 # 2 A 29 HIS B 65 HIS^? -5.26 O1 EDO B 189s A 50 GLU B 31 GLU^? -3.64 O2 EDO B 189s A 113 GLN B 46 GLN^? 7.98 C2 EDO A 190 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 50.22 14.36 -9.72 51.79 15.35 -8.77 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 65 HIS^? 6.20 C1 EDO A 189 C 50 GLU A 31 GLU^? -3.45 O2 EDO A 189s C 113 GLN A 46 GLN^? 7.01 C1 EDO A 190 coo 74.92 8.52 28.42 74.88 6.86 29.70 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 65.25 15.95 28.73 65.73 15.63 30.78 61.87 12.13 2.43 62.94 11.86 0.64 coo 70.80 6.73 32.72 71.88 8.55 32.53 52.63 15.98 -2.49 53.32 14.80 -4.13 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 2 3 # 2 C 29 HIS B 65 HIS^? -5.26 O1 EDO B 189s C 50 GLU B 31 GLU^? -3.64 O2 EDO B 189s C 113 GLN B 46 GLN^? 7.98 C2 EDO A 190 coo 74.92 8.52 28.42 74.88 6.86 29.70 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 65.25 15.95 28.73 65.73 15.63 30.78 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 70.80 6.73 32.72 71.88 8.55 32.53 50.22 14.36 -9.72 51.79 15.35 -8.77 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 65 HIS^? 6.20 C1 EDO A 189 D 50 GLU A 31 GLU^? -3.45 O2 EDO A 189s D 113 GLN A 46 GLN^? 7.01 C1 EDO A 190 coo 38.66 11.31 27.15 38.67 12.13 25.22 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 48.72 12.85 33.83 48.36 14.77 32.95 61.87 12.13 2.43 62.94 11.86 0.64 coo 42.85 14.77 24.15 41.85 15.11 26.02 52.63 15.98 -2.49 53.32 14.80 -4.13 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 2 3 # 2 D 29 HIS B 65 HIS^? -5.26 O1 EDO B 189s D 50 GLU B 31 GLU^? -3.64 O2 EDO B 189s D 113 GLN B 46 GLN^? 7.98 C2 EDO A 190 coo 38.66 11.31 27.15 38.67 12.13 25.22 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 48.72 12.85 33.83 48.36 14.77 32.95 54.51 18.58 -19.03 56.60 18.34 -19.10 coo 42.85 14.77 24.15 41.85 15.11 26.02 50.22 14.36 -9.72 51.79 15.35 -8.77 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 4 ASP.? 9.87 O1 EDO A 188 231 ASP B 179 ASP^? 11.34 O2 EDO A 188 294 ASP B 27 ASP.? 13.66 O1 EDO A 188 coo 27.89 102.52 14.98 29.35 101.92 13.57 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 14.74 93.05 -1.00 14.30 94.22 0.73 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 33.16 106.80 7.72 33.34 104.87 6.92 53.38 27.15 -30.81 53.62 29.24 -30.55 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 # 2 193 ASP A 4 ASP.? 9.87 O1 EDO A 188 231 ASP B 179 ASP^? 11.34 O2 EDO A 188 294 ASP B 28 ASP.? 13.72 O2 EDO B 189 coo 27.89 102.52 14.98 29.35 101.92 13.57 55.32 27.50 -21.80 56.24 27.40 -19.90 coo 14.74 93.05 -1.00 14.30 94.22 0.73 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 33.16 106.80 7.72 33.34 104.87 6.92 53.65 22.40 -31.36 55.55 22.21 -30.45 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 # 3 193 ASP A 27 ASP.? 13.04 O1 EDO B 190 231 ASP A 103 ASP^? 5.49 CM MPD A 191 294 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 27.89 102.52 14.98 29.35 101.92 13.57 68.29 3.95 12.18 68.54 1.87 11.74 coo 14.74 93.05 -1.00 14.30 94.22 0.73 51.58 16.40 16.66 49.70 15.49 16.18 coo 33.16 106.80 7.72 33.34 104.87 6.92 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 4 3 # 4 193 ASP A 27 ASP.? 13.04 O1 EDO B 190 231 ASP A 179 ASP^? 16.86 CM MPD A 191 294 ASP B 4 ASP.? -7.27 O2 EDO B 190s coo 27.89 102.52 14.98 29.35 101.92 13.57 68.29 3.95 12.18 68.54 1.87 11.74 coo 14.74 93.05 -1.00 14.30 94.22 0.73 43.85 0.70 13.63 43.61 -0.87 12.28 coo 33.16 106.80 7.72 33.34 104.87 6.92 64.75 2.11 3.69 66.46 3.28 4.11 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 5 3 # 5 193 ASP A 28 ASP.? 17.25 C2 EDO A 189 231 ASP A 87 ASP^? 16.43 O1 EDO A 189 294 ASP A 56 ASP.? 24.62 C2 EDO A 189 coo 27.89 102.52 14.98 29.35 101.92 13.57 68.65 8.60 12.81 69.48 7.64 14.53 coo 14.74 93.05 -1.00 14.30 94.22 0.73 63.41 29.58 11.55 64.59 31.41 11.51 coo 33.16 106.80 7.72 33.34 104.87 6.92 66.73 9.65 23.28 68.51 8.93 24.16 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 6 3 # 6 193 ASP A 54 ASP.? 20.27 C2 EDO A 189 231 ASP A 48 ASP^? -5.54 C1 EDO A 189s 294 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 27.89 102.52 14.98 29.35 101.92 13.57 68.86 12.45 19.04 67.57 12.48 20.71 coo 14.74 93.05 -1.00 14.30 94.22 0.73 57.58 16.65 0.08 56.71 16.10 -1.78 coo 33.16 106.80 7.72 33.34 104.87 6.92 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 7 3 # 7 193 ASP A 101 ASP^? 14.06 CM MPD A 191 231 ASP A 151 ASP^? 20.35 CM MPD A 191 294 ASP A 56 ASP.? 24.62 C2 EDO A 189 coo 27.89 102.52 14.98 29.35 101.92 13.57 57.05 15.04 20.11 57.86 14.10 21.77 coo 14.74 93.05 -1.00 14.30 94.22 0.73 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 33.16 106.80 7.72 33.34 104.87 6.92 66.73 9.65 23.28 68.51 8.93 24.16 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 8 3 # 8 193 ASP A 172 ASP.? 13.07 O1 EDO B 190 231 ASP A 48 ASP^? -5.54 C1 EDO A 189s 294 ASP A 179 ASP^? 16.86 CM MPD A 191 coo 27.89 102.52 14.98 29.35 101.92 13.57 53.63 -2.61 14.65 54.96 -1.14 13.93 coo 14.74 93.05 -1.00 14.30 94.22 0.73 57.58 16.65 0.08 56.71 16.10 -1.78 coo 33.16 106.80 7.72 33.34 104.87 6.92 43.85 0.70 13.63 43.61 -0.87 12.28 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 9 3 # 9 193 ASP B 4 ASP.? -7.27 O2 EDO B 190s 231 ASP A 179 ASP^? 16.86 CM MPD A 191 294 ASP A 27 ASP.? 13.04 O1 EDO B 190 coo 27.89 102.52 14.98 29.35 101.92 13.57 64.75 2.11 3.69 66.46 3.28 4.11 coo 14.74 93.05 -1.00 14.30 94.22 0.73 43.85 0.70 13.63 43.61 -0.87 12.28 coo 33.16 106.80 7.72 33.34 104.87 6.92 68.29 3.95 12.18 68.54 1.87 11.74 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 10 3 # 10 193 ASP B 4 ASP.? -7.27 O2 EDO B 190s 231 ASP A 179 ASP^? 16.86 CM MPD A 191 294 ASP A 28 ASP.? 17.25 C2 EDO A 189 coo 27.89 102.52 14.98 29.35 101.92 13.57 64.75 2.11 3.69 66.46 3.28 4.11 coo 14.74 93.05 -1.00 14.30 94.22 0.73 43.85 0.70 13.63 43.61 -0.87 12.28 coo 33.16 106.80 7.72 33.34 104.87 6.92 68.65 8.60 12.81 69.48 7.64 14.53 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 11 3 # 11 193 ASP B 27 ASP.? 13.66 O1 EDO A 188 231 ASP B 179 ASP^? 11.34 O2 EDO A 188 294 ASP A 4 ASP.? 9.87 O1 EDO A 188 coo 27.89 102.52 14.98 29.35 101.92 13.57 53.38 27.15 -30.81 53.62 29.24 -30.55 coo 14.74 93.05 -1.00 14.30 94.22 0.73 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 33.16 106.80 7.72 33.34 104.87 6.92 55.32 27.50 -21.80 56.24 27.40 -19.90 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 12 3 # 12 193 ASP B 28 ASP.? 13.72 O2 EDO B 189 231 ASP B 87 ASP^? 16.44 C1 EDO B 189 294 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo 27.89 102.52 14.98 29.35 101.92 13.57 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 14.74 93.05 -1.00 14.30 94.22 0.73 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 33.16 106.80 7.72 33.34 104.87 6.92 45.79 20.82 -38.80 46.38 21.52 -40.72 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 13 3 # 13 193 ASP B 28 ASP.? 13.72 O2 EDO B 189 231 ASP B 89 ASP.? 15.59 O1 EDO B 189 294 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo 27.89 102.52 14.98 29.35 101.92 13.57 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 14.74 93.05 -1.00 14.30 94.22 0.73 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo 33.16 106.80 7.72 33.34 104.87 6.92 45.79 20.82 -38.80 46.38 21.52 -40.72 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 14 3 # 14 193 ASP B 54 ASP.? 15.81 C2 EDO B 193 231 ASP B 48 ASP^? 5.72 O1 EDO B 189 294 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 27.89 102.52 14.98 29.35 101.92 13.57 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 14.74 93.05 -1.00 14.30 94.22 0.73 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 33.16 106.80 7.72 33.34 104.87 6.92 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 15 3 # 15 193 ASP B 101 ASP^? 13.71 C2 EDO B 193 231 ASP B 89 ASP.? 15.59 O1 EDO B 189 294 ASP B 56 ASP.? 14.25 C2 EDO B 193 coo 27.89 102.52 14.98 29.35 101.92 13.57 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 14.74 93.05 -1.00 14.30 94.22 0.73 55.99 -0.94 -28.08 56.69 -0.70 -26.11 coo 33.16 106.80 7.72 33.34 104.87 6.92 45.79 20.82 -38.80 46.38 21.52 -40.72 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 16 3 # 16 193 ASP B 172 ASP.? 7.16 C1 EDO B 193 231 ASP B 48 ASP^? 5.72 O1 EDO B 189 294 ASP B 179 ASP^? 11.34 O2 EDO A 188 coo 27.89 102.52 14.98 29.35 101.92 13.57 40.45 32.96 -23.62 41.93 31.48 -23.99 coo 14.74 93.05 -1.00 14.30 94.22 0.73 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 33.16 106.80 7.72 33.34 104.87 6.92 33.06 29.40 -17.37 33.45 31.08 -16.20 2amg_c06 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 16 hits 2amg_c06 naa= 3 ULMN 3 2apr_c04 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 1 3 # 1 35 ASP A 151 ASP^? 20.35 CM MPD A 191 38 SER A 153 SER.? 20.01 CM MPD A 191 218 ASP A 122 ASP.? 22.97 CM MPD A 191 coo 41.14 58.72 105.19 42.39 59.85 103.92 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 46.04 57.35 103.96 44.97 58.52 105.78 50.18 -2.46 21.39 48.57 -4.23 21.02 coo 41.33 60.20 97.63 42.00 60.96 99.49 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 2apr_c04 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 2 3 # 2 35 ASP B 151 ASP^? -3.26 O1 EDO B 192s 38 SER B 153 SER.? -3.11 C2 EDO B 192s 218 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo 41.14 58.72 105.19 42.39 59.85 103.92 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 46.04 57.35 103.96 44.97 58.52 105.78 33.75 32.64 -27.23 32.53 34.50 -26.24 coo 41.33 60.20 97.63 42.00 60.96 99.49 28.45 32.01 -35.99 29.78 33.29 -34.96 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 14 ARG.? 14.51 O2 EDO B 188 A 161 ASP B 38 ASP.? -2.58 O1 EDO B 191s A 174 TYR B 45 TYR^? 7.97 C2 EDO A 190 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 34.22 19.89 -3.86 35.36 22.47 -5.15 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 44.36 10.34 -9.27 42.37 11.49 -10.86 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 2 3 # 2 A 14 ARG A 14 ARG.? 14.51 O2 EDO B 188 A 161 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 174 TYR B 180 TYR^? 6.70 CM MPD B 194 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 34.22 19.89 -3.86 35.36 22.47 -5.15 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 33.32 22.60 -18.62 32.30 20.35 -20.02 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 3 3 # 3 A 14 ARG A 52 ARG^? 13.70 C2 EDO A 189 A 161 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 174 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 69.17 14.29 10.90 69.97 16.58 12.80 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 57.58 16.65 0.08 56.71 16.10 -1.78 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 4 3 # 4 A 14 ARG A 73 ARG^? 12.55 O1 EDO A 189 A 161 ASP A 103 ASP^? 5.49 CM MPD A 191 A 174 TYR A 132 TYR^? -3.92 O4 MPD A 191s coo 14.43 -13.26 8.40 11.75 -14.25 9.60 53.52 27.95 4.31 55.34 28.60 6.78 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 51.58 16.40 16.66 49.70 15.49 16.18 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 48.86 20.67 16.01 46.69 20.01 14.37 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 5 3 # 5 A 14 ARG A 116 ARG~? 15.92 O1 EDO B 190 A 161 ASP A 103 ASP^? 5.49 CM MPD A 191 A 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo 14.43 -13.26 8.40 11.75 -14.25 9.60 59.64 3.34 19.37 61.78 2.26 17.40 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 51.58 16.40 16.66 49.70 15.49 16.18 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 6 3 # 6 A 14 ARG A 116 ARG~? 15.92 O1 EDO B 190 A 161 ASP A 179 ASP^? 16.86 CM MPD A 191 A 174 TYR A 180 TYR^? 6.78 CM MPD A 191 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 59.64 3.34 19.37 61.78 2.26 17.40 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 43.85 0.70 13.63 43.61 -0.87 12.28 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 7 3 # 7 A 14 ARG A 144 ARG^? 11.59 O2 MPD A 191 A 161 ASP A 101 ASP^? 14.06 CM MPD A 191 A 174 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 48.95 22.48 28.26 46.62 21.31 29.92 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 57.05 15.04 20.11 57.86 14.10 21.77 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 8 3 # 8 A 14 ARG A 144 ARG^? 11.59 O2 MPD A 191 A 161 ASP A 103 ASP^? 5.49 CM MPD A 191 A 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo 14.43 -13.26 8.40 11.75 -14.25 9.60 48.95 22.48 28.26 46.62 21.31 29.92 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 51.58 16.40 16.66 49.70 15.49 16.18 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 9 3 # 9 A 14 ARG A 186 ARG^? 11.98 O1 EDO B 190 A 161 ASP A 103 ASP^? 5.49 CM MPD A 191 A 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo 14.43 -13.26 8.40 11.75 -14.25 9.60 51.29 1.08 9.05 52.68 -0.95 10.91 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 51.58 16.40 16.66 49.70 15.49 16.18 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 10 3 # 10 A 14 ARG B 14 ARG.? 10.57 O1 EDO B 191 A 161 ASP A 38 ASP.? 14.66 C5 MPD A 191 A 174 TYR A 45 TYR^? 11.90 O2 EDO A 190 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 36.61 9.98 2.38 38.30 7.40 2.59 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 42.66 22.43 1.00 42.54 24.24 2.16 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 47.53 19.92 0.67 46.95 18.68 3.19 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 11 3 # 11 A 14 ARG B 14 ARG.? 10.57 O1 EDO B 191 A 161 ASP A 179 ASP^? 16.86 CM MPD A 191 A 174 TYR A 180 TYR^? 6.78 CM MPD A 191 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 36.61 9.98 2.38 38.30 7.40 2.59 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 43.85 0.70 13.63 43.61 -0.87 12.28 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 12 3 # 12 A 14 ARG B 52 ARG^? 13.54 O2 EDO B 189 A 161 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 174 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 14.43 -13.26 8.40 11.75 -14.25 9.60 55.40 16.98 -30.43 55.13 14.61 -32.43 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 48.23 15.25 -19.35 46.43 17.40 -19.57 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 13 3 # 13 A 14 ARG B 116 ARG~? 5.91 C2 EDO B 193 A 161 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 174 TYR B 157 TYR^? -4.69 O2 MPD B 194s coo 14.43 -13.26 8.40 11.75 -14.25 9.60 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 30.68 18.93 -24.72 31.20 16.23 -24.55 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 14 3 # 14 A 14 ARG B 116 ARG~? 5.91 C2 EDO B 193 A 161 ASP B 179 ASP^? 11.34 O2 EDO A 188 A 174 TYR B 180 TYR^? 6.70 CM MPD B 194 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 42.21 27.31 -31.29 45.12 28.46 -31.33 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 33.32 22.60 -18.62 32.30 20.35 -20.02 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 15 3 # 15 A 14 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 161 ASP B 101 ASP^? 13.71 C2 EDO B 193 A 174 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 16 3 # 16 A 14 ARG B 144 ARG^? 12.29 O2 MPD B 194 A 161 ASP B 103 ASP^? 5.57 C5 MPD B 194 A 174 TYR B 157 TYR^? -4.69 O2 MPD B 194s coo 14.43 -13.26 8.40 11.75 -14.25 9.60 28.02 7.86 -31.66 25.29 9.13 -32.53 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 30.68 18.93 -24.72 31.20 16.23 -24.55 2c7v_c08 source 2c7v PTERIDINE REDUCTASE : 16 hits 2c7v_c08 naa= 3 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 1 3 # 1 B 14 ARG A 14 ARG.? 14.51 O2 EDO B 188 B 161 ASP B 38 ASP.? -2.58 O1 EDO B 191s B 174 TYR B 45 TYR^? 7.97 C2 EDO A 190 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 34.22 19.89 -3.86 35.36 22.47 -5.15 coo -14.86 10.19 8.14 -14.82 12.31 8.42 40.43 7.67 -6.71 39.74 5.84 -7.58 coo -21.46 12.70 8.53 -19.04 12.30 7.24 44.36 10.34 -9.27 42.37 11.49 -10.86 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 2 3 # 2 B 14 ARG A 14 ARG.? 14.51 O2 EDO B 188 B 161 ASP B 179 ASP^? 11.34 O2 EDO A 188 B 174 TYR B 180 TYR^? 6.70 CM MPD B 194 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 34.22 19.89 -3.86 35.36 22.47 -5.15 coo -14.86 10.19 8.14 -14.82 12.31 8.42 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -21.46 12.70 8.53 -19.04 12.30 7.24 33.32 22.60 -18.62 32.30 20.35 -20.02 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 3 3 # 3 B 14 ARG A 52 ARG^? 13.70 C2 EDO A 189 B 161 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 174 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 69.17 14.29 10.90 69.97 16.58 12.80 coo -14.86 10.19 8.14 -14.82 12.31 8.42 57.58 16.65 0.08 56.71 16.10 -1.78 coo -21.46 12.70 8.53 -19.04 12.30 7.24 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 4 3 # 4 B 14 ARG A 73 ARG^? 12.55 O1 EDO A 189 B 161 ASP A 103 ASP^? 5.49 CM MPD A 191 B 174 TYR A 132 TYR^? -3.92 O4 MPD A 191s coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 53.52 27.95 4.31 55.34 28.60 6.78 coo -14.86 10.19 8.14 -14.82 12.31 8.42 51.58 16.40 16.66 49.70 15.49 16.18 coo -21.46 12.70 8.53 -19.04 12.30 7.24 48.86 20.67 16.01 46.69 20.01 14.37 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 5 3 # 5 B 14 ARG A 116 ARG~? 15.92 O1 EDO B 190 B 161 ASP A 103 ASP^? 5.49 CM MPD A 191 B 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 59.64 3.34 19.37 61.78 2.26 17.40 coo -14.86 10.19 8.14 -14.82 12.31 8.42 51.58 16.40 16.66 49.70 15.49 16.18 coo -21.46 12.70 8.53 -19.04 12.30 7.24 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 6 3 # 6 B 14 ARG A 116 ARG~? 15.92 O1 EDO B 190 B 161 ASP A 179 ASP^? 16.86 CM MPD A 191 B 174 TYR A 180 TYR^? 6.78 CM MPD A 191 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 59.64 3.34 19.37 61.78 2.26 17.40 coo -14.86 10.19 8.14 -14.82 12.31 8.42 43.85 0.70 13.63 43.61 -0.87 12.28 coo -21.46 12.70 8.53 -19.04 12.30 7.24 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 7 3 # 7 B 14 ARG A 144 ARG^? 11.59 O2 MPD A 191 B 161 ASP A 101 ASP^? 14.06 CM MPD A 191 B 174 TYR A 147 TYR^? 9.49 CM MPD A 191 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 48.95 22.48 28.26 46.62 21.31 29.92 coo -14.86 10.19 8.14 -14.82 12.31 8.42 57.05 15.04 20.11 57.86 14.10 21.77 coo -21.46 12.70 8.53 -19.04 12.30 7.24 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 8 3 # 8 B 14 ARG A 144 ARG^? 11.59 O2 MPD A 191 B 161 ASP A 103 ASP^? 5.49 CM MPD A 191 B 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 48.95 22.48 28.26 46.62 21.31 29.92 coo -14.86 10.19 8.14 -14.82 12.31 8.42 51.58 16.40 16.66 49.70 15.49 16.18 coo -21.46 12.70 8.53 -19.04 12.30 7.24 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 9 3 # 9 B 14 ARG B 14 ARG.? 10.57 O1 EDO B 191 B 161 ASP A 38 ASP.? 14.66 C5 MPD A 191 B 174 TYR A 45 TYR^? 11.90 O2 EDO A 190 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 36.61 9.98 2.38 38.30 7.40 2.59 coo -14.86 10.19 8.14 -14.82 12.31 8.42 42.66 22.43 1.00 42.54 24.24 2.16 coo -21.46 12.70 8.53 -19.04 12.30 7.24 47.53 19.92 0.67 46.95 18.68 3.19 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 10 3 # 10 B 14 ARG B 14 ARG.? 10.57 O1 EDO B 191 B 161 ASP A 179 ASP^? 16.86 CM MPD A 191 B 174 TYR A 180 TYR^? 6.78 CM MPD A 191 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 36.61 9.98 2.38 38.30 7.40 2.59 coo -14.86 10.19 8.14 -14.82 12.31 8.42 43.85 0.70 13.63 43.61 -0.87 12.28 coo -21.46 12.70 8.53 -19.04 12.30 7.24 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 11 3 # 11 B 14 ARG B 52 ARG^? 13.54 O2 EDO B 189 B 161 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 174 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 55.40 16.98 -30.43 55.13 14.61 -32.43 coo -14.86 10.19 8.14 -14.82 12.31 8.42 52.60 14.13 -14.82 53.00 14.96 -12.94 coo -21.46 12.70 8.53 -19.04 12.30 7.24 48.23 15.25 -19.35 46.43 17.40 -19.57 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 12 3 # 12 B 14 ARG B 116 ARG~? 5.91 C2 EDO B 193 B 161 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 174 TYR B 157 TYR^? -4.69 O2 MPD B 194s coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 42.21 27.31 -31.29 45.12 28.46 -31.33 coo -14.86 10.19 8.14 -14.82 12.31 8.42 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -21.46 12.70 8.53 -19.04 12.30 7.24 30.68 18.93 -24.72 31.20 16.23 -24.55 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 13 3 # 13 B 14 ARG B 116 ARG~? 5.91 C2 EDO B 193 B 161 ASP B 179 ASP^? 11.34 O2 EDO A 188 B 174 TYR B 180 TYR^? 6.70 CM MPD B 194 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 42.21 27.31 -31.29 45.12 28.46 -31.33 coo -14.86 10.19 8.14 -14.82 12.31 8.42 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -21.46 12.70 8.53 -19.04 12.30 7.24 33.32 22.60 -18.62 32.30 20.35 -20.02 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 14 3 # 14 B 14 ARG B 144 ARG^? 12.29 O2 MPD B 194 B 161 ASP B 101 ASP^? 13.71 C2 EDO B 193 B 174 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 28.02 7.86 -31.66 25.29 9.13 -32.53 coo -14.86 10.19 8.14 -14.82 12.31 8.42 40.06 15.30 -30.43 39.63 16.39 -32.22 coo -21.46 12.70 8.53 -19.04 12.30 7.24 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 15 3 # 15 B 14 ARG B 144 ARG^? 12.29 O2 MPD B 194 B 161 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 174 TYR B 157 TYR^? -4.69 O2 MPD B 194s coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 28.02 7.86 -31.66 25.29 9.13 -32.53 coo -14.86 10.19 8.14 -14.82 12.31 8.42 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -21.46 12.70 8.53 -19.04 12.30 7.24 30.68 18.93 -24.72 31.20 16.23 -24.55 2c7v_c09 source 2c7v PTERIDINE REDUCTASE : 15 hits 2c7v_c09 naa= 3 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 1 3 # 1 C 14 ARG A 14 ARG.? 14.51 O2 EDO B 188 C 161 ASP B 38 ASP.? -2.58 O1 EDO B 191s C 174 TYR B 45 TYR^? 7.97 C2 EDO A 190 coo 2.84 19.43 40.34 1.59 20.35 37.65 34.22 19.89 -3.86 35.36 22.47 -5.15 coo -0.62 11.10 28.05 -0.65 13.15 27.46 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 5.94 13.28 27.17 3.53 13.05 28.58 44.36 10.34 -9.27 42.37 11.49 -10.86 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 2 3 # 2 C 14 ARG A 14 ARG.? 14.51 O2 EDO B 188 C 161 ASP B 179 ASP^? 11.34 O2 EDO A 188 C 174 TYR B 180 TYR^? 6.70 CM MPD B 194 coo 2.84 19.43 40.34 1.59 20.35 37.65 34.22 19.89 -3.86 35.36 22.47 -5.15 coo -0.62 11.10 28.05 -0.65 13.15 27.46 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 5.94 13.28 27.17 3.53 13.05 28.58 33.32 22.60 -18.62 32.30 20.35 -20.02 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 3 3 # 3 C 14 ARG A 52 ARG^? 13.70 C2 EDO A 189 C 161 ASP A 48 ASP^? -5.54 C1 EDO A 189s C 174 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo 2.84 19.43 40.34 1.59 20.35 37.65 69.17 14.29 10.90 69.97 16.58 12.80 coo -0.62 11.10 28.05 -0.65 13.15 27.46 57.58 16.65 0.08 56.71 16.10 -1.78 coo 5.94 13.28 27.17 3.53 13.05 28.58 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 4 3 # 4 C 14 ARG A 73 ARG^? 12.55 O1 EDO A 189 C 161 ASP A 103 ASP^? 5.49 CM MPD A 191 C 174 TYR A 132 TYR^? -3.92 O4 MPD A 191s coo 2.84 19.43 40.34 1.59 20.35 37.65 53.52 27.95 4.31 55.34 28.60 6.78 coo -0.62 11.10 28.05 -0.65 13.15 27.46 51.58 16.40 16.66 49.70 15.49 16.18 coo 5.94 13.28 27.17 3.53 13.05 28.58 48.86 20.67 16.01 46.69 20.01 14.37 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 5 3 # 5 C 14 ARG A 116 ARG~? 15.92 O1 EDO B 190 C 161 ASP A 103 ASP^? 5.49 CM MPD A 191 C 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo 2.84 19.43 40.34 1.59 20.35 37.65 59.64 3.34 19.37 61.78 2.26 17.40 coo -0.62 11.10 28.05 -0.65 13.15 27.46 51.58 16.40 16.66 49.70 15.49 16.18 coo 5.94 13.28 27.17 3.53 13.05 28.58 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 6 3 # 6 C 14 ARG A 116 ARG~? 15.92 O1 EDO B 190 C 161 ASP A 179 ASP^? 16.86 CM MPD A 191 C 174 TYR A 180 TYR^? 6.78 CM MPD A 191 coo 2.84 19.43 40.34 1.59 20.35 37.65 59.64 3.34 19.37 61.78 2.26 17.40 coo -0.62 11.10 28.05 -0.65 13.15 27.46 43.85 0.70 13.63 43.61 -0.87 12.28 coo 5.94 13.28 27.17 3.53 13.05 28.58 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 7 3 # 7 C 14 ARG A 144 ARG^? 11.59 O2 MPD A 191 C 161 ASP A 101 ASP^? 14.06 CM MPD A 191 C 174 TYR A 147 TYR^? 9.49 CM MPD A 191 coo 2.84 19.43 40.34 1.59 20.35 37.65 48.95 22.48 28.26 46.62 21.31 29.92 coo -0.62 11.10 28.05 -0.65 13.15 27.46 57.05 15.04 20.11 57.86 14.10 21.77 coo 5.94 13.28 27.17 3.53 13.05 28.58 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 8 3 # 8 C 14 ARG A 144 ARG^? 11.59 O2 MPD A 191 C 161 ASP A 103 ASP^? 5.49 CM MPD A 191 C 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo 2.84 19.43 40.34 1.59 20.35 37.65 48.95 22.48 28.26 46.62 21.31 29.92 coo -0.62 11.10 28.05 -0.65 13.15 27.46 51.58 16.40 16.66 49.70 15.49 16.18 coo 5.94 13.28 27.17 3.53 13.05 28.58 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 9 3 # 9 C 14 ARG A 149 ARG^? 22.01 CM MPD A 191 C 161 ASP A 179 ASP^? 16.86 CM MPD A 191 C 174 TYR A 180 TYR^? 6.78 CM MPD A 191 coo 2.84 19.43 40.34 1.59 20.35 37.65 53.15 0.69 27.47 54.83 -1.87 27.18 coo -0.62 11.10 28.05 -0.65 13.15 27.46 43.85 0.70 13.63 43.61 -0.87 12.28 coo 5.94 13.28 27.17 3.53 13.05 28.58 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 10 3 # 10 C 14 ARG A 186 ARG^? 11.98 O1 EDO B 190 C 161 ASP A 103 ASP^? 5.49 CM MPD A 191 C 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo 2.84 19.43 40.34 1.59 20.35 37.65 51.29 1.08 9.05 52.68 -0.95 10.91 coo -0.62 11.10 28.05 -0.65 13.15 27.46 51.58 16.40 16.66 49.70 15.49 16.18 coo 5.94 13.28 27.17 3.53 13.05 28.58 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 11 3 # 11 C 14 ARG B 14 ARG.? 10.57 O1 EDO B 191 C 161 ASP A 38 ASP.? 14.66 C5 MPD A 191 C 174 TYR A 45 TYR^? 11.90 O2 EDO A 190 coo 2.84 19.43 40.34 1.59 20.35 37.65 36.61 9.98 2.38 38.30 7.40 2.59 coo -0.62 11.10 28.05 -0.65 13.15 27.46 42.66 22.43 1.00 42.54 24.24 2.16 coo 5.94 13.28 27.17 3.53 13.05 28.58 47.53 19.92 0.67 46.95 18.68 3.19 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 12 3 # 12 C 14 ARG B 14 ARG.? 10.57 O1 EDO B 191 C 161 ASP A 179 ASP^? 16.86 CM MPD A 191 C 174 TYR A 180 TYR^? 6.78 CM MPD A 191 coo 2.84 19.43 40.34 1.59 20.35 37.65 36.61 9.98 2.38 38.30 7.40 2.59 coo -0.62 11.10 28.05 -0.65 13.15 27.46 43.85 0.70 13.63 43.61 -0.87 12.28 coo 5.94 13.28 27.17 3.53 13.05 28.58 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 13 3 # 13 C 14 ARG B 52 ARG^? 13.54 O2 EDO B 189 C 161 ASP B 48 ASP^? 5.72 O1 EDO B 189 C 174 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo 2.84 19.43 40.34 1.59 20.35 37.65 55.40 16.98 -30.43 55.13 14.61 -32.43 coo -0.62 11.10 28.05 -0.65 13.15 27.46 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 5.94 13.28 27.17 3.53 13.05 28.58 48.23 15.25 -19.35 46.43 17.40 -19.57 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 14 3 # 14 C 14 ARG B 116 ARG~? 5.91 C2 EDO B 193 C 161 ASP B 103 ASP^? 5.57 C5 MPD B 194 C 174 TYR B 157 TYR^? -4.69 O2 MPD B 194s coo 2.84 19.43 40.34 1.59 20.35 37.65 42.21 27.31 -31.29 45.12 28.46 -31.33 coo -0.62 11.10 28.05 -0.65 13.15 27.46 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 5.94 13.28 27.17 3.53 13.05 28.58 30.68 18.93 -24.72 31.20 16.23 -24.55 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 15 3 # 15 C 14 ARG B 116 ARG~? 5.91 C2 EDO B 193 C 161 ASP B 179 ASP^? 11.34 O2 EDO A 188 C 174 TYR B 180 TYR^? 6.70 CM MPD B 194 coo 2.84 19.43 40.34 1.59 20.35 37.65 42.21 27.31 -31.29 45.12 28.46 -31.33 coo -0.62 11.10 28.05 -0.65 13.15 27.46 33.06 29.40 -17.37 33.45 31.08 -16.20 coo 5.94 13.28 27.17 3.53 13.05 28.58 33.32 22.60 -18.62 32.30 20.35 -20.02 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 16 3 # 16 C 14 ARG B 144 ARG^? 12.29 O2 MPD B 194 C 161 ASP B 101 ASP^? 13.71 C2 EDO B 193 C 174 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo 2.84 19.43 40.34 1.59 20.35 37.65 28.02 7.86 -31.66 25.29 9.13 -32.53 coo -0.62 11.10 28.05 -0.65 13.15 27.46 40.06 15.30 -30.43 39.63 16.39 -32.22 coo 5.94 13.28 27.17 3.53 13.05 28.58 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 17 3 # 17 C 14 ARG B 144 ARG^? 12.29 O2 MPD B 194 C 161 ASP B 103 ASP^? 5.57 C5 MPD B 194 C 174 TYR B 157 TYR^? -4.69 O2 MPD B 194s coo 2.84 19.43 40.34 1.59 20.35 37.65 28.02 7.86 -31.66 25.29 9.13 -32.53 coo -0.62 11.10 28.05 -0.65 13.15 27.46 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 5.94 13.28 27.17 3.53 13.05 28.58 30.68 18.93 -24.72 31.20 16.23 -24.55 2c7v_c10 source 2c7v PTERIDINE REDUCTASE : 17 hits 2c7v_c10 naa= 3 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 1 3 # 1 D 14 ARG A 14 ARG.? 14.51 O2 EDO B 188 D 161 ASP B 38 ASP.? -2.58 O1 EDO B 191s D 174 TYR B 45 TYR^? 7.97 C2 EDO A 190 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 34.22 19.89 -3.86 35.36 22.47 -5.15 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 40.43 7.67 -6.71 39.74 5.84 -7.58 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 44.36 10.34 -9.27 42.37 11.49 -10.86 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 2 3 # 2 D 14 ARG A 14 ARG.? 14.51 O2 EDO B 188 D 161 ASP B 179 ASP^? 11.34 O2 EDO A 188 D 174 TYR B 180 TYR^? 6.70 CM MPD B 194 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 34.22 19.89 -3.86 35.36 22.47 -5.15 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 33.32 22.60 -18.62 32.30 20.35 -20.02 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 3 3 # 3 D 14 ARG A 52 ARG^? 13.70 C2 EDO A 189 D 161 ASP A 48 ASP^? -5.54 C1 EDO A 189s D 174 TYR A 49 TYR^? 7.66 O1 EDO A 189 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 69.17 14.29 10.90 69.97 16.58 12.80 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 57.58 16.65 0.08 56.71 16.10 -1.78 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 56.86 15.30 6.36 55.58 13.13 7.63 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 4 3 # 4 D 14 ARG A 73 ARG^? 12.55 O1 EDO A 189 D 161 ASP A 103 ASP^? 5.49 CM MPD A 191 D 174 TYR A 132 TYR^? -3.92 O4 MPD A 191s coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 53.52 27.95 4.31 55.34 28.60 6.78 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 51.58 16.40 16.66 49.70 15.49 16.18 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 48.86 20.67 16.01 46.69 20.01 14.37 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 5 3 # 5 D 14 ARG A 116 ARG~? 15.92 O1 EDO B 190 D 161 ASP A 103 ASP^? 5.49 CM MPD A 191 D 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 59.64 3.34 19.37 61.78 2.26 17.40 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 51.58 16.40 16.66 49.70 15.49 16.18 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 6 3 # 6 D 14 ARG A 116 ARG~? 15.92 O1 EDO B 190 D 161 ASP A 179 ASP^? 16.86 CM MPD A 191 D 174 TYR A 180 TYR^? 6.78 CM MPD A 191 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 59.64 3.34 19.37 61.78 2.26 17.40 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 43.85 0.70 13.63 43.61 -0.87 12.28 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 7 3 # 7 D 14 ARG A 144 ARG^? 11.59 O2 MPD A 191 D 161 ASP A 101 ASP^? 14.06 CM MPD A 191 D 174 TYR A 147 TYR^? 9.49 CM MPD A 191 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 48.95 22.48 28.26 46.62 21.31 29.92 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 57.05 15.04 20.11 57.86 14.10 21.77 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 50.88 9.76 23.94 51.01 10.64 21.28 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 8 3 # 8 D 14 ARG A 144 ARG^? 11.59 O2 MPD A 191 D 161 ASP A 103 ASP^? 5.49 CM MPD A 191 D 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 48.95 22.48 28.26 46.62 21.31 29.92 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 51.58 16.40 16.66 49.70 15.49 16.18 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 9 3 # 9 D 14 ARG A 186 ARG^? 11.98 O1 EDO B 190 D 161 ASP A 103 ASP^? 5.49 CM MPD A 191 D 174 TYR A 157 TYR^? -4.51 CM MPD A 191s coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 51.29 1.08 9.05 52.68 -0.95 10.91 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 51.58 16.40 16.66 49.70 15.49 16.18 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 46.12 11.16 21.21 46.22 13.94 20.83 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 10 3 # 10 D 14 ARG B 14 ARG.? 10.57 O1 EDO B 191 D 161 ASP A 38 ASP.? 14.66 C5 MPD A 191 D 174 TYR A 45 TYR^? 11.90 O2 EDO A 190 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 36.61 9.98 2.38 38.30 7.40 2.59 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 42.66 22.43 1.00 42.54 24.24 2.16 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 47.53 19.92 0.67 46.95 18.68 3.19 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 11 3 # 11 D 14 ARG B 14 ARG.? 10.57 O1 EDO B 191 D 161 ASP A 179 ASP^? 16.86 CM MPD A 191 D 174 TYR A 180 TYR^? 6.78 CM MPD A 191 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 36.61 9.98 2.38 38.30 7.40 2.59 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 43.85 0.70 13.63 43.61 -0.87 12.28 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 44.70 7.55 14.68 44.63 9.72 16.45 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 12 3 # 12 D 14 ARG B 52 ARG^? 13.54 O2 EDO B 189 D 161 ASP B 48 ASP^? 5.72 O1 EDO B 189 D 174 TYR B 49 TYR^? -7.47 C2 EDO B 189s coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 55.40 16.98 -30.43 55.13 14.61 -32.43 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 52.60 14.13 -14.82 53.00 14.96 -12.94 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 48.23 15.25 -19.35 46.43 17.40 -19.57 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 13 3 # 13 D 14 ARG B 116 ARG~? 5.91 C2 EDO B 193 D 161 ASP B 103 ASP^? 5.57 C5 MPD B 194 D 174 TYR B 157 TYR^? -4.69 O2 MPD B 194s coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 42.21 27.31 -31.29 45.12 28.46 -31.33 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 30.68 18.93 -24.72 31.20 16.23 -24.55 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 14 3 # 14 D 14 ARG B 116 ARG~? 5.91 C2 EDO B 193 D 161 ASP B 179 ASP^? 11.34 O2 EDO A 188 D 174 TYR B 180 TYR^? 6.70 CM MPD B 194 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 42.21 27.31 -31.29 45.12 28.46 -31.33 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 33.32 22.60 -18.62 32.30 20.35 -20.02 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 15 3 # 15 D 14 ARG B 144 ARG^? 12.29 O2 MPD B 194 D 161 ASP B 101 ASP^? 13.71 C2 EDO B 193 D 174 TYR B 147 TYR^? 9.73 O2 MPD B 194 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 28.02 7.86 -31.66 25.29 9.13 -32.53 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 40.06 15.30 -30.43 39.63 16.39 -32.22 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 32.90 20.52 -29.81 34.48 19.65 -27.74 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 16 3 # 16 D 14 ARG B 144 ARG^? 12.29 O2 MPD B 194 D 161 ASP B 103 ASP^? 5.57 C5 MPD B 194 D 174 TYR B 157 TYR^? -4.69 O2 MPD B 194s coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 28.02 7.86 -31.66 25.29 9.13 -32.53 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 30.68 18.93 -24.72 31.20 16.23 -24.55 2c7v_c11 source 2c7v PTERIDINE REDUCTASE : 16 hits 2c7v_c11 naa= 3 ULMN 3 2dbt_c00 CHITINASE C user 1 3 # 1 A 147 GLU B 158 GLU^? 10.92 O2 MPD B 194 A 156 GLU B 127 GLU^? 12.59 O2 MPD B 194 A 194 ASN B 111 ASN~? 7.23 CM MPD B 194 coo 74.14 15.91 8.55 72.08 15.36 8.63 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 67.47 20.07 1.34 65.99 20.06 2.88 29.39 12.97 -34.29 27.94 11.43 -34.46 coo 67.44 25.26 13.91 67.54 23.65 15.28 36.94 21.70 -24.36 35.87 20.37 -23.07 2dbt_c00 source 2dbt CHITINASE C : 1 hits 2dbt_c00 naa= 3 ULMN 3 2dbt_c02 CHITINASE C user 1 3 # 1 C 147 GLU A 158 GLU^? 10.31 O2 MPD A 191 C 156 GLU A 127 GLU^? 13.22 O2 MPD A 191 C 194 ASN A 111 ASN~? 7.14 CM MPD A 191 coo 41.23 29.31 13.28 43.03 29.85 12.29 43.36 11.29 26.55 43.12 11.25 28.63 coo 44.75 23.09 5.51 46.77 22.91 6.12 49.68 14.95 31.31 48.32 16.27 32.27 coo 49.75 21.00 18.12 50.45 23.02 18.26 50.97 8.64 17.05 49.29 9.91 16.73 ULMN 3 2dbt_c02 CHITINASE C user 2 3 # 2 C 147 GLU B 158 GLU^? 10.92 O2 MPD B 194 C 156 GLU B 127 GLU^? 12.59 O2 MPD B 194 C 194 ASN B 111 ASN~? 7.23 CM MPD B 194 coo 41.23 29.31 13.28 43.03 29.85 12.29 25.38 18.84 -27.67 24.06 18.79 -29.34 coo 44.75 23.09 5.51 46.77 22.91 6.12 29.39 12.97 -34.29 27.94 11.43 -34.46 coo 49.75 21.00 18.12 50.45 23.02 18.26 36.94 21.70 -24.36 35.87 20.37 -23.07 2dbt_c02 source 2dbt CHITINASE C : 2 hits 2dbt_c02 naa= 3 ULMN 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 157 PHE A 96 PHE~? 14.81 O4 MPD A 191 A 245 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 273 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 9.49 9.24 -34.27 7.12 7.86 -33.75 57.59 26.72 18.48 56.37 27.80 16.21 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 63.41 29.58 11.55 64.59 31.41 11.51 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 58.34 25.75 2.84 62.12 26.28 -2.26 ULMN 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 2 3 # 2 A 157 PHE A 113 PHE~? 14.88 O1 EDO A 189 A 245 ASP A 103 ASP^? 5.49 CM MPD A 191 A 273 LYS A 166 LYS^? 9.67 O2 MPD A 191 coo 9.49 9.24 -34.27 7.12 7.86 -33.75 58.33 11.41 16.78 59.51 11.35 14.22 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 51.58 16.40 16.66 49.70 15.49 16.18 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 40.42 10.96 22.74 39.85 13.02 27.76 ULMN 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 3 3 # 3 A 157 PHE B 96 PHE~? 15.57 O4 MPD B 194 A 245 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 273 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 9.49 9.24 -34.27 7.12 7.86 -33.75 42.14 3.81 -29.42 42.55 2.56 -26.95 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 51.85 4.84 -17.64 57.80 3.80 -15.89 2gsa_c04 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 3 hits 2gsa_c04 naa= 3 ULMN 3 2jxr_c04 LIGAND CP-081282 user 1 3 # 1 A 32 ASP A 151 ASP^? 20.35 CM MPD A 191 A 35 SER A 153 SER.? 20.01 CM MPD A 191 A 215 ASP A 122 ASP.? 22.97 CM MPD A 191 coo -14.00 61.45 43.99 -14.19 63.14 42.84 48.38 -3.74 26.58 47.39 -3.82 24.70 coo -13.21 66.21 45.84 -15.49 65.90 45.84 50.18 -2.46 21.39 48.57 -4.23 21.02 coo -10.72 64.19 37.77 -12.20 64.43 39.15 51.13 -1.78 31.54 51.32 -3.14 29.91 ULMN 3 2jxr_c04 LIGAND CP-081282 user 2 3 # 2 A 32 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 35 SER B 153 SER.? -3.11 C2 EDO B 192s A 215 ASP B 122 ASP.? 7.15 O2 EDO B 192 coo -14.00 61.45 43.99 -14.19 63.14 42.84 29.45 33.81 -30.55 29.73 34.07 -28.42 coo -13.21 66.21 45.84 -15.49 65.90 45.84 33.75 32.64 -27.23 32.53 34.50 -26.24 coo -10.72 64.19 37.77 -12.20 64.43 39.15 28.45 32.01 -35.99 29.78 33.29 -34.96 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 A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 14.96 29.22 19.55 15.62 29.93 17.67 64.74 13.84 22.58 64.60 13.48 24.65 coo 19.64 30.69 22.61 18.18 29.94 21.25 68.86 12.45 19.04 67.57 12.48 20.71 coo 14.54 28.99 9.76 15.06 29.59 10.02 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 2 3 # 2 A 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 14.96 29.22 19.55 15.62 29.93 17.67 64.74 13.84 22.58 64.60 13.48 24.65 coo 19.64 30.69 22.61 18.18 29.94 21.25 68.86 12.45 19.04 67.57 12.48 20.71 coo 14.54 28.99 9.76 15.06 29.59 10.02 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 3 3 # 3 A 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 193 GLY A 83 GLY.? 19.80 C3 MPD A 191 coo 14.96 29.22 19.55 15.62 29.93 17.67 64.74 13.84 22.58 64.60 13.48 24.65 coo 19.64 30.69 22.61 18.18 29.94 21.25 66.73 9.65 23.28 68.51 8.93 24.16 coo 14.54 28.99 9.76 15.06 29.59 10.02 62.79 21.97 24.03 63.48 22.23 23.74 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 4 3 # 4 A 57 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 102 ASP A 56 ASP.? 24.62 C2 EDO A 189 A 193 GLY A 98 GLY.? 17.64 O2 MPD A 191 coo 14.96 29.22 19.55 15.62 29.93 17.67 64.74 13.84 22.58 64.60 13.48 24.65 coo 19.64 30.69 22.61 18.18 29.94 21.25 66.73 9.65 23.28 68.51 8.93 24.16 coo 14.54 28.99 9.76 15.06 29.59 10.02 59.27 22.98 25.86 59.28 23.02 25.07 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 5 3 # 5 A 57 HIS A 65 HIS^? 6.20 C1 EDO A 189 A 102 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 193 GLY A 71 GLY^? 15.15 O2 EDO A 188 coo 14.96 29.22 19.55 15.62 29.93 17.67 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 19.64 30.69 22.61 18.18 29.94 21.25 57.58 16.65 0.08 56.71 16.10 -1.78 coo 14.54 28.99 9.76 15.06 29.59 10.02 51.64 28.27 -4.12 51.34 27.67 -3.59 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 6 3 # 6 A 57 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 102 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 193 GLY A 81 GLY.? 20.02 O1 EDO A 189 coo 14.96 29.22 19.55 15.62 29.93 17.67 65.85 25.32 24.26 66.00 24.92 26.31 coo 19.64 30.69 22.61 18.18 29.94 21.25 60.01 27.52 25.19 61.63 28.83 24.67 coo 14.54 28.99 9.76 15.06 29.59 10.02 66.26 17.90 21.72 66.27 18.63 22.08 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 7 3 # 7 A 57 HIS A 154 HIS^? 17.90 CM MPD A 191 A 102 ASP A 151 ASP^? 20.35 CM MPD A 191 A 193 GLY A 175 GLY.? 16.97 O1 EDO B 190 coo 14.96 29.22 19.55 15.62 29.93 17.67 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 19.64 30.69 22.61 18.18 29.94 21.25 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 14.54 28.99 9.76 15.06 29.59 10.02 55.47 1.95 17.71 55.53 1.72 16.92 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 8 3 # 8 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 14.96 29.22 19.55 15.62 29.93 17.67 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 19.64 30.69 22.61 18.18 29.94 21.25 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 14.54 28.99 9.76 15.06 29.59 10.02 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 9 3 # 9 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 14.96 29.22 19.55 15.62 29.93 17.67 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 19.64 30.69 22.61 18.18 29.94 21.25 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 14.54 28.99 9.76 15.06 29.59 10.02 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 10 3 # 10 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 193 GLY B 119 GLY~? 6.97 O2 EDO B 193 coo 14.96 29.22 19.55 15.62 29.93 17.67 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 19.64 30.69 22.61 18.18 29.94 21.25 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 14.54 28.99 9.76 15.06 29.59 10.02 37.07 25.75 -37.87 36.45 25.24 -37.59 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 11 3 # 11 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 A 193 GLY B 83 GLY.? 19.88 O2 MPD B 194 coo 14.96 29.22 19.55 15.62 29.93 17.67 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 19.64 30.69 22.61 18.18 29.94 21.25 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 14.54 28.99 9.76 15.06 29.59 10.02 42.83 8.47 -37.13 43.54 8.24 -37.38 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 12 3 # 12 A 57 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 102 ASP B 56 ASP.? 14.25 C2 EDO B 193 A 193 GLY B 98 GLY.? 17.68 O2 MPD B 194 coo 14.96 29.22 19.55 15.62 29.93 17.67 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 19.64 30.69 22.61 18.18 29.94 21.25 45.79 20.82 -38.80 46.38 21.52 -40.72 coo 14.54 28.99 9.76 15.06 29.59 10.02 39.01 7.37 -36.59 39.44 7.37 -35.92 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 13 3 # 13 A 57 HIS B 65 HIS^? -5.26 O1 EDO B 189s A 102 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 193 GLY B 71 GLY^? 6.08 O1 EDO A 190 coo 14.96 29.22 19.55 15.62 29.93 17.67 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 19.64 30.69 22.61 18.18 29.94 21.25 52.60 14.13 -14.82 53.00 14.96 -12.94 coo 14.54 28.99 9.76 15.06 29.59 10.02 50.84 2.27 -7.92 50.26 2.83 -8.18 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 14 3 # 14 A 57 HIS B 154 HIS^? 5.27 C1 EDO B 192 A 102 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 193 GLY B 175 GLY.? -3.40 C1 EDO B 193s coo 14.96 29.22 19.55 15.62 29.93 17.67 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 19.64 30.69 22.61 18.18 29.94 21.25 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 14.54 28.99 9.76 15.06 29.59 10.02 39.99 28.43 -27.51 40.50 28.66 -26.90 2lpr_c02 source 2lpr ALPHA-LYTIC PROTEASE : 14 hits 2lpr_c02 naa= 3 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 177 PHE B 96 PHE~? 15.57 O4 MPD B 194 A 263 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 292 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 51.51 50.32 16.39 52.13 49.68 13.75 42.14 3.81 -29.42 42.55 2.56 -26.95 coo 54.43 44.82 23.74 55.21 45.06 21.80 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 63.95 45.30 16.71 59.11 49.15 16.05 51.85 4.84 -17.64 57.80 3.80 -15.89 2oat_c03 source 2oat ORNITHINE AMINOTRANSFERASE : 1 hits 2oat_c03 naa= 3 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 177 PHE B 96 PHE~? 15.57 O4 MPD B 194 C 263 ASP B 87 ASP^? 16.44 C1 EDO B 189 C 292 LYS B 74 LYS^? 9.11 O1 EDO B 189 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 42.14 3.81 -29.42 42.55 2.56 -26.95 coo 19.84 12.02 9.33 18.68 11.23 7.75 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 12.82 3.49 4.98 17.80 5.59 1.90 51.85 4.84 -17.64 57.80 3.80 -15.89 2oat_c05 source 2oat ORNITHINE AMINOTRANSFERASE : 1 hits 2oat_c05 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP A 103 ASP^? 5.49 CM MPD A 191 166 GLY B 11 GLY^? 10.76 O2 EDO A 190 169 GLU B 69 GLU.? -7.04 C2 EDO B 191s coo 8.28 6.87 1.62 10.08 5.77 1.34 51.58 16.40 16.66 49.70 15.49 16.18 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.76 8.31 5.72 42.56 7.67 5.25 coo -16.67 7.89 2.78 -17.65 6.56 1.49 46.74 3.18 -1.73 46.16 1.22 -2.29 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 # 2 141 ASP A 172 ASP.? 13.07 O1 EDO B 190 166 GLY B 11 GLY^? 10.76 O2 EDO A 190 169 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 8.28 6.87 1.62 10.08 5.77 1.34 53.63 -2.61 14.65 54.96 -1.14 13.93 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.76 8.31 5.72 42.56 7.67 5.25 coo -16.67 7.89 2.78 -17.65 6.56 1.49 40.24 18.97 5.60 41.21 18.63 7.48 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 # 3 141 ASP A 179 ASP^? 16.86 CM MPD A 191 166 GLY B 42 GLY.? 7.35 O1 EDO B 191 169 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo 8.28 6.87 1.62 10.08 5.77 1.34 43.85 0.70 13.63 43.61 -0.87 12.28 coo -8.58 13.22 3.21 -8.90 13.15 4.05 38.20 8.45 -1.85 38.82 8.13 -2.23 coo -16.67 7.89 2.78 -17.65 6.56 1.49 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 # 4 141 ASP B 87 ASP^? 16.44 C1 EDO B 189 166 GLY B 98 GLY.? 17.68 O2 MPD B 194 169 GLU B 127 GLU^? 12.59 O2 MPD B 194 coo 8.28 6.87 1.62 10.08 5.77 1.34 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo -8.58 13.22 3.21 -8.90 13.15 4.05 39.01 7.37 -36.59 39.44 7.37 -35.92 coo -16.67 7.89 2.78 -17.65 6.56 1.49 29.39 12.97 -34.29 27.94 11.43 -34.46 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 # 5 141 ASP B 103 ASP^? 5.57 C5 MPD B 194 166 GLY A 11 GLY^? 12.21 O2 EDO B 188 169 GLU A 69 GLU.? 15.47 O2 EDO A 188 coo 8.28 6.87 1.62 10.08 5.77 1.34 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -8.58 13.22 3.21 -8.90 13.15 4.05 37.21 21.76 -10.38 37.30 22.35 -9.86 coo -16.67 7.89 2.78 -17.65 6.56 1.49 44.88 26.70 -3.49 42.93 26.42 -2.77 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 # 6 141 ASP B 172 ASP.? 7.16 C1 EDO B 193 166 GLY A 11 GLY^? 12.21 O2 EDO B 188 169 GLU B 39 GLU.? -2.97 O2 EDO B 188s coo 8.28 6.87 1.62 10.08 5.77 1.34 40.45 32.96 -23.62 41.93 31.48 -23.99 coo -8.58 13.22 3.21 -8.90 13.15 4.05 37.21 21.76 -10.38 37.30 22.35 -9.86 coo -16.67 7.89 2.78 -17.65 6.56 1.49 35.53 10.88 -8.90 35.33 11.18 -11.01 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 # 7 141 ASP B 179 ASP^? 11.34 O2 EDO A 188 166 GLY A 42 GLY.? 16.43 O2 EDO A 190 169 GLU A 39 GLU.? 8.26 C5 MPD A 191 coo 8.28 6.87 1.62 10.08 5.77 1.34 33.06 29.40 -17.37 33.45 31.08 -16.20 coo -8.58 13.22 3.21 -8.90 13.15 4.05 38.18 21.47 -1.45 38.85 21.88 -1.59 coo -16.67 7.89 2.78 -17.65 6.56 1.49 40.24 18.97 5.60 41.21 18.63 7.48 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 7 hits 2tdt_c00 naa= 3 ULMN 3 2tps_c00 THIAMIN PHOSPHATE SYNTHASE user 1 3 # 1 A 59 ARG A 73 ARG^? 12.55 O1 EDO A 189 A 130 SER A 68 SER^? 14.83 O1 EDO A 189 A 159 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 18.35 45.84 20.99 16.20 47.83 21.89 53.52 27.95 4.31 55.34 28.60 6.78 coo 15.14 43.67 10.77 15.61 44.43 13.04 48.79 23.73 -3.35 48.63 25.48 -1.65 coo 11.57 48.49 22.18 13.51 49.99 17.21 58.34 25.75 2.84 62.12 26.28 -2.26 2tps_c00 source 2tps THIAMIN PHOSPHATE SYNTHASE : 1 hits 2tps_c00 naa= 3 ULMN 3 2tps_c01 THIAMIN PHOSPHATE SYNTHASE user 1 3 # 1 B 59 ARG A 73 ARG^? 12.55 O1 EDO A 189 B 130 SER A 68 SER^? 14.83 O1 EDO A 189 B 159 LYS A 74 LYS^? 9.41 O1 EDO A 189 coo 58.72 31.58 20.45 60.80 29.39 20.94 53.52 27.95 4.31 55.34 28.60 6.78 coo 61.66 35.17 10.39 61.29 34.14 12.56 48.79 23.73 -3.35 48.63 25.48 -1.65 coo 65.38 28.77 21.17 63.49 28.03 16.12 58.34 25.75 2.84 62.12 26.28 -2.26 2tps_c01 source 2tps THIAMIN PHOSPHATE SYNTHASE : 1 hits 2tps_c01 naa= 3 ULMN 3 2xis_c00 XYLOSE ISOMERASE (E.C.5.3.1.5) COMPLuser 1 3 # 1 183 LYS A 74 LYS^? 9.41 O1 EDO A 189 220 HIS A 65 HIS^? 6.20 C1 EDO A 189 255 ASP A 48 ASP^? -5.54 C1 EDO A 189s coo 11.94 40.77 50.56 7.67 36.15 49.76 58.34 25.75 2.84 62.12 26.28 -2.26 coo 10.50 40.09 46.76 10.54 37.99 46.56 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 4.47 38.05 47.65 5.63 36.87 46.50 57.58 16.65 0.08 56.71 16.10 -1.78 ULMN 3 2xis_c00 XYLOSE ISOMERASE (E.C.5.3.1.5) COMPLuser 2 3 # 2 183 LYS B 74 LYS^? 9.11 O1 EDO B 189 220 HIS B 65 HIS^? -5.26 O1 EDO B 189s 255 ASP B 48 ASP^? 5.72 O1 EDO B 189 coo 11.94 40.77 50.56 7.67 36.15 49.76 51.85 4.84 -17.64 57.80 3.80 -15.89 coo 10.50 40.09 46.76 10.54 37.99 46.56 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 4.47 38.05 47.65 5.63 36.87 46.50 52.60 14.13 -14.82 53.00 14.96 -12.94 2xis_c00 source 2xis XYLOSE ISOMERASE (E.C.5.3.1.5) COMPLEX WITH XY: 2 hits 2xis_c00 naa= 3 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 1 3 # 1 18 ARG A 60 ARG^? 18.80 O1 EDO A 189 195 HIS A 84 HIS.? 23.86 O4 MPD A 191 199 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 21.96 2.03 15.24 19.33 1.86 13.55 67.94 16.79 18.42 70.70 18.25 18.48 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 65.85 25.32 24.26 66.00 24.92 26.31 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 2 3 # 2 18 ARG A 149 ARG^? 22.01 CM MPD A 191 195 HIS A 154 HIS^? 17.90 CM MPD A 191 199 ASP A 151 ASP^? 20.35 CM MPD A 191 coo 21.96 2.03 15.24 19.33 1.86 13.55 53.15 0.69 27.47 54.83 -1.87 27.18 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 45.67 -1.54 22.26 44.90 -3.17 21.19 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 48.38 -3.74 26.58 47.39 -3.82 24.70 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 3 3 # 3 18 ARG B 60 ARG^? 18.79 C1 EDO B 189 195 HIS B 84 HIS.? 24.24 O2 MPD B 194 199 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 21.96 2.03 15.24 19.33 1.86 13.55 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 49.28 8.80 -38.48 47.34 8.18 -39.14 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 4 3 # 4 18 ARG B 149 ARG^? 5.09 O2 EDO B 193 195 HIS B 154 HIS^? 5.27 C1 EDO B 192 199 ASP B 151 ASP^? -3.26 O1 EDO B 192s coo 21.96 2.03 15.24 19.33 1.86 13.55 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 29.58 31.84 -25.39 29.63 33.61 -24.25 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 29.45 33.81 -30.55 29.73 34.07 -28.42 3cla_c00 source 3cla TYPE III CHLORAMPHENICOL ACETYLTRANSFERASE ( C: 4 hits 3cla_c00 naa= 3 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 # 1 A 158 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 161 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 186 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 18.62 26.83 58.17 18.48 28.64 57.08 68.63 22.07 21.16 67.50 22.56 22.86 coo 23.76 27.69 57.88 24.05 29.81 55.69 67.94 16.79 18.42 70.70 18.25 18.48 coo 16.67 31.22 54.64 18.74 31.15 54.14 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 2 3 # 2 A 158 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 161 ARG A 82 ARG.? 24.76 O1 EDO A 189 A 186 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 18.62 26.83 58.17 18.48 28.64 57.08 68.63 22.07 21.16 67.50 22.56 22.86 coo 23.76 27.69 57.88 24.05 29.81 55.69 69.47 19.71 26.08 71.03 22.01 24.70 coo 16.67 31.22 54.64 18.74 31.15 54.14 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 3 3 # 3 A 158 ASP A 151 ASP^? 20.35 CM MPD A 191 A 161 ARG A 149 ARG^? 22.01 CM MPD A 191 A 186 HIS A 154 HIS^? 17.90 CM MPD A 191 coo 18.62 26.83 58.17 18.48 28.64 57.08 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 23.76 27.69 57.88 24.05 29.81 55.69 53.15 0.69 27.47 54.83 -1.87 27.18 coo 16.67 31.22 54.64 18.74 31.15 54.14 45.67 -1.54 22.26 44.90 -3.17 21.19 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 4 3 # 4 A 158 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 161 ARG B 60 ARG^? 18.79 C1 EDO B 189 A 186 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 18.62 26.83 58.17 18.48 28.64 57.08 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 23.76 27.69 57.88 24.05 29.81 55.69 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 16.67 31.22 54.64 18.74 31.15 54.14 45.35 5.36 -39.37 44.27 5.71 -41.13 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 5 3 # 5 A 158 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 161 ARG B 82 ARG.? 22.52 O2 EDO B 193 A 186 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 18.62 26.83 58.17 18.48 28.64 57.08 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 23.76 27.69 57.88 24.05 29.81 55.69 46.69 11.07 -43.02 44.95 12.59 -45.09 coo 16.67 31.22 54.64 18.74 31.15 54.14 45.35 5.36 -39.37 44.27 5.71 -41.13 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 6 3 # 6 A 158 ASP B 151 ASP^? -3.26 O1 EDO B 192s A 161 ARG B 149 ARG^? 5.09 O2 EDO B 193 A 186 HIS B 154 HIS^? 5.27 C1 EDO B 192 coo 18.62 26.83 58.17 18.48 28.64 57.08 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 23.76 27.69 57.88 24.05 29.81 55.69 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 16.67 31.22 54.64 18.74 31.15 54.14 29.58 31.84 -25.39 29.63 33.61 -24.25 4mdh_c02 source 4mdh CYTOPLASMIC MALATE DEHYDROGENASE (E.C.1.1.1.37: 6 hits 4mdh_c02 naa= 3 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 # 1 B 158 ASP A 80 ASP.? 21.91 O1 EDO A 189 B 161 ARG A 60 ARG^? 18.80 O1 EDO A 189 B 186 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 44.53 16.44 28.54 44.89 18.45 28.77 68.63 22.07 21.16 67.50 22.56 22.86 coo 39.64 19.27 28.15 40.19 21.74 29.94 67.94 16.79 18.42 70.70 18.25 18.48 coo 48.32 20.00 31.44 46.45 20.91 31.50 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 2 3 # 2 B 158 ASP A 97 ASP~? 21.13 O4 MPD A 191 B 161 ARG A 129 ARG^? 14.04 O2 MPD A 191 B 186 HIS A 84 HIS.? 23.86 O4 MPD A 191 coo 44.53 16.44 28.54 44.89 18.45 28.77 60.01 27.52 25.19 61.63 28.83 24.67 coo 39.64 19.27 28.15 40.19 21.74 29.94 54.99 23.34 25.48 52.76 24.40 27.34 coo 48.32 20.00 31.44 46.45 20.91 31.50 65.85 25.32 24.26 66.00 24.92 26.31 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 3 3 # 3 B 158 ASP A 151 ASP^? 20.35 CM MPD A 191 B 161 ARG A 149 ARG^? 22.01 CM MPD A 191 B 186 HIS A 154 HIS^? 17.90 CM MPD A 191 coo 44.53 16.44 28.54 44.89 18.45 28.77 48.38 -3.74 26.58 47.39 -3.82 24.70 coo 39.64 19.27 28.15 40.19 21.74 29.94 53.15 0.69 27.47 54.83 -1.87 27.18 coo 48.32 20.00 31.44 46.45 20.91 31.50 45.67 -1.54 22.26 44.90 -3.17 21.19 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 4 3 # 4 B 158 ASP B 80 ASP.? 22.03 C1 EDO B 189 B 161 ARG B 60 ARG^? 18.79 C1 EDO B 189 B 186 HIS B 84 HIS.? 24.24 O2 MPD B 194 coo 44.53 16.44 28.54 44.89 18.45 28.77 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 39.64 19.27 28.15 40.19 21.74 29.94 50.13 14.01 -35.69 52.36 12.88 -37.47 coo 48.32 20.00 31.44 46.45 20.91 31.50 45.35 5.36 -39.37 44.27 5.71 -41.13 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 5 3 # 5 B 158 ASP B 151 ASP^? -3.26 O1 EDO B 192s B 161 ARG B 149 ARG^? 5.09 O2 EDO B 193 B 186 HIS B 154 HIS^? 5.27 C1 EDO B 192 coo 44.53 16.44 28.54 44.89 18.45 28.77 29.45 33.81 -30.55 29.73 34.07 -28.42 coo 39.64 19.27 28.15 40.19 21.74 29.94 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 48.32 20.00 31.44 46.45 20.91 31.50 29.58 31.84 -25.39 29.63 33.61 -24.25 4mdh_c03 source 4mdh CYTOPLASMIC MALATE DEHYDROGENASE (E.C.1.1.1.37: 5 hits 4mdh_c03 naa= 3 ULMN 3 1k12_p00 LECTIN user 1 3 # 1 A 52 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 79 ARG A 60 ARG^? 18.80 O1 EDO A 189 A 86 ARG A 82 ARG.? 24.76 O1 EDO A 189 coo -5.53 26.98 5.69 -5.98 25.70 4.09 64.74 13.84 22.58 64.60 13.48 24.65 coo -12.15 26.35 6.05 -10.94 27.19 3.35 67.94 16.79 18.42 70.70 18.25 18.48 coo -9.59 20.48 4.28 -9.21 22.28 1.82 69.47 19.71 26.08 71.03 22.01 24.70 ULMN 3 1k12_p00 LECTIN user 2 3 # 2 A 52 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 79 ARG A 82 ARG.? 24.76 O1 EDO A 189 A 86 ARG A 60 ARG^? 18.80 O1 EDO A 189 coo -5.53 26.98 5.69 -5.98 25.70 4.09 64.74 13.84 22.58 64.60 13.48 24.65 coo -12.15 26.35 6.05 -10.94 27.19 3.35 69.47 19.71 26.08 71.03 22.01 24.70 coo -9.59 20.48 4.28 -9.21 22.28 1.82 67.94 16.79 18.42 70.70 18.25 18.48 1k12_p00 source 1k12 LECTIN : 2 hits 1k12_p00 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 111 ASN~? 7.14 CM MPD A 191 coo 5.80 63.03 55.85 5.52 65.03 56.45 50.97 8.64 17.05 49.29 9.91 16.73 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 159 ASN^? -4.07 O2 MPD A 191s coo 5.80 63.03 55.85 5.52 65.03 56.45 42.89 17.02 22.62 43.08 19.17 22.53 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN B 111 ASN~? 7.23 CM MPD B 194 coo 5.80 63.03 55.85 5.52 65.03 56.45 36.94 21.70 -24.36 35.87 20.37 -23.07 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN B 159 ASN^? -3.69 O2 MPD B 194s coo 5.80 63.03 55.85 5.52 65.03 56.45 27.54 13.31 -23.84 27.90 11.24 -23.52 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 4 hits 1kbk_p00 naa= 1 ULMN 3 1o8s_p00 PUTATIVE ENDO-XYLANASE user 1 3 # 1 A 56 TYR A 157 TYR^? -4.51 CM MPD A 191s A 112 PHE A 165 PHE.? -4.22 C1 MPD A 191s A 140 ASN A 159 ASN^? -4.07 O2 MPD A 191s coo -6.29 44.15 17.65 -9.00 44.92 17.68 46.12 11.16 21.21 46.22 13.94 20.83 coo -7.38 52.77 16.75 -5.54 52.71 18.82 40.08 13.76 19.44 40.43 11.62 17.70 coo -4.46 50.64 12.29 -5.69 49.89 13.85 42.89 17.02 22.62 43.08 19.17 22.53 1o8s_p00 source 1o8s PUTATIVE ENDO-XYLANASE : 1 hits 1o8s_p00 naa= 3 ULMN 3 2p3i_p00 VP4 user 1 3 # 1 A 101 ARG A 129 ARG^? 14.04 O2 MPD A 191 A 188 TYR A 132 TYR^? -3.92 O4 MPD A 191s A 190 SER A 142 SER^? 11.36 O4 MPD A 191 coo 37.69 7.64 13.51 38.82 8.84 16.11 54.99 23.34 25.48 52.76 24.40 27.34 coo 47.14 12.10 13.73 48.75 12.33 16.01 48.86 20.67 16.01 46.69 20.01 14.37 coo 43.77 6.93 15.46 45.49 7.21 17.11 52.28 24.44 20.99 51.62 26.22 22.49 ULMN 3 2p3i_p00 VP4 user 2 3 # 2 A 101 ARG A 144 ARG^? 11.59 O2 MPD A 191 A 188 TYR A 132 TYR^? -3.92 O4 MPD A 191s A 190 SER A 142 SER^? 11.36 O4 MPD A 191 coo 37.69 7.64 13.51 38.82 8.84 16.11 48.95 22.48 28.26 46.62 21.31 29.92 coo 47.14 12.10 13.73 48.75 12.33 16.01 48.86 20.67 16.01 46.69 20.01 14.37 coo 43.77 6.93 15.46 45.49 7.21 17.11 52.28 24.44 20.99 51.62 26.22 22.49 ULMN 3 2p3i_p00 VP4 user 3 3 # 3 A 101 ARG B 24 ARG^? 8.74 O1 EDO A 188 A 188 TYR B 49 TYR^? -7.47 C2 EDO B 189s A 190 SER B 32 SER^? 8.66 C2 EDO B 189 coo 37.69 7.64 13.51 38.82 8.84 16.11 54.81 25.46 -16.99 55.14 28.36 -15.99 coo 47.14 12.10 13.73 48.75 12.33 16.01 48.23 15.25 -19.35 46.43 17.40 -19.57 coo 43.77 6.93 15.46 45.49 7.21 17.11 50.26 19.40 -17.21 47.97 19.77 -16.73 ULMN 3 2p3i_p00 VP4 user 4 3 # 4 A 101 ARG B 129 ARG^? 16.59 O2 MPD B 194 A 188 TYR B 132 TYR^? 4.23 O4 MPD B 194s A 190 SER B 142 SER^? 12.79 C3 MPD B 194 coo 37.69 7.64 13.51 38.82 8.84 16.11 35.59 7.18 -33.96 34.54 5.79 -36.47 coo 47.14 12.10 13.73 48.75 12.33 16.01 36.28 9.60 -22.40 35.59 10.15 -19.78 coo 43.77 6.93 15.46 45.49 7.21 17.11 36.25 6.04 -28.61 35.21 4.32 -29.92 2p3i_p00 source 2p3i VP4 : 4 hits 2p3i_p00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 45 TYR^? 11.90 O2 EDO A 190 I 306 VAL A 66 VAL^? 9.00 O1 EDO A 189 I 308 VAL A 72 VAL^? 11.09 O1 EDO A 189 coo 26.18 35.24 6.87 24.33 35.18 8.97 47.53 19.92 0.67 46.95 18.68 3.19 coo 23.55 29.53 9.81 23.15 27.39 10.24 53.87 21.88 0.43 52.27 22.92 1.50 coo 16.43 30.18 9.35 15.05 30.67 11.01 54.65 26.50 -2.71 56.28 25.56 -3.79 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 2 3 # 2 I 303 TYR B 45 TYR^? 7.97 C2 EDO A 190 I 306 VAL B 66 VAL^? 8.25 C1 EDO A 190 I 308 VAL B 72 VAL^? 7.82 O1 EDO A 190 coo 26.18 35.24 6.87 24.33 35.18 8.97 44.36 10.34 -9.27 42.37 11.49 -10.86 coo 23.55 29.53 9.81 23.15 27.39 10.24 49.63 8.54 -12.89 47.65 7.47 -12.84 coo 16.43 30.18 9.35 15.05 30.67 11.01 52.32 3.97 -10.97 54.22 5.02 -11.18 1cqt_d00 source 1cqt GENE REGULATION/DNA : 2 hits 1cqt_d00 naa= 3 ULMN 3 1emh_d00 HYDROLASE/DNA user 1 3 # 1 A 271 PRO A 106 PRO.? 8.71 C5 MPD A 191 A 272 LEU A 34 LEU^? 9.26 O2 EDO A 190 A 276 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 16.45 -2.42 17.59 14.58 -2.74 16.47 46.44 15.19 6.54 47.37 15.30 8.57 coo 10.97 0.43 16.73 11.31 2.11 18.06 51.42 13.55 3.24 49.84 14.38 4.49 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1emh_d00 HYDROLASE/DNA user 2 3 # 2 A 271 PRO A 106 PRO.? 8.71 C5 MPD A 191 A 272 LEU A 47 LEU^? 8.05 O1 EDO A 189 A 276 ARG A 35 ARG^? -3.68 C1 EDO A 190s coo 16.45 -2.42 17.59 14.58 -2.74 16.47 46.44 15.19 6.54 47.37 15.30 8.57 coo 10.97 0.43 16.73 11.31 2.11 18.06 52.48 17.67 2.84 53.43 18.52 4.62 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 49.65 12.45 -3.94 51.87 11.63 -5.97 ULMN 3 1emh_d00 HYDROLASE/DNA user 3 3 # 3 A 271 PRO A 114 PRO~? 12.14 CM MPD A 191 A 272 LEU A 100 LEU.? 17.39 O2 MPD A 191 A 276 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 54.42 11.69 21.28 56.11 10.21 21.42 coo 10.97 0.43 16.73 11.31 2.11 18.06 60.29 16.90 23.44 61.40 17.33 25.26 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1emh_d00 HYDROLASE/DNA user 4 3 # 4 A 271 PRO A 114 PRO~? 12.14 CM MPD A 191 A 272 LEU A 118 LEU~? 16.17 O2 MPD A 191 A 276 ARG A 149 ARG^? 22.01 CM MPD A 191 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 54.42 11.69 21.28 56.11 10.21 21.42 coo 10.97 0.43 16.73 11.31 2.11 18.06 57.28 8.39 26.78 56.34 10.34 26.93 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 53.15 0.69 27.47 54.83 -1.87 27.18 ULMN 3 1emh_d00 HYDROLASE/DNA user 5 3 # 5 A 271 PRO A 140 PRO.? 12.19 O4 MPD A 191 A 272 LEU A 131 LEU^? 12.33 O4 MPD A 191 A 276 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 55.24 25.51 12.84 53.11 25.98 13.46 coo 10.97 0.43 16.73 11.31 2.11 18.06 55.99 21.56 17.89 56.54 23.45 17.02 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 54.99 23.34 25.48 52.76 24.40 27.34 ULMN 3 1emh_d00 HYDROLASE/DNA user 6 3 # 6 A 271 PRO A 181 PRO.? 11.96 CM MPD A 191 A 272 LEU A 170 LEU^? 16.96 CM MPD A 191 A 276 ARG A 186 ARG^? 11.98 O1 EDO B 190 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 41.12 3.13 16.66 41.10 4.37 14.76 coo 10.97 0.43 16.73 11.31 2.11 18.06 45.93 -0.72 17.04 46.06 -2.91 16.98 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 51.29 1.08 9.05 52.68 -0.95 10.91 ULMN 3 1emh_d00 HYDROLASE/DNA user 7 3 # 7 A 271 PRO B 106 PRO.? 7.53 C1 EDO B 188 A 272 LEU B 34 LEU^? 11.05 C2 EDO B 189 A 276 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 39.78 14.95 -13.18 39.36 14.96 -15.40 coo 10.97 0.43 16.73 11.31 2.11 18.06 45.81 16.83 -13.57 43.83 16.06 -13.74 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1emh_d00 HYDROLASE/DNA user 8 3 # 8 A 271 PRO B 106 PRO.? 7.53 C1 EDO B 188 A 272 LEU B 47 LEU^? 8.42 C1 EDO B 189 A 276 ARG B 35 ARG^? 10.43 C2 EDO A 190 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 39.78 14.95 -13.18 39.36 14.96 -15.40 coo 10.97 0.43 16.73 11.31 2.11 18.06 46.97 12.74 -13.92 46.71 12.04 -16.00 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 48.60 18.31 -7.03 51.67 18.96 -6.78 ULMN 3 1emh_d00 HYDROLASE/DNA user 9 3 # 9 A 271 PRO B 114 PRO~? 10.61 C1 EDO B 193 A 272 LEU B 100 LEU.? 17.23 O2 EDO B 193 A 276 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 37.28 18.71 -29.88 38.46 20.23 -30.98 coo 10.97 0.43 16.73 11.31 2.11 18.06 41.00 13.67 -35.13 41.03 13.37 -37.27 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 35.59 7.18 -33.96 34.54 5.79 -36.47 ULMN 3 1emh_d00 HYDROLASE/DNA user 10 3 # 10 A 271 PRO B 114 PRO~? 10.61 C1 EDO B 193 A 272 LEU B 118 LEU~? 10.24 O2 EDO B 193 A 276 ARG B 149 ARG^? 5.09 O2 EDO B 193 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 37.28 18.71 -29.88 38.46 20.23 -30.98 coo 10.97 0.43 16.73 11.31 2.11 18.06 35.92 21.81 -35.83 35.19 19.78 -35.35 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 32.58 29.52 -34.06 34.17 32.07 -34.76 ULMN 3 1emh_d00 HYDROLASE/DNA user 11 3 # 11 A 271 PRO B 140 PRO.? 12.55 O4 MPD B 194 A 272 LEU B 131 LEU^? 12.70 C3 MPD B 194 A 276 ARG B 129 ARG^? 16.59 O2 MPD B 194 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 43.37 4.86 -23.89 41.31 4.48 -23.05 coo 10.97 0.43 16.73 11.31 2.11 18.06 40.82 9.00 -28.22 41.89 7.18 -27.82 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 35.59 7.18 -33.96 34.54 5.79 -36.47 1emh_d00 source 1emh HYDROLASE/DNA : 11 hits 1emh_d00 naa= 3 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 1 3 # 1 E 40 ARG A 5 ARG^? -3.94 O1 EDO A 188s E 41 TYR A 7 TYR^? -3.69 C1 EDO A 188s E 83 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 49.47 32.83 -21.72 46.80 34.39 -21.91 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 46.26 28.35 -19.62 46.61 30.00 -21.81 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 2 3 # 2 E 40 ARG A 5 ARG^? -3.94 O1 EDO A 188s E 41 TYR A 7 TYR^? -3.69 C1 EDO A 188s E 83 ARG A 117 ARG~? 16.06 O2 MPD A 191 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 49.47 32.83 -21.72 46.80 34.39 -21.91 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 46.26 28.35 -19.62 46.61 30.00 -21.81 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 61.14 12.50 23.45 58.83 13.31 25.34 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 3 3 # 3 E 40 ARG A 5 ARG^? -3.94 O1 EDO A 188s E 41 TYR A 7 TYR^? -3.69 C1 EDO A 188s E 83 ARG A 144 ARG^? 11.59 O2 MPD A 191 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 49.47 32.83 -21.72 46.80 34.39 -21.91 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 46.26 28.35 -19.62 46.61 30.00 -21.81 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 48.95 22.48 28.26 46.62 21.31 29.92 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 4 3 # 4 E 40 ARG A 50 ARG^? 6.80 C2 EDO A 189 E 41 TYR A 49 TYR^? 7.66 O1 EDO A 189 E 83 ARG B 82 ARG.? 22.52 O2 EDO B 193 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 65.37 14.47 5.23 66.89 16.94 6.37 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 56.86 15.30 6.36 55.58 13.13 7.63 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 46.69 11.07 -43.02 44.95 12.59 -45.09 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 5 3 # 5 E 40 ARG A 50 ARG^? 6.80 C2 EDO A 189 E 41 TYR A 49 TYR^? 7.66 O1 EDO A 189 E 83 ARG B 144 ARG^? 12.29 O2 MPD B 194 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 65.37 14.47 5.23 66.89 16.94 6.37 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 56.86 15.30 6.36 55.58 13.13 7.63 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 28.02 7.86 -31.66 25.29 9.13 -32.53 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 6 3 # 6 E 40 ARG A 50 ARG^? 6.80 C2 EDO A 189 E 41 TYR A 49 TYR^? 7.66 O1 EDO A 189 E 83 ARG B 149 ARG^? 5.09 O2 EDO B 193 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 65.37 14.47 5.23 66.89 16.94 6.37 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 56.86 15.30 6.36 55.58 13.13 7.63 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 32.58 29.52 -34.06 34.17 32.07 -34.76 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 7 3 # 7 E 40 ARG A 149 ARG^? 22.01 CM MPD A 191 E 41 TYR A 155 TYR^? 14.94 CM MPD A 191 E 83 ARG B 50 ARG^? -6.93 O2 EDO B 189s coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 53.15 0.69 27.47 54.83 -1.87 27.18 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 50.44 4.00 23.33 52.91 2.96 24.17 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 55.72 16.68 -23.20 56.85 15.32 -25.75 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 8 3 # 8 E 40 ARG B 50 ARG^? -6.93 O2 EDO B 189s E 41 TYR B 49 TYR^? -7.47 C2 EDO B 189s E 83 ARG A 82 ARG.? 24.76 O1 EDO A 189 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 48.23 15.25 -19.35 46.43 17.40 -19.57 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 69.47 19.71 26.08 71.03 22.01 24.70 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 9 3 # 9 E 40 ARG B 50 ARG^? -6.93 O2 EDO B 189s E 41 TYR B 49 TYR^? -7.47 C2 EDO B 189s E 83 ARG A 144 ARG^? 11.59 O2 MPD A 191 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 48.23 15.25 -19.35 46.43 17.40 -19.57 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 48.95 22.48 28.26 46.62 21.31 29.92 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 10 3 # 10 E 40 ARG B 50 ARG^? -6.93 O2 EDO B 189s E 41 TYR B 49 TYR^? -7.47 C2 EDO B 189s E 83 ARG A 149 ARG^? 22.01 CM MPD A 191 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 55.72 16.68 -23.20 56.85 15.32 -25.75 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 48.23 15.25 -19.35 46.43 17.40 -19.57 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 53.15 0.69 27.47 54.83 -1.87 27.18 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 11 3 # 11 E 40 ARG B 141 ARG^? 5.70 O4 MPD B 194 E 41 TYR B 132 TYR^? 4.23 O4 MPD B 194s E 83 ARG A 116 ARG~? 15.92 O1 EDO B 190 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 34.68 4.05 -23.26 33.98 5.70 -20.76 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 36.28 9.60 -22.40 35.59 10.15 -19.78 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 59.64 3.34 19.37 61.78 2.26 17.40 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 12 3 # 12 E 40 ARG B 149 ARG^? 5.09 O2 EDO B 193 E 41 TYR B 155 TYR^? 6.08 O1 EDO B 193 E 83 ARG A 24 ARG^? 7.27 O2 EDO A 189 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 63.21 5.10 1.62 63.59 8.06 0.82 ULMN 3 1id3_d00 STRUCTURAL PROTEIN/DNA user 13 3 # 13 E 40 ARG B 149 ARG^? 5.09 O2 EDO B 193 E 41 TYR B 155 TYR^? 6.08 O1 EDO B 193 E 83 ARG A 50 ARG^? 6.80 C2 EDO A 189 coo 41.16 -25.11 -82.73 40.81 -22.13 -82.13 32.58 29.52 -34.06 34.17 32.07 -34.76 coo 40.04 -30.19 -77.46 41.62 -32.14 -76.20 32.75 26.18 -29.08 34.17 27.29 -31.19 coo 33.18 -0.85 -38.14 36.12 -0.03 -38.44 65.37 14.47 5.23 66.89 16.94 6.37 1id3_d00 source 1id3 STRUCTURAL PROTEIN/DNA : 13 hits 1id3_d00 naa= 3 ULMN 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 1 3 # 1 A1290 LYS B 166 LYS^? 10.40 O2 MPD B 194 A1294 ASN B 159 ASN^? -3.69 O2 MPD B 194s A1297 GLU B 161 GLU.? 9.05 O2 MPD B 194 coo 39.24 18.84-161.99 36.62 21.47-165.99 25.14 19.21 -22.67 21.76 17.11 -26.55 coo 33.53 17.37-161.81 34.31 17.81-163.76 27.54 13.31 -23.84 27.90 11.24 -23.52 coo 29.78 23.31-161.30 31.23 23.66-162.84 28.86 7.94 -26.27 29.12 6.39 -27.73 1xpx_d00 source 1xpx TRANSCRIPTION REGULATION/DNA : 1 hits 1xpx_d00 naa= 3 ULMN 4 1zrf_d00 GENE REGULATION/DNA user 1 4 # 1 A 170 GLN B 33 GLN^? 9.24 C2 EDO B 189 A 179 SER A 68 SER^? 14.83 O1 EDO A 189 A 180 ARG B 35 ARG^? 10.43 C2 EDO A 190 A 181 GLU A 67 GLU^? 10.03 C1 EDO A 189 coo 1.45 7.07 4.95 2.68 8.54 5.89 51.15 18.18 -11.32 53.04 18.44 -10.42 coo -3.43 8.18 -1.54 -5.76 8.81 -1.23 48.79 23.73 -3.35 48.63 25.48 -1.65 coo -1.38 9.52 4.42 -3.09 11.26 6.30 48.60 18.31 -7.03 51.67 18.96 -6.78 coo -6.78 10.36 3.32 -4.99 11.32 2.66 54.47 21.64 -4.11 55.33 21.19 -6.01 1zrf_d00 source 1zrf GENE REGULATION/DNA : 1 hits 1zrf_d00 naa= 4 ULMN 4 2bgw_d00 HYDROLASE user 1 4 # 1 A 86 ALA A 62 ALA^? 8.76 O1 EDO A 189 A 87 GLU A 61 GLU^? 10.22 O1 EDO A 189 A 123 TYR A 49 TYR^? 7.66 O1 EDO A 189 A 182 ARG A 52 ARG^? 13.70 C2 EDO A 189 coo 33.66 63.14 16.62 34.95 63.46 15.91 62.10 18.98 10.31 60.83 19.17 11.13 coo 28.97 64.99 12.92 27.92 64.06 11.28 66.46 19.59 10.29 68.35 19.61 9.28 coo 38.40 63.73 13.00 38.79 62.53 10.47 56.86 15.30 6.36 55.58 13.13 7.63 coo 29.35 67.59 19.60 30.93 68.47 17.09 69.17 14.29 10.90 69.97 16.58 12.80 ULMN 4 2bgw_d00 HYDROLASE user 2 4 # 2 A 86 ALA B 62 ALA^? 8.92 C1 EDO B 189 A 87 GLU B 61 GLU^? 10.17 C1 EDO B 189 A 123 TYR B 49 TYR^? -7.47 C2 EDO B 189s A 182 ARG B 52 ARG^? 13.54 O2 EDO B 189 coo 33.66 63.14 16.62 34.95 63.46 15.91 50.28 11.76 -25.69 48.75 11.59 -25.62 coo 28.97 64.99 12.92 27.92 64.06 11.28 53.85 11.48 -28.30 55.92 11.40 -28.71 coo 38.40 63.73 13.00 38.79 62.53 10.47 48.23 15.25 -19.35 46.43 17.40 -19.57 coo 29.35 67.59 19.60 30.93 68.47 17.09 55.40 16.98 -30.43 55.13 14.61 -32.43 ULMN 4 2bgw_d00 HYDROLASE user 3 4 # 3 A 86 ALA B 146 ALA^? 9.91 O2 MPD B 194 A 87 GLU B 127 GLU^? 12.59 O2 MPD B 194 A 123 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 182 ARG B 125 ARG^? 12.90 O2 MPD B 194 coo 33.66 63.14 16.62 34.95 63.46 15.91 29.33 17.08 -30.73 27.86 17.06 -31.19 coo 28.97 64.99 12.92 27.92 64.06 11.28 29.39 12.97 -34.29 27.94 11.43 -34.46 coo 38.40 63.73 13.00 38.79 62.53 10.47 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 29.35 67.59 19.60 30.93 68.47 17.09 24.74 19.51 -33.91 24.95 16.46 -33.56 2bgw_d00 source 2bgw HYDROLASE : 3 hits 2bgw_d00 naa= 4 ULMN 3 2bsq_d00 TRANSCRIPTION user 1 3 # 1 E 3 SER B 68 SER^? -5.55 O2 EDO B 191s E 5 VAL B 66 VAL^? 8.25 C1 EDO A 190 E 7 ARG B 73 ARG^? 12.39 O2 EDO B 191 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 47.96 6.58 -6.86 46.83 4.83 -8.08 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 49.63 8.54 -12.89 47.65 7.47 -12.84 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 48.25 3.22 -16.58 47.20 1.81 -19.15 ULMN 3 2bsq_d00 TRANSCRIPTION user 2 3 # 2 E 3 SER B 68 SER^? -5.55 O2 EDO B 191s E 5 VAL B 72 VAL^? 7.82 O1 EDO A 190 E 7 ARG B 73 ARG^? 12.39 O2 EDO B 191 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 47.96 6.58 -6.86 46.83 4.83 -8.08 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 52.32 3.97 -10.97 54.22 5.02 -11.18 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 48.25 3.22 -16.58 47.20 1.81 -19.15 2bsq_d00 source 2bsq TRANSCRIPTION : 2 hits 2bsq_d00 naa= 3 ULMN 3 2hos_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 5 ARG A 144 ARG^? 11.59 O2 MPD A 191 A 50 LYS A 166 LYS^? 9.67 O2 MPD A 191 A 51 ASN A 159 ASN^? -4.07 O2 MPD A 191s coo 28.68 23.77 42.74 27.76 26.72 42.93 48.95 22.48 28.26 46.62 21.31 29.92 coo 14.40 30.33 40.28 14.25 28.31 45.36 40.42 10.96 22.74 39.85 13.02 27.76 coo 19.09 30.55 41.51 19.09 28.89 42.82 42.89 17.02 22.62 43.08 19.17 22.53 2hos_d00 source 2hos TRANSCRIPTION/DNA : 1 hits 2hos_d00 naa= 3 ULMN 4 2k1n_d00 TRANSITION STATE REGULATORY PROTEIN user 1 4 # 1 B 11 ASP A 101 ASP^? 14.06 CM MPD A 191 B 13 LEU A 100 LEU.? 17.39 O2 MPD A 191 B 15 ARG A 117 ARG~? 16.06 O2 MPD A 191 B 24 ARG A 186 ARG^? 11.98 O1 EDO B 190 coo 15.09 5.12 6.66 17.12 5.29 6.08 57.05 15.04 20.11 57.86 14.10 21.77 coo 11.05 7.46 5.28 10.64 9.34 6.32 60.29 16.90 23.44 61.40 17.33 25.26 coo 13.67 6.19 2.71 15.78 8.26 3.55 61.14 12.50 23.45 58.83 13.31 25.34 coo 32.66 5.71 1.70 32.10 8.08 -0.17 51.29 1.08 9.05 52.68 -0.95 10.91 2k1n_d00 source 2k1n TRANSITION STATE REGULATORY PROTEIN ABRB : 1 hits 2k1n_d00 naa= 4 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 B 34 SER A 163 SER.? 4.62 C1 MPD A 191 B 37 ASN A 159 ASN^? -4.07 O2 MPD A 191s B 45 THR A 148 THR^? 14.42 O2 MPD A 191 coo -19.49 41.97 71.08 -17.37 40.80 71.17 38.30 19.59 22.49 40.04 18.18 21.65 coo -23.05 39.62 69.74 -22.86 39.59 67.61 42.89 17.02 22.62 43.08 19.17 22.53 coo -30.87 34.84 80.57 -28.94 34.51 81.49 48.73 6.54 28.33 47.39 6.78 29.99 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 B 34 SER B 163 SER.? 4.72 C1 MPD B 194 B 37 ASN B 159 ASN^? -3.69 O2 MPD B 194s B 45 THR B 148 THR^? 13.69 O2 EDO B 193 coo -19.49 41.97 71.08 -17.37 40.80 71.17 23.32 10.61 -21.24 25.38 11.94 -21.19 coo -23.05 39.62 69.74 -22.86 39.59 67.61 27.54 13.31 -23.84 27.90 11.24 -23.52 coo -30.87 34.84 80.57 -28.94 34.51 81.49 28.54 23.73 -31.92 26.40 23.60 -32.23 2z3x_d00 source 2z3x DNA BINDING PROTEIN/DNA : 2 hits 2z3x_d00 naa= 3 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 21 GLN A 145 GLN^? 5.80 O2 MPD A 191 A 41 TYR A 132 TYR^? -3.92 O4 MPD A 191s A 43 ASN A 159 ASN^? -4.07 O2 MPD A 191s coo 22.03 6.35 12.16 20.71 6.08 10.54 49.04 16.64 22.28 49.83 15.93 20.47 coo 18.67 0.21 9.03 16.70 -1.66 8.55 48.86 20.67 16.01 46.69 20.01 14.37 coo 14.90 7.30 8.78 14.25 8.14 6.97 42.89 17.02 22.62 43.08 19.17 22.53 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 A 21 GLN A 145 GLN^? 5.80 O2 MPD A 191 A 41 TYR A 147 TYR^? 9.49 CM MPD A 191 A 43 ASN A 111 ASN~? 7.14 CM MPD A 191 coo 22.03 6.35 12.16 20.71 6.08 10.54 49.04 16.64 22.28 49.83 15.93 20.47 coo 18.67 0.21 9.03 16.70 -1.66 8.55 50.88 9.76 23.94 51.01 10.64 21.28 coo 14.90 7.30 8.78 14.25 8.14 6.97 50.97 8.64 17.05 49.29 9.91 16.73 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 A 21 GLN A 145 GLN^? 5.80 O2 MPD A 191 A 41 TYR A 157 TYR^? -4.51 CM MPD A 191s A 43 ASN A 111 ASN~? 7.14 CM MPD A 191 coo 22.03 6.35 12.16 20.71 6.08 10.54 49.04 16.64 22.28 49.83 15.93 20.47 coo 18.67 0.21 9.03 16.70 -1.66 8.55 46.12 11.16 21.21 46.22 13.94 20.83 coo 14.90 7.30 8.78 14.25 8.14 6.97 50.97 8.64 17.05 49.29 9.91 16.73 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 4 3 # 4 A 21 GLN A 145 GLN^? 5.80 O2 MPD A 191 A 41 TYR A 157 TYR^? -4.51 CM MPD A 191s A 43 ASN A 159 ASN^? -4.07 O2 MPD A 191s coo 22.03 6.35 12.16 20.71 6.08 10.54 49.04 16.64 22.28 49.83 15.93 20.47 coo 18.67 0.21 9.03 16.70 -1.66 8.55 46.12 11.16 21.21 46.22 13.94 20.83 coo 14.90 7.30 8.78 14.25 8.14 6.97 42.89 17.02 22.62 43.08 19.17 22.53 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 5 3 # 5 A 21 GLN B 145 GLN^? 5.59 O2 MPD B 194 A 41 TYR B 132 TYR^? 4.23 O4 MPD B 194s A 43 ASN B 159 ASN^? -3.69 O2 MPD B 194s coo 22.03 6.35 12.16 20.71 6.08 10.54 32.37 13.58 -27.30 34.23 14.31 -26.47 coo 18.67 0.21 9.03 16.70 -1.66 8.55 36.28 9.60 -22.40 35.59 10.15 -19.78 coo 14.90 7.30 8.78 14.25 8.14 6.97 27.54 13.31 -23.84 27.90 11.24 -23.52 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 6 3 # 6 A 21 GLN B 145 GLN^? 5.59 O2 MPD B 194 A 41 TYR B 147 TYR^? 9.73 O2 MPD B 194 A 43 ASN B 111 ASN~? 7.23 CM MPD B 194 coo 22.03 6.35 12.16 20.71 6.08 10.54 32.37 13.58 -27.30 34.23 14.31 -26.47 coo 18.67 0.21 9.03 16.70 -1.66 8.55 32.90 20.52 -29.81 34.48 19.65 -27.74 coo 14.90 7.30 8.78 14.25 8.14 6.97 36.94 21.70 -24.36 35.87 20.37 -23.07 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 7 3 # 7 A 21 GLN B 145 GLN^? 5.59 O2 MPD B 194 A 41 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 43 ASN B 111 ASN~? 7.23 CM MPD B 194 coo 22.03 6.35 12.16 20.71 6.08 10.54 32.37 13.58 -27.30 34.23 14.31 -26.47 coo 18.67 0.21 9.03 16.70 -1.66 8.55 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 14.90 7.30 8.78 14.25 8.14 6.97 36.94 21.70 -24.36 35.87 20.37 -23.07 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 8 3 # 8 A 21 GLN B 145 GLN^? 5.59 O2 MPD B 194 A 41 TYR B 157 TYR^? -4.69 O2 MPD B 194s A 43 ASN B 159 ASN^? -3.69 O2 MPD B 194s coo 22.03 6.35 12.16 20.71 6.08 10.54 32.37 13.58 -27.30 34.23 14.31 -26.47 coo 18.67 0.21 9.03 16.70 -1.66 8.55 30.68 18.93 -24.72 31.20 16.23 -24.55 coo 14.90 7.30 8.78 14.25 8.14 6.97 27.54 13.31 -23.84 27.90 11.24 -23.52 3ssc_d00 source 3ssc DNA BINDING PROTEIN/DNA : 8 hits 3ssc_d00 naa= 3 ULMN 3 2ebf_o00 DERMONECROTIC TOXIN user 1 3 # 1 X1165 CYH A 99 CYH.? 13.00 O4 MPD A 191 X1205 HIS A 84 HIS.? 23.86 O4 MPD A 191 X1220 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo -26.56 24.53 92.56 -24.57 23.58 94.36 58.08 21.10 22.79 55.99 22.56 21.69 coo -19.40 30.09 91.63 -20.33 29.86 93.49 65.85 25.32 24.26 66.00 24.92 26.31 coo -21.03 32.79 97.44 -20.59 31.13 96.21 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 2ebf_o00 DERMONECROTIC TOXIN user 2 3 # 2 X1165 CYH B 99 CYH.? 13.42 O2 MPD B 194 X1205 HIS B 84 HIS.? 24.24 O2 MPD B 194 X1220 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo -26.56 24.53 92.56 -24.57 23.58 94.36 39.68 9.38 -33.42 38.76 7.79 -31.29 coo -19.40 30.09 91.63 -20.33 29.86 93.49 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -21.03 32.79 97.44 -20.59 31.13 96.21 49.28 8.80 -38.48 47.34 8.18 -39.14 2ebf_o00 source 2EBF DERMONECROTIC TOXIN : 2 hits 2ebf_o00 naa= 3 ULMN 3 2odj_o00 PORIN D user 1 3 # 1 A 156 HIS A 65 HIS^? 6.20 C1 EDO A 189 A 208 ASP A 38 ASP.? 14.66 C5 MPD A 191 A 296 SER A 142 SER^? 11.36 O4 MPD A 191 coo 12.72 17.48 24.71 12.80 19.37 23.81 58.30 21.39 -1.16 58.14 22.03 -3.16 coo 18.47 29.19 29.68 19.30 29.17 27.75 42.66 22.43 1.00 42.54 24.24 2.16 coo 6.89 17.22 46.63 5.08 16.21 47.91 52.28 24.44 20.99 51.62 26.22 22.49 ULMN 3 2odj_o00 PORIN D user 2 3 # 2 A 156 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 208 ASP B 28 ASP.? 13.72 O2 EDO B 189 A 296 SER B 153 SER.? -3.11 C2 EDO B 192s coo 12.72 17.48 24.71 12.80 19.37 23.81 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 18.47 29.19 29.68 19.30 29.17 27.75 53.65 22.40 -31.36 55.55 22.21 -30.45 coo 6.89 17.22 46.63 5.08 16.21 47.91 33.75 32.64 -27.23 32.53 34.50 -26.24 ULMN 3 2odj_o00 PORIN D user 3 3 # 3 A 156 HIS B 65 HIS^? -5.26 O1 EDO B 189s A 208 ASP B 38 ASP.? -2.58 O1 EDO B 191s A 296 SER B 142 SER^? 12.79 C3 MPD B 194 coo 12.72 17.48 24.71 12.80 19.37 23.81 54.13 9.12 -14.50 55.15 8.45 -12.80 coo 18.47 29.19 29.68 19.30 29.17 27.75 40.43 7.67 -6.71 39.74 5.84 -7.58 coo 6.89 17.22 46.63 5.08 16.21 47.91 36.25 6.04 -28.61 35.21 4.32 -29.92 2odj_o00 source 2ODJ PORIN D : 3 hits 2odj_o00 naa= 3 ULMN 3 2odj_o01 PORIN D user 1 3 # 1 B 156 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 208 ASP A 27 ASP.? 13.04 O1 EDO B 190 B 296 SER A 153 SER.? 20.01 CM MPD A 191 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 64.74 13.84 22.58 64.60 13.48 24.65 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 68.29 3.95 12.18 68.54 1.87 11.74 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 50.18 -2.46 21.39 48.57 -4.23 21.02 ULMN 3 2odj_o01 PORIN D user 2 3 # 2 B 156 HIS A 65 HIS^? 6.20 C1 EDO A 189 B 208 ASP A 38 ASP.? 14.66 C5 MPD A 191 B 296 SER A 142 SER^? 11.36 O4 MPD A 191 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 58.30 21.39 -1.16 58.14 22.03 -3.16 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 42.66 22.43 1.00 42.54 24.24 2.16 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 52.28 24.44 20.99 51.62 26.22 22.49 ULMN 3 2odj_o01 PORIN D user 3 3 # 3 B 156 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 208 ASP B 28 ASP.? 13.72 O2 EDO B 189 B 296 SER B 153 SER.? -3.11 C2 EDO B 192s coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 53.65 22.40 -31.36 55.55 22.21 -30.45 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 33.75 32.64 -27.23 32.53 34.50 -26.24 ULMN 3 2odj_o01 PORIN D user 4 3 # 4 B 156 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 208 ASP B 38 ASP.? -2.58 O1 EDO B 191s B 296 SER B 142 SER^? 12.79 C3 MPD B 194 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 54.13 9.12 -14.50 55.15 8.45 -12.80 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 40.43 7.67 -6.71 39.74 5.84 -7.58 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 36.25 6.04 -28.61 35.21 4.32 -29.92 2odj_o01 source 2ODJ PORIN D : 4 hits 2odj_o01 naa= 3 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 54 ASP.? 20.27 C2 EDO A 189 A 86 HIS A 58 HIS.? 21.11 O2 MPD A 191 A 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 68.86 12.45 19.04 67.57 12.48 20.71 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 64.74 13.84 22.58 64.60 13.48 24.65 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP A 80 ASP.? 21.91 O1 EDO A 189 A 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 68.63 22.07 21.16 67.50 22.56 22.86 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 65.85 25.32 24.26 66.00 24.92 26.31 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 # 3 A 49 ASP A 87 ASP^? 16.43 O1 EDO A 189 A 86 HIS A 76 HIS^? 9.12 O1 EDO A 189 A 250 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 63.41 29.58 11.55 64.59 31.41 11.51 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 65.00 24.12 7.67 66.83 23.12 7.94 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 4 3 # 4 A 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 60.01 27.52 25.19 61.63 28.83 24.67 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 65.85 25.32 24.26 66.00 24.92 26.31 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 # 5 A 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 A 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 60.01 27.52 25.19 61.63 28.83 24.67 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 65.85 25.32 24.26 66.00 24.92 26.31 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 6 3 # 6 A 49 ASP B 54 ASP.? 15.81 C2 EDO B 193 A 86 HIS B 58 HIS.? 15.15 C2 EDO B 193 A 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 # 7 A 49 ASP B 80 ASP.? 22.03 C1 EDO B 189 A 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 48.58 -0.77 -33.67 48.18 -1.29 -35.04 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 8 3 # 8 A 49 ASP B 87 ASP^? 16.44 C1 EDO B 189 A 86 HIS B 76 HIS^? 9.10 C1 EDO B 189 A 250 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 9 3 # 9 A 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 10 3 # 10 A 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 A 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 48.58 -0.77 -33.67 48.18 -1.29 -35.04 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 10 hits 2wwt_o00 naa= 3 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 B 49 ASP A 54 ASP.? 20.27 C2 EDO A 189 B 86 HIS A 58 HIS.? 21.11 O2 MPD A 191 B 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 68.86 12.45 19.04 67.57 12.48 20.71 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 64.74 13.84 22.58 64.60 13.48 24.65 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 B 49 ASP A 80 ASP.? 21.91 O1 EDO A 189 B 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 68.63 22.07 21.16 67.50 22.56 22.86 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 65.85 25.32 24.26 66.00 24.92 26.31 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 # 3 B 49 ASP A 87 ASP^? 16.43 O1 EDO A 189 B 86 HIS A 76 HIS^? 9.12 O1 EDO A 189 B 250 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 63.41 29.58 11.55 64.59 31.41 11.51 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 65.00 24.12 7.67 66.83 23.12 7.94 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 4 3 # 4 B 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 B 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 60.01 27.52 25.19 61.63 28.83 24.67 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 65.85 25.32 24.26 66.00 24.92 26.31 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 # 5 B 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 B 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 B 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 60.01 27.52 25.19 61.63 28.83 24.67 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 65.85 25.32 24.26 66.00 24.92 26.31 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 6 3 # 6 B 49 ASP B 54 ASP.? 15.81 C2 EDO B 193 B 86 HIS B 58 HIS.? 15.15 C2 EDO B 193 B 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 50.24 18.54 -36.80 48.17 18.09 -37.17 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 # 7 B 49 ASP B 80 ASP.? 22.03 C1 EDO B 189 B 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 49.28 8.80 -38.48 47.34 8.18 -39.14 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 48.58 -0.77 -33.67 48.18 -1.29 -35.04 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 8 3 # 8 B 49 ASP B 87 ASP^? 16.44 C1 EDO B 189 B 86 HIS B 76 HIS^? 9.10 C1 EDO B 189 B 250 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 54.34 6.71 -25.28 55.69 7.78 -26.49 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 9 3 # 9 B 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 10 3 # 10 B 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 B 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 B 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 48.58 -0.77 -33.67 48.18 -1.29 -35.04 2wwt_o01 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 10 hits 2wwt_o01 naa= 3 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 C 49 ASP A 54 ASP.? 20.27 C2 EDO A 189 C 86 HIS A 58 HIS.? 21.11 O2 MPD A 191 C 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 68.86 12.45 19.04 67.57 12.48 20.71 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 64.74 13.84 22.58 64.60 13.48 24.65 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 C 49 ASP A 80 ASP.? 21.91 O1 EDO A 189 C 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 C 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 68.63 22.07 21.16 67.50 22.56 22.86 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 65.85 25.32 24.26 66.00 24.92 26.31 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 # 3 C 49 ASP A 87 ASP^? 16.43 O1 EDO A 189 C 86 HIS A 76 HIS^? 9.12 O1 EDO A 189 C 250 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 63.41 29.58 11.55 64.59 31.41 11.51 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 65.00 24.12 7.67 66.83 23.12 7.94 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 4 3 # 4 C 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 C 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 C 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 60.01 27.52 25.19 61.63 28.83 24.67 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 65.85 25.32 24.26 66.00 24.92 26.31 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 # 5 C 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 C 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 C 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 60.01 27.52 25.19 61.63 28.83 24.67 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 65.85 25.32 24.26 66.00 24.92 26.31 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 6 3 # 6 C 49 ASP B 80 ASP.? 22.03 C1 EDO B 189 C 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 C 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 48.58 -0.77 -33.67 48.18 -1.29 -35.04 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 # 7 C 49 ASP B 87 ASP^? 16.44 C1 EDO B 189 C 86 HIS B 76 HIS^? 9.10 C1 EDO B 189 C 250 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 8 3 # 8 C 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 C 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 C 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 9 3 # 9 C 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 C 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 C 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 48.58 -0.77 -33.67 48.18 -1.29 -35.04 2wwt_o02 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 9 hits 2wwt_o02 naa= 3 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 D 49 ASP A 54 ASP.? 20.27 C2 EDO A 189 D 86 HIS A 58 HIS.? 21.11 O2 MPD A 191 D 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 68.86 12.45 19.04 67.57 12.48 20.71 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 64.74 13.84 22.58 64.60 13.48 24.65 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 D 49 ASP A 80 ASP.? 21.91 O1 EDO A 189 D 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 D 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 68.63 22.07 21.16 67.50 22.56 22.86 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 65.85 25.32 24.26 66.00 24.92 26.31 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 # 3 D 49 ASP A 87 ASP^? 16.43 O1 EDO A 189 D 86 HIS A 76 HIS^? 9.12 O1 EDO A 189 D 250 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 63.41 29.58 11.55 64.59 31.41 11.51 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 65.00 24.12 7.67 66.83 23.12 7.94 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 4 3 # 4 D 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 D 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 D 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 60.01 27.52 25.19 61.63 28.83 24.67 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 65.85 25.32 24.26 66.00 24.92 26.31 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 # 5 D 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 D 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 D 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 60.01 27.52 25.19 61.63 28.83 24.67 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 65.85 25.32 24.26 66.00 24.92 26.31 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 6 3 # 6 D 49 ASP B 54 ASP.? 15.81 C2 EDO B 193 D 86 HIS B 58 HIS.? 15.15 C2 EDO B 193 D 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 50.24 18.54 -36.80 48.17 18.09 -37.17 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 44.68 16.85 -37.12 43.29 17.21 -38.66 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 # 7 D 49 ASP B 80 ASP.? 22.03 C1 EDO B 189 D 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 D 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 49.28 8.80 -38.48 47.34 8.18 -39.14 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 48.58 -0.77 -33.67 48.18 -1.29 -35.04 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 8 3 # 8 D 49 ASP B 87 ASP^? 16.44 C1 EDO B 189 D 86 HIS B 76 HIS^? 9.10 C1 EDO B 189 D 250 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 54.34 6.71 -25.28 55.69 7.78 -26.49 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 9 3 # 9 D 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 D 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 D 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 10 3 # 10 D 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 D 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 D 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 39.93 2.83 -36.24 41.54 1.65 -37.01 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 48.58 -0.77 -33.67 48.18 -1.29 -35.04 2wwt_o03 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 10 hits 2wwt_o03 naa= 3 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 E 49 ASP A 54 ASP.? 20.27 C2 EDO A 189 E 86 HIS A 58 HIS.? 21.11 O2 MPD A 191 E 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo -36.18 24.97 18.78 -36.93 26.11 17.11 68.86 12.45 19.04 67.57 12.48 20.71 coo -36.85 29.32 15.06 -38.90 29.14 15.48 64.74 13.84 22.58 64.60 13.48 24.65 coo -44.49 29.68 13.98 -43.47 28.67 13.52 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 E 49 ASP A 80 ASP.? 21.91 O1 EDO A 189 E 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 E 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo -36.18 24.97 18.78 -36.93 26.11 17.11 68.63 22.07 21.16 67.50 22.56 22.86 coo -36.85 29.32 15.06 -38.90 29.14 15.48 65.85 25.32 24.26 66.00 24.92 26.31 coo -44.49 29.68 13.98 -43.47 28.67 13.52 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 # 3 E 49 ASP A 87 ASP^? 16.43 O1 EDO A 189 E 86 HIS A 76 HIS^? 9.12 O1 EDO A 189 E 250 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo -36.18 24.97 18.78 -36.93 26.11 17.11 63.41 29.58 11.55 64.59 31.41 11.51 coo -36.85 29.32 15.06 -38.90 29.14 15.48 65.00 24.12 7.67 66.83 23.12 7.94 coo -44.49 29.68 13.98 -43.47 28.67 13.52 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 4 3 # 4 E 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 E 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 E 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo -36.18 24.97 18.78 -36.93 26.11 17.11 60.01 27.52 25.19 61.63 28.83 24.67 coo -36.85 29.32 15.06 -38.90 29.14 15.48 65.85 25.32 24.26 66.00 24.92 26.31 coo -44.49 29.68 13.98 -43.47 28.67 13.52 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 # 5 E 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 E 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 E 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo -36.18 24.97 18.78 -36.93 26.11 17.11 60.01 27.52 25.19 61.63 28.83 24.67 coo -36.85 29.32 15.06 -38.90 29.14 15.48 65.85 25.32 24.26 66.00 24.92 26.31 coo -44.49 29.68 13.98 -43.47 28.67 13.52 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 6 3 # 6 E 49 ASP B 54 ASP.? 15.81 C2 EDO B 193 E 86 HIS B 58 HIS.? 15.15 C2 EDO B 193 E 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo -36.18 24.97 18.78 -36.93 26.11 17.11 50.24 18.54 -36.80 48.17 18.09 -37.17 coo -36.85 29.32 15.06 -38.90 29.14 15.48 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -44.49 29.68 13.98 -43.47 28.67 13.52 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 # 7 E 49 ASP B 80 ASP.? 22.03 C1 EDO B 189 E 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 E 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo -36.18 24.97 18.78 -36.93 26.11 17.11 49.28 8.80 -38.48 47.34 8.18 -39.14 coo -36.85 29.32 15.06 -38.90 29.14 15.48 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -44.49 29.68 13.98 -43.47 28.67 13.52 48.58 -0.77 -33.67 48.18 -1.29 -35.04 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 8 3 # 8 E 49 ASP B 87 ASP^? 16.44 C1 EDO B 189 E 86 HIS B 76 HIS^? 9.10 C1 EDO B 189 E 250 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo -36.18 24.97 18.78 -36.93 26.11 17.11 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo -36.85 29.32 15.06 -38.90 29.14 15.48 54.34 6.71 -25.28 55.69 7.78 -26.49 coo -44.49 29.68 13.98 -43.47 28.67 13.52 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 9 3 # 9 E 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 E 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 E 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo -36.18 24.97 18.78 -36.93 26.11 17.11 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -36.85 29.32 15.06 -38.90 29.14 15.48 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -44.49 29.68 13.98 -43.47 28.67 13.52 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 10 3 # 10 E 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 E 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 E 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo -36.18 24.97 18.78 -36.93 26.11 17.11 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -36.85 29.32 15.06 -38.90 29.14 15.48 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -44.49 29.68 13.98 -43.47 28.67 13.52 48.58 -0.77 -33.67 48.18 -1.29 -35.04 2wwt_o04 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 10 hits 2wwt_o04 naa= 3 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 F 49 ASP A 54 ASP.? 20.27 C2 EDO A 189 F 86 HIS A 58 HIS.? 21.11 O2 MPD A 191 F 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo -82.12 8.55 35.60 -81.93 9.84 37.19 68.86 12.45 19.04 67.57 12.48 20.71 coo -84.21 11.81 39.90 -82.43 12.70 39.26 64.74 13.84 22.58 64.60 13.48 24.65 coo -78.49 17.13 41.31 -79.25 15.85 41.61 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 F 49 ASP A 80 ASP.? 21.91 O1 EDO A 189 F 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 F 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo -82.12 8.55 35.60 -81.93 9.84 37.19 68.63 22.07 21.16 67.50 22.56 22.86 coo -84.21 11.81 39.90 -82.43 12.70 39.26 65.85 25.32 24.26 66.00 24.92 26.31 coo -78.49 17.13 41.31 -79.25 15.85 41.61 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 3 3 # 3 F 49 ASP A 87 ASP^? 16.43 O1 EDO A 189 F 86 HIS A 76 HIS^? 9.12 O1 EDO A 189 F 250 ALA A 62 ALA^? 8.76 O1 EDO A 189 coo -82.12 8.55 35.60 -81.93 9.84 37.19 63.41 29.58 11.55 64.59 31.41 11.51 coo -84.21 11.81 39.90 -82.43 12.70 39.26 65.00 24.12 7.67 66.83 23.12 7.94 coo -78.49 17.13 41.31 -79.25 15.85 41.61 62.10 18.98 10.31 60.83 19.17 11.13 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 4 3 # 4 F 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 F 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 F 250 ALA A 79 ALA^? 16.03 O1 EDO A 189 coo -82.12 8.55 35.60 -81.93 9.84 37.19 60.01 27.52 25.19 61.63 28.83 24.67 coo -84.21 11.81 39.90 -82.43 12.70 39.26 65.85 25.32 24.26 66.00 24.92 26.31 coo -78.49 17.13 41.31 -79.25 15.85 41.61 65.24 21.66 17.68 64.04 20.76 17.95 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 5 3 # 5 F 49 ASP A 97 ASP~? 21.13 O4 MPD A 191 F 86 HIS A 84 HIS.? 23.86 O4 MPD A 191 F 250 ALA A 92 ALA.? 22.21 O1 EDO A 189 coo -82.12 8.55 35.60 -81.93 9.84 37.19 60.01 27.52 25.19 61.63 28.83 24.67 coo -84.21 11.81 39.90 -82.43 12.70 39.26 65.85 25.32 24.26 66.00 24.92 26.31 coo -78.49 17.13 41.31 -79.25 15.85 41.61 65.16 31.38 17.96 65.64 31.84 19.31 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 6 3 # 6 F 49 ASP B 54 ASP.? 15.81 C2 EDO B 193 F 86 HIS B 58 HIS.? 15.15 C2 EDO B 193 F 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo -82.12 8.55 35.60 -81.93 9.84 37.19 50.24 18.54 -36.80 48.17 18.09 -37.17 coo -84.21 11.81 39.90 -82.43 12.70 39.26 44.68 16.85 -37.12 43.29 17.21 -38.66 coo -78.49 17.13 41.31 -79.25 15.85 41.61 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 7 3 # 7 F 49 ASP B 80 ASP.? 22.03 C1 EDO B 189 F 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 F 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo -82.12 8.55 35.60 -81.93 9.84 37.19 49.28 8.80 -38.48 47.34 8.18 -39.14 coo -84.21 11.81 39.90 -82.43 12.70 39.26 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -78.49 17.13 41.31 -79.25 15.85 41.61 48.58 -0.77 -33.67 48.18 -1.29 -35.04 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 8 3 # 8 F 49 ASP B 87 ASP^? 16.44 C1 EDO B 189 F 86 HIS B 76 HIS^? 9.10 C1 EDO B 189 F 250 ALA B 62 ALA^? 8.92 C1 EDO B 189 coo -82.12 8.55 35.60 -81.93 9.84 37.19 51.11 1.31 -27.58 52.14 -0.39 -28.24 coo -84.21 11.81 39.90 -82.43 12.70 39.26 54.34 6.71 -25.28 55.69 7.78 -26.49 coo -78.49 17.13 41.31 -79.25 15.85 41.61 50.28 11.76 -25.69 48.75 11.59 -25.62 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 9 3 # 9 F 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 F 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 F 250 ALA B 79 ALA^? 16.25 C1 EDO B 189 coo -82.12 8.55 35.60 -81.93 9.84 37.19 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -84.21 11.81 39.90 -82.43 12.70 39.26 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -78.49 17.13 41.31 -79.25 15.85 41.61 48.62 9.08 -33.69 47.43 9.95 -33.20 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 10 3 # 10 F 49 ASP B 97 ASP~? 21.83 C3 MPD B 194 F 86 HIS B 84 HIS.? 24.24 O2 MPD B 194 F 250 ALA B 92 ALA.? 22.43 C1 EDO B 189 coo -82.12 8.55 35.60 -81.93 9.84 37.19 39.93 2.83 -36.24 41.54 1.65 -37.01 coo -84.21 11.81 39.90 -82.43 12.70 39.26 45.35 5.36 -39.37 44.27 5.71 -41.13 coo -78.49 17.13 41.31 -79.25 15.85 41.61 48.58 -0.77 -33.67 48.18 -1.29 -35.04 2wwt_o05 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 10 hits 2wwt_o05 naa= 3 ULMN 3 3b21_o00 SHIGELLA FLEXNERI EFFECTOR OSPI user 1 3 # 1 A 62 CYH A 99 CYH.? 13.00 O4 MPD A 191 A 145 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 160 ASP A 80 ASP.? 21.91 O1 EDO A 189 coo 9.35 16.69 -4.00 10.08 14.08 -3.37 58.08 21.10 22.79 55.99 22.56 21.69 coo 12.85 24.01 -5.47 14.14 22.37 -5.23 65.85 25.32 24.26 66.00 24.92 26.31 coo 18.70 21.56 -2.53 17.15 21.34 -3.98 68.63 22.07 21.16 67.50 22.56 22.86 ULMN 3 3b21_o00 SHIGELLA FLEXNERI EFFECTOR OSPI user 2 3 # 2 A 62 CYH B 99 CYH.? 13.42 O2 MPD B 194 A 145 HIS B 84 HIS.? 24.24 O2 MPD B 194 A 160 ASP B 80 ASP.? 22.03 C1 EDO B 189 coo 9.35 16.69 -4.00 10.08 14.08 -3.37 39.68 9.38 -33.42 38.76 7.79 -31.29 coo 12.85 24.01 -5.47 14.14 22.37 -5.23 45.35 5.36 -39.37 44.27 5.71 -41.13 coo 18.70 21.56 -2.53 17.15 21.34 -3.98 49.28 8.80 -38.48 47.34 8.18 -39.14 3b21_o00 source 3B21 SHIGELLA FLEXNERI EFFECTOR OSPI : 2 hits 3b21_o00 naa= 3 ULMN 3 3hde_o01 LYSOZYME user 1 3 # 1 B 35 GLU A 21 GLU^? 11.03 O2 EDO A 190 B 44 ASP A 103 ASP^? 5.49 CM MPD A 191 B 50 THR A 110 THR~? 10.05 CM MPD A 191 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 52.20 9.76 4.74 52.41 10.59 6.66 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 51.58 16.40 16.66 49.70 15.49 16.18 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 54.00 11.37 14.40 53.43 13.29 13.57 ULMN 3 3hde_o01 LYSOZYME user 2 3 # 2 B 35 GLU B 21 GLU^? 11.62 C2 EDO B 189 B 44 ASP B 103 ASP^? 5.57 C5 MPD B 194 B 50 THR B 110 THR~? 9.89 C5 MPD B 194 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 45.31 20.78 -15.22 44.37 19.83 -16.87 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 37.95 13.84 -24.45 36.74 14.66 -22.84 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 41.08 19.02 -24.12 41.28 17.07 -23.15 3hde_o01 source 3HDE LYSOZYME : 2 hits 3hde_o01 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU A 21 GLU^? 11.03 O2 EDO A 190 C 44 ASP A 103 ASP^? 5.49 CM MPD A 191 C 50 THR A 110 THR~? 10.05 CM MPD A 191 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 52.20 9.76 4.74 52.41 10.59 6.66 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 51.58 16.40 16.66 49.70 15.49 16.18 coo 25.48 4.87 1.60 23.90 4.95 0.15 54.00 11.37 14.40 53.43 13.29 13.57 ULMN 3 3hde_o02 LYSOZYME user 2 3 # 2 C 35 GLU B 21 GLU^? 11.62 C2 EDO B 189 C 44 ASP B 103 ASP^? 5.57 C5 MPD B 194 C 50 THR B 110 THR~? 9.89 C5 MPD B 194 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 45.31 20.78 -15.22 44.37 19.83 -16.87 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 37.95 13.84 -24.45 36.74 14.66 -22.84 coo 25.48 4.87 1.60 23.90 4.95 0.15 41.08 19.02 -24.12 41.28 17.07 -23.15 3hde_o02 source 3HDE LYSOZYME : 2 hits 3hde_o02 naa= 3 ULMN 3 3nwu_o00 SERINE PROTEASE HTRA1 user 1 3 # 1 A 220 HIS A 65 HIS^? 6.20 C1 EDO A 189 A 250 ASP A 48 ASP^? -5.54 C1 EDO A 189s A 328 SER A 68 SER^? 14.83 O1 EDO A 189 coo -31.63 42.33 -9.10 -32.09 43.47 -7.39 58.30 21.39 -1.16 58.14 22.03 -3.16 coo -28.83 47.26 -8.07 -29.71 45.89 -9.37 57.58 16.65 0.08 56.71 16.10 -1.78 coo -31.38 44.75 -19.08 -33.61 43.88 -19.06 48.79 23.73 -3.35 48.63 25.48 -1.65 ULMN 3 3nwu_o00 SERINE PROTEASE HTRA1 user 2 3 # 2 A 220 HIS B 65 HIS^? -5.26 O1 EDO B 189s A 250 ASP B 48 ASP^? 5.72 O1 EDO B 189 A 328 SER B 68 SER^? -5.55 O2 EDO B 191s coo -31.63 42.33 -9.10 -32.09 43.47 -7.39 54.13 9.12 -14.50 55.15 8.45 -12.80 coo -28.83 47.26 -8.07 -29.71 45.89 -9.37 52.60 14.13 -14.82 53.00 14.96 -12.94 coo -31.38 44.75 -19.08 -33.61 43.88 -19.06 47.96 6.58 -6.86 46.83 4.83 -8.08 3nwu_o00 source 3NWU SERINE PROTEASE HTRA1 : 2 hits 3nwu_o00 naa= 3 ULMN 3 3nwu_o01 SERINE PROTEASE HTRA1 user 1 3 # 1 B 220 HIS A 65 HIS^? 6.20 C1 EDO A 189 B 250 ASP A 48 ASP^? -5.54 C1 EDO A 189s B 328 SER A 68 SER^? 14.83 O1 EDO A 189 coo -60.95 64.74 -17.31 -62.53 64.43 -18.66 58.30 21.39 -1.16 58.14 22.03 -3.16 coo -61.22 67.85 -22.15 -60.12 66.82 -20.67 57.58 16.65 0.08 56.71 16.10 -1.78 coo -50.80 64.58 -18.50 -51.05 62.31 -17.80 48.79 23.73 -3.35 48.63 25.48 -1.65 ULMN 3 3nwu_o01 SERINE PROTEASE HTRA1 user 2 3 # 2 B 220 HIS B 65 HIS^? -5.26 O1 EDO B 189s B 250 ASP B 48 ASP^? 5.72 O1 EDO B 189 B 328 SER B 68 SER^? -5.55 O2 EDO B 191s coo -60.95 64.74 -17.31 -62.53 64.43 -18.66 54.13 9.12 -14.50 55.15 8.45 -12.80 coo -61.22 67.85 -22.15 -60.12 66.82 -20.67 52.60 14.13 -14.82 53.00 14.96 -12.94 coo -50.80 64.58 -18.50 -51.05 62.31 -17.80 47.96 6.58 -6.86 46.83 4.83 -8.08 3nwu_o01 source 3NWU SERINE PROTEASE HTRA1 : 2 hits 3nwu_o01 naa= 3 ULMN 3 3nwu_o02 SERINE PROTEASE HTRA1 user 1 3 # 1 C 220 HIS A 65 HIS^? 6.20 C1 EDO A 189 C 250 ASP A 48 ASP^? -5.54 C1 EDO A 189s C 328 SER A 68 SER^? 14.83 O1 EDO A 189 coo -51.93 36.48 -40.55 -50.74 34.79 -40.19 58.30 21.39 -1.16 58.14 22.03 -3.16 coo -46.79 36.05 -43.01 -48.32 37.22 -42.10 57.58 16.65 0.08 56.71 16.10 -1.78 coo -50.01 46.48 -39.48 -50.98 46.14 -37.32 48.79 23.73 -3.35 48.63 25.48 -1.65 ULMN 3 3nwu_o02 SERINE PROTEASE HTRA1 user 2 3 # 2 C 220 HIS B 65 HIS^? -5.26 O1 EDO B 189s C 250 ASP B 48 ASP^? 5.72 O1 EDO B 189 C 328 SER B 68 SER^? -5.55 O2 EDO B 191s coo -51.93 36.48 -40.55 -50.74 34.79 -40.19 54.13 9.12 -14.50 55.15 8.45 -12.80 coo -46.79 36.05 -43.01 -48.32 37.22 -42.10 52.60 14.13 -14.82 53.00 14.96 -12.94 coo -50.01 46.48 -39.48 -50.98 46.14 -37.32 47.96 6.58 -6.86 46.83 4.83 -8.08 3nwu_o02 source 3NWU SERINE PROTEASE HTRA1 : 2 hits 3nwu_o02 naa= 3 ULMN 3 3o0p_o00 ILUS-RELATED SORTASE C OF GROUP B STuser 1 3 # 1 A 157 HIS A 84 HIS.? 23.86 O4 MPD A 191 A 219 CYH A 99 CYH.? 13.00 O4 MPD A 191 A 228 ARG A 129 ARG^? 14.04 O2 MPD A 191 coo -0.49 -3.10 19.35 -0.75 -2.22 21.24 65.85 25.32 24.26 66.00 24.92 26.31 coo 4.22 -5.75 23.73 3.56 -3.19 23.44 58.08 21.10 22.79 55.99 22.56 21.69 coo 7.51 -3.06 24.47 5.76 -1.31 26.31 54.99 23.34 25.48 52.76 24.40 27.34 3o0p_o00 source 3O0p ILUS-RELATED SORTASE C OF GROUP B STREPTOCOCCU: 1 hits 3o0p_o00 naa= 3 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 1 3 # 1 A 966 SER A 142 SER^? 11.36 O4 MPD A 191 A 967 ARG A 129 ARG^? 14.04 O2 MPD A 191 A 975 TYR A 132 TYR^? -3.92 O4 MPD A 191s coo 82.02 40.88 31.11 79.88 41.56 30.18 52.28 24.44 20.99 51.62 26.22 22.49 coo 78.94 44.79 33.75 77.86 47.56 32.82 54.99 23.34 25.48 52.76 24.40 27.34 coo 83.57 40.86 25.45 83.15 43.18 26.91 48.86 20.67 16.01 46.69 20.01 14.37 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 2 3 # 2 A 966 SER B 142 SER^? 12.79 C3 MPD B 194 A 967 ARG B 129 ARG^? 16.59 O2 MPD B 194 A 975 TYR B 132 TYR^? 4.23 O4 MPD B 194s coo 82.02 40.88 31.11 79.88 41.56 30.18 36.25 6.04 -28.61 35.21 4.32 -29.92 coo 78.94 44.79 33.75 77.86 47.56 32.82 35.59 7.18 -33.96 34.54 5.79 -36.47 coo 83.57 40.86 25.45 83.15 43.18 26.91 36.28 9.60 -22.40 35.59 10.15 -19.78 4dqk_o00 source 4DQK BIFUNCTIONAL P-450/NADPH-P450 REDUCTASE : 2 hits 4dqk_o00 naa= 3