*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 4 1a7u_c04 CHLOROPEROXIDASE T user 1 4 # 1 A 140 ALA A 20 ALA.? 1000.00 A 141 PRO A 19 PRO^? 1000.00 A 228 ASP A 51 ASP.? 1000.00 A 257 HIS A 57 HIS^? 1000.00 coo -3.17 33.71 41.15 -2.19 32.81 40.39 9.94 -3.44 -3.56 8.79 -2.53 -3.14 coo -4.29 30.56 43.91 -3.25 32.54 44.01 10.49 -7.03 -7.72 10.99 -4.87 -7.52 coo 2.03 38.95 28.44 3.60 38.60 29.83 5.22 5.50 6.84 4.14 5.83 5.06 coo 6.85 37.62 29.99 7.50 38.47 31.78 8.52 8.65 5.26 6.52 8.65 5.91 ULMN 4 1a7u_c04 CHLOROPEROXIDASE T user 2 4 # 2 A 140 ALA B 20 ALA.? 1000.00 A 141 PRO B 19 PRO^? 1000.00 A 228 ASP B 51 ASP.? 1000.00 A 257 HIS B 57 HIS^? 1000.00 coo -3.17 33.71 41.15 -2.19 32.81 40.39 45.51 6.74 -5.18 46.68 5.81 -4.87 coo -4.29 30.56 43.91 -3.25 32.54 44.01 44.13 10.35 -9.23 44.17 8.14 -9.03 coo 2.03 38.95 28.44 3.60 38.60 29.83 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 6.85 37.62 29.99 7.50 38.47 31.78 48.17 -5.80 3.42 50.22 -6.16 3.68 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 20 ALA.? 1000.00 B 141 PRO A 19 PRO^? 1000.00 B 228 ASP A 51 ASP.? 1000.00 B 257 HIS A 57 HIS^? 1000.00 coo 25.73 54.94 3.35 27.07 55.54 3.80 9.94 -3.44 -3.56 8.79 -2.53 -3.14 coo 25.81 51.10 5.29 24.88 53.11 5.69 10.49 -7.03 -7.72 10.99 -4.87 -7.52 coo 31.11 65.98 -3.92 31.07 66.41 -1.82 5.22 5.50 6.84 4.14 5.83 5.06 coo 32.76 68.02 0.70 31.21 68.44 2.05 8.52 8.65 5.26 6.52 8.65 5.91 1a7u_c05 source 1a7u CHLOROPEROXIDASE T : 1 hits 1a7u_c05 naa= 4 ULMN 4 1doo_c00 HEAT SHOCK LOCUS U user 1 4 # 1 A 1 THR A 63 THR~? 1000.00 A 33 LYS B 41 LYS.? 1000.00 A 48 GLY B 43 GLY.? 1000.00 A 124 SER A 61 SER~? 1000.00 coo 20.60 80.81 78.25 19.93 81.48 80.23 27.46 6.83 7.64 28.67 7.72 6.07 coo 24.21 79.63 86.31 23.19 81.94 80.55 33.89 10.98 6.00 33.54 14.13 10.34 coo 18.07 85.03 84.32 18.49 84.59 84.79 31.38 8.62 0.01 32.09 8.23 0.02 coo 15.73 80.26 75.45 17.95 80.97 75.03 22.92 4.42 5.79 24.11 6.33 4.86 1doo_c00 source 1doo HEAT SHOCK LOCUS U : 1 hits 1doo_c00 naa= 4 ULMN 4 1doo_c01 HEAT SHOCK LOCUS U user 1 4 # 1 B 1 THR A 63 THR~? 1000.00 B 33 LYS B 41 LYS.? 1000.00 B 48 GLY B 43 GLY.? 1000.00 B 124 SER A 61 SER~? 1000.00 coo 26.69 108.13 78.57 25.70 107.69 80.43 27.46 6.83 7.64 28.67 7.72 6.07 coo 30.17 110.91 86.31 27.32 111.03 80.63 33.89 10.98 6.00 33.54 14.13 10.34 coo 22.32 108.46 85.29 22.91 108.64 85.71 31.38 8.62 0.01 32.09 8.23 0.02 coo 24.65 103.43 76.04 24.59 105.78 75.60 22.92 4.42 5.79 24.11 6.33 4.86 1doo_c01 source 1doo HEAT SHOCK LOCUS U : 1 hits 1doo_c01 naa= 4 ULMN 4 1doo_c02 HEAT SHOCK LOCUS U user 1 4 # 1 C 1 THR A 63 THR~? 1000.00 C 33 LYS B 41 LYS.? 1000.00 C 48 GLY B 43 GLY.? 1000.00 C 124 SER A 61 SER~? 1000.00 coo -5.30 26.59 199.66 -4.98 26.05 197.57 27.46 6.83 7.64 28.67 7.72 6.07 coo -4.62 30.60 191.94 -3.32 28.83 197.07 33.89 10.98 6.00 33.54 14.13 10.34 coo -3.44 22.13 193.22 -3.30 22.85 192.94 31.38 8.62 0.01 32.09 8.23 0.02 coo -8.31 23.03 202.48 -6.18 24.15 202.80 22.92 4.42 5.79 24.11 6.33 4.86 1doo_c02 source 1doo HEAT SHOCK LOCUS U : 1 hits 1doo_c02 naa= 4 ULMN 4 1doo_c03 HEAT SHOCK LOCUS U user 1 4 # 1 D 1 THR A 63 THR~? 1000.00 D 33 LYS B 41 LYS.? 1000.00 D 48 GLY B 43 GLY.? 1000.00 D 124 SER A 61 SER~? 1000.00 coo 21.09 18.28 199.42 20.72 17.74 197.38 27.46 6.83 7.64 28.67 7.72 6.07 coo 25.54 20.08 191.91 24.21 17.77 197.54 33.89 10.98 6.00 33.54 14.13 10.34 coo 18.82 14.75 192.32 19.54 14.99 192.16 31.38 8.62 0.01 32.09 8.23 0.02 coo 16.26 18.98 201.87 18.32 18.00 202.67 22.92 4.42 5.79 24.11 6.33 4.86 1doo_c03 source 1doo HEAT SHOCK LOCUS U : 1 hits 1doo_c03 naa= 4 ULMN 4 1eag_c03 PEPTIDE INHIBITOR user 1 4 # 1 A 32 ASP A 99 ASP.? 1000.00 A 33 THR A 12 THR.? 1000.00 A 218 ASP A 100 ASP.? 1000.00 A 219 SER A 101 SER~? 1000.00 coo 47.22 22.34 8.57 45.16 22.02 9.13 6.07 5.96 -16.72 5.18 4.09 -17.03 coo 47.36 17.58 7.81 48.27 16.18 9.23 11.57 3.66 -19.37 9.57 4.28 -18.85 coo 44.05 16.99 12.67 44.05 18.89 11.74 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 48.58 18.17 13.13 49.43 18.91 10.97 12.85 8.31 -19.30 13.97 10.47 -19.16 1eag_c03 source 1eag PEPTIDE INHIBITOR : 1 hits 1eag_c03 naa= 4 ULMN 4 1iec_c02 CAPSID PROTEIN P40: ASSEMBLIN PROTEAuser 1 4 # 1 B 363 HIS A 112 HIS~? 1000.00 B 457 ALA A 105 ALA~? 1000.00 B 465 ARG B 131 ARG~? 1000.00 B 466 ARG B 130 ARG~? 1000.00 coo 66.07 12.30 58.15 65.21 10.91 59.48 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 69.52 5.37 56.42 70.10 6.70 55.92 17.52 7.34 -14.72 16.82 6.00 -14.93 coo 58.20 13.10 62.35 56.97 11.67 59.94 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 59.04 4.50 63.99 59.56 4.71 60.96 29.03 -0.22 -9.33 27.67 -2.50 -7.82 ULMN 4 1iec_c02 CAPSID PROTEIN P40: ASSEMBLIN PROTEAuser 2 4 # 2 B 363 HIS B 112 HIS~? 1000.00 B 457 ALA B 105 ALA~? 1000.00 B 465 ARG A 131 ARG~? 1000.00 B 466 ARG A 130 ARG~? 1000.00 coo 66.07 12.30 58.15 65.21 10.91 59.48 33.67 -6.31 -6.89 34.04 -8.28 -6.27 coo 69.52 5.37 56.42 70.10 6.70 55.92 37.19 -4.44 -15.65 37.88 -3.13 -15.98 coo 58.20 13.10 62.35 56.97 11.67 59.94 24.31 -6.42 -8.86 24.19 -9.09 -10.38 coo 59.04 4.50 63.99 59.56 4.71 60.96 26.14 3.04 -9.06 27.83 5.35 -7.98 1iec_c02 source 1iec CAPSID PROTEIN P40: ASSEMBLIN PROTEASE : 2 hits 1iec_c02 naa= 4 ULMN 4 1sme_c02 PLASMEPSIN II user 1 4 # 1 A 34 ASP A 99 ASP.? 1000.00 A 35 THR A 12 THR.? 1000.00 A 214 ASP A 100 ASP.? 1000.00 A 215 SER A 101 SER~? 1000.00 coo 51.75 60.57 19.10 52.05 60.90 21.19 6.07 5.96 -16.72 5.18 4.09 -17.03 coo 47.08 60.98 20.23 45.92 59.29 20.80 11.57 3.66 -19.37 9.57 4.28 -18.85 coo 48.59 58.89 25.78 50.13 59.74 24.61 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 48.32 55.94 22.14 47.80 57.34 20.24 12.85 8.31 -19.30 13.97 10.47 -19.16 1sme_c02 source 1sme PLASMEPSIN II : 1 hits 1sme_c02 naa= 4 ULMN 4 1sme_c03 PLASMEPSIN II user 1 4 # 1 B 34 ASP A 99 ASP.? 1000.00 B 35 THR A 12 THR.? 1000.00 B 214 ASP A 100 ASP.? 1000.00 B 215 SER A 101 SER~? 1000.00 coo 17.69 97.58 52.73 17.33 97.19 54.77 6.07 5.96 -16.72 5.18 4.09 -17.03 coo 15.50 101.62 53.68 13.37 101.87 53.41 11.57 3.66 -19.37 9.57 4.28 -18.85 coo 12.41 98.71 58.47 14.37 98.17 58.05 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 11.02 98.31 53.92 12.46 99.15 52.21 12.85 8.31 -19.30 13.97 10.47 -19.16 1sme_c03 source 1sme PLASMEPSIN II : 1 hits 1sme_c03 naa= 4 ULMN 3 1a0j_c12 TRYPSIN user 1 3 # 1 A 57 HIS A 34 HIS~? 1000.00 A 102 ASP A 33 ASP~? 1000.00 A 193 GLY A 29 GLY.? 1000.00 coo 25.57 41.22 61.68 24.18 39.98 62.50 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 22.33 45.48 59.73 23.35 43.67 60.06 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 22.57 32.23 64.13 21.98 32.82 64.22 10.16 4.95 14.00 10.62 4.41 13.60 ULMN 3 1a0j_c12 TRYPSIN user 2 3 # 2 A 57 HIS A 57 HIS^? 1000.00 A 102 ASP A 51 ASP.? 1000.00 A 193 GLY A 122 GLY.? 1000.00 coo 25.57 41.22 61.68 24.18 39.98 62.50 8.52 8.65 5.26 6.52 8.65 5.91 coo 22.33 45.48 59.73 23.35 43.67 60.06 5.22 5.50 6.84 4.14 5.83 5.06 coo 22.57 32.23 64.13 21.98 32.82 64.22 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1a0j_c12 TRYPSIN user 3 3 # 3 A 57 HIS B 34 HIS~? 1000.00 A 102 ASP B 33 ASP~? 1000.00 A 193 GLY B 29 GLY.? 1000.00 coo 25.57 41.22 61.68 24.18 39.98 62.50 41.87 5.60 12.60 42.81 7.10 11.48 coo 22.33 45.48 59.73 23.35 43.67 60.06 37.13 3.30 17.02 39.09 3.64 17.72 coo 22.57 32.23 64.13 21.98 32.82 64.22 47.41 -1.84 12.12 46.79 -1.48 11.78 1a0j_c12 source 1a0j TRYPSIN : 3 hits 1a0j_c12 naa= 3 ULMN 3 1a0j_c13 TRYPSIN user 1 3 # 1 B 57 HIS B 34 HIS~? 1000.00 B 102 ASP B 33 ASP~? 1000.00 B 193 GLY B 29 GLY.? 1000.00 coo 44.08 45.58 52.81 45.86 46.55 52.85 41.87 5.60 12.60 42.81 7.10 11.48 coo 43.04 44.75 47.18 43.31 45.51 49.13 37.13 3.30 17.02 39.09 3.64 17.72 coo 50.46 51.91 56.90 50.65 51.62 56.14 47.41 -1.84 12.12 46.79 -1.48 11.78 1a0j_c13 source 1a0j TRYPSIN : 1 hits 1a0j_c13 naa= 3 ULMN 3 1a0j_c14 TRYPSIN user 1 3 # 1 C 57 HIS A 34 HIS~? 1000.00 C 102 ASP A 33 ASP~? 1000.00 C 193 GLY A 29 GLY.? 1000.00 coo 34.37 41.18 73.21 34.04 43.09 73.87 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 34.89 38.34 78.12 35.11 39.59 76.42 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 35.43 51.03 72.12 35.20 50.72 72.87 10.16 4.95 14.00 10.62 4.41 13.60 ULMN 3 1a0j_c14 TRYPSIN user 2 3 # 2 C 57 HIS A 57 HIS^? 1000.00 C 102 ASP A 51 ASP.? 1000.00 C 193 GLY A 122 GLY.? 1000.00 coo 34.37 41.18 73.21 34.04 43.09 73.87 8.52 8.65 5.26 6.52 8.65 5.91 coo 34.89 38.34 78.12 35.11 39.59 76.42 5.22 5.50 6.84 4.14 5.83 5.06 coo 35.43 51.03 72.12 35.20 50.72 72.87 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1a0j_c14 TRYPSIN user 3 3 # 3 C 57 HIS B 34 HIS~? 1000.00 C 102 ASP B 33 ASP~? 1000.00 C 193 GLY B 29 GLY.? 1000.00 coo 34.37 41.18 73.21 34.04 43.09 73.87 41.87 5.60 12.60 42.81 7.10 11.48 coo 34.89 38.34 78.12 35.11 39.59 76.42 37.13 3.30 17.02 39.09 3.64 17.72 coo 35.43 51.03 72.12 35.20 50.72 72.87 47.41 -1.84 12.12 46.79 -1.48 11.78 1a0j_c14 source 1a0j TRYPSIN : 3 hits 1a0j_c14 naa= 3 ULMN 3 1a0j_c15 TRYPSIN user 1 3 # 1 D 57 HIS A 34 HIS~? 1000.00 D 102 ASP A 33 ASP~? 1000.00 D 193 GLY A 29 GLY.? 1000.00 coo 8.19 15.01 95.72 7.78 16.53 97.01 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 13.53 16.28 93.98 11.45 16.21 94.40 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 1.80 21.25 100.04 2.61 21.42 100.18 10.16 4.95 14.00 10.62 4.41 13.60 ULMN 3 1a0j_c15 TRYPSIN user 2 3 # 2 D 57 HIS A 57 HIS^? 1000.00 D 102 ASP A 51 ASP.? 1000.00 D 193 GLY A 122 GLY.? 1000.00 coo 8.19 15.01 95.72 7.78 16.53 97.01 8.52 8.65 5.26 6.52 8.65 5.91 coo 13.53 16.28 93.98 11.45 16.21 94.40 5.22 5.50 6.84 4.14 5.83 5.06 coo 1.80 21.25 100.04 2.61 21.42 100.18 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1a0j_c15 TRYPSIN user 3 3 # 3 D 57 HIS B 34 HIS~? 1000.00 D 102 ASP B 33 ASP~? 1000.00 D 193 GLY B 29 GLY.? 1000.00 coo 8.19 15.01 95.72 7.78 16.53 97.01 41.87 5.60 12.60 42.81 7.10 11.48 coo 13.53 16.28 93.98 11.45 16.21 94.40 37.13 3.30 17.02 39.09 3.64 17.72 coo 1.80 21.25 100.04 2.61 21.42 100.18 47.41 -1.84 12.12 46.79 -1.48 11.78 1a0j_c15 source 1a0j TRYPSIN : 3 hits 1a0j_c15 naa= 3 ULMN 3 1a41_c01 TOPOISOMERASE I user 1 3 # 1 223 ARG A 95 ARG^? 1000.00 265 HIS A 57 HIS^? 1000.00 274 TYR A 44 TYR.? 1000.00 coo -15.18 55.46 8.55 -14.82 52.98 10.38 10.85 10.51 -3.66 10.03 10.94 -0.73 coo -14.48 45.59 11.18 -14.02 47.49 10.42 8.52 8.65 5.26 6.52 8.65 5.91 coo 0.94 52.26 9.16 1.95 54.78 9.91 21.16 -2.49 -1.75 20.15 -3.76 -4.03 ULMN 3 1a41_c01 TOPOISOMERASE I user 2 3 # 2 223 ARG B 95 ARG^? 1000.00 265 HIS B 57 HIS^? 1000.00 274 TYR B 44 TYR.? 1000.00 coo -15.18 55.46 8.55 -14.82 52.98 10.38 45.21 -7.59 -5.33 46.47 -7.64 -2.54 coo -14.48 45.59 11.18 -14.02 47.49 10.42 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 0.94 52.26 9.16 1.95 54.78 9.91 34.70 5.59 -2.21 35.53 6.67 -4.65 1a41_c01 source 1a41 TOPOISOMERASE I : 2 hits 1a41_c01 naa= 3 ULMN 3 1a4y_c00 RIBONUCLEASE INHIBITOR user 1 3 # 1 B 13 HIS A 57 HIS^? 1000.00 B 40 LYS A 84 LYS~? 1000.00 B 114 HIS A 25 HIS.? 1000.00 coo 1.80 -13.66 41.28 2.01 -11.61 41.71 8.52 8.65 5.26 6.52 8.65 5.91 coo 8.72 -5.06 38.24 5.16 -8.30 41.14 14.81 6.41 15.81 10.01 5.61 18.56 coo -3.17 -9.07 46.16 -1.65 -8.08 47.22 10.94 -1.26 4.23 9.26 -2.11 5.16 1a4y_c00 source 1a4y RIBONUCLEASE INHIBITOR : 1 hits 1a4y_c00 naa= 3 ULMN 3 1a79_c00 TRNA ENDONUCLEASE user 1 3 # 1 A 115 TYR B 54 TYR.? 1000.00 A 125 HIS B 25 HIS.? 1000.00 A 156 LYS B 22 LYS~? 1000.00 coo 37.11 -19.03 58.81 39.12 -18.07 60.48 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 44.53 -22.25 60.75 45.90 -22.66 62.28 45.20 4.85 2.41 47.00 5.76 2.99 coo 46.42 -20.06 51.80 44.79 -19.05 56.86 42.49 11.08 -4.25 42.78 13.68 -10.05 1a79_c00 source 1a79 TRNA ENDONUCLEASE : 1 hits 1a79_c00 naa= 3 ULMN 3 1a79_c01 TRNA ENDONUCLEASE user 1 3 # 1 B 115 TYR B 54 TYR.? 1000.00 B 125 HIS B 25 HIS.? 1000.00 B 156 LYS B 22 LYS~? 1000.00 coo 52.78 -23.08 19.46 51.79 -21.72 17.22 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 45.10 -24.12 17.42 43.96 -24.36 15.67 45.20 4.85 2.41 47.00 5.76 2.99 coo 43.97 -19.59 26.02 45.10 -20.27 21.16 42.49 11.08 -4.25 42.78 13.68 -10.05 1a79_c01 source 1a79 TRNA ENDONUCLEASE : 1 hits 1a79_c01 naa= 3 ULMN 3 1a79_c02 TRNA ENDONUCLEASE user 1 3 # 1 C 115 TYR B 54 TYR.? 1000.00 C 125 HIS B 25 HIS.? 1000.00 C 156 LYS B 22 LYS~? 1000.00 coo 72.53 -8.86 48.33 70.89 -10.65 46.92 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 69.12 -16.18 50.82 68.25 -17.99 50.22 45.20 4.85 2.41 47.00 5.76 2.99 coo 64.47 -11.13 56.60 66.23 -12.62 51.81 42.49 11.08 -4.25 42.78 13.68 -10.05 1a79_c02 source 1a79 TRNA ENDONUCLEASE : 1 hits 1a79_c02 naa= 3 ULMN 3 1a79_c03 TRNA ENDONUCLEASE user 1 3 # 1 D 115 TYR B 54 TYR.? 1000.00 D 125 HIS B 25 HIS.? 1000.00 D 156 LYS B 22 LYS~? 1000.00 coo 54.10 1.42 85.16 54.14 4.17 85.62 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 61.27 5.43 85.32 62.73 6.38 86.49 45.20 4.85 2.41 47.00 5.76 2.99 coo 60.28 4.62 76.00 58.35 6.41 80.65 42.49 11.08 -4.25 42.78 13.68 -10.05 1a79_c03 source 1a79 TRNA ENDONUCLEASE : 1 hits 1a79_c03 naa= 3 ULMN 3 1ab4_c00 GYRASE A user 1 3 # 1 32 ARG A 131 ARG~? 1000.00 78 HIS B 112 HIS~? 1000.00 122 TYR B 54 TYR.? 1000.00 coo 48.32 72.26 30.89 48.69 69.28 31.53 24.31 -6.42 -8.86 24.19 -9.09 -10.38 coo 53.63 68.24 34.99 53.08 69.10 33.16 33.67 -6.31 -6.89 34.04 -8.28 -6.27 coo 75.01 61.87 32.93 75.34 59.26 31.96 51.35 3.44 -0.95 49.48 5.47 -1.36 ULMN 3 1ab4_c00 GYRASE A user 2 3 # 2 32 ARG B 131 ARG~? 1000.00 78 HIS A 112 HIS~? 1000.00 122 TYR A 54 TYR.? 1000.00 coo 48.32 72.26 30.89 48.69 69.28 31.53 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 53.63 68.24 34.99 53.08 69.10 33.16 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 75.01 61.87 32.93 75.34 59.26 31.96 4.84 -0.16 0.99 6.55 -2.28 0.31 ULMN 3 1ab4_c00 GYRASE A user 3 3 # 3 32 ARG B 131 ARG~? 1000.00 78 HIS A 112 HIS~? 1000.00 122 TYR A 123 TYR.? 1000.00 coo 48.32 72.26 30.89 48.69 69.28 31.53 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 53.63 68.24 34.99 53.08 69.10 33.16 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 75.01 61.87 32.93 75.34 59.26 31.96 1.57 3.68 -2.19 -0.67 4.60 -0.79 1ab4_c00 source 1ab4 GYRASE A : 3 hits 1ab4_c00 naa= 3 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 1 3 # 1 22 ASN A 90 ASN.? 1000.00 63 ARG A 91 ARG.? 1000.00 255 ARG A 95 ARG^? 1000.00 coo 42.10 13.02 11.14 41.85 11.12 10.23 19.16 11.48 3.60 19.40 12.95 2.08 coo 44.36 11.24 3.39 41.81 12.78 4.00 12.16 14.02 5.92 12.58 13.79 8.95 coo 38.40 3.83 10.26 40.02 6.30 9.25 10.85 10.51 -3.66 10.03 10.94 -0.73 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 2 3 # 2 22 ASN A 92 ASN.? 1000.00 63 ARG A 91 ARG.? 1000.00 255 ARG A 95 ARG^? 1000.00 coo 42.10 13.02 11.14 41.85 11.12 10.23 17.08 16.25 0.34 16.10 18.05 0.95 coo 44.36 11.24 3.39 41.81 12.78 4.00 12.16 14.02 5.92 12.58 13.79 8.95 coo 38.40 3.83 10.26 40.02 6.30 9.25 10.85 10.51 -3.66 10.03 10.94 -0.73 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 3 3 # 3 22 ASN A 119 ASN.? 1000.00 63 ARG A 97 ARG^? 1000.00 255 ARG A 95 ARG^? 1000.00 coo 42.10 13.02 11.14 41.85 11.12 10.23 3.72 2.77 -8.00 2.56 3.18 -6.27 coo 44.36 11.24 3.39 41.81 12.78 4.00 5.24 8.71 -12.77 3.46 8.32 -15.23 coo 38.40 3.83 10.26 40.02 6.30 9.25 10.85 10.51 -3.66 10.03 10.94 -0.73 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 4 3 # 4 22 ASN A 138 ASN~? 1000.00 63 ARG A 143 ARG.? 1000.00 255 ARG A 131 ARG~? 1000.00 coo 42.10 13.02 11.14 41.85 11.12 10.23 28.46 -6.88 -18.73 30.26 -8.01 -18.72 coo 44.36 11.24 3.39 41.81 12.78 4.00 29.36 -13.20 -19.11 27.25 -13.61 -16.94 coo 38.40 3.83 10.26 40.02 6.30 9.25 24.31 -6.42 -8.86 24.19 -9.09 -10.38 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 5 3 # 5 22 ASN B 90 ASN.? 1000.00 63 ARG B 91 ARG.? 1000.00 255 ARG B 95 ARG^? 1000.00 coo 42.10 13.02 11.14 41.85 11.12 10.23 37.32 -8.72 2.58 37.18 -10.17 1.03 coo 44.36 11.24 3.39 41.81 12.78 4.00 43.95 -11.42 5.31 46.09 -9.81 6.81 coo 38.40 3.83 10.26 40.02 6.30 9.25 45.21 -7.59 -5.33 46.47 -7.64 -2.54 ULMN 3 1aj0_c00 DIHYDROPTEROATE SYNTHASE user 6 3 # 6 22 ASN B 92 ASN.? 1000.00 63 ARG B 91 ARG.? 1000.00 255 ARG B 95 ARG^? 1000.00 coo 42.10 13.02 11.14 41.85 11.12 10.23 39.24 -13.20 -0.33 38.83 -14.34 -2.08 coo 44.36 11.24 3.39 41.81 12.78 4.00 43.95 -11.42 5.31 46.09 -9.81 6.81 coo 38.40 3.83 10.26 40.02 6.30 9.25 45.21 -7.59 -5.33 46.47 -7.64 -2.54 1aj0_c00 source 1aj0 DIHYDROPTEROATE SYNTHASE : 6 hits 1aj0_c00 naa= 3 ULMN 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 1 3 # 1 33 ASP A 51 ASP.? 1000.00 187 GLU A 86 GLU~? 1000.00 229 LYS A 84 LYS~? 1000.00 coo -52.57 56.60 47.75 -51.52 54.87 46.95 5.22 5.50 6.84 4.14 5.83 5.06 coo -45.08 48.37 46.81 -46.53 49.74 45.96 12.00 9.86 13.36 10.03 10.14 14.08 coo -47.40 44.36 48.48 -50.80 49.18 46.20 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 2 3 # 2 33 ASP B 51 ASP.? 1000.00 187 GLU B 86 GLU~? 1000.00 229 LYS B 84 LYS~? 1000.00 coo -52.57 56.60 47.75 -51.52 54.87 46.95 51.46 -2.33 4.55 52.23 -2.54 2.59 coo -45.08 48.37 46.81 -46.53 49.74 45.96 45.30 -6.76 11.82 47.29 -7.30 12.26 coo -47.40 44.36 48.48 -50.80 49.18 46.20 43.00 -3.73 14.55 45.69 -3.43 18.79 ULMN 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 3 3 # 3 33 ASP B 120 ASP.? 1000.00 187 GLU B 118 GLU^? 1000.00 229 LYS B 55 LYS.? 1000.00 coo -52.57 56.60 47.75 -51.52 54.87 46.95 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo -45.08 48.37 46.81 -46.53 49.74 45.96 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo -47.40 44.36 48.48 -50.80 49.18 46.20 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1ald_c00 source 1ald ALDOLASE A (E.C.4.1.2.13) : 3 hits 1ald_c00 naa= 3 ULMN 3 1am5_c04 PEPSIN user 1 3 # 1 32 ASP A 100 ASP.? 1000.00 35 SER A 101 SER~? 1000.00 215 ASP A 99 ASP.? 1000.00 coo -7.18 8.92 145.10 -8.77 8.81 143.59 11.24 8.50 -15.15 10.47 10.05 -13.93 coo -12.30 10.35 145.24 -10.75 8.55 145.88 12.85 8.31 -19.30 13.97 10.47 -19.16 coo -8.20 12.64 138.30 -8.86 10.97 139.38 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1am5_c04 PEPSIN user 2 3 # 2 32 ASP B 100 ASP.? 1000.00 35 SER B 101 SER~? 1000.00 215 ASP B 99 ASP.? 1000.00 coo -7.18 8.92 145.10 -8.77 8.81 143.59 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo -12.30 10.35 145.24 -10.75 8.55 145.88 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo -8.20 12.64 138.30 -8.86 10.97 139.38 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1am5_c04 source 1am5 PEPSIN : 2 hits 1am5_c04 naa= 3 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 3 # 1 E 33 ASP A 100 ASP.? 1000.00 E 36 SER A 101 SER~? 1000.00 E 213 ASP A 99 ASP.? 1000.00 coo 26.30 12.96 16.78 25.46 12.99 18.72 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 28.33 15.15 21.27 28.70 13.12 19.97 12.85 8.31 -19.30 13.97 10.47 -19.16 coo 20.15 16.04 19.79 21.65 14.49 19.86 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 2 3 # 2 E 33 ASP B 100 ASP.? 1000.00 E 36 SER B 101 SER~? 1000.00 E 213 ASP B 99 ASP.? 1000.00 coo 26.30 12.96 16.78 25.46 12.99 18.72 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 28.33 15.15 21.27 28.70 13.12 19.97 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo 20.15 16.04 19.79 21.65 14.49 19.86 48.62 -3.60 -18.80 49.23 -5.36 -17.81 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 45 SER.? 1000.00 A 292 ASP A 51 ASP.? 1000.00 A 322 HIS B 112 HIS~? 1000.00 coo 36.34 32.23 39.60 36.43 34.62 39.93 24.74 1.16 0.82 24.17 2.56 -1.08 coo 19.73 19.18 41.39 21.50 18.65 40.34 5.22 5.50 6.84 4.14 5.83 5.06 coo 41.69 45.14 46.60 41.78 47.19 46.18 33.67 -6.31 -6.89 34.04 -8.28 -6.27 ULMN 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 2 3 # 2 A 194 SER B 45 SER.? 1000.00 A 292 ASP B 51 ASP.? 1000.00 A 322 HIS A 112 HIS~? 1000.00 coo 36.34 32.23 39.60 36.43 34.62 39.93 31.32 1.70 0.10 32.27 0.26 -1.62 coo 19.73 19.18 41.39 21.50 18.65 40.34 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 41.69 45.14 46.60 41.78 47.19 46.18 22.04 9.33 -6.37 21.65 11.39 -6.50 1aql_c02 source 1aql BILE-SALT ACTIVATED LIPASE : 2 hits 1aql_c02 naa= 3 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 # 1 B 194 SER A 45 SER.? 1000.00 B 292 ASP A 51 ASP.? 1000.00 B 322 HIS B 112 HIS~? 1000.00 coo 35.42 71.28 22.94 36.24 69.06 22.37 24.74 1.16 0.82 24.17 2.56 -1.08 coo 24.74 78.07 5.59 24.32 79.03 7.46 5.22 5.50 6.84 4.14 5.83 5.06 coo 48.81 64.16 26.34 49.30 62.16 26.73 33.67 -6.31 -6.89 34.04 -8.28 -6.27 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 2 3 # 2 B 194 SER B 45 SER.? 1000.00 B 292 ASP B 51 ASP.? 1000.00 B 322 HIS A 112 HIS~? 1000.00 coo 35.42 71.28 22.94 36.24 69.06 22.37 31.32 1.70 0.10 32.27 0.26 -1.62 coo 24.74 78.07 5.59 24.32 79.03 7.46 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 48.81 64.16 26.34 49.30 62.16 26.73 22.04 9.33 -6.37 21.65 11.39 -6.50 1aql_c03 source 1aql BILE-SALT ACTIVATED LIPASE : 2 hits 1aql_c03 naa= 3 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 B 325 ARG A 91 ARG.? 1000.00 B 342 ASP A 51 ASP.? 1000.00 B 531 ARG A 95 ARG^? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 12.16 14.02 5.92 12.58 13.79 8.95 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 5.22 5.50 6.84 4.14 5.83 5.06 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 10.85 10.51 -3.66 10.03 10.94 -0.73 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 B 325 ARG B 74 ARG.? 1000.00 B 342 ASP A 33 ASP~? 1000.00 B 531 ARG B 79 ARG~? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 26.00 -6.26 25.33 29.00 -5.64 25.39 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 B 325 ARG B 79 ARG~? 1000.00 B 342 ASP B 67 ASP~? 1000.00 B 531 ARG B 74 ARG.? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 34.23 -7.42 21.18 34.10 -9.69 19.14 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 29.42 -8.55 10.33 29.02 -10.62 10.33 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 26.00 -6.26 25.33 29.00 -5.64 25.39 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 B 325 ARG B 91 ARG.? 1000.00 B 342 ASP B 51 ASP.? 1000.00 B 531 ARG B 95 ARG^? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 43.95 -11.42 5.31 46.09 -9.81 6.81 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 45.21 -7.59 -5.33 46.47 -7.64 -2.54 1asy_c00 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 4 hits 1asy_c00 naa= 3 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 A 325 ARG B 91 ARG.? 1000.00 A 342 ASP B 51 ASP.? 1000.00 A 531 ARG B 95 ARG^? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 43.95 -11.42 5.31 46.09 -9.81 6.81 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 45.21 -7.59 -5.33 46.47 -7.64 -2.54 1asy_c01 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 1 hits 1asy_c01 naa= 3 ULMN 3 1avf_c05 GASTRICSIN user 1 3 # 1 J 32 ASP A 100 ASP.? 1000.00 J 35 SER A 101 SER~? 1000.00 J 217 ASP A 99 ASP.? 1000.00 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 11.24 8.50 -15.15 10.47 10.05 -13.93 coo -40.93 -20.91 21.81 -38.85 -21.36 20.65 12.85 8.31 -19.30 13.97 10.47 -19.16 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1avf_c05 GASTRICSIN user 2 3 # 2 J 32 ASP B 100 ASP.? 1000.00 J 35 SER B 101 SER~? 1000.00 J 217 ASP B 99 ASP.? 1000.00 coo -37.57 -17.54 20.53 -38.55 -18.66 19.00 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo -40.93 -20.91 21.81 -38.85 -21.36 20.65 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo -43.00 -16.46 14.92 -41.37 -17.71 15.28 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1avf_c05 source 1avf GASTRICSIN : 2 hits 1avf_c05 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 124 PHE^? 1000.00 A 223 ASP A 51 ASP.? 1000.00 A 265 LYS A 84 LYS~? 1000.00 coo 39.74 52.86 65.74 41.15 55.14 66.52 9.49 1.99 -2.13 12.05 1.00 -2.65 coo 30.70 47.50 67.53 29.83 49.47 67.39 5.22 5.50 6.84 4.14 5.83 5.06 coo 19.99 54.53 64.11 20.55 58.78 68.33 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1ax4_c04 TRYPTOPHANASE user 2 3 # 2 A 130 PHE B 77 PHE~? 1000.00 A 223 ASP B 33 ASP~? 1000.00 A 265 LYS B 41 LYS.? 1000.00 coo 39.74 52.86 65.74 41.15 55.14 66.52 28.52 -0.47 19.68 26.27 -0.43 18.01 coo 30.70 47.50 67.53 29.83 49.47 67.39 37.13 3.30 17.02 39.09 3.64 17.72 coo 19.99 54.53 64.11 20.55 58.78 68.33 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1ax4_c04 TRYPTOPHANASE user 3 3 # 3 A 130 PHE B 124 PHE^? 1000.00 A 223 ASP B 51 ASP.? 1000.00 A 265 LYS B 84 LYS~? 1000.00 coo 39.74 52.86 65.74 41.15 55.14 66.52 46.31 1.48 -3.78 43.73 2.51 -4.11 coo 30.70 47.50 67.53 29.83 49.47 67.39 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 19.99 54.53 64.11 20.55 58.78 68.33 43.00 -3.73 14.55 45.69 -3.43 18.79 1ax4_c04 source 1ax4 TRYPTOPHANASE : 3 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 124 PHE^? 1000.00 B 223 ASP A 51 ASP.? 1000.00 B 265 LYS A 84 LYS~? 1000.00 coo 7.48 54.94 99.62 7.67 52.27 100.42 9.49 1.99 -2.13 12.05 1.00 -2.65 coo 10.43 61.66 91.81 9.80 60.04 90.61 5.22 5.50 6.84 4.14 5.83 5.06 coo 5.43 58.06 80.08 8.57 53.00 79.37 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1ax4_c05 TRYPTOPHANASE user 2 3 # 2 B 130 PHE B 77 PHE~? 1000.00 B 223 ASP B 33 ASP~? 1000.00 B 265 LYS B 41 LYS.? 1000.00 coo 7.48 54.94 99.62 7.67 52.27 100.42 28.52 -0.47 19.68 26.27 -0.43 18.01 coo 10.43 61.66 91.81 9.80 60.04 90.61 37.13 3.30 17.02 39.09 3.64 17.72 coo 5.43 58.06 80.08 8.57 53.00 79.37 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1ax4_c05 TRYPTOPHANASE user 3 3 # 3 B 130 PHE B 124 PHE^? 1000.00 B 223 ASP B 51 ASP.? 1000.00 B 265 LYS B 84 LYS~? 1000.00 coo 7.48 54.94 99.62 7.67 52.27 100.42 46.31 1.48 -3.78 43.73 2.51 -4.11 coo 10.43 61.66 91.81 9.80 60.04 90.61 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 5.43 58.06 80.08 8.57 53.00 79.37 43.00 -3.73 14.55 45.69 -3.43 18.79 1ax4_c05 source 1ax4 TRYPTOPHANASE : 3 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 124 PHE^? 1000.00 C 223 ASP A 51 ASP.? 1000.00 C 265 LYS A 84 LYS~? 1000.00 coo -6.55 73.45 23.60 -6.77 71.48 21.66 9.49 1.99 -2.13 12.05 1.00 -2.65 coo -9.52 75.74 33.62 -8.85 73.74 33.93 5.22 5.50 6.84 4.14 5.83 5.06 coo -4.44 67.20 42.32 -7.50 62.41 40.49 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1ax4_c06 TRYPTOPHANASE user 2 3 # 2 C 130 PHE B 77 PHE~? 1000.00 C 223 ASP B 33 ASP~? 1000.00 C 265 LYS B 41 LYS.? 1000.00 coo -6.55 73.45 23.60 -6.77 71.48 21.66 28.52 -0.47 19.68 26.27 -0.43 18.01 coo -9.52 75.74 33.62 -8.85 73.74 33.93 37.13 3.30 17.02 39.09 3.64 17.72 coo -4.44 67.20 42.32 -7.50 62.41 40.49 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1ax4_c06 TRYPTOPHANASE user 3 3 # 3 C 130 PHE B 124 PHE^? 1000.00 C 223 ASP B 51 ASP.? 1000.00 C 265 LYS B 84 LYS~? 1000.00 coo -6.55 73.45 23.60 -6.77 71.48 21.66 46.31 1.48 -3.78 43.73 2.51 -4.11 coo -9.52 75.74 33.62 -8.85 73.74 33.93 51.46 -2.33 4.55 52.23 -2.54 2.59 coo -4.44 67.20 42.32 -7.50 62.41 40.49 43.00 -3.73 14.55 45.69 -3.43 18.79 1ax4_c06 source 1ax4 TRYPTOPHANASE : 3 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 124 PHE^? 1000.00 D 223 ASP A 51 ASP.? 1000.00 D 265 LYS A 84 LYS~? 1000.00 coo -38.60 55.38 52.70 -40.06 57.72 53.04 9.49 1.99 -2.13 12.05 1.00 -2.65 coo -29.46 51.67 48.51 -28.63 53.31 49.56 5.22 5.50 6.84 4.14 5.83 5.06 coo -18.87 56.53 54.79 -19.47 62.22 53.03 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1ax4_c07 TRYPTOPHANASE user 2 3 # 2 D 130 PHE B 77 PHE~? 1000.00 D 223 ASP B 33 ASP~? 1000.00 D 265 LYS B 41 LYS.? 1000.00 coo -38.60 55.38 52.70 -40.06 57.72 53.04 28.52 -0.47 19.68 26.27 -0.43 18.01 coo -29.46 51.67 48.51 -28.63 53.31 49.56 37.13 3.30 17.02 39.09 3.64 17.72 coo -18.87 56.53 54.79 -19.47 62.22 53.03 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1ax4_c07 TRYPTOPHANASE user 3 3 # 3 D 130 PHE B 124 PHE^? 1000.00 D 223 ASP B 51 ASP.? 1000.00 D 265 LYS B 84 LYS~? 1000.00 coo -38.60 55.38 52.70 -40.06 57.72 53.04 46.31 1.48 -3.78 43.73 2.51 -4.11 coo -29.46 51.67 48.51 -28.63 53.31 49.56 51.46 -2.33 4.55 52.23 -2.54 2.59 coo -18.87 56.53 54.79 -19.47 62.22 53.03 43.00 -3.73 14.55 45.69 -3.43 18.79 1ax4_c07 source 1ax4 TRYPTOPHANASE : 3 hits 1ax4_c07 naa= 3 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 1 3 # 1 A 85 HIS B 25 HIS.? 1000.00 A 171 ARG B 91 ARG.? 1000.00 A 190 LYS B 55 LYS.? 1000.00 coo 22.59 2.26 43.22 21.17 3.47 42.27 45.20 4.85 2.41 47.00 5.76 2.99 coo 13.63 3.81 28.83 14.49 2.91 31.59 43.95 -11.42 5.31 46.09 -9.81 6.81 coo 24.97 7.47 37.69 21.24 10.69 35.89 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 2 3 # 2 A 85 HIS B 57 HIS^? 1000.00 A 171 ARG B 97 ARG^? 1000.00 A 190 LYS B 55 LYS.? 1000.00 coo 22.59 2.26 43.22 21.17 3.47 42.27 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 13.63 3.81 28.83 14.49 2.91 31.59 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 24.97 7.47 37.69 21.24 10.69 35.89 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1azy_c00 source 1azy THYMIDINE PHOSPHORYLASE : 2 hits 1azy_c00 naa= 3 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 1 3 # 1 B 85 HIS B 25 HIS.? 1000.00 B 171 ARG B 91 ARG.? 1000.00 B 190 LYS B 55 LYS.? 1000.00 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 45.20 4.85 2.41 47.00 5.76 2.99 coo 2.83 4.83 10.84 1.96 4.32 7.97 43.95 -11.42 5.31 46.09 -9.81 6.81 coo -8.96 9.04 2.88 -5.39 12.11 5.08 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 2 3 # 2 B 85 HIS B 57 HIS^? 1000.00 B 171 ARG B 97 ARG^? 1000.00 B 190 LYS B 55 LYS.? 1000.00 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 2.83 4.83 10.84 1.96 4.32 7.97 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo -8.96 9.04 2.88 -5.39 12.11 5.08 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1azy_c01 source 1azy THYMIDINE PHOSPHORYLASE : 2 hits 1azy_c01 naa= 3 ULMN 3 1bbs_c06 RENIN user 1 3 # 1 32 ASP A 100 ASP.? 1000.00 35 SER A 101 SER~? 1000.00 215 ASP A 99 ASP.? 1000.00 coo 61.19 45.85 78.73 62.86 45.48 77.48 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 66.00 46.17 80.29 64.31 47.92 79.91 12.85 8.31 -19.30 13.97 10.47 -19.16 coo 63.61 40.10 74.06 64.05 42.07 74.70 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1bbs_c06 RENIN user 2 3 # 2 32 ASP B 100 ASP.? 1000.00 35 SER B 101 SER~? 1000.00 215 ASP B 99 ASP.? 1000.00 coo 61.19 45.85 78.73 62.86 45.48 77.48 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 66.00 46.17 80.29 64.31 47.92 79.91 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo 63.61 40.10 74.06 64.05 42.07 74.70 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1bbs_c06 source 1bbs RENIN : 2 hits 1bbs_c06 naa= 3 ULMN 3 1bbs_c07 RENIN user 1 3 # 1 32 ASP A 100 ASP.? 1000.00 35 SER A 101 SER~? 1000.00 215 ASP A 99 ASP.? 1000.00 coo 61.19 45.85 78.73 62.86 45.48 77.48 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 66.00 46.17 80.29 64.31 47.92 79.91 12.85 8.31 -19.30 13.97 10.47 -19.16 coo 63.61 40.10 74.06 64.05 42.07 74.70 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1bbs_c07 RENIN user 2 3 # 2 32 ASP B 100 ASP.? 1000.00 35 SER B 101 SER~? 1000.00 215 ASP B 99 ASP.? 1000.00 coo 61.19 45.85 78.73 62.86 45.48 77.48 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 66.00 46.17 80.29 64.31 47.92 79.91 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo 63.61 40.10 74.06 64.05 42.07 74.70 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1bbs_c07 source 1bbs RENIN : 2 hits 1bbs_c07 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG A 79 ARG~? 1000.00 C 141 THR A 82 THR~? 1000.00 C 235 ASP B 33 ASP~? 1000.00 coo -5.79 67.26 36.83 -4.57 64.58 37.74 23.98 10.05 21.41 23.46 12.49 19.64 coo -6.81 68.31 28.28 -4.82 68.47 27.57 17.29 5.37 21.85 18.35 6.20 23.54 coo -13.01 70.96 47.58 -11.44 71.65 46.34 37.13 3.30 17.02 39.09 3.64 17.72 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 1 hits 1bd3_c02 naa= 3 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 B 137 ARG A 79 ARG~? 1000.00 B 141 THR A 82 THR~? 1000.00 B 235 ASP B 33 ASP~? 1000.00 coo 8.13 67.41 100.27 7.18 68.35 97.45 23.98 10.05 21.41 23.46 12.49 19.64 coo 8.28 67.78 108.81 6.22 67.65 109.43 17.29 5.37 21.85 18.35 6.20 23.54 coo 14.55 73.52 89.47 12.81 73.95 90.56 37.13 3.30 17.02 39.09 3.64 17.72 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 B 137 ARG B 79 ARG~? 1000.00 B 141 THR B 82 THR~? 1000.00 B 235 ASP A 33 ASP~? 1000.00 coo 8.13 67.41 100.27 7.18 68.35 97.45 34.23 -7.42 21.18 34.10 -9.69 19.14 coo 8.28 67.78 108.81 6.22 67.65 109.43 40.60 -2.71 20.52 40.47 -4.04 22.22 coo 14.55 73.52 89.47 12.81 73.95 90.56 20.33 -0.63 17.74 18.38 -0.89 18.50 1bd3_c03 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 2 hits 1bd3_c03 naa= 3 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 1 3 # 1 14 ASP A 51 ASP.? 1000.00 16 HIS A 57 HIS^? 1000.00 67 GLY A 43 GLY.? 1000.00 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 5.22 5.50 6.84 4.14 5.83 5.06 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 8.52 8.65 5.26 6.52 8.65 5.91 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 23.96 -5.83 0.31 23.37 -5.25 0.41 1be1_c02 source 1be1 GLUTAMATE MUTASE : 1 hits 1be1_c02 naa= 3 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 # 1 B 382 ARG A 74 ARG.? 1000.00 B 451 GLU A 78 GLU~? 1000.00 B 540 GLU A 76 GLU~? 1000.00 coo 82.21 41.07 119.14 83.95 40.66 116.59 32.14 8.48 25.15 29.08 8.40 25.40 coo 86.52 35.28 112.74 87.08 36.38 110.99 24.87 6.26 25.01 26.83 7.05 24.99 coo 83.38 41.19 112.55 85.47 40.59 112.72 28.32 10.24 22.30 27.15 11.94 22.76 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 2 3 # 2 B 382 ARG B 74 ARG.? 1000.00 B 451 GLU B 78 GLU~? 1000.00 B 540 GLU B 76 GLU~? 1000.00 coo 82.21 41.07 119.14 83.95 40.66 116.59 26.00 -6.26 25.33 29.00 -5.64 25.39 coo 86.52 35.28 112.74 87.08 36.38 110.99 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 83.38 41.19 112.55 85.47 40.59 112.72 29.60 -7.66 22.07 30.61 -9.52 22.20 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 3 3 # 3 B 382 ARG B 79 ARG~? 1000.00 B 451 GLU B 81 GLU~? 1000.00 B 540 GLU B 78 GLU~? 1000.00 coo 82.21 41.07 119.14 83.95 40.66 116.59 34.23 -7.42 21.18 34.10 -9.69 19.14 coo 86.52 35.28 112.74 87.08 36.38 110.99 38.01 0.54 22.61 37.05 1.66 24.13 coo 83.38 41.19 112.55 85.47 40.59 112.72 33.27 -3.24 24.53 31.20 -3.63 24.37 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 4 3 # 4 B 382 ARG B 91 ARG.? 1000.00 B 451 GLU B 87 GLU~? 1000.00 B 540 GLU B 86 GLU~? 1000.00 coo 82.21 41.07 119.14 83.95 40.66 116.59 43.95 -11.42 5.31 46.09 -9.81 6.81 coo 86.52 35.28 112.74 87.08 36.38 110.99 41.94 -8.78 14.57 41.73 -8.00 16.51 coo 83.38 41.19 112.55 85.47 40.59 112.72 45.30 -6.76 11.82 47.29 -7.30 12.26 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 4 hits 1bhg_c05 naa= 3 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 1 3 # 1 118 ARG B 97 ARG^? 1000.00 183 LYS B 14 LYS.? 1000.00 317 ARG B 130 ARG~? 1000.00 coo 76.57 109.19 73.41 73.86 110.26 72.16 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 82.09 117.51 66.37 80.60 114.32 71.44 44.48 3.32 -17.22 49.33 1.95 -20.50 coo 65.21 120.62 58.76 63.62 123.14 59.66 29.03 -0.22 -9.33 27.67 -2.50 -7.82 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 2 3 # 2 118 ARG B 131 ARG~? 1000.00 183 LYS B 22 LYS~? 1000.00 317 ARG B 95 ARG^? 1000.00 coo 76.57 109.19 73.41 73.86 110.26 72.16 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 82.09 117.51 66.37 80.60 114.32 71.44 42.49 11.08 -4.25 42.78 13.68 -10.05 coo 65.21 120.62 58.76 63.62 123.14 59.66 45.21 -7.59 -5.33 46.47 -7.64 -2.54 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 51 ASP.? 1000.00 A 759 HIS A 57 HIS^? 1000.00 A 810 SER A 53 SER.? 1000.00 coo 30.11 61.02 29.12 29.36 59.77 27.63 5.22 5.50 6.84 4.14 5.83 5.06 coo 30.94 56.62 25.28 29.94 54.94 26.14 8.52 8.65 5.26 6.52 8.65 5.91 coo 25.05 62.74 29.97 26.88 61.45 29.19 1.42 3.02 4.29 0.48 5.03 5.27 ULMN 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 2 3 # 2 A 757 ASP B 51 ASP.? 1000.00 A 759 HIS B 57 HIS^? 1000.00 A 810 SER B 53 SER.? 1000.00 coo 30.11 61.02 29.12 29.36 59.77 27.63 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 30.94 56.62 25.28 29.94 54.94 26.14 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 25.05 62.74 29.97 26.88 61.45 29.19 54.98 0.20 2.05 55.66 -1.87 3.14 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 51 ASP.? 1000.00 B 759 HIS A 57 HIS^? 1000.00 B 810 SER A 53 SER.? 1000.00 coo -2.30 64.08 6.41 -0.36 64.72 6.26 5.22 5.50 6.84 4.14 5.83 5.06 coo 1.96 66.39 3.07 2.10 68.48 3.58 8.52 8.65 5.26 6.52 8.65 5.91 coo -1.50 63.90 11.86 -1.31 64.33 9.52 1.42 3.02 4.29 0.48 5.03 5.27 ULMN 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 2 3 # 2 B 757 ASP B 51 ASP.? 1000.00 B 759 HIS B 57 HIS^? 1000.00 B 810 SER B 53 SER.? 1000.00 coo -2.30 64.08 6.41 -0.36 64.72 6.26 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 1.96 66.39 3.07 2.10 68.48 3.58 48.17 -5.80 3.42 50.22 -6.16 3.68 coo -1.50 63.90 11.86 -1.31 64.33 9.52 54.98 0.20 2.05 55.66 -1.87 3.14 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 29 GLY.? 1000.00 48 HIS A 34 HIS~? 1000.00 99 ASP A 33 ASP~? 1000.00 coo 12.38 5.55 24.25 13.27 5.59 24.39 10.16 4.95 14.00 10.62 4.41 13.60 coo 18.80 12.68 24.53 17.69 13.54 26.08 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 17.07 18.51 26.62 16.67 17.07 28.09 20.33 -0.63 17.74 18.38 -0.89 18.50 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 2 3 # 2 30 GLY B 29 GLY.? 1000.00 48 HIS B 34 HIS~? 1000.00 99 ASP B 33 ASP~? 1000.00 coo 12.38 5.55 24.25 13.27 5.59 24.39 47.41 -1.84 12.12 46.79 -1.48 11.78 coo 18.80 12.68 24.53 17.69 13.54 26.08 41.87 5.60 12.60 42.81 7.10 11.48 coo 17.07 18.51 26.62 16.67 17.07 28.09 37.13 3.30 17.02 39.09 3.64 17.72 1bp2_c00 source 1bp2 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSPHATIDE AC: 2 hits 1bp2_c00 naa= 3 ULMN 3 1bqc_c01 BETA-MANNANASE user 1 3 # 1 A 50 ARG A 74 ARG.? 1000.00 A 128 GLU A 78 GLU~? 1000.00 A 225 GLU A 76 GLU~? 1000.00 coo 38.56 19.11 14.83 37.12 21.00 16.76 32.14 8.48 25.15 29.08 8.40 25.40 coo 36.48 24.43 22.02 36.86 26.34 21.13 24.87 6.26 25.01 26.83 7.05 24.99 coo 40.16 23.71 17.01 38.52 24.96 17.40 28.32 10.24 22.30 27.15 11.94 22.76 ULMN 3 1bqc_c01 BETA-MANNANASE user 2 3 # 2 A 50 ARG B 74 ARG.? 1000.00 A 128 GLU B 78 GLU~? 1000.00 A 225 GLU B 76 GLU~? 1000.00 coo 38.56 19.11 14.83 37.12 21.00 16.76 26.00 -6.26 25.33 29.00 -5.64 25.39 coo 36.48 24.43 22.02 36.86 26.34 21.13 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 40.16 23.71 17.01 38.52 24.96 17.40 29.60 -7.66 22.07 30.61 -9.52 22.20 ULMN 3 1bqc_c01 BETA-MANNANASE user 3 3 # 3 A 50 ARG B 79 ARG~? 1000.00 A 128 GLU B 81 GLU~? 1000.00 A 225 GLU B 78 GLU~? 1000.00 coo 38.56 19.11 14.83 37.12 21.00 16.76 34.23 -7.42 21.18 34.10 -9.69 19.14 coo 36.48 24.43 22.02 36.86 26.34 21.13 38.01 0.54 22.61 37.05 1.66 24.13 coo 40.16 23.71 17.01 38.52 24.96 17.40 33.27 -3.24 24.53 31.20 -3.63 24.37 1bqc_c01 source 1bqc BETA-MANNANASE : 3 hits 1bqc_c01 naa= 3 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 # 1 A 82 HIS A 25 HIS.? 1000.00 A 168 ARG A 91 ARG.? 1000.00 A 187 LYS A 55 LYS.? 1000.00 coo 62.47 12.00 59.65 61.76 10.14 60.31 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 55.10 8.37 73.00 55.48 9.59 70.20 12.16 14.02 5.92 12.58 13.79 8.95 coo 66.76 10.09 66.23 61.80 8.06 65.82 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 2 3 # 2 A 82 HIS B 25 HIS.? 1000.00 A 168 ARG B 91 ARG.? 1000.00 A 187 LYS B 55 LYS.? 1000.00 coo 62.47 12.00 59.65 61.76 10.14 60.31 45.20 4.85 2.41 47.00 5.76 2.99 coo 55.10 8.37 73.00 55.48 9.59 70.20 43.95 -11.42 5.31 46.09 -9.81 6.81 coo 66.76 10.09 66.23 61.80 8.06 65.82 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 3 3 # 3 A 82 HIS B 57 HIS^? 1000.00 A 168 ARG B 97 ARG^? 1000.00 A 187 LYS B 55 LYS.? 1000.00 coo 62.47 12.00 59.65 61.76 10.14 60.31 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 55.10 8.37 73.00 55.48 9.59 70.20 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 66.76 10.09 66.23 61.80 8.06 65.82 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1brw_c00 source 1brw PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE : 3 hits 1brw_c00 naa= 3 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 1 3 # 1 A 109 PHE B 124 PHE^? 1000.00 A 205 ASP B 120 ASP.? 1000.00 A 236 LYS B 14 LYS.? 1000.00 coo 4.14 2.10 36.34 6.69 3.08 36.92 46.31 1.48 -3.78 43.73 2.51 -4.11 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 44.48 3.32 -17.22 49.33 1.95 -20.50 1bs0_c01 source 1bs0 8-AMINO-7-OXONANOATE SYNTHASE : 1 hits 1bs0_c01 naa= 3 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 136 GLN~? 1000.00 A 91 LEU A 137 LEU~? 1000.00 A 133 GLU A 132 GLU~? 1000.00 coo 43.58 43.67 66.73 42.32 42.78 68.15 21.21 -4.14 -20.77 20.06 -5.90 -21.11 coo 38.58 45.09 70.44 38.28 45.21 72.59 26.68 -1.97 -19.68 28.21 -0.69 -20.53 coo 44.05 36.87 70.65 43.15 38.64 69.97 19.13 -4.57 -11.72 19.25 -6.54 -12.50 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN B 136 GLN~? 1000.00 A 91 LEU B 137 LEU~? 1000.00 A 133 GLU B 132 GLU~? 1000.00 coo 43.58 43.67 66.73 42.32 42.78 68.15 33.13 6.48 -21.17 33.86 8.26 -22.09 coo 38.58 45.09 70.44 38.28 45.21 72.59 27.89 4.52 -20.06 26.08 3.47 -20.62 coo 44.05 36.87 70.65 43.15 38.64 69.97 35.47 7.40 -12.25 35.40 9.42 -12.89 1bs4_c00 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c00 naa= 3 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 # 1 B 550 GLN A 136 GLN~? 1000.00 B 591 LEU A 137 LEU~? 1000.00 B 633 GLU A 132 GLU~? 1000.00 coo 88.06 44.34 57.19 89.06 45.53 55.74 21.21 -4.14 -20.77 20.06 -5.90 -21.11 coo 86.70 48.66 52.61 87.15 48.69 50.51 26.68 -1.97 -19.68 28.21 -0.69 -20.53 coo 95.42 44.52 54.43 93.46 45.31 54.70 19.13 -4.57 -11.72 19.25 -6.54 -12.50 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 2 3 # 2 B 550 GLN B 136 GLN~? 1000.00 B 591 LEU B 137 LEU~? 1000.00 B 633 GLU B 132 GLU~? 1000.00 coo 88.06 44.34 57.19 89.06 45.53 55.74 33.13 6.48 -21.17 33.86 8.26 -22.09 coo 86.70 48.66 52.61 87.15 48.69 50.51 27.89 4.52 -20.06 26.08 3.47 -20.62 coo 95.42 44.52 54.43 93.46 45.31 54.70 35.47 7.40 -12.25 35.40 9.42 -12.89 1bs4_c01 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c01 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 136 GLN~? 1000.00 C1091 LEU A 137 LEU~? 1000.00 C1133 GLU A 132 GLU~? 1000.00 coo 68.29 34.44 43.03 66.67 34.74 44.37 21.21 -4.14 -20.77 20.06 -5.90 -21.11 coo 65.83 38.95 47.05 65.46 38.90 49.20 26.68 -1.97 -19.68 28.21 -0.69 -20.53 coo 63.14 29.39 46.25 63.84 31.31 45.74 19.13 -4.57 -11.72 19.25 -6.54 -12.50 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 # 2 C1050 GLN B 136 GLN~? 1000.00 C1091 LEU B 137 LEU~? 1000.00 C1133 GLU B 132 GLU~? 1000.00 coo 68.29 34.44 43.03 66.67 34.74 44.37 33.13 6.48 -21.17 33.86 8.26 -22.09 coo 65.83 38.95 47.05 65.46 38.90 49.20 27.89 4.52 -20.06 26.08 3.47 -20.62 coo 63.14 29.39 46.25 63.84 31.31 45.74 35.47 7.40 -12.25 35.40 9.42 -12.89 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c02 naa= 3 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 136 GLN~? 1000.00 A 91 LEU A 137 LEU~? 1000.00 A 133 GLU A 132 GLU~? 1000.00 coo 38.23 53.34 67.59 38.84 53.87 69.56 21.21 -4.14 -20.77 20.06 -5.90 -21.11 coo 35.40 53.22 73.30 35.37 54.87 74.74 26.68 -1.97 -19.68 28.21 -0.69 -20.53 coo 45.08 56.04 70.60 43.15 55.19 70.77 19.13 -4.57 -11.72 19.25 -6.54 -12.50 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN B 136 GLN~? 1000.00 A 91 LEU B 137 LEU~? 1000.00 A 133 GLU B 132 GLU~? 1000.00 coo 38.23 53.34 67.59 38.84 53.87 69.56 33.13 6.48 -21.17 33.86 8.26 -22.09 coo 35.40 53.22 73.30 35.37 54.87 74.74 27.89 4.52 -20.06 26.08 3.47 -20.62 coo 45.08 56.04 70.60 43.15 55.19 70.77 35.47 7.40 -12.25 35.40 9.42 -12.89 1bsj_c00 source 1bsj PEPTIDE DEFORMYLASE : 2 hits 1bsj_c00 naa= 3 ULMN 3 1bwp_c01 PLATELET-ACTIVATING FACTOR ACETYLHYDuser 1 3 # 1 104 ASN A 90 ASN.? 1000.00 192 ASP A 51 ASP.? 1000.00 195 HIS A 57 HIS^? 1000.00 coo 48.26 -8.64 25.32 50.17 -7.72 25.52 19.16 11.48 3.60 19.40 12.95 2.08 coo 56.18 0.19 32.76 56.16 -1.23 31.19 5.22 5.50 6.84 4.14 5.83 5.06 coo 56.71 -3.36 28.21 54.80 -3.08 27.37 8.52 8.65 5.26 6.52 8.65 5.91 ULMN 3 1bwp_c01 PLATELET-ACTIVATING FACTOR ACETYLHYDuser 2 3 # 2 104 ASN B 90 ASN.? 1000.00 192 ASP B 51 ASP.? 1000.00 195 HIS B 57 HIS^? 1000.00 coo 48.26 -8.64 25.32 50.17 -7.72 25.52 37.32 -8.72 2.58 37.18 -10.17 1.03 coo 56.18 0.19 32.76 56.16 -1.23 31.19 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 56.71 -3.36 28.21 54.80 -3.08 27.37 48.17 -5.80 3.42 50.22 -6.16 3.68 1bwp_c01 source 1bwp PLATELET-ACTIVATING FACTOR ACETYLHYDROLASE : 2 hits 1bwp_c01 naa= 3 ULMN 3 1c54_c00 RIBONUCLEASE SA user 1 3 # 1 A 54 GLU B 86 GLU~? 1000.00 A 65 ARG B 91 ARG.? 1000.00 A 85 HIS B 57 HIS^? 1000.00 coo -3.75 5.08 -16.45 -4.49 7.03 -16.67 45.30 -6.76 11.82 47.29 -7.30 12.26 coo -11.31 0.89 -21.51 -13.74 2.37 -20.15 43.95 -11.42 5.31 46.09 -9.81 6.81 coo -11.98 -0.40 -12.41 -12.65 1.37 -13.15 48.17 -5.80 3.42 50.22 -6.16 3.68 1c54_c00 source 1c54 RIBONUCLEASE SA : 1 hits 1c54_c00 naa= 3 ULMN 3 1c82_c02 HYALURONATE LYASE user 1 3 # 1 A 399 HIS A 25 HIS.? 1000.00 A 408 TYR A 54 TYR.? 1000.00 A 480 ARG A 97 ARG^? 1000.00 coo 13.02 -18.02 35.24 12.75 -16.25 34.15 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 7.81 -17.82 32.55 9.60 -15.69 32.78 4.84 -0.16 0.99 6.55 -2.28 0.31 coo -6.46 -13.31 26.85 -4.21 -11.25 27.13 5.24 8.71 -12.77 3.46 8.32 -15.23 ULMN 3 1c82_c02 HYALURONATE LYASE user 2 3 # 2 A 399 HIS B 25 HIS.? 1000.00 A 408 TYR B 54 TYR.? 1000.00 A 480 ARG B 97 ARG^? 1000.00 coo 13.02 -18.02 35.24 12.75 -16.25 34.15 45.20 4.85 2.41 47.00 5.76 2.99 coo 7.81 -17.82 32.55 9.60 -15.69 32.78 51.35 3.44 -0.95 49.48 5.47 -1.36 coo -6.46 -13.31 26.85 -4.21 -11.25 27.13 48.24 -7.34 -13.18 47.41 -10.11 -14.15 1c82_c02 source 1c82 HYALURONATE LYASE : 2 hits 1c82_c02 naa= 3 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 # 1 C 14 ASP A 51 ASP.? 1000.00 C 16 HIS A 57 HIS^? 1000.00 C 67 GLY A 29 GLY.? 1000.00 coo 10.04 44.27 88.44 9.47 42.32 89.03 5.22 5.50 6.84 4.14 5.83 5.06 coo 6.38 39.80 88.71 6.88 38.89 86.87 8.52 8.65 5.26 6.52 8.65 5.91 coo 17.63 42.50 89.25 18.11 42.29 88.64 10.16 4.95 14.00 10.62 4.41 13.60 1cb7_c07 source 1cb7 GLUTAMATE MUTASE : 1 hits 1cb7_c07 naa= 3 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 1 3 # 1 71 ARG B 130 ARG~? 1000.00 127 ARG A 130 ARG~? 1000.00 270 GLU A 132 GLU~? 1000.00 coo -0.83 25.63 1.57 0.97 28.05 0.90 29.03 -0.22 -9.33 27.67 -2.50 -7.82 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 26.14 3.04 -9.06 27.83 5.35 -7.98 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 19.13 -4.57 -11.72 19.25 -6.54 -12.50 1cbx_c01 source 1cbx CARBOXYPEPTIDASE A (E.C.3.4.17.1) COMPLEX WITH: 1 hits 1cbx_c01 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 120 ASP.? 1000.00 264 GLU A 132 GLU~? 1000.00 328 ASP A 100 ASP.? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 59.69 92.71 39.85 58.53 92.03 41.47 19.13 -4.57 -11.72 19.25 -6.54 -12.50 coo 45.39 90.72 40.63 45.07 89.14 41.90 11.24 8.50 -15.15 10.47 10.05 -13.93 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 1 hits 1cdg_c00 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 123 TYR.? 1000.00 A 173 ASP A 120 ASP.? 1000.00 C 48 ARG A 95 ARG^? 1000.00 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 24.35 4.55 25.11 25.94 3.23 25.53 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 10.85 10.51 -3.66 10.03 10.94 -0.73 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c00 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 123 TYR.? 1000.00 B 173 ASP A 120 ASP.? 1000.00 D 48 ARG A 95 ARG^? 1000.00 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 10.85 10.51 -3.66 10.03 10.94 -0.73 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c03 naa= 3 ULMN 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 # 1 A 1 ALA A 125 ALA^? 1000.00 A 74 ASN A 119 ASN.? 1000.00 A 75 GLY A 122 GLY.? 1000.00 coo -1.80 62.71 122.76 -1.88 63.70 123.92 7.49 0.49 -6.09 7.03 0.98 -7.46 coo 1.20 66.40 122.20 2.03 64.53 121.46 3.72 2.77 -8.00 2.56 3.18 -6.27 coo 4.68 65.84 125.52 4.11 65.60 126.05 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 2 3 # 2 A 1 ALA B 125 ALA^? 1000.00 A 74 ASN B 119 ASN.? 1000.00 A 75 GLY B 122 GLY.? 1000.00 coo -1.80 62.71 122.76 -1.88 63.70 123.92 47.74 3.13 -7.74 48.32 2.72 -9.09 coo 1.20 66.40 122.20 2.03 64.53 121.46 51.54 0.65 -10.87 52.83 0.79 -9.21 coo 4.68 65.84 125.52 4.11 65.60 126.05 52.80 -4.03 -7.10 52.92 -3.19 -7.11 1ct9_c04 source 1ct9 ASPARAGINE SYNTHETASE B : 2 hits 1ct9_c04 naa= 3 ULMN 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 # 1 B 1 ALA A 125 ALA^? 1000.00 B 74 ASN A 119 ASN.? 1000.00 B 75 GLY A 122 GLY.? 1000.00 coo 39.21 14.97 27.55 40.19 16.01 27.08 7.49 0.49 -6.09 7.03 0.98 -7.46 coo 43.06 12.94 25.74 42.26 11.81 27.44 3.72 2.77 -8.00 2.56 3.18 -6.27 coo 46.38 13.54 29.18 46.14 14.29 29.26 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 2 3 # 2 B 1 ALA B 125 ALA^? 1000.00 B 74 ASN B 119 ASN.? 1000.00 B 75 GLY B 122 GLY.? 1000.00 coo 39.21 14.97 27.55 40.19 16.01 27.08 47.74 3.13 -7.74 48.32 2.72 -9.09 coo 43.06 12.94 25.74 42.26 11.81 27.44 51.54 0.65 -10.87 52.83 0.79 -9.21 coo 46.38 13.54 29.18 46.14 14.29 29.26 52.80 -4.03 -7.10 52.92 -3.19 -7.11 1ct9_c05 source 1ct9 ASPARAGINE SYNTHETASE B : 2 hits 1ct9_c05 naa= 3 ULMN 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 # 1 C 1 ALA A 125 ALA^? 1000.00 C 74 ASN A 119 ASN.? 1000.00 C 75 GLY A 122 GLY.? 1000.00 coo 16.14 15.08 36.63 15.28 14.65 37.81 7.49 0.49 -6.09 7.03 0.98 -7.46 coo 11.60 16.13 36.70 12.80 17.74 35.96 3.72 2.77 -8.00 2.56 3.18 -6.27 coo 10.99 19.23 40.32 11.50 18.77 40.74 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 2 3 # 2 C 1 ALA B 125 ALA^? 1000.00 C 74 ASN B 119 ASN.? 1000.00 C 75 GLY B 122 GLY.? 1000.00 coo 16.14 15.08 36.63 15.28 14.65 37.81 47.74 3.13 -7.74 48.32 2.72 -9.09 coo 11.60 16.13 36.70 12.80 17.74 35.96 51.54 0.65 -10.87 52.83 0.79 -9.21 coo 10.99 19.23 40.32 11.50 18.77 40.74 52.80 -4.03 -7.10 52.92 -3.19 -7.11 1ct9_c06 source 1ct9 ASPARAGINE SYNTHETASE B : 2 hits 1ct9_c06 naa= 3 ULMN 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 # 1 D 1 ALA A 125 ALA^? 1000.00 D 74 ASN A 119 ASN.? 1000.00 D 75 GLY A 122 GLY.? 1000.00 coo -13.31 41.90 116.45 -13.05 40.39 116.25 7.49 0.49 -6.09 7.03 0.98 -7.46 coo -16.85 39.36 115.26 -17.55 40.58 116.90 3.72 2.77 -8.00 2.56 3.18 -6.27 coo -17.65 36.37 119.00 -16.85 36.22 119.00 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 2 3 # 2 D 1 ALA B 125 ALA^? 1000.00 D 74 ASN B 119 ASN.? 1000.00 D 75 GLY B 122 GLY.? 1000.00 coo -13.31 41.90 116.45 -13.05 40.39 116.25 47.74 3.13 -7.74 48.32 2.72 -9.09 coo -16.85 39.36 115.26 -17.55 40.58 116.90 51.54 0.65 -10.87 52.83 0.79 -9.21 coo -17.65 36.37 119.00 -16.85 36.22 119.00 52.80 -4.03 -7.10 52.92 -3.19 -7.11 1ct9_c07 source 1ct9 ASPARAGINE SYNTHETASE B : 2 hits 1ct9_c07 naa= 3 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 1 3 # 1 A 173 TYR B 31 TYR~? 1000.00 A 243 ASP A 33 ASP~? 1000.00 A 272 LYS A 84 LYS~? 1000.00 coo 2.03 68.31 21.46 0.66 68.36 23.90 42.93 0.52 17.54 44.90 -0.41 19.30 coo 16.93 55.67 9.65 17.16 54.23 11.19 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 14.13 45.79 13.40 14.25 49.41 18.30 14.81 6.41 15.81 10.01 5.61 18.56 1d7r_c02 source 1d7r 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYRUVATE) : 1 hits 1d7r_c02 naa= 3 ULMN 3 1db3_c01 GDP-MANNOSE 4,6-DEHYDRATASE user 1 3 # 1 A 132 THR A 52 THR.? 1000.00 A 156 TYR A 54 TYR.? 1000.00 A 160 LYS A 55 LYS.? 1000.00 coo 10.50 56.87 17.73 11.24 57.93 19.43 3.18 1.95 7.50 2.35 2.68 9.35 coo 11.64 63.07 23.95 11.76 62.47 21.20 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 5.78 61.30 21.65 8.04 62.89 17.54 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1db3_c01 GDP-MANNOSE 4,6-DEHYDRATASE user 2 3 # 2 A 132 THR A 52 THR.? 1000.00 A 156 TYR A 123 TYR.? 1000.00 A 160 LYS A 55 LYS.? 1000.00 coo 10.50 56.87 17.73 11.24 57.93 19.43 3.18 1.95 7.50 2.35 2.68 9.35 coo 11.64 63.07 23.95 11.76 62.47 21.20 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 5.78 61.30 21.65 8.04 62.89 17.54 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1db3_c01 GDP-MANNOSE 4,6-DEHYDRATASE user 3 3 # 3 A 132 THR B 52 THR.? 1000.00 A 156 TYR B 123 TYR.? 1000.00 A 160 LYS B 55 LYS.? 1000.00 coo 10.50 56.87 17.73 11.24 57.93 19.43 53.09 1.70 5.01 54.77 2.18 6.27 coo 11.64 63.07 23.95 11.76 62.47 21.20 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 5.78 61.30 21.65 8.04 62.89 17.54 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1db3_c01 source 1db3 GDP-MANNOSE 4,6-DEHYDRATASE : 3 hits 1db3_c01 naa= 3 ULMN 3 1ddj_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 57 HIS^? 1000.00 A 646 ASP A 51 ASP.? 1000.00 A 739 GLY A 122 GLY.? 1000.00 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 8.52 8.65 5.26 6.52 8.65 5.91 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 5.22 5.50 6.84 4.14 5.83 5.06 coo 11.37 50.89 2.29 11.05 51.63 2.25 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1ddj_c12 PLASMINOGEN user 2 3 # 2 A 603 HIS A 57 HIS^? 1000.00 A 646 ASP A 51 ASP.? 1000.00 A 739 GLY A 126 GLY^? 1000.00 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 8.52 8.65 5.26 6.52 8.65 5.91 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 5.22 5.50 6.84 4.14 5.83 5.06 coo 11.37 50.89 2.29 11.05 51.63 2.25 11.14 -0.54 -6.00 11.13 0.28 -6.00 1ddj_c12 source 1ddj PLASMINOGEN : 2 hits 1ddj_c12 naa= 3 ULMN 3 1ddj_c13 PLASMINOGEN user 1 3 # 1 B 603 HIS A 57 HIS^? 1000.00 B 646 ASP A 51 ASP.? 1000.00 B 739 GLY A 126 GLY^? 1000.00 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 8.52 8.65 5.26 6.52 8.65 5.91 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 5.22 5.50 6.84 4.14 5.83 5.06 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 11.14 -0.54 -6.00 11.13 0.28 -6.00 1ddj_c13 source 1ddj PLASMINOGEN : 1 hits 1ddj_c13 naa= 3 ULMN 3 1ddj_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 57 HIS^? 1000.00 C 646 ASP A 51 ASP.? 1000.00 C 739 GLY A 122 GLY.? 1000.00 coo 15.33 59.81 59.60 13.98 60.99 60.69 8.52 8.65 5.26 6.52 8.65 5.91 coo 16.06 55.72 54.73 15.97 56.49 56.70 5.22 5.50 6.84 4.14 5.83 5.06 coo 9.38 49.29 65.28 9.01 50.03 65.31 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1ddj_c14 PLASMINOGEN user 2 3 # 2 C 603 HIS A 57 HIS^? 1000.00 C 646 ASP A 51 ASP.? 1000.00 C 739 GLY A 126 GLY^? 1000.00 coo 15.33 59.81 59.60 13.98 60.99 60.69 8.52 8.65 5.26 6.52 8.65 5.91 coo 16.06 55.72 54.73 15.97 56.49 56.70 5.22 5.50 6.84 4.14 5.83 5.06 coo 9.38 49.29 65.28 9.01 50.03 65.31 11.14 -0.54 -6.00 11.13 0.28 -6.00 ULMN 3 1ddj_c14 PLASMINOGEN user 3 3 # 3 C 603 HIS B 34 HIS~? 1000.00 C 646 ASP B 33 ASP~? 1000.00 C 739 GLY A 71 GLY.? 1000.00 coo 15.33 59.81 59.60 13.98 60.99 60.69 41.87 5.60 12.60 42.81 7.10 11.48 coo 16.06 55.72 54.73 15.97 56.49 56.70 37.13 3.30 17.02 39.09 3.64 17.72 coo 9.38 49.29 65.28 9.01 50.03 65.31 30.77 13.13 20.09 31.38 12.92 19.53 ULMN 3 1ddj_c14 PLASMINOGEN user 4 3 # 4 C 603 HIS B 57 HIS^? 1000.00 C 646 ASP B 51 ASP.? 1000.00 C 739 GLY B 126 GLY^? 1000.00 coo 15.33 59.81 59.60 13.98 60.99 60.69 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 16.06 55.72 54.73 15.97 56.49 56.70 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 9.38 49.29 65.28 9.01 50.03 65.31 44.07 4.01 -7.42 44.15 3.19 -7.38 1ddj_c14 source 1ddj PLASMINOGEN : 4 hits 1ddj_c14 naa= 3 ULMN 3 1ddj_c15 PLASMINOGEN user 1 3 # 1 D 603 HIS A 57 HIS^? 1000.00 D 646 ASP A 51 ASP.? 1000.00 D 739 GLY A 126 GLY^? 1000.00 coo -30.51 33.83 43.05 -30.50 33.12 45.03 8.52 8.65 5.26 6.52 8.65 5.91 coo -25.73 33.05 39.28 -27.50 34.05 39.88 5.22 5.50 6.84 4.14 5.83 5.06 coo -27.66 47.32 40.66 -27.81 47.01 41.41 11.14 -0.54 -6.00 11.13 0.28 -6.00 ULMN 3 1ddj_c15 PLASMINOGEN user 2 3 # 2 D 603 HIS B 57 HIS^? 1000.00 D 646 ASP B 51 ASP.? 1000.00 D 739 GLY B 126 GLY^? 1000.00 coo -30.51 33.83 43.05 -30.50 33.12 45.03 48.17 -5.80 3.42 50.22 -6.16 3.68 coo -25.73 33.05 39.28 -27.50 34.05 39.88 51.46 -2.33 4.55 52.23 -2.54 2.59 coo -27.66 47.32 40.66 -27.81 47.01 41.41 44.07 4.01 -7.42 44.15 3.19 -7.38 1ddj_c15 source 1ddj PLASMINOGEN : 2 hits 1ddj_c15 naa= 3 ULMN 3 1de6_c01 L-RHAMNOSE ISOMERASE user 1 3 # 1 B 236 LYS A 55 LYS.? 1000.00 B 270 HIS A 57 HIS^? 1000.00 B 302 ASP A 51 ASP.? 1000.00 coo 38.57 31.68 38.20 37.57 30.37 32.27 5.21 5.66 1.43 0.49 8.11 0.22 coo 35.21 33.33 36.56 35.91 33.91 34.66 8.52 8.65 5.26 6.52 8.65 5.91 coo 33.27 29.36 33.58 33.68 31.25 32.69 5.22 5.50 6.84 4.14 5.83 5.06 1de6_c01 source 1de6 L-RHAMNOSE ISOMERASE : 1 hits 1de6_c01 naa= 3 ULMN 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 57 GLU A 118 GLU^? 1000.00 A 226 THR A 63 THR~? 1000.00 A 229 LYS B 41 LYS.? 1000.00 coo 9.66 102.78 70.07 9.79 101.18 71.42 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 7.24 97.46 49.60 8.11 95.69 48.80 27.46 6.83 7.64 28.67 7.72 6.07 coo 10.53 97.56 43.71 9.33 93.71 47.17 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 A 57 GLU B 76 GLU~? 1000.00 A 226 THR A 63 THR~? 1000.00 A 229 LYS B 41 LYS.? 1000.00 coo 9.66 102.78 70.07 9.79 101.18 71.42 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 7.24 97.46 49.60 8.11 95.69 48.80 27.46 6.83 7.64 28.67 7.72 6.07 coo 10.53 97.56 43.71 9.33 93.71 47.17 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 A 57 GLU B 81 GLU~? 1000.00 A 226 THR B 52 THR.? 1000.00 A 229 LYS B 55 LYS.? 1000.00 coo 9.66 102.78 70.07 9.79 101.18 71.42 38.01 0.54 22.61 37.05 1.66 24.13 coo 7.24 97.46 49.60 8.11 95.69 48.80 53.09 1.70 5.01 54.77 2.18 6.27 coo 10.53 97.56 43.71 9.33 93.71 47.17 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1dfo_c04 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 3 hits 1dfo_c04 naa= 3 ULMN 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 57 GLU A 118 GLU^? 1000.00 B 226 THR A 63 THR~? 1000.00 B 229 LYS B 41 LYS.? 1000.00 coo 15.90 87.61 49.61 13.92 86.96 49.36 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 20.74 95.78 68.68 19.29 96.84 69.83 27.46 6.83 7.64 28.67 7.72 6.07 coo 22.32 101.61 71.64 17.89 98.63 71.55 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 B 57 GLU B 76 GLU~? 1000.00 B 226 THR A 63 THR~? 1000.00 B 229 LYS B 41 LYS.? 1000.00 coo 15.90 87.61 49.61 13.92 86.96 49.36 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 20.74 95.78 68.68 19.29 96.84 69.83 27.46 6.83 7.64 28.67 7.72 6.07 coo 22.32 101.61 71.64 17.89 98.63 71.55 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 B 57 GLU B 81 GLU~? 1000.00 B 226 THR B 52 THR.? 1000.00 B 229 LYS B 55 LYS.? 1000.00 coo 15.90 87.61 49.61 13.92 86.96 49.36 38.01 0.54 22.61 37.05 1.66 24.13 coo 20.74 95.78 68.68 19.29 96.84 69.83 53.09 1.70 5.01 54.77 2.18 6.27 coo 22.32 101.61 71.64 17.89 98.63 71.55 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1dfo_c05 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 3 hits 1dfo_c05 naa= 3 ULMN 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 57 GLU A 118 GLU^? 1000.00 C 226 THR A 63 THR~? 1000.00 C 229 LYS B 41 LYS.? 1000.00 coo 5.43 40.40 61.63 4.27 41.99 60.90 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 22.16 45.88 73.63 23.23 47.70 73.25 27.46 6.83 7.64 28.67 7.72 6.07 coo 28.90 45.91 73.55 25.22 49.72 72.97 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 C 57 GLU B 76 GLU~? 1000.00 C 226 THR A 63 THR~? 1000.00 C 229 LYS B 41 LYS.? 1000.00 coo 5.43 40.40 61.63 4.27 41.99 60.90 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 22.16 45.88 73.63 23.23 47.70 73.25 27.46 6.83 7.64 28.67 7.72 6.07 coo 28.90 45.91 73.55 25.22 49.72 72.97 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 C 57 GLU B 81 GLU~? 1000.00 C 226 THR B 52 THR.? 1000.00 C 229 LYS B 55 LYS.? 1000.00 coo 5.43 40.40 61.63 4.27 41.99 60.90 38.01 0.54 22.61 37.05 1.66 24.13 coo 22.16 45.88 73.63 23.23 47.70 73.25 53.09 1.70 5.01 54.77 2.18 6.27 coo 28.90 45.91 73.55 25.22 49.72 72.97 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1dfo_c06 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 3 hits 1dfo_c06 naa= 3 ULMN 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 57 GLU A 118 GLU^? 1000.00 D 226 THR A 63 THR~? 1000.00 D 229 LYS B 41 LYS.? 1000.00 coo 26.07 55.89 66.14 25.33 56.50 68.01 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 11.79 47.62 52.67 10.10 46.51 53.39 27.46 6.83 7.64 28.67 7.72 6.07 coo 10.05 41.79 49.80 7.94 44.71 53.76 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 D 57 GLU B 76 GLU~? 1000.00 D 226 THR A 63 THR~? 1000.00 D 229 LYS B 41 LYS.? 1000.00 coo 26.07 55.89 66.14 25.33 56.50 68.01 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 11.79 47.62 52.67 10.10 46.51 53.39 27.46 6.83 7.64 28.67 7.72 6.07 coo 10.05 41.79 49.80 7.94 44.71 53.76 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 D 57 GLU B 81 GLU~? 1000.00 D 226 THR B 52 THR.? 1000.00 D 229 LYS B 55 LYS.? 1000.00 coo 26.07 55.89 66.14 25.33 56.50 68.01 38.01 0.54 22.61 37.05 1.66 24.13 coo 11.79 47.62 52.67 10.10 46.51 53.39 53.09 1.70 5.01 54.77 2.18 6.27 coo 10.05 41.79 49.80 7.94 44.71 53.76 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1dfo_c07 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 3 hits 1dfo_c07 naa= 3 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 123 HIS A 112 HIS~? 1000.00 A 200 ASP A 67 ASP~? 1000.00 A 229 LYS A 84 LYS~? 1000.00 coo 1.13 77.49 40.64 0.62 75.57 39.98 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 0.84 91.24 49.01 2.91 91.61 49.23 27.47 11.30 10.36 28.38 13.14 9.88 coo 10.53 97.56 43.71 9.33 93.71 47.17 14.81 6.41 15.81 10.01 5.61 18.56 1dfo_c12 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c12 naa= 3 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 123 HIS A 112 HIS~? 1000.00 B 200 ASP A 67 ASP~? 1000.00 B 229 LYS A 84 LYS~? 1000.00 coo 9.24 94.26 88.22 8.02 94.07 89.92 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 17.54 90.31 75.01 17.17 92.01 73.80 27.47 11.30 10.36 28.38 13.14 9.88 coo 22.32 101.61 71.64 17.89 98.63 71.55 14.81 6.41 15.81 10.01 5.61 18.56 1dfo_c13 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c13 naa= 3 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 123 HIS A 112 HIS~? 1000.00 C 200 ASP A 67 ASP~? 1000.00 C 229 LYS A 84 LYS~? 1000.00 coo 26.77 65.84 83.49 27.06 67.76 84.27 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 19.52 52.01 79.59 20.28 51.65 77.65 27.47 11.30 10.36 28.38 13.14 9.88 coo 28.90 45.91 73.55 25.22 49.72 72.97 14.81 6.41 15.81 10.01 5.61 18.56 1dfo_c14 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c14 naa= 3 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 123 HIS A 112 HIS~? 1000.00 D 200 ASP A 67 ASP~? 1000.00 D 229 LYS A 84 LYS~? 1000.00 coo -10.90 48.74 53.41 -12.98 48.90 53.67 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 4.60 52.95 52.50 5.57 51.29 53.40 27.47 11.30 10.36 28.38 13.14 9.88 coo 10.05 41.79 49.80 7.94 44.71 53.76 14.81 6.41 15.81 10.01 5.61 18.56 1dfo_c15 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c15 naa= 3 ULMN 3 1do8_c00 MALIC ENZYME user 1 3 # 1 A 112 TYR A 54 TYR.? 1000.00 A 183 LYS A 55 LYS.? 1000.00 A 278 ASP A 121 ASP.? 1000.00 coo 19.43 18.53 42.32 17.66 18.80 40.15 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 21.92 15.80 36.19 17.64 19.44 36.35 5.21 5.66 1.43 0.49 8.11 0.22 coo 15.46 19.03 31.40 15.01 18.25 33.31 -0.75 5.29 -6.38 -2.02 4.12 -7.60 ULMN 3 1do8_c00 MALIC ENZYME user 2 3 # 2 A 112 TYR B 54 TYR.? 1000.00 A 183 LYS B 55 LYS.? 1000.00 A 278 ASP B 121 ASP.? 1000.00 coo 19.43 18.53 42.32 17.66 18.80 40.15 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 21.92 15.80 36.19 17.64 19.44 36.35 50.86 -2.31 -0.81 56.59 -4.06 -2.86 coo 15.46 19.03 31.40 15.01 18.25 33.31 55.83 -1.01 -8.85 57.04 -0.03 -10.25 1do8_c00 source 1do8 MALIC ENZYME : 2 hits 1do8_c00 naa= 3 ULMN 3 1do8_c01 MALIC ENZYME user 1 3 # 1 B 112 TYR A 54 TYR.? 1000.00 B 183 LYS A 55 LYS.? 1000.00 B 278 ASP A 121 ASP.? 1000.00 coo 58.62 15.99 58.34 60.98 14.60 58.93 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 60.11 10.60 53.63 62.59 10.74 58.67 5.21 5.66 1.43 0.49 8.11 0.22 coo 66.50 7.32 58.45 66.26 9.42 58.23 -0.75 5.29 -6.38 -2.02 4.12 -7.60 ULMN 3 1do8_c01 MALIC ENZYME user 2 3 # 2 B 112 TYR B 54 TYR.? 1000.00 B 183 LYS B 55 LYS.? 1000.00 B 278 ASP B 121 ASP.? 1000.00 coo 58.62 15.99 58.34 60.98 14.60 58.93 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 60.11 10.60 53.63 62.59 10.74 58.67 50.86 -2.31 -0.81 56.59 -4.06 -2.86 coo 66.50 7.32 58.45 66.26 9.42 58.23 55.83 -1.01 -8.85 57.04 -0.03 -10.25 1do8_c01 source 1do8 MALIC ENZYME : 2 hits 1do8_c01 naa= 3 ULMN 3 1do8_c02 MALIC ENZYME user 1 3 # 1 C 112 TYR A 54 TYR.? 1000.00 C 183 LYS A 55 LYS.? 1000.00 C 278 ASP A 121 ASP.? 1000.00 coo 76.02 -16.57 8.89 78.24 -15.17 9.87 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 74.18 -11.17 13.22 79.08 -11.19 10.47 5.21 5.66 1.43 0.49 8.11 0.22 coo 82.27 -7.93 13.54 81.93 -10.04 13.72 -0.75 5.29 -6.38 -2.02 4.12 -7.60 ULMN 3 1do8_c02 MALIC ENZYME user 2 3 # 2 C 112 TYR B 54 TYR.? 1000.00 C 183 LYS B 55 LYS.? 1000.00 C 278 ASP B 121 ASP.? 1000.00 coo 76.02 -16.57 8.89 78.24 -15.17 9.87 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 74.18 -11.17 13.22 79.08 -11.19 10.47 50.86 -2.31 -0.81 56.59 -4.06 -2.86 coo 82.27 -7.93 13.54 81.93 -10.04 13.72 55.83 -1.01 -8.85 57.04 -0.03 -10.25 1do8_c02 source 1do8 MALIC ENZYME : 2 hits 1do8_c02 naa= 3 ULMN 3 1do8_c03 MALIC ENZYME user 1 3 # 1 D 112 TYR A 54 TYR.? 1000.00 D 183 LYS A 55 LYS.? 1000.00 D 278 ASP A 121 ASP.? 1000.00 coo 35.64 -19.32 -3.24 32.92 -19.55 -2.64 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 33.51 -16.63 3.10 30.11 -20.23 0.26 5.21 5.66 1.43 0.49 8.11 0.22 coo 25.62 -19.94 2.86 26.44 -19.16 1.09 -0.75 5.29 -6.38 -2.02 4.12 -7.60 ULMN 3 1do8_c03 MALIC ENZYME user 2 3 # 2 D 112 TYR B 54 TYR.? 1000.00 D 183 LYS B 55 LYS.? 1000.00 D 278 ASP B 121 ASP.? 1000.00 coo 35.64 -19.32 -3.24 32.92 -19.55 -2.64 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 33.51 -16.63 3.10 30.11 -20.23 0.26 50.86 -2.31 -0.81 56.59 -4.06 -2.86 coo 25.62 -19.94 2.86 26.44 -19.16 1.09 55.83 -1.01 -8.85 57.04 -0.03 -10.25 1do8_c03 source 1do8 MALIC ENZYME : 2 hits 1do8_c03 naa= 3 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 # 1 E 57 HIS B 34 HIS~? 1000.00 E 102 ASP B 33 ASP~? 1000.00 E 193 GLY B 29 GLY.? 1000.00 coo 11.39 26.86 25.95 9.85 26.64 27.36 41.87 5.60 12.60 42.81 7.10 11.48 coo 10.90 32.83 25.96 10.83 30.68 25.98 37.13 3.30 17.02 39.09 3.64 17.72 coo 4.57 20.60 30.29 4.74 21.36 30.66 47.41 -1.84 12.12 46.79 -1.48 11.78 1ds2_c02 source 1ds2 PROTEINASE B (SGPB : 1 hits 1ds2_c02 naa= 3 ULMN 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 # 1 B 141 GLY A 71 GLY.? 1000.00 B 144 GLU A 76 GLU~? 1000.00 B 164 GLU A 73 GLU.? 1000.00 coo 88.87 114.43 152.30 88.45 115.15 152.32 30.77 13.13 20.09 31.38 12.92 19.53 coo 85.20 111.99 152.05 86.60 110.89 150.91 28.32 10.24 22.30 27.15 11.94 22.76 coo 88.14 113.46 145.73 86.79 113.92 147.30 35.24 14.24 25.23 35.01 14.32 27.33 ULMN 3 1dub_c13 2-ENOYL-COA HYDRATASE user 2 3 # 2 B 141 GLY B 71 GLY.? 1000.00 B 144 GLU B 76 GLU~? 1000.00 B 164 GLU B 73 GLU.? 1000.00 coo 88.87 114.43 152.30 88.45 115.15 152.32 26.80 -10.68 19.61 26.11 -10.43 19.23 coo 85.20 111.99 152.05 86.60 110.89 150.91 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 88.14 113.46 145.73 86.79 113.92 147.30 23.38 -12.14 25.82 23.41 -12.13 27.93 1dub_c13 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c13 naa= 3 ULMN 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 # 1 C 141 GLY A 71 GLY.? 1000.00 C 144 GLU A 76 GLU~? 1000.00 C 164 GLU A 73 GLU.? 1000.00 coo 56.28 104.55 135.84 56.09 105.34 136.05 30.77 13.13 20.09 31.38 12.92 19.53 coo 58.46 103.90 139.48 57.57 102.00 139.16 28.32 10.24 22.30 27.15 11.94 22.76 coo 51.71 102.03 140.09 53.02 103.62 140.54 35.24 14.24 25.23 35.01 14.32 27.33 ULMN 3 1dub_c14 2-ENOYL-COA HYDRATASE user 2 3 # 2 C 141 GLY B 71 GLY.? 1000.00 C 144 GLU B 76 GLU~? 1000.00 C 164 GLU B 73 GLU.? 1000.00 coo 56.28 104.55 135.84 56.09 105.34 136.05 26.80 -10.68 19.61 26.11 -10.43 19.23 coo 58.46 103.90 139.48 57.57 102.00 139.16 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 51.71 102.03 140.09 53.02 103.62 140.54 23.38 -12.14 25.82 23.41 -12.13 27.93 1dub_c14 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c14 naa= 3 ULMN 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 # 1 D 141 GLY A 71 GLY.? 1000.00 D 144 GLU A 76 GLU~? 1000.00 D 164 GLU A 73 GLU.? 1000.00 coo 86.19 80.64 132.77 86.38 79.85 132.93 30.77 13.13 20.09 31.38 12.92 19.53 coo 84.75 81.24 136.88 85.62 83.14 136.43 28.32 10.24 22.30 27.15 11.94 22.76 coo 91.47 83.05 136.24 90.35 81.38 136.84 35.24 14.24 25.23 35.01 14.32 27.33 ULMN 3 1dub_c15 2-ENOYL-COA HYDRATASE user 2 3 # 2 D 141 GLY B 71 GLY.? 1000.00 D 144 GLU B 76 GLU~? 1000.00 D 164 GLU B 73 GLU.? 1000.00 coo 86.19 80.64 132.77 86.38 79.85 132.93 26.80 -10.68 19.61 26.11 -10.43 19.23 coo 84.75 81.24 136.88 85.62 83.14 136.43 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 91.47 83.05 136.24 90.35 81.38 136.84 23.38 -12.14 25.82 23.41 -12.13 27.93 1dub_c15 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c15 naa= 3 ULMN 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 # 1 E 141 GLY A 71 GLY.? 1000.00 E 144 GLU A 76 GLU~? 1000.00 E 164 GLU A 73 GLU.? 1000.00 coo 90.07 81.07 170.50 90.23 80.26 170.38 30.77 13.13 20.09 31.38 12.92 19.53 coo 87.05 81.30 167.53 86.38 82.74 168.94 28.32 10.24 22.30 27.15 11.94 22.76 coo 84.40 80.02 173.80 85.08 79.06 172.03 35.24 14.24 25.23 35.01 14.32 27.33 ULMN 3 1dub_c16 2-ENOYL-COA HYDRATASE user 2 3 # 2 E 141 GLY B 71 GLY.? 1000.00 E 144 GLU B 76 GLU~? 1000.00 E 164 GLU B 73 GLU.? 1000.00 coo 90.07 81.07 170.50 90.23 80.26 170.38 26.80 -10.68 19.61 26.11 -10.43 19.23 coo 87.05 81.30 167.53 86.38 82.74 168.94 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 84.40 80.02 173.80 85.08 79.06 172.03 23.38 -12.14 25.82 23.41 -12.13 27.93 1dub_c16 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c16 naa= 3 ULMN 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 # 1 F 141 GLY A 71 GLY.? 1000.00 F 144 GLU A 76 GLU~? 1000.00 F 164 GLU A 73 GLU.? 1000.00 coo 57.12 70.68 155.10 57.52 69.95 155.02 30.77 13.13 20.09 31.38 12.92 19.53 coo 60.62 73.13 154.21 59.05 74.26 153.35 28.32 10.24 22.30 27.15 11.94 22.76 coo 56.75 71.71 148.46 58.44 71.01 149.54 35.24 14.24 25.23 35.01 14.32 27.33 ULMN 3 1dub_c17 2-ENOYL-COA HYDRATASE user 2 3 # 2 F 141 GLY B 71 GLY.? 1000.00 F 144 GLU B 76 GLU~? 1000.00 F 164 GLU B 73 GLU.? 1000.00 coo 57.12 70.68 155.10 57.52 69.95 155.02 26.80 -10.68 19.61 26.11 -10.43 19.23 coo 60.62 73.13 154.21 59.05 74.26 153.35 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 56.75 71.71 148.46 58.44 71.01 149.54 23.38 -12.14 25.82 23.41 -12.13 27.93 1dub_c17 source 1dub 2-ENOYL-COA HYDRATASE : 2 hits 1dub_c17 naa= 3 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 1 3 # 1 A 107 ALA A 35 ALA~? 1000.00 A 136 TYR A 31 TYR~? 1000.00 A 140 LYS A 84 LYS~? 1000.00 coo 55.90 7.49 23.83 56.71 8.23 22.76 18.36 -0.24 11.00 18.25 1.25 10.77 coo 59.38 10.02 17.51 59.95 9.89 20.21 14.76 2.26 18.96 12.86 3.20 20.79 coo 59.52 3.69 18.67 62.31 6.19 22.58 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 2 3 # 2 A 107 ALA B 35 ALA~? 1000.00 A 136 TYR B 31 TYR~? 1000.00 A 140 LYS B 84 LYS~? 1000.00 coo 55.90 7.49 23.83 56.71 8.23 22.76 38.64 3.06 10.15 38.73 1.57 9.89 coo 59.38 10.02 17.51 59.95 9.89 20.21 42.93 0.52 17.54 44.90 -0.41 19.30 coo 59.52 3.69 18.67 62.31 6.19 22.58 43.00 -3.73 14.55 45.69 -3.43 18.79 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 3 3 # 3 A 107 ALA B 125 ALA^? 1000.00 A 136 TYR B 54 TYR.? 1000.00 A 140 LYS B 55 LYS.? 1000.00 coo 55.90 7.49 23.83 56.71 8.23 22.76 47.74 3.13 -7.74 48.32 2.72 -9.09 coo 59.38 10.02 17.51 59.95 9.89 20.21 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 59.52 3.69 18.67 62.31 6.19 22.58 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 4 3 # 4 A 107 ALA B 125 ALA^? 1000.00 A 136 TYR B 123 TYR.? 1000.00 A 140 LYS B 55 LYS.? 1000.00 coo 55.90 7.49 23.83 56.71 8.23 22.76 47.74 3.13 -7.74 48.32 2.72 -9.09 coo 59.38 10.02 17.51 59.95 9.89 20.21 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 59.52 3.69 18.67 62.31 6.19 22.58 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1e7q_c01 source 1e7q GDP-FUCOSE SYNTHETASE : 4 hits 1e7q_c01 naa= 3 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 # 1 A 32 ASP A 100 ASP.? 1000.00 A 35 SER A 101 SER~? 1000.00 A 218 ASP A 99 ASP.? 1000.00 coo 47.22 22.34 8.57 45.16 22.02 9.13 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 43.58 20.85 5.15 44.62 23.01 5.76 12.85 8.31 -19.30 13.97 10.47 -19.16 coo 44.05 16.99 12.67 44.05 18.89 11.74 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 2 3 # 2 A 32 ASP B 100 ASP.? 1000.00 A 35 SER B 101 SER~? 1000.00 A 218 ASP B 99 ASP.? 1000.00 coo 47.22 22.34 8.57 45.16 22.02 9.13 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 43.58 20.85 5.15 44.62 23.01 5.76 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo 44.05 16.99 12.67 44.05 18.89 11.74 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1eag_c04 source 1eag PEPTIDE INHIBITOR : 2 hits 1eag_c04 naa= 3 ULMN 3 1ecx_c02 AMINOTRANSFERASE user 1 3 # 1 A 99 HIS B 34 HIS~? 1000.00 A 177 ASP B 33 ASP~? 1000.00 A 203 LYS B 41 LYS.? 1000.00 coo 8.74 45.76 47.19 9.33 46.93 45.56 41.87 5.60 12.60 42.81 7.10 11.48 coo 11.68 42.31 52.96 12.05 43.92 51.65 37.13 3.30 17.02 39.09 3.64 17.72 coo 18.07 52.81 49.62 14.17 49.99 48.07 33.89 10.98 6.00 33.54 14.13 10.34 1ecx_c02 source 1ecx AMINOTRANSFERASE : 1 hits 1ecx_c02 naa= 3 ULMN 3 1ecx_c03 AMINOTRANSFERASE user 1 3 # 1 B 99 HIS B 34 HIS~? 1000.00 B 177 ASP B 33 ASP~? 1000.00 B 203 LYS B 41 LYS.? 1000.00 coo 14.87 88.04 21.51 13.64 87.90 19.81 41.87 5.60 12.60 42.81 7.10 11.48 coo 15.87 92.46 27.37 14.46 91.76 25.94 37.13 3.30 17.02 39.09 3.64 17.72 coo 3.60 91.42 23.52 8.20 89.55 22.63 33.89 10.98 6.00 33.54 14.13 10.34 1ecx_c03 source 1ecx AMINOTRANSFERASE : 1 hits 1ecx_c03 naa= 3 ULMN 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 1 3 # 1 P 32 ASP A 100 ASP.? 1000.00 P 35 SER A 101 SER~? 1000.00 P 215 ASP A 99 ASP.? 1000.00 coo 10.15 33.41 11.98 7.98 33.66 12.07 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 7.57 37.60 10.00 8.86 37.02 12.03 12.85 8.31 -19.30 13.97 10.47 -19.16 coo 4.04 29.97 8.82 4.78 31.15 10.46 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1eed_c04 ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLuser 2 3 # 2 P 32 ASP B 100 ASP.? 1000.00 P 35 SER B 101 SER~? 1000.00 P 215 ASP B 99 ASP.? 1000.00 coo 10.15 33.41 11.98 7.98 33.66 12.07 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 7.57 37.60 10.00 8.86 37.02 12.03 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo 4.04 29.97 8.82 4.78 31.15 10.46 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1eed_c04 source 1eed ENDOTHIAPEPSIN (E.C.3.4.23.22) COMPLEX WITH TH: 2 hits 1eed_c04 naa= 3 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 1 3 # 1 A 114 HIS A 25 HIS.? 1000.00 A 197 ASP A 51 ASP.? 1000.00 A 223 LYS A 84 LYS~? 1000.00 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 10.94 -1.26 4.23 9.26 -2.11 5.16 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 5.22 5.50 6.84 4.14 5.83 5.06 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 2 3 # 2 A 114 HIS B 34 HIS~? 1000.00 A 197 ASP B 33 ASP~? 1000.00 A 223 LYS B 41 LYS.? 1000.00 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 41.87 5.60 12.60 42.81 7.10 11.48 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 37.13 3.30 17.02 39.09 3.64 17.72 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 33.89 10.98 6.00 33.54 14.13 10.34 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 25 HIS.? 1000.00 B 197 ASP A 51 ASP.? 1000.00 B 223 LYS A 84 LYS~? 1000.00 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 10.94 -1.26 4.23 9.26 -2.11 5.16 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 5.22 5.50 6.84 4.14 5.83 5.06 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1elq_c03 L-CYSTEINE/L-CYSTINE C-S LYASE user 2 3 # 2 B 114 HIS B 34 HIS~? 1000.00 B 197 ASP B 33 ASP~? 1000.00 B 223 LYS B 41 LYS.? 1000.00 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 41.87 5.60 12.60 42.81 7.10 11.48 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 37.13 3.30 17.02 39.09 3.64 17.72 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 33.89 10.98 6.00 33.54 14.13 10.34 1elq_c03 source 1elq L-CYSTEINE/L-CYSTINE C-S LYASE : 2 hits 1elq_c03 naa= 3 ULMN 3 1eq2_c00 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 A 116 SER A 53 SER.? 1000.00 A 140 TYR A 123 TYR.? 1000.00 A 144 LYS A 55 LYS.? 1000.00 coo 34.67 35.79 48.83 33.57 37.88 49.47 1.42 3.02 4.29 0.48 5.03 5.27 coo 29.60 38.99 53.89 30.10 37.88 51.36 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 32.73 32.94 54.42 29.29 32.83 50.35 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c00 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 A 116 SER B 53 SER.? 1000.00 A 140 TYR B 123 TYR.? 1000.00 A 144 LYS B 55 LYS.? 1000.00 coo 34.67 35.79 48.83 33.57 37.88 49.47 54.98 0.20 2.05 55.66 -1.87 3.14 coo 29.60 38.99 53.89 30.10 37.88 51.36 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 32.73 32.94 54.42 29.29 32.83 50.35 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1eq2_c00 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c00 naa= 3 ULMN 3 1eq2_c01 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 B 116 SER A 53 SER.? 1000.00 B 140 TYR A 123 TYR.? 1000.00 B 144 LYS A 55 LYS.? 1000.00 coo 30.90 35.65 89.60 29.85 37.72 88.83 1.42 3.02 4.29 0.48 5.03 5.27 coo 24.43 38.83 86.53 27.07 38.03 86.12 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 25.13 32.62 89.49 27.74 32.61 84.91 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c01 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 B 116 SER B 53 SER.? 1000.00 B 140 TYR B 123 TYR.? 1000.00 B 144 LYS B 55 LYS.? 1000.00 coo 30.90 35.65 89.60 29.85 37.72 88.83 54.98 0.20 2.05 55.66 -1.87 3.14 coo 24.43 38.83 86.53 27.07 38.03 86.12 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 25.13 32.62 89.49 27.74 32.61 84.91 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1eq2_c01 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c01 naa= 3 ULMN 3 1eq2_c02 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 C 116 SER A 53 SER.? 1000.00 C 140 TYR A 123 TYR.? 1000.00 C 144 LYS A 55 LYS.? 1000.00 coo -8.96 33.70 98.81 -8.96 35.77 97.56 1.42 3.02 4.29 0.48 5.03 5.27 coo -8.28 37.01 91.79 -6.99 36.16 94.13 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -10.48 30.66 93.19 -5.27 31.07 94.32 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c02 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 C 116 SER B 53 SER.? 1000.00 C 140 TYR B 123 TYR.? 1000.00 C 144 LYS B 55 LYS.? 1000.00 coo -8.96 33.70 98.81 -8.96 35.77 97.56 54.98 0.20 2.05 55.66 -1.87 3.14 coo -8.28 37.01 91.79 -6.99 36.16 94.13 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -10.48 30.66 93.19 -5.27 31.07 94.32 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1eq2_c02 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c02 naa= 3 ULMN 3 1eq2_c03 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 D 116 SER A 53 SER.? 1000.00 D 140 TYR A 123 TYR.? 1000.00 D 144 LYS A 55 LYS.? 1000.00 coo -29.80 31.30 63.54 -28.79 33.52 63.37 1.42 3.02 4.29 0.48 5.03 5.27 coo -23.30 35.33 62.20 -25.10 34.24 64.06 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -24.76 28.82 60.31 -24.27 29.01 65.58 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c03 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 D 116 SER B 53 SER.? 1000.00 D 140 TYR B 123 TYR.? 1000.00 D 144 LYS B 55 LYS.? 1000.00 coo -29.80 31.30 63.54 -28.79 33.52 63.37 54.98 0.20 2.05 55.66 -1.87 3.14 coo -23.30 35.33 62.20 -25.10 34.24 64.06 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -24.76 28.82 60.31 -24.27 29.01 65.58 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1eq2_c03 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c03 naa= 3 ULMN 3 1eq2_c04 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 E 116 SER A 53 SER.? 1000.00 E 140 TYR A 123 TYR.? 1000.00 E 144 LYS A 55 LYS.? 1000.00 coo -3.01 32.72 32.71 -2.80 34.91 33.79 1.42 3.02 4.29 0.48 5.03 5.27 coo 0.04 36.70 38.68 -2.21 35.46 37.50 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 1.93 30.52 36.31 -2.84 30.18 38.54 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c04 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 E 116 SER B 53 SER.? 1000.00 E 140 TYR B 123 TYR.? 1000.00 E 144 LYS B 55 LYS.? 1000.00 coo -3.01 32.72 32.71 -2.80 34.91 33.79 54.98 0.20 2.05 55.66 -1.87 3.14 coo 0.04 36.70 38.68 -2.21 35.46 37.50 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 1.93 30.52 36.31 -2.84 30.18 38.54 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1eq2_c04 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c04 naa= 3 ULMN 3 1eq2_c05 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 F 116 SER A 53 SER.? 1000.00 F 140 TYR A 123 TYR.? 1000.00 F 144 LYS A 55 LYS.? 1000.00 coo 55.30 92.46 56.72 55.15 90.39 55.38 1.42 3.02 4.29 0.48 5.03 5.27 coo 54.49 89.31 49.65 53.35 90.16 52.06 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 56.78 95.62 51.15 51.59 95.31 52.37 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c05 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 F 116 SER B 53 SER.? 1000.00 F 140 TYR B 123 TYR.? 1000.00 F 144 LYS B 55 LYS.? 1000.00 coo 55.30 92.46 56.72 55.15 90.39 55.38 54.98 0.20 2.05 55.66 -1.87 3.14 coo 54.49 89.31 49.65 53.35 90.16 52.06 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 56.78 95.62 51.15 51.59 95.31 52.37 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1eq2_c05 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c05 naa= 3 ULMN 3 1eq2_c06 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 G 116 SER A 53 SER.? 1000.00 G 140 TYR A 123 TYR.? 1000.00 G 144 LYS A 55 LYS.? 1000.00 coo 76.25 95.63 21.56 75.29 93.40 21.36 1.42 3.02 4.29 0.48 5.03 5.27 coo 69.78 91.62 20.06 71.51 92.68 22.02 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 71.19 98.21 18.32 70.69 97.75 23.67 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c06 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 G 116 SER B 53 SER.? 1000.00 G 140 TYR B 123 TYR.? 1000.00 G 144 LYS B 55 LYS.? 1000.00 coo 76.25 95.63 21.56 75.29 93.40 21.36 54.98 0.20 2.05 55.66 -1.87 3.14 coo 69.78 91.62 20.06 71.51 92.68 22.02 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 71.19 98.21 18.32 70.69 97.75 23.67 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1eq2_c06 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c06 naa= 3 ULMN 3 1eq2_c07 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 H 116 SER A 53 SER.? 1000.00 H 140 TYR A 123 TYR.? 1000.00 H 144 LYS A 55 LYS.? 1000.00 coo 15.45 90.62 47.70 16.55 88.57 46.97 1.42 3.02 4.29 0.48 5.03 5.27 coo 21.92 87.58 44.67 19.30 88.41 44.23 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 21.26 93.70 47.67 18.47 93.68 43.08 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c07 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 H 116 SER B 53 SER.? 1000.00 H 140 TYR B 123 TYR.? 1000.00 H 144 LYS B 55 LYS.? 1000.00 coo 15.45 90.62 47.70 16.55 88.57 46.97 54.98 0.20 2.05 55.66 -1.87 3.14 coo 21.92 87.58 44.67 19.30 88.41 44.23 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 21.26 93.70 47.67 18.47 93.68 43.08 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1eq2_c07 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c07 naa= 3 ULMN 3 1eq2_c08 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 I 116 SER A 53 SER.? 1000.00 I 140 TYR A 54 TYR.? 1000.00 I 144 LYS A 55 LYS.? 1000.00 coo 11.78 90.82 7.18 12.84 88.72 7.93 1.42 3.02 4.29 0.48 5.03 5.27 coo 16.78 87.76 12.19 16.39 88.69 9.59 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 13.67 93.83 12.65 17.08 93.94 8.58 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c08 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 I 116 SER A 53 SER.? 1000.00 I 140 TYR A 123 TYR.? 1000.00 I 144 LYS A 55 LYS.? 1000.00 coo 11.78 90.82 7.18 12.84 88.72 7.93 1.42 3.02 4.29 0.48 5.03 5.27 coo 16.78 87.76 12.19 16.39 88.69 9.59 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 13.67 93.83 12.65 17.08 93.94 8.58 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c08 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 3 3 # 3 I 116 SER B 53 SER.? 1000.00 I 140 TYR B 54 TYR.? 1000.00 I 144 LYS B 55 LYS.? 1000.00 coo 11.78 90.82 7.18 12.84 88.72 7.93 54.98 0.20 2.05 55.66 -1.87 3.14 coo 16.78 87.76 12.19 16.39 88.69 9.59 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 13.67 93.83 12.65 17.08 93.94 8.58 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1eq2_c08 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 4 3 # 4 I 116 SER B 53 SER.? 1000.00 I 140 TYR B 123 TYR.? 1000.00 I 144 LYS B 55 LYS.? 1000.00 coo 11.78 90.82 7.18 12.84 88.72 7.93 54.98 0.20 2.05 55.66 -1.87 3.14 coo 16.78 87.76 12.19 16.39 88.69 9.59 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 13.67 93.83 12.65 17.08 93.94 8.58 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1eq2_c08 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 4 hits 1eq2_c08 naa= 3 ULMN 3 1eq2_c09 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 1 3 # 1 J 116 SER A 53 SER.? 1000.00 J 140 TYR A 123 TYR.? 1000.00 J 144 LYS A 55 LYS.? 1000.00 coo 49.46 93.97 -9.19 49.31 91.82 -8.04 1.42 3.02 4.29 0.48 5.03 5.27 coo 46.51 90.06 -3.08 48.69 91.36 -4.30 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 44.49 96.17 -5.53 49.37 96.61 -3.37 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1eq2_c09 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMEuser 2 3 # 2 J 116 SER B 53 SER.? 1000.00 J 140 TYR B 123 TYR.? 1000.00 J 144 LYS B 55 LYS.? 1000.00 coo 49.46 93.97 -9.19 49.31 91.82 -8.04 54.98 0.20 2.05 55.66 -1.87 3.14 coo 46.51 90.06 -3.08 48.69 91.36 -4.30 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 44.49 96.17 -5.53 49.37 96.61 -3.37 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1eq2_c09 source 1eq2 ADP-L-GLYCERO-D-MANNOHEPTOSE 6-EPIMERASE : 2 hits 1eq2_c09 naa= 3 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 38 THR B 42 THR.? 1000.00 A 159 LYS B 22 LYS~? 1000.00 A 193 GLU B 132 GLU~? 1000.00 coo -2.58 16.31 54.79 -4.02 14.93 55.64 34.08 9.32 2.59 35.89 8.18 2.86 coo 2.10 10.68 61.44 -2.14 13.16 60.61 42.49 11.08 -4.25 42.78 13.68 -10.05 coo -5.33 11.71 69.72 -4.62 11.92 67.73 35.47 7.40 -12.25 35.40 9.42 -12.89 1et0_c02 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 1 hits 1et0_c02 naa= 3 ULMN 3 1euu_c00 SIALIDASE user 1 3 # 1 92 ASP A 51 ASP.? 1000.00 260 GLU A 118 GLU^? 1000.00 370 TYR A 123 TYR.? 1000.00 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 5.22 5.50 6.84 4.14 5.83 5.06 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 1.57 3.68 -2.19 -0.67 4.60 -0.79 ULMN 3 1euu_c00 SIALIDASE user 2 3 # 2 92 ASP A 120 ASP.? 1000.00 260 GLU A 118 GLU^? 1000.00 370 TYR A 123 TYR.? 1000.00 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 1.57 3.68 -2.19 -0.67 4.60 -0.79 ULMN 3 1euu_c00 SIALIDASE user 3 3 # 3 92 ASP B 51 ASP.? 1000.00 260 GLU B 118 GLU^? 1000.00 370 TYR B 123 TYR.? 1000.00 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 54.16 0.41 -4.97 56.69 0.28 -3.79 ULMN 3 1euu_c00 SIALIDASE user 4 3 # 4 92 ASP B 120 ASP.? 1000.00 260 GLU B 118 GLU^? 1000.00 370 TYR B 123 TYR.? 1000.00 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 54.16 0.41 -4.97 56.69 0.28 -3.79 1euu_c00 source 1euu SIALIDASE : 4 hits 1euu_c00 naa= 3 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 1 3 # 1 A 105 HIS A 25 HIS.? 1000.00 C 62 LYS A 84 LYS~? 1000.00 F 35 ASP A 51 ASP.? 1000.00 coo 15.40 22.79 16.66 13.93 24.10 15.98 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 19.95 18.98 4.81 18.82 20.94 10.49 14.81 6.41 15.81 10.01 5.61 18.56 coo 16.32 15.30 17.19 17.71 14.73 18.69 5.22 5.50 6.84 4.14 5.83 5.06 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 2 3 # 2 A 105 HIS B 34 HIS~? 1000.00 C 62 LYS B 41 LYS.? 1000.00 F 35 ASP B 33 ASP~? 1000.00 coo 15.40 22.79 16.66 13.93 24.10 15.98 41.87 5.60 12.60 42.81 7.10 11.48 coo 19.95 18.98 4.81 18.82 20.94 10.49 33.89 10.98 6.00 33.54 14.13 10.34 coo 16.32 15.30 17.19 17.71 14.73 18.69 37.13 3.30 17.02 39.09 3.64 17.72 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 84 LYS~? 1000.00 C 105 HIS A 25 HIS.? 1000.00 D 35 ASP A 51 ASP.? 1000.00 coo 38.76 28.25 7.87 36.33 26.41 13.58 14.81 6.41 15.81 10.01 5.61 18.56 coo 34.93 19.72 17.37 34.72 18.17 15.98 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 41.01 23.02 20.83 40.65 24.26 22.55 5.22 5.50 6.84 4.14 5.83 5.06 ULMN 3 1f80_c04 ACYL CARRIER PROTEIN user 2 3 # 2 B 62 LYS B 41 LYS.? 1000.00 C 105 HIS B 34 HIS~? 1000.00 D 35 ASP B 33 ASP~? 1000.00 coo 38.76 28.25 7.87 36.33 26.41 13.58 33.89 10.98 6.00 33.54 14.13 10.34 coo 34.93 19.72 17.37 34.72 18.17 15.98 41.87 5.60 12.60 42.81 7.10 11.48 coo 41.01 23.02 20.83 40.65 24.26 22.55 37.13 3.30 17.02 39.09 3.64 17.72 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 84 LYS~? 1000.00 B 105 HIS A 25 HIS.? 1000.00 E 35 ASP A 51 ASP.? 1000.00 coo 20.51 39.76 8.83 21.23 37.38 14.18 14.81 6.41 15.81 10.01 5.61 18.56 coo 27.18 37.56 20.68 29.07 38.28 20.13 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 19.97 40.39 22.03 18.53 39.30 23.18 5.22 5.50 6.84 4.14 5.83 5.06 ULMN 3 1f80_c05 ACYL CARRIER PROTEIN user 2 3 # 2 A 62 LYS B 84 LYS~? 1000.00 B 105 HIS B 25 HIS.? 1000.00 E 35 ASP B 51 ASP.? 1000.00 coo 20.51 39.76 8.83 21.23 37.38 14.18 43.00 -3.73 14.55 45.69 -3.43 18.79 coo 27.18 37.56 20.68 29.07 38.28 20.13 45.20 4.85 2.41 47.00 5.76 2.99 coo 19.97 40.39 22.03 18.53 39.30 23.18 51.46 -2.33 4.55 52.23 -2.54 2.59 1f80_c05 source 1f80 ACYL CARRIER PROTEIN : 2 hits 1f80_c05 naa= 3 ULMN 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 136 HIS A 57 HIS^? 1000.00 A 210 ASP A 51 ASP.? 1000.00 A 244 LYS A 84 LYS~? 1000.00 coo 11.28 44.53 18.60 9.91 46.00 19.20 8.52 8.65 5.26 6.52 8.65 5.91 coo 10.51 37.86 19.71 9.07 39.38 20.04 5.22 5.50 6.84 4.14 5.83 5.06 coo -1.20 42.34 17.67 3.19 45.13 19.06 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 136 HIS B 34 HIS~? 1000.00 A 210 ASP B 33 ASP~? 1000.00 A 244 LYS B 41 LYS.? 1000.00 coo 11.28 44.53 18.60 9.91 46.00 19.20 41.87 5.60 12.60 42.81 7.10 11.48 coo 10.51 37.86 19.71 9.07 39.38 20.04 37.13 3.30 17.02 39.09 3.64 17.72 coo -1.20 42.34 17.67 3.19 45.13 19.06 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 3 3 # 3 A 136 HIS B 57 HIS^? 1000.00 A 210 ASP B 51 ASP.? 1000.00 A 244 LYS B 84 LYS~? 1000.00 coo 11.28 44.53 18.60 9.91 46.00 19.20 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 10.51 37.86 19.71 9.07 39.38 20.04 51.46 -2.33 4.55 52.23 -2.54 2.59 coo -1.20 42.34 17.67 3.19 45.13 19.06 43.00 -3.73 14.55 45.69 -3.43 18.79 1fc4_c04 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 3 hits 1fc4_c04 naa= 3 ULMN 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 136 HIS B 34 HIS~? 1000.00 B 210 ASP B 33 ASP~? 1000.00 B 244 LYS B 41 LYS.? 1000.00 coo 10.08 50.18 41.78 8.91 48.61 41.04 41.87 5.60 12.60 42.81 7.10 11.48 coo 9.06 56.85 40.30 7.71 55.27 39.90 37.13 3.30 17.02 39.09 3.64 17.72 coo -2.38 51.82 41.62 2.07 49.19 40.42 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 136 HIS B 57 HIS^? 1000.00 B 210 ASP B 51 ASP.? 1000.00 B 244 LYS B 84 LYS~? 1000.00 coo 10.08 50.18 41.78 8.91 48.61 41.04 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 9.06 56.85 40.30 7.71 55.27 39.90 51.46 -2.33 4.55 52.23 -2.54 2.59 coo -2.38 51.82 41.62 2.07 49.19 40.42 43.00 -3.73 14.55 45.69 -3.43 18.79 1fc4_c05 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c05 naa= 3 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 137 TYR A 31 TYR~? 1000.00 A 142 LEU A 36 LEU~? 1000.00 A 165 LYS A 84 LYS~? 1000.00 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 14.76 2.26 18.96 12.86 3.20 20.79 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 22.69 -0.57 13.12 24.74 -0.92 13.72 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 137 TYR B 31 TYR~? 1000.00 A 142 LEU B 36 LEU~? 1000.00 A 165 LYS B 84 LYS~? 1000.00 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 42.93 0.52 17.54 44.90 -0.41 19.30 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 34.51 3.28 12.62 32.42 3.51 13.11 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 43.00 -3.73 14.55 45.69 -3.43 18.79 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 A 137 TYR B 31 TYR~? 1000.00 A 142 LEU B 37 LEU~? 1000.00 A 165 LYS B 84 LYS~? 1000.00 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 42.93 0.52 17.54 44.90 -0.41 19.30 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 36.82 7.93 12.48 37.16 10.02 12.94 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 43.00 -3.73 14.55 45.69 -3.43 18.79 1fdy_c00 source 1fdy N-ACETYLNEURAMINATE LYASE : 3 hits 1fdy_c00 naa= 3 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 137 TYR B 31 TYR~? 1000.00 B 142 LEU B 36 LEU~? 1000.00 B 165 LYS B 84 LYS~? 1000.00 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 42.93 0.52 17.54 44.90 -0.41 19.30 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 34.51 3.28 12.62 32.42 3.51 13.11 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 43.00 -3.73 14.55 45.69 -3.43 18.79 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 137 TYR B 31 TYR~? 1000.00 B 142 LEU B 37 LEU~? 1000.00 B 165 LYS B 84 LYS~? 1000.00 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 42.93 0.52 17.54 44.90 -0.41 19.30 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 36.82 7.93 12.48 37.16 10.02 12.94 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 43.00 -3.73 14.55 45.69 -3.43 18.79 1fdy_c01 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c01 naa= 3 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 137 TYR B 31 TYR~? 1000.00 C 142 LEU B 36 LEU~? 1000.00 C 165 LYS B 84 LYS~? 1000.00 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 42.93 0.52 17.54 44.90 -0.41 19.30 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 34.51 3.28 12.62 32.42 3.51 13.11 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 43.00 -3.73 14.55 45.69 -3.43 18.79 1fdy_c02 source 1fdy N-ACETYLNEURAMINATE LYASE : 1 hits 1fdy_c02 naa= 3 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 D 137 TYR B 31 TYR~? 1000.00 D 142 LEU B 36 LEU~? 1000.00 D 165 LYS B 84 LYS~? 1000.00 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 42.93 0.52 17.54 44.90 -0.41 19.30 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 34.51 3.28 12.62 32.42 3.51 13.11 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 43.00 -3.73 14.55 45.69 -3.43 18.79 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 137 TYR B 31 TYR~? 1000.00 D 142 LEU B 37 LEU~? 1000.00 D 165 LYS B 84 LYS~? 1000.00 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 42.93 0.52 17.54 44.90 -0.41 19.30 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 36.82 7.93 12.48 37.16 10.02 12.94 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 43.00 -3.73 14.55 45.69 -3.43 18.79 1fdy_c03 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c03 naa= 3 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 47 SER A 61 SER~? 1000.00 A 48 THR A 63 THR~? 1000.00 A 165 LYS A 84 LYS~? 1000.00 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 22.92 4.42 5.79 24.11 6.33 4.86 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 27.46 6.83 7.64 28.67 7.72 6.07 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 47 SER B 61 SER~? 1000.00 A 48 THR B 63 THR~? 1000.00 A 165 LYS B 41 LYS.? 1000.00 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 33.78 -1.74 5.28 32.53 -3.75 4.72 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 29.43 -3.76 7.40 28.04 -4.53 5.92 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 A 47 SER B 61 SER~? 1000.00 A 48 THR B 63 THR~? 1000.00 A 165 LYS B 84 LYS~? 1000.00 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 33.78 -1.74 5.28 32.53 -3.75 4.72 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 29.43 -3.76 7.40 28.04 -4.53 5.92 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 43.00 -3.73 14.55 45.69 -3.43 18.79 1fdy_c04 source 1fdy N-ACETYLNEURAMINATE LYASE : 3 hits 1fdy_c04 naa= 3 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 47 SER A 61 SER~? 1000.00 B 48 THR A 63 THR~? 1000.00 B 165 LYS A 84 LYS~? 1000.00 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 22.92 4.42 5.79 24.11 6.33 4.86 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 27.46 6.83 7.64 28.67 7.72 6.07 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 47 SER B 61 SER~? 1000.00 B 48 THR B 63 THR~? 1000.00 B 165 LYS B 41 LYS.? 1000.00 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 33.78 -1.74 5.28 32.53 -3.75 4.72 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 29.43 -3.76 7.40 28.04 -4.53 5.92 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 B 47 SER B 61 SER~? 1000.00 B 48 THR B 63 THR~? 1000.00 B 165 LYS B 84 LYS~? 1000.00 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 33.78 -1.74 5.28 32.53 -3.75 4.72 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 29.43 -3.76 7.40 28.04 -4.53 5.92 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 43.00 -3.73 14.55 45.69 -3.43 18.79 1fdy_c05 source 1fdy N-ACETYLNEURAMINATE LYASE : 3 hits 1fdy_c05 naa= 3 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 47 SER A 61 SER~? 1000.00 C 48 THR A 63 THR~? 1000.00 C 165 LYS A 84 LYS~? 1000.00 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 22.92 4.42 5.79 24.11 6.33 4.86 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 27.46 6.83 7.64 28.67 7.72 6.07 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 C 47 SER B 61 SER~? 1000.00 C 48 THR B 63 THR~? 1000.00 C 165 LYS B 84 LYS~? 1000.00 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 33.78 -1.74 5.28 32.53 -3.75 4.72 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 29.43 -3.76 7.40 28.04 -4.53 5.92 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 43.00 -3.73 14.55 45.69 -3.43 18.79 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 61 SER~? 1000.00 D 48 THR A 63 THR~? 1000.00 D 165 LYS A 84 LYS~? 1000.00 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 22.92 4.42 5.79 24.11 6.33 4.86 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 27.46 6.83 7.64 28.67 7.72 6.07 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 47 SER B 61 SER~? 1000.00 D 48 THR B 63 THR~? 1000.00 D 165 LYS B 41 LYS.? 1000.00 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 33.78 -1.74 5.28 32.53 -3.75 4.72 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 29.43 -3.76 7.40 28.04 -4.53 5.92 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 D 47 SER B 61 SER~? 1000.00 D 48 THR B 63 THR~? 1000.00 D 165 LYS B 84 LYS~? 1000.00 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 33.78 -1.74 5.28 32.53 -3.75 4.72 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 29.43 -3.76 7.40 28.04 -4.53 5.92 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 43.00 -3.73 14.55 45.69 -3.43 18.79 1fdy_c07 source 1fdy N-ACETYLNEURAMINATE LYASE : 3 hits 1fdy_c07 naa= 3 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG B 74 ARG.? 1000.00 A 136 GLU B 78 GLU~? 1000.00 A 246 GLU B 76 GLU~? 1000.00 coo 13.48 30.30 107.06 11.75 30.99 109.44 26.00 -6.26 25.33 29.00 -5.64 25.39 coo 9.46 32.37 115.82 8.50 34.20 115.47 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 11.99 34.33 109.92 10.08 34.19 110.77 29.60 -7.66 22.07 30.61 -9.52 22.20 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG B 79 ARG~? 1000.00 A 136 GLU B 81 GLU~? 1000.00 A 246 GLU B 78 GLU~? 1000.00 coo 13.48 30.30 107.06 11.75 30.99 109.44 34.23 -7.42 21.18 34.10 -9.69 19.14 coo 9.46 32.37 115.82 8.50 34.20 115.47 38.01 0.54 22.61 37.05 1.66 24.13 coo 11.99 34.33 109.92 10.08 34.19 110.77 33.27 -3.24 24.53 31.20 -3.63 24.37 1fhl_c00 source 1fhl BETA-1,4-GALACTANASE : 2 hits 1fhl_c00 naa= 3 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG B 74 ARG.? 1000.00 A 136 GLU B 78 GLU~? 1000.00 A 246 GLU B 76 GLU~? 1000.00 coo 13.94 29.84 106.80 11.67 30.40 108.79 26.00 -6.26 25.33 29.00 -5.64 25.39 coo 9.52 31.97 115.23 8.45 33.74 114.72 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 11.92 33.82 109.35 10.10 33.50 110.39 29.60 -7.66 22.07 30.61 -9.52 22.20 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG B 79 ARG~? 1000.00 A 136 GLU B 81 GLU~? 1000.00 A 246 GLU B 78 GLU~? 1000.00 coo 13.94 29.84 106.80 11.67 30.40 108.79 34.23 -7.42 21.18 34.10 -9.69 19.14 coo 9.52 31.97 115.23 8.45 33.74 114.72 38.01 0.54 22.61 37.05 1.66 24.13 coo 11.92 33.82 109.35 10.10 33.50 110.39 33.27 -3.24 24.53 31.20 -3.63 24.37 1fob_c00 source 1fob BETA-1,4-GALACTANASE : 2 hits 1fob_c00 naa= 3 ULMN 3 1foh_c00 PHENOL HYDROXYLASE user 1 3 # 1 A 54 ASP A 120 ASP.? 1000.00 A 281 ARG A 97 ARG^? 1000.00 A 289 TYR A 123 TYR.? 1000.00 coo 54.86 40.00 47.23 55.57 38.60 48.67 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 52.08 40.18 50.14 50.83 38.93 47.73 5.24 8.71 -12.77 3.46 8.32 -15.23 coo 57.82 31.70 50.73 57.94 34.00 49.17 1.57 3.68 -2.19 -0.67 4.60 -0.79 1foh_c00 source 1foh PHENOL HYDROXYLASE : 1 hits 1foh_c00 naa= 3 ULMN 3 1foh_c01 PHENOL HYDROXYLASE user 1 3 # 1 B 54 ASP A 120 ASP.? 1000.00 B 281 ARG A 97 ARG^? 1000.00 B 289 TYR A 123 TYR.? 1000.00 coo 90.56 80.24 98.04 90.36 81.53 96.34 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 86.62 80.67 97.51 87.37 82.00 100.10 5.24 8.71 -12.77 3.46 8.32 -15.23 coo 91.83 88.28 92.88 92.60 85.93 94.14 1.57 3.68 -2.19 -0.67 4.60 -0.79 1foh_c01 source 1foh PHENOL HYDROXYLASE : 1 hits 1foh_c01 naa= 3 ULMN 3 1foh_c02 PHENOL HYDROXYLASE user 1 3 # 1 C 54 ASP A 120 ASP.? 1000.00 C 281 ARG A 97 ARG^? 1000.00 C 289 TYR A 123 TYR.? 1000.00 coo 42.34 76.83 49.10 43.06 78.59 50.01 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 46.12 77.15 48.13 44.44 77.61 45.70 5.24 8.71 -12.77 3.46 8.32 -15.23 coo 42.69 86.18 51.69 41.59 83.63 51.54 1.57 3.68 -2.19 -0.67 4.60 -0.79 1foh_c02 source 1foh PHENOL HYDROXYLASE : 1 hits 1foh_c02 naa= 3 ULMN 3 1foh_c03 PHENOL HYDROXYLASE user 1 3 # 1 D 54 ASP A 120 ASP.? 1000.00 D 281 ARG A 97 ARG^? 1000.00 D 289 TYR A 123 TYR.? 1000.00 coo 75.05 45.80 106.18 74.73 43.88 105.51 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 78.52 44.93 104.78 78.72 44.49 107.76 5.24 8.71 -12.77 3.46 8.32 -15.23 coo 72.35 36.51 104.82 72.00 39.20 105.46 1.57 3.68 -2.19 -0.67 4.60 -0.79 1foh_c03 source 1foh PHENOL HYDROXYLASE : 1 hits 1foh_c03 naa= 3 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 A 36 GLU A 118 GLU^? 1000.00 A 47 ASP A 51 ASP.? 1000.00 A 161 TYR A 123 TYR.? 1000.00 coo 37.12 18.35 73.76 37.09 16.69 72.44 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 29.81 8.06 73.13 30.21 10.11 72.95 5.22 5.50 6.84 4.14 5.83 5.06 coo 37.29 15.56 67.90 37.37 13.79 70.08 1.57 3.68 -2.19 -0.67 4.60 -0.79 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 2 3 # 2 A 36 GLU B 118 GLU^? 1000.00 A 47 ASP B 51 ASP.? 1000.00 A 161 TYR B 123 TYR.? 1000.00 coo 37.12 18.35 73.76 37.09 16.69 72.44 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 29.81 8.06 73.13 30.21 10.11 72.95 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 37.29 15.56 67.90 37.37 13.79 70.08 54.16 0.41 -4.97 56.69 0.28 -3.79 1geq_c02 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 2 hits 1geq_c02 naa= 3 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 B 36 GLU A 118 GLU^? 1000.00 B 47 ASP A 51 ASP.? 1000.00 B 161 TYR A 123 TYR.? 1000.00 coo 53.87 35.49 53.22 55.44 35.72 54.61 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 63.47 43.65 53.95 61.45 43.07 54.06 5.22 5.50 6.84 4.14 5.83 5.06 coo 56.38 35.81 59.19 58.25 35.77 57.10 1.57 3.68 -2.19 -0.67 4.60 -0.79 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 2 3 # 2 B 36 GLU B 118 GLU^? 1000.00 B 47 ASP B 51 ASP.? 1000.00 B 161 TYR B 123 TYR.? 1000.00 coo 53.87 35.49 53.22 55.44 35.72 54.61 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 63.47 43.65 53.95 61.45 43.07 54.06 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 56.38 35.81 59.19 58.25 35.77 57.10 54.16 0.41 -4.97 56.69 0.28 -3.79 1geq_c03 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 2 hits 1geq_c03 naa= 3 ULMN 3 1gns_c00 SUBTILISIN BPN' user 1 3 # 1 A 32 ASP A 51 ASP.? 1000.00 A 64 HIS A 57 HIS^? 1000.00 A 155 ASN A 90 ASN.? 1000.00 coo 3.12 38.70 24.20 3.24 38.59 26.33 5.22 5.50 6.84 4.14 5.83 5.06 coo 1.90 38.00 29.77 3.91 38.35 29.95 8.52 8.65 5.26 6.52 8.65 5.91 coo 9.89 36.55 37.38 9.27 37.99 36.08 19.16 11.48 3.60 19.40 12.95 2.08 ULMN 3 1gns_c00 SUBTILISIN BPN' user 2 3 # 2 A 32 ASP B 51 ASP.? 1000.00 A 64 HIS B 57 HIS^? 1000.00 A 155 ASN B 90 ASN.? 1000.00 coo 3.12 38.70 24.20 3.24 38.59 26.33 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 1.90 38.00 29.77 3.91 38.35 29.95 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 9.89 36.55 37.38 9.27 37.99 36.08 37.32 -8.72 2.58 37.18 -10.17 1.03 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 104 LYS~? 1000.00 210 ARG A 131 ARG~? 1000.00 225 ARG B 130 ARG~? 1000.00 coo 17.51 28.50 73.42 17.24 23.02 75.86 16.90 10.44 -16.85 11.99 12.60 -13.53 coo 24.74 11.56 73.05 25.29 14.32 71.80 24.31 -6.42 -8.86 24.19 -9.09 -10.38 coo 27.81 15.44 77.10 25.66 16.50 75.19 29.03 -0.22 -9.33 27.67 -2.50 -7.82 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 2 3 # 2 160 LYS B 14 LYS.? 1000.00 210 ARG A 130 ARG~? 1000.00 225 ARG B 131 ARG~? 1000.00 coo 17.51 28.50 73.42 17.24 23.02 75.86 44.48 3.32 -17.22 49.33 1.95 -20.50 coo 24.74 11.56 73.05 25.29 14.32 71.80 26.14 3.04 -9.06 27.83 5.35 -7.98 coo 27.81 15.44 77.10 25.66 16.50 75.19 30.35 9.14 -9.20 31.40 11.87 -10.11 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 3 3 # 3 160 LYS B 41 LYS.? 1000.00 210 ARG A 130 ARG~? 1000.00 225 ARG B 131 ARG~? 1000.00 coo 17.51 28.50 73.42 17.24 23.02 75.86 33.89 10.98 6.00 33.54 14.13 10.34 coo 24.74 11.56 73.05 25.29 14.32 71.80 26.14 3.04 -9.06 27.83 5.35 -7.98 coo 27.81 15.44 77.10 25.66 16.50 75.19 30.35 9.14 -9.20 31.40 11.87 -10.11 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 4 3 # 4 160 LYS B 104 LYS~? 1000.00 210 ARG B 131 ARG~? 1000.00 225 ARG A 130 ARG~? 1000.00 coo 17.51 28.50 73.42 17.24 23.02 75.86 37.49 -7.58 -17.76 42.96 -9.14 -14.97 coo 24.74 11.56 73.05 25.29 14.32 71.80 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 27.81 15.44 77.10 25.66 16.50 75.19 26.14 3.04 -9.06 27.83 5.35 -7.98 1gsa_c00 source 1gsa GLUTATHIONE SYNTHETASE : 4 hits 1gsa_c00 naa= 3 ULMN 3 1gz6_c00 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 1 3 # 1 A 151 SER A 53 SER.? 1000.00 A 164 TYR A 54 TYR.? 1000.00 A 168 LYS A 55 LYS.? 1000.00 coo 32.37 52.40 49.35 31.32 53.88 47.74 1.42 3.02 4.29 0.48 5.03 5.27 coo 29.69 55.04 42.83 31.98 53.56 43.49 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 26.96 50.99 47.03 31.03 48.83 44.33 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1gz6_c00 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 # 2 A 151 SER A 53 SER.? 1000.00 A 164 TYR A 123 TYR.? 1000.00 A 168 LYS A 55 LYS.? 1000.00 coo 32.37 52.40 49.35 31.32 53.88 47.74 1.42 3.02 4.29 0.48 5.03 5.27 coo 29.69 55.04 42.83 31.98 53.56 43.49 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 26.96 50.99 47.03 31.03 48.83 44.33 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1gz6_c00 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 3 3 # 3 A 151 SER B 53 SER.? 1000.00 A 164 TYR B 54 TYR.? 1000.00 A 168 LYS B 55 LYS.? 1000.00 coo 32.37 52.40 49.35 31.32 53.88 47.74 54.98 0.20 2.05 55.66 -1.87 3.14 coo 29.69 55.04 42.83 31.98 53.56 43.49 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 26.96 50.99 47.03 31.03 48.83 44.33 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1gz6_c00 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 4 3 # 4 A 151 SER B 53 SER.? 1000.00 A 164 TYR B 123 TYR.? 1000.00 A 168 LYS B 55 LYS.? 1000.00 coo 32.37 52.40 49.35 31.32 53.88 47.74 54.98 0.20 2.05 55.66 -1.87 3.14 coo 29.69 55.04 42.83 31.98 53.56 43.49 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 26.96 50.99 47.03 31.03 48.83 44.33 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1gz6_c00 source 1gz6 ESTRADIOL 17 BETA-DEHYDROGENASE 4 : 4 hits 1gz6_c00 naa= 3 ULMN 3 1gz6_c01 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 1 3 # 1 B 151 SER A 53 SER.? 1000.00 B 164 TYR A 54 TYR.? 1000.00 B 168 LYS A 55 LYS.? 1000.00 coo 13.08 50.93 56.67 13.12 48.99 55.27 1.42 3.02 4.29 0.48 5.03 5.27 coo 11.52 46.03 51.32 10.06 47.90 52.76 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 15.72 50.86 51.22 10.77 52.35 51.39 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1gz6_c01 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 # 2 B 151 SER A 53 SER.? 1000.00 B 164 TYR A 123 TYR.? 1000.00 B 168 LYS A 55 LYS.? 1000.00 coo 13.08 50.93 56.67 13.12 48.99 55.27 1.42 3.02 4.29 0.48 5.03 5.27 coo 11.52 46.03 51.32 10.06 47.90 52.76 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 15.72 50.86 51.22 10.77 52.35 51.39 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1gz6_c01 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 3 3 # 3 B 151 SER B 53 SER.? 1000.00 B 164 TYR B 54 TYR.? 1000.00 B 168 LYS B 55 LYS.? 1000.00 coo 13.08 50.93 56.67 13.12 48.99 55.27 54.98 0.20 2.05 55.66 -1.87 3.14 coo 11.52 46.03 51.32 10.06 47.90 52.76 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 15.72 50.86 51.22 10.77 52.35 51.39 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1gz6_c01 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 4 3 # 4 B 151 SER B 53 SER.? 1000.00 B 164 TYR B 123 TYR.? 1000.00 B 168 LYS B 55 LYS.? 1000.00 coo 13.08 50.93 56.67 13.12 48.99 55.27 54.98 0.20 2.05 55.66 -1.87 3.14 coo 11.52 46.03 51.32 10.06 47.90 52.76 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 15.72 50.86 51.22 10.77 52.35 51.39 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1gz6_c01 source 1gz6 ESTRADIOL 17 BETA-DEHYDROGENASE 4 : 4 hits 1gz6_c01 naa= 3 ULMN 3 1gz6_c02 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 1 3 # 1 C 151 SER A 53 SER.? 1000.00 C 164 TYR A 54 TYR.? 1000.00 C 168 LYS A 55 LYS.? 1000.00 coo 11.22 34.38 82.32 11.07 36.29 83.78 1.42 3.02 4.29 0.48 5.03 5.27 coo 8.83 39.27 87.38 7.60 37.43 85.69 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 12.98 34.46 88.14 8.11 32.96 87.14 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1gz6_c02 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 # 2 C 151 SER A 53 SER.? 1000.00 C 164 TYR A 123 TYR.? 1000.00 C 168 LYS A 55 LYS.? 1000.00 coo 11.22 34.38 82.32 11.07 36.29 83.78 1.42 3.02 4.29 0.48 5.03 5.27 coo 8.83 39.27 87.38 7.60 37.43 85.69 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 12.98 34.46 88.14 8.11 32.96 87.14 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1gz6_c02 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 3 3 # 3 C 151 SER B 53 SER.? 1000.00 C 164 TYR B 54 TYR.? 1000.00 C 168 LYS B 55 LYS.? 1000.00 coo 11.22 34.38 82.32 11.07 36.29 83.78 54.98 0.20 2.05 55.66 -1.87 3.14 coo 8.83 39.27 87.38 7.60 37.43 85.69 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 12.98 34.46 88.14 8.11 32.96 87.14 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1gz6_c02 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 4 3 # 4 C 151 SER B 53 SER.? 1000.00 C 164 TYR B 123 TYR.? 1000.00 C 168 LYS B 55 LYS.? 1000.00 coo 11.22 34.38 82.32 11.07 36.29 83.78 54.98 0.20 2.05 55.66 -1.87 3.14 coo 8.83 39.27 87.38 7.60 37.43 85.69 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 12.98 34.46 88.14 8.11 32.96 87.14 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1gz6_c02 source 1gz6 ESTRADIOL 17 BETA-DEHYDROGENASE 4 : 4 hits 1gz6_c02 naa= 3 ULMN 3 1gz6_c03 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 1 3 # 1 D 151 SER A 53 SER.? 1000.00 D 164 TYR A 54 TYR.? 1000.00 D 168 LYS A 55 LYS.? 1000.00 coo 29.15 32.90 92.57 27.86 31.44 94.02 1.42 3.02 4.29 0.48 5.03 5.27 coo 25.49 30.28 98.59 27.88 31.73 98.26 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 23.46 34.31 94.02 27.08 36.46 97.29 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1gz6_c03 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 2 3 # 2 D 151 SER A 53 SER.? 1000.00 D 164 TYR A 123 TYR.? 1000.00 D 168 LYS A 55 LYS.? 1000.00 coo 29.15 32.90 92.57 27.86 31.44 94.02 1.42 3.02 4.29 0.48 5.03 5.27 coo 25.49 30.28 98.59 27.88 31.73 98.26 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 23.46 34.31 94.02 27.08 36.46 97.29 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1gz6_c03 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 3 3 # 3 D 151 SER B 53 SER.? 1000.00 D 164 TYR B 54 TYR.? 1000.00 D 168 LYS B 55 LYS.? 1000.00 coo 29.15 32.90 92.57 27.86 31.44 94.02 54.98 0.20 2.05 55.66 -1.87 3.14 coo 25.49 30.28 98.59 27.88 31.73 98.26 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 23.46 34.31 94.02 27.08 36.46 97.29 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1gz6_c03 ESTRADIOL 17 BETA-DEHYDROGENASE 4 user 4 3 # 4 D 151 SER B 53 SER.? 1000.00 D 164 TYR B 123 TYR.? 1000.00 D 168 LYS B 55 LYS.? 1000.00 coo 29.15 32.90 92.57 27.86 31.44 94.02 54.98 0.20 2.05 55.66 -1.87 3.14 coo 25.49 30.28 98.59 27.88 31.73 98.26 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 23.46 34.31 94.02 27.08 36.46 97.29 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1gz6_c03 source 1gz6 ESTRADIOL 17 BETA-DEHYDROGENASE 4 : 4 hits 1gz6_c03 naa= 3 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 1 3 # 1 A 50 ASP A 99 ASP.? 1000.00 A 327 GLU B 73 GLU.? 1000.00 A 339 ARG B 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 6.07 5.96 -16.72 5.18 4.09 -17.03 coo 75.11 41.01 160.30 76.65 40.06 161.41 23.38 -12.14 25.82 23.41 -12.13 27.93 coo 82.23 40.35 159.87 85.09 40.67 161.01 26.00 -6.26 25.33 29.00 -5.64 25.39 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 2 3 # 2 A 50 ASP A 99 ASP.? 1000.00 A 327 GLU B 78 GLU~? 1000.00 A 339 ARG B 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 6.07 5.96 -16.72 5.18 4.09 -17.03 coo 75.11 41.01 160.30 76.65 40.06 161.41 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 82.23 40.35 159.87 85.09 40.67 161.01 26.00 -6.26 25.33 29.00 -5.64 25.39 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 3 3 # 3 A 50 ASP A 99 ASP.? 1000.00 A 327 GLU B 78 GLU~? 1000.00 A 339 ARG B 79 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 6.07 5.96 -16.72 5.18 4.09 -17.03 coo 75.11 41.01 160.30 76.65 40.06 161.41 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 82.23 40.35 159.87 85.09 40.67 161.01 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 4 3 # 4 A 50 ASP A 99 ASP.? 1000.00 A 327 GLU B 86 GLU~? 1000.00 A 339 ARG B 91 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 6.07 5.96 -16.72 5.18 4.09 -17.03 coo 75.11 41.01 160.30 76.65 40.06 161.41 45.30 -6.76 11.82 47.29 -7.30 12.26 coo 82.23 40.35 159.87 85.09 40.67 161.01 43.95 -11.42 5.31 46.09 -9.81 6.81 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 5 3 # 5 A 50 ASP A 100 ASP.? 1000.00 A 327 GLU B 73 GLU.? 1000.00 A 339 ARG B 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 75.11 41.01 160.30 76.65 40.06 161.41 23.38 -12.14 25.82 23.41 -12.13 27.93 coo 82.23 40.35 159.87 85.09 40.67 161.01 26.00 -6.26 25.33 29.00 -5.64 25.39 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 6 3 # 6 A 50 ASP A 100 ASP.? 1000.00 A 327 GLU B 78 GLU~? 1000.00 A 339 ARG B 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 75.11 41.01 160.30 76.65 40.06 161.41 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 82.23 40.35 159.87 85.09 40.67 161.01 26.00 -6.26 25.33 29.00 -5.64 25.39 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 7 3 # 7 A 50 ASP A 100 ASP.? 1000.00 A 327 GLU B 78 GLU~? 1000.00 A 339 ARG B 79 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 75.11 41.01 160.30 76.65 40.06 161.41 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 82.23 40.35 159.87 85.09 40.67 161.01 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 8 3 # 8 A 50 ASP A 100 ASP.? 1000.00 A 327 GLU B 81 GLU~? 1000.00 A 339 ARG B 79 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 75.11 41.01 160.30 76.65 40.06 161.41 38.01 0.54 22.61 37.05 1.66 24.13 coo 82.23 40.35 159.87 85.09 40.67 161.01 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 9 3 # 9 A 50 ASP A 120 ASP.? 1000.00 A 327 GLU A 73 GLU.? 1000.00 A 339 ARG A 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 75.11 41.01 160.30 76.65 40.06 161.41 35.24 14.24 25.23 35.01 14.32 27.33 coo 82.23 40.35 159.87 85.09 40.67 161.01 32.14 8.48 25.15 29.08 8.40 25.40 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 10 3 # 10 A 50 ASP A 120 ASP.? 1000.00 A 327 GLU B 73 GLU.? 1000.00 A 339 ARG B 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 75.11 41.01 160.30 76.65 40.06 161.41 23.38 -12.14 25.82 23.41 -12.13 27.93 coo 82.23 40.35 159.87 85.09 40.67 161.01 26.00 -6.26 25.33 29.00 -5.64 25.39 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 11 3 # 11 A 50 ASP A 120 ASP.? 1000.00 A 327 GLU B 78 GLU~? 1000.00 A 339 ARG B 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 75.11 41.01 160.30 76.65 40.06 161.41 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 82.23 40.35 159.87 85.09 40.67 161.01 26.00 -6.26 25.33 29.00 -5.64 25.39 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 12 3 # 12 A 50 ASP A 120 ASP.? 1000.00 A 327 GLU B 78 GLU~? 1000.00 A 339 ARG B 79 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 75.11 41.01 160.30 76.65 40.06 161.41 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 82.23 40.35 159.87 85.09 40.67 161.01 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 13 3 # 13 A 50 ASP A 120 ASP.? 1000.00 A 327 GLU B 81 GLU~? 1000.00 A 339 ARG B 79 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 75.11 41.01 160.30 76.65 40.06 161.41 38.01 0.54 22.61 37.05 1.66 24.13 coo 82.23 40.35 159.87 85.09 40.67 161.01 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 14 3 # 14 A 50 ASP A 120 ASP.? 1000.00 A 327 GLU B 118 GLU^? 1000.00 A 339 ARG B 97 ARG^? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 75.11 41.01 160.30 76.65 40.06 161.41 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 82.23 40.35 159.87 85.09 40.67 161.01 48.24 -7.34 -13.18 47.41 -10.11 -14.15 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 15 3 # 15 A 50 ASP A 121 ASP.? 1000.00 A 327 GLU A 73 GLU.? 1000.00 A 339 ARG A 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 -0.75 5.29 -6.38 -2.02 4.12 -7.60 coo 75.11 41.01 160.30 76.65 40.06 161.41 35.24 14.24 25.23 35.01 14.32 27.33 coo 82.23 40.35 159.87 85.09 40.67 161.01 32.14 8.48 25.15 29.08 8.40 25.40 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 16 3 # 16 A 50 ASP A 121 ASP.? 1000.00 A 327 GLU B 78 GLU~? 1000.00 A 339 ARG B 79 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 -0.75 5.29 -6.38 -2.02 4.12 -7.60 coo 75.11 41.01 160.30 76.65 40.06 161.41 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 82.23 40.35 159.87 85.09 40.67 161.01 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 17 3 # 17 A 50 ASP A 121 ASP.? 1000.00 A 327 GLU B 81 GLU~? 1000.00 A 339 ARG B 79 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 -0.75 5.29 -6.38 -2.02 4.12 -7.60 coo 75.11 41.01 160.30 76.65 40.06 161.41 38.01 0.54 22.61 37.05 1.66 24.13 coo 82.23 40.35 159.87 85.09 40.67 161.01 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 18 3 # 18 A 50 ASP B 99 ASP.? 1000.00 A 327 GLU A 73 GLU.? 1000.00 A 339 ARG A 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo 75.11 41.01 160.30 76.65 40.06 161.41 35.24 14.24 25.23 35.01 14.32 27.33 coo 82.23 40.35 159.87 85.09 40.67 161.01 32.14 8.48 25.15 29.08 8.40 25.40 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 19 3 # 19 A 50 ASP B 99 ASP.? 1000.00 A 327 GLU A 86 GLU~? 1000.00 A 339 ARG A 91 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo 75.11 41.01 160.30 76.65 40.06 161.41 12.00 9.86 13.36 10.03 10.14 14.08 coo 82.23 40.35 159.87 85.09 40.67 161.01 12.16 14.02 5.92 12.58 13.79 8.95 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 20 3 # 20 A 50 ASP B 100 ASP.? 1000.00 A 327 GLU A 73 GLU.? 1000.00 A 339 ARG A 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 75.11 41.01 160.30 76.65 40.06 161.41 35.24 14.24 25.23 35.01 14.32 27.33 coo 82.23 40.35 159.87 85.09 40.67 161.01 32.14 8.48 25.15 29.08 8.40 25.40 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 21 3 # 21 A 50 ASP B 100 ASP.? 1000.00 A 327 GLU A 78 GLU~? 1000.00 A 339 ARG A 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 75.11 41.01 160.30 76.65 40.06 161.41 24.87 6.26 25.01 26.83 7.05 24.99 coo 82.23 40.35 159.87 85.09 40.67 161.01 32.14 8.48 25.15 29.08 8.40 25.40 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 22 3 # 22 A 50 ASP B 100 ASP.? 1000.00 A 327 GLU A 78 GLU~? 1000.00 A 339 ARG A 79 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 75.11 41.01 160.30 76.65 40.06 161.41 24.87 6.26 25.01 26.83 7.05 24.99 coo 82.23 40.35 159.87 85.09 40.67 161.01 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 23 3 # 23 A 50 ASP B 100 ASP.? 1000.00 A 327 GLU B 73 GLU.? 1000.00 A 339 ARG B 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 75.11 41.01 160.30 76.65 40.06 161.41 23.38 -12.14 25.82 23.41 -12.13 27.93 coo 82.23 40.35 159.87 85.09 40.67 161.01 26.00 -6.26 25.33 29.00 -5.64 25.39 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 24 3 # 24 A 50 ASP B 120 ASP.? 1000.00 A 327 GLU A 78 GLU~? 1000.00 A 339 ARG A 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 75.11 41.01 160.30 76.65 40.06 161.41 24.87 6.26 25.01 26.83 7.05 24.99 coo 82.23 40.35 159.87 85.09 40.67 161.01 32.14 8.48 25.15 29.08 8.40 25.40 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 25 3 # 25 A 50 ASP B 120 ASP.? 1000.00 A 327 GLU A 78 GLU~? 1000.00 A 339 ARG A 79 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 75.11 41.01 160.30 76.65 40.06 161.41 24.87 6.26 25.01 26.83 7.05 24.99 coo 82.23 40.35 159.87 85.09 40.67 161.01 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 26 3 # 26 A 50 ASP B 121 ASP.? 1000.00 A 327 GLU A 86 GLU~? 1000.00 A 339 ARG A 91 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 55.83 -1.01 -8.85 57.04 -0.03 -10.25 coo 75.11 41.01 160.30 76.65 40.06 161.41 12.00 9.86 13.36 10.03 10.14 14.08 coo 82.23 40.35 159.87 85.09 40.67 161.01 12.16 14.02 5.92 12.58 13.79 8.95 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 27 3 # 27 A 50 ASP B 121 ASP.? 1000.00 A 327 GLU B 73 GLU.? 1000.00 A 339 ARG B 74 ARG.? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 55.83 -1.01 -8.85 57.04 -0.03 -10.25 coo 75.11 41.01 160.30 76.65 40.06 161.41 23.38 -12.14 25.82 23.41 -12.13 27.93 coo 82.23 40.35 159.87 85.09 40.67 161.01 26.00 -6.26 25.33 29.00 -5.64 25.39 1hto_c00 source 1hto GLUTAMINE SYNTHETASE : 27 hits 1hto_c00 naa= 3 ULMN 3 1i19_c00 CHOLESTEROL OXIDASE user 1 3 # 1 A 311 GLU A 76 GLU~? 1000.00 A 475 GLU A 78 GLU~? 1000.00 A 477 ARG A 79 ARG~? 1000.00 coo 13.27 46.15 59.96 13.96 44.19 59.76 28.32 10.24 22.30 27.15 11.94 22.76 coo 9.69 44.01 59.12 10.58 42.11 58.89 24.87 6.26 25.01 26.83 7.05 24.99 coo 13.49 45.17 55.56 13.84 42.22 54.75 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1i19_c00 CHOLESTEROL OXIDASE user 2 3 # 2 A 311 GLU A 78 GLU~? 1000.00 A 475 GLU A 76 GLU~? 1000.00 A 477 ARG A 79 ARG~? 1000.00 coo 13.27 46.15 59.96 13.96 44.19 59.76 24.87 6.26 25.01 26.83 7.05 24.99 coo 9.69 44.01 59.12 10.58 42.11 58.89 28.32 10.24 22.30 27.15 11.94 22.76 coo 13.49 45.17 55.56 13.84 42.22 54.75 23.98 10.05 21.41 23.46 12.49 19.64 1i19_c00 source 1i19 CHOLESTEROL OXIDASE : 2 hits 1i19_c00 naa= 3 ULMN 3 1i19_c01 CHOLESTEROL OXIDASE user 1 3 # 1 B 311 GLU A 76 GLU~? 1000.00 B 475 GLU A 78 GLU~? 1000.00 B 477 ARG A 79 ARG~? 1000.00 coo 42.69 29.93 84.57 42.00 28.96 82.83 28.32 10.24 22.30 27.15 11.94 22.76 coo 46.14 28.45 82.89 45.10 27.86 81.15 24.87 6.26 25.01 26.83 7.05 24.99 coo 42.47 25.53 85.29 42.25 23.66 82.85 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1i19_c01 CHOLESTEROL OXIDASE user 2 3 # 2 B 311 GLU A 78 GLU~? 1000.00 B 475 GLU A 76 GLU~? 1000.00 B 477 ARG A 79 ARG~? 1000.00 coo 42.69 29.93 84.57 42.00 28.96 82.83 24.87 6.26 25.01 26.83 7.05 24.99 coo 46.14 28.45 82.89 45.10 27.86 81.15 28.32 10.24 22.30 27.15 11.94 22.76 coo 42.47 25.53 85.29 42.25 23.66 82.85 23.98 10.05 21.41 23.46 12.49 19.64 1i19_c01 source 1i19 CHOLESTEROL OXIDASE : 2 hits 1i19_c01 naa= 3 ULMN 3 1i29_c01 CSDB user 1 3 # 1 A 123 HIS B 34 HIS~? 1000.00 A 200 ASP B 33 ASP~? 1000.00 A 226 LYS B 41 LYS.? 1000.00 coo 23.24 46.58 4.39 24.43 46.59 2.66 41.87 5.60 12.60 42.81 7.10 11.48 coo 24.51 43.28 11.18 25.17 44.50 9.58 37.13 3.30 17.02 39.09 3.64 17.72 coo 34.47 51.09 7.19 28.58 51.18 7.53 33.89 10.98 6.00 33.54 14.13 10.34 1i29_c01 source 1i29 CSDB : 1 hits 1i29_c01 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL A 13 VAL.? 1000.00 A 200 ASP A 120 ASP.? 1000.00 A 226 LYS A 55 LYS.? 1000.00 coo 19.13 38.05 1.41 19.72 38.80 -0.53 12.42 2.64 -15.79 12.92 3.87 -14.06 coo 24.51 43.28 11.18 25.17 44.50 9.58 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 34.47 51.09 7.19 28.58 51.18 7.53 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1i29_c03 CSDB user 2 3 # 2 A 128 VAL B 13 VAL.? 1000.00 A 200 ASP B 120 ASP.? 1000.00 A 226 LYS B 55 LYS.? 1000.00 coo 19.13 38.05 1.41 19.72 38.80 -0.53 41.99 0.40 -17.37 42.08 -0.85 -15.58 coo 24.51 43.28 11.18 25.17 44.50 9.58 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 34.47 51.09 7.19 28.58 51.18 7.53 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1i29_c03 CSDB user 3 3 # 3 A 128 VAL B 88 VAL~? 1000.00 A 200 ASP B 33 ASP~? 1000.00 A 226 LYS B 41 LYS.? 1000.00 coo 19.13 38.05 1.41 19.72 38.80 -0.53 38.10 -8.03 9.86 37.15 -6.54 11.15 coo 24.51 43.28 11.18 25.17 44.50 9.58 37.13 3.30 17.02 39.09 3.64 17.72 coo 34.47 51.09 7.19 28.58 51.18 7.53 33.89 10.98 6.00 33.54 14.13 10.34 1i29_c03 source 1i29 CSDB : 3 hits 1i29_c03 naa= 3 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 # 1 A 55 ASP A 120 ASP.? 1000.00 A 58 ASP A 121 ASP.? 1000.00 A 424 GLU A 118 GLU^? 1000.00 coo 58.42 47.76 20.67 58.01 49.10 19.12 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 58.59 41.80 18.81 58.94 43.89 18.94 -0.75 5.29 -6.38 -2.02 4.12 -7.60 coo 52.85 46.34 13.34 54.09 44.97 14.42 8.38 7.16 -4.95 8.02 9.11 -4.23 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 2 3 # 2 A 55 ASP A 121 ASP.? 1000.00 A 58 ASP A 120 ASP.? 1000.00 A 424 GLU A 118 GLU^? 1000.00 coo 58.42 47.76 20.67 58.01 49.10 19.12 -0.75 5.29 -6.38 -2.02 4.12 -7.60 coo 58.59 41.80 18.81 58.94 43.89 18.94 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 52.85 46.34 13.34 54.09 44.97 14.42 8.38 7.16 -4.95 8.02 9.11 -4.23 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 3 3 # 3 A 55 ASP B 120 ASP.? 1000.00 A 58 ASP B 121 ASP.? 1000.00 A 424 GLU B 118 GLU^? 1000.00 coo 58.42 47.76 20.67 58.01 49.10 19.12 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 58.59 41.80 18.81 58.94 43.89 18.94 55.83 -1.01 -8.85 57.04 -0.03 -10.25 coo 52.85 46.34 13.34 54.09 44.97 14.42 47.80 -3.78 -6.65 48.51 -5.65 -5.96 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 4 3 # 4 A 55 ASP B 121 ASP.? 1000.00 A 58 ASP B 120 ASP.? 1000.00 A 424 GLU B 118 GLU^? 1000.00 coo 58.42 47.76 20.67 58.01 49.10 19.12 55.83 -1.01 -8.85 57.04 -0.03 -10.25 coo 58.59 41.80 18.81 58.94 43.89 18.94 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 52.85 46.34 13.34 54.09 44.97 14.42 47.80 -3.78 -6.65 48.51 -5.65 -5.96 1js4_c00 source 1js4 ENDO-EXOCELLULASE E4 : 4 hits 1js4_c00 naa= 3 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 # 1 B 55 ASP A 120 ASP.? 1000.00 B 58 ASP A 121 ASP.? 1000.00 B 424 GLU A 118 GLU^? 1000.00 coo 112.10 61.46 19.99 111.82 60.65 18.07 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 117.85 63.62 21.08 115.96 63.25 20.18 -0.75 5.29 -6.38 -2.02 4.12 -7.60 coo 118.47 57.23 15.57 119.32 58.77 16.73 8.38 7.16 -4.95 8.02 9.11 -4.23 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 2 3 # 2 B 55 ASP A 121 ASP.? 1000.00 B 58 ASP A 120 ASP.? 1000.00 B 424 GLU A 118 GLU^? 1000.00 coo 112.10 61.46 19.99 111.82 60.65 18.07 -0.75 5.29 -6.38 -2.02 4.12 -7.60 coo 117.85 63.62 21.08 115.96 63.25 20.18 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 118.47 57.23 15.57 119.32 58.77 16.73 8.38 7.16 -4.95 8.02 9.11 -4.23 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 3 3 # 3 B 55 ASP B 120 ASP.? 1000.00 B 58 ASP B 121 ASP.? 1000.00 B 424 GLU B 118 GLU^? 1000.00 coo 112.10 61.46 19.99 111.82 60.65 18.07 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 117.85 63.62 21.08 115.96 63.25 20.18 55.83 -1.01 -8.85 57.04 -0.03 -10.25 coo 118.47 57.23 15.57 119.32 58.77 16.73 47.80 -3.78 -6.65 48.51 -5.65 -5.96 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 4 3 # 4 B 55 ASP B 121 ASP.? 1000.00 B 58 ASP B 120 ASP.? 1000.00 B 424 GLU B 118 GLU^? 1000.00 coo 112.10 61.46 19.99 111.82 60.65 18.07 55.83 -1.01 -8.85 57.04 -0.03 -10.25 coo 117.85 63.62 21.08 115.96 63.25 20.18 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 118.47 57.23 15.57 119.32 58.77 16.73 47.80 -3.78 -6.65 48.51 -5.65 -5.96 1js4_c01 source 1js4 ENDO-EXOCELLULASE E4 : 4 hits 1js4_c01 naa= 3 ULMN 3 1kdg_c02 CELLOBIOSE DEHYDROGENASE user 1 3 # 1 A 609 TYR A 31 TYR~? 1000.00 A 689 HIS A 34 HIS~? 1000.00 A 732 ASN A 30 ASN.? 1000.00 coo 22.52 29.89 18.33 23.85 28.06 20.03 14.76 2.26 18.96 12.86 3.20 20.79 coo 24.46 23.36 17.42 25.88 24.61 18.33 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 27.06 24.40 21.98 27.51 26.43 21.46 12.99 1.13 13.14 11.29 0.22 12.22 ULMN 3 1kdg_c02 CELLOBIOSE DEHYDROGENASE user 2 3 # 2 A 609 TYR B 31 TYR~? 1000.00 A 689 HIS B 34 HIS~? 1000.00 A 732 ASN B 30 ASN.? 1000.00 coo 22.52 29.89 18.33 23.85 28.06 20.03 42.93 0.52 17.54 44.90 -0.41 19.30 coo 24.46 23.36 17.42 25.88 24.61 18.33 41.87 5.60 12.60 42.81 7.10 11.48 coo 27.06 24.40 21.98 27.51 26.43 21.46 44.16 1.73 11.59 45.65 3.03 10.80 1kdg_c02 source 1kdg CELLOBIOSE DEHYDROGENASE : 2 hits 1kdg_c02 naa= 3 ULMN 3 1kdg_c03 CELLOBIOSE DEHYDROGENASE user 1 3 # 1 B 609 TYR A 31 TYR~? 1000.00 B 689 HIS A 34 HIS~? 1000.00 B 732 ASN A 30 ASN.? 1000.00 coo 25.77 15.27 -24.02 28.47 14.70 -24.59 14.76 2.26 18.96 12.86 3.20 20.79 coo 31.55 17.32 -20.91 31.51 15.29 -21.43 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 33.56 13.69 -24.17 31.95 12.28 -24.00 12.99 1.13 13.14 11.29 0.22 12.22 ULMN 3 1kdg_c03 CELLOBIOSE DEHYDROGENASE user 2 3 # 2 B 609 TYR B 31 TYR~? 1000.00 B 689 HIS B 34 HIS~? 1000.00 B 732 ASN B 30 ASN.? 1000.00 coo 25.77 15.27 -24.02 28.47 14.70 -24.59 42.93 0.52 17.54 44.90 -0.41 19.30 coo 31.55 17.32 -20.91 31.51 15.29 -21.43 41.87 5.60 12.60 42.81 7.10 11.48 coo 33.56 13.69 -24.17 31.95 12.28 -24.00 44.16 1.73 11.59 45.65 3.03 10.80 1kdg_c03 source 1kdg CELLOBIOSE DEHYDROGENASE : 2 hits 1kdg_c03 naa= 3 ULMN 3 1kim_c00 THYMIDINE KINASE user 1 3 # 1 A 83 GLU A 76 GLU~? 1000.00 A 163 ARG A 74 ARG.? 1000.00 A 222 ARG A 79 ARG~? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 28.32 10.24 22.30 27.15 11.94 22.76 coo 48.06 78.22 50.94 48.51 78.27 53.98 32.14 8.48 25.15 29.08 8.40 25.40 coo 54.85 84.16 52.60 54.26 81.23 53.34 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1kim_c00 THYMIDINE KINASE user 2 3 # 2 A 83 GLU A 76 GLU~? 1000.00 A 163 ARG A 79 ARG~? 1000.00 A 222 ARG A 74 ARG.? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 28.32 10.24 22.30 27.15 11.94 22.76 coo 48.06 78.22 50.94 48.51 78.27 53.98 23.98 10.05 21.41 23.46 12.49 19.64 coo 54.85 84.16 52.60 54.26 81.23 53.34 32.14 8.48 25.15 29.08 8.40 25.40 ULMN 3 1kim_c00 THYMIDINE KINASE user 3 3 # 3 A 83 GLU A 78 GLU~? 1000.00 A 163 ARG A 79 ARG~? 1000.00 A 222 ARG A 74 ARG.? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 24.87 6.26 25.01 26.83 7.05 24.99 coo 48.06 78.22 50.94 48.51 78.27 53.98 23.98 10.05 21.41 23.46 12.49 19.64 coo 54.85 84.16 52.60 54.26 81.23 53.34 32.14 8.48 25.15 29.08 8.40 25.40 ULMN 3 1kim_c00 THYMIDINE KINASE user 4 3 # 4 A 83 GLU B 76 GLU~? 1000.00 A 163 ARG B 74 ARG.? 1000.00 A 222 ARG B 79 ARG~? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 48.06 78.22 50.94 48.51 78.27 53.98 26.00 -6.26 25.33 29.00 -5.64 25.39 coo 54.85 84.16 52.60 54.26 81.23 53.34 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1kim_c00 THYMIDINE KINASE user 5 3 # 5 A 83 GLU B 76 GLU~? 1000.00 A 163 ARG B 79 ARG~? 1000.00 A 222 ARG B 74 ARG.? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 29.60 -7.66 22.07 30.61 -9.52 22.20 coo 48.06 78.22 50.94 48.51 78.27 53.98 34.23 -7.42 21.18 34.10 -9.69 19.14 coo 54.85 84.16 52.60 54.26 81.23 53.34 26.00 -6.26 25.33 29.00 -5.64 25.39 ULMN 3 1kim_c00 THYMIDINE KINASE user 6 3 # 6 A 83 GLU B 78 GLU~? 1000.00 A 163 ARG B 79 ARG~? 1000.00 A 222 ARG B 74 ARG.? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 33.27 -3.24 24.53 31.20 -3.63 24.37 coo 48.06 78.22 50.94 48.51 78.27 53.98 34.23 -7.42 21.18 34.10 -9.69 19.14 coo 54.85 84.16 52.60 54.26 81.23 53.34 26.00 -6.26 25.33 29.00 -5.64 25.39 ULMN 3 1kim_c00 THYMIDINE KINASE user 7 3 # 7 A 83 GLU B 118 GLU^? 1000.00 A 163 ARG B 95 ARG^? 1000.00 A 222 ARG B 97 ARG^? 1000.00 coo 51.27 81.34 48.31 51.67 80.79 50.28 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 48.06 78.22 50.94 48.51 78.27 53.98 45.21 -7.59 -5.33 46.47 -7.64 -2.54 coo 54.85 84.16 52.60 54.26 81.23 53.34 48.24 -7.34 -13.18 47.41 -10.11 -14.15 1kim_c00 source 1kim THYMIDINE KINASE : 7 hits 1kim_c00 naa= 3 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 # 1 255 ASP B 99 ASP.? 1000.00 262 LYS B 14 LYS.? 1000.00 336 ARG B 95 ARG^? 1000.00 coo 61.88 50.78 12.96 63.84 50.60 13.71 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo 63.59 44.40 18.32 63.20 49.74 17.95 44.48 3.32 -17.22 49.33 1.95 -20.50 coo 72.60 57.42 15.86 71.61 56.68 18.70 45.21 -7.59 -5.33 46.47 -7.64 -2.54 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP B 100 ASP.? 1000.00 262 LYS B 14 LYS.? 1000.00 336 ARG B 95 ARG^? 1000.00 coo 61.88 50.78 12.96 63.84 50.60 13.71 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 63.59 44.40 18.32 63.20 49.74 17.95 44.48 3.32 -17.22 49.33 1.95 -20.50 coo 72.60 57.42 15.86 71.61 56.68 18.70 45.21 -7.59 -5.33 46.47 -7.64 -2.54 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 2 hits 1lam_c00 naa= 3 ULMN 3 1mpp_c04 PEPSIN (RENIN) (E.C.3.4.23.23) user 1 3 # 1 32 ASP A 100 ASP.? 1000.00 35 SER A 101 SER~? 1000.00 215 ASP A 99 ASP.? 1000.00 coo 20.97 14.47 32.28 19.66 15.96 31.62 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 16.04 14.72 33.82 17.27 13.71 31.95 12.85 8.31 -19.30 13.97 10.47 -19.16 coo 20.65 22.00 33.80 20.06 20.56 32.39 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1mpp_c04 PEPSIN (RENIN) (E.C.3.4.23.23) user 2 3 # 2 32 ASP B 100 ASP.? 1000.00 35 SER B 101 SER~? 1000.00 215 ASP B 99 ASP.? 1000.00 coo 20.97 14.47 32.28 19.66 15.96 31.62 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 16.04 14.72 33.82 17.27 13.71 31.95 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo 20.65 22.00 33.80 20.06 20.56 32.39 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1mpp_c04 source 1mpp PEPSIN (RENIN) (E.C.3.4.23.23) : 2 hits 1mpp_c04 naa= 3 ULMN 3 1naa_c02 CELLOBIOSE DEHYDROGENASE user 1 3 # 1 A 609 TYR A 31 TYR~? 1000.00 A 689 HIS A 34 HIS~? 1000.00 A 732 ASN A 30 ASN.? 1000.00 coo 23.89 30.33 18.51 26.53 29.83 17.65 14.76 2.26 18.96 12.86 3.20 20.79 coo 24.69 23.24 17.44 26.23 24.43 18.22 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 27.47 24.40 22.13 27.89 26.42 21.78 12.99 1.13 13.14 11.29 0.22 12.22 ULMN 3 1naa_c02 CELLOBIOSE DEHYDROGENASE user 2 3 # 2 A 609 TYR B 31 TYR~? 1000.00 A 689 HIS B 34 HIS~? 1000.00 A 732 ASN B 30 ASN.? 1000.00 coo 23.89 30.33 18.51 26.53 29.83 17.65 42.93 0.52 17.54 44.90 -0.41 19.30 coo 24.69 23.24 17.44 26.23 24.43 18.22 41.87 5.60 12.60 42.81 7.10 11.48 coo 27.47 24.40 22.13 27.89 26.42 21.78 44.16 1.73 11.59 45.65 3.03 10.80 1naa_c02 source 1naa CELLOBIOSE DEHYDROGENASE : 2 hits 1naa_c02 naa= 3 ULMN 3 1naa_c03 CELLOBIOSE DEHYDROGENASE user 1 3 # 1 B 609 TYR A 31 TYR~? 1000.00 B 689 HIS A 34 HIS~? 1000.00 B 732 ASN A 30 ASN.? 1000.00 coo 26.13 14.71 -23.89 27.40 13.01 -22.05 14.76 2.26 18.96 12.86 3.20 20.79 coo 31.95 18.02 -21.08 31.88 15.94 -21.37 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 33.92 13.94 -24.42 32.27 12.62 -24.35 12.99 1.13 13.14 11.29 0.22 12.22 ULMN 3 1naa_c03 CELLOBIOSE DEHYDROGENASE user 2 3 # 2 B 609 TYR B 31 TYR~? 1000.00 B 689 HIS B 34 HIS~? 1000.00 B 732 ASN B 30 ASN.? 1000.00 coo 26.13 14.71 -23.89 27.40 13.01 -22.05 42.93 0.52 17.54 44.90 -0.41 19.30 coo 31.95 18.02 -21.08 31.88 15.94 -21.37 41.87 5.60 12.60 42.81 7.10 11.48 coo 33.92 13.94 -24.42 32.27 12.62 -24.35 44.16 1.73 11.59 45.65 3.03 10.80 1naa_c03 source 1naa CELLOBIOSE DEHYDROGENASE : 2 hits 1naa_c03 naa= 3 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 1 3 # 1 B 59 GLU A 86 GLU~? 1000.00 B 128 HIS A 34 HIS~? 1000.00 C 263 HIS A 25 HIS.? 1000.00 coo 6.12 5.94 82.00 7.16 6.32 83.81 12.00 9.86 13.36 10.03 10.14 14.08 coo 12.51 16.35 80.99 13.16 14.90 82.37 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 11.58 14.94 93.26 12.25 14.03 91.50 10.94 -1.26 4.23 9.26 -2.11 5.16 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 2 3 # 2 B 59 GLU B 86 GLU~? 1000.00 B 128 HIS B 34 HIS~? 1000.00 C 263 HIS B 25 HIS.? 1000.00 coo 6.12 5.94 82.00 7.16 6.32 83.81 45.30 -6.76 11.82 47.29 -7.30 12.26 coo 12.51 16.35 80.99 13.16 14.90 82.37 41.87 5.60 12.60 42.81 7.10 11.48 coo 11.58 14.94 93.26 12.25 14.03 91.50 45.20 4.85 2.41 47.00 5.76 2.99 1ni4_c00 source 1ni4 PYRUVATE DEHYDROGENASE E1 COMPONENT: ALPHA SUB: 2 hits 1ni4_c00 naa= 3 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 1 3 # 1 A 263 HIS A 25 HIS.? 1000.00 D 59 GLU A 86 GLU~? 1000.00 D 128 HIS A 34 HIS~? 1000.00 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 12.00 9.86 13.36 10.03 10.14 14.08 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 15.31 -2.76 13.60 14.28 -4.22 12.50 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 2 3 # 2 A 263 HIS B 25 HIS.? 1000.00 D 59 GLU B 86 GLU~? 1000.00 D 128 HIS B 34 HIS~? 1000.00 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 45.20 4.85 2.41 47.00 5.76 2.99 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 45.30 -6.76 11.82 47.29 -7.30 12.26 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 41.87 5.60 12.60 42.81 7.10 11.48 1ni4_c01 source 1ni4 PYRUVATE DEHYDROGENASE E1 COMPONENT: ALPHA SUB: 2 hits 1ni4_c01 naa= 3 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG B 97 ARG^? 1000.00 A 101 ASP B 99 ASP.? 1000.00 A 132 ASP B 120 ASP.? 1000.00 coo 11.61 22.83 17.30 14.06 21.71 15.78 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 11.37 24.94 11.48 12.48 24.45 13.28 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo 16.14 18.17 13.37 15.92 19.81 14.71 53.95 -3.06 -13.70 52.62 -2.92 -15.33 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG B 97 ARG^? 1000.00 A 101 ASP B 120 ASP.? 1000.00 A 132 ASP B 99 ASP.? 1000.00 coo 11.61 22.83 17.30 14.06 21.71 15.78 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 11.37 24.94 11.48 12.48 24.45 13.28 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 16.14 18.17 13.37 15.92 19.81 14.71 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1nu3_c00 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nu3_c00 naa= 3 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG B 97 ARG^? 1000.00 B 101 ASP B 99 ASP.? 1000.00 B 132 ASP B 120 ASP.? 1000.00 coo 11.61 3.43 18.38 9.11 4.29 16.86 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 11.74 0.51 12.98 10.75 1.32 14.67 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo 6.93 7.52 14.08 7.18 6.08 15.65 53.95 -3.06 -13.70 52.62 -2.92 -15.33 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG B 97 ARG^? 1000.00 B 101 ASP B 120 ASP.? 1000.00 B 132 ASP B 99 ASP.? 1000.00 coo 11.61 3.43 18.38 9.11 4.29 16.86 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 11.74 0.51 12.98 10.75 1.32 14.67 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 6.93 7.52 14.08 7.18 6.08 15.65 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1nu3_c01 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nu3_c01 naa= 3 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG B 97 ARG^? 1000.00 A 101 ASP B 99 ASP.? 1000.00 A 132 ASP B 120 ASP.? 1000.00 coo 11.50 22.77 17.24 14.00 21.62 15.86 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 11.19 25.00 11.76 12.16 24.45 13.59 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo 16.04 18.11 13.43 15.88 19.70 14.83 53.95 -3.06 -13.70 52.62 -2.92 -15.33 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG B 97 ARG^? 1000.00 A 101 ASP B 120 ASP.? 1000.00 A 132 ASP B 99 ASP.? 1000.00 coo 11.50 22.77 17.24 14.00 21.62 15.86 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 11.19 25.00 11.76 12.16 24.45 13.59 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 16.04 18.11 13.43 15.88 19.70 14.83 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1nww_c02 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nww_c02 naa= 3 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG B 97 ARG^? 1000.00 B 101 ASP B 99 ASP.? 1000.00 B 132 ASP B 120 ASP.? 1000.00 coo 11.48 3.09 18.25 9.01 4.07 16.77 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 11.83 0.33 13.01 10.88 1.04 14.81 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo 6.85 7.33 14.07 7.10 5.88 15.60 53.95 -3.06 -13.70 52.62 -2.92 -15.33 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG B 97 ARG^? 1000.00 B 101 ASP B 120 ASP.? 1000.00 B 132 ASP B 99 ASP.? 1000.00 coo 11.48 3.09 18.25 9.01 4.07 16.77 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 11.83 0.33 13.01 10.88 1.04 14.81 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 6.85 7.33 14.07 7.10 5.88 15.60 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1nww_c03 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nww_c03 naa= 3 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 A 175 LYS B 14 LYS.? 1000.00 A 208 GLN B 136 GLN~? 1000.00 A 209 LYS B 135 LYS~? 1000.00 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 44.48 3.32 -17.22 49.33 1.95 -20.50 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 33.13 6.48 -21.17 33.86 8.26 -22.09 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 29.94 8.76 -16.33 31.69 11.42 -12.73 1ohh_c06 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 1 hits 1ohh_c06 naa= 3 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 B 175 LYS B 14 LYS.? 1000.00 B 208 GLN B 136 GLN~? 1000.00 B 209 LYS B 135 LYS~? 1000.00 coo 105.03 46.01 19.55 106.59 42.35 15.55 44.48 3.32 -17.22 49.33 1.95 -20.50 coo 113.93 46.99 13.56 113.37 48.52 14.95 33.13 6.48 -21.17 33.86 8.26 -22.09 coo 115.66 49.12 8.60 111.19 49.52 4.73 29.94 8.76 -16.33 31.69 11.42 -12.73 1ohh_c07 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 1 hits 1ohh_c07 naa= 3 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 C 175 LYS B 14 LYS.? 1000.00 C 208 GLN B 136 GLN~? 1000.00 C 209 LYS B 135 LYS~? 1000.00 coo 100.54 -2.78 25.52 103.29 2.02 24.05 44.48 3.32 -17.22 49.33 1.95 -20.50 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 33.13 6.48 -21.17 33.86 8.26 -22.09 coo 113.62 1.19 33.65 109.52 3.92 36.47 29.94 8.76 -16.33 31.69 11.42 -12.73 1ohh_c08 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 1 hits 1ohh_c08 naa= 3 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 A 24 ASP A 120 ASP.? 1000.00 A 146 TYR A 123 TYR.? 1000.00 A 177 LYS A 55 LYS.? 1000.00 coo -3.50 124.89 25.05 -2.25 124.77 23.26 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 1.87 119.38 16.45 1.41 122.11 16.84 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -2.59 124.07 12.67 -0.91 126.17 18.42 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 A 24 ASP B 21 ASP~? 1000.00 A 146 TYR B 123 TYR.? 1000.00 A 177 LYS B 55 LYS.? 1000.00 coo -3.50 124.89 25.05 -2.25 124.77 23.26 47.17 11.20 -4.12 46.63 12.10 -5.95 coo 1.87 119.38 16.45 1.41 122.11 16.84 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -2.59 124.07 12.67 -0.91 126.17 18.42 50.86 -2.31 -0.81 56.59 -4.06 -2.86 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 120 ASP.? 1000.00 B 146 TYR A 123 TYR.? 1000.00 B 177 LYS A 55 LYS.? 1000.00 coo -7.43 109.06 51.23 -5.84 110.54 50.86 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 0.22 114.56 44.62 -0.76 115.18 47.18 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -4.18 120.17 46.85 -4.02 115.31 51.00 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 B 24 ASP B 21 ASP~? 1000.00 B 146 TYR B 123 TYR.? 1000.00 B 177 LYS B 55 LYS.? 1000.00 coo -7.43 109.06 51.23 -5.84 110.54 50.86 47.17 11.20 -4.12 46.63 12.10 -5.95 coo 0.22 114.56 44.62 -0.76 115.18 47.18 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -4.18 120.17 46.85 -4.02 115.31 51.00 50.86 -2.31 -0.81 56.59 -4.06 -2.86 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 120 ASP.? 1000.00 C 146 TYR A 123 TYR.? 1000.00 C 177 LYS A 55 LYS.? 1000.00 coo -13.49 79.65 43.90 -12.13 80.29 45.45 1.50 5.98 -11.47 2.88 5.62 -13.02 coo -5.65 86.78 48.49 -7.16 84.72 49.65 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -11.22 87.18 53.49 -10.94 81.64 50.31 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 C 24 ASP B 21 ASP~? 1000.00 C 146 TYR B 123 TYR.? 1000.00 C 177 LYS B 55 LYS.? 1000.00 coo -13.49 79.65 43.90 -12.13 80.29 45.45 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -5.65 86.78 48.49 -7.16 84.72 49.65 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -11.22 87.18 53.49 -10.94 81.64 50.31 50.86 -2.31 -0.81 56.59 -4.06 -2.86 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 120 ASP.? 1000.00 D 146 TYR A 123 TYR.? 1000.00 D 177 LYS A 55 LYS.? 1000.00 coo -13.44 77.36 13.12 -12.53 75.97 14.48 1.50 5.98 -11.47 2.88 5.62 -13.02 coo -7.85 74.44 22.75 -9.22 72.86 20.89 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -14.24 70.61 23.48 -12.55 71.73 17.42 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 D 24 ASP B 21 ASP~? 1000.00 D 146 TYR B 123 TYR.? 1000.00 D 177 LYS B 55 LYS.? 1000.00 coo -13.44 77.36 13.12 -12.53 75.97 14.48 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -7.85 74.44 22.75 -9.22 72.86 20.89 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -14.24 70.61 23.48 -12.55 71.73 17.42 50.86 -2.31 -0.81 56.59 -4.06 -2.86 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 120 ASP.? 1000.00 E 146 TYR A 123 TYR.? 1000.00 E 177 LYS A 55 LYS.? 1000.00 coo -7.12 105.25 1.43 -6.30 103.34 0.77 1.50 5.98 -11.47 2.88 5.62 -13.02 coo -3.11 94.55 3.01 -3.83 95.92 0.66 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 E 24 ASP B 21 ASP~? 1000.00 E 146 TYR B 123 TYR.? 1000.00 E 177 LYS B 55 LYS.? 1000.00 coo -7.12 105.25 1.43 -6.30 103.34 0.77 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -3.11 94.55 3.01 -3.83 95.92 0.66 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 50.86 -2.31 -0.81 56.59 -4.06 -2.86 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 120 ASP.? 1000.00 F 146 TYR A 123 TYR.? 1000.00 F 177 LYS A 55 LYS.? 1000.00 coo -44.75 128.15 10.28 -45.68 129.67 11.55 1.50 5.98 -11.47 2.88 5.62 -13.02 coo -50.43 131.90 19.60 -49.04 133.31 17.60 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -44.10 135.86 19.99 -45.67 134.21 14.07 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 F 24 ASP B 21 ASP~? 1000.00 F 146 TYR B 123 TYR.? 1000.00 F 177 LYS B 55 LYS.? 1000.00 coo -44.75 128.15 10.28 -45.68 129.67 11.55 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -50.43 131.90 19.60 -49.04 133.31 17.60 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -44.10 135.86 19.99 -45.67 134.21 14.07 50.86 -2.31 -0.81 56.59 -4.06 -2.86 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 120 ASP.? 1000.00 G 146 TYR A 123 TYR.? 1000.00 G 177 LYS A 55 LYS.? 1000.00 coo -44.97 128.78 41.20 -46.32 128.26 42.83 1.50 5.98 -11.47 2.88 5.62 -13.02 coo -52.83 122.13 46.42 -51.31 124.30 47.39 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -47.30 122.24 51.49 -47.46 127.44 47.81 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 G 24 ASP B 21 ASP~? 1000.00 G 146 TYR B 123 TYR.? 1000.00 G 177 LYS B 55 LYS.? 1000.00 coo -44.97 128.78 41.20 -46.32 128.26 42.83 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -52.83 122.13 46.42 -51.31 124.30 47.39 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -47.30 122.24 51.49 -47.46 127.44 47.81 50.86 -2.31 -0.81 56.59 -4.06 -2.86 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 120 ASP.? 1000.00 H 146 TYR A 123 TYR.? 1000.00 H 177 LYS A 55 LYS.? 1000.00 coo -51.11 100.30 51.41 -52.67 98.82 51.12 1.50 5.98 -11.47 2.88 5.62 -13.02 coo -58.70 94.17 45.32 -57.76 93.82 47.92 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -54.32 88.79 48.13 -54.61 94.04 51.74 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 H 24 ASP B 21 ASP~? 1000.00 H 146 TYR B 123 TYR.? 1000.00 H 177 LYS B 55 LYS.? 1000.00 coo -51.11 100.30 51.41 -52.67 98.82 51.12 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -58.70 94.17 45.32 -57.76 93.82 47.92 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -54.32 88.79 48.13 -54.61 94.04 51.74 50.86 -2.31 -0.81 56.59 -4.06 -2.86 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 120 ASP.? 1000.00 I 146 TYR A 123 TYR.? 1000.00 I 177 LYS A 55 LYS.? 1000.00 coo -54.65 81.97 26.87 -55.88 81.89 25.07 1.50 5.98 -11.47 2.88 5.62 -13.02 coo -59.92 86.62 17.74 -59.42 83.94 18.40 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -55.38 81.61 14.50 -57.11 80.05 20.41 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 I 24 ASP B 21 ASP~? 1000.00 I 146 TYR B 123 TYR.? 1000.00 I 177 LYS B 55 LYS.? 1000.00 coo -54.65 81.97 26.87 -55.88 81.89 25.07 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -59.92 86.62 17.74 -59.42 83.94 18.40 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -55.38 81.61 14.50 -57.11 80.05 20.41 50.86 -2.31 -0.81 56.59 -4.06 -2.86 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 120 ASP.? 1000.00 J 146 TYR A 123 TYR.? 1000.00 J 177 LYS A 55 LYS.? 1000.00 coo -50.64 99.08 1.52 -51.52 100.83 0.67 1.50 5.98 -11.47 2.88 5.62 -13.02 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 J 24 ASP B 21 ASP~? 1000.00 J 146 TYR B 123 TYR.? 1000.00 J 177 LYS B 55 LYS.? 1000.00 coo -50.64 99.08 1.52 -51.52 100.83 0.67 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 50.86 -2.31 -0.81 56.59 -4.06 -2.86 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 51 ASP.? 1000.00 A 96 GLU A 87 GLU~? 1000.00 A 132 LYS A 84 LYS~? 1000.00 coo 31.23 12.29 16.44 30.82 11.56 18.39 5.22 5.50 6.84 4.14 5.83 5.06 coo 26.82 3.20 24.36 27.99 4.86 24.98 15.12 11.62 15.65 15.42 10.65 17.50 coo 29.99 0.62 22.18 30.38 6.69 20.81 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1onr_c00 TRANSALDOLASE B user 2 3 # 2 A 17 ASP A 67 ASP~? 1000.00 A 96 GLU A 87 GLU~? 1000.00 A 132 LYS A 84 LYS~? 1000.00 coo 31.23 12.29 16.44 30.82 11.56 18.39 27.47 11.30 10.36 28.38 13.14 9.88 coo 26.82 3.20 24.36 27.99 4.86 24.98 15.12 11.62 15.65 15.42 10.65 17.50 coo 29.99 0.62 22.18 30.38 6.69 20.81 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1onr_c00 TRANSALDOLASE B user 3 3 # 3 A 17 ASP B 67 ASP~? 1000.00 A 96 GLU B 87 GLU~? 1000.00 A 132 LYS B 84 LYS~? 1000.00 coo 31.23 12.29 16.44 30.82 11.56 18.39 29.42 -8.55 10.33 29.02 -10.62 10.33 coo 26.82 3.20 24.36 27.99 4.86 24.98 41.94 -8.78 14.57 41.73 -8.00 16.51 coo 29.99 0.62 22.18 30.38 6.69 20.81 43.00 -3.73 14.55 45.69 -3.43 18.79 1onr_c00 source 1onr TRANSALDOLASE B : 3 hits 1onr_c00 naa= 3 ULMN 3 1onr_c01 TRANSALDOLASE B user 1 3 # 1 B 17 ASP A 51 ASP.? 1000.00 B 96 GLU A 87 GLU~? 1000.00 B 132 LYS A 84 LYS~? 1000.00 coo 31.16 57.31 -0.94 30.73 56.64 1.01 5.22 5.50 6.84 4.14 5.83 5.06 coo 26.69 48.45 7.18 27.85 50.13 7.74 15.12 11.62 15.65 15.42 10.65 17.50 coo 29.82 45.80 5.07 30.26 51.81 3.56 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1onr_c01 TRANSALDOLASE B user 2 3 # 2 B 17 ASP A 67 ASP~? 1000.00 B 96 GLU A 87 GLU~? 1000.00 B 132 LYS A 84 LYS~? 1000.00 coo 31.16 57.31 -0.94 30.73 56.64 1.01 27.47 11.30 10.36 28.38 13.14 9.88 coo 26.69 48.45 7.18 27.85 50.13 7.74 15.12 11.62 15.65 15.42 10.65 17.50 coo 29.82 45.80 5.07 30.26 51.81 3.56 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1onr_c01 TRANSALDOLASE B user 3 3 # 3 B 17 ASP B 67 ASP~? 1000.00 B 96 GLU B 87 GLU~? 1000.00 B 132 LYS B 84 LYS~? 1000.00 coo 31.16 57.31 -0.94 30.73 56.64 1.01 29.42 -8.55 10.33 29.02 -10.62 10.33 coo 26.69 48.45 7.18 27.85 50.13 7.74 41.94 -8.78 14.57 41.73 -8.00 16.51 coo 29.82 45.80 5.07 30.26 51.81 3.56 43.00 -3.73 14.55 45.69 -3.43 18.79 1onr_c01 source 1onr TRANSALDOLASE B : 3 hits 1onr_c01 naa= 3 ULMN 3 1opm_c00 1.14.17.0003 user 1 3 # 1 A 108 HIS A 25 HIS.? 1000.00 A 170 GLN A 27 GLN.? 1000.00 A 242 HIS A 57 HIS^? 1000.00 coo 36.16 34.36 39.40 38.12 34.09 40.00 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 40.85 35.41 43.73 41.85 33.73 42.88 8.23 0.49 9.56 9.25 -1.39 9.49 coo 40.72 26.15 37.61 42.10 27.69 37.19 8.52 8.65 5.26 6.52 8.65 5.91 ULMN 3 1opm_c00 1.14.17.0003 user 2 3 # 2 A 108 HIS B 25 HIS.? 1000.00 A 170 GLN B 27 GLN.? 1000.00 A 242 HIS B 57 HIS^? 1000.00 coo 36.16 34.36 39.40 38.12 34.09 40.00 45.20 4.85 2.41 47.00 5.76 2.99 coo 40.85 35.41 43.73 41.85 33.73 42.88 48.14 2.40 7.55 49.75 3.32 8.59 coo 40.72 26.15 37.61 42.10 27.69 37.19 48.17 -5.80 3.42 50.22 -6.16 3.68 1opm_c00 source 1opm 1.14.17.0003 : 2 hits 1opm_c00 naa= 3 ULMN 3 1oya_c00 OLD YELLOW ENZYME (OXIDIZED) (OYE) (user 1 3 # 1 191 HIS A 34 HIS~? 1000.00 194 ASN A 30 ASN.? 1000.00 196 TYR A 31 TYR~? 1000.00 coo 40.21 70.60 24.49 39.36 69.94 22.74 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 39.62 68.39 19.02 38.50 66.72 19.87 12.99 1.13 13.14 11.29 0.22 12.22 coo 40.89 73.30 19.79 38.36 73.12 18.60 14.76 2.26 18.96 12.86 3.20 20.79 ULMN 3 1oya_c00 OLD YELLOW ENZYME (OXIDIZED) (OYE) (user 2 3 # 2 191 HIS B 34 HIS~? 1000.00 194 ASN B 30 ASN.? 1000.00 196 TYR B 31 TYR~? 1000.00 coo 40.21 70.60 24.49 39.36 69.94 22.74 41.87 5.60 12.60 42.81 7.10 11.48 coo 39.62 68.39 19.02 38.50 66.72 19.87 44.16 1.73 11.59 45.65 3.03 10.80 coo 40.89 73.30 19.79 38.36 73.12 18.60 42.93 0.52 17.54 44.90 -0.41 19.30 1oya_c00 source 1oya OLD YELLOW ENZYME (OXIDIZED) (OYE) (E.C.1.6.99: 2 hits 1oya_c00 naa= 3 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 1 3 # 1 A 225 HIS A 34 HIS~? 1000.00 A 259 TYR A 31 TYR~? 1000.00 A 552 ASP B 21 ASP~? 1000.00 coo 11.34 95.90 25.54 12.13 96.42 23.67 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 14.91 97.39 18.63 13.39 95.60 20.20 14.76 2.26 18.96 12.86 3.20 20.79 coo 46.37 82.54 38.83 45.97 84.66 38.77 47.17 11.20 -4.12 46.63 12.10 -5.95 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 2 3 # 2 A 225 HIS B 34 HIS~? 1000.00 A 259 TYR B 31 TYR~? 1000.00 A 552 ASP A 21 ASP~? 1000.00 coo 11.34 95.90 25.54 12.13 96.42 23.67 41.87 5.60 12.60 42.81 7.10 11.48 coo 14.91 97.39 18.63 13.39 95.60 20.20 42.93 0.52 17.54 44.90 -0.41 19.30 coo 46.37 82.54 38.83 45.97 84.66 38.77 8.04 -7.86 -2.86 8.75 -8.68 -4.68 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 68 ALA~? 1000.00 A 126 LEU A 70 LEU.? 1000.00 A 158 GLU A 76 GLU~? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 24.93 11.65 14.19 23.48 11.29 13.87 coo -4.62 32.83 147.14 -5.50 32.85 149.12 30.73 11.72 15.51 31.86 10.39 14.24 coo -0.83 29.57 149.77 -0.39 31.47 148.95 28.32 10.24 22.30 27.15 11.94 22.76 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA B 68 ALA~? 1000.00 A 126 LEU B 70 LEU.? 1000.00 A 158 GLU B 76 GLU~? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 32.53 -8.90 13.60 33.93 -8.37 13.29 coo -4.62 32.83 147.14 -5.50 32.85 149.12 26.61 -9.10 15.18 25.55 -7.78 13.83 coo -0.83 29.57 149.77 -0.39 31.47 148.95 29.60 -7.66 22.07 30.61 -9.52 22.20 1pjh_c00 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 2 hits 1pjh_c00 naa= 3 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 B 70 ALA A 68 ALA~? 1000.00 B 126 LEU A 70 LEU.? 1000.00 B 158 GLU A 76 GLU~? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 24.93 11.65 14.19 23.48 11.29 13.87 coo -34.22 5.06 149.25 -33.65 4.24 151.15 30.73 11.72 15.51 31.86 10.39 14.24 coo -33.03 9.93 151.71 -34.98 9.38 151.11 28.32 10.24 22.30 27.15 11.94 22.76 1pjh_c01 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 1 hits 1pjh_c01 naa= 3 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 C 70 ALA A 68 ALA~? 1000.00 C 126 LEU A 70 LEU.? 1000.00 C 158 GLU A 76 GLU~? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 24.93 11.65 14.19 23.48 11.29 13.87 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 30.73 11.72 15.51 31.86 10.39 14.24 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 28.32 10.24 22.30 27.15 11.94 22.76 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA B 68 ALA~? 1000.00 C 126 LEU B 70 LEU.? 1000.00 C 158 GLU B 76 GLU~? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 32.53 -8.90 13.60 33.93 -8.37 13.29 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 26.61 -9.10 15.18 25.55 -7.78 13.83 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 29.60 -7.66 22.07 30.61 -9.52 22.20 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 2 hits 1pjh_c02 naa= 3 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 1 3 # 1 A 248 ASP A 67 ASP~? 1000.00 A 270 LYS B 41 LYS.? 1000.00 A 382 MET B 65 MET~? 1000.00 coo -27.63 121.99 45.48 -26.66 123.86 45.68 27.47 11.30 10.36 28.38 13.14 9.88 coo -32.20 115.91 49.56 -31.37 121.03 53.12 33.89 10.98 6.00 33.54 14.13 10.34 coo -23.75 127.89 58.42 -26.02 128.79 55.12 33.15 -4.06 11.28 35.25 -0.45 11.08 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 2 3 # 2 A 248 ASP A 67 ASP~? 1000.00 A 270 LYS B 41 LYS.? 1000.00 A 382 MET B 66 MET~? 1000.00 coo -27.63 121.99 45.48 -26.66 123.86 45.68 27.47 11.30 10.36 28.38 13.14 9.88 coo -32.20 115.91 49.56 -31.37 121.03 53.12 33.89 10.98 6.00 33.54 14.13 10.34 coo -23.75 127.89 58.42 -26.02 128.79 55.12 29.58 -4.24 12.55 28.38 -1.47 13.62 1pjq_c02 source 1pjq SIROHEME SYNTHASE : 2 hits 1pjq_c02 naa= 3 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 1 3 # 1 B 248 ASP A 67 ASP~? 1000.00 B 270 LYS B 41 LYS.? 1000.00 B 382 MET B 65 MET~? 1000.00 coo -11.82 154.51 43.38 -12.86 152.74 43.79 27.47 11.30 10.36 28.38 13.14 9.88 coo -5.09 158.39 43.41 -0.74 158.80 47.15 33.89 10.98 6.00 33.54 14.13 10.34 coo -2.79 145.52 50.38 -5.75 148.14 51.66 33.15 -4.06 11.28 35.25 -0.45 11.08 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 2 3 # 2 B 248 ASP B 99 ASP.? 1000.00 B 270 LYS B 14 LYS.? 1000.00 B 382 MET B 9 MET.? 1000.00 coo -11.82 154.51 43.38 -12.86 152.74 43.79 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo -5.09 158.39 43.41 -0.74 158.80 47.15 44.48 3.32 -17.22 49.33 1.95 -20.50 coo -2.79 145.52 50.38 -5.75 148.14 51.66 38.34 -2.06 -29.72 36.98 -4.25 -31.26 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 3 3 # 3 B 248 ASP B 99 ASP.? 1000.00 B 270 LYS B 14 LYS.? 1000.00 B 382 MET B 103 MET~? 1000.00 coo -11.82 154.51 43.38 -12.86 152.74 43.79 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo -5.09 158.39 43.41 -0.74 158.80 47.15 44.48 3.32 -17.22 49.33 1.95 -20.50 coo -2.79 145.52 50.38 -5.75 148.14 51.66 36.08 -5.71 -20.74 35.23 -8.67 -23.55 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 4 3 # 4 B 248 ASP B 100 ASP.? 1000.00 B 270 LYS B 14 LYS.? 1000.00 B 382 MET B 9 MET.? 1000.00 coo -11.82 154.51 43.38 -12.86 152.74 43.79 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo -5.09 158.39 43.41 -0.74 158.80 47.15 44.48 3.32 -17.22 49.33 1.95 -20.50 coo -2.79 145.52 50.38 -5.75 148.14 51.66 38.34 -2.06 -29.72 36.98 -4.25 -31.26 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 5 3 # 5 B 248 ASP B 100 ASP.? 1000.00 B 270 LYS B 104 LYS~? 1000.00 B 382 MET B 9 MET.? 1000.00 coo -11.82 154.51 43.38 -12.86 152.74 43.79 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo -5.09 158.39 43.41 -0.74 158.80 47.15 37.49 -7.58 -17.76 42.96 -9.14 -14.97 coo -2.79 145.52 50.38 -5.75 148.14 51.66 38.34 -2.06 -29.72 36.98 -4.25 -31.26 1pjq_c03 source 1pjq SIROHEME SYNTHASE : 5 hits 1pjq_c03 naa= 3 ULMN 3 1pyl_c00 RIBONUCLEASE user 1 3 # 1 A 56 GLU B 86 GLU~? 1000.00 A 67 ARG B 91 ARG.? 1000.00 A 86 HIS B 57 HIS^? 1000.00 coo 18.15 3.28 18.56 20.10 2.92 19.20 45.30 -6.76 11.82 47.29 -7.30 12.26 coo 21.52 6.83 26.64 21.22 5.53 23.85 43.95 -11.42 5.31 46.09 -9.81 6.81 coo 22.36 -1.88 25.52 23.57 -0.73 24.25 48.17 -5.80 3.42 50.22 -6.16 3.68 1pyl_c00 source 1pyl RIBONUCLEASE : 1 hits 1pyl_c00 naa= 3 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 A 48 LEU A 36 LEU~? 1000.00 A 58 ASP A 33 ASP~? 1000.00 A 120 LYS A 84 LYS~? 1000.00 coo 34.02 69.29 75.26 34.82 67.82 76.74 22.69 -0.57 13.12 24.74 -0.92 13.72 coo 34.46 72.45 78.57 32.82 72.75 77.28 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 28.96 77.64 81.19 29.05 74.53 77.51 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 2 3 # 2 A 48 LEU A 70 LEU.? 1000.00 A 58 ASP A 67 ASP~? 1000.00 A 120 LYS B 41 LYS.? 1000.00 coo 34.02 69.29 75.26 34.82 67.82 76.74 30.73 11.72 15.51 31.86 10.39 14.24 coo 34.46 72.45 78.57 32.82 72.75 77.28 27.47 11.30 10.36 28.38 13.14 9.88 coo 28.96 77.64 81.19 29.05 74.53 77.51 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 3 3 # 3 A 48 LEU B 36 LEU~? 1000.00 A 58 ASP B 33 ASP~? 1000.00 A 120 LYS B 84 LYS~? 1000.00 coo 34.02 69.29 75.26 34.82 67.82 76.74 34.51 3.28 12.62 32.42 3.51 13.11 coo 34.46 72.45 78.57 32.82 72.75 77.28 37.13 3.30 17.02 39.09 3.64 17.72 coo 28.96 77.64 81.19 29.05 74.53 77.51 43.00 -3.73 14.55 45.69 -3.43 18.79 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 4 3 # 4 A 48 LEU B 37 LEU~? 1000.00 A 58 ASP B 33 ASP~? 1000.00 A 120 LYS B 84 LYS~? 1000.00 coo 34.02 69.29 75.26 34.82 67.82 76.74 36.82 7.93 12.48 37.16 10.02 12.94 coo 34.46 72.45 78.57 32.82 72.75 77.28 37.13 3.30 17.02 39.09 3.64 17.72 coo 28.96 77.64 81.19 29.05 74.53 77.51 43.00 -3.73 14.55 45.69 -3.43 18.79 1pym_c00 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 4 hits 1pym_c00 naa= 3 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 B 48 LEU A 36 LEU~? 1000.00 B 58 ASP A 33 ASP~? 1000.00 B 120 LYS A 84 LYS~? 1000.00 coo 54.50 104.32 58.69 55.83 105.69 59.81 22.69 -0.57 13.12 24.74 -0.92 13.72 coo 57.63 101.19 59.83 56.60 100.89 57.99 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 61.58 95.88 55.22 58.18 99.30 54.71 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 2 3 # 2 B 48 LEU A 70 LEU.? 1000.00 B 58 ASP A 67 ASP~? 1000.00 B 120 LYS B 41 LYS.? 1000.00 coo 54.50 104.32 58.69 55.83 105.69 59.81 30.73 11.72 15.51 31.86 10.39 14.24 coo 57.63 101.19 59.83 56.60 100.89 57.99 27.47 11.30 10.36 28.38 13.14 9.88 coo 61.58 95.88 55.22 58.18 99.30 54.71 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 3 3 # 3 B 48 LEU B 36 LEU~? 1000.00 B 58 ASP B 33 ASP~? 1000.00 B 120 LYS B 84 LYS~? 1000.00 coo 54.50 104.32 58.69 55.83 105.69 59.81 34.51 3.28 12.62 32.42 3.51 13.11 coo 57.63 101.19 59.83 56.60 100.89 57.99 37.13 3.30 17.02 39.09 3.64 17.72 coo 61.58 95.88 55.22 58.18 99.30 54.71 43.00 -3.73 14.55 45.69 -3.43 18.79 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 4 3 # 4 B 48 LEU B 37 LEU~? 1000.00 B 58 ASP B 33 ASP~? 1000.00 B 120 LYS B 84 LYS~? 1000.00 coo 54.50 104.32 58.69 55.83 105.69 59.81 36.82 7.93 12.48 37.16 10.02 12.94 coo 57.63 101.19 59.83 56.60 100.89 57.99 37.13 3.30 17.02 39.09 3.64 17.72 coo 61.58 95.88 55.22 58.18 99.30 54.71 43.00 -3.73 14.55 45.69 -3.43 18.79 1pym_c01 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 4 hits 1pym_c01 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 67 ASP~? 1000.00 A 68 ALA A 68 ALA~? 1000.00 A 72 LEU A 70 LEU.? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 27.47 11.30 10.36 28.38 13.14 9.88 coo 48.88 4.35 16.59 48.73 5.09 15.20 24.93 11.65 14.19 23.48 11.29 13.87 coo 53.89 6.25 15.09 52.88 7.92 14.14 30.73 11.72 15.51 31.86 10.39 14.24 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 1 hits 1q6l_c05 naa= 3 ULMN 3 1qfl_c00 ACETOACETYL-COA THIOLASE user 1 3 # 1 A 348 HIS A 25 HIS.? 1000.00 A 378 CYH A 116 CYH^? 1000.00 A 380 GLY A 58 GLY^? 1000.00 coo 28.93 -15.66 12.20 27.40 -15.25 10.79 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 22.08 -17.67 5.57 22.76 -18.91 8.05 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 18.19 -14.51 10.52 18.01 -14.23 9.79 13.97 8.66 2.66 13.72 7.90 2.79 ULMN 3 1qfl_c00 ACETOACETYL-COA THIOLASE user 2 3 # 2 A 348 HIS A 25 HIS.? 1000.00 A 378 CYH A 116 CYH^? 1000.00 A 380 GLY A 126 GLY^? 1000.00 coo 28.93 -15.66 12.20 27.40 -15.25 10.79 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 22.08 -17.67 5.57 22.76 -18.91 8.05 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 18.19 -14.51 10.52 18.01 -14.23 9.79 11.14 -0.54 -6.00 11.13 0.28 -6.00 ULMN 3 1qfl_c00 ACETOACETYL-COA THIOLASE user 3 3 # 3 A 348 HIS A 112 HIS~? 1000.00 A 378 CYH A 116 CYH^? 1000.00 A 380 GLY A 58 GLY^? 1000.00 coo 28.93 -15.66 12.20 27.40 -15.25 10.79 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 22.08 -17.67 5.57 22.76 -18.91 8.05 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 18.19 -14.51 10.52 18.01 -14.23 9.79 13.97 8.66 2.66 13.72 7.90 2.79 1qfl_c00 source 1qfl ACETOACETYL-COA THIOLASE : 3 hits 1qfl_c00 naa= 3 ULMN 3 1qfl_c01 ACETOACETYL-COA THIOLASE user 1 3 # 1 B 348 HIS A 25 HIS.? 1000.00 B 378 CYH A 116 CYH^? 1000.00 B 380 GLY A 58 GLY^? 1000.00 coo 13.24 15.55 12.21 14.75 15.10 10.80 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 20.14 17.58 5.68 19.50 18.95 7.99 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 24.06 14.49 10.58 24.24 14.15 9.79 13.97 8.66 2.66 13.72 7.90 2.79 ULMN 3 1qfl_c01 ACETOACETYL-COA THIOLASE user 2 3 # 2 B 348 HIS A 25 HIS.? 1000.00 B 378 CYH A 116 CYH^? 1000.00 B 380 GLY A 126 GLY^? 1000.00 coo 13.24 15.55 12.21 14.75 15.10 10.80 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 20.14 17.58 5.68 19.50 18.95 7.99 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 24.06 14.49 10.58 24.24 14.15 9.79 11.14 -0.54 -6.00 11.13 0.28 -6.00 ULMN 3 1qfl_c01 ACETOACETYL-COA THIOLASE user 3 3 # 3 B 348 HIS A 112 HIS~? 1000.00 B 378 CYH A 116 CYH^? 1000.00 B 380 GLY A 58 GLY^? 1000.00 coo 13.24 15.55 12.21 14.75 15.10 10.80 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 20.14 17.58 5.68 19.50 18.95 7.99 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 24.06 14.49 10.58 24.24 14.15 9.79 13.97 8.66 2.66 13.72 7.90 2.79 1qfl_c01 source 1qfl ACETOACETYL-COA THIOLASE : 3 hits 1qfl_c01 naa= 3 ULMN 3 1qfl_c02 ACETOACETYL-COA THIOLASE user 1 3 # 1 C 348 HIS A 25 HIS.? 1000.00 C 378 CYH A 116 CYH^? 1000.00 C 380 GLY A 58 GLY^? 1000.00 coo 39.92 0.27 55.80 38.80 1.56 57.03 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 38.90 7.44 62.34 40.19 7.59 59.85 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 34.29 9.51 57.55 33.93 9.43 58.29 13.97 8.66 2.66 13.72 7.90 2.79 ULMN 3 1qfl_c02 ACETOACETYL-COA THIOLASE user 2 3 # 2 C 348 HIS A 25 HIS.? 1000.00 C 378 CYH A 116 CYH^? 1000.00 C 380 GLY A 126 GLY^? 1000.00 coo 39.92 0.27 55.80 38.80 1.56 57.03 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 38.90 7.44 62.34 40.19 7.59 59.85 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 34.29 9.51 57.55 33.93 9.43 58.29 11.14 -0.54 -6.00 11.13 0.28 -6.00 ULMN 3 1qfl_c02 ACETOACETYL-COA THIOLASE user 3 3 # 3 C 348 HIS A 112 HIS~? 1000.00 C 378 CYH A 116 CYH^? 1000.00 C 380 GLY A 58 GLY^? 1000.00 coo 39.92 0.27 55.80 38.80 1.56 57.03 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 38.90 7.44 62.34 40.19 7.59 59.85 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 34.29 9.51 57.55 33.93 9.43 58.29 13.97 8.66 2.66 13.72 7.90 2.79 ULMN 3 1qfl_c02 ACETOACETYL-COA THIOLASE user 4 3 # 4 C 348 HIS B 25 HIS.? 1000.00 C 378 CYH B 116 CYH^? 1000.00 C 380 GLY B 126 GLY^? 1000.00 coo 39.92 0.27 55.80 38.80 1.56 57.03 45.20 4.85 2.41 47.00 5.76 2.99 coo 38.90 7.44 62.34 40.19 7.59 59.85 41.62 -1.76 -6.63 41.26 -1.83 -3.85 coo 34.29 9.51 57.55 33.93 9.43 58.29 44.07 4.01 -7.42 44.15 3.19 -7.38 1qfl_c02 source 1qfl ACETOACETYL-COA THIOLASE : 4 hits 1qfl_c02 naa= 3 ULMN 3 1qfl_c03 ACETOACETYL-COA THIOLASE user 1 3 # 1 D 348 HIS A 25 HIS.? 1000.00 D 378 CYH A 116 CYH^? 1000.00 D 380 GLY A 58 GLY^? 1000.00 coo 4.85 0.61 57.13 5.96 -0.63 58.38 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 6.41 -6.55 63.64 4.67 -6.39 61.44 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 10.63 -8.62 58.57 11.08 -8.54 59.30 13.97 8.66 2.66 13.72 7.90 2.79 ULMN 3 1qfl_c03 ACETOACETYL-COA THIOLASE user 2 3 # 2 D 348 HIS A 25 HIS.? 1000.00 D 378 CYH A 116 CYH^? 1000.00 D 380 GLY A 126 GLY^? 1000.00 coo 4.85 0.61 57.13 5.96 -0.63 58.38 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 6.41 -6.55 63.64 4.67 -6.39 61.44 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 10.63 -8.62 58.57 11.08 -8.54 59.30 11.14 -0.54 -6.00 11.13 0.28 -6.00 ULMN 3 1qfl_c03 ACETOACETYL-COA THIOLASE user 3 3 # 3 D 348 HIS A 112 HIS~? 1000.00 D 378 CYH A 116 CYH^? 1000.00 D 380 GLY A 58 GLY^? 1000.00 coo 4.85 0.61 57.13 5.96 -0.63 58.38 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 6.41 -6.55 63.64 4.67 -6.39 61.44 14.05 4.72 -5.27 14.64 4.77 -2.52 coo 10.63 -8.62 58.57 11.08 -8.54 59.30 13.97 8.66 2.66 13.72 7.90 2.79 ULMN 3 1qfl_c03 ACETOACETYL-COA THIOLASE user 4 3 # 4 D 348 HIS B 25 HIS.? 1000.00 D 378 CYH B 116 CYH^? 1000.00 D 380 GLY B 126 GLY^? 1000.00 coo 4.85 0.61 57.13 5.96 -0.63 58.38 45.20 4.85 2.41 47.00 5.76 2.99 coo 6.41 -6.55 63.64 4.67 -6.39 61.44 41.62 -1.76 -6.63 41.26 -1.83 -3.85 coo 10.63 -8.62 58.57 11.08 -8.54 59.30 44.07 4.01 -7.42 44.15 3.19 -7.38 1qfl_c03 source 1qfl ACETOACETYL-COA THIOLASE : 4 hits 1qfl_c03 naa= 3 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 110 ARG A 95 ARG^? 1000.00 D 163 TYR A 123 TYR.? 1000.00 D 236 ASP A 51 ASP.? 1000.00 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 10.85 10.51 -3.66 10.03 10.94 -0.73 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 5.22 5.50 6.84 4.14 5.83 5.06 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 110 ARG A 95 ARG^? 1000.00 D 163 TYR A 123 TYR.? 1000.00 D 236 ASP A 120 ASP.? 1000.00 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 10.85 10.51 -3.66 10.03 10.94 -0.73 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 1.50 5.98 -11.47 2.88 5.62 -13.02 1qgn_c17 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c17 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG A 95 ARG^? 1000.00 H 163 TYR A 123 TYR.? 1000.00 H 236 ASP A 51 ASP.? 1000.00 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 10.85 10.51 -3.66 10.03 10.94 -0.73 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 5.22 5.50 6.84 4.14 5.83 5.06 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 110 ARG A 95 ARG^? 1000.00 H 163 TYR A 123 TYR.? 1000.00 H 236 ASP A 120 ASP.? 1000.00 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 10.85 10.51 -3.66 10.03 10.94 -0.73 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 1.50 5.98 -11.47 2.88 5.62 -13.02 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c21 naa= 3 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 # 1 A 49 ASP A 67 ASP~? 1000.00 A 147 THR B 40 THR~? 1000.00 A 294 ASP B 33 ASP~? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 27.47 11.30 10.36 28.38 13.14 9.88 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 32.13 8.13 7.81 31.28 8.21 9.80 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 37.13 3.30 17.02 39.09 3.64 17.72 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 2 3 # 2 A 49 ASP B 67 ASP~? 1000.00 A 147 THR A 40 THR~? 1000.00 A 294 ASP A 33 ASP~? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 29.42 -8.55 10.33 29.02 -10.62 10.33 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 24.69 -5.08 8.04 25.67 -5.31 9.95 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 20.33 -0.63 17.74 18.38 -0.89 18.50 1qgx_c02 source 1qgx 3',5'-ADENOSINE BISPHOSPHATASE : 2 hits 1qgx_c02 naa= 3 ULMN 3 1qho_c05 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 99 ASP.? 1000.00 A 261 ASP A 21 ASP~? 1000.00 A 329 ASP A 121 ASP.? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 6.07 5.96 -16.72 5.18 4.09 -17.03 coo 34.02 79.89 42.60 34.73 78.01 41.86 8.04 -7.86 -2.86 8.75 -8.68 -4.68 coo 37.87 70.12 31.80 36.61 69.74 30.15 -0.75 5.29 -6.38 -2.02 4.12 -7.60 ULMN 3 1qho_c05 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP B 99 ASP.? 1000.00 A 261 ASP B 21 ASP~? 1000.00 A 329 ASP B 121 ASP.? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo 34.02 79.89 42.60 34.73 78.01 41.86 47.17 11.20 -4.12 46.63 12.10 -5.95 coo 37.87 70.12 31.80 36.61 69.74 30.15 55.83 -1.01 -8.85 57.04 -0.03 -10.25 1qho_c05 source 1qho ALPHA-AMYLASE : 2 hits 1qho_c05 naa= 3 ULMN 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 A 51 ALA A 35 ALA~? 1000.00 A 148 HIS A 34 HIS~? 1000.00 A 163 ASP A 33 ASP~? 1000.00 coo 1.42 19.18 21.84 1.11 19.57 23.28 18.36 -0.24 11.00 18.25 1.25 10.77 coo 0.71 19.67 27.92 2.43 19.16 26.83 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 7.15 16.22 27.50 6.15 18.00 27.94 20.33 -0.63 17.74 18.38 -0.89 18.50 ULMN 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 A 51 ALA B 35 ALA~? 1000.00 A 148 HIS B 34 HIS~? 1000.00 A 163 ASP B 33 ASP~? 1000.00 coo 1.42 19.18 21.84 1.11 19.57 23.28 38.64 3.06 10.15 38.73 1.57 9.89 coo 0.71 19.67 27.92 2.43 19.16 26.83 41.87 5.60 12.60 42.81 7.10 11.48 coo 7.15 16.22 27.50 6.15 18.00 27.94 37.13 3.30 17.02 39.09 3.64 17.72 1qol_c00 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c00 naa= 3 ULMN 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 B 51 ALA A 35 ALA~? 1000.00 B 148 HIS A 34 HIS~? 1000.00 B 163 ASP A 33 ASP~? 1000.00 coo -33.97 19.78 54.18 -33.40 20.11 52.82 18.36 -0.24 11.00 18.25 1.25 10.77 coo -33.17 20.01 48.16 -34.95 19.37 49.06 15.31 -2.76 13.60 14.28 -4.22 12.50 coo -39.82 16.62 48.85 -38.59 18.24 48.48 20.33 -0.63 17.74 18.38 -0.89 18.50 ULMN 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 B 51 ALA B 24 ALA.? 1000.00 B 148 HIS B 25 HIS.? 1000.00 B 163 ASP B 21 ASP~? 1000.00 coo -33.97 19.78 54.18 -33.40 20.11 52.82 41.15 7.56 1.31 39.91 7.94 2.12 coo -33.17 20.01 48.16 -34.95 19.37 49.06 45.20 4.85 2.41 47.00 5.76 2.99 coo -39.82 16.62 48.85 -38.59 18.24 48.48 47.17 11.20 -4.12 46.63 12.10 -5.95 ULMN 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 # 3 B 51 ALA B 35 ALA~? 1000.00 B 148 HIS B 34 HIS~? 1000.00 B 163 ASP B 33 ASP~? 1000.00 coo -33.97 19.78 54.18 -33.40 20.11 52.82 38.64 3.06 10.15 38.73 1.57 9.89 coo -33.17 20.01 48.16 -34.95 19.37 49.06 41.87 5.60 12.60 42.81 7.10 11.48 coo -39.82 16.62 48.85 -38.59 18.24 48.48 37.13 3.30 17.02 39.09 3.64 17.72 1qol_c01 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 3 hits 1qol_c01 naa= 3 ULMN 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 C 51 ALA A 35 ALA~? 1000.00 C 148 HIS A 34 HIS~? 1000.00 C 163 ASP A 33 ASP~? 1000.00 coo -26.36 -19.12 21.15 -25.71 -19.49 22.47 18.36 -0.24 11.00 18.25 1.25 10.77 coo -25.01 -20.21 26.78 -26.91 -20.55 25.93 15.31 -2.76 13.60 14.28 -4.22 12.50 coo -32.17 -20.34 27.36 -30.15 -20.93 27.54 20.33 -0.63 17.74 18.38 -0.89 18.50 ULMN 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 C 51 ALA B 35 ALA~? 1000.00 C 148 HIS B 34 HIS~? 1000.00 C 163 ASP B 33 ASP~? 1000.00 coo -26.36 -19.12 21.15 -25.71 -19.49 22.47 38.64 3.06 10.15 38.73 1.57 9.89 coo -25.01 -20.21 26.78 -26.91 -20.55 25.93 41.87 5.60 12.60 42.81 7.10 11.48 coo -32.17 -20.34 27.36 -30.15 -20.93 27.54 37.13 3.30 17.02 39.09 3.64 17.72 1qol_c02 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c02 naa= 3 ULMN 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 D 51 ALA A 35 ALA~? 1000.00 D 148 HIS A 34 HIS~? 1000.00 D 163 ASP A 33 ASP~? 1000.00 coo -6.15 -19.18 55.49 -6.70 -19.60 54.15 18.36 -0.24 11.00 18.25 1.25 10.77 coo -7.62 -20.32 49.70 -5.89 -20.86 50.74 15.31 -2.76 13.60 14.28 -4.22 12.50 coo -0.41 -20.05 49.27 -2.21 -21.16 49.24 20.33 -0.63 17.74 18.38 -0.89 18.50 ULMN 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 D 51 ALA B 35 ALA~? 1000.00 D 148 HIS B 34 HIS~? 1000.00 D 163 ASP B 33 ASP~? 1000.00 coo -6.15 -19.18 55.49 -6.70 -19.60 54.15 38.64 3.06 10.15 38.73 1.57 9.89 coo -7.62 -20.32 49.70 -5.89 -20.86 50.74 41.87 5.60 12.60 42.81 7.10 11.48 coo -0.41 -20.05 49.27 -2.21 -21.16 49.24 37.13 3.30 17.02 39.09 3.64 17.72 1qol_c03 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c03 naa= 3 ULMN 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 E 51 ALA A 35 ALA~? 1000.00 E 148 HIS A 34 HIS~? 1000.00 E 163 ASP A 33 ASP~? 1000.00 coo 5.48 -16.06 -47.92 6.03 -15.45 -46.65 18.36 -0.24 11.00 18.25 1.25 10.77 coo 5.81 -16.05 -42.05 5.54 -17.84 -43.11 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 2.75 -22.21 -43.08 4.67 -21.31 -42.96 20.33 -0.63 17.74 18.38 -0.89 18.50 ULMN 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 E 51 ALA B 35 ALA~? 1000.00 E 148 HIS B 34 HIS~? 1000.00 E 163 ASP B 33 ASP~? 1000.00 coo 5.48 -16.06 -47.92 6.03 -15.45 -46.65 38.64 3.06 10.15 38.73 1.57 9.89 coo 5.81 -16.05 -42.05 5.54 -17.84 -43.11 41.87 5.60 12.60 42.81 7.10 11.48 coo 2.75 -22.21 -43.08 4.67 -21.31 -42.96 37.13 3.30 17.02 39.09 3.64 17.72 1qol_c04 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c04 naa= 3 ULMN 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 F 51 ALA A 35 ALA~? 1000.00 F 148 HIS A 34 HIS~? 1000.00 F 163 ASP A 33 ASP~? 1000.00 coo 5.33 15.59 -14.28 5.80 15.15 -15.64 18.36 -0.24 11.00 18.25 1.25 10.77 coo 5.79 15.50 -20.13 5.50 17.28 -19.05 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 2.42 22.00 -18.97 4.23 20.92 -19.18 20.33 -0.63 17.74 18.38 -0.89 18.50 ULMN 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 F 51 ALA B 24 ALA.? 1000.00 F 148 HIS B 25 HIS.? 1000.00 F 163 ASP B 21 ASP~? 1000.00 coo 5.33 15.59 -14.28 5.80 15.15 -15.64 41.15 7.56 1.31 39.91 7.94 2.12 coo 5.79 15.50 -20.13 5.50 17.28 -19.05 45.20 4.85 2.41 47.00 5.76 2.99 coo 2.42 22.00 -18.97 4.23 20.92 -19.18 47.17 11.20 -4.12 46.63 12.10 -5.95 ULMN 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 # 3 F 51 ALA B 35 ALA~? 1000.00 F 148 HIS B 34 HIS~? 1000.00 F 163 ASP B 33 ASP~? 1000.00 coo 5.33 15.59 -14.28 5.80 15.15 -15.64 38.64 3.06 10.15 38.73 1.57 9.89 coo 5.79 15.50 -20.13 5.50 17.28 -19.05 41.87 5.60 12.60 42.81 7.10 11.48 coo 2.42 22.00 -18.97 4.23 20.92 -19.18 37.13 3.30 17.02 39.09 3.64 17.72 1qol_c05 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 3 hits 1qol_c05 naa= 3 ULMN 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 G 51 ALA A 35 ALA~? 1000.00 G 148 HIS A 34 HIS~? 1000.00 G 163 ASP A 33 ASP~? 1000.00 coo -33.28 -11.88 -14.46 -33.66 -11.38 -15.87 18.36 -0.24 11.00 18.25 1.25 10.77 coo -34.88 -9.77 -20.15 -35.41 -11.60 -19.26 15.31 -2.76 13.60 14.28 -4.22 12.50 coo -34.41 -16.73 -21.11 -35.66 -15.03 -20.96 20.33 -0.63 17.74 18.38 -0.89 18.50 ULMN 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 G 51 ALA B 35 ALA~? 1000.00 G 148 HIS B 34 HIS~? 1000.00 G 163 ASP B 33 ASP~? 1000.00 coo -33.28 -11.88 -14.46 -33.66 -11.38 -15.87 38.64 3.06 10.15 38.73 1.57 9.89 coo -34.88 -9.77 -20.15 -35.41 -11.60 -19.26 41.87 5.60 12.60 42.81 7.10 11.48 coo -34.41 -16.73 -21.11 -35.66 -15.03 -20.96 37.13 3.30 17.02 39.09 3.64 17.72 1qol_c06 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c06 naa= 3 ULMN 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 H 51 ALA A 35 ALA~? 1000.00 H 148 HIS A 34 HIS~? 1000.00 H 163 ASP A 33 ASP~? 1000.00 coo -33.97 9.40 -47.46 -34.31 8.55 -46.23 18.36 -0.24 11.00 18.25 1.25 10.77 coo -35.28 7.86 -41.76 -36.20 9.51 -42.67 15.31 -2.76 13.60 14.28 -4.22 12.50 coo -35.25 15.19 -41.05 -35.81 13.11 -41.05 20.33 -0.63 17.74 18.38 -0.89 18.50 ULMN 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 H 51 ALA B 24 ALA.? 1000.00 H 148 HIS B 25 HIS.? 1000.00 H 163 ASP B 21 ASP~? 1000.00 coo -33.97 9.40 -47.46 -34.31 8.55 -46.23 41.15 7.56 1.31 39.91 7.94 2.12 coo -35.28 7.86 -41.76 -36.20 9.51 -42.67 45.20 4.85 2.41 47.00 5.76 2.99 coo -35.25 15.19 -41.05 -35.81 13.11 -41.05 47.17 11.20 -4.12 46.63 12.10 -5.95 ULMN 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 # 3 H 51 ALA B 35 ALA~? 1000.00 H 148 HIS B 34 HIS~? 1000.00 H 163 ASP B 33 ASP~? 1000.00 coo -33.97 9.40 -47.46 -34.31 8.55 -46.23 38.64 3.06 10.15 38.73 1.57 9.89 coo -35.28 7.86 -41.76 -36.20 9.51 -42.67 41.87 5.60 12.60 42.81 7.10 11.48 coo -35.25 15.19 -41.05 -35.81 13.11 -41.05 37.13 3.30 17.02 39.09 3.64 17.72 1qol_c07 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 3 hits 1qol_c07 naa= 3 ULMN 3 1qrr_c01 SULFOLIPID BIOSYNTHESIS (SQD1) PROTEuser 1 3 # 1 A 145 THR A 52 THR.? 1000.00 A 182 TYR A 54 TYR.? 1000.00 A 186 LYS A 55 LYS.? 1000.00 coo 69.38 87.38 24.64 71.11 88.47 25.40 3.18 1.95 7.50 2.35 2.68 9.35 coo 73.61 90.42 31.12 71.36 89.66 29.64 4.84 -0.16 0.99 6.55 -2.28 0.31 coo 73.54 84.00 28.64 69.01 86.68 29.71 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1qrr_c01 SULFOLIPID BIOSYNTHESIS (SQD1) PROTEuser 2 3 # 2 A 145 THR A 52 THR.? 1000.00 A 182 TYR A 123 TYR.? 1000.00 A 186 LYS A 55 LYS.? 1000.00 coo 69.38 87.38 24.64 71.11 88.47 25.40 3.18 1.95 7.50 2.35 2.68 9.35 coo 73.61 90.42 31.12 71.36 89.66 29.64 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 73.54 84.00 28.64 69.01 86.68 29.71 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1qrr_c01 SULFOLIPID BIOSYNTHESIS (SQD1) PROTEuser 3 3 # 3 A 145 THR B 52 THR.? 1000.00 A 182 TYR B 54 TYR.? 1000.00 A 186 LYS B 55 LYS.? 1000.00 coo 69.38 87.38 24.64 71.11 88.47 25.40 53.09 1.70 5.01 54.77 2.18 6.27 coo 73.61 90.42 31.12 71.36 89.66 29.64 51.35 3.44 -0.95 49.48 5.47 -1.36 coo 73.54 84.00 28.64 69.01 86.68 29.71 50.86 -2.31 -0.81 56.59 -4.06 -2.86 ULMN 3 1qrr_c01 SULFOLIPID BIOSYNTHESIS (SQD1) PROTEuser 4 3 # 4 A 145 THR B 52 THR.? 1000.00 A 182 TYR B 123 TYR.? 1000.00 A 186 LYS B 55 LYS.? 1000.00 coo 69.38 87.38 24.64 71.11 88.47 25.40 53.09 1.70 5.01 54.77 2.18 6.27 coo 73.61 90.42 31.12 71.36 89.66 29.64 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 73.54 84.00 28.64 69.01 86.68 29.71 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1qrr_c01 source 1qrr SULFOLIPID BIOSYNTHESIS (SQD1) PROTEIN : 4 hits 1qrr_c01 naa= 3 ULMN 3 1qrz_c20 PLASMINOGEN user 1 3 # 1 A 603 HIS A 25 HIS.? 1000.00 A 646 ASP A 21 ASP~? 1000.00 A 739 GLY A 43 GLY.? 1000.00 coo -20.72 2.99 34.37 -21.94 1.82 35.61 10.94 -1.26 4.23 9.26 -2.11 5.16 coo -18.83 7.68 26.86 -20.89 7.78 26.56 8.04 -7.86 -2.86 8.75 -8.68 -4.68 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 23.96 -5.83 0.31 23.37 -5.25 0.41 ULMN 3 1qrz_c20 PLASMINOGEN user 2 3 # 2 A 603 HIS A 25 HIS.? 1000.00 A 646 ASP A 21 ASP~? 1000.00 A 739 GLY A 122 GLY.? 1000.00 coo -20.72 2.99 34.37 -21.94 1.82 35.61 10.94 -1.26 4.23 9.26 -2.11 5.16 coo -18.83 7.68 26.86 -20.89 7.78 26.56 8.04 -7.86 -2.86 8.75 -8.68 -4.68 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1qrz_c20 PLASMINOGEN user 3 3 # 3 A 603 HIS B 25 HIS.? 1000.00 A 646 ASP B 21 ASP~? 1000.00 A 739 GLY B 43 GLY.? 1000.00 coo -20.72 2.99 34.37 -21.94 1.82 35.61 45.20 4.85 2.41 47.00 5.76 2.99 coo -18.83 7.68 26.86 -20.89 7.78 26.56 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 31.38 8.62 0.01 32.09 8.23 0.02 ULMN 3 1qrz_c20 PLASMINOGEN user 4 3 # 4 A 603 HIS B 25 HIS.? 1000.00 A 646 ASP B 21 ASP~? 1000.00 A 739 GLY B 122 GLY.? 1000.00 coo -20.72 2.99 34.37 -21.94 1.82 35.61 45.20 4.85 2.41 47.00 5.76 2.99 coo -18.83 7.68 26.86 -20.89 7.78 26.56 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 52.80 -4.03 -7.10 52.92 -3.19 -7.11 1qrz_c20 source 1qrz PLASMINOGEN : 4 hits 1qrz_c20 naa= 3 ULMN 3 1qrz_c21 PLASMINOGEN user 1 3 # 1 B 603 HIS A 25 HIS.? 1000.00 B 646 ASP A 21 ASP~? 1000.00 B 739 GLY A 43 GLY.? 1000.00 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 10.94 -1.26 4.23 9.26 -2.11 5.16 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 8.04 -7.86 -2.86 8.75 -8.68 -4.68 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 23.96 -5.83 0.31 23.37 -5.25 0.41 ULMN 3 1qrz_c21 PLASMINOGEN user 2 3 # 2 B 603 HIS A 25 HIS.? 1000.00 B 646 ASP A 21 ASP~? 1000.00 B 739 GLY A 122 GLY.? 1000.00 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 10.94 -1.26 4.23 9.26 -2.11 5.16 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 8.04 -7.86 -2.86 8.75 -8.68 -4.68 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1qrz_c21 PLASMINOGEN user 3 3 # 3 B 603 HIS B 25 HIS.? 1000.00 B 646 ASP B 21 ASP~? 1000.00 B 739 GLY B 43 GLY.? 1000.00 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 45.20 4.85 2.41 47.00 5.76 2.99 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 31.38 8.62 0.01 32.09 8.23 0.02 ULMN 3 1qrz_c21 PLASMINOGEN user 4 3 # 4 B 603 HIS B 25 HIS.? 1000.00 B 646 ASP B 21 ASP~? 1000.00 B 739 GLY B 122 GLY.? 1000.00 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 45.20 4.85 2.41 47.00 5.76 2.99 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 52.80 -4.03 -7.10 52.92 -3.19 -7.11 1qrz_c21 source 1qrz PLASMINOGEN : 4 hits 1qrz_c21 naa= 3 ULMN 3 1qrz_c22 PLASMINOGEN user 1 3 # 1 C 603 HIS A 25 HIS.? 1000.00 C 646 ASP A 21 ASP~? 1000.00 C 739 GLY A 43 GLY.? 1000.00 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 8.04 -7.86 -2.86 8.75 -8.68 -4.68 coo 7.82 1.25 3.03 7.30 1.31 3.65 23.96 -5.83 0.31 23.37 -5.25 0.41 ULMN 3 1qrz_c22 PLASMINOGEN user 2 3 # 2 C 603 HIS A 25 HIS.? 1000.00 C 646 ASP A 21 ASP~? 1000.00 C 739 GLY A 122 GLY.? 1000.00 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 10.94 -1.26 4.23 9.26 -2.11 5.16 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 8.04 -7.86 -2.86 8.75 -8.68 -4.68 coo 7.82 1.25 3.03 7.30 1.31 3.65 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1qrz_c22 PLASMINOGEN user 3 3 # 3 C 603 HIS B 25 HIS.? 1000.00 C 646 ASP B 21 ASP~? 1000.00 C 739 GLY B 43 GLY.? 1000.00 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 45.20 4.85 2.41 47.00 5.76 2.99 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 47.17 11.20 -4.12 46.63 12.10 -5.95 coo 7.82 1.25 3.03 7.30 1.31 3.65 31.38 8.62 0.01 32.09 8.23 0.02 ULMN 3 1qrz_c22 PLASMINOGEN user 4 3 # 4 C 603 HIS B 25 HIS.? 1000.00 C 646 ASP B 21 ASP~? 1000.00 C 739 GLY B 122 GLY.? 1000.00 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 45.20 4.85 2.41 47.00 5.76 2.99 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 47.17 11.20 -4.12 46.63 12.10 -5.95 coo 7.82 1.25 3.03 7.30 1.31 3.65 52.80 -4.03 -7.10 52.92 -3.19 -7.11 1qrz_c22 source 1qrz PLASMINOGEN : 4 hits 1qrz_c22 naa= 3 ULMN 3 1qrz_c23 PLASMINOGEN user 1 3 # 1 D 603 HIS A 25 HIS.? 1000.00 D 646 ASP A 21 ASP~? 1000.00 D 739 GLY A 43 GLY.? 1000.00 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 10.94 -1.26 4.23 9.26 -2.11 5.16 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 8.04 -7.86 -2.86 8.75 -8.68 -4.68 coo -45.82 1.31 41.67 -46.38 1.39 42.31 23.96 -5.83 0.31 23.37 -5.25 0.41 ULMN 3 1qrz_c23 PLASMINOGEN user 2 3 # 2 D 603 HIS A 25 HIS.? 1000.00 D 646 ASP A 21 ASP~? 1000.00 D 739 GLY A 122 GLY.? 1000.00 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 10.94 -1.26 4.23 9.26 -2.11 5.16 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 8.04 -7.86 -2.86 8.75 -8.68 -4.68 coo -45.82 1.31 41.67 -46.38 1.39 42.31 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 1qrz_c23 PLASMINOGEN user 3 3 # 3 D 603 HIS B 25 HIS.? 1000.00 D 646 ASP B 21 ASP~? 1000.00 D 739 GLY B 43 GLY.? 1000.00 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 45.20 4.85 2.41 47.00 5.76 2.99 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -45.82 1.31 41.67 -46.38 1.39 42.31 31.38 8.62 0.01 32.09 8.23 0.02 ULMN 3 1qrz_c23 PLASMINOGEN user 4 3 # 4 D 603 HIS B 25 HIS.? 1000.00 D 646 ASP B 21 ASP~? 1000.00 D 739 GLY B 122 GLY.? 1000.00 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 45.20 4.85 2.41 47.00 5.76 2.99 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -45.82 1.31 41.67 -46.38 1.39 42.31 52.80 -4.03 -7.10 52.92 -3.19 -7.11 1qrz_c23 source 1qrz PLASMINOGEN : 4 hits 1qrz_c23 naa= 3 ULMN 3 1rbn_c01 RIBONUCLEASE A (E.C.3.1.27.5) DERIVAuser 1 3 # 1 A 12 HIS A 57 HIS^? 1000.00 A 41 LYS A 84 LYS~? 1000.00 A 119 HIS A 25 HIS.? 1000.00 coo 27.25 41.76 -6.97 28.67 40.32 -7.25 8.52 8.65 5.26 6.52 8.65 5.91 coo 35.53 36.24 -0.58 31.10 37.46 -4.56 14.81 6.41 15.81 10.01 5.61 18.56 coo 26.49 34.97 -12.73 26.25 33.07 -12.07 10.94 -1.26 4.23 9.26 -2.11 5.16 ULMN 3 1rbn_c01 RIBONUCLEASE A (E.C.3.1.27.5) DERIVAuser 2 3 # 2 A 12 HIS B 34 HIS~? 1000.00 A 41 LYS B 41 LYS.? 1000.00 A 119 HIS B 25 HIS.? 1000.00 coo 27.25 41.76 -6.97 28.67 40.32 -7.25 41.87 5.60 12.60 42.81 7.10 11.48 coo 35.53 36.24 -0.58 31.10 37.46 -4.56 33.89 10.98 6.00 33.54 14.13 10.34 coo 26.49 34.97 -12.73 26.25 33.07 -12.07 45.20 4.85 2.41 47.00 5.76 2.99 1rbn_c01 source 1rbn RIBONUCLEASE A (E.C.3.1.27.5) DERIVATIVE II CO: 2 hits 1rbn_c01 naa= 3 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 1 3 # 1 A 608 ASP B 51 ASP.? 1000.00 A 610 HIS B 57 HIS^? 1000.00 A 661 HIS B 25 HIS.? 1000.00 coo 75.99 81.56 1.86 73.91 81.34 2.28 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 71.04 78.84 0.46 71.54 76.90 1.02 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 75.40 81.38 12.06 74.88 79.42 12.63 45.20 4.85 2.41 47.00 5.76 2.99 1req_c10 source 1req METHYLMALONYL-COA MUTASE : 1 hits 1req_c10 naa= 3 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 1 3 # 1 C 608 ASP B 51 ASP.? 1000.00 C 610 HIS B 57 HIS^? 1000.00 C 661 HIS B 25 HIS.? 1000.00 coo -17.65 80.52 58.00 -16.23 80.79 56.41 51.46 -2.33 4.55 52.23 -2.54 2.59 coo -16.56 83.18 53.03 -16.33 85.18 53.60 48.17 -5.80 3.42 50.22 -6.16 3.68 coo -8.38 80.78 62.24 -7.53 82.67 62.02 45.20 4.85 2.41 47.00 5.76 2.99 1req_c11 source 1req METHYLMALONYL-COA MUTASE : 1 hits 1req_c11 naa= 3 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 # 1 32 ASP A 100 ASP.? 1000.00 35 SER A 101 SER~? 1000.00 215 ASP A 99 ASP.? 1000.00 coo 11.85 17.24 72.81 11.09 15.37 72.36 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 12.20 12.71 75.45 13.69 13.84 74.03 12.85 8.31 -19.30 13.97 10.47 -19.16 coo 5.22 15.03 71.43 7.19 14.88 70.83 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 3 # 2 32 ASP B 100 ASP.? 1000.00 35 SER B 101 SER~? 1000.00 215 ASP B 99 ASP.? 1000.00 coo 11.85 17.24 72.81 11.09 15.37 72.36 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 12.20 12.71 75.45 13.69 13.84 74.03 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo 5.22 15.03 71.43 7.19 14.88 70.83 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1rne_c04 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 2 hits 1rne_c04 naa= 3 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 A 137 GLU B 81 GLU~? 1000.00 A 288 HIS B 25 HIS.? 1000.00 A 329 LYS B 22 LYS~? 1000.00 coo 29.27 18.78 14.99 27.16 18.62 14.76 38.01 0.54 22.61 37.05 1.66 24.13 coo 49.52 10.06 10.36 50.99 9.65 8.92 45.20 4.85 2.41 47.00 5.76 2.99 coo 57.80 12.92 13.83 53.77 8.42 12.15 42.49 11.08 -4.25 42.78 13.68 -10.05 1roz_c00 source 1roz DEOXYHYPUSINE SYNTHASE : 1 hits 1roz_c00 naa= 3 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 B 137 GLU B 81 GLU~? 1000.00 B 288 HIS B 25 HIS.? 1000.00 B 329 LYS B 22 LYS~? 1000.00 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 38.01 0.54 22.61 37.05 1.66 24.13 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 45.20 4.85 2.41 47.00 5.76 2.99 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 42.49 11.08 -4.25 42.78 13.68 -10.05 1roz_c01 source 1roz DEOXYHYPUSINE SYNTHASE : 1 hits 1roz_c01 naa= 3 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 # 1 B 57 HIS A 34 HIS~? 1000.00 B 102 ASP A 33 ASP~? 1000.00 B 193 GLY A 29 GLY.? 1000.00 coo -4.60 27.52 42.88 -4.63 27.41 40.76 15.31 -2.76 13.60 14.28 -4.22 12.50 coo -0.27 31.24 43.51 -1.49 29.62 42.98 20.33 -0.63 17.74 18.38 -0.89 18.50 coo -6.81 22.81 34.74 -6.42 23.54 34.62 10.16 4.95 14.00 10.62 4.41 13.60 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 2 3 # 2 B 57 HIS B 34 HIS~? 1000.00 B 102 ASP B 33 ASP~? 1000.00 B 193 GLY B 29 GLY.? 1000.00 coo -4.60 27.52 42.88 -4.63 27.41 40.76 41.87 5.60 12.60 42.81 7.10 11.48 coo -0.27 31.24 43.51 -1.49 29.62 42.98 37.13 3.30 17.02 39.09 3.64 17.72 coo -6.81 22.81 34.74 -6.42 23.54 34.62 47.41 -1.84 12.12 46.79 -1.48 11.78 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 3 3 # 3 B 57 HIS B 57 HIS^? 1000.00 B 102 ASP B 51 ASP.? 1000.00 B 193 GLY B 122 GLY.? 1000.00 coo -4.60 27.52 42.88 -4.63 27.41 40.76 48.17 -5.80 3.42 50.22 -6.16 3.68 coo -0.27 31.24 43.51 -1.49 29.62 42.98 51.46 -2.33 4.55 52.23 -2.54 2.59 coo -6.81 22.81 34.74 -6.42 23.54 34.62 52.80 -4.03 -7.10 52.92 -3.19 -7.11 1rtf_c06 source 1rtf TWO CHAIN TISSUE PLASMINOGEN ACTIVATOR : 3 hits 1rtf_c06 naa= 3 ULMN 3 1sca_c01 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 1 3 # 1 32 ASP A 51 ASP.? 1000.00 64 HIS A 57 HIS^? 1000.00 155 ASN A 90 ASN.? 1000.00 coo 80.16 73.25 62.48 80.01 71.25 61.82 5.22 5.50 6.84 4.14 5.83 5.06 coo 78.27 67.69 61.83 79.58 67.76 60.19 8.52 8.65 5.26 6.52 8.65 5.91 coo 80.34 61.88 52.75 81.25 63.19 54.35 19.16 11.48 3.60 19.40 12.95 2.08 ULMN 3 1sca_c01 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 2 3 # 2 32 ASP B 51 ASP.? 1000.00 64 HIS B 57 HIS^? 1000.00 155 ASN B 90 ASN.? 1000.00 coo 80.16 73.25 62.48 80.01 71.25 61.82 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 78.27 67.69 61.83 79.58 67.76 60.19 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 80.34 61.88 52.75 81.25 63.19 54.35 37.32 -8.72 2.58 37.18 -10.17 1.03 1sca_c01 source 1sca SUBTILISIN CARLSBERG (E.C.3.4.21.62) (AQUEOUS : 2 hits 1sca_c01 naa= 3 ULMN 3 1sll_c00 SIALIDASE L user 1 3 # 1 318 ASP A 51 ASP.? 1000.00 595 GLU A 118 GLU^? 1000.00 713 TYR A 123 TYR.? 1000.00 coo 5.64 2.82 38.49 4.59 4.19 37.25 5.22 5.50 6.84 4.14 5.83 5.06 coo 4.35 13.73 37.63 3.39 12.18 36.55 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 3.76 10.25 31.38 3.16 9.87 34.10 1.57 3.68 -2.19 -0.67 4.60 -0.79 ULMN 3 1sll_c00 SIALIDASE L user 2 3 # 2 318 ASP A 120 ASP.? 1000.00 595 GLU A 118 GLU^? 1000.00 713 TYR A 123 TYR.? 1000.00 coo 5.64 2.82 38.49 4.59 4.19 37.25 1.50 5.98 -11.47 2.88 5.62 -13.02 coo 4.35 13.73 37.63 3.39 12.18 36.55 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 3.76 10.25 31.38 3.16 9.87 34.10 1.57 3.68 -2.19 -0.67 4.60 -0.79 ULMN 3 1sll_c00 SIALIDASE L user 3 3 # 3 318 ASP B 51 ASP.? 1000.00 595 GLU B 118 GLU^? 1000.00 713 TYR B 123 TYR.? 1000.00 coo 5.64 2.82 38.49 4.59 4.19 37.25 51.46 -2.33 4.55 52.23 -2.54 2.59 coo 4.35 13.73 37.63 3.39 12.18 36.55 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 3.76 10.25 31.38 3.16 9.87 34.10 54.16 0.41 -4.97 56.69 0.28 -3.79 ULMN 3 1sll_c00 SIALIDASE L user 4 3 # 4 318 ASP B 120 ASP.? 1000.00 595 GLU B 118 GLU^? 1000.00 713 TYR B 123 TYR.? 1000.00 coo 5.64 2.82 38.49 4.59 4.19 37.25 53.95 -3.06 -13.70 52.62 -2.92 -15.33 coo 4.35 13.73 37.63 3.39 12.18 36.55 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 3.76 10.25 31.38 3.16 9.87 34.10 54.16 0.41 -4.97 56.69 0.28 -3.79 1sll_c00 source 1sll SIALIDASE L : 4 hits 1sll_c00 naa= 3 ULMN 3 1sme_c04 PLASMEPSIN II user 1 3 # 1 A 34 ASP A 100 ASP.? 1000.00 A 37 SER A 101 SER~? 1000.00 A 214 ASP A 99 ASP.? 1000.00 coo 51.75 60.57 19.10 52.05 60.90 21.19 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 51.10 65.11 20.73 52.62 63.74 19.42 12.85 8.31 -19.30 13.97 10.47 -19.16 coo 48.59 58.89 25.78 50.13 59.74 24.61 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1sme_c04 PLASMEPSIN II user 2 3 # 2 A 34 ASP B 100 ASP.? 1000.00 A 37 SER B 101 SER~? 1000.00 A 214 ASP B 99 ASP.? 1000.00 coo 51.75 60.57 19.10 52.05 60.90 21.19 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 51.10 65.11 20.73 52.62 63.74 19.42 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo 48.59 58.89 25.78 50.13 59.74 24.61 48.62 -3.60 -18.80 49.23 -5.36 -17.81 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 100 ASP.? 1000.00 B 37 SER A 101 SER~? 1000.00 B 214 ASP A 99 ASP.? 1000.00 coo 17.69 97.58 52.73 17.33 97.19 54.77 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 20.67 100.44 55.84 20.21 98.51 54.45 12.85 8.31 -19.30 13.97 10.47 -19.16 coo 12.41 98.71 58.47 14.37 98.17 58.05 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 1sme_c05 PLASMEPSIN II user 2 3 # 2 B 34 ASP B 100 ASP.? 1000.00 B 37 SER B 101 SER~? 1000.00 B 214 ASP B 99 ASP.? 1000.00 coo 17.69 97.58 52.73 17.33 97.19 54.77 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 20.67 100.44 55.84 20.21 98.51 54.45 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo 12.41 98.71 58.47 14.37 98.17 58.05 48.62 -3.60 -18.80 49.23 -5.36 -17.81 1sme_c05 source 1sme PLASMEPSIN II : 2 hits 1sme_c05 naa= 3 ULMN 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 1 3 # 1 A 87 ARG A 95 ARG^? 1000.00 A 89 HIS A 57 HIS^? 1000.00 A 119 ASN A 90 ASN.? 1000.00 coo 28.44 23.52 73.95 30.13 24.84 76.11 10.85 10.51 -3.66 10.03 10.94 -0.73 coo 21.34 20.13 69.47 22.14 19.11 71.12 8.52 8.65 5.26 6.52 8.65 5.91 coo 19.69 29.00 71.61 19.80 26.98 72.20 19.16 11.48 3.60 19.40 12.95 2.08 ULMN 3 1smn_c00 EXTRACELLULAR ENDONUCLEASE user 2 3 # 2 A 87 ARG B 95 ARG^? 1000.00 A 89 HIS B 57 HIS^? 1000.00 A 119 ASN B 90 ASN.? 1000.00 coo 28.44 23.52 73.95 30.13 24.84 76.11 45.21 -7.59 -5.33 46.47 -7.64 -2.54 coo 21.34 20.13 69.47 22.14 19.11 71.12 48.17 -5.80 3.42 50.22 -6.16 3.68 coo 19.69 29.00 71.61 19.80 26.98 72.20 37.32 -8.72 2.58 37.18 -10.17 1.03 1smn_c00 source 1smn EXTRACELLULAR ENDONUCLEASE : 2 hits 1smn_c00 naa= 3 ULMN 3 1smn_c01 EXTRACELLULAR ENDONUCLEASE user 1 3 # 1 B 87 ARG A 95 ARG^? 1000.00 B 89 HIS A 57 HIS^? 1000.00 B 119 ASN A 90 ASN.? 1000.00 coo -30.08 23.20 29.48 -31.80 24.60 27.35 10.85 10.51 -3.66 10.03 10.94 -0.73 coo -22.85 19.92 33.92 -23.63 18.94 32.24 8.52 8.65 5.26 6.52 8.65 5.91 coo -21.28 28.91 31.84 -21.35 26.90 31.17 19.16 11.48 3.60 19.40 12.95 2.08 ULMN 3 1smn_c01 EXTRACELLULAR ENDONUCLEASE user 2 3 # 2 B 87 ARG B 95 ARG^? 1000.00 B 89 HIS B 57 HIS^? 1000.00 B 119 ASN B 90 ASN.? 1000.00 coo -30.08 23.20 29.48 -31.80 24.60 27.35 45.21 -7.59 -5.33 46.47 -7.64 -2.54 coo -22.85 19.92 33.92 -23.63 18.94 32.24 48.17 -5.80 3.42 50.22 -6.16 3.68 coo -21.28 28.91 31.84 -21.35 26.90 31.17 37.32 -8.72 2.58 37.18 -10.17 1.03 1smn_c01 source 1smn EXTRACELLULAR ENDONUCLEASE : 2 hits 1smn_c01 naa= 3 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 1 3 # 1 A 57 HIS A 34 HIS~? 1000.00 A 102 ASP A 33 ASP~? 1000.00 A 193 GLY A 29 GLY.? 1000.00 coo 15.02 29.17 19.44 15.63 29.96 17.60 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 19.67 30.58 22.61 18.30 29.87 21.17 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 14.52 29.10 10.01 15.08 29.66 10.19 10.16 4.95 14.00 10.62 4.41 13.60 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 2 3 # 2 A 57 HIS B 34 HIS~? 1000.00 A 102 ASP B 33 ASP~? 1000.00 A 193 GLY B 29 GLY.? 1000.00 coo 15.02 29.17 19.44 15.63 29.96 17.60 41.87 5.60 12.60 42.81 7.10 11.48 coo 19.67 30.58 22.61 18.30 29.87 21.17 37.13 3.30 17.02 39.09 3.64 17.72 coo 14.52 29.10 10.01 15.08 29.66 10.19 47.41 -1.84 12.12 46.79 -1.48 11.78 1ssx_c02 source 1ssx ALPHA-LYTIC PROTEASE : 2 hits 1ssx_c02 naa= 3 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 1 3 # 1 E 166 ASP A 33 ASP~? 1000.00 E 168 LYS A 84 LYS~? 1000.00 E 201 THR A 82 THR~? 1000.00 coo 5.36 16.20 22.10 3.88 17.00 23.31 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 5.06 22.32 18.11 1.02 22.08 22.74 14.81 6.41 15.81 10.01 5.61 18.56 coo -1.79 18.29 19.05 -1.19 20.28 19.71 17.29 5.37 21.85 18.35 6.20 23.54 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 2 3 # 2 E 166 ASP A 100 ASP.? 1000.00 E 168 LYS A 104 LYS~? 1000.00 E 201 THR A 12 THR.? 1000.00 coo 5.36 16.20 22.10 3.88 17.00 23.31 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 5.06 22.32 18.11 1.02 22.08 22.74 16.90 10.44 -16.85 11.99 12.60 -13.53 coo -1.79 18.29 19.05 -1.19 20.28 19.71 11.57 3.66 -19.37 9.57 4.28 -18.85 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 3 3 # 3 E 166 ASP B 100 ASP.? 1000.00 E 168 LYS B 104 LYS~? 1000.00 E 201 THR B 12 THR.? 1000.00 coo 5.36 16.20 22.10 3.88 17.00 23.31 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 5.06 22.32 18.11 1.02 22.08 22.74 37.49 -7.58 -17.76 42.96 -9.14 -14.97 coo -1.79 18.29 19.05 -1.19 20.28 19.71 42.26 -0.44 -21.09 44.38 -0.38 -20.76 1stc_c02 source 1stc CAMP-DEPENDENT PROTEIN KINASE : 3 hits 1stc_c02 naa= 3 ULMN 3 1uag_c01 UDP-N-ACETYLMURAMOYL-L-ALANINE-:D-GLuser 1 3 # 1 115 LYS B 84 LYS~? 1000.00 138 ASN B 30 ASN.? 1000.00 183 HIS B 25 HIS.? 1000.00 coo 36.44 -9.55 24.75 39.00 -9.24 20.52 43.00 -3.73 14.55 45.69 -3.43 18.79 coo 42.86 -4.84 22.91 42.38 -4.90 20.84 44.16 1.73 11.59 45.65 3.03 10.80 coo 43.51 -9.99 13.57 42.49 -8.60 14.69 45.20 4.85 2.41 47.00 5.76 2.99 ULMN 3 1uag_c01 UDP-N-ACETYLMURAMOYL-L-ALANINE-:D-GLuser 2 3 # 2 115 LYS B 84 LYS~? 1000.00 138 ASN B 30 ASN.? 1000.00 183 HIS B 57 HIS^? 1000.00 coo 36.44 -9.55 24.75 39.00 -9.24 20.52 43.00 -3.73 14.55 45.69 -3.43 18.79 coo 42.86 -4.84 22.91 42.38 -4.90 20.84 44.16 1.73 11.59 45.65 3.03 10.80 coo 43.51 -9.99 13.57 42.49 -8.60 14.69 48.17 -5.80 3.42 50.22 -6.16 3.68 1uag_c01 source 1uag UDP-N-ACETYLMURAMOYL-L-ALANINE-:D-GLUTAMATE LI: 2 hits 1uag_c01 naa= 3 ULMN 3 1uf7_c00 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 1 3 # 1 A 46 GLU A 118 GLU^? 1000.00 A 126 LYS A 55 LYS.? 1000.00 A 171 ALA A 125 ALA^? 1000.00 coo 52.87 81.38 -9.32 53.05 81.09 -7.22 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 51.43 89.29 -7.19 53.08 83.69 -4.74 5.21 5.66 1.43 0.49 8.11 0.22 coo 48.80 81.73 -5.45 50.30 81.43 -5.45 7.49 0.49 -6.09 7.03 0.98 -7.46 ULMN 3 1uf7_c00 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 2 3 # 2 A 46 GLU B 118 GLU^? 1000.00 A 126 LYS B 55 LYS.? 1000.00 A 171 ALA B 125 ALA^? 1000.00 coo 52.87 81.38 -9.32 53.05 81.09 -7.22 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 51.43 89.29 -7.19 53.08 83.69 -4.74 50.86 -2.31 -0.81 56.59 -4.06 -2.86 coo 48.80 81.73 -5.45 50.30 81.43 -5.45 47.74 3.13 -7.74 48.32 2.72 -9.09 1uf7_c00 source 1uf7 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLASE : 2 hits 1uf7_c00 naa= 3 ULMN 3 1uf7_c01 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 1 3 # 1 B 46 GLU A 118 GLU^? 1000.00 B 126 LYS A 55 LYS.? 1000.00 B 171 ALA A 125 ALA^? 1000.00 coo 20.47 87.42 16.54 20.16 87.17 14.45 8.38 7.16 -4.95 8.02 9.11 -4.23 coo 24.73 94.37 14.59 21.08 89.84 11.98 5.21 5.66 1.43 0.49 8.11 0.22 coo 24.38 86.32 12.71 22.88 86.54 12.71 7.49 0.49 -6.09 7.03 0.98 -7.46 ULMN 3 1uf7_c01 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 2 3 # 2 B 46 GLU B 118 GLU^? 1000.00 B 126 LYS B 55 LYS.? 1000.00 B 171 ALA B 125 ALA^? 1000.00 coo 20.47 87.42 16.54 20.16 87.17 14.45 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 24.73 94.37 14.59 21.08 89.84 11.98 50.86 -2.31 -0.81 56.59 -4.06 -2.86 coo 24.38 86.32 12.71 22.88 86.54 12.71 47.74 3.13 -7.74 48.32 2.72 -9.09 1uf7_c01 source 1uf7 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLASE : 2 hits 1uf7_c01 naa= 3 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 1 3 # 1 A 581 GLU A 73 GLU.? 1000.00 A 596 ARG A 74 ARG.? 1000.00 A 647 ARG A 79 ARG~? 1000.00 coo 69.13 32.20 28.58 68.39 32.96 30.44 35.24 14.24 25.23 35.01 14.32 27.33 coo 70.89 37.31 29.70 69.54 36.29 32.39 32.14 8.48 25.15 29.08 8.40 25.40 coo 66.09 40.54 34.70 66.92 37.69 35.49 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 2 3 # 2 A 581 GLU A 132 GLU~? 1000.00 A 596 ARG A 131 ARG~? 1000.00 A 647 ARG B 130 ARG~? 1000.00 coo 69.13 32.20 28.58 68.39 32.96 30.44 19.13 -4.57 -11.72 19.25 -6.54 -12.50 coo 70.89 37.31 29.70 69.54 36.29 32.39 24.31 -6.42 -8.86 24.19 -9.09 -10.38 coo 66.09 40.54 34.70 66.92 37.69 35.49 29.03 -0.22 -9.33 27.67 -2.50 -7.82 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 3 3 # 3 A 581 GLU B 73 GLU.? 1000.00 A 596 ARG B 74 ARG.? 1000.00 A 647 ARG B 79 ARG~? 1000.00 coo 69.13 32.20 28.58 68.39 32.96 30.44 23.38 -12.14 25.82 23.41 -12.13 27.93 coo 70.89 37.31 29.70 69.54 36.29 32.39 26.00 -6.26 25.33 29.00 -5.64 25.39 coo 66.09 40.54 34.70 66.92 37.69 35.49 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 4 3 # 4 A 581 GLU B 132 GLU~? 1000.00 A 596 ARG B 131 ARG~? 1000.00 A 647 ARG A 130 ARG~? 1000.00 coo 69.13 32.20 28.58 68.39 32.96 30.44 35.47 7.40 -12.25 35.40 9.42 -12.89 coo 70.89 37.31 29.70 69.54 36.29 32.39 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 66.09 40.54 34.70 66.92 37.69 35.49 26.14 3.04 -9.06 27.83 5.35 -7.98 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 5 3 # 5 A 581 GLU B 132 GLU~? 1000.00 A 596 ARG B 131 ARG~? 1000.00 A 647 ARG B 130 ARG~? 1000.00 coo 69.13 32.20 28.58 68.39 32.96 30.44 35.47 7.40 -12.25 35.40 9.42 -12.89 coo 70.89 37.31 29.70 69.54 36.29 32.39 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 66.09 40.54 34.70 66.92 37.69 35.49 29.03 -0.22 -9.33 27.67 -2.50 -7.82 1v0e_c00 source 1v0e ENDO-ALPHA-SIALIDASE : 5 hits 1v0e_c00 naa= 3 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 1 3 # 1 B 581 GLU A 73 GLU.? 1000.00 B 596 ARG A 74 ARG.? 1000.00 B 647 ARG A 79 ARG~? 1000.00 coo 38.22 57.83 70.36 36.82 56.74 69.18 35.24 14.24 25.23 35.01 14.32 27.33 coo 34.24 60.89 68.08 33.31 57.93 67.63 32.14 8.48 25.15 29.08 8.40 25.40 coo 31.43 57.38 61.97 31.90 55.58 64.41 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 2 3 # 2 B 581 GLU A 132 GLU~? 1000.00 B 596 ARG A 131 ARG~? 1000.00 B 647 ARG B 130 ARG~? 1000.00 coo 38.22 57.83 70.36 36.82 56.74 69.18 19.13 -4.57 -11.72 19.25 -6.54 -12.50 coo 34.24 60.89 68.08 33.31 57.93 67.63 24.31 -6.42 -8.86 24.19 -9.09 -10.38 coo 31.43 57.38 61.97 31.90 55.58 64.41 29.03 -0.22 -9.33 27.67 -2.50 -7.82 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 3 3 # 3 B 581 GLU B 73 GLU.? 1000.00 B 596 ARG B 74 ARG.? 1000.00 B 647 ARG B 79 ARG~? 1000.00 coo 38.22 57.83 70.36 36.82 56.74 69.18 23.38 -12.14 25.82 23.41 -12.13 27.93 coo 34.24 60.89 68.08 33.31 57.93 67.63 26.00 -6.26 25.33 29.00 -5.64 25.39 coo 31.43 57.38 61.97 31.90 55.58 64.41 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 4 3 # 4 B 581 GLU B 132 GLU~? 1000.00 B 596 ARG B 131 ARG~? 1000.00 B 647 ARG A 130 ARG~? 1000.00 coo 38.22 57.83 70.36 36.82 56.74 69.18 35.47 7.40 -12.25 35.40 9.42 -12.89 coo 34.24 60.89 68.08 33.31 57.93 67.63 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 31.43 57.38 61.97 31.90 55.58 64.41 26.14 3.04 -9.06 27.83 5.35 -7.98 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 5 3 # 5 B 581 GLU B 132 GLU~? 1000.00 B 596 ARG B 131 ARG~? 1000.00 B 647 ARG B 130 ARG~? 1000.00 coo 38.22 57.83 70.36 36.82 56.74 69.18 35.47 7.40 -12.25 35.40 9.42 -12.89 coo 34.24 60.89 68.08 33.31 57.93 67.63 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 31.43 57.38 61.97 31.90 55.58 64.41 29.03 -0.22 -9.33 27.67 -2.50 -7.82 1v0e_c01 source 1v0e ENDO-ALPHA-SIALIDASE : 5 hits 1v0e_c01 naa= 3 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 1 3 # 1 C 581 GLU A 73 GLU.? 1000.00 C 596 ARG A 74 ARG.? 1000.00 C 647 ARG A 79 ARG~? 1000.00 coo 11.31 31.26 27.00 13.31 30.71 26.58 35.24 14.24 25.23 35.01 14.32 27.33 coo 13.44 32.78 22.07 15.56 30.91 23.37 32.14 8.48 25.15 29.08 8.40 25.40 coo 21.00 33.35 22.82 19.83 30.82 24.09 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 2 3 # 2 C 581 GLU A 132 GLU~? 1000.00 C 596 ARG A 131 ARG~? 1000.00 C 647 ARG B 130 ARG~? 1000.00 coo 11.31 31.26 27.00 13.31 30.71 26.58 19.13 -4.57 -11.72 19.25 -6.54 -12.50 coo 13.44 32.78 22.07 15.56 30.91 23.37 24.31 -6.42 -8.86 24.19 -9.09 -10.38 coo 21.00 33.35 22.82 19.83 30.82 24.09 29.03 -0.22 -9.33 27.67 -2.50 -7.82 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 3 3 # 3 C 581 GLU B 73 GLU.? 1000.00 C 596 ARG B 74 ARG.? 1000.00 C 647 ARG B 79 ARG~? 1000.00 coo 11.31 31.26 27.00 13.31 30.71 26.58 23.38 -12.14 25.82 23.41 -12.13 27.93 coo 13.44 32.78 22.07 15.56 30.91 23.37 26.00 -6.26 25.33 29.00 -5.64 25.39 coo 21.00 33.35 22.82 19.83 30.82 24.09 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 4 3 # 4 C 581 GLU B 132 GLU~? 1000.00 C 596 ARG B 131 ARG~? 1000.00 C 647 ARG A 130 ARG~? 1000.00 coo 11.31 31.26 27.00 13.31 30.71 26.58 35.47 7.40 -12.25 35.40 9.42 -12.89 coo 13.44 32.78 22.07 15.56 30.91 23.37 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 21.00 33.35 22.82 19.83 30.82 24.09 26.14 3.04 -9.06 27.83 5.35 -7.98 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 5 3 # 5 C 581 GLU B 132 GLU~? 1000.00 C 596 ARG B 131 ARG~? 1000.00 C 647 ARG B 130 ARG~? 1000.00 coo 11.31 31.26 27.00 13.31 30.71 26.58 35.47 7.40 -12.25 35.40 9.42 -12.89 coo 13.44 32.78 22.07 15.56 30.91 23.37 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 21.00 33.35 22.82 19.83 30.82 24.09 29.03 -0.22 -9.33 27.67 -2.50 -7.82 1v0e_c02 source 1v0e ENDO-ALPHA-SIALIDASE : 5 hits 1v0e_c02 naa= 3 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 1 3 # 1 D 581 GLU A 73 GLU.? 1000.00 D 596 ARG A 74 ARG.? 1000.00 D 647 ARG A 79 ARG~? 1000.00 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 35.24 14.24 25.23 35.01 14.32 27.33 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 32.14 8.48 25.15 29.08 8.40 25.40 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 2 3 # 2 D 581 GLU A 132 GLU~? 1000.00 D 596 ARG A 131 ARG~? 1000.00 D 647 ARG B 130 ARG~? 1000.00 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 19.13 -4.57 -11.72 19.25 -6.54 -12.50 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 24.31 -6.42 -8.86 24.19 -9.09 -10.38 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 29.03 -0.22 -9.33 27.67 -2.50 -7.82 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 3 3 # 3 D 581 GLU B 73 GLU.? 1000.00 D 596 ARG B 74 ARG.? 1000.00 D 647 ARG B 79 ARG~? 1000.00 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 23.38 -12.14 25.82 23.41 -12.13 27.93 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 26.00 -6.26 25.33 29.00 -5.64 25.39 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 34.23 -7.42 21.18 34.10 -9.69 19.14 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 4 3 # 4 D 581 GLU B 132 GLU~? 1000.00 D 596 ARG B 131 ARG~? 1000.00 D 647 ARG A 130 ARG~? 1000.00 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 35.47 7.40 -12.25 35.40 9.42 -12.89 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 30.35 9.14 -9.20 31.40 11.87 -10.11 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 26.14 3.04 -9.06 27.83 5.35 -7.98 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 5 3 # 5 D 581 GLU B 132 GLU~? 1000.00 D 596 ARG B 131 ARG~? 1000.00 D 647 ARG B 130 ARG~? 1000.00 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 35.47 7.40 -12.25 35.40 9.42 -12.89 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 30.35 9.14 -9.20 31.40 11.87 -10.11 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 29.03 -0.22 -9.33 27.67 -2.50 -7.82 1v0e_c03 source 1v0e ENDO-ALPHA-SIALIDASE : 5 hits 1v0e_c03 naa= 3 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 1 3 # 1 E 581 GLU A 73 GLU.? 1000.00 E 596 ARG A 74 ARG.? 1000.00 E 647 ARG A 79 ARG~? 1000.00 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 35.24 14.24 25.23 35.01 14.32 27.33 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 32.14 8.48 25.15 29.08 8.40 25.40 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 2 3 # 2 E 581 GLU A 132 GLU~? 1000.00 E 596 ARG A 131 ARG~? 1000.00 E 647 ARG B 130 ARG~? 1000.00 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 19.13 -4.57 -11.72 19.25 -6.54 -12.50 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 24.31 -6.42 -8.86 24.19 -9.09 -10.38 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 29.03 -0.22 -9.33 27.67 -2.50 -7.82 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 3 3 # 3 E 581 GLU B 132 GLU~? 1000.00 E 596 ARG B 131 ARG~? 1000.00 E 647 ARG A 130 ARG~? 1000.00 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 35.47 7.40 -12.25 35.40 9.42 -12.89 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 26.14 3.04 -9.06 27.83 5.35 -7.98 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 4 3 # 4 E 581 GLU B 132 GLU~? 1000.00 E 596 ARG B 131 ARG~? 1000.00 E 647 ARG B 130 ARG~? 1000.00 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 35.47 7.40 -12.25 35.40 9.42 -12.89 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 29.03 -0.22 -9.33 27.67 -2.50 -7.82 1v0e_c04 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c04 naa= 3 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 1 3 # 1 F 581 GLU A 73 GLU.? 1000.00 F 596 ARG A 74 ARG.? 1000.00 F 647 ARG A 79 ARG~? 1000.00 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 35.24 14.24 25.23 35.01 14.32 27.33 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 32.14 8.48 25.15 29.08 8.40 25.40 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 23.98 10.05 21.41 23.46 12.49 19.64 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 2 3 # 2 F 581 GLU A 132 GLU~? 1000.00 F 596 ARG A 131 ARG~? 1000.00 F 647 ARG B 130 ARG~? 1000.00 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 19.13 -4.57 -11.72 19.25 -6.54 -12.50 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 24.31 -6.42 -8.86 24.19 -9.09 -10.38 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 29.03 -0.22 -9.33 27.67 -2.50 -7.82 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 3 3 # 3 F 581 GLU B 132 GLU~? 1000.00 F 596 ARG B 131 ARG~? 1000.00 F 647 ARG A 130 ARG~? 1000.00 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 35.47 7.40 -12.25 35.40 9.42 -12.89 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 30.35 9.14 -9.20 31.40 11.87 -10.11 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 26.14 3.04 -9.06 27.83 5.35 -7.98 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 4 3 # 4 F 581 GLU B 132 GLU~? 1000.00 F 596 ARG B 131 ARG~? 1000.00 F 647 ARG B 130 ARG~? 1000.00 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 35.47 7.40 -12.25 35.40 9.42 -12.89 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 30.35 9.14 -9.20 31.40 11.87 -10.11 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 29.03 -0.22 -9.33 27.67 -2.50 -7.82 1v0e_c05 source 1v0e ENDO-ALPHA-SIALIDASE : 4 hits 1v0e_c05 naa= 3 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 123 TYR.? 1000.00 A 40 ASP A 51 ASP.? 1000.00 A 103 LEU A 56 LEU^? 1000.00 coo 12.09 16.13 10.57 11.28 18.80 10.73 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 7.55 25.51 14.34 9.65 25.73 14.24 5.22 5.50 6.84 4.14 5.83 5.06 coo 11.83 18.73 16.99 10.99 19.71 15.26 9.58 6.43 -0.49 11.68 6.34 -0.97 1vzz_c00 source 1vzz STEROID DELTA-ISOMERASE : 1 hits 1vzz_c00 naa= 3 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 123 TYR.? 1000.00 B 40 ASP A 51 ASP.? 1000.00 B 103 LEU A 56 LEU^? 1000.00 coo 14.25 20.09 37.35 13.48 17.40 37.38 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 9.39 10.77 34.53 11.50 10.63 34.41 5.22 5.50 6.84 4.14 5.83 5.06 coo 12.89 17.60 31.13 12.34 16.51 32.90 9.58 6.43 -0.49 11.68 6.34 -0.97 1vzz_c01 source 1vzz STEROID DELTA-ISOMERASE : 1 hits 1vzz_c01 naa= 3 ULMN 3 1ybv_c00 TRIHYDROXYNAPHTHALENE REDUCTASE user 1 3 # 1 A 164 SER A 53 SER.? 1000.00 A 178 TYR A 123 TYR.? 1000.00 A 182 LYS A 55 LYS.? 1000.00 coo 81.46 10.53 21.66 82.20 10.82 19.39 1.42 3.02 4.29 0.48 5.03 5.27 coo 87.67 8.69 17.10 86.62 10.83 18.52 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 85.30 6.17 22.83 87.26 11.02 23.50 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ybv_c00 TRIHYDROXYNAPHTHALENE REDUCTASE user 2 3 # 2 A 164 SER B 53 SER.? 1000.00 A 178 TYR B 123 TYR.? 1000.00 A 182 LYS B 55 LYS.? 1000.00 coo 81.46 10.53 21.66 82.20 10.82 19.39 54.98 0.20 2.05 55.66 -1.87 3.14 coo 87.67 8.69 17.10 86.62 10.83 18.52 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 85.30 6.17 22.83 87.26 11.02 23.50 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1ybv_c00 source 1ybv TRIHYDROXYNAPHTHALENE REDUCTASE : 2 hits 1ybv_c00 naa= 3 ULMN 3 1ybv_c01 TRIHYDROXYNAPHTHALENE REDUCTASE user 1 3 # 1 B 164 SER A 53 SER.? 1000.00 B 178 TYR A 123 TYR.? 1000.00 B 182 LYS A 55 LYS.? 1000.00 coo 61.22 3.61 34.51 60.46 1.86 35.98 1.42 3.02 4.29 0.48 5.03 5.27 coo 54.99 -1.20 35.40 56.04 1.15 36.44 1.57 3.68 -2.19 -0.67 4.60 -0.79 coo 57.40 2.23 30.19 55.43 5.44 33.87 5.21 5.66 1.43 0.49 8.11 0.22 ULMN 3 1ybv_c01 TRIHYDROXYNAPHTHALENE REDUCTASE user 2 3 # 2 B 164 SER B 53 SER.? 1000.00 B 178 TYR B 123 TYR.? 1000.00 B 182 LYS B 55 LYS.? 1000.00 coo 61.22 3.61 34.51 60.46 1.86 35.98 54.98 0.20 2.05 55.66 -1.87 3.14 coo 54.99 -1.20 35.40 56.04 1.15 36.44 54.16 0.41 -4.97 56.69 0.28 -3.79 coo 57.40 2.23 30.19 55.43 5.44 33.87 50.86 -2.31 -0.81 56.59 -4.06 -2.86 1ybv_c01 source 1ybv TRIHYDROXYNAPHTHALENE REDUCTASE : 2 hits 1ybv_c01 naa= 3 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 1 3 # 1 A 369 ASP A 33 ASP~? 1000.00 A 371 LYS A 84 LYS~? 1000.00 A 407 THR A 82 THR~? 1000.00 coo -5.17 31.09 15.73 -7.07 31.12 16.73 20.33 -0.63 17.74 18.38 -0.89 18.50 coo -4.43 30.92 22.89 -6.61 31.91 19.71 14.81 6.41 15.81 10.01 5.61 18.56 coo -8.38 36.02 19.06 -8.83 34.10 19.89 17.29 5.37 21.85 18.35 6.20 23.54 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 2 3 # 2 A 369 ASP A 67 ASP~? 1000.00 A 371 LYS B 41 LYS.? 1000.00 A 407 THR A 63 THR~? 1000.00 coo -5.17 31.09 15.73 -7.07 31.12 16.73 27.47 11.30 10.36 28.38 13.14 9.88 coo -4.43 30.92 22.89 -6.61 31.91 19.71 33.89 10.98 6.00 33.54 14.13 10.34 coo -8.38 36.02 19.06 -8.83 34.10 19.89 27.46 6.83 7.64 28.67 7.72 6.07 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 3 3 # 3 A 369 ASP A 100 ASP.? 1000.00 A 371 LYS A 104 LYS~? 1000.00 A 407 THR A 12 THR.? 1000.00 coo -5.17 31.09 15.73 -7.07 31.12 16.73 11.24 8.50 -15.15 10.47 10.05 -13.93 coo -4.43 30.92 22.89 -6.61 31.91 19.71 16.90 10.44 -16.85 11.99 12.60 -13.53 coo -8.38 36.02 19.06 -8.83 34.10 19.89 11.57 3.66 -19.37 9.57 4.28 -18.85 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 4 3 # 4 A 369 ASP B 99 ASP.? 1000.00 A 371 LYS B 14 LYS.? 1000.00 A 407 THR B 12 THR.? 1000.00 coo -5.17 31.09 15.73 -7.07 31.12 16.73 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo -4.43 30.92 22.89 -6.61 31.91 19.71 44.48 3.32 -17.22 49.33 1.95 -20.50 coo -8.38 36.02 19.06 -8.83 34.10 19.89 42.26 -0.44 -21.09 44.38 -0.38 -20.76 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 5 3 # 5 A 369 ASP B 100 ASP.? 1000.00 A 371 LYS B 14 LYS.? 1000.00 A 407 THR B 12 THR.? 1000.00 coo -5.17 31.09 15.73 -7.07 31.12 16.73 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo -4.43 30.92 22.89 -6.61 31.91 19.71 44.48 3.32 -17.22 49.33 1.95 -20.50 coo -8.38 36.02 19.06 -8.83 34.10 19.89 42.26 -0.44 -21.09 44.38 -0.38 -20.76 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 6 3 # 6 A 369 ASP B 100 ASP.? 1000.00 A 371 LYS B 104 LYS~? 1000.00 A 407 THR B 12 THR.? 1000.00 coo -5.17 31.09 15.73 -7.07 31.12 16.73 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo -4.43 30.92 22.89 -6.61 31.91 19.71 37.49 -7.58 -17.76 42.96 -9.14 -14.97 coo -8.38 36.02 19.06 -8.83 34.10 19.89 42.26 -0.44 -21.09 44.38 -0.38 -20.76 1zrz_c02 source 1zrz PROTEIN KINASE C, IOTA : 6 hits 1zrz_c02 naa= 3 ULMN 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 1 3 # 1 A 43 ASP A 33 ASP~? 1000.00 A 48 HIS A 34 HIS~? 1000.00 A 77 LYS A 84 LYS~? 1000.00 coo 13.04 30.41 72.50 12.95 30.65 70.36 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 12.77 23.50 68.33 13.58 25.42 68.49 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 7.53 29.84 65.06 12.29 29.41 67.79 14.81 6.41 15.81 10.01 5.61 18.56 ULMN 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 2 3 # 2 A 43 ASP B 33 ASP~? 1000.00 A 48 HIS B 34 HIS~? 1000.00 A 77 LYS B 84 LYS~? 1000.00 coo 13.04 30.41 72.50 12.95 30.65 70.36 37.13 3.30 17.02 39.09 3.64 17.72 coo 12.77 23.50 68.33 13.58 25.42 68.49 41.87 5.60 12.60 42.81 7.10 11.48 coo 7.53 29.84 65.06 12.29 29.41 67.79 43.00 -3.73 14.55 45.69 -3.43 18.79 2acu_c01 source 2acu ALDOSE REDUCTASE (E.C.1.1.1.21) MUTANT WITH TY: 2 hits 2acu_c01 naa= 3 ULMN 3 2apr_c04 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 1 3 # 1 35 ASP A 100 ASP.? 1000.00 38 SER A 101 SER~? 1000.00 218 ASP A 99 ASP.? 1000.00 coo 41.14 58.72 105.19 42.39 59.85 103.92 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 46.04 57.35 103.96 44.97 58.52 105.78 12.85 8.31 -19.30 13.97 10.47 -19.16 coo 41.33 60.20 97.63 42.00 60.96 99.49 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 2apr_c04 ACID PROTEINASE (RHIZOPUSPEPSIN) (E.user 2 3 # 2 35 ASP B 100 ASP.? 1000.00 38 SER B 101 SER~? 1000.00 218 ASP B 99 ASP.? 1000.00 coo 41.14 58.72 105.19 42.39 59.85 103.92 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 46.04 57.35 103.96 44.97 58.52 105.78 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo 41.33 60.20 97.63 42.00 60.96 99.49 48.62 -3.60 -18.80 49.23 -5.36 -17.81 2apr_c04 source 2apr ACID PROTEINASE (RHIZOPUSPEPSIN) (E.C.3.4.23.6: 2 hits 2apr_c04 naa= 3 ULMN 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 157 PHE A 77 PHE~? 1000.00 A 245 ASP B 33 ASP~? 1000.00 A 273 LYS B 41 LYS.? 1000.00 coo 9.49 9.24 -34.27 7.12 7.86 -33.75 29.11 2.95 19.66 31.07 2.74 17.67 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 37.13 3.30 17.02 39.09 3.64 17.72 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 33.89 10.98 6.00 33.54 14.13 10.34 ULMN 3 2gsa_c04 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 2 3 # 2 A 157 PHE B 77 PHE~? 1000.00 A 245 ASP B 33 ASP~? 1000.00 A 273 LYS B 41 LYS.? 1000.00 coo 9.49 9.24 -34.27 7.12 7.86 -33.75 28.52 -0.47 19.68 26.27 -0.43 18.01 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 37.13 3.30 17.02 39.09 3.64 17.72 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 33.89 10.98 6.00 33.54 14.13 10.34 2gsa_c04 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 2 hits 2gsa_c04 naa= 3 ULMN 3 2jxr_c04 LIGAND CP-081282 user 1 3 # 1 A 32 ASP A 100 ASP.? 1000.00 A 35 SER A 101 SER~? 1000.00 A 215 ASP A 99 ASP.? 1000.00 coo -14.00 61.45 43.99 -14.19 63.14 42.84 11.24 8.50 -15.15 10.47 10.05 -13.93 coo -13.21 66.21 45.84 -15.49 65.90 45.84 12.85 8.31 -19.30 13.97 10.47 -19.16 coo -10.72 64.19 37.77 -12.20 64.43 39.15 6.07 5.96 -16.72 5.18 4.09 -17.03 ULMN 3 2jxr_c04 LIGAND CP-081282 user 2 3 # 2 A 32 ASP B 100 ASP.? 1000.00 A 35 SER B 101 SER~? 1000.00 A 215 ASP B 99 ASP.? 1000.00 coo -14.00 61.45 43.99 -14.19 63.14 42.84 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo -13.21 66.21 45.84 -15.49 65.90 45.84 41.39 -5.20 -20.49 39.72 -6.00 -22.06 coo -10.72 64.19 37.77 -12.20 64.43 39.15 48.62 -3.60 -18.80 49.23 -5.36 -17.81 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 34 HIS~? 1000.00 A 102 ASP A 33 ASP~? 1000.00 A 193 GLY A 29 GLY.? 1000.00 coo 14.96 29.22 19.55 15.62 29.93 17.67 15.31 -2.76 13.60 14.28 -4.22 12.50 coo 19.64 30.69 22.61 18.18 29.94 21.25 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 14.54 28.99 9.76 15.06 29.59 10.02 10.16 4.95 14.00 10.62 4.41 13.60 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 2 3 # 2 A 57 HIS A 57 HIS^? 1000.00 A 102 ASP A 51 ASP.? 1000.00 A 193 GLY A 122 GLY.? 1000.00 coo 14.96 29.22 19.55 15.62 29.93 17.67 8.52 8.65 5.26 6.52 8.65 5.91 coo 19.64 30.69 22.61 18.18 29.94 21.25 5.22 5.50 6.84 4.14 5.83 5.06 coo 14.54 28.99 9.76 15.06 29.59 10.02 2.74 7.56 -4.88 2.64 6.74 -4.83 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 3 3 # 3 A 57 HIS B 34 HIS~? 1000.00 A 102 ASP B 33 ASP~? 1000.00 A 193 GLY B 29 GLY.? 1000.00 coo 14.96 29.22 19.55 15.62 29.93 17.67 41.87 5.60 12.60 42.81 7.10 11.48 coo 19.64 30.69 22.61 18.18 29.94 21.25 37.13 3.30 17.02 39.09 3.64 17.72 coo 14.54 28.99 9.76 15.06 29.59 10.02 47.41 -1.84 12.12 46.79 -1.48 11.78 2lpr_c02 source 2lpr ALPHA-LYTIC PROTEASE : 3 hits 2lpr_c02 naa= 3 ULMN 3 2phk_c02 MC-PEPTIDE user 1 3 # 1 A 149 ASP A 67 ASP~? 1000.00 A 151 LYS B 41 LYS.? 1000.00 A 186 THR A 63 THR~? 1000.00 coo 41.42 17.90 44.98 43.39 18.36 45.61 27.47 11.30 10.36 28.38 13.14 9.88 coo 45.75 16.58 39.61 47.43 18.26 45.54 33.89 10.98 6.00 33.54 14.13 10.34 coo 45.88 23.02 44.72 46.99 21.16 44.68 27.46 6.83 7.64 28.67 7.72 6.07 ULMN 3 2phk_c02 MC-PEPTIDE user 2 3 # 2 A 149 ASP A 100 ASP.? 1000.00 A 151 LYS A 104 LYS~? 1000.00 A 186 THR A 12 THR.? 1000.00 coo 41.42 17.90 44.98 43.39 18.36 45.61 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 45.75 16.58 39.61 47.43 18.26 45.54 16.90 10.44 -16.85 11.99 12.60 -13.53 coo 45.88 23.02 44.72 46.99 21.16 44.68 11.57 3.66 -19.37 9.57 4.28 -18.85 ULMN 3 2phk_c02 MC-PEPTIDE user 3 3 # 3 A 149 ASP B 100 ASP.? 1000.00 A 151 LYS B 104 LYS~? 1000.00 A 186 THR B 12 THR.? 1000.00 coo 41.42 17.90 44.98 43.39 18.36 45.61 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 45.75 16.58 39.61 47.43 18.26 45.54 37.49 -7.58 -17.76 42.96 -9.14 -14.97 coo 45.88 23.02 44.72 46.99 21.16 44.68 42.26 -0.44 -21.09 44.38 -0.38 -20.76 2phk_c02 source 2phk MC-PEPTIDE : 3 hits 2phk_c02 naa= 3 ULMN 3 2rnf_c02 RIBONUCLEASE 4 user 1 3 # 1 A 12 HIS A 57 HIS^? 1000.00 A 40 LYS A 84 LYS~? 1000.00 A 116 HIS A 25 HIS.? 1000.00 coo 12.34 -0.45 10.80 13.53 1.19 11.34 8.52 8.65 5.26 6.52 8.65 5.91 coo 18.50 3.53 20.10 16.17 2.61 14.41 14.81 6.41 15.81 10.01 5.61 18.56 coo 14.70 6.01 5.61 14.27 7.69 6.78 10.94 -1.26 4.23 9.26 -2.11 5.16 2rnf_c02 source 2rnf RIBONUCLEASE 4 : 1 hits 2rnf_c02 naa= 3 ULMN 3 2rnf_c03 RIBONUCLEASE 4 user 1 3 # 1 B 12 HIS A 57 HIS^? 1000.00 B 40 LYS A 84 LYS~? 1000.00 B 116 HIS A 25 HIS.? 1000.00 coo -6.35 21.42 14.69 -6.06 23.46 15.04 8.52 8.65 5.26 6.52 8.65 5.91 coo -10.61 31.45 9.72 -8.75 26.69 13.45 14.81 6.41 15.81 10.01 5.61 18.56 coo -0.95 25.22 19.68 -0.68 26.73 18.24 10.94 -1.26 4.23 9.26 -2.11 5.16 2rnf_c03 source 2rnf RIBONUCLEASE 4 : 1 hits 2rnf_c03 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP A 21 ASP~? 1000.00 166 GLY A 58 GLY^? 1000.00 169 GLU A 86 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 8.04 -7.86 -2.86 8.75 -8.68 -4.68 coo -8.58 13.22 3.21 -8.90 13.15 4.05 13.97 8.66 2.66 13.72 7.90 2.79 coo -16.67 7.89 2.78 -17.65 6.56 1.49 12.00 9.86 13.36 10.03 10.14 14.08 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 # 2 141 ASP A 33 ASP~? 1000.00 166 GLY A 58 GLY^? 1000.00 169 GLU A 118 GLU^? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 20.33 -0.63 17.74 18.38 -0.89 18.50 coo -8.58 13.22 3.21 -8.90 13.15 4.05 13.97 8.66 2.66 13.72 7.90 2.79 coo -16.67 7.89 2.78 -17.65 6.56 1.49 8.38 7.16 -4.95 8.02 9.11 -4.23 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 # 3 141 ASP A 121 ASP.? 1000.00 166 GLY A 58 GLY^? 1000.00 169 GLU A 86 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 -0.75 5.29 -6.38 -2.02 4.12 -7.60 coo -8.58 13.22 3.21 -8.90 13.15 4.05 13.97 8.66 2.66 13.72 7.90 2.79 coo -16.67 7.89 2.78 -17.65 6.56 1.49 12.00 9.86 13.36 10.03 10.14 14.08 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 # 4 141 ASP B 21 ASP~? 1000.00 166 GLY B 58 GLY^? 1000.00 169 GLU B 86 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 47.17 11.20 -4.12 46.63 12.10 -5.95 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.48 -5.87 1.38 42.73 -5.09 1.47 coo -16.67 7.89 2.78 -17.65 6.56 1.49 45.30 -6.76 11.82 47.29 -7.30 12.26 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 # 5 141 ASP B 33 ASP~? 1000.00 166 GLY B 58 GLY^? 1000.00 169 GLU B 118 GLU^? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 37.13 3.30 17.02 39.09 3.64 17.72 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.48 -5.87 1.38 42.73 -5.09 1.47 coo -16.67 7.89 2.78 -17.65 6.56 1.49 47.80 -3.78 -6.65 48.51 -5.65 -5.96 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 # 6 141 ASP B 121 ASP.? 1000.00 166 GLY B 58 GLY^? 1000.00 169 GLU B 86 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 55.83 -1.01 -8.85 57.04 -0.03 -10.25 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.48 -5.87 1.38 42.73 -5.09 1.47 coo -16.67 7.89 2.78 -17.65 6.56 1.49 45.30 -6.76 11.82 47.29 -7.30 12.26 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 6 hits 2tdt_c00 naa= 3 ULMN 3 2tpl_c04 TYROSINE PHENOL-LYASE user 1 3 # 1 A 122 TYR B 54 TYR.? 1000.00 A 214 ASP B 121 ASP.? 1000.00 A 256 LYS B 14 LYS.? 1000.00 coo -36.51 -15.34 5.35 -36.90 -16.76 7.69 51.35 3.44 -0.95 49.48 5.47 -1.36 coo -29.95 -11.32 -1.46 -28.83 -11.55 0.31 55.83 -1.01 -8.85 57.04 -0.03 -10.25 coo -18.13 -8.46 4.26 -20.75 -6.32 9.36 44.48 3.32 -17.22 49.33 1.95 -20.50 2tpl_c04 source 2tpl TYROSINE PHENOL-LYASE : 1 hits 2tpl_c04 naa= 3 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 1 3 # 1 71 ARG A 130 ARG~? 1000.00 127 ARG B 130 ARG~? 1000.00 270 GLU A 132 GLU~? 1000.00 coo -1.14 25.72 1.64 0.76 28.10 1.50 26.14 3.04 -9.06 27.83 5.35 -7.98 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 29.03 -0.22 -9.33 27.67 -2.50 -7.82 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 19.13 -4.57 -11.72 19.25 -6.54 -12.50 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 2 3 # 2 71 ARG B 130 ARG~? 1000.00 127 ARG A 130 ARG~? 1000.00 270 GLU A 132 GLU~? 1000.00 coo -1.14 25.72 1.64 0.76 28.10 1.50 29.03 -0.22 -9.33 27.67 -2.50 -7.82 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 26.14 3.04 -9.06 27.83 5.35 -7.98 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 19.13 -4.57 -11.72 19.25 -6.54 -12.50 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 3 3 # 3 71 ARG B 130 ARG~? 1000.00 127 ARG A 130 ARG~? 1000.00 270 GLU B 132 GLU~? 1000.00 coo -1.14 25.72 1.64 0.76 28.10 1.50 29.03 -0.22 -9.33 27.67 -2.50 -7.82 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 26.14 3.04 -9.06 27.83 5.35 -7.98 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 35.47 7.40 -12.25 35.40 9.42 -12.89 5cpa_c01 source 5cpa CARBOXYPEPTIDASE A=ALPHA= (COX) (E.C.3.4.17.1): 3 hits 5cpa_c01 naa= 3 ULMN 3 5rsa_c01 RIBONUCLEASE A user 1 3 # 1 12 HIS A 57 HIS^? 1000.00 41 LYS A 84 LYS~? 1000.00 119 HIS A 25 HIS.? 1000.00 coo 28.18 18.67 11.43 28.83 17.39 9.89 8.52 8.65 5.26 6.52 8.65 5.91 coo 25.33 8.32 6.30 27.86 13.90 7.82 14.81 6.41 15.81 10.01 5.61 18.56 coo 33.68 19.99 5.35 34.98 18.36 5.19 10.94 -1.26 4.23 9.26 -2.11 5.16 5rsa_c01 source 5rsa RIBONUCLEASE A : 1 hits 5rsa_c01 naa= 3 ULMN 3 1k12_p00 LECTIN user 1 3 # 1 A 52 HIS A 112 HIS~? 1000.00 A 79 ARG A 130 ARG~? 1000.00 A 86 ARG B 131 ARG~? 1000.00 coo -5.53 26.98 5.69 -5.98 25.70 4.09 22.04 9.33 -6.37 21.65 11.39 -6.50 coo -12.15 26.35 6.05 -10.94 27.19 3.35 26.14 3.04 -9.06 27.83 5.35 -7.98 coo -9.59 20.48 4.28 -9.21 22.28 1.82 30.35 9.14 -9.20 31.40 11.87 -10.11 ULMN 3 1k12_p00 LECTIN user 2 3 # 2 A 52 HIS B 112 HIS~? 1000.00 A 79 ARG B 130 ARG~? 1000.00 A 86 ARG A 131 ARG~? 1000.00 coo -5.53 26.98 5.69 -5.98 25.70 4.09 33.67 -6.31 -6.89 34.04 -8.28 -6.27 coo -12.15 26.35 6.05 -10.94 27.19 3.35 29.03 -0.22 -9.33 27.67 -2.50 -7.82 coo -9.59 20.48 4.28 -9.21 22.28 1.82 24.31 -6.42 -8.86 24.19 -9.09 -10.38 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 30 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 12.99 1.13 13.14 11.29 0.22 12.22 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 90 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 19.16 11.48 3.60 19.40 12.95 2.08 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN A 92 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 17.08 16.25 0.34 16.10 18.05 0.95 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN A 111 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 25.27 11.32 -8.72 26.44 12.83 -9.67 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 5 1 # 5 A 461 ASN A 119 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 3.72 2.77 -8.00 2.56 3.18 -6.27 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 6 1 # 6 A 461 ASN A 138 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 28.46 -6.88 -18.73 30.26 -8.01 -18.72 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 7 1 # 7 A 461 ASN B 30 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 44.16 1.73 11.59 45.65 3.03 10.80 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 8 1 # 8 A 461 ASN B 90 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 37.32 -8.72 2.58 37.18 -10.17 1.03 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 9 1 # 9 A 461 ASN B 92 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 39.24 -13.20 -0.33 38.83 -14.34 -2.08 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 10 1 # 10 A 461 ASN B 111 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 30.17 -8.52 -8.75 28.85 -10.02 -9.49 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 11 1 # 11 A 461 ASN B 119 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 51.54 0.65 -10.87 52.83 0.79 -9.21 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 12 1 # 12 A 461 ASN B 138 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 26.02 9.33 -18.63 24.49 10.82 -18.66 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 12 hits 1kbk_p00 naa= 1 ULMN 4 2g3n_p00 ALPHA-GLUCOSIDASE user 1 4 # 1 A 87 ASP B 99 ASP.? 1000.00 A 184 TYR B 123 TYR.? 1000.00 A 400 ARG B 97 ARG^? 1000.00 A 416 ASP B 120 ASP.? 1000.00 coo -0.32 21.89 76.95 -2.29 21.43 77.55 48.62 -3.60 -18.80 49.23 -5.36 -17.81 coo -13.84 24.02 81.30 -13.39 23.42 78.61 54.16 0.41 -4.97 56.69 0.28 -3.79 coo -2.45 25.99 82.19 -2.93 24.57 79.52 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo -5.39 20.15 83.91 -5.94 21.73 82.59 53.95 -3.06 -13.70 52.62 -2.92 -15.33 2g3n_p00 source 2g3n ALPHA-GLUCOSIDASE : 1 hits 2g3n_p00 naa= 4 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 # 1 A 270 ASN A 30 ASN.? 1000.00 A 384 ASN A 119 ASN.? 1000.00 A 385 GLU A 118 GLU^? 1000.00 coo 22.28 63.17 110.61 22.47 65.06 111.53 12.99 1.13 13.14 11.29 0.22 12.22 coo 7.06 50.07 96.17 8.50 48.54 96.31 3.72 2.77 -8.00 2.56 3.18 -6.27 coo 11.59 49.83 99.41 10.92 47.97 100.16 8.38 7.16 -4.95 8.02 9.11 -4.23 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 2 3 # 2 A 270 ASN B 30 ASN.? 1000.00 A 384 ASN B 119 ASN.? 1000.00 A 385 GLU B 118 GLU^? 1000.00 coo 22.28 63.17 110.61 22.47 65.06 111.53 44.16 1.73 11.59 45.65 3.03 10.80 coo 7.06 50.07 96.17 8.50 48.54 96.31 51.54 0.65 -10.87 52.83 0.79 -9.21 coo 11.59 49.83 99.41 10.92 47.97 100.16 47.80 -3.78 -6.65 48.51 -5.65 -5.96 2v3r_p00 source 2v3r EXOGLUCANASE 1 : 2 hits 2v3r_p00 naa= 3 ULMN 3 1bdv_d00 GENE REGULATION/DNA user 1 3 # 1 A 9 GLN A 136 GLN~? 1000.00 A 11 ASN A 138 ASN~? 1000.00 A 13 ARG A 143 ARG.? 1000.00 coo 33.45 2.10 7.21 34.51 1.09 5.67 21.21 -4.14 -20.77 20.06 -5.90 -21.11 coo 38.37 -1.60 11.46 39.03 -3.43 10.75 28.46 -6.88 -18.73 30.26 -8.01 -18.72 coo 41.73 -6.32 12.94 43.25 -5.49 10.40 29.36 -13.20 -19.11 27.25 -13.61 -16.94 ULMN 3 1bdv_d00 GENE REGULATION/DNA user 2 3 # 2 A 9 GLN A 140 GLN~? 1000.00 A 11 ASN A 138 ASN~? 1000.00 A 13 ARG A 143 ARG.? 1000.00 coo 33.45 2.10 7.21 34.51 1.09 5.67 23.92 -4.70 -24.33 22.54 -3.13 -23.91 coo 38.37 -1.60 11.46 39.03 -3.43 10.75 28.46 -6.88 -18.73 30.26 -8.01 -18.72 coo 41.73 -6.32 12.94 43.25 -5.49 10.40 29.36 -13.20 -19.11 27.25 -13.61 -16.94 1bdv_d00 source 1bdv GENE REGULATION/DNA : 2 hits 1bdv_d00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 31 TYR~? 1000.00 I 306 VAL A 85 VAL~? 1000.00 I 308 VAL A 26 VAL.? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 14.76 2.26 18.96 12.86 3.20 20.79 coo 23.55 29.53 9.81 23.15 27.39 10.24 15.67 6.41 12.09 14.71 4.68 11.15 coo 16.43 30.18 9.35 15.05 30.67 11.01 12.86 0.13 7.70 14.97 0.44 8.14 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 2 3 # 2 I 303 TYR A 31 TYR~? 1000.00 I 306 VAL A 85 VAL~? 1000.00 I 308 VAL A 88 VAL~? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 14.76 2.26 18.96 12.86 3.20 20.79 coo 23.55 29.53 9.81 23.15 27.39 10.24 15.67 6.41 12.09 14.71 4.68 11.15 coo 16.43 30.18 9.35 15.05 30.67 11.01 18.88 10.54 11.04 20.50 9.38 11.90 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 3 3 # 3 I 303 TYR B 31 TYR~? 1000.00 I 306 VAL B 85 VAL~? 1000.00 I 308 VAL B 26 VAL.? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 42.93 0.52 17.54 44.90 -0.41 19.30 coo 23.55 29.53 9.81 23.15 27.39 10.24 41.78 -3.37 10.94 41.72 -1.80 9.40 coo 16.43 30.18 9.35 15.05 30.67 11.01 43.81 2.79 6.20 41.74 2.56 6.82 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 4 3 # 4 I 303 TYR B 31 TYR~? 1000.00 I 306 VAL B 85 VAL~? 1000.00 I 308 VAL B 88 VAL~? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 42.93 0.52 17.54 44.90 -0.41 19.30 coo 23.55 29.53 9.81 23.15 27.39 10.24 41.78 -3.37 10.94 41.72 -1.80 9.40 coo 16.43 30.18 9.35 15.05 30.67 11.01 38.10 -8.03 9.86 37.15 -6.54 11.15 1cqt_d00 source 1cqt GENE REGULATION/DNA : 4 hits 1cqt_d00 naa= 3 ULMN 3 1emh_d00 HYDROLASE/DNA user 1 3 # 1 A 271 PRO A 48 PRO^? 1000.00 A 272 LEU A 59 LEU^? 1000.00 A 276 ARG A 95 ARG^? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 14.76 1.64 -0.02 15.18 2.52 1.98 coo 10.97 0.43 16.73 11.31 2.11 18.06 18.08 6.69 1.70 17.71 5.98 -0.30 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 10.85 10.51 -3.66 10.03 10.94 -0.73 ULMN 3 1emh_d00 HYDROLASE/DNA user 2 3 # 2 A 271 PRO A 94 PRO.? 1000.00 A 272 LEU A 108 LEU~? 1000.00 A 276 ARG A 130 ARG~? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 18.13 10.37 -5.84 16.36 11.56 -5.19 coo 10.97 0.43 16.73 11.31 2.11 18.06 19.44 9.61 -11.20 17.94 11.15 -10.88 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 26.14 3.04 -9.06 27.83 5.35 -7.98 ULMN 3 1emh_d00 HYDROLASE/DNA user 3 3 # 3 A 271 PRO A 144 PRO.? 1000.00 A 272 LEU B 108 LEU~? 1000.00 A 276 ARG B 130 ARG~? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 34.76 -9.72 -17.28 34.80 -11.28 -18.89 coo 10.97 0.43 16.73 11.31 2.11 18.06 35.74 -6.72 -12.01 37.32 -8.15 -11.64 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 29.03 -0.22 -9.33 27.67 -2.50 -7.82 ULMN 3 1emh_d00 HYDROLASE/DNA user 4 3 # 4 A 271 PRO B 48 PRO^? 1000.00 A 272 LEU B 59 LEU^? 1000.00 A 276 ARG B 95 ARG^? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 41.99 1.99 -0.52 40.95 0.46 0.69 coo 10.97 0.43 16.73 11.31 2.11 18.06 38.30 -3.90 0.79 38.33 -2.97 -1.17 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 45.21 -7.59 -5.33 46.47 -7.64 -2.54 ULMN 3 1emh_d00 HYDROLASE/DNA user 5 3 # 5 A 271 PRO B 94 PRO.? 1000.00 A 272 LEU B 96 LEU^? 1000.00 A 276 ARG B 97 ARG^? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 37.58 -7.59 -6.72 39.42 -8.68 -6.13 coo 10.97 0.43 16.73 11.31 2.11 18.06 42.66 -4.06 -11.95 40.75 -4.42 -12.89 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 48.24 -7.34 -13.18 47.41 -10.11 -14.15 ULMN 3 1emh_d00 HYDROLASE/DNA user 6 3 # 6 A 271 PRO B 94 PRO.? 1000.00 A 272 LEU B 108 LEU~? 1000.00 A 276 ARG B 130 ARG~? 1000.00 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 37.58 -7.59 -6.72 39.42 -8.68 -6.13 coo 10.97 0.43 16.73 11.31 2.11 18.06 35.74 -6.72 -12.01 37.32 -8.15 -11.64 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 29.03 -0.22 -9.33 27.67 -2.50 -7.82 1emh_d00 source 1emh HYDROLASE/DNA : 6 hits 1emh_d00 naa= 3 ULMN 3 1hwt_d00 GENE REGULATION/DNA user 1 3 # 1 C 70 ARG A 131 ARG~? 1000.00 C 71 LYS A 135 LYS~? 1000.00 C 72 VAL A 133 VAL~? 1000.00 coo 23.89 33.54 29.21 26.59 34.86 28.68 24.31 -6.42 -8.86 24.19 -9.09 -10.38 coo 25.82 26.89 29.68 23.33 22.98 25.84 24.67 -5.89 -15.87 21.09 -10.09 -12.80 coo 28.86 29.08 30.37 28.04 31.02 29.93 22.24 -1.13 -15.54 21.97 1.03 -15.70 ULMN 3 1hwt_d00 GENE REGULATION/DNA user 2 3 # 2 C 70 ARG B 131 ARG~? 1000.00 C 71 LYS B 135 LYS~? 1000.00 C 72 VAL A 110 VAL~? 1000.00 coo 23.89 33.54 29.21 26.59 34.86 28.68 30.35 9.14 -9.20 31.40 11.87 -10.11 coo 25.82 26.89 29.68 23.33 22.98 25.84 29.94 8.76 -16.33 31.69 11.42 -12.73 coo 28.86 29.08 30.37 28.04 31.02 29.93 26.00 8.10 -12.14 26.74 9.08 -13.94 1hwt_d00 source 1hwt GENE REGULATION/DNA : 2 hits 1hwt_d00 naa= 3 ULMN 3 1mjo_d00 TRANSCRIPTION/DNA user 1 3 # 1 D 23 LYS B 41 LYS.? 1000.00 D 25 THR A 63 THR~? 1000.00 D 27 SER A 61 SER~? 1000.00 coo 86.60 33.38 44.00 87.05 39.52 42.71 33.89 10.98 6.00 33.54 14.13 10.34 coo 81.20 31.58 48.03 79.23 32.24 47.54 27.46 6.83 7.64 28.67 7.72 6.07 coo 79.09 29.82 54.20 77.17 28.90 53.05 22.92 4.42 5.79 24.11 6.33 4.86 1mjo_d00 source 1mjo TRANSCRIPTION/DNA : 1 hits 1mjo_d00 naa= 3 ULMN 3 1r4i_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 563 LYS B 135 LYS~? 1000.00 A 564 VAL A 110 VAL~? 1000.00 A 568 ARG A 130 ARG~? 1000.00 coo -6.60 80.79 55.64 -8.55 79.48 61.01 29.94 8.76 -16.33 31.69 11.42 -12.73 coo -9.25 78.14 55.31 -11.11 77.94 56.39 26.00 8.10 -12.14 26.74 9.08 -13.94 coo -12.31 74.86 52.32 -13.99 74.91 54.92 26.14 3.04 -9.06 27.83 5.35 -7.98 ULMN 3 1r4i_d00 TRANSCRIPTION/DNA user 2 3 # 2 A 563 LYS B 135 LYS~? 1000.00 A 564 VAL A 110 VAL~? 1000.00 A 568 ARG B 131 ARG~? 1000.00 coo -6.60 80.79 55.64 -8.55 79.48 61.01 29.94 8.76 -16.33 31.69 11.42 -12.73 coo -9.25 78.14 55.31 -11.11 77.94 56.39 26.00 8.10 -12.14 26.74 9.08 -13.94 coo -12.31 74.86 52.32 -13.99 74.91 54.92 30.35 9.14 -9.20 31.40 11.87 -10.11 1r4i_d00 source 1r4i TRANSCRIPTION/DNA : 2 hits 1r4i_d00 naa= 3 ULMN 4 2ql2_d00 TRANSCRIPTION/DNA user 1 4 # 1 A 548 ASN B 119 ASN.? 1000.00 A 550 ARG B 97 ARG^? 1000.00 A 551 GLU B 118 GLU^? 1000.00 A 554 ARG B 95 ARG^? 1000.00 coo 10.14 52.78 -20.71 8.21 53.68 -20.78 51.54 0.65 -10.87 52.83 0.79 -9.21 coo 11.95 46.81 -13.63 11.17 49.52 -12.45 48.24 -7.34 -13.18 47.41 -10.11 -14.15 coo 9.01 46.23 -21.76 8.49 44.22 -21.22 47.80 -3.78 -6.65 48.51 -5.65 -5.96 coo 10.46 41.35 -18.53 9.11 40.22 -21.03 45.21 -7.59 -5.33 46.47 -7.64 -2.54 2ql2_d00 source 2ql2 TRANSCRIPTION/DNA : 1 hits 2ql2_d00 naa= 4 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 1 4 # 1 B 122 ARG A 130 ARG~? 1000.00 B 148 LYS B 14 LYS.? 1000.00 B 151 LEU B 17 LEU.? 1000.00 B 154 ILE B 18 ILE^? 1000.00 coo 13.00 32.05 60.31 16.02 31.73 59.80 26.14 3.04 -9.06 27.83 5.35 -7.98 coo 11.05 44.13 44.68 12.77 44.45 49.56 44.48 3.32 -17.22 49.33 1.95 -20.50 coo 11.72 38.91 44.77 13.11 39.67 46.23 43.31 4.96 -13.40 44.71 4.41 -11.86 coo 7.03 36.97 46.99 7.83 37.90 47.52 40.06 7.24 -9.31 38.91 7.95 -8.66 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 2 4 # 2 B 122 ARG A 130 ARG~? 1000.00 B 148 LYS B 41 LYS.? 1000.00 B 151 LEU B 39 LEU~? 1000.00 B 154 ILE B 47 ILE^? 1000.00 coo 13.00 32.05 60.31 16.02 31.73 59.80 26.14 3.04 -9.06 27.83 5.35 -7.98 coo 11.05 44.13 44.68 12.77 44.45 49.56 33.89 10.98 6.00 33.54 14.13 10.34 coo 11.72 38.91 44.77 13.11 39.67 46.23 34.10 4.25 6.53 34.57 2.44 5.47 coo 7.03 36.97 46.99 7.83 37.90 47.52 38.63 2.80 2.69 38.38 3.58 3.86 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 3 4 # 3 B 122 ARG B 130 ARG~? 1000.00 B 148 LYS B 41 LYS.? 1000.00 B 151 LEU B 39 LEU~? 1000.00 B 154 ILE B 47 ILE^? 1000.00 coo 13.00 32.05 60.31 16.02 31.73 59.80 29.03 -0.22 -9.33 27.67 -2.50 -7.82 coo 11.05 44.13 44.68 12.77 44.45 49.56 33.89 10.98 6.00 33.54 14.13 10.34 coo 11.72 38.91 44.77 13.11 39.67 46.23 34.10 4.25 6.53 34.57 2.44 5.47 coo 7.03 36.97 46.99 7.83 37.90 47.52 38.63 2.80 2.69 38.38 3.58 3.86 3odc_d00 source 3odc DNA BINDING PROTEIN/DNA : 3 hits 3odc_d00 naa= 4 ULMN 3 3s57_d00 OXIDOREDUCTASE/DNA user 1 3 # 1 A 101 VAL A 13 VAL.? 1000.00 A 102 PHE A 16 PHE.? 1000.00 A 169 CYH A 116 CYH^? 1000.00 coo -0.48 2.03 12.21 0.64 0.32 12.97 12.42 2.64 -15.79 12.92 3.87 -14.06 coo 0.51 5.20 15.97 0.26 4.09 18.50 16.57 -1.37 -16.64 17.24 -0.62 -19.24 coo 4.56 -7.03 18.26 5.32 -4.76 16.88 14.05 4.72 -5.27 14.64 4.77 -2.52 ULMN 3 3s57_d00 OXIDOREDUCTASE/DNA user 2 3 # 2 A 101 VAL B 13 VAL.? 1000.00 A 102 PHE B 16 PHE.? 1000.00 A 169 CYH B 116 CYH^? 1000.00 coo -0.48 2.03 12.21 0.64 0.32 12.97 41.99 0.40 -17.37 42.08 -0.85 -15.58 coo 0.51 5.20 15.97 0.26 4.09 18.50 37.75 4.16 -17.47 36.60 3.89 -20.00 coo 4.56 -7.03 18.26 5.32 -4.76 16.88 41.62 -1.76 -6.63 41.26 -1.83 -3.85 3s57_d00 source 3s57 OXIDOREDUCTASE/DNA : 2 hits 3s57_d00 naa= 3 ULMN 3 4er8_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 78 ARG B 95 ARG^? 1000.00 A 82 LYS B 55 LYS.? 1000.00 A 97 ARG B 91 ARG.? 1000.00 coo 16.80 -30.32 -16.38 19.04 -32.25 -17.14 45.21 -7.59 -5.33 46.47 -7.64 -2.54 coo 13.73 -24.92 -13.04 16.51 -30.06 -12.17 50.86 -2.31 -0.81 56.59 -4.06 -2.86 coo 12.19 -29.83 -26.51 14.22 -31.21 -28.36 43.95 -11.42 5.31 46.09 -9.81 6.81 4er8_d00 source 4er8 DNA BINDING PROTEIN/DNA : 1 hits 4er8_d00 naa= 3 ULMN 3 4hn5_d00 TRANSCRIPTION/DNA user 1 3 # 1 B 442 LYS B 135 LYS~? 1000.00 B 443 VAL A 110 VAL~? 1000.00 B 447 ARG A 130 ARG~? 1000.00 coo -11.49 8.72 29.13 -11.20 3.78 25.16 29.94 8.76 -16.33 31.69 11.42 -12.73 coo -11.96 6.22 31.96 -10.74 4.61 32.81 26.00 8.10 -12.14 26.74 9.08 -13.94 coo -14.58 4.58 36.41 -12.11 2.82 36.84 26.14 3.04 -9.06 27.83 5.35 -7.98 ULMN 3 4hn5_d00 TRANSCRIPTION/DNA user 2 3 # 2 B 442 LYS B 135 LYS~? 1000.00 B 443 VAL A 110 VAL~? 1000.00 B 447 ARG B 131 ARG~? 1000.00 coo -11.49 8.72 29.13 -11.20 3.78 25.16 29.94 8.76 -16.33 31.69 11.42 -12.73 coo -11.96 6.22 31.96 -10.74 4.61 32.81 26.00 8.10 -12.14 26.74 9.08 -13.94 coo -14.58 4.58 36.41 -12.11 2.82 36.84 30.35 9.14 -9.20 31.40 11.87 -10.11 4hn5_d00 source 4hn5 TRANSCRIPTION/DNA : 2 hits 4hn5_d00 naa= 3 ULMN 4 1a0s_o00 SUCROSE-SPECIFIC PORIN user 1 4 # 1 P 437 ARG A 79 ARG~? 1000.00 P 439 GLU A 76 GLU~? 1000.00 P 441 ARG A 74 ARG.? 1000.00 P 480 GLU A 78 GLU~? 1000.00 coo -39.15 -21.23 -5.06 -40.81 -23.83 -5.29 23.98 10.05 21.41 23.46 12.49 19.64 coo -36.01 -24.08 -5.13 -37.35 -25.76 -5.05 28.32 10.24 22.30 27.15 11.94 22.76 coo -34.44 -25.13 -9.10 -37.40 -24.16 -9.24 32.14 8.48 25.15 29.08 8.40 25.40 coo -38.47 -19.83 -8.68 -39.93 -21.24 -9.24 24.87 6.26 25.01 26.83 7.05 24.99 ULMN 4 1a0s_o00 SUCROSE-SPECIFIC PORIN user 2 4 # 2 P 437 ARG B 79 ARG~? 1000.00 P 439 GLU B 76 GLU~? 1000.00 P 441 ARG B 74 ARG.? 1000.00 P 480 GLU B 78 GLU~? 1000.00 coo -39.15 -21.23 -5.06 -40.81 -23.83 -5.29 34.23 -7.42 21.18 34.10 -9.69 19.14 coo -36.01 -24.08 -5.13 -37.35 -25.76 -5.05 29.60 -7.66 22.07 30.61 -9.52 22.20 coo -34.44 -25.13 -9.10 -37.40 -24.16 -9.24 26.00 -6.26 25.33 29.00 -5.64 25.39 coo -38.47 -19.83 -8.68 -39.93 -21.24 -9.24 33.27 -3.24 24.53 31.20 -3.63 24.37 1a0s_o00 source 1a0s SUCROSE-SPECIFIC PORIN : 2 hits 1a0s_o00 naa= 4 ULMN 3 2odj_o00 PORIN D user 1 3 # 1 A 156 HIS A 112 HIS~? 1000.00 A 208 ASP A 100 ASP.? 1000.00 A 296 SER A 53 SER.? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 22.04 9.33 -6.37 21.65 11.39 -6.50 coo 18.47 29.19 29.68 19.30 29.17 27.75 11.24 8.50 -15.15 10.47 10.05 -13.93 coo 6.89 17.22 46.63 5.08 16.21 47.91 1.42 3.02 4.29 0.48 5.03 5.27 ULMN 3 2odj_o00 PORIN D user 2 3 # 2 A 156 HIS B 112 HIS~? 1000.00 A 208 ASP B 100 ASP.? 1000.00 A 296 SER B 53 SER.? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 33.67 -6.31 -6.89 34.04 -8.28 -6.27 coo 18.47 29.19 29.68 19.30 29.17 27.75 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo 6.89 17.22 46.63 5.08 16.21 47.91 54.98 0.20 2.05 55.66 -1.87 3.14 2odj_o00 source 2ODJ PORIN D : 2 hits 2odj_o00 naa= 3 ULMN 3 2odj_o01 PORIN D user 1 3 # 1 B 156 HIS A 112 HIS~? 1000.00 B 208 ASP A 100 ASP.? 1000.00 B 296 SER A 53 SER.? 1000.00 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 22.04 9.33 -6.37 21.65 11.39 -6.50 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 11.24 8.50 -15.15 10.47 10.05 -13.93 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 1.42 3.02 4.29 0.48 5.03 5.27 ULMN 3 2odj_o01 PORIN D user 2 3 # 2 B 156 HIS B 112 HIS~? 1000.00 B 208 ASP B 100 ASP.? 1000.00 B 296 SER B 53 SER.? 1000.00 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 33.67 -6.31 -6.89 34.04 -8.28 -6.27 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 43.58 -5.76 -16.56 44.78 -7.17 -15.53 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 54.98 0.20 2.05 55.66 -1.87 3.14 2odj_o01 source 2ODJ PORIN D : 2 hits 2odj_o01 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 78 GLU~? 1000.00 A 44 ASP A 33 ASP~? 1000.00 A 50 THR A 82 THR~? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 24.87 6.26 25.01 26.83 7.05 24.99 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 20.33 -0.63 17.74 18.38 -0.89 18.50 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 17.29 5.37 21.85 18.35 6.20 23.54 ULMN 3 3hde_o00 LYSOZYME user 2 3 # 2 A 35 GLU B 78 GLU~? 1000.00 A 44 ASP B 33 ASP~? 1000.00 A 50 THR B 82 THR~? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 33.27 -3.24 24.53 31.20 -3.63 24.37 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 37.13 3.30 17.02 39.09 3.64 17.72 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 40.60 -2.71 20.52 40.47 -4.04 22.22 3hde_o00 source 3HDE LYSOZYME : 2 hits 3hde_o00 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU A 86 GLU~? 1000.00 C 44 ASP A 33 ASP~? 1000.00 C 50 THR A 82 THR~? 1000.00 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 12.00 9.86 13.36 10.03 10.14 14.08 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 25.48 4.87 1.60 23.90 4.95 0.15 17.29 5.37 21.85 18.35 6.20 23.54 ULMN 3 3hde_o02 LYSOZYME user 2 3 # 2 C 35 GLU A 87 GLU~? 1000.00 C 44 ASP A 33 ASP~? 1000.00 C 50 THR A 82 THR~? 1000.00 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 15.12 11.62 15.65 15.42 10.65 17.50 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 20.33 -0.63 17.74 18.38 -0.89 18.50 coo 25.48 4.87 1.60 23.90 4.95 0.15 17.29 5.37 21.85 18.35 6.20 23.54 ULMN 3 3hde_o02 LYSOZYME user 3 3 # 3 C 35 GLU B 86 GLU~? 1000.00 C 44 ASP B 33 ASP~? 1000.00 C 50 THR B 82 THR~? 1000.00 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 45.30 -6.76 11.82 47.29 -7.30 12.26 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 37.13 3.30 17.02 39.09 3.64 17.72 coo 25.48 4.87 1.60 23.90 4.95 0.15 40.60 -2.71 20.52 40.47 -4.04 22.22 3hde_o02 source 3HDE LYSOZYME : 3 hits 3hde_o02 naa= 3