*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 86 HIS A 88 HIS^? 13.90 OXT ACT A 123 A 250 ALA A 89 ALA^? 11.47 O1 EDO A 126 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 1.19 42.59 14.96 0.64 41.15 15.03 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 86 HIS B 88 HIS^? 7.16 O1 EDO B 123 A 250 ALA B 89 ALA^? 11.41 O2 EDO B 123 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 12.86 47.80 -13.77 13.41 46.50 -14.35 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o00 naa= 3 ULMN 4 1di1_c00 ARISTOLOCHENE SYNTHASE user 1 4 # 1 A 92 TYR A 102 TYR^? 8.02 OXT ACT A 123 A 112 PHE A 96 PHE^? 9.38 OXT ACT A 123 A 178 PHE B 41 PHE^? 12.86 O2 EDO B 125 A 333 TRP A 106 TRP^? 4.14 O ACT A 123 coo 36.26 31.30 22.39 35.67 33.02 24.49 2.53 56.58 17.48 2.05 53.90 18.03 coo 45.52 35.08 26.96 42.72 35.07 26.70 3.05 50.53 10.55 5.47 49.81 11.76 coo 43.67 42.67 22.02 43.98 41.21 24.38 -1.73 59.31 6.86 -0.60 60.93 8.76 coo 37.80 27.73 29.78 38.27 31.62 30.15 8.32 51.05 18.05 8.68 49.61 14.39 ULMN 4 1di1_c00 ARISTOLOCHENE SYNTHASE user 2 4 # 2 A 92 TYR B 102 TYR^? 11.19 O2 EDO B 124 A 112 PHE B 96 PHE^? 9.36 O2 EDO B 124 A 178 PHE A 41 PHE^? 6.84 C1 EDO A 128 A 333 TRP B 106 TRP^? 6.57 O2 EDO B 124 coo 36.26 31.30 22.39 35.67 33.02 24.49 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 45.52 35.08 26.96 42.72 35.07 26.70 10.95 53.66 -6.99 8.59 53.45 -8.41 coo 43.67 42.67 22.02 43.98 41.21 24.38 15.76 60.60 -0.51 14.59 62.89 -1.66 coo 37.80 27.73 29.78 38.27 31.62 30.15 5.92 56.83 -13.86 5.41 54.26 -10.92 1di1_c00 source 1di1 ARISTOLOCHENE SYNTHASE : 2 hits 1di1_c00 naa= 4 ULMN 4 1di1_c01 ARISTOLOCHENE SYNTHASE user 1 4 # 1 B 92 TYR A 102 TYR^? 8.02 OXT ACT A 123 B 112 PHE A 96 PHE^? 9.38 OXT ACT A 123 B 178 PHE B 41 PHE^? 12.86 O2 EDO B 125 B 333 TRP A 106 TRP^? 4.14 O ACT A 123 coo 99.56 54.98 23.15 101.17 54.32 25.32 2.53 56.58 17.48 2.05 53.90 18.03 coo 95.53 46.26 28.54 97.54 48.18 28.09 3.05 50.53 10.55 5.47 49.81 11.76 coo 102.10 41.65 23.98 100.86 42.71 26.26 -1.73 59.31 6.86 -0.60 60.93 8.76 coo 96.01 57.16 30.39 98.35 54.06 31.01 8.32 51.05 18.05 8.68 49.61 14.39 1di1_c01 source 1di1 ARISTOLOCHENE SYNTHASE : 1 hits 1di1_c01 naa= 4 ULMN 4 1djo_c00 GLUTAMINASE-ASPARAGINASE user 1 4 # 1 A1020 THR A 64 THR.? 6.35 OXT ACT A 123 A1034 TYR A 67 TYR^? -4.09 C2 EDO A 127s A1100 THR A 103 THR^? 10.25 OXT ACT A 123 B3294 GLU A 69 GLU^? 4.98 OXT ACT A 123 coo 40.94 131.25 89.60 39.24 130.12 90.27 7.24 60.99 16.88 6.03 59.56 15.82 coo 35.38 132.08 89.27 36.78 129.74 88.76 9.19 62.70 13.11 10.16 60.66 14.79 coo 43.56 124.16 89.51 42.17 124.73 91.05 3.98 57.48 21.66 3.28 59.10 22.89 coo 33.89 125.64 85.55 35.54 126.95 85.33 8.76 56.68 10.43 10.20 56.07 11.84 ULMN 4 1djo_c00 GLUTAMINASE-ASPARAGINASE user 2 4 # 2 A1020 THR A 65 THR.? 10.39 O1 EDO A 127 A1034 TYR A 67 TYR^? -4.09 C2 EDO A 127s A1100 THR A 103 THR^? 10.25 OXT ACT A 123 B3294 GLU A 69 GLU^? 4.98 OXT ACT A 123 coo 40.94 131.25 89.60 39.24 130.12 90.27 6.50 64.50 18.16 6.15 65.44 20.11 coo 35.38 132.08 89.27 36.78 129.74 88.76 9.19 62.70 13.11 10.16 60.66 14.79 coo 43.56 124.16 89.51 42.17 124.73 91.05 3.98 57.48 21.66 3.28 59.10 22.89 coo 33.89 125.64 85.55 35.54 126.95 85.33 8.76 56.68 10.43 10.20 56.07 11.84 ULMN 4 1djo_c00 GLUTAMINASE-ASPARAGINASE user 3 4 # 3 A1020 THR B 64 THR^? 7.68 C1 EDO B 125 A1034 TYR B 67 TYR^? -3.57 C1 EDO B 125s A1100 THR B 103 THR^? 13.94 C1 EDO B 125 B3294 GLU B 69 GLU^? -2.92 O2 EDO B 124s coo 40.94 131.25 89.60 39.24 130.12 90.27 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 35.38 132.08 89.27 36.78 129.74 88.76 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 43.56 124.16 89.51 42.17 124.73 91.05 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 33.89 125.64 85.55 35.54 126.95 85.33 5.26 59.46 -4.72 3.83 59.41 -6.26 ULMN 4 1djo_c00 GLUTAMINASE-ASPARAGINASE user 4 4 # 4 A1020 THR B 65 THR^? 10.56 C1 EDO B 125 A1034 TYR B 67 TYR^? -3.57 C1 EDO B 125s A1100 THR B 103 THR^? 13.94 C1 EDO B 125 B3294 GLU B 69 GLU^? -2.92 O2 EDO B 124s coo 40.94 131.25 89.60 39.24 130.12 90.27 7.62 69.47 -9.24 7.92 71.08 -10.64 coo 35.38 132.08 89.27 36.78 129.74 88.76 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 43.56 124.16 89.51 42.17 124.73 91.05 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 33.89 125.64 85.55 35.54 126.95 85.33 5.26 59.46 -4.72 3.83 59.41 -6.26 1djo_c00 source 1djo GLUTAMINASE-ASPARAGINASE : 4 hits 1djo_c00 naa= 4 ULMN 4 1djo_c01 GLUTAMINASE-ASPARAGINASE user 1 4 # 1 A1294 GLU A 69 GLU^? 4.98 OXT ACT A 123 B3020 THR A 64 THR.? 6.35 OXT ACT A 123 B3034 TYR A 67 TYR^? -4.09 C2 EDO A 127s B3100 THR A 103 THR^? 10.25 OXT ACT A 123 coo 42.18 93.40 84.96 40.44 92.19 85.03 8.76 56.68 10.43 10.20 56.07 11.84 coo 35.69 87.89 89.88 37.41 89.09 90.33 7.24 60.99 16.88 6.03 59.56 15.82 coo 40.98 87.08 88.86 39.63 89.46 88.41 9.19 62.70 13.11 10.16 60.66 14.79 coo 33.09 94.86 90.18 34.63 94.22 91.55 3.98 57.48 21.66 3.28 59.10 22.89 ULMN 4 1djo_c01 GLUTAMINASE-ASPARAGINASE user 2 4 # 2 A1294 GLU A 69 GLU^? 4.98 OXT ACT A 123 B3020 THR A 65 THR.? 10.39 O1 EDO A 127 B3034 TYR A 67 TYR^? -4.09 C2 EDO A 127s B3100 THR A 103 THR^? 10.25 OXT ACT A 123 coo 42.18 93.40 84.96 40.44 92.19 85.03 8.76 56.68 10.43 10.20 56.07 11.84 coo 35.69 87.89 89.88 37.41 89.09 90.33 6.50 64.50 18.16 6.15 65.44 20.11 coo 40.98 87.08 88.86 39.63 89.46 88.41 9.19 62.70 13.11 10.16 60.66 14.79 coo 33.09 94.86 90.18 34.63 94.22 91.55 3.98 57.48 21.66 3.28 59.10 22.89 ULMN 4 1djo_c01 GLUTAMINASE-ASPARAGINASE user 3 4 # 3 A1294 GLU B 69 GLU^? -2.92 O2 EDO B 124s B3020 THR B 64 THR^? 7.68 C1 EDO B 125 B3034 TYR B 67 TYR^? -3.57 C1 EDO B 125s B3100 THR B 103 THR^? 13.94 C1 EDO B 125 coo 42.18 93.40 84.96 40.44 92.19 85.03 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 35.69 87.89 89.88 37.41 89.09 90.33 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 40.98 87.08 88.86 39.63 89.46 88.41 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 33.09 94.86 90.18 34.63 94.22 91.55 10.26 64.09 -15.02 10.94 66.08 -15.56 ULMN 4 1djo_c01 GLUTAMINASE-ASPARAGINASE user 4 4 # 4 A1294 GLU B 69 GLU^? -2.92 O2 EDO B 124s B3020 THR B 65 THR^? 10.56 C1 EDO B 125 B3034 TYR B 67 TYR^? -3.57 C1 EDO B 125s B3100 THR B 103 THR^? 13.94 C1 EDO B 125 coo 42.18 93.40 84.96 40.44 92.19 85.03 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 35.69 87.89 89.88 37.41 89.09 90.33 7.62 69.47 -9.24 7.92 71.08 -10.64 coo 40.98 87.08 88.86 39.63 89.46 88.41 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 33.09 94.86 90.18 34.63 94.22 91.55 10.26 64.09 -15.02 10.94 66.08 -15.56 1djo_c01 source 1djo GLUTAMINASE-ASPARAGINASE : 4 hits 1djo_c01 naa= 4 ULMN 4 1doo_c04 HEAT SHOCK LOCUS U user 1 4 # 1 A 1 THR A 56 THR^? 7.33 C2 EDO A 125 A 33 LYS A 113 LYS^? 12.75 O2 EDO A 124 A 45 GLY A 76 GLY^? 13.00 O2 EDO A 126 A 124 SER A 34 SER.? -3.56 C2 EDO A 125s coo 20.60 80.81 78.25 19.93 81.48 80.23 17.43 43.07 17.55 19.51 43.25 18.06 coo 24.21 79.63 86.31 23.19 81.94 80.55 13.93 45.27 9.54 19.06 43.44 6.58 coo 20.39 75.93 87.86 19.67 76.00 88.35 11.11 39.60 10.62 10.59 39.98 10.13 coo 15.73 80.26 75.45 17.95 80.97 75.03 20.28 47.66 19.28 22.08 46.10 18.94 ULMN 4 1doo_c04 HEAT SHOCK LOCUS U user 2 4 # 2 A 1 THR B 56 THR^? 10.83 C3 PEG B 126 A 33 LYS B 113 LYS^? 13.71 C2 EDO B 124 A 45 GLY B 76 GLY^? 12.82 C3 PEG B 126 A 124 SER B 34 SER^? 13.24 C2 EDO B 124 coo 20.60 80.81 78.25 19.93 81.48 80.23 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo 24.21 79.63 86.31 23.19 81.94 80.55 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 20.39 75.93 87.86 19.67 76.00 88.35 2.80 43.65 -10.92 3.34 43.82 -10.31 coo 15.73 80.26 75.45 17.95 80.97 75.03 -6.11 54.18 -16.40 -8.31 53.39 -15.87 1doo_c04 source 1doo HEAT SHOCK LOCUS U : 2 hits 1doo_c04 naa= 4 ULMN 4 1doo_c05 HEAT SHOCK LOCUS U user 1 4 # 1 B 1 THR A 56 THR^? 7.33 C2 EDO A 125 B 33 LYS A 113 LYS^? 12.75 O2 EDO A 124 B 45 GLY A 76 GLY^? 13.00 O2 EDO A 126 B 124 SER A 34 SER.? -3.56 C2 EDO A 125s coo 26.69 108.13 78.57 25.70 107.69 80.43 17.43 43.07 17.55 19.51 43.25 18.06 coo 30.17 110.91 86.31 27.32 111.03 80.63 13.93 45.27 9.54 19.06 43.44 6.58 coo 31.73 106.00 88.02 31.34 105.46 88.62 11.11 39.60 10.62 10.59 39.98 10.13 coo 24.65 103.43 76.04 24.59 105.78 75.60 20.28 47.66 19.28 22.08 46.10 18.94 ULMN 4 1doo_c05 HEAT SHOCK LOCUS U user 2 4 # 2 B 1 THR B 56 THR^? 10.83 C3 PEG B 126 B 33 LYS B 113 LYS^? 13.71 C2 EDO B 124 B 45 GLY B 76 GLY^? 12.82 C3 PEG B 126 B 124 SER B 34 SER^? 13.24 C2 EDO B 124 coo 26.69 108.13 78.57 25.70 107.69 80.43 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo 30.17 110.91 86.31 27.32 111.03 80.63 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 31.73 106.00 88.02 31.34 105.46 88.62 2.80 43.65 -10.92 3.34 43.82 -10.31 coo 24.65 103.43 76.04 24.59 105.78 75.60 -6.11 54.18 -16.40 -8.31 53.39 -15.87 1doo_c05 source 1doo HEAT SHOCK LOCUS U : 2 hits 1doo_c05 naa= 4 ULMN 4 1doo_c06 HEAT SHOCK LOCUS U user 1 4 # 1 C 1 THR A 56 THR^? 7.33 C2 EDO A 125 C 33 LYS A 113 LYS^? 12.75 O2 EDO A 124 C 45 GLY A 76 GLY^? 13.00 O2 EDO A 126 C 124 SER A 34 SER.? -3.56 C2 EDO A 125s coo -5.30 26.59 199.66 -4.98 26.05 197.57 17.43 43.07 17.55 19.51 43.25 18.06 coo -4.62 30.60 191.94 -3.32 28.83 197.07 13.93 45.27 9.54 19.06 43.44 6.58 coo -9.57 29.11 189.94 -9.84 28.44 189.46 11.11 39.60 10.62 10.59 39.98 10.13 coo -8.31 23.03 202.48 -6.18 24.15 202.80 20.28 47.66 19.28 22.08 46.10 18.94 ULMN 4 1doo_c06 HEAT SHOCK LOCUS U user 2 4 # 2 C 1 THR B 56 THR^? 10.83 C3 PEG B 126 C 33 LYS B 113 LYS^? 13.71 C2 EDO B 124 C 45 GLY B 76 GLY^? 12.82 C3 PEG B 126 C 124 SER B 34 SER^? 13.24 C2 EDO B 124 coo -5.30 26.59 199.66 -4.98 26.05 197.57 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -4.62 30.60 191.94 -3.32 28.83 197.07 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo -9.57 29.11 189.94 -9.84 28.44 189.46 2.80 43.65 -10.92 3.34 43.82 -10.31 coo -8.31 23.03 202.48 -6.18 24.15 202.80 -6.11 54.18 -16.40 -8.31 53.39 -15.87 1doo_c06 source 1doo HEAT SHOCK LOCUS U : 2 hits 1doo_c06 naa= 4 ULMN 4 1doo_c07 HEAT SHOCK LOCUS U user 1 4 # 1 D 1 THR A 56 THR^? 7.33 C2 EDO A 125 D 33 LYS A 113 LYS^? 12.75 O2 EDO A 124 D 45 GLY A 76 GLY^? 13.00 O2 EDO A 126 D 124 SER A 34 SER.? -3.56 C2 EDO A 125s coo 21.09 18.28 199.42 20.72 17.74 197.38 17.43 43.07 17.55 19.51 43.25 18.06 coo 25.54 20.08 191.91 24.21 17.77 197.54 13.93 45.27 9.54 19.06 43.44 6.58 coo 21.95 23.77 189.96 21.30 23.70 189.39 11.11 39.60 10.62 10.59 39.98 10.13 coo 16.26 18.98 201.87 18.32 18.00 202.67 20.28 47.66 19.28 22.08 46.10 18.94 ULMN 4 1doo_c07 HEAT SHOCK LOCUS U user 2 4 # 2 D 1 THR B 56 THR^? 10.83 C3 PEG B 126 D 33 LYS B 113 LYS^? 13.71 C2 EDO B 124 D 45 GLY B 76 GLY^? 12.82 C3 PEG B 126 D 124 SER B 34 SER^? 13.24 C2 EDO B 124 coo 21.09 18.28 199.42 20.72 17.74 197.38 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo 25.54 20.08 191.91 24.21 17.77 197.54 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 21.95 23.77 189.96 21.30 23.70 189.39 2.80 43.65 -10.92 3.34 43.82 -10.31 coo 16.26 18.98 201.87 18.32 18.00 202.67 -6.11 54.18 -16.40 -8.31 53.39 -15.87 1doo_c07 source 1doo HEAT SHOCK LOCUS U : 2 hits 1doo_c07 naa= 4 ULMN 4 1eag_c05 PEPTIDE INHIBITOR user 1 4 # 1 A 32 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 35 SER B 7 SER^? 13.90 OXT ACT A 123 A 84 TYR A 102 TYR^? 8.02 OXT ACT A 123 A 218 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 47.22 22.34 8.57 45.16 22.02 9.13 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 43.58 20.85 5.15 44.62 23.01 5.76 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 40.49 26.39 8.83 42.48 26.82 6.92 2.53 56.58 17.48 2.05 53.90 18.03 coo 44.05 16.99 12.67 44.05 18.89 11.74 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 4 1eag_c05 PEPTIDE INHIBITOR user 2 4 # 2 A 32 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 35 SER A 7 SER.? 11.72 O1 EDO B 123 A 84 TYR B 102 TYR^? 11.19 O2 EDO B 124 A 218 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 47.22 22.34 8.57 45.16 22.02 9.13 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 43.58 20.85 5.15 44.62 23.01 5.76 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 40.49 26.39 8.83 42.48 26.82 6.92 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 44.05 16.99 12.67 44.05 18.89 11.74 20.02 60.63 -18.97 20.31 59.23 -17.40 1eag_c05 source 1eag PEPTIDE INHIBITOR : 2 hits 1eag_c05 naa= 4 ULMN 4 1f6d_c01 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 1 4 # 1 B 95 ASP A 109 ASP^? -4.58 O2 EDO A 126s B 117 GLU A 107 GLU^? -3.18 O1 EDO A 126s B 131 GLU A 77 GLU^? 11.16 O2 EDO A 126 B 213 HIS A 111 HIS^? 11.74 C2 EDO A 125 coo 39.14 56.64 24.68 38.62 56.32 26.77 9.63 38.15 19.81 7.90 38.49 20.93 coo 40.54 62.45 29.38 39.23 60.98 30.16 6.31 45.06 22.90 4.64 44.18 23.93 coo 38.13 52.78 25.48 37.33 50.83 25.51 8.02 38.51 14.00 9.59 37.31 13.17 coo 35.79 48.48 32.46 36.87 50.29 32.45 16.68 40.80 13.52 18.19 42.09 12.84 ULMN 4 1f6d_c01 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 2 4 # 2 B 95 ASP B 109 ASP^? -4.16 O4 PEG B 126s B 117 GLU B 107 GLU^? -3.66 C1 PEG B 126s B 131 GLU B 77 GLU^? 10.85 O4 PEG B 126 B 213 HIS B 111 HIS^? 12.89 C3 PEG B 126 coo 39.14 56.64 24.68 38.62 56.32 26.77 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 40.54 62.45 29.38 39.23 60.98 30.16 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 38.13 52.78 25.48 37.33 50.83 25.51 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 35.79 48.48 32.46 36.87 50.29 32.45 -2.41 45.44 -12.93 -3.29 45.75 -11.05 1f6d_c01 source 1f6d UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE : 2 hits 1f6d_c01 naa= 4 ULMN 4 1fy2_c00 ASPARTYL DIPEPTIDASE user 1 4 # 1 A 120 SER A 57 SER^? 6.85 O2 EDO A 126 A 121 ALA A 33 ALA.? 8.34 O2 EDO A 126 A 157 HIS A 111 HIS^? 11.74 C2 EDO A 125 A 192 GLU A 54 GLU^? 10.26 O1 EDO A 125 coo 8.85 20.26 10.46 6.48 19.62 10.40 15.14 41.83 20.35 16.25 40.17 21.70 coo 7.28 23.73 9.88 5.99 24.23 10.47 17.73 46.03 21.52 16.32 46.64 21.20 coo 6.91 15.88 7.40 6.70 16.82 9.27 16.68 40.80 13.52 18.19 42.09 12.84 coo 8.84 12.00 8.47 7.02 11.60 9.46 19.19 45.91 11.58 20.09 44.01 11.30 1fy2_c00 source 1fy2 ASPARTYL DIPEPTIDASE : 1 hits 1fy2_c00 naa= 4 ULMN 4 1g0d_c00 PROTEIN-GLUTAMINE GAMMA-GLUTAMYLTRANuser 1 4 # 1 A 272 CYH A 71 CYH^? 6.77 OXT ACT A 123 A 332 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 355 ASP A 94 ASP.? 16.52 O ACT A 123 A 515 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 46.10 15.37 7.21 48.39 16.33 5.98 7.28 52.14 8.02 7.72 52.85 10.71 coo 52.08 14.39 6.78 50.88 13.04 7.85 6.89 48.41 3.38 5.73 47.19 2.13 coo 51.01 10.60 12.62 50.82 11.50 10.72 2.85 44.85 7.76 1.66 43.09 7.95 coo 48.55 18.50 0.51 47.48 16.93 2.61 8.28 55.71 -0.18 8.56 53.06 0.60 ULMN 4 1g0d_c00 PROTEIN-GLUTAMINE GAMMA-GLUTAMYLTRANuser 2 4 # 2 A 272 CYH B 71 CYH^? 5.39 O2 EDO B 124 A 332 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 355 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 515 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 46.10 15.37 7.21 48.39 16.33 5.98 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 52.08 14.39 6.78 50.88 13.04 7.85 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 51.01 10.60 12.62 50.82 11.50 10.72 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 48.55 18.50 0.51 47.48 16.93 2.61 5.72 54.72 4.86 5.42 52.52 3.21 1g0d_c00 source 1g0d PROTEIN-GLUTAMINE GAMMA-GLUTAMYLTRANSFERASE : 2 hits 1g0d_c00 naa= 4 ULMN 4 1iec_c02 CAPSID PROTEIN P40: ASSEMBLIN PROTEAuser 1 4 # 1 B 363 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 457 ALA A 40 ALA^? 5.85 C2 EDO A 128 B 465 ARG A 8 ARG.? -3.85 O1 EDO B 123s B 466 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 66.07 12.30 58.15 65.21 10.91 59.48 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 69.52 5.37 56.42 70.10 6.70 55.92 19.00 56.05 1.37 17.90 55.08 0.98 coo 58.20 13.10 62.35 56.97 11.67 59.94 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 59.04 4.50 63.99 59.56 4.71 60.96 16.32 51.23 -8.65 14.73 48.69 -9.52 ULMN 4 1iec_c02 CAPSID PROTEIN P40: ASSEMBLIN PROTEAuser 2 4 # 2 B 363 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 457 ALA B 40 ALA^? 11.12 O1 EDO B 124 B 465 ARG B 8 ARG^? 17.13 OXT ACT A 123 B 466 ARG B 11 ARG^? 15.69 O ACT A 123 coo 66.07 12.30 58.15 65.21 10.91 59.48 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 69.52 5.37 56.42 70.10 6.70 55.92 -5.04 55.86 3.46 -3.88 54.80 3.46 coo 58.20 13.10 62.35 56.97 11.67 59.94 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 59.04 4.50 63.99 59.56 4.71 60.96 -2.30 47.71 11.46 -0.79 44.99 11.29 1iec_c02 source 1iec CAPSID PROTEIN P40: ASSEMBLIN PROTEASE : 2 hits 1iec_c02 naa= 4 ULMN 4 1kim_c01 THYMIDINE KINASE user 1 4 # 1 B 59 GLY A 85 GLY.? 11.94 O1 EDO A 126 B 83 GLU A 107 GLU^? -3.18 O1 EDO A 126s B 163 ARG A 105 ARG^? 7.37 O1 EDO A 126 B 222 ARG A 79 ARG^? -4.30 O1 EDO A 126s coo 12.62 99.24 38.96 12.68 98.60 38.52 -2.98 48.97 24.74 -3.25 49.30 24.08 coo 14.40 90.04 44.78 14.76 92.05 44.57 6.31 45.06 22.90 4.64 44.18 23.93 coo 17.43 90.38 41.69 17.76 92.72 39.75 5.55 48.74 25.05 2.82 47.97 26.30 coo 13.56 96.78 47.94 12.87 95.13 45.44 2.90 41.63 20.04 5.49 40.23 20.98 ULMN 4 1kim_c01 THYMIDINE KINASE user 2 4 # 2 B 59 GLY B 85 GLY^? 6.90 C2 EDO B 123 B 83 GLU B 107 GLU^? -3.66 C1 PEG B 126s B 163 ARG B 105 ARG^? 8.10 C1 PEG B 126 B 222 ARG B 79 ARG^? -4.39 C1 PEG B 126s coo 12.62 99.24 38.96 12.68 98.60 38.52 17.33 56.99 -20.74 17.59 57.10 -19.99 coo 14.40 90.04 44.78 14.76 92.05 44.57 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 17.43 90.38 41.69 17.76 92.72 39.75 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 13.56 96.78 47.94 12.87 95.13 45.44 11.19 48.56 -18.94 8.63 47.63 -20.34 1kim_c01 source 1kim THYMIDINE KINASE : 2 hits 1kim_c01 naa= 4 ULMN 4 1qh9_c01 2-HALOACID DEHALOGENASE user 1 4 # 1 A 10 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 41 ARG A 105 ARG^? 7.37 O1 EDO A 126 A 118 SER B 7 SER^? 13.90 OXT ACT A 123 A 180 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 20.70 13.03 9.13 22.27 11.81 9.81 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 23.00 19.17 17.85 22.49 17.70 15.19 5.55 48.74 25.05 2.82 47.97 26.30 coo 17.70 9.25 13.10 16.68 11.30 13.99 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 26.47 11.43 10.70 25.16 9.82 11.06 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 4 1qh9_c01 2-HALOACID DEHALOGENASE user 2 4 # 2 A 10 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 41 ARG B 105 ARG^? 8.10 C1 PEG B 126 A 118 SER A 7 SER.? 11.72 O1 EDO B 123 A 180 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 20.70 13.03 9.13 22.27 11.81 9.81 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 23.00 19.17 17.85 22.49 17.70 15.19 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 17.70 9.25 13.10 16.68 11.30 13.99 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 26.47 11.43 10.70 25.16 9.82 11.06 20.02 60.63 -18.97 20.31 59.23 -17.40 1qh9_c01 source 1qh9 2-HALOACID DEHALOGENASE : 2 hits 1qh9_c01 naa= 4 ULMN 4 1qq5_c02 L-2-HALOACID DEHALOGENASE user 1 4 # 1 A 8 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 39 ARG A 105 ARG^? 7.37 O1 EDO A 126 A 114 SER B 7 SER^? 13.90 OXT ACT A 123 A 176 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 11.74 10.89 36.46 11.22 9.07 35.52 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 9.95 2.30 29.39 10.16 4.06 31.89 5.55 48.74 25.05 2.82 47.97 26.30 coo 14.04 6.15 40.29 15.11 4.90 38.49 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 6.71 9.84 37.08 8.21 10.00 38.54 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 4 1qq5_c02 L-2-HALOACID DEHALOGENASE user 2 4 # 2 A 8 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 39 ARG B 105 ARG^? 8.10 C1 PEG B 126 A 114 SER A 7 SER.? 11.72 O1 EDO B 123 A 176 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 11.74 10.89 36.46 11.22 9.07 35.52 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 9.95 2.30 29.39 10.16 4.06 31.89 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 14.04 6.15 40.29 15.11 4.90 38.49 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 6.71 9.84 37.08 8.21 10.00 38.54 20.02 60.63 -18.97 20.31 59.23 -17.40 1qq5_c02 source 1qq5 L-2-HALOACID DEHALOGENASE : 2 hits 1qq5_c02 naa= 4 ULMN 4 1qq5_c03 L-2-HALOACID DEHALOGENASE user 1 4 # 1 B 8 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 39 ARG A 105 ARG^? 7.37 O1 EDO A 126 B 114 SER B 7 SER^? 13.90 OXT ACT A 123 B 176 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo -12.56 -11.18 35.50 -11.97 -9.35 34.62 -1.93 52.21 20.42 -1.91 52.01 18.28 coo -10.21 -2.50 28.59 -10.64 -4.26 31.07 5.55 48.74 25.05 2.82 47.97 26.30 coo -15.18 -6.47 39.05 -16.09 -5.31 37.09 -2.26 57.69 19.56 -2.09 59.00 21.60 coo -7.57 -10.16 36.43 -9.20 -10.33 37.73 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 4 1qq5_c03 L-2-HALOACID DEHALOGENASE user 2 4 # 2 B 8 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 39 ARG B 105 ARG^? 8.10 C1 PEG B 126 B 114 SER A 7 SER.? 11.72 O1 EDO B 123 B 176 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo -12.56 -11.18 35.50 -11.97 -9.35 34.62 16.23 58.63 -15.55 16.12 57.73 -13.62 coo -10.21 -2.50 28.59 -10.64 -4.26 31.07 8.93 56.93 -21.13 11.75 56.76 -22.27 coo -15.18 -6.47 39.05 -16.09 -5.31 37.09 16.55 63.58 -12.78 16.44 65.52 -14.23 coo -7.57 -10.16 36.43 -9.20 -10.33 37.73 20.02 60.63 -18.97 20.31 59.23 -17.40 1qq5_c03 source 1qq5 L-2-HALOACID DEHALOGENASE : 2 hits 1qq5_c03 naa= 4 ULMN 4 3eca_c04 ASPARAGINASE TYPE II user 1 4 # 1 A 283 GLU A 69 GLU^? 4.98 OXT ACT A 123 C 12 THR A 64 THR.? 6.35 OXT ACT A 123 C 25 TYR A 67 TYR^? -4.09 C2 EDO A 127s C 89 THR A 103 THR^? 10.25 OXT ACT A 123 coo 60.56 18.92 0.90 61.14 20.52 2.16 8.76 56.68 10.43 10.20 56.07 11.84 coo 55.95 25.18 2.21 55.69 23.16 3.11 7.24 60.99 16.88 6.03 59.56 15.82 coo 55.67 19.31 -0.41 56.70 20.51 1.90 9.19 62.70 13.11 10.16 60.66 14.79 coo 59.81 26.53 8.25 58.00 25.30 8.32 3.98 57.48 21.66 3.28 59.10 22.89 ULMN 4 3eca_c04 ASPARAGINASE TYPE II user 2 4 # 2 A 283 GLU A 100 GLU^? 12.02 O1 EDO A 127 C 12 THR A 64 THR.? 6.35 OXT ACT A 123 C 25 TYR A 67 TYR^? -4.09 C2 EDO A 127s C 89 THR A 103 THR^? 10.25 OXT ACT A 123 coo 60.56 18.92 0.90 61.14 20.52 2.16 3.40 65.53 14.62 2.89 66.21 16.58 coo 55.95 25.18 2.21 55.69 23.16 3.11 7.24 60.99 16.88 6.03 59.56 15.82 coo 55.67 19.31 -0.41 56.70 20.51 1.90 9.19 62.70 13.11 10.16 60.66 14.79 coo 59.81 26.53 8.25 58.00 25.30 8.32 3.98 57.48 21.66 3.28 59.10 22.89 ULMN 4 3eca_c04 ASPARAGINASE TYPE II user 3 4 # 3 A 283 GLU B 69 GLU^? -2.92 O2 EDO B 124s C 12 THR B 64 THR^? 7.68 C1 EDO B 125 C 25 TYR B 67 TYR^? -3.57 C1 EDO B 125s C 89 THR B 103 THR^? 13.94 C1 EDO B 125 coo 60.56 18.92 0.90 61.14 20.52 2.16 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 55.95 25.18 2.21 55.69 23.16 3.11 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 55.67 19.31 -0.41 56.70 20.51 1.90 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 59.81 26.53 8.25 58.00 25.30 8.32 10.26 64.09 -15.02 10.94 66.08 -15.56 ULMN 4 3eca_c04 ASPARAGINASE TYPE II user 4 4 # 4 A 283 GLU B 100 GLU^? 11.75 C1 EDO B 125 C 12 THR B 64 THR^? 7.68 C1 EDO B 125 C 25 TYR B 67 TYR^? -3.57 C1 EDO B 125s C 89 THR B 103 THR^? 13.94 C1 EDO B 125 coo 60.56 18.92 0.90 61.14 20.52 2.16 10.53 69.09 -5.55 11.13 70.44 -7.09 coo 55.95 25.18 2.21 55.69 23.16 3.11 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 55.67 19.31 -0.41 56.70 20.51 1.90 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 59.81 26.53 8.25 58.00 25.30 8.32 10.26 64.09 -15.02 10.94 66.08 -15.56 3eca_c04 source 3eca ASPARAGINASE TYPE II : 4 hits 3eca_c04 naa= 4 ULMN 4 3eca_c05 ASPARAGINASE TYPE II user 1 4 # 1 B 283 GLU A 69 GLU^? 4.98 OXT ACT A 123 D 12 THR A 64 THR.? 6.35 OXT ACT A 123 D 25 TYR A 67 TYR^? -4.09 C2 EDO A 127s D 89 THR A 103 THR^? 10.25 OXT ACT A 123 coo 30.23 27.31 19.48 30.08 25.34 19.98 8.76 56.68 10.43 10.20 56.07 11.84 coo 32.19 21.46 15.06 33.45 23.05 16.00 7.24 60.99 16.88 6.03 59.56 15.82 coo 31.17 27.34 14.84 32.70 26.15 16.86 9.19 62.70 13.11 10.16 60.66 14.79 coo 35.78 18.11 20.94 36.76 19.54 19.61 3.98 57.48 21.66 3.28 59.10 22.89 ULMN 4 3eca_c05 ASPARAGINASE TYPE II user 2 4 # 2 B 283 GLU A 100 GLU^? 12.02 O1 EDO A 127 D 12 THR A 64 THR.? 6.35 OXT ACT A 123 D 25 TYR A 67 TYR^? -4.09 C2 EDO A 127s D 89 THR A 103 THR^? 10.25 OXT ACT A 123 coo 30.23 27.31 19.48 30.08 25.34 19.98 3.40 65.53 14.62 2.89 66.21 16.58 coo 32.19 21.46 15.06 33.45 23.05 16.00 7.24 60.99 16.88 6.03 59.56 15.82 coo 31.17 27.34 14.84 32.70 26.15 16.86 9.19 62.70 13.11 10.16 60.66 14.79 coo 35.78 18.11 20.94 36.76 19.54 19.61 3.98 57.48 21.66 3.28 59.10 22.89 ULMN 4 3eca_c05 ASPARAGINASE TYPE II user 3 4 # 3 B 283 GLU B 69 GLU^? -2.92 O2 EDO B 124s D 12 THR B 64 THR^? 7.68 C1 EDO B 125 D 25 TYR B 67 TYR^? -3.57 C1 EDO B 125s D 89 THR B 103 THR^? 13.94 C1 EDO B 125 coo 30.23 27.31 19.48 30.08 25.34 19.98 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 32.19 21.46 15.06 33.45 23.05 16.00 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 31.17 27.34 14.84 32.70 26.15 16.86 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 35.78 18.11 20.94 36.76 19.54 19.61 10.26 64.09 -15.02 10.94 66.08 -15.56 ULMN 4 3eca_c05 ASPARAGINASE TYPE II user 4 4 # 4 B 283 GLU B 100 GLU^? 11.75 C1 EDO B 125 D 12 THR B 64 THR^? 7.68 C1 EDO B 125 D 25 TYR B 67 TYR^? -3.57 C1 EDO B 125s D 89 THR B 103 THR^? 13.94 C1 EDO B 125 coo 30.23 27.31 19.48 30.08 25.34 19.98 10.53 69.09 -5.55 11.13 70.44 -7.09 coo 32.19 21.46 15.06 33.45 23.05 16.00 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 31.17 27.34 14.84 32.70 26.15 16.86 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 35.78 18.11 20.94 36.76 19.54 19.61 10.26 64.09 -15.02 10.94 66.08 -15.56 3eca_c05 source 3eca ASPARAGINASE TYPE II : 4 hits 3eca_c05 naa= 4 ULMN 4 3eca_c06 ASPARAGINASE TYPE II user 1 4 # 1 A 12 THR A 64 THR.? 6.35 OXT ACT A 123 A 25 TYR A 67 TYR^? -4.09 C2 EDO A 127s A 89 THR A 103 THR^? 10.25 OXT ACT A 123 C 283 GLU A 69 GLU^? 4.98 OXT ACT A 123 coo 76.53 15.20 38.92 75.75 17.07 38.27 7.24 60.99 16.88 6.03 59.56 15.82 coo 78.55 20.90 39.91 77.09 20.09 37.68 9.19 62.70 13.11 10.16 60.66 14.79 coo 72.66 13.38 32.85 71.79 14.81 34.24 3.98 57.48 21.66 3.28 59.10 22.89 coo 79.85 20.73 35.44 79.36 18.97 34.45 8.76 56.68 10.43 10.20 56.07 11.84 ULMN 4 3eca_c06 ASPARAGINASE TYPE II user 2 4 # 2 A 12 THR A 64 THR.? 6.35 OXT ACT A 123 A 25 TYR A 67 TYR^? -4.09 C2 EDO A 127s A 89 THR A 103 THR^? 10.25 OXT ACT A 123 C 283 GLU A 100 GLU^? 12.02 O1 EDO A 127 coo 76.53 15.20 38.92 75.75 17.07 38.27 7.24 60.99 16.88 6.03 59.56 15.82 coo 78.55 20.90 39.91 77.09 20.09 37.68 9.19 62.70 13.11 10.16 60.66 14.79 coo 72.66 13.38 32.85 71.79 14.81 34.24 3.98 57.48 21.66 3.28 59.10 22.89 coo 79.85 20.73 35.44 79.36 18.97 34.45 3.40 65.53 14.62 2.89 66.21 16.58 ULMN 4 3eca_c06 ASPARAGINASE TYPE II user 3 4 # 3 A 12 THR B 64 THR^? 7.68 C1 EDO B 125 A 25 TYR B 67 TYR^? -3.57 C1 EDO B 125s A 89 THR B 103 THR^? 13.94 C1 EDO B 125 C 283 GLU B 69 GLU^? -2.92 O2 EDO B 124s coo 76.53 15.20 38.92 75.75 17.07 38.27 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 78.55 20.90 39.91 77.09 20.09 37.68 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 72.66 13.38 32.85 71.79 14.81 34.24 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 79.85 20.73 35.44 79.36 18.97 34.45 5.26 59.46 -4.72 3.83 59.41 -6.26 ULMN 4 3eca_c06 ASPARAGINASE TYPE II user 4 4 # 4 A 12 THR B 64 THR^? 7.68 C1 EDO B 125 A 25 TYR B 67 TYR^? -3.57 C1 EDO B 125s A 89 THR B 103 THR^? 13.94 C1 EDO B 125 C 283 GLU B 100 GLU^? 11.75 C1 EDO B 125 coo 76.53 15.20 38.92 75.75 17.07 38.27 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 78.55 20.90 39.91 77.09 20.09 37.68 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 72.66 13.38 32.85 71.79 14.81 34.24 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 79.85 20.73 35.44 79.36 18.97 34.45 10.53 69.09 -5.55 11.13 70.44 -7.09 3eca_c06 source 3eca ASPARAGINASE TYPE II : 4 hits 3eca_c06 naa= 4 ULMN 4 3eca_c07 ASPARAGINASE TYPE II user 1 4 # 1 B 12 THR A 64 THR.? 6.35 OXT ACT A 123 B 25 TYR A 67 TYR^? -4.09 C2 EDO A 127s B 89 THR A 103 THR^? 10.25 OXT ACT A 123 D 283 GLU A 69 GLU^? 4.98 OXT ACT A 123 coo 53.77 21.59 52.52 53.72 19.81 51.24 7.24 60.99 16.88 6.03 59.56 15.82 coo 52.81 15.60 53.32 51.72 16.94 51.12 9.19 62.70 13.11 10.16 60.66 14.79 coo 50.67 24.88 46.55 52.16 23.30 46.40 3.98 57.48 21.66 3.28 59.10 22.89 coo 48.21 16.39 52.49 47.84 18.39 51.92 8.76 56.68 10.43 10.20 56.07 11.84 ULMN 4 3eca_c07 ASPARAGINASE TYPE II user 2 4 # 2 B 12 THR A 64 THR.? 6.35 OXT ACT A 123 B 25 TYR A 67 TYR^? -4.09 C2 EDO A 127s B 89 THR A 103 THR^? 10.25 OXT ACT A 123 D 283 GLU A 100 GLU^? 12.02 O1 EDO A 127 coo 53.77 21.59 52.52 53.72 19.81 51.24 7.24 60.99 16.88 6.03 59.56 15.82 coo 52.81 15.60 53.32 51.72 16.94 51.12 9.19 62.70 13.11 10.16 60.66 14.79 coo 50.67 24.88 46.55 52.16 23.30 46.40 3.98 57.48 21.66 3.28 59.10 22.89 coo 48.21 16.39 52.49 47.84 18.39 51.92 3.40 65.53 14.62 2.89 66.21 16.58 ULMN 4 3eca_c07 ASPARAGINASE TYPE II user 3 4 # 3 B 12 THR B 64 THR^? 7.68 C1 EDO B 125 B 25 TYR B 67 TYR^? -3.57 C1 EDO B 125s B 89 THR B 103 THR^? 13.94 C1 EDO B 125 D 283 GLU B 69 GLU^? -2.92 O2 EDO B 124s coo 53.77 21.59 52.52 53.72 19.81 51.24 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 52.81 15.60 53.32 51.72 16.94 51.12 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 50.67 24.88 46.55 52.16 23.30 46.40 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 48.21 16.39 52.49 47.84 18.39 51.92 5.26 59.46 -4.72 3.83 59.41 -6.26 ULMN 4 3eca_c07 ASPARAGINASE TYPE II user 4 4 # 4 B 12 THR B 64 THR^? 7.68 C1 EDO B 125 B 25 TYR B 67 TYR^? -3.57 C1 EDO B 125s B 89 THR B 103 THR^? 13.94 C1 EDO B 125 D 283 GLU B 100 GLU^? 11.75 C1 EDO B 125 coo 53.77 21.59 52.52 53.72 19.81 51.24 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 52.81 15.60 53.32 51.72 16.94 51.12 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 50.67 24.88 46.55 52.16 23.30 46.40 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 48.21 16.39 52.49 47.84 18.39 51.92 10.53 69.09 -5.55 11.13 70.44 -7.09 3eca_c07 source 3eca ASPARAGINASE TYPE II : 4 hits 3eca_c07 naa= 4 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 1 3 # 1 A 46 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 100 ARG A 105 ARG^? 7.37 O1 EDO A 126 A 116 GLN A 61 GLN^? 9.36 CH3 ACT A 123 coo 32.24 20.09 5.34 30.38 19.04 5.27 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 26.40 25.34 6.28 26.15 22.33 7.25 5.55 48.74 25.05 2.82 47.97 26.30 coo 26.74 21.94 13.78 27.57 20.97 12.08 7.22 54.92 24.39 6.58 56.14 26.02 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 2 3 # 2 A 46 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 100 ARG B 105 ARG^? 8.10 C1 PEG B 126 A 116 GLN B 61 GLN^? 13.56 C2 PEG B 126 coo 32.24 20.09 5.34 30.38 19.04 5.27 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 26.40 25.34 6.28 26.15 22.33 7.25 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 26.74 21.94 13.78 27.57 20.97 12.08 7.29 62.74 -18.68 8.17 64.12 -20.04 12as_c00 source 12as ASPARAGINE SYNTHETASE : 2 hits 12as_c00 naa= 3 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 1 3 # 1 B 46 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 100 ARG A 105 ARG^? 7.37 O1 EDO A 126 B 116 GLN A 61 GLN^? 9.36 CH3 ACT A 123 coo 32.18 48.37 12.48 33.96 49.46 12.97 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 39.04 43.25 11.37 38.30 45.35 13.56 5.55 48.74 25.05 2.82 47.97 26.30 coo 37.43 42.63 19.41 36.76 44.08 17.97 7.22 54.92 24.39 6.58 56.14 26.02 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 2 3 # 2 B 46 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 100 ARG B 105 ARG^? 8.10 C1 PEG B 126 B 116 GLN B 61 GLN^? 13.56 C2 PEG B 126 coo 32.18 48.37 12.48 33.96 49.46 12.97 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 39.04 43.25 11.37 38.30 45.35 13.56 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 37.43 42.63 19.41 36.76 44.08 17.97 7.29 62.74 -18.68 8.17 64.12 -20.04 12as_c01 source 12as ASPARAGINE SYNTHETASE : 2 hits 12as_c01 naa= 3 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 140 TYR A 70 TYR^? 13.06 C1 EDO B 124 B 190 LYS A 114 LYS^? 4.03 O ACT A 123 B 222 ASP A 94 ASP.? 16.52 O ACT A 123 coo 7.17 16.59 41.26 8.01 19.20 40.73 5.72 54.72 4.86 5.42 52.52 3.21 coo 13.38 20.00 35.06 11.43 22.49 39.53 11.95 48.07 7.92 11.03 52.28 12.68 coo 9.76 26.58 38.10 11.63 25.78 38.76 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 140 TYR B 70 TYR^? 11.25 O2 EDO B 124 B 190 LYS B 114 LYS^? -2.62 O2 EDO B 124s B 222 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 7.17 16.59 41.26 8.01 19.20 40.73 8.28 55.71 -0.18 8.56 53.06 0.60 coo 13.38 20.00 35.06 11.43 22.49 39.53 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 9.76 26.58 38.10 11.63 25.78 38.76 11.18 47.39 -6.30 12.32 45.78 -7.12 1a05_c00 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 2 hits 1a05_c00 naa= 3 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 190 LYS A 114 LYS^? 4.03 O ACT A 123 A 222 ASP A 94 ASP.? 16.52 O ACT A 123 B 140 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo -4.61 20.12 30.34 -2.74 22.65 25.95 11.95 48.07 7.92 11.03 52.28 12.68 coo -1.04 26.60 27.37 -2.94 25.93 26.69 2.85 44.85 7.76 1.66 43.09 7.95 coo 1.51 16.60 24.17 0.82 19.23 24.79 5.72 54.72 4.86 5.42 52.52 3.21 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 190 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 222 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 140 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo -4.61 20.12 30.34 -2.74 22.65 25.95 1.96 50.52 -5.38 3.03 56.08 -8.37 coo -1.04 26.60 27.37 -2.94 25.93 26.69 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 1.51 16.60 24.17 0.82 19.23 24.79 8.28 55.71 -0.18 8.56 53.06 0.60 1a05_c01 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 2 hits 1a05_c01 naa= 3 ULMN 3 1a0j_c12 TRYPSIN user 1 3 # 1 A 57 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 102 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 193 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo 25.57 41.22 61.68 24.18 39.98 62.50 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 22.33 45.48 59.73 23.35 43.67 60.06 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 22.57 32.23 64.13 21.98 32.82 64.22 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 1a0j_c12 TRYPSIN user 2 3 # 2 A 57 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 102 ASP A 94 ASP.? 16.52 O ACT A 123 A 193 GLY B 93 GLY^? 13.55 O1 EDO A 124 coo 25.57 41.22 61.68 24.18 39.98 62.50 6.89 48.41 3.38 5.73 47.19 2.13 coo 22.33 45.48 59.73 23.35 43.67 60.06 2.85 44.85 7.76 1.66 43.09 7.95 coo 22.57 32.23 64.13 21.98 32.82 64.22 8.78 44.49 -3.21 8.81 45.00 -3.81 ULMN 3 1a0j_c12 TRYPSIN user 3 3 # 3 A 57 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 102 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 193 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo 25.57 41.22 61.68 24.18 39.98 62.50 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 22.33 45.48 59.73 23.35 43.67 60.06 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 22.57 32.23 64.13 21.98 32.82 64.22 0.61 67.88 8.18 -0.15 67.82 7.90 ULMN 3 1a0j_c12 TRYPSIN user 4 3 # 4 A 57 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 102 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 193 GLY A 93 GLY.? 17.43 O ACT A 123 coo 25.57 41.22 61.68 24.18 39.98 62.50 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 22.33 45.48 59.73 23.35 43.67 60.06 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 22.57 32.23 64.13 21.98 32.82 64.22 5.07 43.20 3.81 5.07 43.46 4.54 1a0j_c12 source 1a0j TRYPSIN : 4 hits 1a0j_c12 naa= 3 ULMN 3 1a0j_c13 TRYPSIN user 1 3 # 1 B 57 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 102 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 193 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo 44.08 45.58 52.81 45.86 46.55 52.85 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 43.04 44.75 47.18 43.31 45.51 49.13 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 50.46 51.91 56.90 50.65 51.62 56.14 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 1a0j_c13 TRYPSIN user 2 3 # 2 B 57 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 102 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 193 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo 44.08 45.58 52.81 45.86 46.55 52.85 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 43.04 44.75 47.18 43.31 45.51 49.13 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 50.46 51.91 56.90 50.65 51.62 56.14 0.61 67.88 8.18 -0.15 67.82 7.90 ULMN 3 1a0j_c13 TRYPSIN user 3 3 # 3 B 57 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 102 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 193 GLY A 93 GLY.? 17.43 O ACT A 123 coo 44.08 45.58 52.81 45.86 46.55 52.85 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 43.04 44.75 47.18 43.31 45.51 49.13 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 50.46 51.91 56.90 50.65 51.62 56.14 5.07 43.20 3.81 5.07 43.46 4.54 1a0j_c13 source 1a0j TRYPSIN : 3 hits 1a0j_c13 naa= 3 ULMN 3 1a0j_c14 TRYPSIN user 1 3 # 1 C 57 HIS A 4 HIS.? 6.54 O1 EDO A 128 C 102 ASP A 5 ASP.? 11.32 O1 EDO B 123 C 193 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo 34.37 41.18 73.21 34.04 43.09 73.87 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 34.89 38.34 78.12 35.11 39.59 76.42 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 35.43 51.03 72.12 35.20 50.72 72.87 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 1a0j_c14 TRYPSIN user 2 3 # 2 C 57 HIS B 4 HIS^? 16.30 OXT ACT A 123 C 102 ASP B 5 ASP^? 17.31 OXT ACT A 123 C 193 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo 34.37 41.18 73.21 34.04 43.09 73.87 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 34.89 38.34 78.12 35.11 39.59 76.42 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 35.43 51.03 72.12 35.20 50.72 72.87 0.61 67.88 8.18 -0.15 67.82 7.90 1a0j_c14 source 1a0j TRYPSIN : 2 hits 1a0j_c14 naa= 3 ULMN 3 1a0j_c15 TRYPSIN user 1 3 # 1 D 57 HIS A 4 HIS.? 6.54 O1 EDO A 128 D 102 ASP A 5 ASP.? 11.32 O1 EDO B 123 D 193 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo 8.19 15.01 95.72 7.78 16.53 97.01 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 13.53 16.28 93.98 11.45 16.21 94.40 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 1.80 21.25 100.04 2.61 21.42 100.18 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 1a0j_c15 TRYPSIN user 2 3 # 2 D 57 HIS B 4 HIS^? 16.30 OXT ACT A 123 D 102 ASP B 5 ASP^? 17.31 OXT ACT A 123 D 193 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo 8.19 15.01 95.72 7.78 16.53 97.01 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 13.53 16.28 93.98 11.45 16.21 94.40 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 1.80 21.25 100.04 2.61 21.42 100.18 0.61 67.88 8.18 -0.15 67.82 7.90 ULMN 3 1a0j_c15 TRYPSIN user 3 3 # 3 D 57 HIS B 72 HIS^? 13.54 O1 EDO A 124 D 102 ASP B 94 ASP^? 10.22 O1 EDO A 124 D 193 GLY A 93 GLY.? 17.43 O ACT A 123 coo 8.19 15.01 95.72 7.78 16.53 97.01 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 13.53 16.28 93.98 11.45 16.21 94.40 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 1.80 21.25 100.04 2.61 21.42 100.18 5.07 43.20 3.81 5.07 43.46 4.54 1a0j_c15 source 1a0j TRYPSIN : 3 hits 1a0j_c15 naa= 3 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 # 1 A 49 GLU A 49 GLU^? 5.11 O2 EDO A 127 A 60 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 175 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo 46.10 28.27 19.27 45.48 26.99 20.84 16.74 60.19 6.60 17.85 60.24 8.39 coo 56.42 28.06 12.93 55.01 27.92 14.50 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 45.02 22.04 15.38 46.16 24.00 13.76 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 2 3 # 2 A 49 GLU A 69 GLU^? 4.98 OXT ACT A 123 A 60 ASP A 94 ASP.? 16.52 O ACT A 123 A 175 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo 46.10 28.27 19.27 45.48 26.99 20.84 8.76 56.68 10.43 10.20 56.07 11.84 coo 56.42 28.06 12.93 55.01 27.92 14.50 2.85 44.85 7.76 1.66 43.09 7.95 coo 45.02 22.04 15.38 46.16 24.00 13.76 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 3 3 # 3 A 49 GLU B 49 GLU^? -4.87 O2 EDO B 125s A 60 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 175 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo 46.10 28.27 19.27 45.48 26.99 20.84 -2.74 61.61 0.34 -3.60 61.93 -1.53 coo 56.42 28.06 12.93 55.01 27.92 14.50 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 45.02 22.04 15.38 46.16 24.00 13.76 0.65 57.23 -3.12 -1.98 58.01 -2.52 1a50_c03 source 1a50 TRYPTOPHAN SYNTHASE : 3 hits 1a50_c03 naa= 3 ULMN 3 1a79_c00 TRNA ENDONUCLEASE user 1 3 # 1 A 115 TYR A 70 TYR^? 13.06 C1 EDO B 124 A 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 156 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 37.11 -19.03 58.81 39.12 -18.07 60.48 5.72 54.72 4.86 5.42 52.52 3.21 coo 44.53 -22.25 60.75 45.90 -22.66 62.28 6.89 48.41 3.38 5.73 47.19 2.13 coo 46.42 -20.06 51.80 44.79 -19.05 56.86 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1a79_c00 TRNA ENDONUCLEASE user 2 3 # 2 A 115 TYR A 70 TYR^? 13.06 C1 EDO B 124 A 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 156 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 37.11 -19.03 58.81 39.12 -18.07 60.48 5.72 54.72 4.86 5.42 52.52 3.21 coo 44.53 -22.25 60.75 45.90 -22.66 62.28 6.89 48.41 3.38 5.73 47.19 2.13 coo 46.42 -20.06 51.80 44.79 -19.05 56.86 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1a79_c00 TRNA ENDONUCLEASE user 3 3 # 3 A 115 TYR B 70 TYR^? 11.25 O2 EDO B 124 A 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 156 LYS A 114 LYS^? 4.03 O ACT A 123 coo 37.11 -19.03 58.81 39.12 -18.07 60.48 8.28 55.71 -0.18 8.56 53.06 0.60 coo 44.53 -22.25 60.75 45.90 -22.66 62.28 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 46.42 -20.06 51.80 44.79 -19.05 56.86 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1a79_c00 TRNA ENDONUCLEASE user 4 3 # 4 A 115 TYR B 70 TYR^? 11.25 O2 EDO B 124 A 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 156 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 37.11 -19.03 58.81 39.12 -18.07 60.48 8.28 55.71 -0.18 8.56 53.06 0.60 coo 44.53 -22.25 60.75 45.90 -22.66 62.28 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 46.42 -20.06 51.80 44.79 -19.05 56.86 0.03 48.55 -7.94 -5.29 45.92 -6.26 1a79_c00 source 1a79 TRNA ENDONUCLEASE : 4 hits 1a79_c00 naa= 3 ULMN 3 1a79_c01 TRNA ENDONUCLEASE user 1 3 # 1 B 115 TYR A 70 TYR^? 13.06 C1 EDO B 124 B 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 156 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 52.78 -23.08 19.46 51.79 -21.72 17.22 5.72 54.72 4.86 5.42 52.52 3.21 coo 45.10 -24.12 17.42 43.96 -24.36 15.67 6.89 48.41 3.38 5.73 47.19 2.13 coo 43.97 -19.59 26.02 45.10 -20.27 21.16 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1a79_c01 TRNA ENDONUCLEASE user 2 3 # 2 B 115 TYR A 70 TYR^? 13.06 C1 EDO B 124 B 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 156 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 52.78 -23.08 19.46 51.79 -21.72 17.22 5.72 54.72 4.86 5.42 52.52 3.21 coo 45.10 -24.12 17.42 43.96 -24.36 15.67 6.89 48.41 3.38 5.73 47.19 2.13 coo 43.97 -19.59 26.02 45.10 -20.27 21.16 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1a79_c01 TRNA ENDONUCLEASE user 3 3 # 3 B 115 TYR A 70 TYR^? 13.06 C1 EDO B 124 B 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 156 LYS A 114 LYS^? 4.03 O ACT A 123 coo 52.78 -23.08 19.46 51.79 -21.72 17.22 5.72 54.72 4.86 5.42 52.52 3.21 coo 45.10 -24.12 17.42 43.96 -24.36 15.67 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 43.97 -19.59 26.02 45.10 -20.27 21.16 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1a79_c01 TRNA ENDONUCLEASE user 4 3 # 4 B 115 TYR B 70 TYR^? 11.25 O2 EDO B 124 B 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 156 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 52.78 -23.08 19.46 51.79 -21.72 17.22 8.28 55.71 -0.18 8.56 53.06 0.60 coo 45.10 -24.12 17.42 43.96 -24.36 15.67 6.89 48.41 3.38 5.73 47.19 2.13 coo 43.97 -19.59 26.02 45.10 -20.27 21.16 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1a79_c01 TRNA ENDONUCLEASE user 5 3 # 5 B 115 TYR B 70 TYR^? 11.25 O2 EDO B 124 B 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 156 LYS A 114 LYS^? 4.03 O ACT A 123 coo 52.78 -23.08 19.46 51.79 -21.72 17.22 8.28 55.71 -0.18 8.56 53.06 0.60 coo 45.10 -24.12 17.42 43.96 -24.36 15.67 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 43.97 -19.59 26.02 45.10 -20.27 21.16 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1a79_c01 TRNA ENDONUCLEASE user 6 3 # 6 B 115 TYR B 70 TYR^? 11.25 O2 EDO B 124 B 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 156 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 52.78 -23.08 19.46 51.79 -21.72 17.22 8.28 55.71 -0.18 8.56 53.06 0.60 coo 45.10 -24.12 17.42 43.96 -24.36 15.67 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 43.97 -19.59 26.02 45.10 -20.27 21.16 0.03 48.55 -7.94 -5.29 45.92 -6.26 1a79_c01 source 1a79 TRNA ENDONUCLEASE : 6 hits 1a79_c01 naa= 3 ULMN 3 1a79_c02 TRNA ENDONUCLEASE user 1 3 # 1 C 115 TYR A 70 TYR^? 13.06 C1 EDO B 124 C 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 C 156 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 72.53 -8.86 48.33 70.89 -10.65 46.92 5.72 54.72 4.86 5.42 52.52 3.21 coo 69.12 -16.18 50.82 68.25 -17.99 50.22 6.89 48.41 3.38 5.73 47.19 2.13 coo 64.47 -11.13 56.60 66.23 -12.62 51.81 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1a79_c02 TRNA ENDONUCLEASE user 2 3 # 2 C 115 TYR A 70 TYR^? 13.06 C1 EDO B 124 C 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 C 156 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 72.53 -8.86 48.33 70.89 -10.65 46.92 5.72 54.72 4.86 5.42 52.52 3.21 coo 69.12 -16.18 50.82 68.25 -17.99 50.22 6.89 48.41 3.38 5.73 47.19 2.13 coo 64.47 -11.13 56.60 66.23 -12.62 51.81 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1a79_c02 TRNA ENDONUCLEASE user 3 3 # 3 C 115 TYR A 116 TYR^? 6.05 O2 EDO A 127 C 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 C 156 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 72.53 -8.86 48.33 70.89 -10.65 46.92 13.42 55.06 8.10 16.05 56.03 7.83 coo 69.12 -16.18 50.82 68.25 -17.99 50.22 6.89 48.41 3.38 5.73 47.19 2.13 coo 64.47 -11.13 56.60 66.23 -12.62 51.81 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1a79_c02 TRNA ENDONUCLEASE user 4 3 # 4 C 115 TYR B 70 TYR^? 11.25 O2 EDO B 124 C 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 C 156 LYS A 114 LYS^? 4.03 O ACT A 123 coo 72.53 -8.86 48.33 70.89 -10.65 46.92 8.28 55.71 -0.18 8.56 53.06 0.60 coo 69.12 -16.18 50.82 68.25 -17.99 50.22 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 64.47 -11.13 56.60 66.23 -12.62 51.81 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1a79_c02 TRNA ENDONUCLEASE user 5 3 # 5 C 115 TYR B 70 TYR^? 11.25 O2 EDO B 124 C 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 C 156 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 72.53 -8.86 48.33 70.89 -10.65 46.92 8.28 55.71 -0.18 8.56 53.06 0.60 coo 69.12 -16.18 50.82 68.25 -17.99 50.22 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 64.47 -11.13 56.60 66.23 -12.62 51.81 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1a79_c02 TRNA ENDONUCLEASE user 6 3 # 6 C 115 TYR B 116 TYR^? 3.94 O1 EDO B 124 C 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 C 156 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 72.53 -8.86 48.33 70.89 -10.65 46.92 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo 69.12 -16.18 50.82 68.25 -17.99 50.22 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 64.47 -11.13 56.60 66.23 -12.62 51.81 0.03 48.55 -7.94 -5.29 45.92 -6.26 1a79_c02 source 1a79 TRNA ENDONUCLEASE : 6 hits 1a79_c02 naa= 3 ULMN 3 1a79_c03 TRNA ENDONUCLEASE user 1 3 # 1 D 115 TYR A 70 TYR^? 13.06 C1 EDO B 124 D 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 D 156 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 54.10 1.42 85.16 54.14 4.17 85.62 5.72 54.72 4.86 5.42 52.52 3.21 coo 61.27 5.43 85.32 62.73 6.38 86.49 6.89 48.41 3.38 5.73 47.19 2.13 coo 60.28 4.62 76.00 58.35 6.41 80.65 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1a79_c03 TRNA ENDONUCLEASE user 2 3 # 2 D 115 TYR A 70 TYR^? 13.06 C1 EDO B 124 D 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 D 156 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 54.10 1.42 85.16 54.14 4.17 85.62 5.72 54.72 4.86 5.42 52.52 3.21 coo 61.27 5.43 85.32 62.73 6.38 86.49 6.89 48.41 3.38 5.73 47.19 2.13 coo 60.28 4.62 76.00 58.35 6.41 80.65 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1a79_c03 TRNA ENDONUCLEASE user 3 3 # 3 D 115 TYR A 70 TYR^? 13.06 C1 EDO B 124 D 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 D 156 LYS A 114 LYS^? 4.03 O ACT A 123 coo 54.10 1.42 85.16 54.14 4.17 85.62 5.72 54.72 4.86 5.42 52.52 3.21 coo 61.27 5.43 85.32 62.73 6.38 86.49 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 60.28 4.62 76.00 58.35 6.41 80.65 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1a79_c03 TRNA ENDONUCLEASE user 4 3 # 4 D 115 TYR B 70 TYR^? 11.25 O2 EDO B 124 D 125 HIS A 72 HIS^? 15.66 C2 EDO B 124 D 156 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 54.10 1.42 85.16 54.14 4.17 85.62 8.28 55.71 -0.18 8.56 53.06 0.60 coo 61.27 5.43 85.32 62.73 6.38 86.49 6.89 48.41 3.38 5.73 47.19 2.13 coo 60.28 4.62 76.00 58.35 6.41 80.65 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1a79_c03 TRNA ENDONUCLEASE user 5 3 # 5 D 115 TYR B 70 TYR^? 11.25 O2 EDO B 124 D 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 D 156 LYS A 114 LYS^? 4.03 O ACT A 123 coo 54.10 1.42 85.16 54.14 4.17 85.62 8.28 55.71 -0.18 8.56 53.06 0.60 coo 61.27 5.43 85.32 62.73 6.38 86.49 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 60.28 4.62 76.00 58.35 6.41 80.65 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1a79_c03 TRNA ENDONUCLEASE user 6 3 # 6 D 115 TYR B 70 TYR^? 11.25 O2 EDO B 124 D 125 HIS B 72 HIS^? 13.54 O1 EDO A 124 D 156 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 54.10 1.42 85.16 54.14 4.17 85.62 8.28 55.71 -0.18 8.56 53.06 0.60 coo 61.27 5.43 85.32 62.73 6.38 86.49 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 60.28 4.62 76.00 58.35 6.41 80.65 0.03 48.55 -7.94 -5.29 45.92 -6.26 1a79_c03 source 1a79 TRNA ENDONUCLEASE : 6 hits 1a79_c03 naa= 3 ULMN 3 1ab4_c00 GYRASE A user 1 3 # 1 32 ARG A 79 ARG^? -4.30 O1 EDO A 126s 78 HIS A 88 HIS^? 13.90 OXT ACT A 123 122 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo 48.32 72.26 30.89 48.69 69.28 31.53 2.90 41.63 20.04 5.49 40.23 20.98 coo 53.63 68.24 34.99 53.08 69.10 33.16 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 75.01 61.87 32.93 75.34 59.26 31.96 0.65 57.23 -3.12 -1.98 58.01 -2.52 ULMN 3 1ab4_c00 GYRASE A user 2 3 # 2 32 ARG A 110 ARG^? 13.67 O2 EDO A 126 78 HIS A 111 HIS^? 11.74 C2 EDO A 125 122 TYR A 67 TYR^? -4.09 C2 EDO A 127s coo 48.32 72.26 30.89 48.69 69.28 31.53 13.94 35.14 15.37 15.97 35.29 13.07 coo 53.63 68.24 34.99 53.08 69.10 33.16 16.68 40.80 13.52 18.19 42.09 12.84 coo 75.01 61.87 32.93 75.34 59.26 31.96 9.19 62.70 13.11 10.16 60.66 14.79 ULMN 3 1ab4_c00 GYRASE A user 3 3 # 3 32 ARG B 79 ARG^? -4.39 C1 PEG B 126s 78 HIS B 88 HIS^? 7.16 O1 EDO B 123 122 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo 48.32 72.26 30.89 48.69 69.28 31.53 11.19 48.56 -18.94 8.63 47.63 -20.34 coo 53.63 68.24 34.99 53.08 69.10 33.16 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 75.01 61.87 32.93 75.34 59.26 31.96 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1ab4_c00 GYRASE A user 4 3 # 4 32 ARG B 110 ARG^? 12.48 O4 PEG B 126 78 HIS B 111 HIS^? 12.89 C3 PEG B 126 122 TYR B 67 TYR^? -3.57 C1 EDO B 125s coo 48.32 72.26 30.89 48.69 69.28 31.53 -0.05 41.10 -16.85 -2.14 40.61 -14.61 coo 53.63 68.24 34.99 53.08 69.10 33.16 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo 75.01 61.87 32.93 75.34 59.26 31.96 4.90 65.99 -5.12 3.99 64.76 -7.44 1ab4_c00 source 1ab4 GYRASE A : 4 hits 1ab4_c00 naa= 3 ULMN 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 1 3 # 1 33 ASP B 94 ASP^? 10.22 O1 EDO A 124 187 GLU B 75 GLU^? 16.27 C2 EDO B 124 229 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -52.57 56.60 47.75 -51.52 54.87 46.95 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -45.08 48.37 46.81 -46.53 49.74 45.96 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo -47.40 44.36 48.48 -50.80 49.18 46.20 0.03 48.55 -7.94 -5.29 45.92 -6.26 1ald_c00 source 1ald ALDOLASE A (E.C.4.1.2.13) : 1 hits 1ald_c00 naa= 3 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 5 ASP.? 11.32 O1 EDO B 123 214 ASP B 32 ASP^? 11.80 C3 PEG B 126 289 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 26.86 59.76 46.36 25.42 58.23 45.92 -5.79 54.47 -23.19 -5.94 55.44 -25.07 coo 9.42 68.07 30.27 7.35 68.27 30.10 16.23 58.63 -15.55 16.12 57.73 -13.62 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 5 ASP.? 11.32 O1 EDO B 123 214 ASP B 32 ASP^? 11.80 C3 PEG B 126 289 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 26.86 59.76 46.36 25.42 58.23 45.92 -5.79 54.47 -23.19 -5.94 55.44 -25.07 coo 9.42 68.07 30.27 7.35 68.27 30.10 20.02 60.63 -18.97 20.31 59.23 -17.40 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 13 ASP.? -3.81 O2 EDO A 124s 214 ASP B 32 ASP^? 11.80 C3 PEG B 126 289 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo -0.62 65.95 29.97 0.31 67.47 31.05 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 26.86 59.76 46.36 25.42 58.23 45.92 -5.79 54.47 -23.19 -5.94 55.44 -25.07 coo 9.42 68.07 30.27 7.35 68.27 30.10 11.18 47.39 -6.30 12.32 45.78 -7.12 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP B 5 ASP^? 17.31 OXT ACT A 123 214 ASP A 32 ASP.? 9.00 C2 EDO A 125 289 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 26.86 59.76 46.36 25.42 58.23 45.92 20.30 44.49 25.52 20.49 42.41 25.06 coo 9.42 68.07 30.27 7.35 68.27 30.10 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 # 5 179 ASP B 13 ASP^? 17.03 O1 EDO B 124 214 ASP A 32 ASP.? 9.00 C2 EDO A 125 289 ASP A 94 ASP.? 16.52 O ACT A 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 26.86 59.76 46.36 25.42 58.23 45.92 20.30 44.49 25.52 20.49 42.41 25.06 coo 9.42 68.07 30.27 7.35 68.27 30.10 2.85 44.85 7.76 1.66 43.09 7.95 1amy_c01 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 5 hits 1amy_c01 naa= 3 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 5 ASP.? 11.32 O1 EDO B 123 227 GLU B 69 GLU^? -2.92 O2 EDO B 124s 289 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 3.96 55.76 41.24 4.83 57.69 41.17 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 9.42 68.07 30.27 7.35 68.27 30.10 16.23 58.63 -15.55 16.12 57.73 -13.62 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 13 ASP.? -3.81 O2 EDO A 124s 227 GLU A 49 GLU^? 5.11 O2 EDO A 127 289 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo -0.62 65.95 29.97 0.31 67.47 31.05 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 3.96 55.76 41.24 4.83 57.69 41.17 16.74 60.19 6.60 17.85 60.24 8.39 coo 9.42 68.07 30.27 7.35 68.27 30.10 11.18 47.39 -6.30 12.32 45.78 -7.12 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 13 ASP.? -3.81 O2 EDO A 124s 227 GLU A 75 GLU^? 16.23 O2 EDO A 124 289 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo -0.62 65.95 29.97 0.31 67.47 31.05 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 3.96 55.76 41.24 4.83 57.69 41.17 14.12 39.75 7.18 16.10 39.69 6.63 coo 9.42 68.07 30.27 7.35 68.27 30.10 11.18 47.39 -6.30 12.32 45.78 -7.12 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP A 82 ASP.? 12.57 OXT ACT A 123 227 GLU A 69 GLU^? 4.98 OXT ACT A 123 289 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 3.96 55.76 41.24 4.83 57.69 41.17 8.76 56.68 10.43 10.20 56.07 11.84 coo 9.42 68.07 30.27 7.35 68.27 30.10 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 # 5 179 ASP B 13 ASP^? 17.03 O1 EDO B 124 227 GLU B 69 GLU^? -2.92 O2 EDO B 124s 289 ASP A 94 ASP.? 16.52 O ACT A 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 3.96 55.76 41.24 4.83 57.69 41.17 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 9.42 68.07 30.27 7.35 68.27 30.10 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 6 3 # 6 179 ASP B 13 ASP^? 17.03 O1 EDO B 124 227 GLU B 75 GLU^? 16.27 C2 EDO B 124 289 ASP A 94 ASP.? 16.52 O ACT A 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 3.96 55.76 41.24 4.83 57.69 41.17 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 9.42 68.07 30.27 7.35 68.27 30.10 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 # 7 179 ASP B 82 ASP^? 7.08 O1 EDO B 123 227 GLU B 69 GLU^? -2.92 O2 EDO B 124s 289 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 3.96 55.76 41.24 4.83 57.69 41.17 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 9.42 68.07 30.27 7.35 68.27 30.10 20.60 64.37 -9.63 20.20 65.77 -11.14 1amy_c06 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 7 hits 1amy_c06 naa= 3 ULMN 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 1 3 # 1 232 HIS A 72 HIS^? 15.66 C2 EDO B 124 254 LYS A 91 LYS^? 18.66 O2 EDO A 126 333 ARG B 11 ARG^? 15.69 O ACT A 123 coo 28.11 -1.15 8.51 29.21 0.63 8.34 6.89 48.41 3.38 5.73 47.19 2.13 coo 26.09 4.87 14.60 27.89 3.33 10.26 5.43 41.25 9.74 2.02 38.13 6.82 coo 37.35 7.47 11.84 34.90 6.11 10.60 -2.30 47.71 11.46 -0.79 44.99 11.29 ULMN 3 1aq2_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE user 2 3 # 2 232 HIS B 72 HIS^? 13.54 O1 EDO A 124 254 LYS B 91 LYS^? 13.69 O1 EDO A 124 333 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 28.11 -1.15 8.51 29.21 0.63 8.34 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 26.09 4.87 14.60 27.89 3.33 10.26 8.58 44.72 -9.41 12.21 41.02 -7.65 coo 37.35 7.47 11.84 34.90 6.11 10.60 16.32 51.23 -8.65 14.73 48.69 -9.52 1aq2_c00 source 1aq2 PHOSPHOENOLPYRUVATE CARBOXYKINASE : 2 hits 1aq2_c00 naa= 3 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 A 325 ARG A 11 ARG^? -8.10 O1 EDO A 124s A 342 ASP B 84 ASP^? 4.63 O1 EDO B 123 A 531 ARG B 79 ARG^? -4.39 C1 PEG B 126s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 11.19 48.56 -18.94 8.63 47.63 -20.34 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 A 325 ARG A 79 ARG^? -4.30 O1 EDO A 126s A 342 ASP A 84 ASP.? 16.56 O1 EDO A 126 A 531 ARG B 11 ARG^? 15.69 O ACT A 123 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 2.90 41.63 20.04 5.49 40.23 20.98 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -5.66 53.01 24.37 -6.07 52.23 22.45 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -2.30 47.71 11.46 -0.79 44.99 11.29 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 A 325 ARG A 79 ARG^? -4.30 O1 EDO A 126s A 342 ASP A 94 ASP.? 16.52 O ACT A 123 A 531 ARG A 110 ARG^? 13.67 O2 EDO A 126 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 2.90 41.63 20.04 5.49 40.23 20.98 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 2.85 44.85 7.76 1.66 43.09 7.95 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 13.94 35.14 15.37 15.97 35.29 13.07 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 A 325 ARG B 11 ARG^? 15.69 O ACT A 123 A 342 ASP A 84 ASP.? 16.56 O1 EDO A 126 A 531 ARG A 79 ARG^? -4.30 O1 EDO A 126s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -2.30 47.71 11.46 -0.79 44.99 11.29 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -5.66 53.01 24.37 -6.07 52.23 22.45 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 2.90 41.63 20.04 5.49 40.23 20.98 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 5 3 # 5 A 325 ARG B 79 ARG^? -4.39 C1 PEG B 126s A 342 ASP B 84 ASP^? 4.63 O1 EDO B 123 A 531 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 73.40 61.96 -24.99 72.46 63.92 -22.84 11.19 48.56 -18.94 8.63 47.63 -20.34 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 16.32 51.23 -8.65 14.73 48.69 -9.52 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 6 3 # 6 A 325 ARG B 79 ARG^? -4.39 C1 PEG B 126s A 342 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 531 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 11.19 48.56 -18.94 8.63 47.63 -20.34 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -0.05 41.10 -16.85 -2.14 40.61 -14.61 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 7 3 # 7 A 325 ARG B 105 ARG^? 8.10 C1 PEG B 126 A 342 ASP B 32 ASP^? 11.80 C3 PEG B 126 A 531 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -5.79 54.47 -23.19 -5.94 55.44 -25.07 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 3.96 65.71 -18.47 3.56 68.28 -16.63 1asy_c01 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 7 hits 1asy_c01 naa= 3 ULMN 3 1avf_c04 GASTRICSIN user 1 3 # 1 A 32 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 35 SER A 7 SER.? 11.72 O1 EDO B 123 A 217 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo -10.06 2.54 49.69 -8.83 3.73 50.96 20.60 64.37 -9.63 20.20 65.77 -11.14 coo -11.96 5.74 52.90 -10.55 6.74 51.22 16.55 63.58 -12.78 16.44 65.52 -14.23 coo -5.22 1.43 56.08 -5.36 2.84 54.49 20.02 60.63 -18.97 20.31 59.23 -17.40 ULMN 3 1avf_c04 GASTRICSIN user 2 3 # 2 A 32 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 35 SER B 7 SER^? 13.90 OXT ACT A 123 A 217 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo -10.06 2.54 49.69 -8.83 3.73 50.96 -6.45 59.57 16.94 -6.05 60.31 18.88 coo -11.96 5.74 52.90 -10.55 6.74 51.22 -2.26 57.69 19.56 -2.09 59.00 21.60 coo -5.22 1.43 56.08 -5.36 2.84 54.49 -5.66 53.01 24.37 -6.07 52.23 22.45 1avf_c04 source 1avf GASTRICSIN : 2 hits 1avf_c04 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 41 PHE^? 6.84 C1 EDO A 128 A 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 265 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 39.74 52.86 65.74 41.15 55.14 66.52 15.76 60.60 -0.51 14.59 62.89 -1.66 coo 30.70 47.50 67.53 29.83 49.47 67.39 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 19.99 54.53 64.11 20.55 58.78 68.33 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1ax4_c04 TRYPTOPHANASE user 2 3 # 2 A 130 PHE A 41 PHE^? 6.84 C1 EDO A 128 A 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 265 LYS B 91 LYS^? 13.69 O1 EDO A 124 coo 39.74 52.86 65.74 41.15 55.14 66.52 15.76 60.60 -0.51 14.59 62.89 -1.66 coo 30.70 47.50 67.53 29.83 49.47 67.39 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 19.99 54.53 64.11 20.55 58.78 68.33 8.58 44.72 -9.41 12.21 41.02 -7.65 ULMN 3 1ax4_c04 TRYPTOPHANASE user 3 3 # 3 A 130 PHE A 96 PHE^? 9.38 OXT ACT A 123 A 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 265 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 39.74 52.86 65.74 41.15 55.14 66.52 3.05 50.53 10.55 5.47 49.81 11.76 coo 30.70 47.50 67.53 29.83 49.47 67.39 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 19.99 54.53 64.11 20.55 58.78 68.33 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1ax4_c04 TRYPTOPHANASE user 4 3 # 4 A 130 PHE B 41 PHE^? 12.86 O2 EDO B 125 A 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 265 LYS A 91 LYS^? 18.66 O2 EDO A 126 coo 39.74 52.86 65.74 41.15 55.14 66.52 -1.73 59.31 6.86 -0.60 60.93 8.76 coo 30.70 47.50 67.53 29.83 49.47 67.39 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 19.99 54.53 64.11 20.55 58.78 68.33 5.43 41.25 9.74 2.02 38.13 6.82 ULMN 3 1ax4_c04 TRYPTOPHANASE user 5 3 # 5 A 130 PHE B 41 PHE^? 12.86 O2 EDO B 125 A 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 265 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 39.74 52.86 65.74 41.15 55.14 66.52 -1.73 59.31 6.86 -0.60 60.93 8.76 coo 30.70 47.50 67.53 29.83 49.47 67.39 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 19.99 54.53 64.11 20.55 58.78 68.33 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1ax4_c04 TRYPTOPHANASE user 6 3 # 6 A 130 PHE B 96 PHE^? 9.36 O2 EDO B 124 A 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 265 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 39.74 52.86 65.74 41.15 55.14 66.52 10.95 53.66 -6.99 8.59 53.45 -8.41 coo 30.70 47.50 67.53 29.83 49.47 67.39 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 19.99 54.53 64.11 20.55 58.78 68.33 13.93 45.27 9.54 19.06 43.44 6.58 1ax4_c04 source 1ax4 TRYPTOPHANASE : 6 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 41 PHE^? 6.84 C1 EDO A 128 B 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 265 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 7.48 54.94 99.62 7.67 52.27 100.42 15.76 60.60 -0.51 14.59 62.89 -1.66 coo 10.43 61.66 91.81 9.80 60.04 90.61 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 5.43 58.06 80.08 8.57 53.00 79.37 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1ax4_c05 TRYPTOPHANASE user 2 3 # 2 B 130 PHE A 41 PHE^? 6.84 C1 EDO A 128 B 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 265 LYS B 91 LYS^? 13.69 O1 EDO A 124 coo 7.48 54.94 99.62 7.67 52.27 100.42 15.76 60.60 -0.51 14.59 62.89 -1.66 coo 10.43 61.66 91.81 9.80 60.04 90.61 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 5.43 58.06 80.08 8.57 53.00 79.37 8.58 44.72 -9.41 12.21 41.02 -7.65 ULMN 3 1ax4_c05 TRYPTOPHANASE user 3 3 # 3 B 130 PHE A 96 PHE^? 9.38 OXT ACT A 123 B 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 265 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 7.48 54.94 99.62 7.67 52.27 100.42 3.05 50.53 10.55 5.47 49.81 11.76 coo 10.43 61.66 91.81 9.80 60.04 90.61 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 5.43 58.06 80.08 8.57 53.00 79.37 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1ax4_c05 TRYPTOPHANASE user 4 3 # 4 B 130 PHE B 41 PHE^? 12.86 O2 EDO B 125 B 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 265 LYS A 91 LYS^? 18.66 O2 EDO A 126 coo 7.48 54.94 99.62 7.67 52.27 100.42 -1.73 59.31 6.86 -0.60 60.93 8.76 coo 10.43 61.66 91.81 9.80 60.04 90.61 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 5.43 58.06 80.08 8.57 53.00 79.37 5.43 41.25 9.74 2.02 38.13 6.82 ULMN 3 1ax4_c05 TRYPTOPHANASE user 5 3 # 5 B 130 PHE B 41 PHE^? 12.86 O2 EDO B 125 B 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 265 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 7.48 54.94 99.62 7.67 52.27 100.42 -1.73 59.31 6.86 -0.60 60.93 8.76 coo 10.43 61.66 91.81 9.80 60.04 90.61 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 5.43 58.06 80.08 8.57 53.00 79.37 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1ax4_c05 TRYPTOPHANASE user 6 3 # 6 B 130 PHE B 96 PHE^? 9.36 O2 EDO B 124 B 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 265 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 7.48 54.94 99.62 7.67 52.27 100.42 10.95 53.66 -6.99 8.59 53.45 -8.41 coo 10.43 61.66 91.81 9.80 60.04 90.61 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 5.43 58.06 80.08 8.57 53.00 79.37 13.93 45.27 9.54 19.06 43.44 6.58 1ax4_c05 source 1ax4 TRYPTOPHANASE : 6 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 41 PHE^? 6.84 C1 EDO A 128 C 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s C 265 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo -6.55 73.45 23.60 -6.77 71.48 21.66 15.76 60.60 -0.51 14.59 62.89 -1.66 coo -9.52 75.74 33.62 -8.85 73.74 33.93 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -4.44 67.20 42.32 -7.50 62.41 40.49 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1ax4_c06 TRYPTOPHANASE user 2 3 # 2 C 130 PHE A 41 PHE^? 6.84 C1 EDO A 128 C 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s C 265 LYS B 91 LYS^? 13.69 O1 EDO A 124 coo -6.55 73.45 23.60 -6.77 71.48 21.66 15.76 60.60 -0.51 14.59 62.89 -1.66 coo -9.52 75.74 33.62 -8.85 73.74 33.93 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -4.44 67.20 42.32 -7.50 62.41 40.49 8.58 44.72 -9.41 12.21 41.02 -7.65 ULMN 3 1ax4_c06 TRYPTOPHANASE user 3 3 # 3 C 130 PHE A 96 PHE^? 9.38 OXT ACT A 123 C 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 C 265 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -6.55 73.45 23.60 -6.77 71.48 21.66 3.05 50.53 10.55 5.47 49.81 11.76 coo -9.52 75.74 33.62 -8.85 73.74 33.93 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -4.44 67.20 42.32 -7.50 62.41 40.49 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1ax4_c06 TRYPTOPHANASE user 4 3 # 4 C 130 PHE B 41 PHE^? 12.86 O2 EDO B 125 C 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 C 265 LYS A 91 LYS^? 18.66 O2 EDO A 126 coo -6.55 73.45 23.60 -6.77 71.48 21.66 -1.73 59.31 6.86 -0.60 60.93 8.76 coo -9.52 75.74 33.62 -8.85 73.74 33.93 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -4.44 67.20 42.32 -7.50 62.41 40.49 5.43 41.25 9.74 2.02 38.13 6.82 ULMN 3 1ax4_c06 TRYPTOPHANASE user 5 3 # 5 C 130 PHE B 41 PHE^? 12.86 O2 EDO B 125 C 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 C 265 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -6.55 73.45 23.60 -6.77 71.48 21.66 -1.73 59.31 6.86 -0.60 60.93 8.76 coo -9.52 75.74 33.62 -8.85 73.74 33.93 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -4.44 67.20 42.32 -7.50 62.41 40.49 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1ax4_c06 TRYPTOPHANASE user 6 3 # 6 C 130 PHE B 96 PHE^? 9.36 O2 EDO B 124 C 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s C 265 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo -6.55 73.45 23.60 -6.77 71.48 21.66 10.95 53.66 -6.99 8.59 53.45 -8.41 coo -9.52 75.74 33.62 -8.85 73.74 33.93 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -4.44 67.20 42.32 -7.50 62.41 40.49 13.93 45.27 9.54 19.06 43.44 6.58 1ax4_c06 source 1ax4 TRYPTOPHANASE : 6 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 41 PHE^? 6.84 C1 EDO A 128 D 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s D 265 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo -38.60 55.38 52.70 -40.06 57.72 53.04 15.76 60.60 -0.51 14.59 62.89 -1.66 coo -29.46 51.67 48.51 -28.63 53.31 49.56 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -18.87 56.53 54.79 -19.47 62.22 53.03 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1ax4_c07 TRYPTOPHANASE user 2 3 # 2 D 130 PHE A 41 PHE^? 6.84 C1 EDO A 128 D 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s D 265 LYS B 91 LYS^? 13.69 O1 EDO A 124 coo -38.60 55.38 52.70 -40.06 57.72 53.04 15.76 60.60 -0.51 14.59 62.89 -1.66 coo -29.46 51.67 48.51 -28.63 53.31 49.56 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -18.87 56.53 54.79 -19.47 62.22 53.03 8.58 44.72 -9.41 12.21 41.02 -7.65 ULMN 3 1ax4_c07 TRYPTOPHANASE user 3 3 # 3 D 130 PHE A 96 PHE^? 9.38 OXT ACT A 123 D 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 D 265 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -38.60 55.38 52.70 -40.06 57.72 53.04 3.05 50.53 10.55 5.47 49.81 11.76 coo -29.46 51.67 48.51 -28.63 53.31 49.56 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -18.87 56.53 54.79 -19.47 62.22 53.03 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1ax4_c07 TRYPTOPHANASE user 4 3 # 4 D 130 PHE B 41 PHE^? 12.86 O2 EDO B 125 D 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 D 265 LYS A 91 LYS^? 18.66 O2 EDO A 126 coo -38.60 55.38 52.70 -40.06 57.72 53.04 -1.73 59.31 6.86 -0.60 60.93 8.76 coo -29.46 51.67 48.51 -28.63 53.31 49.56 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -18.87 56.53 54.79 -19.47 62.22 53.03 5.43 41.25 9.74 2.02 38.13 6.82 ULMN 3 1ax4_c07 TRYPTOPHANASE user 5 3 # 5 D 130 PHE B 41 PHE^? 12.86 O2 EDO B 125 D 223 ASP B 13 ASP^? 17.03 O1 EDO B 124 D 265 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -38.60 55.38 52.70 -40.06 57.72 53.04 -1.73 59.31 6.86 -0.60 60.93 8.76 coo -29.46 51.67 48.51 -28.63 53.31 49.56 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -18.87 56.53 54.79 -19.47 62.22 53.03 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1ax4_c07 TRYPTOPHANASE user 6 3 # 6 D 130 PHE B 96 PHE^? 9.36 O2 EDO B 124 D 223 ASP A 13 ASP.? -3.81 O2 EDO A 124s D 265 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo -38.60 55.38 52.70 -40.06 57.72 53.04 10.95 53.66 -6.99 8.59 53.45 -8.41 coo -29.46 51.67 48.51 -28.63 53.31 49.56 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -18.87 56.53 54.79 -19.47 62.22 53.03 13.93 45.27 9.54 19.06 43.44 6.58 1ax4_c07 source 1ax4 TRYPTOPHANASE : 6 hits 1ax4_c07 naa= 3 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 1 3 # 1 A 85 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 171 ARG A 79 ARG^? -4.30 O1 EDO A 126s A 190 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 22.59 2.26 43.22 21.17 3.47 42.27 6.89 48.41 3.38 5.73 47.19 2.13 coo 13.63 3.81 28.83 14.49 2.91 31.59 2.90 41.63 20.04 5.49 40.23 20.98 coo 24.97 7.47 37.69 21.24 10.69 35.89 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 2 3 # 2 A 85 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 171 ARG A 79 ARG^? -4.30 O1 EDO A 126s A 190 LYS A 114 LYS^? 4.03 O ACT A 123 coo 22.59 2.26 43.22 21.17 3.47 42.27 6.89 48.41 3.38 5.73 47.19 2.13 coo 13.63 3.81 28.83 14.49 2.91 31.59 2.90 41.63 20.04 5.49 40.23 20.98 coo 24.97 7.47 37.69 21.24 10.69 35.89 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 3 3 # 3 A 85 HIS A 111 HIS^? 11.74 C2 EDO A 125 A 171 ARG A 79 ARG^? -4.30 O1 EDO A 126s A 190 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 22.59 2.26 43.22 21.17 3.47 42.27 16.68 40.80 13.52 18.19 42.09 12.84 coo 13.63 3.81 28.83 14.49 2.91 31.59 2.90 41.63 20.04 5.49 40.23 20.98 coo 24.97 7.47 37.69 21.24 10.69 35.89 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 4 3 # 4 A 85 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 171 ARG B 79 ARG^? -4.39 C1 PEG B 126s A 190 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 22.59 2.26 43.22 21.17 3.47 42.27 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 13.63 3.81 28.83 14.49 2.91 31.59 11.19 48.56 -18.94 8.63 47.63 -20.34 coo 24.97 7.47 37.69 21.24 10.69 35.89 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 5 3 # 5 A 85 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 171 ARG B 79 ARG^? -4.39 C1 PEG B 126s A 190 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 22.59 2.26 43.22 21.17 3.47 42.27 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 13.63 3.81 28.83 14.49 2.91 31.59 11.19 48.56 -18.94 8.63 47.63 -20.34 coo 24.97 7.47 37.69 21.24 10.69 35.89 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 6 3 # 6 A 85 HIS B 111 HIS^? 12.89 C3 PEG B 126 A 171 ARG B 79 ARG^? -4.39 C1 PEG B 126s A 190 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 22.59 2.26 43.22 21.17 3.47 42.27 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo 13.63 3.81 28.83 14.49 2.91 31.59 11.19 48.56 -18.94 8.63 47.63 -20.34 coo 24.97 7.47 37.69 21.24 10.69 35.89 0.03 48.55 -7.94 -5.29 45.92 -6.26 1azy_c00 source 1azy THYMIDINE PHOSPHORYLASE : 6 hits 1azy_c00 naa= 3 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 1 3 # 1 B 85 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 171 ARG A 79 ARG^? -4.30 O1 EDO A 126s B 190 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 6.89 48.41 3.38 5.73 47.19 2.13 coo 2.83 4.83 10.84 1.96 4.32 7.97 2.90 41.63 20.04 5.49 40.23 20.98 coo -8.96 9.04 2.88 -5.39 12.11 5.08 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 2 3 # 2 B 85 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 171 ARG A 79 ARG^? -4.30 O1 EDO A 126s B 190 LYS A 114 LYS^? 4.03 O ACT A 123 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 6.89 48.41 3.38 5.73 47.19 2.13 coo 2.83 4.83 10.84 1.96 4.32 7.97 2.90 41.63 20.04 5.49 40.23 20.98 coo -8.96 9.04 2.88 -5.39 12.11 5.08 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 3 3 # 3 B 85 HIS A 111 HIS^? 11.74 C2 EDO A 125 B 171 ARG A 79 ARG^? -4.30 O1 EDO A 126s B 190 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 16.68 40.80 13.52 18.19 42.09 12.84 coo 2.83 4.83 10.84 1.96 4.32 7.97 2.90 41.63 20.04 5.49 40.23 20.98 coo -8.96 9.04 2.88 -5.39 12.11 5.08 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 4 3 # 4 B 85 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 171 ARG B 79 ARG^? -4.39 C1 PEG B 126s B 190 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 2.83 4.83 10.84 1.96 4.32 7.97 11.19 48.56 -18.94 8.63 47.63 -20.34 coo -8.96 9.04 2.88 -5.39 12.11 5.08 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 5 3 # 5 B 85 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 171 ARG B 79 ARG^? -4.39 C1 PEG B 126s B 190 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 2.83 4.83 10.84 1.96 4.32 7.97 11.19 48.56 -18.94 8.63 47.63 -20.34 coo -8.96 9.04 2.88 -5.39 12.11 5.08 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 6 3 # 6 B 85 HIS B 111 HIS^? 12.89 C3 PEG B 126 B 171 ARG B 79 ARG^? -4.39 C1 PEG B 126s B 190 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo 2.83 4.83 10.84 1.96 4.32 7.97 11.19 48.56 -18.94 8.63 47.63 -20.34 coo -8.96 9.04 2.88 -5.39 12.11 5.08 0.03 48.55 -7.94 -5.29 45.92 -6.26 1azy_c01 source 1azy THYMIDINE PHOSPHORYLASE : 6 hits 1azy_c01 naa= 3 ULMN 3 1b5d_c04 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 1 3 # 1 A 60 GLU A 77 GLU^? 11.16 O2 EDO A 126 A 148 CYH A 71 CYH^? 6.77 OXT ACT A 123 A 179 ASP A 94 ASP.? 16.52 O ACT A 123 coo 20.47 15.77 27.32 19.04 14.27 26.94 8.02 38.51 14.00 9.59 37.31 13.17 coo 21.87 3.71 21.27 20.32 3.55 23.64 7.28 52.14 8.02 7.72 52.85 10.71 coo 17.09 11.24 20.19 17.85 10.05 21.76 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1b5d_c04 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 2 3 # 2 A 60 GLU B 77 GLU^? 10.85 O4 PEG B 126 A 148 CYH B 71 CYH^? 5.39 O2 EDO B 124 A 179 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 20.47 15.77 27.32 19.04 14.27 26.94 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 21.87 3.71 21.27 20.32 3.55 23.64 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 17.09 11.24 20.19 17.85 10.05 21.76 11.18 47.39 -6.30 12.32 45.78 -7.12 1b5d_c04 source 1b5d DEOXYCYTIDYLATE HYDROXYMETHYLASE : 2 hits 1b5d_c04 naa= 3 ULMN 3 1b5d_c05 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 1 3 # 1 B 60 GLU A 77 GLU^? 11.16 O2 EDO A 126 B 148 CYH A 71 CYH^? 6.77 OXT ACT A 123 B 179 ASP A 94 ASP.? 16.52 O ACT A 123 coo 34.11 -11.05 -1.22 32.89 -9.54 -2.05 8.02 38.51 14.00 9.59 37.31 13.17 coo 30.30 0.93 3.58 31.01 1.18 0.88 7.28 52.14 8.02 7.72 52.85 10.71 coo 26.42 -6.51 0.59 28.13 -5.32 0.24 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1b5d_c05 DEOXYCYTIDYLATE HYDROXYMETHYLASE user 2 3 # 2 B 60 GLU B 77 GLU^? 10.85 O4 PEG B 126 B 148 CYH B 71 CYH^? 5.39 O2 EDO B 124 B 179 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 34.11 -11.05 -1.22 32.89 -9.54 -2.05 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 30.30 0.93 3.58 31.01 1.18 0.88 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 26.42 -6.51 0.59 28.13 -5.32 0.24 11.18 47.39 -6.30 12.32 45.78 -7.12 1b5d_c05 source 1b5d DEOXYCYTIDYLATE HYDROXYMETHYLASE : 2 hits 1b5d_c05 naa= 3 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 1 3 # 1 A 18 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 91 ARG A 8 ARG.? -3.85 O1 EDO B 123s A 129 SER A 7 SER.? 11.72 O1 EDO B 123 coo 24.39 47.01 49.70 26.42 47.04 49.21 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 25.98 44.20 42.23 28.53 42.98 43.43 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 30.00 49.76 45.68 28.73 48.72 47.47 16.55 63.58 -12.78 16.44 65.52 -14.23 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 2 3 # 2 A 18 HIS A 111 HIS^? 11.74 C2 EDO A 125 A 91 ARG A 110 ARG^? 13.67 O2 EDO A 126 A 129 SER A 57 SER^? 6.85 O2 EDO A 126 coo 24.39 47.01 49.70 26.42 47.04 49.21 16.68 40.80 13.52 18.19 42.09 12.84 coo 25.98 44.20 42.23 28.53 42.98 43.43 13.94 35.14 15.37 15.97 35.29 13.07 coo 30.00 49.76 45.68 28.73 48.72 47.47 15.14 41.83 20.35 16.25 40.17 21.70 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 3 3 # 3 A 18 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 91 ARG B 8 ARG^? 17.13 OXT ACT A 123 A 129 SER B 7 SER^? 13.90 OXT ACT A 123 coo 24.39 47.01 49.70 26.42 47.04 49.21 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 25.98 44.20 42.23 28.53 42.98 43.43 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 30.00 49.76 45.68 28.73 48.72 47.47 -2.26 57.69 19.56 -2.09 59.00 21.60 ULMN 3 1b6t_c00 PHOSPHOPANTETHEINE ADENYLYLTRANSFERAuser 4 3 # 4 A 18 HIS B 111 HIS^? 12.89 C3 PEG B 126 A 91 ARG B 110 ARG^? 12.48 O4 PEG B 126 A 129 SER B 57 SER^? 6.28 O4 PEG B 126 coo 24.39 47.01 49.70 26.42 47.04 49.21 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo 25.98 44.20 42.23 28.53 42.98 43.43 -0.05 41.10 -16.85 -2.14 40.61 -14.61 coo 30.00 49.76 45.68 28.73 48.72 47.47 -1.05 49.09 -19.26 -2.38 47.97 -20.95 1b6t_c00 source 1b6t PHOSPHOPANTETHEINE ADENYLYLTRANSFERASE : 4 hits 1b6t_c00 naa= 3 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 A 137 ARG A 36 ARG^? -3.17 O2 EDO A 125s A 141 THR A 56 THR^? 7.33 C2 EDO A 125 A 235 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 6.21 93.81 36.58 4.58 96.33 37.17 24.38 48.23 13.15 25.39 47.42 15.97 coo 6.80 92.87 28.33 4.91 92.74 27.40 17.43 43.07 17.55 19.51 43.25 18.06 coo 12.98 90.36 47.57 11.26 89.62 46.62 20.17 49.39 -1.56 21.38 47.59 -1.63 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 A 137 ARG A 105 ARG^? 7.37 O1 EDO A 126 A 141 THR A 103 THR^? 10.25 OXT ACT A 123 A 235 ASP A 32 ASP.? 9.00 C2 EDO A 125 coo 6.21 93.81 36.58 4.58 96.33 37.17 5.55 48.74 25.05 2.82 47.97 26.30 coo 6.80 92.87 28.33 4.91 92.74 27.40 3.98 57.48 21.66 3.28 59.10 22.89 coo 12.98 90.36 47.57 11.26 89.62 46.62 20.30 44.49 25.52 20.49 42.41 25.06 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 A 137 ARG A 105 ARG^? 7.37 O1 EDO A 126 A 141 THR A 103 THR^? 10.25 OXT ACT A 123 A 235 ASP A 109 ASP^? -4.58 O2 EDO A 126s coo 6.21 93.81 36.58 4.58 96.33 37.17 5.55 48.74 25.05 2.82 47.97 26.30 coo 6.80 92.87 28.33 4.91 92.74 27.40 3.98 57.48 21.66 3.28 59.10 22.89 coo 12.98 90.36 47.57 11.26 89.62 46.62 9.63 38.15 19.81 7.90 38.49 20.93 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 A 137 ARG B 36 ARG^? 14.13 O1 EDO B 124 A 141 THR B 56 THR^? 10.83 C3 PEG B 126 A 235 ASP B 13 ASP^? 17.03 O1 EDO B 124 coo 6.21 93.81 36.58 4.58 96.33 37.17 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo 6.80 92.87 28.33 4.91 92.74 27.40 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo 12.98 90.36 47.57 11.26 89.62 46.62 -6.23 48.66 3.73 -7.41 46.97 3.18 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 A 137 ARG B 105 ARG^? 8.10 C1 PEG B 126 A 141 THR B 103 THR^? 13.94 C1 EDO B 125 A 235 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 6.21 93.81 36.58 4.58 96.33 37.17 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 6.80 92.87 28.33 4.91 92.74 27.40 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 12.98 90.36 47.57 11.26 89.62 46.62 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 A 137 ARG B 105 ARG^? 8.10 C1 PEG B 126 A 141 THR B 103 THR^? 13.94 C1 EDO B 125 A 235 ASP B 109 ASP^? -4.16 O4 PEG B 126s coo 6.21 93.81 36.58 4.58 96.33 37.17 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 6.80 92.87 28.33 4.91 92.74 27.40 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 12.98 90.36 47.57 11.26 89.62 46.62 4.45 45.35 -19.96 6.21 46.00 -20.89 1bd3_c00 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 6 hits 1bd3_c00 naa= 3 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 D 137 ARG A 11 ARG^? -8.10 O1 EDO A 124s D 141 THR A 14 THR.? 8.58 O1 EDO A 124 D 235 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo -8.33 92.80 100.06 -7.71 95.33 98.44 16.32 51.23 -8.65 14.73 48.69 -9.52 coo -9.24 93.49 108.77 -7.37 94.21 109.61 17.20 46.38 0.71 15.18 46.20 -0.03 coo -14.64 87.74 89.51 -12.89 87.43 90.65 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 D 137 ARG A 105 ARG^? 7.37 O1 EDO A 126 D 141 THR A 103 THR^? 10.25 OXT ACT A 123 D 235 ASP A 109 ASP^? -4.58 O2 EDO A 126s coo -8.33 92.80 100.06 -7.71 95.33 98.44 5.55 48.74 25.05 2.82 47.97 26.30 coo -9.24 93.49 108.77 -7.37 94.21 109.61 3.98 57.48 21.66 3.28 59.10 22.89 coo -14.64 87.74 89.51 -12.89 87.43 90.65 9.63 38.15 19.81 7.90 38.49 20.93 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 D 137 ARG B 11 ARG^? 15.69 O ACT A 123 D 141 THR B 14 THR^? 15.08 C2 EDO B 124 D 235 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo -8.33 92.80 100.06 -7.71 95.33 98.44 -2.30 47.71 11.46 -0.79 44.99 11.29 coo -9.24 93.49 108.77 -7.37 94.21 109.61 -3.15 46.62 0.75 -1.23 46.14 1.47 coo -14.64 87.74 89.51 -12.89 87.43 90.65 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 D 137 ARG B 36 ARG^? 14.13 O1 EDO B 124 D 141 THR B 56 THR^? 10.83 C3 PEG B 126 D 235 ASP B 13 ASP^? 17.03 O1 EDO B 124 coo -8.33 92.80 100.06 -7.71 95.33 98.44 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo -9.24 93.49 108.77 -7.37 94.21 109.61 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -14.64 87.74 89.51 -12.89 87.43 90.65 -6.23 48.66 3.73 -7.41 46.97 3.18 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 D 137 ARG B 105 ARG^? 8.10 C1 PEG B 126 D 141 THR B 103 THR^? 13.94 C1 EDO B 125 D 235 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo -8.33 92.80 100.06 -7.71 95.33 98.44 8.93 56.93 -21.13 11.75 56.76 -22.27 coo -9.24 93.49 108.77 -7.37 94.21 109.61 10.26 64.09 -15.02 10.94 66.08 -15.56 coo -14.64 87.74 89.51 -12.89 87.43 90.65 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 D 137 ARG B 105 ARG^? 8.10 C1 PEG B 126 D 141 THR B 103 THR^? 13.94 C1 EDO B 125 D 235 ASP B 109 ASP^? -4.16 O4 PEG B 126s coo -8.33 92.80 100.06 -7.71 95.33 98.44 8.93 56.93 -21.13 11.75 56.76 -22.27 coo -9.24 93.49 108.77 -7.37 94.21 109.61 10.26 64.09 -15.02 10.94 66.08 -15.56 coo -14.64 87.74 89.51 -12.89 87.43 90.65 4.45 45.35 -19.96 6.21 46.00 -20.89 1bd3_c01 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 6 hits 1bd3_c01 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG A 11 ARG^? -8.10 O1 EDO A 124s C 141 THR A 14 THR.? 8.58 O1 EDO A 124 C 235 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo -5.79 67.26 36.83 -4.57 64.58 37.74 16.32 51.23 -8.65 14.73 48.69 -9.52 coo -6.81 68.31 28.28 -4.82 68.47 27.57 17.20 46.38 0.71 15.18 46.20 -0.03 coo -13.01 70.96 47.58 -11.44 71.65 46.34 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 C 137 ARG A 36 ARG^? -3.17 O2 EDO A 125s C 141 THR A 56 THR^? 7.33 C2 EDO A 125 C 235 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo -5.79 67.26 36.83 -4.57 64.58 37.74 24.38 48.23 13.15 25.39 47.42 15.97 coo -6.81 68.31 28.28 -4.82 68.47 27.57 17.43 43.07 17.55 19.51 43.25 18.06 coo -13.01 70.96 47.58 -11.44 71.65 46.34 20.17 49.39 -1.56 21.38 47.59 -1.63 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 C 137 ARG A 105 ARG^? 7.37 O1 EDO A 126 C 141 THR A 103 THR^? 10.25 OXT ACT A 123 C 235 ASP A 32 ASP.? 9.00 C2 EDO A 125 coo -5.79 67.26 36.83 -4.57 64.58 37.74 5.55 48.74 25.05 2.82 47.97 26.30 coo -6.81 68.31 28.28 -4.82 68.47 27.57 3.98 57.48 21.66 3.28 59.10 22.89 coo -13.01 70.96 47.58 -11.44 71.65 46.34 20.30 44.49 25.52 20.49 42.41 25.06 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 C 137 ARG A 105 ARG^? 7.37 O1 EDO A 126 C 141 THR A 103 THR^? 10.25 OXT ACT A 123 C 235 ASP A 109 ASP^? -4.58 O2 EDO A 126s coo -5.79 67.26 36.83 -4.57 64.58 37.74 5.55 48.74 25.05 2.82 47.97 26.30 coo -6.81 68.31 28.28 -4.82 68.47 27.57 3.98 57.48 21.66 3.28 59.10 22.89 coo -13.01 70.96 47.58 -11.44 71.65 46.34 9.63 38.15 19.81 7.90 38.49 20.93 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 C 137 ARG B 36 ARG^? 14.13 O1 EDO B 124 C 141 THR B 56 THR^? 10.83 C3 PEG B 126 C 235 ASP B 13 ASP^? 17.03 O1 EDO B 124 coo -5.79 67.26 36.83 -4.57 64.58 37.74 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo -6.81 68.31 28.28 -4.82 68.47 27.57 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -13.01 70.96 47.58 -11.44 71.65 46.34 -6.23 48.66 3.73 -7.41 46.97 3.18 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 C 137 ARG B 105 ARG^? 8.10 C1 PEG B 126 C 141 THR B 103 THR^? 13.94 C1 EDO B 125 C 235 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo -5.79 67.26 36.83 -4.57 64.58 37.74 8.93 56.93 -21.13 11.75 56.76 -22.27 coo -6.81 68.31 28.28 -4.82 68.47 27.57 10.26 64.09 -15.02 10.94 66.08 -15.56 coo -13.01 70.96 47.58 -11.44 71.65 46.34 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 7 3 # 7 C 137 ARG B 105 ARG^? 8.10 C1 PEG B 126 C 141 THR B 103 THR^? 13.94 C1 EDO B 125 C 235 ASP B 109 ASP^? -4.16 O4 PEG B 126s coo -5.79 67.26 36.83 -4.57 64.58 37.74 8.93 56.93 -21.13 11.75 56.76 -22.27 coo -6.81 68.31 28.28 -4.82 68.47 27.57 10.26 64.09 -15.02 10.94 66.08 -15.56 coo -13.01 70.96 47.58 -11.44 71.65 46.34 4.45 45.35 -19.96 6.21 46.00 -20.89 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 7 hits 1bd3_c02 naa= 3 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 B 137 ARG A 36 ARG^? -3.17 O2 EDO A 125s B 141 THR A 56 THR^? 7.33 C2 EDO A 125 B 235 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 8.13 67.41 100.27 7.18 68.35 97.45 24.38 48.23 13.15 25.39 47.42 15.97 coo 8.28 67.78 108.81 6.22 67.65 109.43 17.43 43.07 17.55 19.51 43.25 18.06 coo 14.55 73.52 89.47 12.81 73.95 90.56 20.17 49.39 -1.56 21.38 47.59 -1.63 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 B 137 ARG A 105 ARG^? 7.37 O1 EDO A 126 B 141 THR A 103 THR^? 10.25 OXT ACT A 123 B 235 ASP A 32 ASP.? 9.00 C2 EDO A 125 coo 8.13 67.41 100.27 7.18 68.35 97.45 5.55 48.74 25.05 2.82 47.97 26.30 coo 8.28 67.78 108.81 6.22 67.65 109.43 3.98 57.48 21.66 3.28 59.10 22.89 coo 14.55 73.52 89.47 12.81 73.95 90.56 20.30 44.49 25.52 20.49 42.41 25.06 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 B 137 ARG A 105 ARG^? 7.37 O1 EDO A 126 B 141 THR A 103 THR^? 10.25 OXT ACT A 123 B 235 ASP A 109 ASP^? -4.58 O2 EDO A 126s coo 8.13 67.41 100.27 7.18 68.35 97.45 5.55 48.74 25.05 2.82 47.97 26.30 coo 8.28 67.78 108.81 6.22 67.65 109.43 3.98 57.48 21.66 3.28 59.10 22.89 coo 14.55 73.52 89.47 12.81 73.95 90.56 9.63 38.15 19.81 7.90 38.49 20.93 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 B 137 ARG B 27 ARG^? 11.58 C1 EDO B 125 B 141 THR B 64 THR^? 7.68 C1 EDO B 125 B 235 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 8.13 67.41 100.27 7.18 68.35 97.45 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 8.28 67.78 108.81 6.22 67.65 109.43 6.89 65.75 -9.40 8.01 63.98 -8.88 coo 14.55 73.52 89.47 12.81 73.95 90.56 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 B 137 ARG B 27 ARG^? 11.58 C1 EDO B 125 B 141 THR B 103 THR^? 13.94 C1 EDO B 125 B 235 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 8.13 67.41 100.27 7.18 68.35 97.45 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 8.28 67.78 108.81 6.22 67.65 109.43 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 14.55 73.52 89.47 12.81 73.95 90.56 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 B 137 ARG B 36 ARG^? 14.13 O1 EDO B 124 B 141 THR B 56 THR^? 10.83 C3 PEG B 126 B 235 ASP B 13 ASP^? 17.03 O1 EDO B 124 coo 8.13 67.41 100.27 7.18 68.35 97.45 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo 8.28 67.78 108.81 6.22 67.65 109.43 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo 14.55 73.52 89.47 12.81 73.95 90.56 -6.23 48.66 3.73 -7.41 46.97 3.18 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 7 3 # 7 B 137 ARG B 105 ARG^? 8.10 C1 PEG B 126 B 141 THR B 103 THR^? 13.94 C1 EDO B 125 B 235 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 8.13 67.41 100.27 7.18 68.35 97.45 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 8.28 67.78 108.81 6.22 67.65 109.43 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 14.55 73.52 89.47 12.81 73.95 90.56 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 8 3 # 8 B 137 ARG B 105 ARG^? 8.10 C1 PEG B 126 B 141 THR B 103 THR^? 13.94 C1 EDO B 125 B 235 ASP B 109 ASP^? -4.16 O4 PEG B 126s coo 8.13 67.41 100.27 7.18 68.35 97.45 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 8.28 67.78 108.81 6.22 67.65 109.43 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 14.55 73.52 89.47 12.81 73.95 90.56 4.45 45.35 -19.96 6.21 46.00 -20.89 1bd3_c03 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 8 hits 1bd3_c03 naa= 3 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 1 3 # 1 14 ASP A 5 ASP.? 11.32 O1 EDO B 123 16 HIS A 4 HIS.? 6.54 O1 EDO A 128 67 GLY A 15 GLY.? 7.73 O2 EDO A 124 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 20.60 64.37 -9.63 20.20 65.77 -11.14 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 20.36 44.24 0.16 20.26 44.88 0.74 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 2 3 # 2 14 ASP A 82 ASP.? 12.57 OXT ACT A 123 16 HIS A 88 HIS^? 13.90 OXT ACT A 123 67 GLY A 31 GLY^? 7.19 O2 EDO A 126 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -1.93 52.21 20.42 -1.91 52.01 18.28 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 15.93 43.70 26.69 16.04 44.49 26.98 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 3 3 # 3 14 ASP A 82 ASP.? 12.57 OXT ACT A 123 16 HIS A 88 HIS^? 13.90 OXT ACT A 123 67 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -1.93 52.21 20.42 -1.91 52.01 18.28 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 0.61 67.88 8.18 -0.15 67.82 7.90 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 4 3 # 4 14 ASP A 94 ASP.? 16.52 O ACT A 123 16 HIS A 72 HIS^? 15.66 C2 EDO B 124 67 GLY A 23 GLY^? -4.10 O1 EDO A 125s coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 2.85 44.85 7.76 1.66 43.09 7.95 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 6.89 48.41 3.38 5.73 47.19 2.13 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 22.34 53.08 17.55 22.37 52.24 17.58 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 5 3 # 5 14 ASP A 94 ASP.? 16.52 O ACT A 123 16 HIS A 72 HIS^? 15.66 C2 EDO B 124 67 GLY A 66 GLY.? 8.10 O1 EDO A 127 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 2.85 44.85 7.76 1.66 43.09 7.95 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 6.89 48.41 3.38 5.73 47.19 2.13 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 7.39 66.84 15.28 7.11 66.12 15.09 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 6 3 # 6 14 ASP A 94 ASP.? 16.52 O ACT A 123 16 HIS A 72 HIS^? 15.66 C2 EDO B 124 67 GLY A 101 GLY^? 10.82 OXT ACT A 123 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 2.85 44.85 7.76 1.66 43.09 7.95 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 6.89 48.41 3.38 5.73 47.19 2.13 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 3.01 62.75 18.31 2.94 62.11 17.83 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 7 3 # 7 14 ASP A 94 ASP.? 16.52 O ACT A 123 16 HIS A 72 HIS^? 15.66 C2 EDO B 124 67 GLY B 43 GLY^? 12.55 O2 EDO B 125 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 2.85 44.85 7.76 1.66 43.09 7.95 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 6.89 48.41 3.38 5.73 47.19 2.13 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -1.43 64.73 7.62 -1.31 65.01 6.86 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 8 3 # 8 14 ASP A 94 ASP.? 16.52 O ACT A 123 16 HIS A 72 HIS^? 15.66 C2 EDO B 124 67 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 2.85 44.85 7.76 1.66 43.09 7.95 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 6.89 48.41 3.38 5.73 47.19 2.13 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 0.61 67.88 8.18 -0.15 67.82 7.90 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 9 3 # 9 14 ASP B 5 ASP^? 17.31 OXT ACT A 123 16 HIS B 4 HIS^? 16.30 OXT ACT A 123 67 GLY A 93 GLY.? 17.43 O ACT A 123 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -6.45 59.57 16.94 -6.05 60.31 18.88 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 5.07 43.20 3.81 5.07 43.46 4.54 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 10 3 # 10 14 ASP B 5 ASP^? 17.31 OXT ACT A 123 16 HIS B 4 HIS^? 16.30 OXT ACT A 123 67 GLY B 15 GLY^? 17.15 C2 EDO B 124 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 -6.45 59.57 16.94 -6.05 60.31 18.88 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -6.29 44.44 0.22 -6.18 45.23 -0.09 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 11 3 # 11 14 ASP B 82 ASP^? 7.08 O1 EDO B 123 16 HIS B 88 HIS^? 7.16 O1 EDO B 123 67 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 16.23 58.63 -15.55 16.12 57.73 -13.62 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 12 3 # 12 14 ASP B 82 ASP^? 7.08 O1 EDO B 123 16 HIS B 88 HIS^? 7.16 O1 EDO B 123 67 GLY B 31 GLY^? 6.91 C3 PEG B 126 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 16.23 58.63 -15.55 16.12 57.73 -13.62 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -1.76 52.92 -24.37 -1.97 53.59 -24.25 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 13 3 # 13 14 ASP B 94 ASP^? 10.22 O1 EDO A 124 16 HIS B 72 HIS^? 13.54 O1 EDO A 124 67 GLY A 43 GLY^? 7.66 O1 EDO A 128 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 15.75 65.96 0.86 15.59 65.90 1.67 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 14 3 # 14 14 ASP B 94 ASP^? 10.22 O1 EDO A 124 16 HIS B 72 HIS^? 13.54 O1 EDO A 124 67 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 15 3 # 15 14 ASP B 94 ASP^? 10.22 O1 EDO A 124 16 HIS B 72 HIS^? 13.54 O1 EDO A 124 67 GLY B 23 GLY^? 9.48 O1 EDO B 124 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -7.84 58.99 -12.71 -7.94 58.25 -13.11 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 16 3 # 16 14 ASP B 94 ASP^? 10.22 O1 EDO A 124 16 HIS B 72 HIS^? 13.54 O1 EDO A 124 67 GLY B 66 GLY^? 8.25 C1 EDO B 125 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 6.69 70.61 -5.68 6.96 69.89 -5.76 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 17 3 # 17 14 ASP B 94 ASP^? 10.22 O1 EDO A 124 16 HIS B 72 HIS^? 13.54 O1 EDO A 124 67 GLY B 101 GLY^? 11.26 C1 EDO B 125 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 11.02 67.85 -9.89 11.10 67.10 -9.69 1be1_c02 source 1be1 GLUTAMATE MUTASE : 17 hits 1be1_c02 naa= 3 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 # 1 A 461 GLU A 49 GLU^? 5.11 O2 EDO A 127 A 503 TYR A 67 TYR^? -4.09 C2 EDO A 127s A 537 GLU A 69 GLU^? 4.98 OXT ACT A 123 coo 24.06 146.21 11.09 22.89 146.18 9.36 16.74 60.19 6.60 17.85 60.24 8.39 coo 15.91 140.69 8.32 15.71 143.39 9.13 9.19 62.70 13.11 10.16 60.66 14.79 coo 16.65 144.44 13.24 18.34 145.22 12.33 8.76 56.68 10.43 10.20 56.07 11.84 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 2 3 # 2 A 461 GLU B 49 GLU^? -4.87 O2 EDO B 125s A 503 TYR B 67 TYR^? -3.57 C1 EDO B 125s A 537 GLU B 69 GLU^? -2.92 O2 EDO B 124s coo 24.06 146.21 11.09 22.89 146.18 9.36 -2.74 61.61 0.34 -3.60 61.93 -1.53 coo 15.91 140.69 8.32 15.71 143.39 9.13 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 16.65 144.44 13.24 18.34 145.22 12.33 5.26 59.46 -4.72 3.83 59.41 -6.26 1bgl_c08 source 1bgl BETA-GALACTOSIDASE : 2 hits 1bgl_c08 naa= 3 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 1 3 # 1 118 ARG A 36 ARG^? -3.17 O2 EDO A 125s 183 LYS A 113 LYS^? 12.75 O2 EDO A 124 317 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 76.57 109.19 73.41 73.86 110.26 72.16 24.38 48.23 13.15 25.39 47.42 15.97 coo 82.09 117.51 66.37 80.60 114.32 71.44 13.93 45.27 9.54 19.06 43.44 6.58 coo 65.21 120.62 58.76 63.62 123.14 59.66 16.32 51.23 -8.65 14.73 48.69 -9.52 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 2 3 # 2 118 ARG A 36 ARG^? -3.17 O2 EDO A 125s 183 LYS A 113 LYS^? 12.75 O2 EDO A 124 317 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 76.57 109.19 73.41 73.86 110.26 72.16 24.38 48.23 13.15 25.39 47.42 15.97 coo 82.09 117.51 66.37 80.60 114.32 71.44 13.93 45.27 9.54 19.06 43.44 6.58 coo 65.21 120.62 58.76 63.62 123.14 59.66 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 3 3 # 3 118 ARG A 36 ARG^? -3.17 O2 EDO A 125s 183 LYS A 113 LYS^? 12.75 O2 EDO A 124 317 ARG A 105 ARG^? 7.37 O1 EDO A 126 coo 76.57 109.19 73.41 73.86 110.26 72.16 24.38 48.23 13.15 25.39 47.42 15.97 coo 82.09 117.51 66.37 80.60 114.32 71.44 13.93 45.27 9.54 19.06 43.44 6.58 coo 65.21 120.62 58.76 63.62 123.14 59.66 5.55 48.74 25.05 2.82 47.97 26.30 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 4 3 # 4 118 ARG A 36 ARG^? -3.17 O2 EDO A 125s 183 LYS A 114 LYS^? 4.03 O ACT A 123 317 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 76.57 109.19 73.41 73.86 110.26 72.16 24.38 48.23 13.15 25.39 47.42 15.97 coo 82.09 117.51 66.37 80.60 114.32 71.44 11.95 48.07 7.92 11.03 52.28 12.68 coo 65.21 120.62 58.76 63.62 123.14 59.66 16.32 51.23 -8.65 14.73 48.69 -9.52 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 5 3 # 5 118 ARG A 36 ARG^? -3.17 O2 EDO A 125s 183 LYS A 114 LYS^? 4.03 O ACT A 123 317 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 76.57 109.19 73.41 73.86 110.26 72.16 24.38 48.23 13.15 25.39 47.42 15.97 coo 82.09 117.51 66.37 80.60 114.32 71.44 11.95 48.07 7.92 11.03 52.28 12.68 coo 65.21 120.62 58.76 63.62 123.14 59.66 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 6 3 # 6 118 ARG A 36 ARG^? -3.17 O2 EDO A 125s 183 LYS A 114 LYS^? 4.03 O ACT A 123 317 ARG A 105 ARG^? 7.37 O1 EDO A 126 coo 76.57 109.19 73.41 73.86 110.26 72.16 24.38 48.23 13.15 25.39 47.42 15.97 coo 82.09 117.51 66.37 80.60 114.32 71.44 11.95 48.07 7.92 11.03 52.28 12.68 coo 65.21 120.62 58.76 63.62 123.14 59.66 5.55 48.74 25.05 2.82 47.97 26.30 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 7 3 # 7 118 ARG A 79 ARG^? -4.30 O1 EDO A 126s 183 LYS A 91 LYS^? 18.66 O2 EDO A 126 317 ARG A 36 ARG^? -3.17 O2 EDO A 125s coo 76.57 109.19 73.41 73.86 110.26 72.16 2.90 41.63 20.04 5.49 40.23 20.98 coo 82.09 117.51 66.37 80.60 114.32 71.44 5.43 41.25 9.74 2.02 38.13 6.82 coo 65.21 120.62 58.76 63.62 123.14 59.66 24.38 48.23 13.15 25.39 47.42 15.97 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 8 3 # 8 118 ARG B 36 ARG^? 14.13 O1 EDO B 124 183 LYS B 113 LYS^? 13.71 C2 EDO B 124 317 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 76.57 109.19 73.41 73.86 110.26 72.16 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo 82.09 117.51 66.37 80.60 114.32 71.44 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 65.21 120.62 58.76 63.62 123.14 59.66 3.96 65.71 -18.47 3.56 68.28 -16.63 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 9 3 # 9 118 ARG B 36 ARG^? 14.13 O1 EDO B 124 183 LYS B 113 LYS^? 13.71 C2 EDO B 124 317 ARG B 105 ARG^? 8.10 C1 PEG B 126 coo 76.57 109.19 73.41 73.86 110.26 72.16 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo 82.09 117.51 66.37 80.60 114.32 71.44 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 65.21 120.62 58.76 63.62 123.14 59.66 8.93 56.93 -21.13 11.75 56.76 -22.27 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 10 3 # 10 118 ARG B 36 ARG^? 14.13 O1 EDO B 124 183 LYS B 114 LYS^? -2.62 O2 EDO B 124s 317 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 76.57 109.19 73.41 73.86 110.26 72.16 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo 82.09 117.51 66.37 80.60 114.32 71.44 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 65.21 120.62 58.76 63.62 123.14 59.66 3.96 65.71 -18.47 3.56 68.28 -16.63 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 11 3 # 11 118 ARG B 36 ARG^? 14.13 O1 EDO B 124 183 LYS B 114 LYS^? -2.62 O2 EDO B 124s 317 ARG B 105 ARG^? 8.10 C1 PEG B 126 coo 76.57 109.19 73.41 73.86 110.26 72.16 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo 82.09 117.51 66.37 80.60 114.32 71.44 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 65.21 120.62 58.76 63.62 123.14 59.66 8.93 56.93 -21.13 11.75 56.76 -22.27 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 12 3 # 12 118 ARG B 79 ARG^? -4.39 C1 PEG B 126s 183 LYS B 91 LYS^? 13.69 O1 EDO A 124 317 ARG B 36 ARG^? 14.13 O1 EDO B 124 coo 76.57 109.19 73.41 73.86 110.26 72.16 11.19 48.56 -18.94 8.63 47.63 -20.34 coo 82.09 117.51 66.37 80.60 114.32 71.44 8.58 44.72 -9.41 12.21 41.02 -7.65 coo 65.21 120.62 58.76 63.62 123.14 59.66 -10.17 52.84 -10.41 -11.23 53.10 -13.33 1bib_c00 source 1bib BIRA BIFUNCTIONAL PROTEIN (ACTS AS BIOTIN OPER: 12 hits 1bib_c00 naa= 3 ULMN 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 # 1 A 757 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 759 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 810 SER A 7 SER.? 11.72 O1 EDO B 123 coo 30.11 61.02 29.12 29.36 59.77 27.63 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 30.94 56.62 25.28 29.94 54.94 26.14 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 25.05 62.74 29.97 26.88 61.45 29.19 16.55 63.58 -12.78 16.44 65.52 -14.23 ULMN 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 2 3 # 2 A 757 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 759 HIS A 88 HIS^? 13.90 OXT ACT A 123 A 810 SER B 7 SER^? 13.90 OXT ACT A 123 coo 30.11 61.02 29.12 29.36 59.77 27.63 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 30.94 56.62 25.28 29.94 54.94 26.14 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 25.05 62.74 29.97 26.88 61.45 29.19 -2.26 57.69 19.56 -2.09 59.00 21.60 ULMN 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 3 3 # 3 A 757 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 759 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 810 SER B 7 SER^? 13.90 OXT ACT A 123 coo 30.11 61.02 29.12 29.36 59.77 27.63 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 30.94 56.62 25.28 29.94 54.94 26.14 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 25.05 62.74 29.97 26.88 61.45 29.19 -2.26 57.69 19.56 -2.09 59.00 21.60 ULMN 3 1bmt_c04 METHIONINE SYNTHASE (B12-BINDING DOMuser 4 3 # 4 A 757 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 759 HIS B 88 HIS^? 7.16 O1 EDO B 123 A 810 SER A 7 SER.? 11.72 O1 EDO B 123 coo 30.11 61.02 29.12 29.36 59.77 27.63 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 30.94 56.62 25.28 29.94 54.94 26.14 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 25.05 62.74 29.97 26.88 61.45 29.19 16.55 63.58 -12.78 16.44 65.52 -14.23 1bmt_c04 source 1bmt METHIONINE SYNTHASE (B12-BINDING DOMAINS) (E.C: 4 hits 1bmt_c04 naa= 3 ULMN 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 1 3 # 1 B 757 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 759 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 810 SER A 7 SER.? 11.72 O1 EDO B 123 coo -2.30 64.08 6.41 -0.36 64.72 6.26 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 1.96 66.39 3.07 2.10 68.48 3.58 18.39 63.32 -4.14 17.16 64.86 -3.40 coo -1.50 63.90 11.86 -1.31 64.33 9.52 16.55 63.58 -12.78 16.44 65.52 -14.23 ULMN 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 2 3 # 2 B 757 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 759 HIS A 88 HIS^? 13.90 OXT ACT A 123 B 810 SER B 7 SER^? 13.90 OXT ACT A 123 coo -2.30 64.08 6.41 -0.36 64.72 6.26 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 1.96 66.39 3.07 2.10 68.48 3.58 -1.51 48.14 15.79 -3.04 49.51 16.18 coo -1.50 63.90 11.86 -1.31 64.33 9.52 -2.26 57.69 19.56 -2.09 59.00 21.60 ULMN 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 3 3 # 3 B 757 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 759 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 810 SER B 7 SER^? 13.90 OXT ACT A 123 coo -2.30 64.08 6.41 -0.36 64.72 6.26 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 1.96 66.39 3.07 2.10 68.48 3.58 -4.28 60.61 11.46 -3.09 62.30 11.15 coo -1.50 63.90 11.86 -1.31 64.33 9.52 -2.26 57.69 19.56 -2.09 59.00 21.60 ULMN 3 1bmt_c05 METHIONINE SYNTHASE (B12-BINDING DOMuser 4 3 # 4 B 757 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 759 HIS B 88 HIS^? 7.16 O1 EDO B 123 B 810 SER A 7 SER.? 11.72 O1 EDO B 123 coo -2.30 64.08 6.41 -0.36 64.72 6.26 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 1.96 66.39 3.07 2.10 68.48 3.58 15.57 53.23 -12.61 17.12 54.63 -12.48 coo -1.50 63.90 11.86 -1.31 64.33 9.52 16.55 63.58 -12.78 16.44 65.52 -14.23 1bmt_c05 source 1bmt METHIONINE SYNTHASE (B12-BINDING DOMAINS) (E.C: 4 hits 1bmt_c05 naa= 3 ULMN 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 1 3 # 1 A 53 SER A 7 SER.? 11.72 O1 EDO B 123 A 54 PRO B 99 PRO^? 10.99 O1 EDO A 128 A 96 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo -9.03 45.15 44.45 -7.51 43.26 44.28 16.55 63.58 -12.78 16.44 65.52 -14.23 coo -12.82 46.62 43.11 -11.69 44.75 42.79 14.86 62.43 -7.25 12.79 62.68 -6.39 coo -5.86 47.39 44.34 -4.55 46.60 42.83 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1boo_c00 N-4 CYTOSINE-SPECIFIC METHYLTRANSFERuser 2 3 # 2 A 53 SER B 7 SER^? 13.90 OXT ACT A 123 A 54 PRO A 99 PRO^? 11.11 OXT ACT A 123 A 96 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo -9.03 45.15 44.45 -7.51 43.26 44.28 -2.26 57.69 19.56 -2.09 59.00 21.60 coo -12.82 46.62 43.11 -11.69 44.75 42.79 -0.62 58.72 14.05 1.37 59.18 13.09 coo -5.86 47.39 44.34 -4.55 46.60 42.83 -6.45 59.57 16.94 -6.05 60.31 18.88 1boo_c00 source 1boo N-4 CYTOSINE-SPECIFIC METHYLTRANSFERASE PVU II: 2 hits 1boo_c00 naa= 3 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 1 3 # 1 30 GLY A 44 GLY.? 11.35 O1 EDO A 128 48 HIS A 4 HIS.? 6.54 O1 EDO A 128 99 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 12.38 5.55 24.25 13.27 5.59 24.39 13.50 68.96 1.57 14.29 68.84 1.77 coo 18.80 12.68 24.53 17.69 13.54 26.08 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 17.07 18.51 26.62 16.67 17.07 28.09 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 2 3 # 2 30 GLY A 93 GLY.? 17.43 O ACT A 123 48 HIS B 72 HIS^? 13.54 O1 EDO A 124 99 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 12.38 5.55 24.25 13.27 5.59 24.39 5.07 43.20 3.81 5.07 43.46 4.54 coo 18.80 12.68 24.53 17.69 13.54 26.08 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 17.07 18.51 26.62 16.67 17.07 28.09 11.18 47.39 -6.30 12.32 45.78 -7.12 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 3 3 # 3 30 GLY B 44 GLY^? 13.85 O2 EDO B 125 48 HIS B 4 HIS^? 16.30 OXT ACT A 123 99 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 12.38 5.55 24.25 13.27 5.59 24.39 0.61 67.88 8.18 -0.15 67.82 7.90 coo 18.80 12.68 24.53 17.69 13.54 26.08 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 17.07 18.51 26.62 16.67 17.07 28.09 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 4 3 # 4 30 GLY B 93 GLY^? 13.55 O1 EDO A 124 48 HIS A 72 HIS^? 15.66 C2 EDO B 124 99 ASP A 94 ASP.? 16.52 O ACT A 123 coo 12.38 5.55 24.25 13.27 5.59 24.39 8.78 44.49 -3.21 8.81 45.00 -3.81 coo 18.80 12.68 24.53 17.69 13.54 26.08 6.89 48.41 3.38 5.73 47.19 2.13 coo 17.07 18.51 26.62 16.67 17.07 28.09 2.85 44.85 7.76 1.66 43.09 7.95 1bp2_c00 source 1bp2 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSPHATIDE AC: 4 hits 1bp2_c00 naa= 3 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 # 1 B1082 HIS A 72 HIS^? 15.66 C2 EDO B 124 B1168 ARG B 11 ARG^? 15.69 O ACT A 123 B1187 LYS A 114 LYS^? 4.03 O ACT A 123 coo 35.03 5.72 103.61 36.82 5.00 102.79 6.89 48.41 3.38 5.73 47.19 2.13 coo 41.91 5.48 91.85 40.59 6.81 94.28 -2.30 47.71 11.46 -0.79 44.99 11.29 coo 32.93 -0.12 99.60 37.71 2.39 99.23 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 2 3 # 2 B1082 HIS B 72 HIS^? 13.54 O1 EDO A 124 B1168 ARG A 11 ARG^? -8.10 O1 EDO A 124s B1187 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 35.03 5.72 103.61 36.82 5.00 102.79 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 41.91 5.48 91.85 40.59 6.81 94.28 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 32.93 -0.12 99.60 37.71 2.39 99.23 1.96 50.52 -5.38 3.03 56.08 -8.37 1brw_c01 source 1brw PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE : 2 hits 1brw_c01 naa= 3 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 1 3 # 1 A 109 PHE A 117 PHE^? 10.80 O2 EDO A 127 A 205 ASP A 94 ASP.? 16.52 O ACT A 123 A 236 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 4.14 2.10 36.34 6.69 3.08 36.92 9.48 58.60 3.19 9.65 60.80 1.54 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 2.85 44.85 7.76 1.66 43.09 7.95 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 2 3 # 2 A 109 PHE A 117 PHE^? 10.80 O2 EDO A 127 A 205 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 236 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 4.14 2.10 36.34 6.69 3.08 36.92 9.48 58.60 3.19 9.65 60.80 1.54 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 3 3 # 3 A 109 PHE B 117 PHE^? 10.47 O2 EDO B 125 A 205 ASP A 94 ASP.? 16.52 O ACT A 123 A 236 LYS A 114 LYS^? 4.03 O ACT A 123 coo 4.14 2.10 36.34 6.69 3.08 36.92 4.63 58.62 2.81 4.66 60.10 5.16 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 2.85 44.85 7.76 1.66 43.09 7.95 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1bs0_c01 8-AMINO-7-OXONANOATE SYNTHASE user 4 3 # 4 A 109 PHE B 117 PHE^? 10.47 O2 EDO B 125 A 205 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 236 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 4.14 2.10 36.34 6.69 3.08 36.92 4.63 58.62 2.81 4.66 60.10 5.16 coo 0.29 -1.62 50.50 1.21 -2.50 52.18 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 6.34 -8.87 44.53 6.49 -3.84 42.65 0.03 48.55 -7.94 -5.29 45.92 -6.26 1bs0_c01 source 1bs0 8-AMINO-7-OXONANOATE SYNTHASE : 4 hits 1bs0_c01 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 5 ASP.? 11.32 O1 EDO B 123 264 GLU B 107 GLU^? -3.66 C1 PEG B 126s 328 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 45.62 80.42 43.69 45.65 82.01 45.07 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 59.69 92.71 39.85 58.53 92.03 41.47 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 45.39 90.72 40.63 45.07 89.14 41.90 20.02 60.63 -18.97 20.31 59.23 -17.40 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP A 13 ASP.? -3.81 O2 EDO A 124s 264 GLU B 69 GLU^? -2.92 O2 EDO B 124s 328 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 45.62 80.42 43.69 45.65 82.01 45.07 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 59.69 92.71 39.85 58.53 92.03 41.47 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 45.39 90.72 40.63 45.07 89.14 41.90 11.18 47.39 -6.30 12.32 45.78 -7.12 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 # 3 229 ASP A 82 ASP.? 12.57 OXT ACT A 123 264 GLU B 42 GLU^? 9.23 O2 EDO B 125 328 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 45.62 80.42 43.69 45.65 82.01 45.07 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 59.69 92.71 39.85 58.53 92.03 41.47 -4.84 63.10 3.03 -6.17 64.39 2.00 coo 45.39 90.72 40.63 45.07 89.14 41.90 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 # 4 229 ASP A 94 ASP.? 16.52 O ACT A 123 264 GLU B 42 GLU^? 9.23 O2 EDO B 125 328 ASP B 13 ASP^? 17.03 O1 EDO B 124 coo 45.62 80.42 43.69 45.65 82.01 45.07 2.85 44.85 7.76 1.66 43.09 7.95 coo 59.69 92.71 39.85 58.53 92.03 41.47 -4.84 63.10 3.03 -6.17 64.39 2.00 coo 45.39 90.72 40.63 45.07 89.14 41.90 -6.23 48.66 3.73 -7.41 46.97 3.18 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 5 3 # 5 229 ASP A 94 ASP.? 16.52 O ACT A 123 264 GLU B 49 GLU^? -4.87 O2 EDO B 125s 328 ASP B 13 ASP^? 17.03 O1 EDO B 124 coo 45.62 80.42 43.69 45.65 82.01 45.07 2.85 44.85 7.76 1.66 43.09 7.95 coo 59.69 92.71 39.85 58.53 92.03 41.47 -2.74 61.61 0.34 -3.60 61.93 -1.53 coo 45.39 90.72 40.63 45.07 89.14 41.90 -6.23 48.66 3.73 -7.41 46.97 3.18 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 6 3 # 6 229 ASP A 94 ASP.? 16.52 O ACT A 123 264 GLU B 54 GLU^? 12.15 C2 EDO B 124 328 ASP B 13 ASP^? 17.03 O1 EDO B 124 coo 45.62 80.42 43.69 45.65 82.01 45.07 2.85 44.85 7.76 1.66 43.09 7.95 coo 59.69 92.71 39.85 58.53 92.03 41.47 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 45.39 90.72 40.63 45.07 89.14 41.90 -6.23 48.66 3.73 -7.41 46.97 3.18 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 7 3 # 7 229 ASP B 5 ASP^? 17.31 OXT ACT A 123 264 GLU A 107 GLU^? -3.18 O1 EDO A 126s 328 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 45.62 80.42 43.69 45.65 82.01 45.07 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 59.69 92.71 39.85 58.53 92.03 41.47 6.31 45.06 22.90 4.64 44.18 23.93 coo 45.39 90.72 40.63 45.07 89.14 41.90 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 8 3 # 8 229 ASP B 13 ASP^? 17.03 O1 EDO B 124 264 GLU A 69 GLU^? 4.98 OXT ACT A 123 328 ASP A 94 ASP.? 16.52 O ACT A 123 coo 45.62 80.42 43.69 45.65 82.01 45.07 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 59.69 92.71 39.85 58.53 92.03 41.47 8.76 56.68 10.43 10.20 56.07 11.84 coo 45.39 90.72 40.63 45.07 89.14 41.90 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 9 3 # 9 229 ASP B 82 ASP^? 7.08 O1 EDO B 123 264 GLU A 42 GLU^? -4.18 C1 EDO A 128s 328 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 45.62 80.42 43.69 45.65 82.01 45.07 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 59.69 92.71 39.85 58.53 92.03 41.47 19.47 62.47 4.05 21.30 62.78 5.02 coo 45.39 90.72 40.63 45.07 89.14 41.90 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 10 3 # 10 229 ASP B 94 ASP^? 10.22 O1 EDO A 124 264 GLU A 42 GLU^? -4.18 C1 EDO A 128s 328 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 45.62 80.42 43.69 45.65 82.01 45.07 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 59.69 92.71 39.85 58.53 92.03 41.47 19.47 62.47 4.05 21.30 62.78 5.02 coo 45.39 90.72 40.63 45.07 89.14 41.90 20.17 49.39 -1.56 21.38 47.59 -1.63 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 11 3 # 11 229 ASP B 94 ASP^? 10.22 O1 EDO A 124 264 GLU A 49 GLU^? 5.11 O2 EDO A 127 328 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 45.62 80.42 43.69 45.65 82.01 45.07 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 59.69 92.71 39.85 58.53 92.03 41.47 16.74 60.19 6.60 17.85 60.24 8.39 coo 45.39 90.72 40.63 45.07 89.14 41.90 20.17 49.39 -1.56 21.38 47.59 -1.63 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 12 3 # 12 229 ASP B 94 ASP^? 10.22 O1 EDO A 124 264 GLU A 54 GLU^? 10.26 O1 EDO A 125 328 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 45.62 80.42 43.69 45.65 82.01 45.07 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 59.69 92.71 39.85 58.53 92.03 41.47 19.19 45.91 11.58 20.09 44.01 11.30 coo 45.39 90.72 40.63 45.07 89.14 41.90 20.17 49.39 -1.56 21.38 47.59 -1.63 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 12 hits 1cdg_c00 naa= 3 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 A 198 GLY A 23 GLY^? -4.10 O1 EDO A 125s A 228 SER A 34 SER.? -3.56 C2 EDO A 125s A 549 ASP A 32 ASP.? 9.00 C2 EDO A 125 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 22.34 53.08 17.55 22.37 52.24 17.58 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 20.28 47.66 19.28 22.08 46.10 18.94 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 20.30 44.49 25.52 20.49 42.41 25.06 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 # 2 A 198 GLY A 31 GLY^? 7.19 O2 EDO A 126 A 228 SER A 57 SER^? 6.85 O2 EDO A 126 A 549 ASP A 109 ASP^? -4.58 O2 EDO A 126s coo 43.62 -9.31 54.06 43.04 -9.29 54.58 15.93 43.70 26.69 16.04 44.49 26.98 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 15.14 41.83 20.35 16.25 40.17 21.70 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 9.63 38.15 19.81 7.90 38.49 20.93 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 3 3 # 3 A 198 GLY A 101 GLY^? 10.82 OXT ACT A 123 A 228 SER B 7 SER^? 13.90 OXT ACT A 123 A 549 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 3.01 62.75 18.31 2.94 62.11 17.83 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 4 3 # 4 A 198 GLY A 101 GLY^? 10.82 OXT ACT A 123 A 228 SER B 7 SER^? 13.90 OXT ACT A 123 A 549 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 3.01 62.75 18.31 2.94 62.11 17.83 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 5 3 # 5 A 198 GLY A 104 GLY^? 8.46 OXT ACT A 123 A 228 SER B 7 SER^? 13.90 OXT ACT A 123 A 549 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 3.30 53.73 21.39 4.06 54.12 21.33 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 6 3 # 6 A 198 GLY B 23 GLY^? 9.48 O1 EDO B 124 A 228 SER B 34 SER^? 13.24 C2 EDO B 124 A 549 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 -7.84 58.99 -12.71 -7.94 58.25 -13.11 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 -6.11 54.18 -16.40 -8.31 53.39 -15.87 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 7 3 # 7 A 198 GLY B 31 GLY^? 6.91 C3 PEG B 126 A 228 SER B 57 SER^? 6.28 O4 PEG B 126 A 549 ASP B 109 ASP^? -4.16 O4 PEG B 126s coo 43.62 -9.31 54.06 43.04 -9.29 54.58 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 4.45 45.35 -19.96 6.21 46.00 -20.89 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 8 3 # 8 A 198 GLY B 101 GLY^? 11.26 C1 EDO B 125 A 228 SER A 7 SER.? 11.72 O1 EDO B 123 A 549 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 11.02 67.85 -9.89 11.10 67.10 -9.69 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 9 3 # 9 A 198 GLY B 104 GLY^? 12.52 O1 EDO B 123 A 228 SER A 7 SER.? 11.72 O1 EDO B 123 A 549 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 11.05 60.46 -16.00 10.29 60.83 -15.82 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 20.02 60.63 -18.97 20.31 59.23 -17.40 1cjy_c00 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 9 hits 1cjy_c00 naa= 3 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 B1198 GLY A 23 GLY^? -4.10 O1 EDO A 125s B1228 SER A 34 SER.? -3.56 C2 EDO A 125s B1549 ASP A 32 ASP.? 9.00 C2 EDO A 125 coo 126.34 72.75 125.66 125.95 73.27 126.11 22.34 53.08 17.55 22.37 52.24 17.58 coo 131.65 74.68 129.41 130.31 72.73 128.82 20.28 47.66 19.28 22.08 46.10 18.94 coo 134.72 69.43 130.42 133.03 70.65 130.08 20.30 44.49 25.52 20.49 42.41 25.06 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 2 3 # 2 B1198 GLY A 31 GLY^? 7.19 O2 EDO A 126 B1228 SER A 57 SER^? 6.85 O2 EDO A 126 B1549 ASP A 109 ASP^? -4.58 O2 EDO A 126s coo 126.34 72.75 125.66 125.95 73.27 126.11 15.93 43.70 26.69 16.04 44.49 26.98 coo 131.65 74.68 129.41 130.31 72.73 128.82 15.14 41.83 20.35 16.25 40.17 21.70 coo 134.72 69.43 130.42 133.03 70.65 130.08 9.63 38.15 19.81 7.90 38.49 20.93 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 3 3 # 3 B1198 GLY A 101 GLY^? 10.82 OXT ACT A 123 B1228 SER B 7 SER^? 13.90 OXT ACT A 123 B1549 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 126.34 72.75 125.66 125.95 73.27 126.11 3.01 62.75 18.31 2.94 62.11 17.83 coo 131.65 74.68 129.41 130.31 72.73 128.82 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 134.72 69.43 130.42 133.03 70.65 130.08 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 4 3 # 4 B1198 GLY A 101 GLY^? 10.82 OXT ACT A 123 B1228 SER B 7 SER^? 13.90 OXT ACT A 123 B1549 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 126.34 72.75 125.66 125.95 73.27 126.11 3.01 62.75 18.31 2.94 62.11 17.83 coo 131.65 74.68 129.41 130.31 72.73 128.82 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 134.72 69.43 130.42 133.03 70.65 130.08 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 5 3 # 5 B1198 GLY A 104 GLY^? 8.46 OXT ACT A 123 B1228 SER B 7 SER^? 13.90 OXT ACT A 123 B1549 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 126.34 72.75 125.66 125.95 73.27 126.11 3.30 53.73 21.39 4.06 54.12 21.33 coo 131.65 74.68 129.41 130.31 72.73 128.82 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 134.72 69.43 130.42 133.03 70.65 130.08 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 6 3 # 6 B1198 GLY B 23 GLY^? 9.48 O1 EDO B 124 B1228 SER B 34 SER^? 13.24 C2 EDO B 124 B1549 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 126.34 72.75 125.66 125.95 73.27 126.11 -7.84 58.99 -12.71 -7.94 58.25 -13.11 coo 131.65 74.68 129.41 130.31 72.73 128.82 -6.11 54.18 -16.40 -8.31 53.39 -15.87 coo 134.72 69.43 130.42 133.03 70.65 130.08 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 7 3 # 7 B1198 GLY B 31 GLY^? 6.91 C3 PEG B 126 B1228 SER B 57 SER^? 6.28 O4 PEG B 126 B1549 ASP B 109 ASP^? -4.16 O4 PEG B 126s coo 126.34 72.75 125.66 125.95 73.27 126.11 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 131.65 74.68 129.41 130.31 72.73 128.82 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo 134.72 69.43 130.42 133.03 70.65 130.08 4.45 45.35 -19.96 6.21 46.00 -20.89 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 8 3 # 8 B1198 GLY B 101 GLY^? 11.26 C1 EDO B 125 B1228 SER A 7 SER.? 11.72 O1 EDO B 123 B1549 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 126.34 72.75 125.66 125.95 73.27 126.11 11.02 67.85 -9.89 11.10 67.10 -9.69 coo 131.65 74.68 129.41 130.31 72.73 128.82 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 134.72 69.43 130.42 133.03 70.65 130.08 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 9 3 # 9 B1198 GLY B 101 GLY^? 11.26 C1 EDO B 125 B1228 SER A 7 SER.? 11.72 O1 EDO B 123 B1549 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 126.34 72.75 125.66 125.95 73.27 126.11 11.02 67.85 -9.89 11.10 67.10 -9.69 coo 131.65 74.68 129.41 130.31 72.73 128.82 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 134.72 69.43 130.42 133.03 70.65 130.08 16.23 58.63 -15.55 16.12 57.73 -13.62 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 10 3 # 10 B1198 GLY B 104 GLY^? 12.52 O1 EDO B 123 B1228 SER A 7 SER.? 11.72 O1 EDO B 123 B1549 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 126.34 72.75 125.66 125.95 73.27 126.11 11.05 60.46 -16.00 10.29 60.83 -15.82 coo 131.65 74.68 129.41 130.31 72.73 128.82 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 134.72 69.43 130.42 133.03 70.65 130.08 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 11 3 # 11 B1198 GLY B 104 GLY^? 12.52 O1 EDO B 123 B1228 SER A 7 SER.? 11.72 O1 EDO B 123 B1549 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 126.34 72.75 125.66 125.95 73.27 126.11 11.05 60.46 -16.00 10.29 60.83 -15.82 coo 131.65 74.68 129.41 130.31 72.73 128.82 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 134.72 69.43 130.42 133.03 70.65 130.08 20.02 60.63 -18.97 20.31 59.23 -17.40 1cjy_c01 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 11 hits 1cjy_c01 naa= 3 ULMN 3 1cms_c04 CHYMOSIN B (FORMERLY KNOWN AS RENNINuser 1 3 # 1 34 ASP B 5 ASP^? 17.31 OXT ACT A 123 37 SER B 7 SER^? 13.90 OXT ACT A 123 216 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 16.90 26.20 29.49 16.22 24.50 28.41 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 12.23 24.31 30.40 14.55 23.96 31.03 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 13.93 25.52 22.10 14.75 24.44 23.75 -5.66 53.01 24.37 -6.07 52.23 22.45 1cms_c04 source 1cms CHYMOSIN B (FORMERLY KNOWN AS RENNIN) (E.C.3.4: 1 hits 1cms_c04 naa= 3 ULMN 3 1cns_c00 CHITINASE user 1 3 # 1 A 67 GLU A 77 GLU^? 11.16 O2 EDO A 126 A 89 GLU A 107 GLU^? -3.18 O1 EDO A 126s A 120 SER A 57 SER^? 6.85 O2 EDO A 126 coo -24.35 9.53 67.64 -25.07 11.29 68.60 8.02 38.51 14.00 9.59 37.31 13.17 coo -31.18 6.91 75.60 -32.39 8.51 74.91 6.31 45.06 22.90 4.64 44.18 23.93 coo -34.73 8.57 68.21 -33.63 9.08 70.28 15.14 41.83 20.35 16.25 40.17 21.70 ULMN 3 1cns_c00 CHITINASE user 2 3 # 2 A 67 GLU A 100 GLU^? 12.02 O1 EDO A 127 A 89 GLU A 69 GLU^? 4.98 OXT ACT A 123 A 120 SER A 62 SER.? -2.76 OXT ACT A 123s coo -24.35 9.53 67.64 -25.07 11.29 68.60 3.40 65.53 14.62 2.89 66.21 16.58 coo -31.18 6.91 75.60 -32.39 8.51 74.91 8.76 56.68 10.43 10.20 56.07 11.84 coo -34.73 8.57 68.21 -33.63 9.08 70.28 8.49 55.74 20.24 8.16 54.20 18.38 ULMN 3 1cns_c00 CHITINASE user 3 3 # 3 A 67 GLU A 107 GLU^? -3.18 O1 EDO A 126s A 89 GLU A 77 GLU^? 11.16 O2 EDO A 126 A 120 SER A 57 SER^? 6.85 O2 EDO A 126 coo -24.35 9.53 67.64 -25.07 11.29 68.60 6.31 45.06 22.90 4.64 44.18 23.93 coo -31.18 6.91 75.60 -32.39 8.51 74.91 8.02 38.51 14.00 9.59 37.31 13.17 coo -34.73 8.57 68.21 -33.63 9.08 70.28 15.14 41.83 20.35 16.25 40.17 21.70 ULMN 3 1cns_c00 CHITINASE user 4 3 # 4 A 67 GLU B 77 GLU^? 10.85 O4 PEG B 126 A 89 GLU B 107 GLU^? -3.66 C1 PEG B 126s A 120 SER B 57 SER^? 6.28 O4 PEG B 126 coo -24.35 9.53 67.64 -25.07 11.29 68.60 6.00 43.66 -14.33 4.35 42.35 -13.99 coo -31.18 6.91 75.60 -32.39 8.51 74.91 7.84 52.79 -20.58 9.53 52.35 -21.72 coo -34.73 8.57 68.21 -33.63 9.08 70.28 -1.05 49.09 -19.26 -2.38 47.97 -20.95 ULMN 3 1cns_c00 CHITINASE user 5 3 # 5 A 67 GLU B 100 GLU^? 11.75 C1 EDO B 125 A 89 GLU B 69 GLU^? -2.92 O2 EDO B 124s A 120 SER B 62 SER^? 7.18 O2 EDO B 124 coo -24.35 9.53 67.64 -25.07 11.29 68.60 10.53 69.09 -5.55 11.13 70.44 -7.09 coo -31.18 6.91 75.60 -32.39 8.51 74.91 5.26 59.46 -4.72 3.83 59.41 -6.26 coo -34.73 8.57 68.21 -33.63 9.08 70.28 5.78 62.05 -14.51 6.16 59.94 -13.32 ULMN 3 1cns_c00 CHITINASE user 6 3 # 6 A 67 GLU B 107 GLU^? -3.66 C1 PEG B 126s A 89 GLU B 77 GLU^? 10.85 O4 PEG B 126 A 120 SER B 57 SER^? 6.28 O4 PEG B 126 coo -24.35 9.53 67.64 -25.07 11.29 68.60 7.84 52.79 -20.58 9.53 52.35 -21.72 coo -31.18 6.91 75.60 -32.39 8.51 74.91 6.00 43.66 -14.33 4.35 42.35 -13.99 coo -34.73 8.57 68.21 -33.63 9.08 70.28 -1.05 49.09 -19.26 -2.38 47.97 -20.95 1cns_c00 source 1cns CHITINASE : 6 hits 1cns_c00 naa= 3 ULMN 3 1cns_c01 CHITINASE user 1 3 # 1 B 67 GLU A 54 GLU^? 10.26 O1 EDO A 125 B 89 GLU A 77 GLU^? 11.16 O2 EDO A 126 B 120 SER A 57 SER^? 6.85 O2 EDO A 126 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 19.19 45.91 11.58 20.09 44.01 11.30 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 8.02 38.51 14.00 9.59 37.31 13.17 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 15.14 41.83 20.35 16.25 40.17 21.70 ULMN 3 1cns_c01 CHITINASE user 2 3 # 2 B 67 GLU A 77 GLU^? 11.16 O2 EDO A 126 B 89 GLU A 54 GLU^? 10.26 O1 EDO A 125 B 120 SER A 57 SER^? 6.85 O2 EDO A 126 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 8.02 38.51 14.00 9.59 37.31 13.17 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 19.19 45.91 11.58 20.09 44.01 11.30 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 15.14 41.83 20.35 16.25 40.17 21.70 ULMN 3 1cns_c01 CHITINASE user 3 3 # 3 B 67 GLU A 77 GLU^? 11.16 O2 EDO A 126 B 89 GLU A 107 GLU^? -3.18 O1 EDO A 126s B 120 SER A 57 SER^? 6.85 O2 EDO A 126 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 8.02 38.51 14.00 9.59 37.31 13.17 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 6.31 45.06 22.90 4.64 44.18 23.93 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 15.14 41.83 20.35 16.25 40.17 21.70 ULMN 3 1cns_c01 CHITINASE user 4 3 # 4 B 67 GLU A 100 GLU^? 12.02 O1 EDO A 127 B 89 GLU A 69 GLU^? 4.98 OXT ACT A 123 B 120 SER A 62 SER.? -2.76 OXT ACT A 123s coo 9.89 -17.65 45.79 9.28 -17.39 43.77 3.40 65.53 14.62 2.89 66.21 16.58 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 8.76 56.68 10.43 10.20 56.07 11.84 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 8.49 55.74 20.24 8.16 54.20 18.38 ULMN 3 1cns_c01 CHITINASE user 5 3 # 5 B 67 GLU A 107 GLU^? -3.18 O1 EDO A 126s B 89 GLU A 77 GLU^? 11.16 O2 EDO A 126 B 120 SER A 57 SER^? 6.85 O2 EDO A 126 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 6.31 45.06 22.90 4.64 44.18 23.93 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 8.02 38.51 14.00 9.59 37.31 13.17 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 15.14 41.83 20.35 16.25 40.17 21.70 ULMN 3 1cns_c01 CHITINASE user 6 3 # 6 B 67 GLU B 54 GLU^? 12.15 C2 EDO B 124 B 89 GLU B 77 GLU^? 10.85 O4 PEG B 126 B 120 SER B 57 SER^? 6.28 O4 PEG B 126 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 -1.05 49.09 -19.26 -2.38 47.97 -20.95 ULMN 3 1cns_c01 CHITINASE user 7 3 # 7 B 67 GLU B 77 GLU^? 10.85 O4 PEG B 126 B 89 GLU B 54 GLU^? 12.15 C2 EDO B 124 B 120 SER B 57 SER^? 6.28 O4 PEG B 126 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 -1.05 49.09 -19.26 -2.38 47.97 -20.95 ULMN 3 1cns_c01 CHITINASE user 8 3 # 8 B 67 GLU B 77 GLU^? 10.85 O4 PEG B 126 B 89 GLU B 107 GLU^? -3.66 C1 PEG B 126s B 120 SER B 57 SER^? 6.28 O4 PEG B 126 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 -1.05 49.09 -19.26 -2.38 47.97 -20.95 ULMN 3 1cns_c01 CHITINASE user 9 3 # 9 B 67 GLU B 100 GLU^? 11.75 C1 EDO B 125 B 89 GLU B 69 GLU^? -2.92 O2 EDO B 124s B 120 SER B 62 SER^? 7.18 O2 EDO B 124 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 10.53 69.09 -5.55 11.13 70.44 -7.09 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 5.78 62.05 -14.51 6.16 59.94 -13.32 ULMN 3 1cns_c01 CHITINASE user 10 3 # 10 B 67 GLU B 107 GLU^? -3.66 C1 PEG B 126s B 89 GLU B 77 GLU^? 10.85 O4 PEG B 126 B 120 SER B 57 SER^? 6.28 O4 PEG B 126 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 -1.05 49.09 -19.26 -2.38 47.97 -20.95 1cns_c01 source 1cns CHITINASE : 10 hits 1cns_c01 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 102 TYR^? 8.02 OXT ACT A 123 A 173 ASP A 82 ASP.? 12.57 OXT ACT A 123 C 48 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 2.53 56.58 17.48 2.05 53.90 18.03 coo 24.35 4.55 25.11 25.94 3.23 25.53 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 101 TYR B 102 TYR^? 11.19 O2 EDO B 124 A 173 ASP B 82 ASP^? 7.08 O1 EDO B 123 C 48 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 24.35 4.55 25.11 25.94 3.23 25.53 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 3.96 65.71 -18.47 3.56 68.28 -16.63 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1cs1_c00 naa= 3 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 48 ARG A 27 ARG.? 5.17 CH3 ACT A 123 C 101 TYR A 102 TYR^? 8.02 OXT ACT A 123 C 173 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 32.27 5.62 48.15 31.93 6.48 51.06 10.94 57.70 24.22 11.90 58.81 21.49 coo 29.64 3.64 57.39 31.22 5.14 55.65 2.53 56.58 17.48 2.05 53.90 18.03 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 48 ARG B 11 ARG^? 15.69 O ACT A 123 C 101 TYR A 102 TYR^? 8.02 OXT ACT A 123 C 173 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 32.27 5.62 48.15 31.93 6.48 51.06 -2.30 47.71 11.46 -0.79 44.99 11.29 coo 29.64 3.64 57.39 31.22 5.14 55.65 2.53 56.58 17.48 2.05 53.90 18.03 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 48 ARG B 27 ARG^? 11.58 C1 EDO B 125 C 101 TYR B 102 TYR^? 11.19 O2 EDO B 124 C 173 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 32.27 5.62 48.15 31.93 6.48 51.06 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 29.64 3.64 57.39 31.22 5.14 55.65 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 16.23 58.63 -15.55 16.12 57.73 -13.62 1cs1_c01 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 3 hits 1cs1_c01 naa= 3 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 48 ARG A 27 ARG.? 5.17 CH3 ACT A 123 D 101 TYR A 102 TYR^? 8.02 OXT ACT A 123 D 173 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 69.08 8.58 32.60 69.70 10.81 30.58 10.94 57.70 24.22 11.90 58.81 21.49 coo 71.77 11.86 24.26 70.23 12.22 26.56 2.53 56.58 17.48 2.05 53.90 18.03 coo 71.60 6.14 19.25 70.26 6.87 20.69 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 48 ARG B 27 ARG^? 11.58 C1 EDO B 125 D 101 TYR B 102 TYR^? 11.19 O2 EDO B 124 D 173 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 69.08 8.58 32.60 69.70 10.81 30.58 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 71.77 11.86 24.26 70.23 12.22 26.56 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 71.60 6.14 19.25 70.26 6.87 20.69 16.23 58.63 -15.55 16.12 57.73 -13.62 1cs1_c02 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1cs1_c02 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 102 TYR^? 8.02 OXT ACT A 123 B 173 ASP A 82 ASP.? 12.57 OXT ACT A 123 D 48 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 2.53 56.58 17.48 2.05 53.90 18.03 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 101 TYR A 102 TYR^? 8.02 OXT ACT A 123 B 173 ASP B 5 ASP^? 17.31 OXT ACT A 123 D 48 ARG B 11 ARG^? 15.69 O ACT A 123 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 2.53 56.58 17.48 2.05 53.90 18.03 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 -2.30 47.71 11.46 -0.79 44.99 11.29 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 101 TYR B 102 TYR^? 11.19 O2 EDO B 124 B 173 ASP A 5 ASP.? 11.32 O1 EDO B 123 D 48 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 16.32 51.23 -8.65 14.73 48.69 -9.52 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 101 TYR B 102 TYR^? 11.19 O2 EDO B 124 B 173 ASP B 82 ASP^? 7.08 O1 EDO B 123 D 48 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 3.96 65.71 -18.47 3.56 68.28 -16.63 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 4 hits 1cs1_c03 naa= 3 ULMN 3 1cz0_c00 INTRON-ENCODED HOMING ENDONUCLEASE Iuser 1 3 # 1 A 61 ARG A 11 ARG^? -8.10 O1 EDO A 124s A 98 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 105 CYH B 71 CYH^? 5.39 O2 EDO B 124 coo 7.07 33.61 23.71 5.33 32.14 25.75 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 3.48 23.70 23.03 2.52 25.46 22.40 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -0.29 24.99 18.39 -1.39 22.52 19.08 6.71 54.39 -4.07 6.30 55.99 -6.30 ULMN 3 1cz0_c00 INTRON-ENCODED HOMING ENDONUCLEASE Iuser 2 3 # 2 A 61 ARG B 11 ARG^? 15.69 O ACT A 123 A 98 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 105 CYH A 71 CYH^? 6.77 OXT ACT A 123 coo 7.07 33.61 23.71 5.33 32.14 25.75 -2.30 47.71 11.46 -0.79 44.99 11.29 coo 3.48 23.70 23.03 2.52 25.46 22.40 6.89 48.41 3.38 5.73 47.19 2.13 coo -0.29 24.99 18.39 -1.39 22.52 19.08 7.28 52.14 8.02 7.72 52.85 10.71 1cz0_c00 source 1cz0 INTRON-ENCODED HOMING ENDONUCLEASE I-PPOI : 2 hits 1cz0_c00 naa= 3 ULMN 3 1cz0_c01 INTRON-ENCODED HOMING ENDONUCLEASE Iuser 1 3 # 1 B 261 ARG A 11 ARG^? -8.10 O1 EDO A 124s B 298 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 305 CYH B 71 CYH^? 5.39 O2 EDO B 124 coo 29.33 30.70 34.35 30.40 28.94 32.09 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 30.19 20.41 34.76 31.59 21.88 35.30 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 34.39 20.58 39.40 34.78 17.92 38.61 6.71 54.39 -4.07 6.30 55.99 -6.30 ULMN 3 1cz0_c01 INTRON-ENCODED HOMING ENDONUCLEASE Iuser 2 3 # 2 B 261 ARG B 11 ARG^? 15.69 O ACT A 123 B 298 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 305 CYH A 71 CYH^? 6.77 OXT ACT A 123 coo 29.33 30.70 34.35 30.40 28.94 32.09 -2.30 47.71 11.46 -0.79 44.99 11.29 coo 30.19 20.41 34.76 31.59 21.88 35.30 6.89 48.41 3.38 5.73 47.19 2.13 coo 34.39 20.58 39.40 34.78 17.92 38.61 7.28 52.14 8.02 7.72 52.85 10.71 1cz0_c01 source 1cz0 INTRON-ENCODED HOMING ENDONUCLEASE I-PPOI : 2 hits 1cz0_c01 naa= 3 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 # 1 A 37 ASP A 94 ASP.? 16.52 O ACT A 123 A 56 ILE A 97 ILE^? 12.34 OXT ACT A 123 A 82 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 2.85 44.85 7.76 1.66 43.09 7.95 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 1.48 56.19 8.72 1.32 57.20 7.75 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 5.72 54.72 4.86 5.42 52.52 3.21 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 # 2 A 37 ASP A 94 ASP.? 16.52 O ACT A 123 A 56 ILE A 115 ILE^? 11.48 O1 EDO A 124 A 82 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 2.85 44.85 7.76 1.66 43.09 7.95 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 11.60 50.72 3.88 11.70 50.71 2.48 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 5.72 54.72 4.86 5.42 52.52 3.21 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 3 3 # 3 A 37 ASP A 94 ASP.? 16.52 O ACT A 123 A 56 ILE B 115 ILE^? 10.23 C2 EDO B 124 A 82 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 2.85 44.85 7.76 1.66 43.09 7.95 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 2.37 51.60 -0.68 2.29 51.10 0.64 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 5.72 54.72 4.86 5.42 52.52 3.21 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 4 3 # 4 A 37 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 56 ILE A 115 ILE^? 11.48 O1 EDO A 124 A 82 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 11.60 50.72 3.88 11.70 50.71 2.48 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 8.28 55.71 -0.18 8.56 53.06 0.60 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 5 3 # 5 A 37 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 56 ILE B 97 ILE^? 9.82 C1 EDO A 128 A 82 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 12.61 58.33 -3.24 12.76 58.90 -2.00 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 8.28 55.71 -0.18 8.56 53.06 0.60 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 6 3 # 6 A 37 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 56 ILE B 115 ILE^? 10.23 C2 EDO B 124 A 82 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 2.37 51.60 -0.68 2.29 51.10 0.64 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 8.28 55.71 -0.18 8.56 53.06 0.60 1d6o_c00 source 1d6o FK506-BINDING PROTEIN : 6 hits 1d6o_c00 naa= 3 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 # 1 B 37 ASP A 94 ASP.? 16.52 O ACT A 123 B 56 ILE A 97 ILE^? 12.34 OXT ACT A 123 B 82 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 2.85 44.85 7.76 1.66 43.09 7.95 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 1.48 56.19 8.72 1.32 57.20 7.75 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 5.72 54.72 4.86 5.42 52.52 3.21 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 # 2 B 37 ASP A 94 ASP.? 16.52 O ACT A 123 B 56 ILE A 115 ILE^? 11.48 O1 EDO A 124 B 82 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 2.85 44.85 7.76 1.66 43.09 7.95 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 11.60 50.72 3.88 11.70 50.71 2.48 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 5.72 54.72 4.86 5.42 52.52 3.21 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 3 3 # 3 B 37 ASP A 94 ASP.? 16.52 O ACT A 123 B 56 ILE B 115 ILE^? 10.23 C2 EDO B 124 B 82 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 2.85 44.85 7.76 1.66 43.09 7.95 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 2.37 51.60 -0.68 2.29 51.10 0.64 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 5.72 54.72 4.86 5.42 52.52 3.21 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 4 3 # 4 B 37 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 56 ILE A 115 ILE^? 11.48 O1 EDO A 124 B 82 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 11.60 50.72 3.88 11.70 50.71 2.48 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 8.28 55.71 -0.18 8.56 53.06 0.60 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 5 3 # 5 B 37 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 56 ILE B 97 ILE^? 9.82 C1 EDO A 128 B 82 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 12.61 58.33 -3.24 12.76 58.90 -2.00 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 8.28 55.71 -0.18 8.56 53.06 0.60 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 6 3 # 6 B 37 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 56 ILE B 115 ILE^? 10.23 C2 EDO B 124 B 82 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 2.37 51.60 -0.68 2.29 51.10 0.64 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 8.28 55.71 -0.18 8.56 53.06 0.60 1d6o_c01 source 1d6o FK506-BINDING PROTEIN : 6 hits 1d6o_c01 naa= 3 ULMN 3 1ddj_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 646 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 739 GLY B 66 GLY^? 8.25 C1 EDO B 125 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 11.37 50.89 2.29 11.05 51.63 2.25 6.69 70.61 -5.68 6.96 69.89 -5.76 ULMN 3 1ddj_c12 PLASMINOGEN user 2 3 # 2 A 603 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 646 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 739 GLY B 104 GLY^? 12.52 O1 EDO B 123 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 11.37 50.89 2.29 11.05 51.63 2.25 11.05 60.46 -16.00 10.29 60.83 -15.82 ULMN 3 1ddj_c12 PLASMINOGEN user 3 3 # 3 A 603 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 646 ASP A 94 ASP.? 16.52 O ACT A 123 A 739 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 6.89 48.41 3.38 5.73 47.19 2.13 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 2.85 44.85 7.76 1.66 43.09 7.95 coo 11.37 50.89 2.29 11.05 51.63 2.25 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1ddj_c12 PLASMINOGEN user 4 3 # 4 A 603 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 646 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 739 GLY A 66 GLY.? 8.10 O1 EDO A 127 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 11.37 50.89 2.29 11.05 51.63 2.25 7.39 66.84 15.28 7.11 66.12 15.09 ULMN 3 1ddj_c12 PLASMINOGEN user 5 3 # 5 A 603 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 646 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 739 GLY A 104 GLY^? 8.46 OXT ACT A 123 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 11.37 50.89 2.29 11.05 51.63 2.25 3.30 53.73 21.39 4.06 54.12 21.33 ULMN 3 1ddj_c12 PLASMINOGEN user 6 3 # 6 A 603 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 646 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 739 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 11.37 50.89 2.29 11.05 51.63 2.25 16.39 54.43 4.53 15.61 54.28 4.81 1ddj_c12 source 1ddj PLASMINOGEN : 6 hits 1ddj_c12 naa= 3 ULMN 3 1ddj_c13 PLASMINOGEN user 1 3 # 1 B 603 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 646 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 739 GLY B 66 GLY^? 8.25 C1 EDO B 125 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 18.39 63.32 -4.14 17.16 64.86 -3.40 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 20.60 64.37 -9.63 20.20 65.77 -11.14 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 6.69 70.61 -5.68 6.96 69.89 -5.76 ULMN 3 1ddj_c13 PLASMINOGEN user 2 3 # 2 B 603 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 646 ASP A 94 ASP.? 16.52 O ACT A 123 B 739 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 6.89 48.41 3.38 5.73 47.19 2.13 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 2.85 44.85 7.76 1.66 43.09 7.95 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1ddj_c13 PLASMINOGEN user 3 3 # 3 B 603 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 646 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 739 GLY A 66 GLY.? 8.10 O1 EDO A 127 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 -4.28 60.61 11.46 -3.09 62.30 11.15 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 -6.45 59.57 16.94 -6.05 60.31 18.88 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 7.39 66.84 15.28 7.11 66.12 15.09 ULMN 3 1ddj_c13 PLASMINOGEN user 4 3 # 4 B 603 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 646 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 739 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 16.39 54.43 4.53 15.61 54.28 4.81 1ddj_c13 source 1ddj PLASMINOGEN : 4 hits 1ddj_c13 naa= 3 ULMN 3 1ddj_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 4 HIS.? 6.54 O1 EDO A 128 C 646 ASP A 5 ASP.? 11.32 O1 EDO B 123 C 739 GLY B 66 GLY^? 8.25 C1 EDO B 125 coo 15.33 59.81 59.60 13.98 60.99 60.69 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 16.06 55.72 54.73 15.97 56.49 56.70 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 9.38 49.29 65.28 9.01 50.03 65.31 6.69 70.61 -5.68 6.96 69.89 -5.76 ULMN 3 1ddj_c14 PLASMINOGEN user 2 3 # 2 C 603 HIS A 4 HIS.? 6.54 O1 EDO A 128 C 646 ASP A 5 ASP.? 11.32 O1 EDO B 123 C 739 GLY B 104 GLY^? 12.52 O1 EDO B 123 coo 15.33 59.81 59.60 13.98 60.99 60.69 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 16.06 55.72 54.73 15.97 56.49 56.70 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 9.38 49.29 65.28 9.01 50.03 65.31 11.05 60.46 -16.00 10.29 60.83 -15.82 ULMN 3 1ddj_c14 PLASMINOGEN user 3 3 # 3 C 603 HIS A 72 HIS^? 15.66 C2 EDO B 124 C 646 ASP A 94 ASP.? 16.52 O ACT A 123 C 739 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo 15.33 59.81 59.60 13.98 60.99 60.69 6.89 48.41 3.38 5.73 47.19 2.13 coo 16.06 55.72 54.73 15.97 56.49 56.70 2.85 44.85 7.76 1.66 43.09 7.95 coo 9.38 49.29 65.28 9.01 50.03 65.31 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1ddj_c14 PLASMINOGEN user 4 3 # 4 C 603 HIS B 4 HIS^? 16.30 OXT ACT A 123 C 646 ASP B 5 ASP^? 17.31 OXT ACT A 123 C 739 GLY A 66 GLY.? 8.10 O1 EDO A 127 coo 15.33 59.81 59.60 13.98 60.99 60.69 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 16.06 55.72 54.73 15.97 56.49 56.70 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 9.38 49.29 65.28 9.01 50.03 65.31 7.39 66.84 15.28 7.11 66.12 15.09 ULMN 3 1ddj_c14 PLASMINOGEN user 5 3 # 5 C 603 HIS B 4 HIS^? 16.30 OXT ACT A 123 C 646 ASP B 5 ASP^? 17.31 OXT ACT A 123 C 739 GLY A 104 GLY^? 8.46 OXT ACT A 123 coo 15.33 59.81 59.60 13.98 60.99 60.69 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 16.06 55.72 54.73 15.97 56.49 56.70 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 9.38 49.29 65.28 9.01 50.03 65.31 3.30 53.73 21.39 4.06 54.12 21.33 ULMN 3 1ddj_c14 PLASMINOGEN user 6 3 # 6 C 603 HIS B 72 HIS^? 13.54 O1 EDO A 124 C 646 ASP B 94 ASP^? 10.22 O1 EDO A 124 C 739 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo 15.33 59.81 59.60 13.98 60.99 60.69 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 16.06 55.72 54.73 15.97 56.49 56.70 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 9.38 49.29 65.28 9.01 50.03 65.31 16.39 54.43 4.53 15.61 54.28 4.81 1ddj_c14 source 1ddj PLASMINOGEN : 6 hits 1ddj_c14 naa= 3 ULMN 3 1ddj_c15 PLASMINOGEN user 1 3 # 1 D 603 HIS A 4 HIS.? 6.54 O1 EDO A 128 D 646 ASP A 5 ASP.? 11.32 O1 EDO B 123 D 739 GLY B 66 GLY^? 8.25 C1 EDO B 125 coo -30.51 33.83 43.05 -30.50 33.12 45.03 18.39 63.32 -4.14 17.16 64.86 -3.40 coo -25.73 33.05 39.28 -27.50 34.05 39.88 20.60 64.37 -9.63 20.20 65.77 -11.14 coo -27.66 47.32 40.66 -27.81 47.01 41.41 6.69 70.61 -5.68 6.96 69.89 -5.76 ULMN 3 1ddj_c15 PLASMINOGEN user 2 3 # 2 D 603 HIS A 72 HIS^? 15.66 C2 EDO B 124 D 646 ASP A 94 ASP.? 16.52 O ACT A 123 D 739 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo -30.51 33.83 43.05 -30.50 33.12 45.03 6.89 48.41 3.38 5.73 47.19 2.13 coo -25.73 33.05 39.28 -27.50 34.05 39.88 2.85 44.85 7.76 1.66 43.09 7.95 coo -27.66 47.32 40.66 -27.81 47.01 41.41 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1ddj_c15 PLASMINOGEN user 3 3 # 3 D 603 HIS B 4 HIS^? 16.30 OXT ACT A 123 D 646 ASP B 5 ASP^? 17.31 OXT ACT A 123 D 739 GLY A 66 GLY.? 8.10 O1 EDO A 127 coo -30.51 33.83 43.05 -30.50 33.12 45.03 -4.28 60.61 11.46 -3.09 62.30 11.15 coo -25.73 33.05 39.28 -27.50 34.05 39.88 -6.45 59.57 16.94 -6.05 60.31 18.88 coo -27.66 47.32 40.66 -27.81 47.01 41.41 7.39 66.84 15.28 7.11 66.12 15.09 ULMN 3 1ddj_c15 PLASMINOGEN user 4 3 # 4 D 603 HIS B 72 HIS^? 13.54 O1 EDO A 124 D 646 ASP B 94 ASP^? 10.22 O1 EDO A 124 D 739 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo -30.51 33.83 43.05 -30.50 33.12 45.03 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -25.73 33.05 39.28 -27.50 34.05 39.88 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -27.66 47.32 40.66 -27.81 47.01 41.41 16.39 54.43 4.53 15.61 54.28 4.81 1ddj_c15 source 1ddj PLASMINOGEN : 4 hits 1ddj_c15 naa= 3 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 200 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 229 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 1.13 77.49 40.64 0.62 75.57 39.98 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 0.84 91.24 49.01 2.91 91.61 49.23 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 10.53 97.56 43.71 9.33 93.71 47.17 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 A 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 200 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 229 LYS A 114 LYS^? 4.03 O ACT A 123 coo 1.13 77.49 40.64 0.62 75.57 39.98 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 0.84 91.24 49.01 2.91 91.61 49.23 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 10.53 97.56 43.71 9.33 93.71 47.17 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 A 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 200 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 229 LYS A 114 LYS^? 4.03 O ACT A 123 coo 1.13 77.49 40.64 0.62 75.57 39.98 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 0.84 91.24 49.01 2.91 91.61 49.23 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 10.53 97.56 43.71 9.33 93.71 47.17 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 4 3 # 4 A 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 200 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 229 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 1.13 77.49 40.64 0.62 75.57 39.98 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 0.84 91.24 49.01 2.91 91.61 49.23 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 10.53 97.56 43.71 9.33 93.71 47.17 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 # 5 A 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 200 ASP A 94 ASP.? 16.52 O ACT A 123 A 229 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 1.13 77.49 40.64 0.62 75.57 39.98 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 0.84 91.24 49.01 2.91 91.61 49.23 2.85 44.85 7.76 1.66 43.09 7.95 coo 10.53 97.56 43.71 9.33 93.71 47.17 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 6 3 # 6 A 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 200 ASP A 94 ASP.? 16.52 O ACT A 123 A 229 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 1.13 77.49 40.64 0.62 75.57 39.98 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 0.84 91.24 49.01 2.91 91.61 49.23 2.85 44.85 7.76 1.66 43.09 7.95 coo 10.53 97.56 43.71 9.33 93.71 47.17 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 7 3 # 7 A 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 200 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 229 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 1.13 77.49 40.64 0.62 75.57 39.98 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 0.84 91.24 49.01 2.91 91.61 49.23 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 10.53 97.56 43.71 9.33 93.71 47.17 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 8 3 # 8 A 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 200 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 229 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 1.13 77.49 40.64 0.62 75.57 39.98 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 0.84 91.24 49.01 2.91 91.61 49.23 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 10.53 97.56 43.71 9.33 93.71 47.17 1.96 50.52 -5.38 3.03 56.08 -8.37 1dfo_c12 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 8 hits 1dfo_c12 naa= 3 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 200 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 229 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 9.24 94.26 88.22 8.02 94.07 89.92 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 17.54 90.31 75.01 17.17 92.01 73.80 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 22.32 101.61 71.64 17.89 98.63 71.55 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 B 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 200 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 229 LYS A 114 LYS^? 4.03 O ACT A 123 coo 9.24 94.26 88.22 8.02 94.07 89.92 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 17.54 90.31 75.01 17.17 92.01 73.80 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 22.32 101.61 71.64 17.89 98.63 71.55 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 B 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 200 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 229 LYS A 114 LYS^? 4.03 O ACT A 123 coo 9.24 94.26 88.22 8.02 94.07 89.92 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 17.54 90.31 75.01 17.17 92.01 73.80 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 22.32 101.61 71.64 17.89 98.63 71.55 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 4 3 # 4 B 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 200 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 229 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 9.24 94.26 88.22 8.02 94.07 89.92 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 17.54 90.31 75.01 17.17 92.01 73.80 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 22.32 101.61 71.64 17.89 98.63 71.55 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 # 5 B 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 200 ASP A 94 ASP.? 16.52 O ACT A 123 B 229 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 9.24 94.26 88.22 8.02 94.07 89.92 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 17.54 90.31 75.01 17.17 92.01 73.80 2.85 44.85 7.76 1.66 43.09 7.95 coo 22.32 101.61 71.64 17.89 98.63 71.55 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 6 3 # 6 B 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 200 ASP A 94 ASP.? 16.52 O ACT A 123 B 229 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 9.24 94.26 88.22 8.02 94.07 89.92 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 17.54 90.31 75.01 17.17 92.01 73.80 2.85 44.85 7.76 1.66 43.09 7.95 coo 22.32 101.61 71.64 17.89 98.63 71.55 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 7 3 # 7 B 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 200 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 229 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 9.24 94.26 88.22 8.02 94.07 89.92 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 17.54 90.31 75.01 17.17 92.01 73.80 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 22.32 101.61 71.64 17.89 98.63 71.55 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 8 3 # 8 B 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 200 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 229 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 9.24 94.26 88.22 8.02 94.07 89.92 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 17.54 90.31 75.01 17.17 92.01 73.80 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 22.32 101.61 71.64 17.89 98.63 71.55 1.96 50.52 -5.38 3.03 56.08 -8.37 1dfo_c13 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 8 hits 1dfo_c13 naa= 3 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 C 200 ASP A 13 ASP.? -3.81 O2 EDO A 124s C 229 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 26.77 65.84 83.49 27.06 67.76 84.27 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 19.52 52.01 79.59 20.28 51.65 77.65 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 28.90 45.91 73.55 25.22 49.72 72.97 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 C 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 C 200 ASP A 13 ASP.? -3.81 O2 EDO A 124s C 229 LYS A 114 LYS^? 4.03 O ACT A 123 coo 26.77 65.84 83.49 27.06 67.76 84.27 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 19.52 52.01 79.59 20.28 51.65 77.65 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 28.90 45.91 73.55 25.22 49.72 72.97 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 C 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 C 200 ASP B 94 ASP^? 10.22 O1 EDO A 124 C 229 LYS A 114 LYS^? 4.03 O ACT A 123 coo 26.77 65.84 83.49 27.06 67.76 84.27 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 19.52 52.01 79.59 20.28 51.65 77.65 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 28.90 45.91 73.55 25.22 49.72 72.97 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 4 3 # 4 C 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 C 200 ASP B 94 ASP^? 10.22 O1 EDO A 124 C 229 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 26.77 65.84 83.49 27.06 67.76 84.27 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 19.52 52.01 79.59 20.28 51.65 77.65 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 28.90 45.91 73.55 25.22 49.72 72.97 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 # 5 C 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 C 200 ASP A 94 ASP.? 16.52 O ACT A 123 C 229 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 26.77 65.84 83.49 27.06 67.76 84.27 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 19.52 52.01 79.59 20.28 51.65 77.65 2.85 44.85 7.76 1.66 43.09 7.95 coo 28.90 45.91 73.55 25.22 49.72 72.97 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 6 3 # 6 C 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 C 200 ASP A 94 ASP.? 16.52 O ACT A 123 C 229 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 26.77 65.84 83.49 27.06 67.76 84.27 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 19.52 52.01 79.59 20.28 51.65 77.65 2.85 44.85 7.76 1.66 43.09 7.95 coo 28.90 45.91 73.55 25.22 49.72 72.97 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 7 3 # 7 C 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 C 200 ASP B 13 ASP^? 17.03 O1 EDO B 124 C 229 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 26.77 65.84 83.49 27.06 67.76 84.27 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 19.52 52.01 79.59 20.28 51.65 77.65 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 28.90 45.91 73.55 25.22 49.72 72.97 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 8 3 # 8 C 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 C 200 ASP B 13 ASP^? 17.03 O1 EDO B 124 C 229 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 26.77 65.84 83.49 27.06 67.76 84.27 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 19.52 52.01 79.59 20.28 51.65 77.65 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 28.90 45.91 73.55 25.22 49.72 72.97 1.96 50.52 -5.38 3.03 56.08 -8.37 1dfo_c14 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 8 hits 1dfo_c14 naa= 3 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 D 200 ASP A 13 ASP.? -3.81 O2 EDO A 124s D 229 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo -10.90 48.74 53.41 -12.98 48.90 53.67 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 4.60 52.95 52.50 5.57 51.29 53.40 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 10.05 41.79 49.80 7.94 44.71 53.76 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 D 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 D 200 ASP A 13 ASP.? -3.81 O2 EDO A 124s D 229 LYS A 114 LYS^? 4.03 O ACT A 123 coo -10.90 48.74 53.41 -12.98 48.90 53.67 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 4.60 52.95 52.50 5.57 51.29 53.40 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 10.05 41.79 49.80 7.94 44.71 53.76 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 D 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 D 200 ASP B 94 ASP^? 10.22 O1 EDO A 124 D 229 LYS A 114 LYS^? 4.03 O ACT A 123 coo -10.90 48.74 53.41 -12.98 48.90 53.67 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 4.60 52.95 52.50 5.57 51.29 53.40 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 10.05 41.79 49.80 7.94 44.71 53.76 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 4 3 # 4 D 123 HIS A 4 HIS.? 6.54 O1 EDO A 128 D 200 ASP B 94 ASP^? 10.22 O1 EDO A 124 D 229 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -10.90 48.74 53.41 -12.98 48.90 53.67 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 4.60 52.95 52.50 5.57 51.29 53.40 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 10.05 41.79 49.80 7.94 44.71 53.76 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 5 3 # 5 D 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 D 200 ASP A 94 ASP.? 16.52 O ACT A 123 D 229 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo -10.90 48.74 53.41 -12.98 48.90 53.67 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 4.60 52.95 52.50 5.57 51.29 53.40 2.85 44.85 7.76 1.66 43.09 7.95 coo 10.05 41.79 49.80 7.94 44.71 53.76 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 6 3 # 6 D 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 D 200 ASP A 94 ASP.? 16.52 O ACT A 123 D 229 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -10.90 48.74 53.41 -12.98 48.90 53.67 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 4.60 52.95 52.50 5.57 51.29 53.40 2.85 44.85 7.76 1.66 43.09 7.95 coo 10.05 41.79 49.80 7.94 44.71 53.76 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 7 3 # 7 D 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 D 200 ASP B 13 ASP^? 17.03 O1 EDO B 124 D 229 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -10.90 48.74 53.41 -12.98 48.90 53.67 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 4.60 52.95 52.50 5.57 51.29 53.40 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 10.05 41.79 49.80 7.94 44.71 53.76 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 8 3 # 8 D 123 HIS B 4 HIS^? 16.30 OXT ACT A 123 D 200 ASP B 13 ASP^? 17.03 O1 EDO B 124 D 229 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -10.90 48.74 53.41 -12.98 48.90 53.67 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 4.60 52.95 52.50 5.57 51.29 53.40 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 10.05 41.79 49.80 7.94 44.71 53.76 1.96 50.52 -5.38 3.03 56.08 -8.37 1dfo_c15 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 8 hits 1dfo_c15 naa= 3 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 1 3 # 1 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 150 LYS A 114 LYS^? 4.03 O ACT A 123 186 ASN A 63 ASN.? 9.31 CH3 ACT A 123 coo 32.88 50.55 24.33 31.89 51.78 26.65 13.42 55.06 8.10 16.05 56.03 7.83 coo 27.04 52.42 22.30 26.88 49.99 27.00 11.95 48.07 7.92 11.03 52.28 12.68 coo 36.98 50.30 37.29 35.85 50.29 35.50 8.51 60.27 21.48 7.48 62.07 21.93 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 2 3 # 2 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 150 LYS B 114 LYS^? -2.62 O2 EDO B 124s 186 ASN B 63 ASN^? 10.45 C1 EDO B 125 coo 32.88 50.55 24.33 31.89 51.78 26.65 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo 27.04 52.42 22.30 26.88 49.99 27.00 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 36.98 50.30 37.29 35.85 50.29 35.50 5.72 66.69 -14.07 6.70 68.56 -13.76 1dhr_c00 source 1dhr DIHYDROPTERIDINE REDUCTASE (DHPR) (E.C.1.6.99.: 2 hits 1dhr_c00 naa= 3 ULMN 3 1din_c00 DIENELACTONE HYDROLASE user 1 3 # 1 123 CYH A 71 CYH^? 6.77 OXT ACT A 123 171 ASP A 94 ASP.? 16.52 O ACT A 123 202 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo 13.53 50.63 6.92 14.43 49.91 4.38 7.28 52.14 8.02 7.72 52.85 10.71 coo 11.86 58.52 0.90 11.25 56.63 1.71 2.85 44.85 7.76 1.66 43.09 7.95 coo 12.37 53.26 1.34 11.86 52.62 3.19 6.89 48.41 3.38 5.73 47.19 2.13 ULMN 3 1din_c00 DIENELACTONE HYDROLASE user 2 3 # 2 123 CYH B 71 CYH^? 5.39 O2 EDO B 124 171 ASP B 94 ASP^? 10.22 O1 EDO A 124 202 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo 13.53 50.63 6.92 14.43 49.91 4.38 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 11.86 58.52 0.90 11.25 56.63 1.71 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 12.37 53.26 1.34 11.86 52.62 3.19 7.05 49.23 -1.00 8.21 47.66 -0.22 1din_c00 source 1din DIENELACTONE HYDROLASE : 2 hits 1din_c00 naa= 3 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 1 3 # 1 A 48 ALA A 95 ALA^? 14.79 C2 EDO B 124 A 52 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 191 TRP A 106 TRP^? 4.14 O ACT A 123 coo 0.32 19.13 2.10 -0.45 20.12 1.22 3.02 49.05 5.86 2.79 49.60 4.45 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 6.89 48.41 3.38 5.73 47.19 2.13 coo -12.27 21.19 4.26 -8.94 21.66 2.22 8.32 51.05 18.05 8.68 49.61 14.39 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 2 3 # 2 A 48 ALA B 95 ALA^? 9.56 O1 EDO A 124 A 52 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 191 TRP B 106 TRP^? 6.57 O2 EDO B 124 coo 0.32 19.13 2.10 -0.45 20.12 1.22 10.94 50.69 -3.13 11.14 50.75 -1.62 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -12.27 21.19 4.26 -8.94 21.66 2.22 5.92 56.83 -13.86 5.41 54.26 -10.92 1dj1_c00 source 1dj1 CYTOCHROME C PEROXIDASE : 2 hits 1dj1_c00 naa= 3 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 # 1 E 57 HIS A 4 HIS.? 6.54 O1 EDO A 128 E 102 ASP A 5 ASP.? 11.32 O1 EDO B 123 E 193 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo 11.39 26.86 25.95 9.85 26.64 27.36 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 10.90 32.83 25.96 10.83 30.68 25.98 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 4.57 20.60 30.29 4.74 21.36 30.66 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 2 3 # 2 E 57 HIS A 72 HIS^? 15.66 C2 EDO B 124 E 102 ASP A 94 ASP.? 16.52 O ACT A 123 E 193 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo 11.39 26.86 25.95 9.85 26.64 27.36 6.89 48.41 3.38 5.73 47.19 2.13 coo 10.90 32.83 25.96 10.83 30.68 25.98 2.85 44.85 7.76 1.66 43.09 7.95 coo 4.57 20.60 30.29 4.74 21.36 30.66 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 3 3 # 3 E 57 HIS B 4 HIS^? 16.30 OXT ACT A 123 E 102 ASP B 5 ASP^? 17.31 OXT ACT A 123 E 193 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo 11.39 26.86 25.95 9.85 26.64 27.36 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 10.90 32.83 25.96 10.83 30.68 25.98 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 4.57 20.60 30.29 4.74 21.36 30.66 0.61 67.88 8.18 -0.15 67.82 7.90 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 4 3 # 4 E 57 HIS B 72 HIS^? 13.54 O1 EDO A 124 E 102 ASP B 94 ASP^? 10.22 O1 EDO A 124 E 193 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo 11.39 26.86 25.95 9.85 26.64 27.36 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 10.90 32.83 25.96 10.83 30.68 25.98 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 4.57 20.60 30.29 4.74 21.36 30.66 16.39 54.43 4.53 15.61 54.28 4.81 1ds2_c02 source 1ds2 PROTEINASE B (SGPB : 4 hits 1ds2_c02 naa= 3 ULMN 3 1e2t_c00 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 # 1 A 69 CYH A 71 CYH^? 6.77 OXT ACT A 123 A 107 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 122 ASP A 94 ASP.? 16.52 O ACT A 123 coo 107.06 101.85 70.21 107.82 99.27 70.56 7.28 52.14 8.02 7.72 52.85 10.71 coo 112.02 99.34 69.11 112.26 101.12 70.20 6.89 48.41 3.38 5.73 47.19 2.13 coo 114.37 105.59 70.16 113.40 104.00 71.21 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1e2t_c00 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 2 3 # 2 A 69 CYH B 71 CYH^? 5.39 O2 EDO B 124 A 107 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 122 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 107.06 101.85 70.21 107.82 99.27 70.56 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 112.02 99.34 69.11 112.26 101.12 70.20 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 114.37 105.59 70.16 113.40 104.00 71.21 11.18 47.39 -6.30 12.32 45.78 -7.12 1e2t_c00 source 1e2t N-HYDROXYARYLAMINE O-ACETYLTRANSFERASE : 2 hits 1e2t_c00 naa= 3 ULMN 3 1e2t_c01 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 # 1 B 69 CYH A 71 CYH^? 6.77 OXT ACT A 123 B 107 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 122 ASP A 94 ASP.? 16.52 O ACT A 123 coo 71.18 90.15 69.62 72.19 87.91 68.26 7.28 52.14 8.02 7.72 52.85 10.71 coo 68.66 85.12 69.19 67.36 86.67 68.68 6.89 48.41 3.38 5.73 47.19 2.13 coo 63.06 88.82 69.94 64.68 88.56 68.63 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1e2t_c01 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 2 3 # 2 B 69 CYH B 71 CYH^? 5.39 O2 EDO B 124 B 107 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 122 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 71.18 90.15 69.62 72.19 87.91 68.26 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 68.66 85.12 69.19 67.36 86.67 68.68 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 63.06 88.82 69.94 64.68 88.56 68.63 11.18 47.39 -6.30 12.32 45.78 -7.12 1e2t_c01 source 1e2t N-HYDROXYARYLAMINE O-ACETYLTRANSFERASE : 2 hits 1e2t_c01 naa= 3 ULMN 3 1e2t_c02 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 # 1 C 69 CYH A 71 CYH^? 6.77 OXT ACT A 123 C 107 HIS A 72 HIS^? 15.66 C2 EDO B 124 C 122 ASP A 94 ASP.? 16.52 O ACT A 123 coo 87.22 70.88 82.51 87.10 73.53 83.33 7.28 52.14 8.02 7.72 52.85 10.71 coo 83.94 73.51 86.28 84.82 71.77 87.03 6.89 48.41 3.38 5.73 47.19 2.13 coo 83.85 67.31 89.02 85.24 68.84 88.61 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1e2t_c02 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 2 3 # 2 C 69 CYH B 71 CYH^? 5.39 O2 EDO B 124 C 107 HIS B 72 HIS^? 13.54 O1 EDO A 124 C 122 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 87.22 70.88 82.51 87.10 73.53 83.33 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 83.94 73.51 86.28 84.82 71.77 87.03 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 83.85 67.31 89.02 85.24 68.84 88.61 11.18 47.39 -6.30 12.32 45.78 -7.12 1e2t_c02 source 1e2t N-HYDROXYARYLAMINE O-ACETYLTRANSFERASE : 2 hits 1e2t_c02 naa= 3 ULMN 3 1e2t_c03 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 # 1 D 69 CYH A 71 CYH^? 6.77 OXT ACT A 123 D 107 HIS A 72 HIS^? 15.66 C2 EDO B 124 D 122 ASP A 94 ASP.? 16.52 O ACT A 123 coo 103.83 82.01 50.25 102.30 84.27 50.28 7.28 52.14 8.02 7.72 52.85 10.71 coo 104.67 87.04 47.86 104.93 85.42 46.57 6.89 48.41 3.38 5.73 47.19 2.13 coo 108.03 83.30 43.35 106.06 83.62 44.11 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1e2t_c03 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 2 3 # 2 D 69 CYH B 71 CYH^? 5.39 O2 EDO B 124 D 107 HIS B 72 HIS^? 13.54 O1 EDO A 124 D 122 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 103.83 82.01 50.25 102.30 84.27 50.28 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 104.67 87.04 47.86 104.93 85.42 46.57 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 108.03 83.30 43.35 106.06 83.62 44.11 11.18 47.39 -6.30 12.32 45.78 -7.12 1e2t_c03 source 1e2t N-HYDROXYARYLAMINE O-ACETYLTRANSFERASE : 2 hits 1e2t_c03 naa= 3 ULMN 3 1e2t_c04 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 # 1 E 69 CYH A 71 CYH^? 6.77 OXT ACT A 123 E 107 HIS A 72 HIS^? 15.66 C2 EDO B 124 E 122 ASP A 94 ASP.? 16.52 O ACT A 123 coo 26.92 104.93 15.26 26.00 102.32 15.14 7.28 52.14 8.02 7.72 52.85 10.71 coo 21.83 102.75 16.48 21.72 104.53 15.38 6.89 48.41 3.38 5.73 47.19 2.13 coo 19.90 109.15 15.39 20.77 107.51 14.36 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1e2t_c04 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 2 3 # 2 E 69 CYH B 71 CYH^? 5.39 O2 EDO B 124 E 107 HIS B 72 HIS^? 13.54 O1 EDO A 124 E 122 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 26.92 104.93 15.26 26.00 102.32 15.14 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 21.83 102.75 16.48 21.72 104.53 15.38 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 19.90 109.15 15.39 20.77 107.51 14.36 11.18 47.39 -6.30 12.32 45.78 -7.12 1e2t_c04 source 1e2t N-HYDROXYARYLAMINE O-ACETYLTRANSFERASE : 2 hits 1e2t_c04 naa= 3 ULMN 3 1e2t_c05 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 # 1 F 69 CYH A 71 CYH^? 6.77 OXT ACT A 123 F 107 HIS A 72 HIS^? 15.66 C2 EDO B 124 F 122 ASP A 94 ASP.? 16.52 O ACT A 123 coo 61.95 90.52 15.40 60.72 88.41 16.77 7.28 52.14 8.02 7.72 52.85 10.71 coo 64.03 85.31 15.74 65.44 86.77 16.21 6.89 48.41 3.38 5.73 47.19 2.13 coo 69.94 88.54 14.99 68.36 88.38 16.36 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1e2t_c05 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 2 3 # 2 F 69 CYH B 71 CYH^? 5.39 O2 EDO B 124 F 107 HIS B 72 HIS^? 13.54 O1 EDO A 124 F 122 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 61.95 90.52 15.40 60.72 88.41 16.77 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 64.03 85.31 15.74 65.44 86.77 16.21 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 69.94 88.54 14.99 68.36 88.38 16.36 11.18 47.39 -6.30 12.32 45.78 -7.12 1e2t_c05 source 1e2t N-HYDROXYARYLAMINE O-ACETYLTRANSFERASE : 2 hits 1e2t_c05 naa= 3 ULMN 3 1e2t_c06 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 # 1 G 69 CYH A 71 CYH^? 6.77 OXT ACT A 123 G 107 HIS A 72 HIS^? 15.66 C2 EDO B 124 G 122 ASP A 94 ASP.? 16.52 O ACT A 123 coo 29.36 85.15 35.54 31.07 87.28 35.30 7.28 52.14 8.02 7.72 52.85 10.71 coo 28.98 90.29 37.87 28.74 88.77 39.28 6.89 48.41 3.38 5.73 47.19 2.13 coo 25.53 86.86 42.58 27.46 86.99 41.71 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1e2t_c06 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 2 3 # 2 G 69 CYH B 71 CYH^? 5.39 O2 EDO B 124 G 107 HIS B 72 HIS^? 13.54 O1 EDO A 124 G 122 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 29.36 85.15 35.54 31.07 87.28 35.30 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 28.98 90.29 37.87 28.74 88.77 39.28 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 25.53 86.86 42.58 27.46 86.99 41.71 11.18 47.39 -6.30 12.32 45.78 -7.12 1e2t_c06 source 1e2t N-HYDROXYARYLAMINE O-ACETYLTRANSFERASE : 2 hits 1e2t_c06 naa= 3 ULMN 3 1e2t_c07 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 1 3 # 1 H 69 CYH A 71 CYH^? 6.77 OXT ACT A 123 H 107 HIS A 72 HIS^? 15.66 C2 EDO B 124 H 122 ASP A 94 ASP.? 16.52 O ACT A 123 coo 44.08 72.69 2.52 44.26 75.30 1.64 7.28 52.14 8.02 7.72 52.85 10.71 coo 47.49 75.16 -1.32 46.47 73.52 -2.11 6.89 48.41 3.38 5.73 47.19 2.13 coo 47.09 69.01 -4.12 45.87 70.66 -3.64 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1e2t_c07 N-HYDROXYARYLAMINE O-ACETYLTRANSFERAuser 2 3 # 2 H 69 CYH B 71 CYH^? 5.39 O2 EDO B 124 H 107 HIS B 72 HIS^? 13.54 O1 EDO A 124 H 122 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 44.08 72.69 2.52 44.26 75.30 1.64 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 47.49 75.16 -1.32 46.47 73.52 -2.11 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 47.09 69.01 -4.12 45.87 70.66 -3.64 11.18 47.39 -6.30 12.32 45.78 -7.12 1e2t_c07 source 1e2t N-HYDROXYARYLAMINE O-ACETYLTRANSFERASE : 2 hits 1e2t_c07 naa= 3 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 102 TYR^? 8.02 OXT ACT A 123 A 40 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 103 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 2.53 56.58 17.48 2.05 53.90 18.03 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR B 102 TYR^? 11.19 O2 EDO B 124 A 40 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 103 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 16.23 58.63 -15.55 16.12 57.73 -13.62 1e3v_c02 source 1e3v STEROID DELTA-ISOMERASE : 2 hits 1e3v_c02 naa= 3 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 102 TYR^? 8.02 OXT ACT A 123 B 40 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 103 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 2.53 56.58 17.48 2.05 53.90 18.03 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR B 102 TYR^? 11.19 O2 EDO B 124 B 40 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 103 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 16.23 58.63 -15.55 16.12 57.73 -13.62 1e3v_c03 source 1e3v STEROID DELTA-ISOMERASE : 2 hits 1e3v_c03 naa= 3 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 # 1 A 32 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 35 SER B 7 SER^? 13.90 OXT ACT A 123 A 218 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 47.22 22.34 8.57 45.16 22.02 9.13 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 43.58 20.85 5.15 44.62 23.01 5.76 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 44.05 16.99 12.67 44.05 18.89 11.74 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 2 3 # 2 A 32 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 35 SER A 7 SER.? 11.72 O1 EDO B 123 A 218 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 47.22 22.34 8.57 45.16 22.02 9.13 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 43.58 20.85 5.15 44.62 23.01 5.76 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 44.05 16.99 12.67 44.05 18.89 11.74 20.02 60.63 -18.97 20.31 59.23 -17.40 1eag_c04 source 1eag PEPTIDE INHIBITOR : 2 hits 1eag_c04 naa= 3 ULMN 3 1ecx_c02 AMINOTRANSFERASE user 1 3 # 1 A 99 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 177 ASP A 94 ASP.? 16.52 O ACT A 123 A 203 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 8.74 45.76 47.19 9.33 46.93 45.56 6.89 48.41 3.38 5.73 47.19 2.13 coo 11.68 42.31 52.96 12.05 43.92 51.65 2.85 44.85 7.76 1.66 43.09 7.95 coo 18.07 52.81 49.62 14.17 49.99 48.07 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1ecx_c02 AMINOTRANSFERASE user 2 3 # 2 A 99 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 177 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 203 LYS A 114 LYS^? 4.03 O ACT A 123 coo 8.74 45.76 47.19 9.33 46.93 45.56 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 11.68 42.31 52.96 12.05 43.92 51.65 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 18.07 52.81 49.62 14.17 49.99 48.07 11.95 48.07 7.92 11.03 52.28 12.68 1ecx_c02 source 1ecx AMINOTRANSFERASE : 2 hits 1ecx_c02 naa= 3 ULMN 3 1ecx_c03 AMINOTRANSFERASE user 1 3 # 1 B 99 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 177 ASP A 94 ASP.? 16.52 O ACT A 123 B 203 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 14.87 88.04 21.51 13.64 87.90 19.81 6.89 48.41 3.38 5.73 47.19 2.13 coo 15.87 92.46 27.37 14.46 91.76 25.94 2.85 44.85 7.76 1.66 43.09 7.95 coo 3.60 91.42 23.52 8.20 89.55 22.63 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1ecx_c03 AMINOTRANSFERASE user 2 3 # 2 B 99 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 177 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 203 LYS A 114 LYS^? 4.03 O ACT A 123 coo 14.87 88.04 21.51 13.64 87.90 19.81 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 15.87 92.46 27.37 14.46 91.76 25.94 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 3.60 91.42 23.52 8.20 89.55 22.63 11.95 48.07 7.92 11.03 52.28 12.68 1ecx_c03 source 1ecx AMINOTRANSFERASE : 2 hits 1ecx_c03 naa= 3 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 A 107 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 246 ASP A 94 ASP.? 16.52 O ACT A 123 A 275 HIS A 88 HIS^? 13.90 OXT ACT A 123 coo 28.44 37.56 46.79 26.87 37.11 48.10 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 22.84 50.35 52.24 23.24 48.32 52.90 2.85 44.85 7.76 1.66 43.09 7.95 coo 26.67 42.94 48.26 27.49 41.07 48.73 -1.51 48.14 15.79 -3.04 49.51 16.18 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 A 107 ASP A 94 ASP.? 16.52 O ACT A 123 A 246 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 275 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo 28.44 37.56 46.79 26.87 37.11 48.10 2.85 44.85 7.76 1.66 43.09 7.95 coo 22.84 50.35 52.24 23.24 48.32 52.90 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 26.67 42.94 48.26 27.49 41.07 48.73 6.89 48.41 3.38 5.73 47.19 2.13 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 A 107 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 246 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 275 HIS B 88 HIS^? 7.16 O1 EDO B 123 coo 28.44 37.56 46.79 26.87 37.11 48.10 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 22.84 50.35 52.24 23.24 48.32 52.90 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 26.67 42.94 48.26 27.49 41.07 48.73 15.57 53.23 -12.61 17.12 54.63 -12.48 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 4 3 # 4 A 107 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 246 ASP A 94 ASP.? 16.52 O ACT A 123 A 275 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo 28.44 37.56 46.79 26.87 37.11 48.10 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 22.84 50.35 52.24 23.24 48.32 52.90 2.85 44.85 7.76 1.66 43.09 7.95 coo 26.67 42.94 48.26 27.49 41.07 48.73 7.05 49.23 -1.00 8.21 47.66 -0.22 1ehy_c00 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 4 hits 1ehy_c00 naa= 3 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 B 107 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 246 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 275 HIS A 88 HIS^? 13.90 OXT ACT A 123 coo 34.84 56.77 81.62 34.95 54.74 82.03 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 43.18 49.30 68.39 44.75 49.87 69.78 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 38.73 55.10 77.62 36.80 55.01 78.46 -1.51 48.14 15.79 -3.04 49.51 16.18 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 B 107 ASP A 94 ASP.? 16.52 O ACT A 123 B 246 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 275 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo 34.84 56.77 81.62 34.95 54.74 82.03 2.85 44.85 7.76 1.66 43.09 7.95 coo 43.18 49.30 68.39 44.75 49.87 69.78 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 38.73 55.10 77.62 36.80 55.01 78.46 6.89 48.41 3.38 5.73 47.19 2.13 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 B 107 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 246 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 275 HIS B 88 HIS^? 7.16 O1 EDO B 123 coo 34.84 56.77 81.62 34.95 54.74 82.03 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 43.18 49.30 68.39 44.75 49.87 69.78 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 38.73 55.10 77.62 36.80 55.01 78.46 15.57 53.23 -12.61 17.12 54.63 -12.48 ULMN 3 1ehy_c01 SOLUBLE EPOXIDE HYDROLASE user 4 3 # 4 B 107 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 246 ASP A 94 ASP.? 16.52 O ACT A 123 B 275 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo 34.84 56.77 81.62 34.95 54.74 82.03 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 43.18 49.30 68.39 44.75 49.87 69.78 2.85 44.85 7.76 1.66 43.09 7.95 coo 38.73 55.10 77.62 36.80 55.01 78.46 7.05 49.23 -1.00 8.21 47.66 -0.22 1ehy_c01 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 4 hits 1ehy_c01 naa= 3 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 C 107 ASP A 5 ASP.? 11.32 O1 EDO B 123 C 246 ASP A 13 ASP.? -3.81 O2 EDO A 124s C 275 HIS A 4 HIS.? 6.54 O1 EDO A 128 coo 1.90 35.26 72.76 3.20 35.74 71.18 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 12.03 20.33 71.56 10.48 19.25 70.56 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 3.92 29.96 71.75 4.22 31.96 72.31 18.39 63.32 -4.14 17.16 64.86 -3.40 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 C 107 ASP A 82 ASP.? 12.57 OXT ACT A 123 C 246 ASP B 13 ASP^? 17.03 O1 EDO B 124 C 275 HIS A 88 HIS^? 13.90 OXT ACT A 123 coo 1.90 35.26 72.76 3.20 35.74 71.18 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 12.03 20.33 71.56 10.48 19.25 70.56 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 3.92 29.96 71.75 4.22 31.96 72.31 -1.51 48.14 15.79 -3.04 49.51 16.18 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 C 107 ASP A 94 ASP.? 16.52 O ACT A 123 C 246 ASP B 94 ASP^? 10.22 O1 EDO A 124 C 275 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo 1.90 35.26 72.76 3.20 35.74 71.18 2.85 44.85 7.76 1.66 43.09 7.95 coo 12.03 20.33 71.56 10.48 19.25 70.56 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 3.92 29.96 71.75 4.22 31.96 72.31 6.89 48.41 3.38 5.73 47.19 2.13 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 4 3 # 4 C 107 ASP B 5 ASP^? 17.31 OXT ACT A 123 C 246 ASP B 13 ASP^? 17.03 O1 EDO B 124 C 275 HIS B 4 HIS^? 16.30 OXT ACT A 123 coo 1.90 35.26 72.76 3.20 35.74 71.18 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 12.03 20.33 71.56 10.48 19.25 70.56 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 3.92 29.96 71.75 4.22 31.96 72.31 -4.28 60.61 11.46 -3.09 62.30 11.15 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 5 3 # 5 C 107 ASP B 82 ASP^? 7.08 O1 EDO B 123 C 246 ASP A 13 ASP.? -3.81 O2 EDO A 124s C 275 HIS B 88 HIS^? 7.16 O1 EDO B 123 coo 1.90 35.26 72.76 3.20 35.74 71.18 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 12.03 20.33 71.56 10.48 19.25 70.56 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 3.92 29.96 71.75 4.22 31.96 72.31 15.57 53.23 -12.61 17.12 54.63 -12.48 ULMN 3 1ehy_c02 SOLUBLE EPOXIDE HYDROLASE user 6 3 # 6 C 107 ASP B 94 ASP^? 10.22 O1 EDO A 124 C 246 ASP A 94 ASP.? 16.52 O ACT A 123 C 275 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo 1.90 35.26 72.76 3.20 35.74 71.18 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 12.03 20.33 71.56 10.48 19.25 70.56 2.85 44.85 7.76 1.66 43.09 7.95 coo 3.92 29.96 71.75 4.22 31.96 72.31 7.05 49.23 -1.00 8.21 47.66 -0.22 1ehy_c02 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 6 hits 1ehy_c02 naa= 3 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 D 107 ASP A 82 ASP.? 12.57 OXT ACT A 123 D 246 ASP A 94 ASP.? 16.52 O ACT A 123 D 275 HIS A 88 HIS^? 13.90 OXT ACT A 123 coo 37.41 19.89 81.58 37.64 21.98 81.53 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 23.50 26.43 88.52 24.76 26.47 90.29 2.85 44.85 7.76 1.66 43.09 7.95 coo 33.16 21.44 85.29 34.07 21.53 83.40 -1.51 48.14 15.79 -3.04 49.51 16.18 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 2 3 # 2 D 107 ASP A 82 ASP.? 12.57 OXT ACT A 123 D 246 ASP B 13 ASP^? 17.03 O1 EDO B 124 D 275 HIS A 88 HIS^? 13.90 OXT ACT A 123 coo 37.41 19.89 81.58 37.64 21.98 81.53 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 23.50 26.43 88.52 24.76 26.47 90.29 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 33.16 21.44 85.29 34.07 21.53 83.40 -1.51 48.14 15.79 -3.04 49.51 16.18 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 3 3 # 3 D 107 ASP A 94 ASP.? 16.52 O ACT A 123 D 246 ASP B 94 ASP^? 10.22 O1 EDO A 124 D 275 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo 37.41 19.89 81.58 37.64 21.98 81.53 2.85 44.85 7.76 1.66 43.09 7.95 coo 23.50 26.43 88.52 24.76 26.47 90.29 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 33.16 21.44 85.29 34.07 21.53 83.40 6.89 48.41 3.38 5.73 47.19 2.13 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 4 3 # 4 D 107 ASP B 82 ASP^? 7.08 O1 EDO B 123 D 246 ASP A 13 ASP.? -3.81 O2 EDO A 124s D 275 HIS B 88 HIS^? 7.16 O1 EDO B 123 coo 37.41 19.89 81.58 37.64 21.98 81.53 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 23.50 26.43 88.52 24.76 26.47 90.29 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 33.16 21.44 85.29 34.07 21.53 83.40 15.57 53.23 -12.61 17.12 54.63 -12.48 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 5 3 # 5 D 107 ASP B 82 ASP^? 7.08 O1 EDO B 123 D 246 ASP B 94 ASP^? 10.22 O1 EDO A 124 D 275 HIS B 88 HIS^? 7.16 O1 EDO B 123 coo 37.41 19.89 81.58 37.64 21.98 81.53 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 23.50 26.43 88.52 24.76 26.47 90.29 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 33.16 21.44 85.29 34.07 21.53 83.40 15.57 53.23 -12.61 17.12 54.63 -12.48 ULMN 3 1ehy_c03 SOLUBLE EPOXIDE HYDROLASE user 6 3 # 6 D 107 ASP B 94 ASP^? 10.22 O1 EDO A 124 D 246 ASP A 94 ASP.? 16.52 O ACT A 123 D 275 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo 37.41 19.89 81.58 37.64 21.98 81.53 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 23.50 26.43 88.52 24.76 26.47 90.29 2.85 44.85 7.76 1.66 43.09 7.95 coo 33.16 21.44 85.29 34.07 21.53 83.40 7.05 49.23 -1.00 8.21 47.66 -0.22 1ehy_c03 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 6 hits 1ehy_c03 naa= 3 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 1 3 # 1 150 ASP A 5 ASP.? 11.32 O1 EDO B 123 153 ARG A 8 ARG.? -3.85 O1 EDO B 123s 177 HIS A 4 HIS.? 6.54 O1 EDO A 128 coo 6.83 2.75 19.17 7.40 0.75 19.11 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 1.78 0.50 17.43 2.55 -2.31 16.44 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 18.39 63.32 -4.14 17.16 64.86 -3.40 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 2 3 # 2 150 ASP B 5 ASP^? 17.31 OXT ACT A 123 153 ARG B 8 ARG^? 17.13 OXT ACT A 123 177 HIS B 4 HIS^? 16.30 OXT ACT A 123 coo 6.83 2.75 19.17 7.40 0.75 19.11 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 1.78 0.50 17.43 2.55 -2.31 16.44 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 -4.28 60.61 11.46 -3.09 62.30 11.15 1emd_c01 source 1emd MALATE DEHYDROGENASE (E.C.1.1.1.37) : 2 hits 1emd_c01 naa= 3 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 # 1 A 229 ALA A 78 ALA^? 8.34 O2 EDO A 126 A 257 ALA A 89 ALA^? 11.47 O1 EDO A 126 A 328 ASP A 94 ASP.? 16.52 O ACT A 123 coo 39.84 24.12 8.44 38.50 24.23 9.11 7.30 43.06 15.76 8.05 44.38 15.61 coo 43.22 26.73 5.37 41.81 27.09 5.79 1.19 42.59 14.96 0.64 41.15 15.03 coo 38.17 34.10 6.67 37.72 32.06 6.84 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 # 2 A 229 ALA B 78 ALA^? 8.57 O2 PEG B 126 A 257 ALA B 89 ALA^? 11.41 O2 EDO B 123 A 328 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 39.84 24.12 8.44 38.50 24.23 9.11 6.78 48.53 -14.43 6.13 49.77 -13.82 coo 43.22 26.73 5.37 41.81 27.09 5.79 12.86 47.80 -13.77 13.41 46.50 -14.35 coo 38.17 34.10 6.67 37.72 32.06 6.84 11.18 47.39 -6.30 12.32 45.78 -7.12 1eo7_c00 source 1eo7 CYCLODEXTRIN GLYCOSYLTRANSFERASE : 2 hits 1eo7_c00 naa= 3 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 159 LYS A 113 LYS^? 12.75 O2 EDO A 124 A 193 GLU A 77 GLU^? 11.16 O2 EDO A 126 A 217 VAL A 112 VAL^? 10.06 O ACT A 123 coo 2.10 10.68 61.44 -2.14 13.16 60.61 13.93 45.27 9.54 19.06 43.44 6.58 coo -5.33 11.71 69.72 -4.62 11.92 67.73 8.02 38.51 14.00 9.59 37.31 13.17 coo 0.07 12.29 66.53 -0.24 11.95 64.38 12.94 43.10 12.51 11.40 44.60 13.12 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 2 3 # 2 A 159 LYS A 114 LYS^? 4.03 O ACT A 123 A 193 GLU A 77 GLU^? 11.16 O2 EDO A 126 A 217 VAL A 112 VAL^? 10.06 O ACT A 123 coo 2.10 10.68 61.44 -2.14 13.16 60.61 11.95 48.07 7.92 11.03 52.28 12.68 coo -5.33 11.71 69.72 -4.62 11.92 67.73 8.02 38.51 14.00 9.59 37.31 13.17 coo 0.07 12.29 66.53 -0.24 11.95 64.38 12.94 43.10 12.51 11.40 44.60 13.12 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 3 3 # 3 A 159 LYS B 113 LYS^? 13.71 C2 EDO B 124 A 193 GLU B 77 GLU^? 10.85 O4 PEG B 126 A 217 VAL B 112 VAL^? 10.50 O2 EDO B 124 coo 2.10 10.68 61.44 -2.14 13.16 60.61 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo -5.33 11.71 69.72 -4.62 11.92 67.73 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 0.07 12.29 66.53 -0.24 11.95 64.38 1.05 47.66 -11.52 2.65 49.21 -11.51 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 4 3 # 4 A 159 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 193 GLU B 77 GLU^? 10.85 O4 PEG B 126 A 217 VAL B 112 VAL^? 10.50 O2 EDO B 124 coo 2.10 10.68 61.44 -2.14 13.16 60.61 1.96 50.52 -5.38 3.03 56.08 -8.37 coo -5.33 11.71 69.72 -4.62 11.92 67.73 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 0.07 12.29 66.53 -0.24 11.95 64.38 1.05 47.66 -11.52 2.65 49.21 -11.51 1et0_c00 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 4 hits 1et0_c00 naa= 3 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 38 THR A 14 THR.? 8.58 O1 EDO A 124 A 159 LYS A 113 LYS^? 12.75 O2 EDO A 124 A 193 GLU A 69 GLU^? 4.98 OXT ACT A 123 coo -2.58 16.31 54.79 -4.02 14.93 55.64 17.20 46.38 0.71 15.18 46.20 -0.03 coo 2.10 10.68 61.44 -2.14 13.16 60.61 13.93 45.27 9.54 19.06 43.44 6.58 coo -5.33 11.71 69.72 -4.62 11.92 67.73 8.76 56.68 10.43 10.20 56.07 11.84 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 2 3 # 2 A 38 THR A 14 THR.? 8.58 O1 EDO A 124 A 159 LYS A 114 LYS^? 4.03 O ACT A 123 A 193 GLU A 49 GLU^? 5.11 O2 EDO A 127 coo -2.58 16.31 54.79 -4.02 14.93 55.64 17.20 46.38 0.71 15.18 46.20 -0.03 coo 2.10 10.68 61.44 -2.14 13.16 60.61 11.95 48.07 7.92 11.03 52.28 12.68 coo -5.33 11.71 69.72 -4.62 11.92 67.73 16.74 60.19 6.60 17.85 60.24 8.39 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 3 3 # 3 A 38 THR A 14 THR.? 8.58 O1 EDO A 124 A 159 LYS A 114 LYS^? 4.03 O ACT A 123 A 193 GLU A 69 GLU^? 4.98 OXT ACT A 123 coo -2.58 16.31 54.79 -4.02 14.93 55.64 17.20 46.38 0.71 15.18 46.20 -0.03 coo 2.10 10.68 61.44 -2.14 13.16 60.61 11.95 48.07 7.92 11.03 52.28 12.68 coo -5.33 11.71 69.72 -4.62 11.92 67.73 8.76 56.68 10.43 10.20 56.07 11.84 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 4 3 # 4 A 38 THR A 56 THR^? 7.33 C2 EDO A 125 A 159 LYS A 113 LYS^? 12.75 O2 EDO A 124 A 193 GLU A 69 GLU^? 4.98 OXT ACT A 123 coo -2.58 16.31 54.79 -4.02 14.93 55.64 17.43 43.07 17.55 19.51 43.25 18.06 coo 2.10 10.68 61.44 -2.14 13.16 60.61 13.93 45.27 9.54 19.06 43.44 6.58 coo -5.33 11.71 69.72 -4.62 11.92 67.73 8.76 56.68 10.43 10.20 56.07 11.84 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 5 3 # 5 A 38 THR B 14 THR^? 15.08 C2 EDO B 124 A 159 LYS B 113 LYS^? 13.71 C2 EDO B 124 A 193 GLU B 69 GLU^? -2.92 O2 EDO B 124s coo -2.58 16.31 54.79 -4.02 14.93 55.64 -3.15 46.62 0.75 -1.23 46.14 1.47 coo 2.10 10.68 61.44 -2.14 13.16 60.61 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo -5.33 11.71 69.72 -4.62 11.92 67.73 5.26 59.46 -4.72 3.83 59.41 -6.26 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 6 3 # 6 A 38 THR B 14 THR^? 15.08 C2 EDO B 124 A 159 LYS B 113 LYS^? 13.71 C2 EDO B 124 A 193 GLU B 77 GLU^? 10.85 O4 PEG B 126 coo -2.58 16.31 54.79 -4.02 14.93 55.64 -3.15 46.62 0.75 -1.23 46.14 1.47 coo 2.10 10.68 61.44 -2.14 13.16 60.61 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo -5.33 11.71 69.72 -4.62 11.92 67.73 6.00 43.66 -14.33 4.35 42.35 -13.99 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 7 3 # 7 A 38 THR B 14 THR^? 15.08 C2 EDO B 124 A 159 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 193 GLU B 69 GLU^? -2.92 O2 EDO B 124s coo -2.58 16.31 54.79 -4.02 14.93 55.64 -3.15 46.62 0.75 -1.23 46.14 1.47 coo 2.10 10.68 61.44 -2.14 13.16 60.61 1.96 50.52 -5.38 3.03 56.08 -8.37 coo -5.33 11.71 69.72 -4.62 11.92 67.73 5.26 59.46 -4.72 3.83 59.41 -6.26 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 8 3 # 8 A 38 THR B 14 THR^? 15.08 C2 EDO B 124 A 159 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 193 GLU B 77 GLU^? 10.85 O4 PEG B 126 coo -2.58 16.31 54.79 -4.02 14.93 55.64 -3.15 46.62 0.75 -1.23 46.14 1.47 coo 2.10 10.68 61.44 -2.14 13.16 60.61 1.96 50.52 -5.38 3.03 56.08 -8.37 coo -5.33 11.71 69.72 -4.62 11.92 67.73 6.00 43.66 -14.33 4.35 42.35 -13.99 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 9 3 # 9 A 38 THR B 56 THR^? 10.83 C3 PEG B 126 A 159 LYS B 113 LYS^? 13.71 C2 EDO B 124 A 193 GLU B 69 GLU^? -2.92 O2 EDO B 124s coo -2.58 16.31 54.79 -4.02 14.93 55.64 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo 2.10 10.68 61.44 -2.14 13.16 60.61 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo -5.33 11.71 69.72 -4.62 11.92 67.73 5.26 59.46 -4.72 3.83 59.41 -6.26 1et0_c02 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 9 hits 1et0_c02 naa= 3 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 1 3 # 1 A 34 GLU A 75 GLU^? 16.23 O2 EDO A 124 A 260 ARG A 79 ARG^? -4.30 O1 EDO A 126s A 270 LYS A 91 LYS^? 18.66 O2 EDO A 126 coo 50.99 29.43 12.86 52.11 29.45 14.65 14.12 39.75 7.18 16.10 39.69 6.63 coo 39.80 27.50 22.98 42.20 26.56 21.34 2.90 41.63 20.04 5.49 40.23 20.98 coo 48.83 21.70 19.50 47.44 24.99 15.25 5.43 41.25 9.74 2.02 38.13 6.82 1euy_c00 source 1euy GLUTAMINYL-TRNA SYNTHETASE : 1 hits 1euy_c00 naa= 3 ULMN 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 1 3 # 1 C 95 ASP A 109 ASP^? -4.58 O2 EDO A 126s C 117 GLU A 107 GLU^? -3.18 O1 EDO A 126s C 131 GLU A 77 GLU^? 11.16 O2 EDO A 126 coo 68.01 56.37 72.57 68.42 56.10 70.51 9.63 38.15 19.81 7.90 38.49 20.93 coo 66.59 62.50 67.44 67.57 60.64 67.12 6.31 45.06 22.90 4.64 44.18 23.93 coo 69.24 52.27 71.96 69.91 50.26 71.89 8.02 38.51 14.00 9.59 37.31 13.17 ULMN 3 1f6d_c02 UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE user 2 3 # 2 C 95 ASP B 109 ASP^? -4.16 O4 PEG B 126s C 117 GLU B 107 GLU^? -3.66 C1 PEG B 126s C 131 GLU B 77 GLU^? 10.85 O4 PEG B 126 coo 68.01 56.37 72.57 68.42 56.10 70.51 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 66.59 62.50 67.44 67.57 60.64 67.12 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 69.24 52.27 71.96 69.91 50.26 71.89 6.00 43.66 -14.33 4.35 42.35 -13.99 1f6d_c02 source 1f6d UDP-N-ACETYLGLUCOSAMINE 2-EPIMERASE : 2 hits 1f6d_c02 naa= 3 ULMN 3 1f7u_c00 ARGINYL-TRNA SYNTHETASE user 1 3 # 1 A 156 LYS A 114 LYS^? 4.03 O ACT A 123 A 159 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 162 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo 28.43 39.38 -0.97 23.05 38.55 -2.04 11.95 48.07 7.92 11.03 52.28 12.68 coo 29.80 39.37 7.24 28.18 38.06 7.48 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 30.26 35.04 5.34 28.61 35.92 4.39 6.89 48.41 3.38 5.73 47.19 2.13 ULMN 3 1f7u_c00 ARGINYL-TRNA SYNTHETASE user 2 3 # 2 A 156 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 159 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 162 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo 28.43 39.38 -0.97 23.05 38.55 -2.04 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 29.80 39.37 7.24 28.18 38.06 7.48 6.89 48.41 3.38 5.73 47.19 2.13 coo 30.26 35.04 5.34 28.61 35.92 4.39 7.05 49.23 -1.00 8.21 47.66 -0.22 1f7u_c00 source 1f7u ARGINYL-TRNA SYNTHETASE : 2 hits 1f7u_c00 naa= 3 ULMN 3 1f80_c05 ACYL CARRIER PROTEIN user 1 3 # 1 A 62 LYS A 91 LYS^? 18.66 O2 EDO A 126 B 105 HIS A 111 HIS^? 11.74 C2 EDO A 125 E 35 ASP A 109 ASP^? -4.58 O2 EDO A 126s coo 20.51 39.76 8.83 21.23 37.38 14.18 5.43 41.25 9.74 2.02 38.13 6.82 coo 27.18 37.56 20.68 29.07 38.28 20.13 16.68 40.80 13.52 18.19 42.09 12.84 coo 19.97 40.39 22.03 18.53 39.30 23.18 9.63 38.15 19.81 7.90 38.49 20.93 1f80_c05 source 1f80 ACYL CARRIER PROTEIN : 1 hits 1f80_c05 naa= 3 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 112 PHE A 41 PHE^? 6.84 C1 EDO A 128 A 210 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 244 LYS A 114 LYS^? 4.03 O ACT A 123 coo 9.23 46.77 25.11 11.48 48.39 24.76 15.76 60.60 -0.51 14.59 62.89 -1.66 coo 10.51 37.86 19.71 9.07 39.38 20.04 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -1.20 42.34 17.67 3.19 45.13 19.06 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 112 PHE A 60 PHE^? 5.17 O ACT A 123 A 210 ASP A 109 ASP^? -4.58 O2 EDO A 126s A 244 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 9.23 46.77 25.11 11.48 48.39 24.76 12.57 50.14 21.37 12.60 48.93 18.85 coo 10.51 37.86 19.71 9.07 39.38 20.04 9.63 38.15 19.81 7.90 38.49 20.93 coo -1.20 42.34 17.67 3.19 45.13 19.06 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 3 3 # 3 A 112 PHE B 41 PHE^? 12.86 O2 EDO B 125 A 210 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 244 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 9.23 46.77 25.11 11.48 48.39 24.76 -1.73 59.31 6.86 -0.60 60.93 8.76 coo 10.51 37.86 19.71 9.07 39.38 20.04 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -1.20 42.34 17.67 3.19 45.13 19.06 1.96 50.52 -5.38 3.03 56.08 -8.37 1fc4_c02 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 3 hits 1fc4_c02 naa= 3 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 112 PHE A 41 PHE^? 6.84 C1 EDO A 128 B 210 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 244 LYS A 114 LYS^? 4.03 O ACT A 123 coo 8.76 47.85 34.91 11.08 46.36 35.41 15.76 60.60 -0.51 14.59 62.89 -1.66 coo 9.06 56.85 40.30 7.71 55.27 39.90 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -2.38 51.82 41.62 2.07 49.19 40.42 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 112 PHE A 60 PHE^? 5.17 O ACT A 123 B 210 ASP A 109 ASP^? -4.58 O2 EDO A 126s B 244 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 8.76 47.85 34.91 11.08 46.36 35.41 12.57 50.14 21.37 12.60 48.93 18.85 coo 9.06 56.85 40.30 7.71 55.27 39.90 9.63 38.15 19.81 7.90 38.49 20.93 coo -2.38 51.82 41.62 2.07 49.19 40.42 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 3 3 # 3 B 112 PHE B 41 PHE^? 12.86 O2 EDO B 125 B 210 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 244 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 8.76 47.85 34.91 11.08 46.36 35.41 -1.73 59.31 6.86 -0.60 60.93 8.76 coo 9.06 56.85 40.30 7.71 55.27 39.90 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -2.38 51.82 41.62 2.07 49.19 40.42 1.96 50.52 -5.38 3.03 56.08 -8.37 1fc4_c03 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 3 hits 1fc4_c03 naa= 3 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 47 SER A 34 SER.? -3.56 C2 EDO A 125s A 48 THR A 56 THR^? 7.33 C2 EDO A 125 A 165 LYS A 114 LYS^? 4.03 O ACT A 123 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 20.28 47.66 19.28 22.08 46.10 18.94 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 17.43 43.07 17.55 19.51 43.25 18.06 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 47 SER A 55 SER^? 7.70 O ACT A 123 A 48 THR A 56 THR^? 7.33 C2 EDO A 125 A 165 LYS A 91 LYS^? 18.66 O2 EDO A 126 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 16.48 46.12 15.51 15.38 46.59 17.63 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 17.43 43.07 17.55 19.51 43.25 18.06 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 5.43 41.25 9.74 2.02 38.13 6.82 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 A 47 SER B 34 SER^? 13.24 C2 EDO B 124 A 48 THR B 56 THR^? 10.83 C3 PEG B 126 A 165 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 -6.11 54.18 -16.40 -8.31 53.39 -15.87 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 A 47 SER B 55 SER^? 9.36 O2 PEG B 126 A 48 THR B 56 THR^? 10.83 C3 PEG B 126 A 165 LYS B 91 LYS^? 13.69 O1 EDO A 124 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 8.58 44.72 -9.41 12.21 41.02 -7.65 1fdy_c04 source 1fdy N-ACETYLNEURAMINATE LYASE : 4 hits 1fdy_c04 naa= 3 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 47 SER A 34 SER.? -3.56 C2 EDO A 125s B 48 THR A 56 THR^? 7.33 C2 EDO A 125 B 165 LYS A 114 LYS^? 4.03 O ACT A 123 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 20.28 47.66 19.28 22.08 46.10 18.94 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 17.43 43.07 17.55 19.51 43.25 18.06 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 47 SER A 55 SER^? 7.70 O ACT A 123 B 48 THR A 56 THR^? 7.33 C2 EDO A 125 B 165 LYS A 91 LYS^? 18.66 O2 EDO A 126 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 16.48 46.12 15.51 15.38 46.59 17.63 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 17.43 43.07 17.55 19.51 43.25 18.06 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 5.43 41.25 9.74 2.02 38.13 6.82 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 B 47 SER A 57 SER^? 6.85 O2 EDO A 126 B 48 THR A 56 THR^? 7.33 C2 EDO A 125 B 165 LYS A 114 LYS^? 4.03 O ACT A 123 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 15.14 41.83 20.35 16.25 40.17 21.70 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 17.43 43.07 17.55 19.51 43.25 18.06 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 B 47 SER B 34 SER^? 13.24 C2 EDO B 124 B 48 THR B 56 THR^? 10.83 C3 PEG B 126 B 165 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 -6.11 54.18 -16.40 -8.31 53.39 -15.87 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 5 3 # 5 B 47 SER B 55 SER^? 9.36 O2 PEG B 126 B 48 THR B 56 THR^? 10.83 C3 PEG B 126 B 165 LYS B 91 LYS^? 13.69 O1 EDO A 124 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 8.58 44.72 -9.41 12.21 41.02 -7.65 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 6 3 # 6 B 47 SER B 57 SER^? 6.28 O4 PEG B 126 B 48 THR B 56 THR^? 10.83 C3 PEG B 126 B 165 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 1.96 50.52 -5.38 3.03 56.08 -8.37 1fdy_c05 source 1fdy N-ACETYLNEURAMINATE LYASE : 6 hits 1fdy_c05 naa= 3 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 47 SER A 34 SER.? -3.56 C2 EDO A 125s C 48 THR A 56 THR^? 7.33 C2 EDO A 125 C 165 LYS A 114 LYS^? 4.03 O ACT A 123 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 20.28 47.66 19.28 22.08 46.10 18.94 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 17.43 43.07 17.55 19.51 43.25 18.06 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 C 47 SER A 55 SER^? 7.70 O ACT A 123 C 48 THR A 56 THR^? 7.33 C2 EDO A 125 C 165 LYS A 91 LYS^? 18.66 O2 EDO A 126 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 16.48 46.12 15.51 15.38 46.59 17.63 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 17.43 43.07 17.55 19.51 43.25 18.06 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 5.43 41.25 9.74 2.02 38.13 6.82 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 C 47 SER B 34 SER^? 13.24 C2 EDO B 124 C 48 THR B 56 THR^? 10.83 C3 PEG B 126 C 165 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 -6.11 54.18 -16.40 -8.31 53.39 -15.87 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 C 47 SER B 55 SER^? 9.36 O2 PEG B 126 C 48 THR B 56 THR^? 10.83 C3 PEG B 126 C 165 LYS B 91 LYS^? 13.69 O1 EDO A 124 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 8.58 44.72 -9.41 12.21 41.02 -7.65 1fdy_c06 source 1fdy N-ACETYLNEURAMINATE LYASE : 4 hits 1fdy_c06 naa= 3 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 D 47 SER A 34 SER.? -3.56 C2 EDO A 125s D 48 THR A 56 THR^? 7.33 C2 EDO A 125 D 165 LYS A 114 LYS^? 4.03 O ACT A 123 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 20.28 47.66 19.28 22.08 46.10 18.94 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 17.43 43.07 17.55 19.51 43.25 18.06 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 47 SER A 55 SER^? 7.70 O ACT A 123 D 48 THR A 56 THR^? 7.33 C2 EDO A 125 D 165 LYS A 91 LYS^? 18.66 O2 EDO A 126 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 16.48 46.12 15.51 15.38 46.59 17.63 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 17.43 43.07 17.55 19.51 43.25 18.06 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 5.43 41.25 9.74 2.02 38.13 6.82 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 D 47 SER A 57 SER^? 6.85 O2 EDO A 126 D 48 THR A 56 THR^? 7.33 C2 EDO A 125 D 165 LYS A 91 LYS^? 18.66 O2 EDO A 126 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 15.14 41.83 20.35 16.25 40.17 21.70 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 17.43 43.07 17.55 19.51 43.25 18.06 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 5.43 41.25 9.74 2.02 38.13 6.82 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 D 47 SER A 57 SER^? 6.85 O2 EDO A 126 D 48 THR A 56 THR^? 7.33 C2 EDO A 125 D 165 LYS A 114 LYS^? 4.03 O ACT A 123 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 15.14 41.83 20.35 16.25 40.17 21.70 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 17.43 43.07 17.55 19.51 43.25 18.06 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 5 3 # 5 D 47 SER B 34 SER^? 13.24 C2 EDO B 124 D 48 THR B 56 THR^? 10.83 C3 PEG B 126 D 165 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 -6.11 54.18 -16.40 -8.31 53.39 -15.87 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 6 3 # 6 D 47 SER B 55 SER^? 9.36 O2 PEG B 126 D 48 THR B 56 THR^? 10.83 C3 PEG B 126 D 165 LYS B 91 LYS^? 13.69 O1 EDO A 124 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 8.58 44.72 -9.41 12.21 41.02 -7.65 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 7 3 # 7 D 47 SER B 57 SER^? 6.28 O4 PEG B 126 D 48 THR B 56 THR^? 10.83 C3 PEG B 126 D 165 LYS B 91 LYS^? 13.69 O1 EDO A 124 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 8.58 44.72 -9.41 12.21 41.02 -7.65 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 8 3 # 8 D 47 SER B 57 SER^? 6.28 O4 PEG B 126 D 48 THR B 56 THR^? 10.83 C3 PEG B 126 D 165 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 1.96 50.52 -5.38 3.03 56.08 -8.37 1fdy_c07 source 1fdy N-ACETYLNEURAMINATE LYASE : 8 hits 1fdy_c07 naa= 3 ULMN 3 1fgj_c01 HYDROXYLAMINE OXIDOREDUCTASE user 1 3 # 1 B 267 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 268 HIS A 88 HIS^? 13.90 OXT ACT A 123 B 334 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo 34.92 32.34 -16.78 33.96 30.63 -15.98 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 34.35 32.52 -12.02 33.62 30.54 -12.18 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 31.28 36.97 -17.45 31.29 34.40 -16.38 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 1fgj_c01 HYDROXYLAMINE OXIDOREDUCTASE user 2 3 # 2 B 267 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 268 HIS B 88 HIS^? 7.16 O1 EDO B 123 B 334 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo 34.92 32.34 -16.78 33.96 30.63 -15.98 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 34.35 32.52 -12.02 33.62 30.54 -12.18 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 31.28 36.97 -17.45 31.29 34.40 -16.38 11.57 61.77 -11.34 12.14 59.44 -12.79 1fgj_c01 source 1fgj HYDROXYLAMINE OXIDOREDUCTASE : 2 hits 1fgj_c01 naa= 3 ULMN 3 1fnb_c00 FERREDOXIN:NADP+ OXIDOREDUCTASE (FERuser 1 3 # 1 96 SER A 50 SER^? 9.40 C1 EDO A 128 272 CYH A 71 CYH^? 6.77 OXT ACT A 123 312 GLU A 69 GLU^? 4.98 OXT ACT A 123 coo 27.57 5.78 14.13 25.30 6.31 13.99 14.41 57.62 4.09 13.08 56.25 2.54 coo 18.48 7.50 15.98 21.17 6.92 15.38 7.28 52.14 8.02 7.72 52.85 10.71 coo 22.30 10.15 12.52 24.07 9.52 13.47 8.76 56.68 10.43 10.20 56.07 11.84 ULMN 3 1fnb_c00 FERREDOXIN:NADP+ OXIDOREDUCTASE (FERuser 2 3 # 2 96 SER B 50 SER^? 9.43 C1 EDO B 124 272 CYH B 71 CYH^? 5.39 O2 EDO B 124 312 GLU B 69 GLU^? -2.92 O2 EDO B 124s coo 27.57 5.78 14.13 25.30 6.31 13.99 -0.37 58.24 1.54 1.00 56.43 2.53 coo 18.48 7.50 15.98 21.17 6.92 15.38 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 22.30 10.15 12.52 24.07 9.52 13.47 5.26 59.46 -4.72 3.83 59.41 -6.26 1fnb_c00 source 1fnb FERREDOXIN:NADP+ OXIDOREDUCTASE (FERREDOXIN RE: 2 hits 1fnb_c00 naa= 3 ULMN 3 1fo6_c00 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 1 3 # 1 A 47 GLU A 69 GLU^? 4.98 OXT ACT A 123 A 127 LYS A 114 LYS^? 4.03 O ACT A 123 A 172 CYH A 71 CYH^? 6.77 OXT ACT A 123 coo 14.84 17.73 17.72 12.66 18.02 17.60 8.76 56.68 10.43 10.20 56.07 11.84 coo 13.59 13.62 10.66 10.48 17.11 15.01 11.95 48.07 7.92 11.03 52.28 12.68 coo 10.73 13.80 18.28 9.65 16.43 18.61 7.28 52.14 8.02 7.72 52.85 10.71 ULMN 3 1fo6_c00 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 2 3 # 2 A 47 GLU B 69 GLU^? -2.92 O2 EDO B 124s A 127 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 172 CYH B 71 CYH^? 5.39 O2 EDO B 124 coo 14.84 17.73 17.72 12.66 18.02 17.60 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 13.59 13.62 10.66 10.48 17.11 15.01 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 10.73 13.80 18.28 9.65 16.43 18.61 6.71 54.39 -4.07 6.30 55.99 -6.30 1fo6_c00 source 1fo6 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLASE : 2 hits 1fo6_c00 naa= 3 ULMN 3 1fo6_c01 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 1 3 # 1 B 47 GLU B 69 GLU^? -2.92 O2 EDO B 124s B 127 LYS B 114 LYS^? -2.62 O2 EDO B 124s B 172 CYH B 71 CYH^? 5.39 O2 EDO B 124 coo -11.43 -15.11 20.71 -9.41 -15.34 21.12 5.26 59.46 -4.72 3.83 59.41 -6.26 coo -8.59 -13.62 12.98 -6.65 -15.32 18.82 1.96 50.52 -5.38 3.03 56.08 -8.37 coo -7.53 -11.08 20.68 -6.56 -13.38 22.13 6.71 54.39 -4.07 6.30 55.99 -6.30 1fo6_c01 source 1fo6 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLASE : 1 hits 1fo6_c01 naa= 3 ULMN 3 1fo6_c02 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 1 3 # 1 C 47 GLU B 69 GLU^? -2.92 O2 EDO B 124s C 127 LYS B 114 LYS^? -2.62 O2 EDO B 124s C 172 CYH B 71 CYH^? 5.39 O2 EDO B 124 coo -14.75 22.68 45.73 -12.65 22.97 45.86 5.26 59.46 -4.72 3.83 59.41 -6.26 coo -13.46 21.30 53.90 -10.36 22.98 48.58 1.96 50.52 -5.38 3.03 56.08 -8.37 coo -10.67 18.91 46.59 -9.50 21.20 45.39 6.71 54.39 -4.07 6.30 55.99 -6.30 1fo6_c02 source 1fo6 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLASE : 1 hits 1fo6_c02 naa= 3 ULMN 3 1fo6_c03 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 1 3 # 1 D 47 GLU A 69 GLU^? 4.98 OXT ACT A 123 D 127 LYS A 114 LYS^? 4.03 O ACT A 123 D 172 CYH A 71 CYH^? 6.77 OXT ACT A 123 coo 11.48 -9.38 54.24 9.40 -9.76 53.86 8.76 56.68 10.43 10.20 56.07 11.84 coo 8.59 -5.45 60.90 6.67 -8.84 55.89 11.95 48.07 7.92 11.03 52.28 12.68 coo 7.45 -5.79 52.90 6.67 -8.39 52.10 7.28 52.14 8.02 7.72 52.85 10.71 ULMN 3 1fo6_c03 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLuser 2 3 # 2 D 47 GLU B 69 GLU^? -2.92 O2 EDO B 124s D 127 LYS B 114 LYS^? -2.62 O2 EDO B 124s D 172 CYH B 71 CYH^? 5.39 O2 EDO B 124 coo 11.48 -9.38 54.24 9.40 -9.76 53.86 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 8.59 -5.45 60.90 6.67 -8.84 55.89 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 7.45 -5.79 52.90 6.67 -8.39 52.10 6.71 54.39 -4.07 6.30 55.99 -6.30 1fo6_c03 source 1fo6 N-CARBAMOYL-D-AMINO-ACID AMIDOHYDROLASE : 2 hits 1fo6_c03 naa= 3 ULMN 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 A 317 GLU B 107 GLU^? -3.66 C1 PEG B 126s A 319 ASP B 109 ASP^? -4.16 O4 PEG B 126s A 359 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo 14.41 12.40 16.42 12.92 13.74 15.71 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 12.25 13.04 23.85 11.56 15.02 23.93 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 10.89 14.95 28.28 12.39 12.53 29.31 -0.05 41.10 -16.85 -2.14 40.61 -14.61 1fr8_c00 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 1 hits 1fr8_c00 naa= 3 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 B 317 GLU A 107 GLU^? -3.18 O1 EDO A 126s B 319 ASP A 109 ASP^? -4.58 O2 EDO A 126s B 359 ARG A 110 ARG^? 13.67 O2 EDO A 126 coo 10.77 13.13 40.94 11.03 14.73 39.51 6.31 45.06 22.90 4.64 44.18 23.93 coo 3.77 12.64 38.21 3.35 14.53 37.39 9.63 38.15 19.81 7.90 38.49 20.93 coo -1.16 15.32 35.60 -3.32 13.56 36.98 13.94 35.14 15.37 15.97 35.29 13.07 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 # 2 B 317 GLU B 107 GLU^? -3.66 C1 PEG B 126s B 319 ASP B 109 ASP^? -4.16 O4 PEG B 126s B 359 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo 10.77 13.13 40.94 11.03 14.73 39.51 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 3.77 12.64 38.21 3.35 14.53 37.39 4.45 45.35 -19.96 6.21 46.00 -20.89 coo -1.16 15.32 35.60 -3.32 13.56 36.98 -0.05 41.10 -16.85 -2.14 40.61 -14.61 1fr8_c01 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 2 hits 1fr8_c01 naa= 3 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 1 3 # 1 A 197 ARG A 11 ARG^? -8.10 O1 EDO A 124s A 201 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 204 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo -27.47 20.45 37.96 -26.70 17.86 36.51 16.32 51.23 -8.65 14.73 48.69 -9.52 coo -15.08 14.90 41.58 -16.70 13.64 42.02 6.89 48.41 3.38 5.73 47.19 2.13 coo -15.44 20.23 39.72 -16.43 18.87 38.47 7.05 49.23 -1.00 8.21 47.66 -0.22 ULMN 3 1g8f_c00 SULFATE ADENYLYLTRANSFERASE user 2 3 # 2 A 197 ARG B 11 ARG^? 15.69 O ACT A 123 A 201 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 204 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo -27.47 20.45 37.96 -26.70 17.86 36.51 -2.30 47.71 11.46 -0.79 44.99 11.29 coo -15.08 14.90 41.58 -16.70 13.64 42.02 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -15.44 20.23 39.72 -16.43 18.87 38.47 6.89 48.41 3.38 5.73 47.19 2.13 1g8f_c00 source 1g8f SULFATE ADENYLYLTRANSFERASE : 2 hits 1g8f_c00 naa= 3 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 1 3 # 1 A 314 TRP A 106 TRP^? 4.14 O ACT A 123 A 317 GLU A 107 GLU^? -3.18 O1 EDO A 126s A 365 ARG B 8 ARG^? 17.13 OXT ACT A 123 coo 79.91 26.87 38.77 78.95 23.18 37.81 8.32 51.05 18.05 8.68 49.61 14.39 coo 85.55 26.30 41.25 85.59 24.97 39.65 6.31 45.06 22.90 4.64 44.18 23.93 coo 83.47 25.30 27.10 83.44 27.82 25.29 -5.69 52.78 16.51 -6.54 52.92 19.56 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 2 3 # 2 A 314 TRP A 106 TRP^? 4.14 O ACT A 123 A 317 GLU A 107 GLU^? -3.18 O1 EDO A 126s A 365 ARG B 11 ARG^? 15.69 O ACT A 123 coo 79.91 26.87 38.77 78.95 23.18 37.81 8.32 51.05 18.05 8.68 49.61 14.39 coo 85.55 26.30 41.25 85.59 24.97 39.65 6.31 45.06 22.90 4.64 44.18 23.93 coo 83.47 25.30 27.10 83.44 27.82 25.29 -2.30 47.71 11.46 -0.79 44.99 11.29 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 3 3 # 3 A 314 TRP B 106 TRP^? 6.57 O2 EDO B 124 A 317 GLU B 107 GLU^? -3.66 C1 PEG B 126s A 365 ARG A 8 ARG.? -3.85 O1 EDO B 123s coo 79.91 26.87 38.77 78.95 23.18 37.81 5.92 56.83 -13.86 5.41 54.26 -10.92 coo 85.55 26.30 41.25 85.59 24.97 39.65 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 83.47 25.30 27.10 83.44 27.82 25.29 19.83 57.78 -11.68 20.81 58.85 -14.45 ULMN 3 1g8o_c01 N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALuser 4 3 # 4 A 314 TRP B 106 TRP^? 6.57 O2 EDO B 124 A 317 GLU B 107 GLU^? -3.66 C1 PEG B 126s A 365 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 79.91 26.87 38.77 78.95 23.18 37.81 5.92 56.83 -13.86 5.41 54.26 -10.92 coo 85.55 26.30 41.25 85.59 24.97 39.65 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 83.47 25.30 27.10 83.44 27.82 25.29 16.32 51.23 -8.65 14.73 48.69 -9.52 1g8o_c01 source 1g8o N-ACETYLLACTOSAMINIDE ALPHA-1,3- GALACTOSYLTRA: 4 hits 1g8o_c01 naa= 3 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 A 36 GLU A 49 GLU^? 5.11 O2 EDO A 127 A 47 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 161 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo 37.12 18.35 73.76 37.09 16.69 72.44 16.74 60.19 6.60 17.85 60.24 8.39 coo 29.81 8.06 73.13 30.21 10.11 72.95 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 37.29 15.56 67.90 37.37 13.79 70.08 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 2 3 # 2 A 36 GLU A 69 GLU^? 4.98 OXT ACT A 123 A 47 ASP A 94 ASP.? 16.52 O ACT A 123 A 161 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 37.12 18.35 73.76 37.09 16.69 72.44 8.76 56.68 10.43 10.20 56.07 11.84 coo 29.81 8.06 73.13 30.21 10.11 72.95 2.85 44.85 7.76 1.66 43.09 7.95 coo 37.29 15.56 67.90 37.37 13.79 70.08 5.72 54.72 4.86 5.42 52.52 3.21 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 3 3 # 3 A 36 GLU B 49 GLU^? -4.87 O2 EDO B 125s A 47 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 161 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo 37.12 18.35 73.76 37.09 16.69 72.44 -2.74 61.61 0.34 -3.60 61.93 -1.53 coo 29.81 8.06 73.13 30.21 10.11 72.95 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 37.29 15.56 67.90 37.37 13.79 70.08 0.65 57.23 -3.12 -1.98 58.01 -2.52 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 4 3 # 4 A 36 GLU B 69 GLU^? -2.92 O2 EDO B 124s A 47 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 161 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 37.12 18.35 73.76 37.09 16.69 72.44 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 29.81 8.06 73.13 30.21 10.11 72.95 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 37.29 15.56 67.90 37.37 13.79 70.08 8.28 55.71 -0.18 8.56 53.06 0.60 1geq_c02 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 4 hits 1geq_c02 naa= 3 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 B 36 GLU A 49 GLU^? 5.11 O2 EDO A 127 B 47 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 161 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo 53.87 35.49 53.22 55.44 35.72 54.61 16.74 60.19 6.60 17.85 60.24 8.39 coo 63.47 43.65 53.95 61.45 43.07 54.06 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 56.38 35.81 59.19 58.25 35.77 57.10 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 2 3 # 2 B 36 GLU A 69 GLU^? 4.98 OXT ACT A 123 B 47 ASP A 94 ASP.? 16.52 O ACT A 123 B 161 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 53.87 35.49 53.22 55.44 35.72 54.61 8.76 56.68 10.43 10.20 56.07 11.84 coo 63.47 43.65 53.95 61.45 43.07 54.06 2.85 44.85 7.76 1.66 43.09 7.95 coo 56.38 35.81 59.19 58.25 35.77 57.10 5.72 54.72 4.86 5.42 52.52 3.21 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 3 3 # 3 B 36 GLU B 49 GLU^? -4.87 O2 EDO B 125s B 47 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 161 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo 53.87 35.49 53.22 55.44 35.72 54.61 -2.74 61.61 0.34 -3.60 61.93 -1.53 coo 63.47 43.65 53.95 61.45 43.07 54.06 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 56.38 35.81 59.19 58.25 35.77 57.10 0.65 57.23 -3.12 -1.98 58.01 -2.52 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 4 3 # 4 B 36 GLU B 69 GLU^? -2.92 O2 EDO B 124s B 47 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 161 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 53.87 35.49 53.22 55.44 35.72 54.61 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 63.47 43.65 53.95 61.45 43.07 54.06 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 56.38 35.81 59.19 58.25 35.77 57.10 8.28 55.71 -0.18 8.56 53.06 0.60 1geq_c03 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 4 hits 1geq_c03 naa= 3 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 1 3 # 1 A 50 ASP A 32 ASP.? 9.00 C2 EDO A 125 A 327 GLU B 107 GLU^? -3.66 C1 PEG B 126s A 339 ARG B 79 ARG^? -4.39 C1 PEG B 126s coo 85.81 57.99 116.01 86.03 55.86 115.89 20.30 44.49 25.52 20.49 42.41 25.06 coo 75.11 41.01 160.30 76.65 40.06 161.41 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 82.23 40.35 159.87 85.09 40.67 161.01 11.19 48.56 -18.94 8.63 47.63 -20.34 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 2 3 # 2 A 50 ASP A 84 ASP.? 16.56 O1 EDO A 126 A 327 GLU B 107 GLU^? -3.66 C1 PEG B 126s A 339 ARG B 79 ARG^? -4.39 C1 PEG B 126s coo 85.81 57.99 116.01 86.03 55.86 115.89 -5.66 53.01 24.37 -6.07 52.23 22.45 coo 75.11 41.01 160.30 76.65 40.06 161.41 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 82.23 40.35 159.87 85.09 40.67 161.01 11.19 48.56 -18.94 8.63 47.63 -20.34 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 3 3 # 3 A 50 ASP B 32 ASP^? 11.80 C3 PEG B 126 A 327 GLU A 107 GLU^? -3.18 O1 EDO A 126s A 339 ARG A 79 ARG^? -4.30 O1 EDO A 126s coo 85.81 57.99 116.01 86.03 55.86 115.89 -5.79 54.47 -23.19 -5.94 55.44 -25.07 coo 75.11 41.01 160.30 76.65 40.06 161.41 6.31 45.06 22.90 4.64 44.18 23.93 coo 82.23 40.35 159.87 85.09 40.67 161.01 2.90 41.63 20.04 5.49 40.23 20.98 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 4 3 # 4 A 50 ASP B 84 ASP^? 4.63 O1 EDO B 123 A 327 GLU A 107 GLU^? -3.18 O1 EDO A 126s A 339 ARG A 79 ARG^? -4.30 O1 EDO A 126s coo 85.81 57.99 116.01 86.03 55.86 115.89 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 75.11 41.01 160.30 76.65 40.06 161.41 6.31 45.06 22.90 4.64 44.18 23.93 coo 82.23 40.35 159.87 85.09 40.67 161.01 2.90 41.63 20.04 5.49 40.23 20.98 1hto_c00 source 1hto GLUTAMINE SYNTHETASE : 4 hits 1hto_c00 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL A 52 VAL^? 10.38 O2 EDO A 124 A 200 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 226 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 19.13 38.05 1.41 19.72 38.80 -0.53 16.49 51.04 6.23 17.48 49.84 4.76 coo 24.51 43.28 11.18 25.17 44.50 9.58 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 34.47 51.09 7.19 28.58 51.18 7.53 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1i29_c03 CSDB user 2 3 # 2 A 128 VAL A 90 VAL^? 12.33 O ACT A 123 A 200 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 226 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 19.13 38.05 1.41 19.72 38.80 -0.53 3.43 43.59 12.02 4.00 45.65 12.60 coo 24.51 43.28 11.18 25.17 44.50 9.58 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 34.47 51.09 7.19 28.58 51.18 7.53 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1i29_c03 CSDB user 3 3 # 3 A 128 VAL A 112 VAL^? 10.06 O ACT A 123 A 200 ASP A 94 ASP.? 16.52 O ACT A 123 A 226 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 19.13 38.05 1.41 19.72 38.80 -0.53 12.94 43.10 12.51 11.40 44.60 13.12 coo 24.51 43.28 11.18 25.17 44.50 9.58 2.85 44.85 7.76 1.66 43.09 7.95 coo 34.47 51.09 7.19 28.58 51.18 7.53 1.96 50.52 -5.38 3.03 56.08 -8.37 ULMN 3 1i29_c03 CSDB user 4 3 # 4 A 128 VAL B 90 VAL^? 12.13 O1 EDO A 124 A 200 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 226 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 19.13 38.05 1.41 19.72 38.80 -0.53 10.54 47.65 -10.75 10.04 49.82 -10.56 coo 24.51 43.28 11.18 25.17 44.50 9.58 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 34.47 51.09 7.19 28.58 51.18 7.53 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1i29_c03 CSDB user 5 3 # 5 A 128 VAL B 112 VAL^? 10.50 O2 EDO B 124 A 200 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 226 LYS A 114 LYS^? 4.03 O ACT A 123 coo 19.13 38.05 1.41 19.72 38.80 -0.53 1.05 47.66 -11.52 2.65 49.21 -11.51 coo 24.51 43.28 11.18 25.17 44.50 9.58 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 34.47 51.09 7.19 28.58 51.18 7.53 11.95 48.07 7.92 11.03 52.28 12.68 1i29_c03 source 1i29 CSDB : 5 hits 1i29_c03 naa= 3 ULMN 3 1ig8_c00 HEXOKINASE PII user 1 3 # 1 A 158 SER A 7 SER.? 11.72 O1 EDO B 123 A 173 ARG B 27 ARG^? 11.58 C1 EDO B 125 A 211 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 22.72 76.24 0.23 24.60 76.86 -1.25 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 18.77 77.82 11.69 20.55 80.22 10.73 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1ig8_c00 HEXOKINASE PII user 2 3 # 2 A 158 SER A 7 SER.? 11.72 O1 EDO B 123 A 173 ARG B 27 ARG^? 11.58 C1 EDO B 125 A 211 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 22.72 76.24 0.23 24.60 76.86 -1.25 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 18.77 77.82 11.69 20.55 80.22 10.73 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 20.02 60.63 -18.97 20.31 59.23 -17.40 ULMN 3 1ig8_c00 HEXOKINASE PII user 3 3 # 3 A 158 SER A 7 SER.? 11.72 O1 EDO B 123 A 173 ARG B 105 ARG^? 8.10 C1 PEG B 126 A 211 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 22.72 76.24 0.23 24.60 76.86 -1.25 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 18.77 77.82 11.69 20.55 80.22 10.73 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1ig8_c00 HEXOKINASE PII user 4 3 # 4 A 158 SER A 57 SER^? 6.85 O2 EDO A 126 A 173 ARG A 36 ARG^? -3.17 O2 EDO A 125s A 211 ASP A 109 ASP^? -4.58 O2 EDO A 126s coo 22.72 76.24 0.23 24.60 76.86 -1.25 15.14 41.83 20.35 16.25 40.17 21.70 coo 18.77 77.82 11.69 20.55 80.22 10.73 24.38 48.23 13.15 25.39 47.42 15.97 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 9.63 38.15 19.81 7.90 38.49 20.93 ULMN 3 1ig8_c00 HEXOKINASE PII user 5 3 # 5 A 158 SER A 57 SER^? 6.85 O2 EDO A 126 A 173 ARG A 79 ARG^? -4.30 O1 EDO A 126s A 211 ASP A 32 ASP.? 9.00 C2 EDO A 125 coo 22.72 76.24 0.23 24.60 76.86 -1.25 15.14 41.83 20.35 16.25 40.17 21.70 coo 18.77 77.82 11.69 20.55 80.22 10.73 2.90 41.63 20.04 5.49 40.23 20.98 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 20.30 44.49 25.52 20.49 42.41 25.06 ULMN 3 1ig8_c00 HEXOKINASE PII user 6 3 # 6 A 158 SER B 7 SER^? 13.90 OXT ACT A 123 A 173 ARG A 27 ARG.? 5.17 CH3 ACT A 123 A 211 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 22.72 76.24 0.23 24.60 76.86 -1.25 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 18.77 77.82 11.69 20.55 80.22 10.73 10.94 57.70 24.22 11.90 58.81 21.49 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 3 1ig8_c00 HEXOKINASE PII user 7 3 # 7 A 158 SER B 7 SER^? 13.90 OXT ACT A 123 A 173 ARG A 27 ARG.? 5.17 CH3 ACT A 123 A 211 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 22.72 76.24 0.23 24.60 76.86 -1.25 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 18.77 77.82 11.69 20.55 80.22 10.73 10.94 57.70 24.22 11.90 58.81 21.49 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1ig8_c00 HEXOKINASE PII user 8 3 # 8 A 158 SER B 7 SER^? 13.90 OXT ACT A 123 A 173 ARG A 105 ARG^? 7.37 O1 EDO A 126 A 211 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 22.72 76.24 0.23 24.60 76.86 -1.25 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 18.77 77.82 11.69 20.55 80.22 10.73 5.55 48.74 25.05 2.82 47.97 26.30 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1ig8_c00 HEXOKINASE PII user 9 3 # 9 A 158 SER B 57 SER^? 6.28 O4 PEG B 126 A 173 ARG B 36 ARG^? 14.13 O1 EDO B 124 A 211 ASP B 109 ASP^? -4.16 O4 PEG B 126s coo 22.72 76.24 0.23 24.60 76.86 -1.25 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo 18.77 77.82 11.69 20.55 80.22 10.73 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 4.45 45.35 -19.96 6.21 46.00 -20.89 1ig8_c00 source 1ig8 HEXOKINASE PII : 9 hits 1ig8_c00 naa= 3 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 1 3 # 1 A 14 GLU A 42 GLU^? -4.18 C1 EDO A 128s A 61 GLU B 100 GLU^? 11.75 C1 EDO B 125 A 162 HIS A 4 HIS.? 6.54 O1 EDO A 128 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 19.47 62.47 4.05 21.30 62.78 5.02 coo -4.89 20.85 5.22 -3.95 21.69 6.91 10.53 69.09 -5.55 11.13 70.44 -7.09 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 18.39 63.32 -4.14 17.16 64.86 -3.40 ULMN 3 1j53_c00 DNA POLYMERASE III, EPSILON CHAIN user 2 3 # 2 A 14 GLU B 42 GLU^? 9.23 O2 EDO B 125 A 61 GLU A 100 GLU^? 12.02 O1 EDO A 127 A 162 HIS B 4 HIS^? 16.30 OXT ACT A 123 coo -1.50 25.58 -6.20 -2.54 26.76 -4.79 -4.84 63.10 3.03 -6.17 64.39 2.00 coo -4.89 20.85 5.22 -3.95 21.69 6.91 3.40 65.53 14.62 2.89 66.21 16.58 coo -7.53 27.82 -3.33 -8.58 28.59 -1.68 -4.28 60.61 11.46 -3.09 62.30 11.15 1j53_c00 source 1j53 DNA POLYMERASE III, EPSILON CHAIN : 2 hits 1j53_c00 naa= 3 ULMN 3 1j70_c00 ATP SULPHURYLASE user 1 3 # 1 A 197 ARG A 11 ARG^? -8.10 O1 EDO A 124s A 201 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 204 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 16.32 51.23 -8.65 14.73 48.69 -9.52 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 6.89 48.41 3.38 5.73 47.19 2.13 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 7.05 49.23 -1.00 8.21 47.66 -0.22 ULMN 3 1j70_c00 ATP SULPHURYLASE user 2 3 # 2 A 197 ARG B 11 ARG^? 15.69 O ACT A 123 A 201 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 204 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo -32.92 141.33 -11.12 -31.04 140.06 -13.21 -2.30 47.71 11.46 -0.79 44.99 11.29 coo -19.36 141.46 -7.82 -20.46 139.73 -7.39 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -21.65 146.14 -9.69 -22.29 144.59 -10.94 6.89 48.41 3.38 5.73 47.19 2.13 1j70_c00 source 1j70 ATP SULPHURYLASE : 2 hits 1j70_c00 naa= 3 ULMN 3 1j70_c01 ATP SULPHURYLASE user 1 3 # 1 B 197 ARG A 11 ARG^? -8.10 O1 EDO A 124s B 201 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 204 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo -18.85 104.93 27.44 -18.03 106.58 29.88 16.32 51.23 -8.65 14.73 48.69 -9.52 coo -8.48 114.03 24.38 -10.47 114.55 23.97 6.89 48.41 3.38 5.73 47.19 2.13 coo -6.99 108.94 26.28 -8.54 109.57 27.55 7.05 49.23 -1.00 8.21 47.66 -0.22 ULMN 3 1j70_c01 ATP SULPHURYLASE user 2 3 # 2 B 197 ARG B 11 ARG^? 15.69 O ACT A 123 B 201 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 204 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo -18.85 104.93 27.44 -18.03 106.58 29.88 -2.30 47.71 11.46 -0.79 44.99 11.29 coo -8.48 114.03 24.38 -10.47 114.55 23.97 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -6.99 108.94 26.28 -8.54 109.57 27.55 6.89 48.41 3.38 5.73 47.19 2.13 1j70_c01 source 1j70 ATP SULPHURYLASE : 2 hits 1j70_c01 naa= 3 ULMN 3 1j70_c02 ATP SULPHURYLASE user 1 3 # 1 C 197 ARG A 11 ARG^? -8.10 O1 EDO A 124s C 201 HIS A 72 HIS^? 15.66 C2 EDO B 124 C 204 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo 30.92 14.23 15.70 28.82 13.90 13.48 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 20.16 5.55 18.86 20.00 7.59 19.34 6.89 48.41 3.38 5.73 47.19 2.13 coo 24.92 3.29 16.90 24.41 4.92 15.69 7.05 49.23 -1.00 8.21 47.66 -0.22 ULMN 3 1j70_c02 ATP SULPHURYLASE user 2 3 # 2 C 197 ARG B 11 ARG^? 15.69 O ACT A 123 C 201 HIS B 72 HIS^? 13.54 O1 EDO A 124 C 204 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo 30.92 14.23 15.70 28.82 13.90 13.48 -2.30 47.71 11.46 -0.79 44.99 11.29 coo 20.16 5.55 18.86 20.00 7.59 19.34 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 24.92 3.29 16.90 24.41 4.92 15.69 6.89 48.41 3.38 5.73 47.19 2.13 1j70_c02 source 1j70 ATP SULPHURYLASE : 2 hits 1j70_c02 naa= 3 ULMN 3 1joa_c00 NADH PEROXIDASE user 1 3 # 1 10 HIS A 88 HIS^? 13.90 OXT ACT A 123 41 SER B 7 SER^? 13.90 OXT ACT A 123 303 ARG B 11 ARG^? 15.69 O ACT A 123 coo 62.94 54.74 73.45 64.13 56.17 74.27 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 65.67 62.51 70.93 64.56 61.94 68.74 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 63.38 52.38 77.01 66.48 52.75 76.49 -2.30 47.71 11.46 -0.79 44.99 11.29 ULMN 3 1joa_c00 NADH PEROXIDASE user 2 3 # 2 10 HIS B 88 HIS^? 7.16 O1 EDO B 123 41 SER A 7 SER.? 11.72 O1 EDO B 123 303 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 62.94 54.74 73.45 64.13 56.17 74.27 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 65.67 62.51 70.93 64.56 61.94 68.74 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 63.38 52.38 77.01 66.48 52.75 76.49 16.32 51.23 -8.65 14.73 48.69 -9.52 1joa_c00 source 1joa NADH PEROXIDASE : 2 hits 1joa_c00 naa= 3 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 A 2 GLU A 54 GLU^? 10.26 O1 EDO A 125 A 56 LYS A 114 LYS^? 4.03 O ACT A 123 A 258 ARG A 110 ARG^? 13.67 O2 EDO A 126 coo 42.33 1.56 26.99 42.38 2.91 28.66 19.19 45.91 11.58 20.09 44.01 11.30 coo 38.45 -0.44 19.89 37.36 0.90 25.90 11.95 48.07 7.92 11.03 52.28 12.68 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 13.94 35.14 15.37 15.97 35.29 13.07 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 A 2 GLU A 75 GLU^? 16.23 O2 EDO A 124 A 56 LYS A 114 LYS^? 4.03 O ACT A 123 A 258 ARG A 110 ARG^? 13.67 O2 EDO A 126 coo 42.33 1.56 26.99 42.38 2.91 28.66 14.12 39.75 7.18 16.10 39.69 6.63 coo 38.45 -0.44 19.89 37.36 0.90 25.90 11.95 48.07 7.92 11.03 52.28 12.68 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 13.94 35.14 15.37 15.97 35.29 13.07 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 A 2 GLU B 54 GLU^? 12.15 C2 EDO B 124 A 56 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 258 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo 42.33 1.56 26.99 42.38 2.91 28.66 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 38.45 -0.44 19.89 37.36 0.90 25.90 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 -0.05 41.10 -16.85 -2.14 40.61 -14.61 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 A 2 GLU B 75 GLU^? 16.27 C2 EDO B 124 A 56 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 258 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo 42.33 1.56 26.99 42.38 2.91 28.66 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 38.45 -0.44 19.89 37.36 0.90 25.90 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 -0.05 41.10 -16.85 -2.14 40.61 -14.61 1k82_c00 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 4 hits 1k82_c00 naa= 3 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 B 2 GLU A 54 GLU^? 10.26 O1 EDO A 125 B 56 LYS A 114 LYS^? 4.03 O ACT A 123 B 258 ARG A 110 ARG^? 13.67 O2 EDO A 126 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 19.19 45.91 11.58 20.09 44.01 11.30 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 11.95 48.07 7.92 11.03 52.28 12.68 coo 2.64 1.83 34.81 1.56 1.13 32.02 13.94 35.14 15.37 15.97 35.29 13.07 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 B 2 GLU A 75 GLU^? 16.23 O2 EDO A 124 B 56 LYS A 114 LYS^? 4.03 O ACT A 123 B 258 ARG A 110 ARG^? 13.67 O2 EDO A 126 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 14.12 39.75 7.18 16.10 39.69 6.63 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 11.95 48.07 7.92 11.03 52.28 12.68 coo 2.64 1.83 34.81 1.56 1.13 32.02 13.94 35.14 15.37 15.97 35.29 13.07 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 B 2 GLU B 54 GLU^? 12.15 C2 EDO B 124 B 56 LYS B 114 LYS^? -2.62 O2 EDO B 124s B 258 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 2.64 1.83 34.81 1.56 1.13 32.02 -0.05 41.10 -16.85 -2.14 40.61 -14.61 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 B 2 GLU B 75 GLU^? 16.27 C2 EDO B 124 B 56 LYS B 114 LYS^? -2.62 O2 EDO B 124s B 258 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 2.64 1.83 34.81 1.56 1.13 32.02 -0.05 41.10 -16.85 -2.14 40.61 -14.61 1k82_c01 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 4 hits 1k82_c01 naa= 3 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 C 2 GLU A 54 GLU^? 10.26 O1 EDO A 125 C 56 LYS A 114 LYS^? 4.03 O ACT A 123 C 258 ARG A 110 ARG^? 13.67 O2 EDO A 126 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 19.19 45.91 11.58 20.09 44.01 11.30 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 11.95 48.07 7.92 11.03 52.28 12.68 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 13.94 35.14 15.37 15.97 35.29 13.07 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 C 2 GLU A 75 GLU^? 16.23 O2 EDO A 124 C 56 LYS A 114 LYS^? 4.03 O ACT A 123 C 258 ARG A 110 ARG^? 13.67 O2 EDO A 126 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 14.12 39.75 7.18 16.10 39.69 6.63 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 11.95 48.07 7.92 11.03 52.28 12.68 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 13.94 35.14 15.37 15.97 35.29 13.07 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 C 2 GLU B 54 GLU^? 12.15 C2 EDO B 124 C 56 LYS B 114 LYS^? -2.62 O2 EDO B 124s C 258 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 -0.05 41.10 -16.85 -2.14 40.61 -14.61 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 C 2 GLU B 75 GLU^? 16.27 C2 EDO B 124 C 56 LYS B 114 LYS^? -2.62 O2 EDO B 124s C 258 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 -0.05 41.10 -16.85 -2.14 40.61 -14.61 1k82_c02 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 4 hits 1k82_c02 naa= 3 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 D 2 GLU A 54 GLU^? 10.26 O1 EDO A 125 D 56 LYS A 114 LYS^? 4.03 O ACT A 123 D 258 ARG A 110 ARG^? 13.67 O2 EDO A 126 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 19.19 45.91 11.58 20.09 44.01 11.30 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 11.95 48.07 7.92 11.03 52.28 12.68 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 13.94 35.14 15.37 15.97 35.29 13.07 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 D 2 GLU A 75 GLU^? 16.23 O2 EDO A 124 D 56 LYS A 114 LYS^? 4.03 O ACT A 123 D 258 ARG A 110 ARG^? 13.67 O2 EDO A 126 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 14.12 39.75 7.18 16.10 39.69 6.63 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 11.95 48.07 7.92 11.03 52.28 12.68 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 13.94 35.14 15.37 15.97 35.29 13.07 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 D 2 GLU B 54 GLU^? 12.15 C2 EDO B 124 D 56 LYS B 114 LYS^? -2.62 O2 EDO B 124s D 258 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 -0.05 41.10 -16.85 -2.14 40.61 -14.61 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 D 2 GLU B 75 GLU^? 16.27 C2 EDO B 124 D 56 LYS B 114 LYS^? -2.62 O2 EDO B 124s D 258 ARG B 110 ARG^? 12.48 O4 PEG B 126 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 -0.05 41.10 -16.85 -2.14 40.61 -14.61 1k82_c03 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 4 hits 1k82_c03 naa= 3 ULMN 3 1kim_c00 THYMIDINE KINASE user 1 3 # 1 A 83 GLU A 107 GLU^? -3.18 O1 EDO A 126s A 163 ARG A 79 ARG^? -4.30 O1 EDO A 126s A 222 ARG A 105 ARG^? 7.37 O1 EDO A 126 coo 51.27 81.34 48.31 51.67 80.79 50.28 6.31 45.06 22.90 4.64 44.18 23.93 coo 48.06 78.22 50.94 48.51 78.27 53.98 2.90 41.63 20.04 5.49 40.23 20.98 coo 54.85 84.16 52.60 54.26 81.23 53.34 5.55 48.74 25.05 2.82 47.97 26.30 ULMN 3 1kim_c00 THYMIDINE KINASE user 2 3 # 2 A 83 GLU A 107 GLU^? -3.18 O1 EDO A 126s A 163 ARG A 105 ARG^? 7.37 O1 EDO A 126 A 222 ARG A 79 ARG^? -4.30 O1 EDO A 126s coo 51.27 81.34 48.31 51.67 80.79 50.28 6.31 45.06 22.90 4.64 44.18 23.93 coo 48.06 78.22 50.94 48.51 78.27 53.98 5.55 48.74 25.05 2.82 47.97 26.30 coo 54.85 84.16 52.60 54.26 81.23 53.34 2.90 41.63 20.04 5.49 40.23 20.98 ULMN 3 1kim_c00 THYMIDINE KINASE user 3 3 # 3 A 83 GLU B 107 GLU^? -3.66 C1 PEG B 126s A 163 ARG B 79 ARG^? -4.39 C1 PEG B 126s A 222 ARG B 105 ARG^? 8.10 C1 PEG B 126 coo 51.27 81.34 48.31 51.67 80.79 50.28 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 48.06 78.22 50.94 48.51 78.27 53.98 11.19 48.56 -18.94 8.63 47.63 -20.34 coo 54.85 84.16 52.60 54.26 81.23 53.34 8.93 56.93 -21.13 11.75 56.76 -22.27 ULMN 3 1kim_c00 THYMIDINE KINASE user 4 3 # 4 A 83 GLU B 107 GLU^? -3.66 C1 PEG B 126s A 163 ARG B 105 ARG^? 8.10 C1 PEG B 126 A 222 ARG B 79 ARG^? -4.39 C1 PEG B 126s coo 51.27 81.34 48.31 51.67 80.79 50.28 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 48.06 78.22 50.94 48.51 78.27 53.98 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 54.85 84.16 52.60 54.26 81.23 53.34 11.19 48.56 -18.94 8.63 47.63 -20.34 1kim_c00 source 1kim THYMIDINE KINASE : 4 hits 1kim_c00 naa= 3 ULMN 3 1kqf_c03 FORMATE DEHYDROGENASE, NITRATE-INDUCuser 1 3 # 1 A 94 LYS A 114 LYS^? 4.03 O ACT A 123 A 197 HIS B 88 HIS^? 7.16 O1 EDO B 123 A 446 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 3.26 62.02 109.14 4.83 57.73 107.38 11.95 48.07 7.92 11.03 52.28 12.68 coo 9.48 43.28 113.60 10.05 44.21 111.80 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 12.14 46.28 115.16 13.57 43.60 115.68 16.32 51.23 -8.65 14.73 48.69 -9.52 ULMN 3 1kqf_c03 FORMATE DEHYDROGENASE, NITRATE-INDUCuser 2 3 # 2 A 94 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 197 HIS A 88 HIS^? 13.90 OXT ACT A 123 A 446 ARG B 11 ARG^? 15.69 O ACT A 123 coo 3.26 62.02 109.14 4.83 57.73 107.38 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 9.48 43.28 113.60 10.05 44.21 111.80 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 12.14 46.28 115.16 13.57 43.60 115.68 -2.30 47.71 11.46 -0.79 44.99 11.29 1kqf_c03 source 1kqf FORMATE DEHYDROGENASE, NITRATE-INDUCIBLE, CYTO: 2 hits 1kqf_c03 naa= 3 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 # 1 255 ASP A 94 ASP.? 16.52 O ACT A 123 262 LYS A 114 LYS^? 4.03 O ACT A 123 336 ARG A 79 ARG^? -4.30 O1 EDO A 126s coo 61.88 50.78 12.96 63.84 50.60 13.71 2.85 44.85 7.76 1.66 43.09 7.95 coo 63.59 44.40 18.32 63.20 49.74 17.95 11.95 48.07 7.92 11.03 52.28 12.68 coo 72.60 57.42 15.86 71.61 56.68 18.70 2.90 41.63 20.04 5.49 40.23 20.98 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP B 94 ASP^? 10.22 O1 EDO A 124 262 LYS B 114 LYS^? -2.62 O2 EDO B 124s 336 ARG B 79 ARG^? -4.39 C1 PEG B 126s coo 61.88 50.78 12.96 63.84 50.60 13.71 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 63.59 44.40 18.32 63.20 49.74 17.95 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 72.60 57.42 15.86 71.61 56.68 18.70 11.19 48.56 -18.94 8.63 47.63 -20.34 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 2 hits 1lam_c00 naa= 3 ULMN 3 1lci_c00 LUCIFERASE user 1 3 # 1 218 ARG A 105 ARG^? 7.37 O1 EDO A 126 245 HIS A 88 HIS^? 13.90 OXT ACT A 123 343 THR A 86 THR.? 15.12 O1 EDO A 126 coo 18.11 85.25 41.19 18.04 83.33 43.59 5.55 48.74 25.05 2.82 47.97 26.30 coo 5.34 86.23 43.48 6.16 87.26 45.12 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 9.06 92.76 42.80 7.04 92.63 42.14 -4.19 48.24 21.18 -5.67 49.16 19.86 ULMN 3 1lci_c00 LUCIFERASE user 2 3 # 2 218 ARG B 105 ARG^? 8.10 C1 PEG B 126 245 HIS B 88 HIS^? 7.16 O1 EDO B 123 343 THR B 86 THR^? -2.76 O1 EDO B 123s coo 18.11 85.25 41.19 18.04 83.33 43.59 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 5.34 86.23 43.48 6.16 87.26 45.12 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 9.06 92.76 42.80 7.04 92.63 42.14 18.42 55.14 -17.57 19.88 55.50 -16.03 1lci_c00 source 1lci LUCIFERASE : 2 hits 1lci_c00 naa= 3 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 1 3 # 1 166 ASP A 5 ASP.? 11.32 O1 EDO B 123 169 ARG A 8 ARG.? -3.85 O1 EDO B 123s 193 HIS A 4 HIS.? 6.54 O1 EDO A 128 coo 20.88 15.91 3.60 20.25 17.72 4.50 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 17.70 17.91 -0.80 15.74 19.74 0.84 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 18.81 19.85 7.63 17.55 19.89 5.97 18.39 63.32 -4.14 17.16 64.86 -3.40 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 2 3 # 2 166 ASP B 5 ASP^? 17.31 OXT ACT A 123 169 ARG B 8 ARG^? 17.13 OXT ACT A 123 193 HIS B 4 HIS^? 16.30 OXT ACT A 123 coo 20.88 15.91 3.60 20.25 17.72 4.50 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 17.70 17.91 -0.80 15.74 19.74 0.84 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 18.81 19.85 7.63 17.55 19.89 5.97 -4.28 60.61 11.46 -3.09 62.30 11.15 1ldm_c01 source 1ldm M4 LACTATE DEHYDROGENASE : 2 hits 1ldm_c01 naa= 3 ULMN 3 1lij_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 30 ALA^? 5.91 C2 EDO A 126 A 317 GLY A 31 GLY^? 7.19 O2 EDO A 126 A 318 ASP A 32 ASP.? 9.00 C2 EDO A 125 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 13.25 45.75 28.33 12.17 44.74 28.71 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 15.93 43.70 26.69 16.04 44.49 26.98 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 20.30 44.49 25.52 20.49 42.41 25.06 ULMN 3 1lij_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA A 92 ALA.? 17.17 O ACT A 123 A 317 GLY A 93 GLY.? 17.43 O ACT A 123 A 318 ASP A 94 ASP.? 16.52 O ACT A 123 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 7.18 41.33 6.36 8.11 40.19 5.85 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 5.07 43.20 3.81 5.07 43.46 4.54 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1lij_c01 ADENOSINE KINASE user 3 3 # 3 A 316 ALA B 30 ALA^? 5.92 C2 PEG B 126 A 317 GLY B 31 GLY^? 6.91 C3 PEG B 126 A 318 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 0.82 55.62 -25.24 1.89 54.87 -26.04 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1lij_c01 ADENOSINE KINASE user 4 3 # 4 A 316 ALA B 33 ALA^? 8.32 O2 PEG B 126 A 317 GLY B 31 GLY^? 6.91 C3 PEG B 126 A 318 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 -3.27 53.90 -18.94 -1.92 54.28 -18.39 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1lij_c01 ADENOSINE KINASE user 5 3 # 5 A 316 ALA B 92 ALA^? 16.52 O2 EDO B 124 A 317 GLY B 93 GLY^? 13.55 O1 EDO A 124 A 318 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 6.78 43.61 -6.33 5.76 42.38 -6.21 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 8.78 44.49 -3.21 8.81 45.00 -3.81 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 11.18 47.39 -6.30 12.32 45.78 -7.12 1lij_c01 source 1lij ADENOSINE KINASE : 5 hits 1lij_c01 naa= 3 ULMN 3 1lio_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 92 ALA.? 17.17 O ACT A 123 A 317 GLY A 93 GLY.? 17.43 O ACT A 123 A 318 ASP A 94 ASP.? 16.52 O ACT A 123 coo 27.04 23.54 41.85 25.72 24.19 42.18 7.18 41.33 6.36 8.11 40.19 5.85 coo 27.87 23.16 38.17 28.43 22.97 38.87 5.07 43.20 3.81 5.07 43.46 4.54 coo 32.11 22.71 40.58 33.42 24.22 39.78 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1lio_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA B 30 ALA^? 5.92 C2 PEG B 126 A 317 GLY B 31 GLY^? 6.91 C3 PEG B 126 A 318 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 27.04 23.54 41.85 25.72 24.19 42.18 0.82 55.62 -25.24 1.89 54.87 -26.04 coo 27.87 23.16 38.17 28.43 22.97 38.87 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 32.11 22.71 40.58 33.42 24.22 39.78 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1lio_c01 ADENOSINE KINASE user 3 3 # 3 A 316 ALA B 33 ALA^? 8.32 O2 PEG B 126 A 317 GLY B 31 GLY^? 6.91 C3 PEG B 126 A 318 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 27.04 23.54 41.85 25.72 24.19 42.18 -3.27 53.90 -18.94 -1.92 54.28 -18.39 coo 27.87 23.16 38.17 28.43 22.97 38.87 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 32.11 22.71 40.58 33.42 24.22 39.78 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1lio_c01 ADENOSINE KINASE user 4 3 # 4 A 316 ALA B 92 ALA^? 16.52 O2 EDO B 124 A 317 GLY B 93 GLY^? 13.55 O1 EDO A 124 A 318 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 27.04 23.54 41.85 25.72 24.19 42.18 6.78 43.61 -6.33 5.76 42.38 -6.21 coo 27.87 23.16 38.17 28.43 22.97 38.87 8.78 44.49 -3.21 8.81 45.00 -3.81 coo 32.11 22.71 40.58 33.42 24.22 39.78 11.18 47.39 -6.30 12.32 45.78 -7.12 1lio_c01 source 1lio ADENOSINE KINASE : 4 hits 1lio_c01 naa= 3 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 265 GLU A 69 GLU^? 4.98 OXT ACT A 123 A 369 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 11.74 38.14 80.19 10.63 36.40 80.65 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 17.36 23.57 72.04 18.68 21.92 71.98 8.76 56.68 10.43 10.20 56.07 11.84 coo 12.19 31.08 87.29 11.13 32.66 86.38 11.18 47.39 -6.30 12.32 45.78 -7.12 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 94 ASP.? 16.52 O ACT A 123 A 265 GLU B 69 GLU^? -2.92 O2 EDO B 124s A 369 ASP B 13 ASP^? 17.03 O1 EDO B 124 coo 11.74 38.14 80.19 10.63 36.40 80.65 2.85 44.85 7.76 1.66 43.09 7.95 coo 17.36 23.57 72.04 18.68 21.92 71.98 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 12.19 31.08 87.29 11.13 32.66 86.38 -6.23 48.66 3.73 -7.41 46.97 3.18 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 265 GLU B 69 GLU^? -2.92 O2 EDO B 124s A 369 ASP A 94 ASP.? 16.52 O ACT A 123 coo 11.74 38.14 80.19 10.63 36.40 80.65 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 17.36 23.57 72.04 18.68 21.92 71.98 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 12.19 31.08 87.29 11.13 32.66 86.38 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 4 3 # 4 A 241 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 265 GLU A 69 GLU^? 4.98 OXT ACT A 123 A 369 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 11.74 38.14 80.19 10.63 36.40 80.65 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 17.36 23.57 72.04 18.68 21.92 71.98 8.76 56.68 10.43 10.20 56.07 11.84 coo 12.19 31.08 87.29 11.13 32.66 86.38 20.17 49.39 -1.56 21.38 47.59 -1.63 1m53_c05 source 1m53 ISOMALTULOSE SYNTHASE : 4 hits 1m53_c05 naa= 3 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 94 ASP.? 16.52 O ACT A 123 A 279 GLU A 54 GLU^? 10.26 O1 EDO A 125 A 369 ASP B 13 ASP^? 17.03 O1 EDO B 124 coo 11.74 38.14 80.19 10.63 36.40 80.65 2.85 44.85 7.76 1.66 43.09 7.95 coo 16.54 46.37 63.94 14.77 45.79 62.95 19.19 45.91 11.58 20.09 44.01 11.30 coo 12.19 31.08 87.29 11.13 32.66 86.38 -6.23 48.66 3.73 -7.41 46.97 3.18 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 279 GLU B 54 GLU^? 12.15 C2 EDO B 124 A 369 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 11.74 38.14 80.19 10.63 36.40 80.65 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 16.54 46.37 63.94 14.77 45.79 62.95 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 12.19 31.08 87.29 11.13 32.66 86.38 20.17 49.39 -1.56 21.38 47.59 -1.63 1m53_c06 source 1m53 ISOMALTULOSE SYNTHASE : 2 hits 1m53_c06 naa= 3 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 # 1 159 ARG A 36 ARG^? -3.17 O2 EDO A 125s 229 SER A 34 SER.? -3.56 C2 EDO A 125s 325 GLU A 54 GLU^? 10.26 O1 EDO A 125 coo 2.54 15.84 18.57 3.24 17.85 16.30 24.38 48.23 13.15 25.39 47.42 15.97 coo 10.17 13.48 15.92 9.61 15.76 15.27 20.28 47.66 19.28 22.08 46.10 18.94 coo 5.42 13.04 19.75 5.74 13.81 17.79 19.19 45.91 11.58 20.09 44.01 11.30 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 2 3 # 2 159 ARG A 36 ARG^? -3.17 O2 EDO A 125s 229 SER A 55 SER^? 7.70 O ACT A 123 325 GLU A 54 GLU^? 10.26 O1 EDO A 125 coo 2.54 15.84 18.57 3.24 17.85 16.30 24.38 48.23 13.15 25.39 47.42 15.97 coo 10.17 13.48 15.92 9.61 15.76 15.27 16.48 46.12 15.51 15.38 46.59 17.63 coo 5.42 13.04 19.75 5.74 13.81 17.79 19.19 45.91 11.58 20.09 44.01 11.30 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 3 3 # 3 159 ARG A 79 ARG^? -4.30 O1 EDO A 126s 229 SER A 59 SER^? 4.36 C2 EDO A 126 325 GLU A 107 GLU^? -3.18 O1 EDO A 126s coo 2.54 15.84 18.57 3.24 17.85 16.30 2.90 41.63 20.04 5.49 40.23 20.98 coo 10.17 13.48 15.92 9.61 15.76 15.27 11.11 46.68 23.73 10.51 46.10 25.99 coo 5.42 13.04 19.75 5.74 13.81 17.79 6.31 45.06 22.90 4.64 44.18 23.93 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 4 3 # 4 159 ARG B 36 ARG^? 14.13 O1 EDO B 124 229 SER B 34 SER^? 13.24 C2 EDO B 124 325 GLU B 54 GLU^? 12.15 C2 EDO B 124 coo 2.54 15.84 18.57 3.24 17.85 16.30 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo 10.17 13.48 15.92 9.61 15.76 15.27 -6.11 54.18 -16.40 -8.31 53.39 -15.87 coo 5.42 13.04 19.75 5.74 13.81 17.79 -5.07 50.29 -9.79 -6.20 48.55 -10.09 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 5 3 # 5 159 ARG B 36 ARG^? 14.13 O1 EDO B 124 229 SER B 55 SER^? 9.36 O2 PEG B 126 325 GLU B 54 GLU^? 12.15 C2 EDO B 124 coo 2.54 15.84 18.57 3.24 17.85 16.30 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo 10.17 13.48 15.92 9.61 15.76 15.27 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo 5.42 13.04 19.75 5.74 13.81 17.79 -5.07 50.29 -9.79 -6.20 48.55 -10.09 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 6 3 # 6 159 ARG B 79 ARG^? -4.39 C1 PEG B 126s 229 SER B 59 SER^? 4.17 C2 PEG B 126 325 GLU B 107 GLU^? -3.66 C1 PEG B 126s coo 2.54 15.84 18.57 3.24 17.85 16.30 11.19 48.56 -18.94 8.63 47.63 -20.34 coo 10.17 13.48 15.92 9.61 15.76 15.27 3.03 54.79 -20.60 3.74 54.94 -22.89 coo 5.42 13.04 19.75 5.74 13.81 17.79 7.84 52.79 -20.58 9.53 52.35 -21.72 1mbb_c00 source 1mbb URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMI: 6 hits 1mbb_c00 naa= 3 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 # 1 A 465 GLY A 15 GLY.? 7.73 O2 EDO A 124 A 501 ASP A 109 ASP^? -4.58 O2 EDO A 126s B 367 TYR B 67 TYR^? -3.57 C1 EDO B 125s coo 4.40 25.46 -23.33 5.00 25.87 -23.68 20.36 44.24 0.16 20.26 44.88 0.74 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 9.63 38.15 19.81 7.90 38.49 20.93 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 4.90 65.99 -5.12 3.99 64.76 -7.44 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 2 3 # 2 A 465 GLY A 15 GLY.? 7.73 O2 EDO A 124 A 501 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 367 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 20.36 44.24 0.16 20.26 44.88 0.74 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 3 3 # 3 A 465 GLY A 85 GLY.? 11.94 O1 EDO A 126 A 501 ASP A 32 ASP.? 9.00 C2 EDO A 125 B 367 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 -2.98 48.97 24.74 -3.25 49.30 24.08 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 20.30 44.49 25.52 20.49 42.41 25.06 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 0.65 57.23 -3.12 -1.98 58.01 -2.52 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 4 3 # 4 A 465 GLY B 15 GLY^? 17.15 C2 EDO B 124 A 501 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 367 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 -6.29 44.44 0.22 -6.18 45.23 -0.09 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 11.57 61.77 -11.34 12.14 59.44 -12.79 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 5 3 # 5 A 465 GLY B 15 GLY^? 17.15 C2 EDO B 124 A 501 ASP B 109 ASP^? -4.16 O4 PEG B 126s B 367 TYR A 67 TYR^? -4.09 C2 EDO A 127s coo 4.40 25.46 -23.33 5.00 25.87 -23.68 -6.29 44.44 0.22 -6.18 45.23 -0.09 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 9.19 62.70 13.11 10.16 60.66 14.79 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 6 3 # 6 A 465 GLY B 85 GLY^? 6.90 C2 EDO B 123 A 501 ASP B 32 ASP^? 11.80 C3 PEG B 126 B 367 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 17.33 56.99 -20.74 17.59 57.10 -19.99 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 -5.79 54.47 -23.19 -5.94 55.44 -25.07 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 13.42 55.06 8.10 16.05 56.03 7.83 1mro_c00 source 1mro METHYL-COENZYME M REDUCTASE : 6 hits 1mro_c00 naa= 3 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 # 1 D 465 GLY A 15 GLY.? 7.73 O2 EDO A 124 D 501 ASP A 109 ASP^? -4.58 O2 EDO A 126s E 367 TYR B 67 TYR^? -3.57 C1 EDO B 125s coo 21.60 60.44 -42.77 21.61 59.72 -42.40 20.36 44.24 0.16 20.26 44.88 0.74 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 9.63 38.15 19.81 7.90 38.49 20.93 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 4.90 65.99 -5.12 3.99 64.76 -7.44 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 2 3 # 2 D 465 GLY A 15 GLY.? 7.73 O2 EDO A 124 D 501 ASP B 82 ASP^? 7.08 O1 EDO B 123 E 367 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 20.36 44.24 0.16 20.26 44.88 0.74 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 3 3 # 3 D 465 GLY B 15 GLY^? 17.15 C2 EDO B 124 D 501 ASP A 82 ASP.? 12.57 OXT ACT A 123 E 367 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 -6.29 44.44 0.22 -6.18 45.23 -0.09 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 11.57 61.77 -11.34 12.14 59.44 -12.79 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 4 3 # 4 D 465 GLY B 15 GLY^? 17.15 C2 EDO B 124 D 501 ASP B 109 ASP^? -4.16 O4 PEG B 126s E 367 TYR A 67 TYR^? -4.09 C2 EDO A 127s coo 21.60 60.44 -42.77 21.61 59.72 -42.40 -6.29 44.44 0.22 -6.18 45.23 -0.09 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 9.19 62.70 13.11 10.16 60.66 14.79 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 5 3 # 5 D 465 GLY B 85 GLY^? 6.90 C2 EDO B 123 D 501 ASP B 32 ASP^? 11.80 C3 PEG B 126 E 367 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 17.33 56.99 -20.74 17.59 57.10 -19.99 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 -5.79 54.47 -23.19 -5.94 55.44 -25.07 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 13.42 55.06 8.10 16.05 56.03 7.83 1mro_c01 source 1mro METHYL-COENZYME M REDUCTASE : 5 hits 1mro_c01 naa= 3 ULMN 3 1mt5_c08 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 I 142 LYS B 113 LYS^? 13.71 C2 EDO B 124 I 217 SER B 55 SER^? 9.36 O2 PEG B 126 I 241 SER B 34 SER^? 13.24 C2 EDO B 124 coo -5.05 91.11 27.04 -1.24 87.39 30.21 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 2.83 88.63 29.54 1.30 86.82 30.03 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo 2.37 88.32 34.25 2.82 86.58 32.61 -6.11 54.18 -16.40 -8.31 53.39 -15.87 ULMN 3 1mt5_c08 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 I 142 LYS B 113 LYS^? 13.71 C2 EDO B 124 I 217 SER B 55 SER^? 9.36 O2 PEG B 126 I 241 SER B 57 SER^? 6.28 O4 PEG B 126 coo -5.05 91.11 27.04 -1.24 87.39 30.21 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 2.83 88.63 29.54 1.30 86.82 30.03 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo 2.37 88.32 34.25 2.82 86.58 32.61 -1.05 49.09 -19.26 -2.38 47.97 -20.95 1mt5_c08 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 2 hits 1mt5_c08 naa= 3 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 A 114 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 197 ASP A 94 ASP.? 16.52 O ACT A 123 A 223 ALA B 40 ALA^? 11.12 O1 EDO B 124 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 6.89 48.41 3.38 5.73 47.19 2.13 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 2.85 44.85 7.76 1.66 43.09 7.95 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 -5.04 55.86 3.46 -3.88 54.80 3.46 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 A 114 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 197 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 223 ALA A 40 ALA^? 5.85 C2 EDO A 128 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 19.00 56.05 1.37 17.90 55.08 0.98 1n2t_c02 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 2 hits 1n2t_c02 naa= 3 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 B 114 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 197 ASP A 94 ASP.? 16.52 O ACT A 123 B 223 ALA B 40 ALA^? 11.12 O1 EDO B 124 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 6.89 48.41 3.38 5.73 47.19 2.13 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 2.85 44.85 7.76 1.66 43.09 7.95 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 -5.04 55.86 3.46 -3.88 54.80 3.46 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 B 114 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 197 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 223 ALA A 40 ALA^? 5.85 C2 EDO A 128 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 19.00 56.05 1.37 17.90 55.08 0.98 1n2t_c03 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 2 hits 1n2t_c03 naa= 3 ULMN 3 1nhx_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE, Cuser 1 3 # 1 A 264 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 290 LYS A 91 LYS^? 18.66 O2 EDO A 126 A 405 ARG B 11 ARG^? 15.69 O ACT A 123 coo 41.33 25.99 28.05 41.95 26.95 29.80 6.89 48.41 3.38 5.73 47.19 2.13 coo 37.11 33.75 31.82 38.72 27.95 29.90 5.43 41.25 9.74 2.02 38.13 6.82 coo 42.28 27.98 41.30 43.16 28.14 38.35 -2.30 47.71 11.46 -0.79 44.99 11.29 ULMN 3 1nhx_c00 PHOSPHOENOLPYRUVATE CARBOXYKINASE, Cuser 2 3 # 2 A 264 HIS B 111 HIS^? 12.89 C3 PEG B 126 A 290 LYS B 91 LYS^? 13.69 O1 EDO A 124 A 405 ARG B 79 ARG^? -4.39 C1 PEG B 126s coo 41.33 25.99 28.05 41.95 26.95 29.80 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo 37.11 33.75 31.82 38.72 27.95 29.90 8.58 44.72 -9.41 12.21 41.02 -7.65 coo 42.28 27.98 41.30 43.16 28.14 38.35 11.19 48.56 -18.94 8.63 47.63 -20.34 1nhx_c00 source 1nhx PHOSPHOENOLPYRUVATE CARBOXYKINASE, CYTOSOLIC : 2 hits 1nhx_c00 naa= 3 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 1 3 # 1 B 59 GLU A 69 GLU^? 4.98 OXT ACT A 123 B 128 HIS B 4 HIS^? 16.30 OXT ACT A 123 C 263 HIS A 88 HIS^? 13.90 OXT ACT A 123 coo 6.12 5.94 82.00 7.16 6.32 83.81 8.76 56.68 10.43 10.20 56.07 11.84 coo 12.51 16.35 80.99 13.16 14.90 82.37 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 11.58 14.94 93.26 12.25 14.03 91.50 -1.51 48.14 15.79 -3.04 49.51 16.18 ULMN 3 1ni4_c00 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 2 3 # 2 B 59 GLU B 69 GLU^? -2.92 O2 EDO B 124s B 128 HIS A 4 HIS.? 6.54 O1 EDO A 128 C 263 HIS B 88 HIS^? 7.16 O1 EDO B 123 coo 6.12 5.94 82.00 7.16 6.32 83.81 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 12.51 16.35 80.99 13.16 14.90 82.37 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 11.58 14.94 93.26 12.25 14.03 91.50 15.57 53.23 -12.61 17.12 54.63 -12.48 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 88 HIS^? 13.90 OXT ACT A 123 D 59 GLU A 69 GLU^? 4.98 OXT ACT A 123 D 128 HIS B 4 HIS^? 16.30 OXT ACT A 123 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 8.76 56.68 10.43 10.20 56.07 11.84 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 -4.28 60.61 11.46 -3.09 62.30 11.15 ULMN 3 1ni4_c01 PYRUVATE DEHYDROGENASE E1 COMPONENT:user 2 3 # 2 A 263 HIS B 88 HIS^? 7.16 O1 EDO B 123 D 59 GLU B 69 GLU^? -2.92 O2 EDO B 124s D 128 HIS A 4 HIS.? 6.54 O1 EDO A 128 coo 8.65 -19.64 67.59 7.76 -17.92 68.39 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 12.72 -5.58 71.72 12.08 -7.54 72.22 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 4.03 -8.95 63.85 3.80 -9.89 65.71 18.39 63.32 -4.14 17.16 64.86 -3.40 1ni4_c01 source 1ni4 PYRUVATE DEHYDROGENASE E1 COMPONENT: ALPHA SUB: 2 hits 1ni4_c01 naa= 3 ULMN 3 1nmw_c00 PEPTIDYL-PROLYL CIS-TRANS ISOMERASE user 1 3 # 1 A 59 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 113 CYH A 71 CYH^? 6.77 OXT ACT A 123 A 157 HIS B 72 HIS^? 13.54 O1 EDO A 124 coo 51.86 1.82 -1.00 52.89 0.19 -1.82 6.89 48.41 3.38 5.73 47.19 2.13 coo 57.27 -1.57 -5.42 55.50 -3.10 -3.86 7.28 52.14 8.02 7.72 52.85 10.71 coo 55.48 0.33 2.46 56.32 -1.35 1.53 7.05 49.23 -1.00 8.21 47.66 -0.22 ULMN 3 1nmw_c00 PEPTIDYL-PROLYL CIS-TRANS ISOMERASE user 2 3 # 2 A 59 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 113 CYH B 71 CYH^? 5.39 O2 EDO B 124 A 157 HIS A 72 HIS^? 15.66 C2 EDO B 124 coo 51.86 1.82 -1.00 52.89 0.19 -1.82 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 57.27 -1.57 -5.42 55.50 -3.10 -3.86 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 55.48 0.33 2.46 56.32 -1.35 1.53 6.89 48.41 3.38 5.73 47.19 2.13 1nmw_c00 source 1nmw PEPTIDYL-PROLYL CIS-TRANS ISOMERASE NIMA- INTE: 2 hits 1nmw_c00 naa= 3 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s A 101 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 132 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 11.61 22.83 17.30 14.06 21.71 15.78 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.37 24.94 11.48 12.48 24.45 13.28 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 16.14 18.17 13.37 15.92 19.81 14.71 20.02 60.63 -18.97 20.31 59.23 -17.40 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s A 101 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 132 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 11.61 22.83 17.30 14.06 21.71 15.78 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.37 24.94 11.48 12.48 24.45 13.28 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 16.14 18.17 13.37 15.92 19.81 14.71 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 A 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s A 101 ASP B 84 ASP^? 4.63 O1 EDO B 123 A 132 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 11.61 22.83 17.30 14.06 21.71 15.78 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.37 24.94 11.48 12.48 24.45 13.28 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 16.14 18.17 13.37 15.92 19.81 14.71 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 A 99 ARG A 11 ARG^? -8.10 O1 EDO A 124s A 101 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 132 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 11.61 22.83 17.30 14.06 21.71 15.78 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 11.37 24.94 11.48 12.48 24.45 13.28 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 16.14 18.17 13.37 15.92 19.81 14.71 20.17 49.39 -1.56 21.38 47.59 -1.63 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 A 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 A 101 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 132 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 11.61 22.83 17.30 14.06 21.71 15.78 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.37 24.94 11.48 12.48 24.45 13.28 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 16.14 18.17 13.37 15.92 19.81 14.71 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 A 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 A 101 ASP A 84 ASP.? 16.56 O1 EDO A 126 A 132 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 11.61 22.83 17.30 14.06 21.71 15.78 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.37 24.94 11.48 12.48 24.45 13.28 -5.66 53.01 24.37 -6.07 52.23 22.45 coo 16.14 18.17 13.37 15.92 19.81 14.71 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 # 7 A 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 A 101 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 132 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 11.61 22.83 17.30 14.06 21.71 15.78 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.37 24.94 11.48 12.48 24.45 13.28 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 16.14 18.17 13.37 15.92 19.81 14.71 -5.66 53.01 24.37 -6.07 52.23 22.45 1nu3_c00 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 7 hits 1nu3_c00 naa= 3 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s B 101 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 132 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 11.61 3.43 18.38 9.11 4.29 16.86 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.74 0.51 12.98 10.75 1.32 14.67 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 6.93 7.52 14.08 7.18 6.08 15.65 20.02 60.63 -18.97 20.31 59.23 -17.40 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s B 101 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 132 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 11.61 3.43 18.38 9.11 4.29 16.86 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.74 0.51 12.98 10.75 1.32 14.67 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 6.93 7.52 14.08 7.18 6.08 15.65 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 B 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s B 101 ASP B 84 ASP^? 4.63 O1 EDO B 123 B 132 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 11.61 3.43 18.38 9.11 4.29 16.86 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.74 0.51 12.98 10.75 1.32 14.67 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 6.93 7.52 14.08 7.18 6.08 15.65 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 B 99 ARG A 11 ARG^? -8.10 O1 EDO A 124s B 101 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 132 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 11.61 3.43 18.38 9.11 4.29 16.86 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 11.74 0.51 12.98 10.75 1.32 14.67 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 6.93 7.52 14.08 7.18 6.08 15.65 20.17 49.39 -1.56 21.38 47.59 -1.63 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 B 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 B 101 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 132 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 11.61 3.43 18.38 9.11 4.29 16.86 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.74 0.51 12.98 10.75 1.32 14.67 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 6.93 7.52 14.08 7.18 6.08 15.65 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 B 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 B 101 ASP A 84 ASP.? 16.56 O1 EDO A 126 B 132 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 11.61 3.43 18.38 9.11 4.29 16.86 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.74 0.51 12.98 10.75 1.32 14.67 -5.66 53.01 24.37 -6.07 52.23 22.45 coo 6.93 7.52 14.08 7.18 6.08 15.65 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 # 7 B 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 B 101 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 132 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 11.61 3.43 18.38 9.11 4.29 16.86 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.74 0.51 12.98 10.75 1.32 14.67 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 6.93 7.52 14.08 7.18 6.08 15.65 -5.66 53.01 24.37 -6.07 52.23 22.45 1nu3_c01 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 7 hits 1nu3_c01 naa= 3 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s A 101 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 132 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 11.50 22.77 17.24 14.00 21.62 15.86 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.19 25.00 11.76 12.16 24.45 13.59 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 16.04 18.11 13.43 15.88 19.70 14.83 20.02 60.63 -18.97 20.31 59.23 -17.40 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s A 101 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 132 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 11.50 22.77 17.24 14.00 21.62 15.86 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.19 25.00 11.76 12.16 24.45 13.59 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 16.04 18.11 13.43 15.88 19.70 14.83 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 A 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s A 101 ASP B 84 ASP^? 4.63 O1 EDO B 123 A 132 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 11.50 22.77 17.24 14.00 21.62 15.86 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.19 25.00 11.76 12.16 24.45 13.59 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 16.04 18.11 13.43 15.88 19.70 14.83 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 A 99 ARG A 11 ARG^? -8.10 O1 EDO A 124s A 101 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 132 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 11.50 22.77 17.24 14.00 21.62 15.86 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 11.19 25.00 11.76 12.16 24.45 13.59 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 16.04 18.11 13.43 15.88 19.70 14.83 20.17 49.39 -1.56 21.38 47.59 -1.63 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 A 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 A 101 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 132 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 11.50 22.77 17.24 14.00 21.62 15.86 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.19 25.00 11.76 12.16 24.45 13.59 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 16.04 18.11 13.43 15.88 19.70 14.83 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 A 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 A 101 ASP A 84 ASP.? 16.56 O1 EDO A 126 A 132 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 11.50 22.77 17.24 14.00 21.62 15.86 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.19 25.00 11.76 12.16 24.45 13.59 -5.66 53.01 24.37 -6.07 52.23 22.45 coo 16.04 18.11 13.43 15.88 19.70 14.83 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 # 7 A 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 A 101 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 132 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 11.50 22.77 17.24 14.00 21.62 15.86 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.19 25.00 11.76 12.16 24.45 13.59 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 16.04 18.11 13.43 15.88 19.70 14.83 -5.66 53.01 24.37 -6.07 52.23 22.45 1nww_c02 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 7 hits 1nww_c02 naa= 3 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s B 101 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 132 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 11.48 3.09 18.25 9.01 4.07 16.77 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.83 0.33 13.01 10.88 1.04 14.81 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 6.85 7.33 14.07 7.10 5.88 15.60 20.02 60.63 -18.97 20.31 59.23 -17.40 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s B 101 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 132 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 11.48 3.09 18.25 9.01 4.07 16.77 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.83 0.33 13.01 10.88 1.04 14.81 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 6.85 7.33 14.07 7.10 5.88 15.60 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 3 3 # 3 B 99 ARG A 8 ARG.? -3.85 O1 EDO B 123s B 101 ASP B 84 ASP^? 4.63 O1 EDO B 123 B 132 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 11.48 3.09 18.25 9.01 4.07 16.77 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 11.83 0.33 13.01 10.88 1.04 14.81 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 6.85 7.33 14.07 7.10 5.88 15.60 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 4 3 # 4 B 99 ARG A 11 ARG^? -8.10 O1 EDO A 124s B 101 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 132 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 11.48 3.09 18.25 9.01 4.07 16.77 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 11.83 0.33 13.01 10.88 1.04 14.81 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 6.85 7.33 14.07 7.10 5.88 15.60 20.17 49.39 -1.56 21.38 47.59 -1.63 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 5 3 # 5 B 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 B 101 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 132 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 11.48 3.09 18.25 9.01 4.07 16.77 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.83 0.33 13.01 10.88 1.04 14.81 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 6.85 7.33 14.07 7.10 5.88 15.60 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 6 3 # 6 B 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 B 101 ASP A 84 ASP.? 16.56 O1 EDO A 126 B 132 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 11.48 3.09 18.25 9.01 4.07 16.77 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.83 0.33 13.01 10.88 1.04 14.81 -5.66 53.01 24.37 -6.07 52.23 22.45 coo 6.85 7.33 14.07 7.10 5.88 15.60 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 7 3 # 7 B 99 ARG B 8 ARG^? 17.13 OXT ACT A 123 B 101 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 132 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 11.48 3.09 18.25 9.01 4.07 16.77 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 11.83 0.33 13.01 10.88 1.04 14.81 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 6.85 7.33 14.07 7.10 5.88 15.60 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 8 3 # 8 B 99 ARG B 11 ARG^? 15.69 O ACT A 123 B 101 ASP A 94 ASP.? 16.52 O ACT A 123 B 132 ASP B 13 ASP^? 17.03 O1 EDO B 124 coo 11.48 3.09 18.25 9.01 4.07 16.77 -2.30 47.71 11.46 -0.79 44.99 11.29 coo 11.83 0.33 13.01 10.88 1.04 14.81 2.85 44.85 7.76 1.66 43.09 7.95 coo 6.85 7.33 14.07 7.10 5.88 15.60 -6.23 48.66 3.73 -7.41 46.97 3.18 1nww_c03 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 8 hits 1nww_c03 naa= 3 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 A 24 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 A 177 LYS A 114 LYS^? 4.03 O ACT A 123 coo -3.50 124.89 25.05 -2.25 124.77 23.26 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 1.87 119.38 16.45 1.41 122.11 16.84 13.42 55.06 8.10 16.05 56.03 7.83 coo -2.59 124.07 12.67 -0.91 126.17 18.42 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 A 24 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 A 177 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -3.50 124.89 25.05 -2.25 124.77 23.26 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 1.87 119.38 16.45 1.41 122.11 16.84 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo -2.59 124.07 12.67 -0.91 126.17 18.42 1.96 50.52 -5.38 3.03 56.08 -8.37 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 13 ASP.? -3.81 O2 EDO A 124s B 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 B 177 LYS A 114 LYS^? 4.03 O ACT A 123 coo -7.43 109.06 51.23 -5.84 110.54 50.86 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 0.22 114.56 44.62 -0.76 115.18 47.18 13.42 55.06 8.10 16.05 56.03 7.83 coo -4.18 120.17 46.85 -4.02 115.31 51.00 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 B 24 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 B 177 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -7.43 109.06 51.23 -5.84 110.54 50.86 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 0.22 114.56 44.62 -0.76 115.18 47.18 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo -4.18 120.17 46.85 -4.02 115.31 51.00 1.96 50.52 -5.38 3.03 56.08 -8.37 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 13 ASP.? -3.81 O2 EDO A 124s C 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 C 177 LYS A 114 LYS^? 4.03 O ACT A 123 coo -13.49 79.65 43.90 -12.13 80.29 45.45 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -5.65 86.78 48.49 -7.16 84.72 49.65 13.42 55.06 8.10 16.05 56.03 7.83 coo -11.22 87.18 53.49 -10.94 81.64 50.31 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 C 24 ASP B 13 ASP^? 17.03 O1 EDO B 124 C 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 C 177 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -13.49 79.65 43.90 -12.13 80.29 45.45 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -5.65 86.78 48.49 -7.16 84.72 49.65 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo -11.22 87.18 53.49 -10.94 81.64 50.31 1.96 50.52 -5.38 3.03 56.08 -8.37 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 13 ASP.? -3.81 O2 EDO A 124s D 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 D 177 LYS A 114 LYS^? 4.03 O ACT A 123 coo -13.44 77.36 13.12 -12.53 75.97 14.48 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -7.85 74.44 22.75 -9.22 72.86 20.89 13.42 55.06 8.10 16.05 56.03 7.83 coo -14.24 70.61 23.48 -12.55 71.73 17.42 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 D 24 ASP B 13 ASP^? 17.03 O1 EDO B 124 D 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 D 177 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -13.44 77.36 13.12 -12.53 75.97 14.48 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -7.85 74.44 22.75 -9.22 72.86 20.89 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo -14.24 70.61 23.48 -12.55 71.73 17.42 1.96 50.52 -5.38 3.03 56.08 -8.37 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 13 ASP.? -3.81 O2 EDO A 124s E 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 E 177 LYS A 114 LYS^? 4.03 O ACT A 123 coo -7.12 105.25 1.43 -6.30 103.34 0.77 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -3.11 94.55 3.01 -3.83 95.92 0.66 13.42 55.06 8.10 16.05 56.03 7.83 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 E 24 ASP B 13 ASP^? 17.03 O1 EDO B 124 E 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 E 177 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -7.12 105.25 1.43 -6.30 103.34 0.77 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -3.11 94.55 3.01 -3.83 95.92 0.66 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 1.96 50.52 -5.38 3.03 56.08 -8.37 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 13 ASP.? -3.81 O2 EDO A 124s F 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 F 177 LYS A 114 LYS^? 4.03 O ACT A 123 coo -44.75 128.15 10.28 -45.68 129.67 11.55 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -50.43 131.90 19.60 -49.04 133.31 17.60 13.42 55.06 8.10 16.05 56.03 7.83 coo -44.10 135.86 19.99 -45.67 134.21 14.07 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 F 24 ASP B 13 ASP^? 17.03 O1 EDO B 124 F 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 F 177 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -44.75 128.15 10.28 -45.68 129.67 11.55 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -50.43 131.90 19.60 -49.04 133.31 17.60 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo -44.10 135.86 19.99 -45.67 134.21 14.07 1.96 50.52 -5.38 3.03 56.08 -8.37 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 13 ASP.? -3.81 O2 EDO A 124s G 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 G 177 LYS A 114 LYS^? 4.03 O ACT A 123 coo -44.97 128.78 41.20 -46.32 128.26 42.83 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -52.83 122.13 46.42 -51.31 124.30 47.39 13.42 55.06 8.10 16.05 56.03 7.83 coo -47.30 122.24 51.49 -47.46 127.44 47.81 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 G 24 ASP B 13 ASP^? 17.03 O1 EDO B 124 G 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 G 177 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -44.97 128.78 41.20 -46.32 128.26 42.83 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -52.83 122.13 46.42 -51.31 124.30 47.39 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo -47.30 122.24 51.49 -47.46 127.44 47.81 1.96 50.52 -5.38 3.03 56.08 -8.37 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 13 ASP.? -3.81 O2 EDO A 124s H 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 H 177 LYS A 114 LYS^? 4.03 O ACT A 123 coo -51.11 100.30 51.41 -52.67 98.82 51.12 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -58.70 94.17 45.32 -57.76 93.82 47.92 13.42 55.06 8.10 16.05 56.03 7.83 coo -54.32 88.79 48.13 -54.61 94.04 51.74 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 H 24 ASP B 13 ASP^? 17.03 O1 EDO B 124 H 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 H 177 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -51.11 100.30 51.41 -52.67 98.82 51.12 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -58.70 94.17 45.32 -57.76 93.82 47.92 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo -54.32 88.79 48.13 -54.61 94.04 51.74 1.96 50.52 -5.38 3.03 56.08 -8.37 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 13 ASP.? -3.81 O2 EDO A 124s I 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 I 177 LYS A 114 LYS^? 4.03 O ACT A 123 coo -54.65 81.97 26.87 -55.88 81.89 25.07 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -59.92 86.62 17.74 -59.42 83.94 18.40 13.42 55.06 8.10 16.05 56.03 7.83 coo -55.38 81.61 14.50 -57.11 80.05 20.41 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 I 24 ASP B 13 ASP^? 17.03 O1 EDO B 124 I 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 I 177 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -54.65 81.97 26.87 -55.88 81.89 25.07 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -59.92 86.62 17.74 -59.42 83.94 18.40 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo -55.38 81.61 14.50 -57.11 80.05 20.41 1.96 50.52 -5.38 3.03 56.08 -8.37 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 13 ASP.? -3.81 O2 EDO A 124s J 146 TYR A 116 TYR^? 6.05 O2 EDO A 127 J 177 LYS A 114 LYS^? 4.03 O ACT A 123 coo -50.64 99.08 1.52 -51.52 100.83 0.67 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 13.42 55.06 8.10 16.05 56.03 7.83 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 J 24 ASP B 13 ASP^? 17.03 O1 EDO B 124 J 146 TYR B 116 TYR^? 3.94 O1 EDO B 124 J 177 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo -50.64 99.08 1.52 -51.52 100.83 0.67 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 1.96 50.52 -5.38 3.03 56.08 -8.37 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 13 ASP.? -3.81 O2 EDO A 124s A 96 GLU A 54 GLU^? 10.26 O1 EDO A 125 A 132 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 31.23 12.29 16.44 30.82 11.56 18.39 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 26.82 3.20 24.36 27.99 4.86 24.98 19.19 45.91 11.58 20.09 44.01 11.30 coo 29.99 0.62 22.18 30.38 6.69 20.81 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1onr_c00 TRANSALDOLASE B user 2 3 # 2 A 17 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 96 GLU A 75 GLU^? 16.23 O2 EDO A 124 A 132 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 31.23 12.29 16.44 30.82 11.56 18.39 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 26.82 3.20 24.36 27.99 4.86 24.98 14.12 39.75 7.18 16.10 39.69 6.63 coo 29.99 0.62 22.18 30.38 6.69 20.81 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1onr_c00 TRANSALDOLASE B user 3 3 # 3 A 17 ASP A 94 ASP.? 16.52 O ACT A 123 A 96 GLU A 75 GLU^? 16.23 O2 EDO A 124 A 132 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 31.23 12.29 16.44 30.82 11.56 18.39 2.85 44.85 7.76 1.66 43.09 7.95 coo 26.82 3.20 24.36 27.99 4.86 24.98 14.12 39.75 7.18 16.10 39.69 6.63 coo 29.99 0.62 22.18 30.38 6.69 20.81 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1onr_c00 TRANSALDOLASE B user 4 3 # 4 A 17 ASP A 109 ASP^? -4.58 O2 EDO A 126s A 96 GLU A 75 GLU^? 16.23 O2 EDO A 124 A 132 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 31.23 12.29 16.44 30.82 11.56 18.39 9.63 38.15 19.81 7.90 38.49 20.93 coo 26.82 3.20 24.36 27.99 4.86 24.98 14.12 39.75 7.18 16.10 39.69 6.63 coo 29.99 0.62 22.18 30.38 6.69 20.81 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1onr_c00 TRANSALDOLASE B user 5 3 # 5 A 17 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 96 GLU B 54 GLU^? 12.15 C2 EDO B 124 A 132 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 31.23 12.29 16.44 30.82 11.56 18.39 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 26.82 3.20 24.36 27.99 4.86 24.98 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 29.99 0.62 22.18 30.38 6.69 20.81 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1onr_c00 TRANSALDOLASE B user 6 3 # 6 A 17 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 96 GLU B 75 GLU^? 16.27 C2 EDO B 124 A 132 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 31.23 12.29 16.44 30.82 11.56 18.39 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 26.82 3.20 24.36 27.99 4.86 24.98 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 29.99 0.62 22.18 30.38 6.69 20.81 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1onr_c00 TRANSALDOLASE B user 7 3 # 7 A 17 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 96 GLU B 75 GLU^? 16.27 C2 EDO B 124 A 132 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 31.23 12.29 16.44 30.82 11.56 18.39 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 26.82 3.20 24.36 27.99 4.86 24.98 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 29.99 0.62 22.18 30.38 6.69 20.81 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1onr_c00 TRANSALDOLASE B user 8 3 # 8 A 17 ASP B 109 ASP^? -4.16 O4 PEG B 126s A 96 GLU B 54 GLU^? 12.15 C2 EDO B 124 A 132 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 31.23 12.29 16.44 30.82 11.56 18.39 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 26.82 3.20 24.36 27.99 4.86 24.98 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 29.99 0.62 22.18 30.38 6.69 20.81 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1onr_c00 TRANSALDOLASE B user 9 3 # 9 A 17 ASP B 109 ASP^? -4.16 O4 PEG B 126s A 96 GLU B 75 GLU^? 16.27 C2 EDO B 124 A 132 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 31.23 12.29 16.44 30.82 11.56 18.39 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 26.82 3.20 24.36 27.99 4.86 24.98 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 29.99 0.62 22.18 30.38 6.69 20.81 0.03 48.55 -7.94 -5.29 45.92 -6.26 1onr_c00 source 1onr TRANSALDOLASE B : 9 hits 1onr_c00 naa= 3 ULMN 3 1onr_c01 TRANSALDOLASE B user 1 3 # 1 B 17 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 96 GLU A 54 GLU^? 10.26 O1 EDO A 125 B 132 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 31.16 57.31 -0.94 30.73 56.64 1.01 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 26.69 48.45 7.18 27.85 50.13 7.74 19.19 45.91 11.58 20.09 44.01 11.30 coo 29.82 45.80 5.07 30.26 51.81 3.56 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1onr_c01 TRANSALDOLASE B user 2 3 # 2 B 17 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 96 GLU A 75 GLU^? 16.23 O2 EDO A 124 B 132 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 31.16 57.31 -0.94 30.73 56.64 1.01 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 26.69 48.45 7.18 27.85 50.13 7.74 14.12 39.75 7.18 16.10 39.69 6.63 coo 29.82 45.80 5.07 30.26 51.81 3.56 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1onr_c01 TRANSALDOLASE B user 3 3 # 3 B 17 ASP A 94 ASP.? 16.52 O ACT A 123 B 96 GLU A 75 GLU^? 16.23 O2 EDO A 124 B 132 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 31.16 57.31 -0.94 30.73 56.64 1.01 2.85 44.85 7.76 1.66 43.09 7.95 coo 26.69 48.45 7.18 27.85 50.13 7.74 14.12 39.75 7.18 16.10 39.69 6.63 coo 29.82 45.80 5.07 30.26 51.81 3.56 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1onr_c01 TRANSALDOLASE B user 4 3 # 4 B 17 ASP A 109 ASP^? -4.58 O2 EDO A 126s B 96 GLU A 75 GLU^? 16.23 O2 EDO A 124 B 132 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 31.16 57.31 -0.94 30.73 56.64 1.01 9.63 38.15 19.81 7.90 38.49 20.93 coo 26.69 48.45 7.18 27.85 50.13 7.74 14.12 39.75 7.18 16.10 39.69 6.63 coo 29.82 45.80 5.07 30.26 51.81 3.56 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1onr_c01 TRANSALDOLASE B user 5 3 # 5 B 17 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 96 GLU B 54 GLU^? 12.15 C2 EDO B 124 B 132 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 31.16 57.31 -0.94 30.73 56.64 1.01 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 26.69 48.45 7.18 27.85 50.13 7.74 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 29.82 45.80 5.07 30.26 51.81 3.56 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1onr_c01 TRANSALDOLASE B user 6 3 # 6 B 17 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 96 GLU B 75 GLU^? 16.27 C2 EDO B 124 B 132 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 31.16 57.31 -0.94 30.73 56.64 1.01 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 26.69 48.45 7.18 27.85 50.13 7.74 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 29.82 45.80 5.07 30.26 51.81 3.56 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1onr_c01 TRANSALDOLASE B user 7 3 # 7 B 17 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 96 GLU B 75 GLU^? 16.27 C2 EDO B 124 B 132 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 31.16 57.31 -0.94 30.73 56.64 1.01 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 26.69 48.45 7.18 27.85 50.13 7.74 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 29.82 45.80 5.07 30.26 51.81 3.56 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1onr_c01 TRANSALDOLASE B user 8 3 # 8 B 17 ASP B 109 ASP^? -4.16 O4 PEG B 126s B 96 GLU B 54 GLU^? 12.15 C2 EDO B 124 B 132 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 31.16 57.31 -0.94 30.73 56.64 1.01 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 26.69 48.45 7.18 27.85 50.13 7.74 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 29.82 45.80 5.07 30.26 51.81 3.56 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1onr_c01 TRANSALDOLASE B user 9 3 # 9 B 17 ASP B 109 ASP^? -4.16 O4 PEG B 126s B 96 GLU B 75 GLU^? 16.27 C2 EDO B 124 B 132 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 31.16 57.31 -0.94 30.73 56.64 1.01 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 26.69 48.45 7.18 27.85 50.13 7.74 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 29.82 45.80 5.07 30.26 51.81 3.56 0.03 48.55 -7.94 -5.29 45.92 -6.26 1onr_c01 source 1onr TRANSALDOLASE B : 9 hits 1onr_c01 naa= 3 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 1 3 # 1 A 225 HIS A 88 HIS^? 13.90 OXT ACT A 123 A 259 TYR A 102 TYR^? 8.02 OXT ACT A 123 A 552 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 11.34 95.90 25.54 12.13 96.42 23.67 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 14.91 97.39 18.63 13.39 95.60 20.20 2.53 56.58 17.48 2.05 53.90 18.03 coo 46.37 82.54 38.83 45.97 84.66 38.77 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1pj5_c00 N,N-DIMETHYLGLYCINE OXIDASE user 2 3 # 2 A 225 HIS B 88 HIS^? 7.16 O1 EDO B 123 A 259 TYR B 102 TYR^? 11.19 O2 EDO B 124 A 552 ASP A 32 ASP.? 9.00 C2 EDO A 125 coo 11.34 95.90 25.54 12.13 96.42 23.67 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 14.91 97.39 18.63 13.39 95.60 20.20 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 46.37 82.54 38.83 45.97 84.66 38.77 20.30 44.49 25.52 20.49 42.41 25.06 1pj5_c00 source 1pj5 N,N-DIMETHYLGLYCINE OXIDASE : 2 hits 1pj5_c00 naa= 3 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 1 3 # 1 B 248 ASP A 94 ASP.? 16.52 O ACT A 123 B 270 LYS A 114 LYS^? 4.03 O ACT A 123 B 382 MET A 98 MET?? 4.19 OXT ACT A 123 coo -11.82 154.51 43.38 -12.86 152.74 43.79 2.85 44.85 7.76 1.66 43.09 7.95 coo -5.09 158.39 43.41 -0.74 158.80 47.15 11.95 48.07 7.92 11.03 52.28 12.68 coo -2.79 145.52 50.38 -5.75 148.14 51.66 3.11 56.58 12.96 6.31 54.69 15.18 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 2 3 # 2 B 248 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 270 LYS B 114 LYS^? -2.62 O2 EDO B 124s B 382 MET B 98 MET?? 6.49 O2 EDO B 124 coo -11.82 154.51 43.38 -12.86 152.74 43.79 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -5.09 158.39 43.41 -0.74 158.80 47.15 1.96 50.52 -5.38 3.03 56.08 -8.37 coo -2.79 145.52 50.38 -5.75 148.14 51.66 11.03 60.17 -7.16 7.83 59.26 -9.86 1pjq_c03 source 1pjq SIROHEME SYNTHASE : 2 hits 1pjq_c03 naa= 3 ULMN 3 1pow_c02 PYRUVATE OXIDASE (E.C.1.2.3.3) (WILDuser 1 3 # 1 A 264 ARG A 36 ARG^? -3.17 O2 EDO A 125s A 479 PHE A 35 PHE^? 5.85 O ACT A 123 A 483 GLU A 54 GLU^? 10.26 O1 EDO A 125 coo 17.33 52.29 2.24 18.71 54.03 0.18 24.38 48.23 13.15 25.39 47.42 15.97 coo 20.06 57.44 1.28 18.39 56.19 3.12 17.95 50.83 16.89 15.69 51.12 18.49 coo 17.33 54.96 -3.04 16.34 56.76 -2.51 19.19 45.91 11.58 20.09 44.01 11.30 1pow_c02 source 1pow PYRUVATE OXIDASE (E.C.1.2.3.3) (WILD TYPE) : 1 hits 1pow_c02 naa= 3 ULMN 3 1pow_c03 PYRUVATE OXIDASE (E.C.1.2.3.3) (WILDuser 1 3 # 1 B 264 ARG A 36 ARG^? -3.17 O2 EDO A 125s B 479 PHE A 35 PHE^? 5.85 O ACT A 123 B 483 GLU A 54 GLU^? 10.26 O1 EDO A 125 coo -26.72 93.28 20.13 -28.02 93.55 17.39 24.38 48.23 13.15 25.39 47.42 15.97 coo -29.34 90.48 15.69 -27.62 89.95 17.80 17.95 50.83 16.89 15.69 51.12 18.49 coo -26.63 95.49 14.65 -25.77 93.77 13.77 19.19 45.91 11.58 20.09 44.01 11.30 1pow_c03 source 1pow PYRUVATE OXIDASE (E.C.1.2.3.3) (WILD TYPE) : 1 hits 1pow_c03 naa= 3 ULMN 3 1qe3_c00 PARA-NITROBENZYL ESTERASE user 1 3 # 1 A 189 SER A 55 SER^? 7.70 O ACT A 123 A 310 GLU A 75 GLU^? 16.23 O2 EDO A 124 A 399 HIS A 111 HIS^? 11.74 C2 EDO A 125 coo 2.67 37.96 55.23 1.78 40.01 56.16 16.48 46.12 15.51 15.38 46.59 17.63 coo 6.61 38.44 63.61 6.69 38.31 61.50 14.12 39.75 7.18 16.10 39.69 6.63 coo 4.95 41.82 59.53 3.85 40.70 58.14 16.68 40.80 13.52 18.19 42.09 12.84 ULMN 3 1qe3_c00 PARA-NITROBENZYL ESTERASE user 2 3 # 2 A 189 SER A 57 SER^? 6.85 O2 EDO A 126 A 310 GLU A 54 GLU^? 10.26 O1 EDO A 125 A 399 HIS A 111 HIS^? 11.74 C2 EDO A 125 coo 2.67 37.96 55.23 1.78 40.01 56.16 15.14 41.83 20.35 16.25 40.17 21.70 coo 6.61 38.44 63.61 6.69 38.31 61.50 19.19 45.91 11.58 20.09 44.01 11.30 coo 4.95 41.82 59.53 3.85 40.70 58.14 16.68 40.80 13.52 18.19 42.09 12.84 ULMN 3 1qe3_c00 PARA-NITROBENZYL ESTERASE user 3 3 # 3 A 189 SER B 55 SER^? 9.36 O2 PEG B 126 A 310 GLU B 75 GLU^? 16.27 C2 EDO B 124 A 399 HIS B 111 HIS^? 12.89 C3 PEG B 126 coo 2.67 37.96 55.23 1.78 40.01 56.16 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo 6.61 38.44 63.61 6.69 38.31 61.50 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 4.95 41.82 59.53 3.85 40.70 58.14 -2.41 45.44 -12.93 -3.29 45.75 -11.05 ULMN 3 1qe3_c00 PARA-NITROBENZYL ESTERASE user 4 3 # 4 A 189 SER B 57 SER^? 6.28 O4 PEG B 126 A 310 GLU B 54 GLU^? 12.15 C2 EDO B 124 A 399 HIS B 111 HIS^? 12.89 C3 PEG B 126 coo 2.67 37.96 55.23 1.78 40.01 56.16 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo 6.61 38.44 63.61 6.69 38.31 61.50 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 4.95 41.82 59.53 3.85 40.70 58.14 -2.41 45.44 -12.93 -3.29 45.75 -11.05 1qe3_c00 source 1qe3 PARA-NITROBENZYL ESTERASE : 4 hits 1qe3_c00 naa= 3 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 110 ARG A 27 ARG.? 5.17 CH3 ACT A 123 C 163 TYR A 102 TYR^? 8.02 OXT ACT A 123 C 236 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 39.01 29.77 22.02 37.48 31.30 19.84 10.94 57.70 24.22 11.90 58.81 21.49 coo 39.51 34.34 13.63 37.63 32.61 14.79 2.53 56.58 17.48 2.05 53.90 18.03 coo 45.78 31.11 9.51 44.25 30.06 10.53 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 110 ARG B 27 ARG^? 11.58 C1 EDO B 125 C 163 TYR B 102 TYR^? 11.19 O2 EDO B 124 C 236 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 39.01 29.77 22.02 37.48 31.30 19.84 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 39.51 34.34 13.63 37.63 32.61 14.79 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 45.78 31.11 9.51 44.25 30.06 10.53 16.23 58.63 -15.55 16.12 57.73 -13.62 1qgn_c16 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c16 naa= 3 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 110 ARG A 27 ARG.? 5.17 CH3 ACT A 123 D 163 TYR A 102 TYR^? 8.02 OXT ACT A 123 D 236 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 10.94 57.70 24.22 11.90 58.81 21.49 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 2.53 56.58 17.48 2.05 53.90 18.03 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 110 ARG B 27 ARG^? 11.58 C1 EDO B 125 D 163 TYR B 102 TYR^? 11.19 O2 EDO B 124 D 236 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 16.23 58.63 -15.55 16.12 57.73 -13.62 1qgn_c17 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c17 naa= 3 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 102 TYR^? 8.02 OXT ACT A 123 A 236 ASP A 82 ASP.? 12.57 OXT ACT A 123 C 110 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 55.48 26.51 40.65 55.39 23.99 39.43 2.53 56.58 17.48 2.05 53.90 18.03 coo 48.87 29.19 44.63 49.10 27.34 43.63 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 52.39 23.42 32.10 54.51 23.27 34.29 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR B 102 TYR^? 11.19 O2 EDO B 124 A 236 ASP B 82 ASP^? 7.08 O1 EDO B 123 C 110 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 55.48 26.51 40.65 55.39 23.99 39.43 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 48.87 29.19 44.63 49.10 27.34 43.63 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 52.39 23.42 32.10 54.51 23.27 34.29 3.96 65.71 -18.47 3.56 68.28 -16.63 1qgn_c18 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c18 naa= 3 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 102 TYR^? 8.02 OXT ACT A 123 B 236 ASP A 82 ASP.? 12.57 OXT ACT A 123 D 110 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 2.53 56.58 17.48 2.05 53.90 18.03 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR B 102 TYR^? 11.19 O2 EDO B 124 B 236 ASP B 82 ASP^? 7.08 O1 EDO B 123 D 110 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 3.96 65.71 -18.47 3.56 68.28 -16.63 1qgn_c19 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c19 naa= 3 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 110 ARG A 27 ARG.? 5.17 CH3 ACT A 123 G 163 TYR A 102 TYR^? 8.02 OXT ACT A 123 G 236 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 10.94 57.70 24.22 11.90 58.81 21.49 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 2.53 56.58 17.48 2.05 53.90 18.03 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 110 ARG B 27 ARG^? 11.58 C1 EDO B 125 G 163 TYR B 102 TYR^? 11.19 O2 EDO B 124 G 236 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 16.23 58.63 -15.55 16.12 57.73 -13.62 1qgn_c20 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c20 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG A 27 ARG.? 5.17 CH3 ACT A 123 H 163 TYR A 102 TYR^? 8.02 OXT ACT A 123 H 236 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 10.94 57.70 24.22 11.90 58.81 21.49 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 2.53 56.58 17.48 2.05 53.90 18.03 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 110 ARG B 27 ARG^? 11.58 C1 EDO B 125 H 163 TYR B 102 TYR^? 11.19 O2 EDO B 124 H 236 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 16.23 58.63 -15.55 16.12 57.73 -13.62 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c21 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 102 TYR^? 8.02 OXT ACT A 123 E 236 ASP A 82 ASP.? 12.57 OXT ACT A 123 G 110 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 2.53 56.58 17.48 2.05 53.90 18.03 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR B 102 TYR^? 11.19 O2 EDO B 124 E 236 ASP B 82 ASP^? 7.08 O1 EDO B 123 G 110 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 3.96 65.71 -18.47 3.56 68.28 -16.63 1qgn_c22 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c22 naa= 3 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 102 TYR^? 8.02 OXT ACT A 123 F 236 ASP A 82 ASP.? 12.57 OXT ACT A 123 H 110 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 2.53 56.58 17.48 2.05 53.90 18.03 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR B 102 TYR^? 11.19 O2 EDO B 124 F 236 ASP B 82 ASP^? 7.08 O1 EDO B 123 H 110 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 3.96 65.71 -18.47 3.56 68.28 -16.63 1qgn_c23 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c23 naa= 3 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 # 1 A 49 ASP B 32 ASP^? 11.80 C3 PEG B 126 A 147 THR B 56 THR^? 10.83 C3 PEG B 126 A 294 ASP B 109 ASP^? -4.16 O4 PEG B 126s coo 1.13 15.67 -24.51 2.35 14.34 -25.71 -5.79 54.47 -23.19 -5.94 55.44 -25.07 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 -3.37 49.51 -16.24 -5.44 50.02 -16.76 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 4.45 45.35 -19.96 6.21 46.00 -20.89 1qgx_c02 source 1qgx 3',5'-ADENOSINE BISPHOSPHATASE : 1 hits 1qgx_c02 naa= 3 ULMN 3 1qho_c05 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 261 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 329 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 28.46 69.88 26.74 30.40 70.70 26.53 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 34.02 79.89 42.60 34.73 78.01 41.86 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 37.87 70.12 31.80 36.61 69.74 30.15 16.23 58.63 -15.55 16.12 57.73 -13.62 ULMN 3 1qho_c05 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 261 ASP A 94 ASP.? 16.52 O ACT A 123 A 329 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 28.46 69.88 26.74 30.40 70.70 26.53 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 34.02 79.89 42.60 34.73 78.01 41.86 2.85 44.85 7.76 1.66 43.09 7.95 coo 37.87 70.12 31.80 36.61 69.74 30.15 11.18 47.39 -6.30 12.32 45.78 -7.12 ULMN 3 1qho_c05 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 261 ASP A 94 ASP.? 16.52 O ACT A 123 A 329 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 28.46 69.88 26.74 30.40 70.70 26.53 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 34.02 79.89 42.60 34.73 78.01 41.86 2.85 44.85 7.76 1.66 43.09 7.95 coo 37.87 70.12 31.80 36.61 69.74 30.15 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1qho_c05 ALPHA-AMYLASE user 4 3 # 4 A 228 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 261 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 329 ASP A 94 ASP.? 16.52 O ACT A 123 coo 28.46 69.88 26.74 30.40 70.70 26.53 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 34.02 79.89 42.60 34.73 78.01 41.86 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 37.87 70.12 31.80 36.61 69.74 30.15 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1qho_c05 ALPHA-AMYLASE user 5 3 # 5 A 228 ASP B 84 ASP^? 4.63 O1 EDO B 123 A 261 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 329 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 28.46 69.88 26.74 30.40 70.70 26.53 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 34.02 79.89 42.60 34.73 78.01 41.86 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 37.87 70.12 31.80 36.61 69.74 30.15 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1qho_c05 ALPHA-AMYLASE user 6 3 # 6 A 228 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 261 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 329 ASP A 13 ASP.? -3.81 O2 EDO A 124s coo 28.46 69.88 26.74 30.40 70.70 26.53 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 34.02 79.89 42.60 34.73 78.01 41.86 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 37.87 70.12 31.80 36.61 69.74 30.15 20.17 49.39 -1.56 21.38 47.59 -1.63 1qho_c05 source 1qho ALPHA-AMYLASE : 6 hits 1qho_c05 naa= 3 ULMN 3 1qho_c07 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 260 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 329 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 28.46 69.88 26.74 30.40 70.70 26.53 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 30.73 81.29 37.61 31.23 82.07 35.69 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 37.87 70.12 31.80 36.61 69.74 30.15 11.18 47.39 -6.30 12.32 45.78 -7.12 ULMN 3 1qho_c07 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 260 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 329 ASP A 94 ASP.? 16.52 O ACT A 123 coo 28.46 69.88 26.74 30.40 70.70 26.53 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 30.73 81.29 37.61 31.23 82.07 35.69 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 37.87 70.12 31.80 36.61 69.74 30.15 2.85 44.85 7.76 1.66 43.09 7.95 1qho_c07 source 1qho ALPHA-AMYLASE : 2 hits 1qho_c07 naa= 3 ULMN 3 1qrz_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 111 HIS^? 11.74 C2 EDO A 125 A 646 ASP A 109 ASP^? -4.58 O2 EDO A 126s A 741 SER A 55 SER^? 7.70 O ACT A 123 coo -20.72 2.99 34.37 -21.94 1.82 35.61 16.68 40.80 13.52 18.19 42.09 12.84 coo -18.83 7.68 26.86 -20.89 7.78 26.56 9.63 38.15 19.81 7.90 38.49 20.93 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 16.48 46.12 15.51 15.38 46.59 17.63 ULMN 3 1qrz_c12 PLASMINOGEN user 2 3 # 2 A 603 HIS B 111 HIS^? 12.89 C3 PEG B 126 A 646 ASP B 109 ASP^? -4.16 O4 PEG B 126s A 741 SER B 55 SER^? 9.36 O2 PEG B 126 coo -20.72 2.99 34.37 -21.94 1.82 35.61 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo -18.83 7.68 26.86 -20.89 7.78 26.56 4.45 45.35 -19.96 6.21 46.00 -20.89 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 -2.31 51.65 -13.29 -1.27 52.80 -15.19 1qrz_c12 source 1qrz PLASMINOGEN : 2 hits 1qrz_c12 naa= 3 ULMN 3 1qrz_c13 PLASMINOGEN user 1 3 # 1 B 603 HIS A 111 HIS^? 11.74 C2 EDO A 125 B 646 ASP A 109 ASP^? -4.58 O2 EDO A 126s B 741 SER A 55 SER^? 7.70 O ACT A 123 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 16.68 40.80 13.52 18.19 42.09 12.84 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 9.63 38.15 19.81 7.90 38.49 20.93 coo -43.75 -1.60 -6.12 -44.85 0.33 -5.15 16.48 46.12 15.51 15.38 46.59 17.63 ULMN 3 1qrz_c13 PLASMINOGEN user 2 3 # 2 B 603 HIS B 111 HIS^? 12.89 C3 PEG B 126 B 646 ASP B 109 ASP^? -4.16 O4 PEG B 126s B 741 SER B 55 SER^? 9.36 O2 PEG B 126 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 4.45 45.35 -19.96 6.21 46.00 -20.89 coo -43.75 -1.60 -6.12 -44.85 0.33 -5.15 -2.31 51.65 -13.29 -1.27 52.80 -15.19 1qrz_c13 source 1qrz PLASMINOGEN : 2 hits 1qrz_c13 naa= 3 ULMN 3 1qrz_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 111 HIS^? 11.74 C2 EDO A 125 C 646 ASP A 109 ASP^? -4.58 O2 EDO A 126s C 741 SER A 55 SER^? 7.70 O ACT A 123 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 16.68 40.80 13.52 18.19 42.09 12.84 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 9.63 38.15 19.81 7.90 38.49 20.93 coo 4.71 -4.57 4.71 3.58 -6.49 5.69 16.48 46.12 15.51 15.38 46.59 17.63 ULMN 3 1qrz_c14 PLASMINOGEN user 2 3 # 2 C 603 HIS B 111 HIS^? 12.89 C3 PEG B 126 C 646 ASP B 109 ASP^? -4.16 O4 PEG B 126s C 741 SER B 55 SER^? 9.36 O2 PEG B 126 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 4.71 -4.57 4.71 3.58 -6.49 5.69 -2.31 51.65 -13.29 -1.27 52.80 -15.19 1qrz_c14 source 1qrz PLASMINOGEN : 2 hits 1qrz_c14 naa= 3 ULMN 3 1qrz_c15 PLASMINOGEN user 1 3 # 1 D 603 HIS A 111 HIS^? 11.74 C2 EDO A 125 D 646 ASP A 109 ASP^? -4.58 O2 EDO A 126s D 741 SER A 55 SER^? 7.70 O ACT A 123 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 16.68 40.80 13.52 18.19 42.09 12.84 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 9.63 38.15 19.81 7.90 38.49 20.93 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 16.48 46.12 15.51 15.38 46.59 17.63 ULMN 3 1qrz_c15 PLASMINOGEN user 2 3 # 2 D 603 HIS B 111 HIS^? 12.89 C3 PEG B 126 D 646 ASP B 109 ASP^? -4.16 O4 PEG B 126s D 741 SER B 55 SER^? 9.36 O2 PEG B 126 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 4.45 45.35 -19.96 6.21 46.00 -20.89 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 -2.31 51.65 -13.29 -1.27 52.80 -15.19 1qrz_c15 source 1qrz PLASMINOGEN : 2 hits 1qrz_c15 naa= 3 ULMN 3 1qrz_c20 PLASMINOGEN user 1 3 # 1 A 603 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 646 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 739 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo -20.72 2.99 34.37 -21.94 1.82 35.61 6.89 48.41 3.38 5.73 47.19 2.13 coo -18.83 7.68 26.86 -20.89 7.78 26.56 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1qrz_c20 PLASMINOGEN user 2 3 # 2 A 603 HIS A 111 HIS^? 11.74 C2 EDO A 125 A 646 ASP A 109 ASP^? -4.58 O2 EDO A 126s A 739 GLY A 93 GLY.? 17.43 O ACT A 123 coo -20.72 2.99 34.37 -21.94 1.82 35.61 16.68 40.80 13.52 18.19 42.09 12.84 coo -18.83 7.68 26.86 -20.89 7.78 26.56 9.63 38.15 19.81 7.90 38.49 20.93 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 5.07 43.20 3.81 5.07 43.46 4.54 ULMN 3 1qrz_c20 PLASMINOGEN user 3 3 # 3 A 603 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 646 ASP A 94 ASP.? 16.52 O ACT A 123 A 739 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo -20.72 2.99 34.37 -21.94 1.82 35.61 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -18.83 7.68 26.86 -20.89 7.78 26.56 2.85 44.85 7.76 1.66 43.09 7.95 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 16.39 54.43 4.53 15.61 54.28 4.81 ULMN 3 1qrz_c20 PLASMINOGEN user 4 3 # 4 A 603 HIS B 111 HIS^? 12.89 C3 PEG B 126 A 646 ASP B 109 ASP^? -4.16 O4 PEG B 126s A 739 GLY B 93 GLY^? 13.55 O1 EDO A 124 coo -20.72 2.99 34.37 -21.94 1.82 35.61 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo -18.83 7.68 26.86 -20.89 7.78 26.56 4.45 45.35 -19.96 6.21 46.00 -20.89 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 8.78 44.49 -3.21 8.81 45.00 -3.81 1qrz_c20 source 1qrz PLASMINOGEN : 4 hits 1qrz_c20 naa= 3 ULMN 3 1qrz_c21 PLASMINOGEN user 1 3 # 1 B 603 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 646 ASP A 94 ASP.? 16.52 O ACT A 123 B 739 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 6.89 48.41 3.38 5.73 47.19 2.13 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 2.85 44.85 7.76 1.66 43.09 7.95 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1qrz_c21 PLASMINOGEN user 2 3 # 2 B 603 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 646 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 739 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 6.89 48.41 3.38 5.73 47.19 2.13 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1qrz_c21 PLASMINOGEN user 3 3 # 3 B 603 HIS A 111 HIS^? 11.74 C2 EDO A 125 B 646 ASP A 109 ASP^? -4.58 O2 EDO A 126s B 739 GLY A 93 GLY.? 17.43 O ACT A 123 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 16.68 40.80 13.52 18.19 42.09 12.84 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 9.63 38.15 19.81 7.90 38.49 20.93 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 5.07 43.20 3.81 5.07 43.46 4.54 ULMN 3 1qrz_c21 PLASMINOGEN user 4 3 # 4 B 603 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 646 ASP A 94 ASP.? 16.52 O ACT A 123 B 739 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 2.85 44.85 7.76 1.66 43.09 7.95 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 16.39 54.43 4.53 15.61 54.28 4.81 ULMN 3 1qrz_c21 PLASMINOGEN user 5 3 # 5 B 603 HIS B 111 HIS^? 12.89 C3 PEG B 126 B 646 ASP B 109 ASP^? -4.16 O4 PEG B 126s B 739 GLY B 93 GLY^? 13.55 O1 EDO A 124 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 4.45 45.35 -19.96 6.21 46.00 -20.89 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 8.78 44.49 -3.21 8.81 45.00 -3.81 1qrz_c21 source 1qrz PLASMINOGEN : 5 hits 1qrz_c21 naa= 3 ULMN 3 1qrz_c22 PLASMINOGEN user 1 3 # 1 C 603 HIS A 72 HIS^? 15.66 C2 EDO B 124 C 646 ASP B 94 ASP^? 10.22 O1 EDO A 124 C 739 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 6.89 48.41 3.38 5.73 47.19 2.13 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 7.82 1.25 3.03 7.30 1.31 3.65 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1qrz_c22 PLASMINOGEN user 2 3 # 2 C 603 HIS A 111 HIS^? 11.74 C2 EDO A 125 C 646 ASP A 109 ASP^? -4.58 O2 EDO A 126s C 739 GLY A 93 GLY.? 17.43 O ACT A 123 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 16.68 40.80 13.52 18.19 42.09 12.84 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 9.63 38.15 19.81 7.90 38.49 20.93 coo 7.82 1.25 3.03 7.30 1.31 3.65 5.07 43.20 3.81 5.07 43.46 4.54 ULMN 3 1qrz_c22 PLASMINOGEN user 3 3 # 3 C 603 HIS B 72 HIS^? 13.54 O1 EDO A 124 C 646 ASP A 94 ASP.? 16.52 O ACT A 123 C 739 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 2.85 44.85 7.76 1.66 43.09 7.95 coo 7.82 1.25 3.03 7.30 1.31 3.65 16.39 54.43 4.53 15.61 54.28 4.81 ULMN 3 1qrz_c22 PLASMINOGEN user 4 3 # 4 C 603 HIS B 111 HIS^? 12.89 C3 PEG B 126 C 646 ASP B 109 ASP^? -4.16 O4 PEG B 126s C 739 GLY B 93 GLY^? 13.55 O1 EDO A 124 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 7.82 1.25 3.03 7.30 1.31 3.65 8.78 44.49 -3.21 8.81 45.00 -3.81 1qrz_c22 source 1qrz PLASMINOGEN : 4 hits 1qrz_c22 naa= 3 ULMN 3 1qrz_c23 PLASMINOGEN user 1 3 # 1 D 603 HIS A 72 HIS^? 15.66 C2 EDO B 124 D 646 ASP A 94 ASP.? 16.52 O ACT A 123 D 739 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 6.89 48.41 3.38 5.73 47.19 2.13 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 2.85 44.85 7.76 1.66 43.09 7.95 coo -45.82 1.31 41.67 -46.38 1.39 42.31 16.39 54.43 4.53 15.61 54.28 4.81 ULMN 3 1qrz_c23 PLASMINOGEN user 2 3 # 2 D 603 HIS A 72 HIS^? 15.66 C2 EDO B 124 D 646 ASP B 94 ASP^? 10.22 O1 EDO A 124 D 739 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 6.89 48.41 3.38 5.73 47.19 2.13 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -45.82 1.31 41.67 -46.38 1.39 42.31 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1qrz_c23 PLASMINOGEN user 3 3 # 3 D 603 HIS B 72 HIS^? 13.54 O1 EDO A 124 D 646 ASP A 94 ASP.? 16.52 O ACT A 123 D 739 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 2.85 44.85 7.76 1.66 43.09 7.95 coo -45.82 1.31 41.67 -46.38 1.39 42.31 16.39 54.43 4.53 15.61 54.28 4.81 ULMN 3 1qrz_c23 PLASMINOGEN user 4 3 # 4 D 603 HIS B 72 HIS^? 13.54 O1 EDO A 124 D 646 ASP B 94 ASP^? 10.22 O1 EDO A 124 D 739 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -45.82 1.31 41.67 -46.38 1.39 42.31 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1qrz_c23 PLASMINOGEN user 5 3 # 5 D 603 HIS B 111 HIS^? 12.89 C3 PEG B 126 D 646 ASP B 109 ASP^? -4.16 O4 PEG B 126s D 739 GLY B 93 GLY^? 13.55 O1 EDO A 124 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 4.45 45.35 -19.96 6.21 46.00 -20.89 coo -45.82 1.31 41.67 -46.38 1.39 42.31 8.78 44.49 -3.21 8.81 45.00 -3.81 1qrz_c23 source 1qrz PLASMINOGEN : 5 hits 1qrz_c23 naa= 3 ULMN 3 1qz9_c02 KYNURENINASE user 1 3 # 1 A 129 PHE A 96 PHE^? 9.38 OXT ACT A 123 A 201 ASP A 94 ASP.? 16.52 O ACT A 123 A 227 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 23.39 49.81 32.16 21.33 51.68 32.26 3.05 50.53 10.55 5.47 49.81 11.76 coo 25.52 45.12 37.98 23.98 46.65 37.85 2.85 44.85 7.76 1.66 43.09 7.95 coo 12.68 46.83 36.69 18.26 48.67 34.51 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1qz9_c02 KYNURENINASE user 2 3 # 2 A 129 PHE B 96 PHE^? 9.36 O2 EDO B 124 A 201 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 227 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 23.39 49.81 32.16 21.33 51.68 32.26 10.95 53.66 -6.99 8.59 53.45 -8.41 coo 25.52 45.12 37.98 23.98 46.65 37.85 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 12.68 46.83 36.69 18.26 48.67 34.51 0.03 48.55 -7.94 -5.29 45.92 -6.26 1qz9_c02 source 1qz9 KYNURENINASE : 2 hits 1qz9_c02 naa= 3 ULMN 3 1rgq_c01 NS4A PEPTIDE user 1 3 # 1 B 60 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 84 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 140 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 1rgq_c01 NS4A PEPTIDE user 2 3 # 2 B 60 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 84 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 140 GLY A 46 GLY.? 10.19 C1 EDO A 128 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 16.81 68.43 6.03 16.13 68.48 5.69 ULMN 3 1rgq_c01 NS4A PEPTIDE user 3 3 # 3 B 60 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 84 ASP A 94 ASP.? 16.52 O ACT A 123 B 140 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 6.89 48.41 3.38 5.73 47.19 2.13 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 2.85 44.85 7.76 1.66 43.09 7.95 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 16.39 54.43 4.53 15.61 54.28 4.81 ULMN 3 1rgq_c01 NS4A PEPTIDE user 4 3 # 4 B 60 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 84 ASP A 94 ASP.? 16.52 O ACT A 123 B 140 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 6.89 48.41 3.38 5.73 47.19 2.13 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 2.85 44.85 7.76 1.66 43.09 7.95 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 -2.37 55.43 0.00 -1.58 55.37 -0.28 ULMN 3 1rgq_c01 NS4A PEPTIDE user 5 3 # 5 B 60 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 84 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 140 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 0.61 67.88 8.18 -0.15 67.82 7.90 ULMN 3 1rgq_c01 NS4A PEPTIDE user 6 3 # 6 B 60 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 84 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 140 GLY B 46 GLY^? 9.85 O1 EDO B 125 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 -2.16 69.12 3.48 -1.54 68.93 3.96 ULMN 3 1rgq_c01 NS4A PEPTIDE user 7 3 # 7 B 60 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 84 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 140 GLY A 51 GLY^? 8.00 C2 EDO A 128 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 16.39 54.43 4.53 15.61 54.28 4.81 ULMN 3 1rgq_c01 NS4A PEPTIDE user 8 3 # 8 B 60 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 84 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 140 GLY B 51 GLY^? 7.59 O1 EDO B 124 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 -2.37 55.43 0.00 -1.58 55.37 -0.28 1rgq_c01 source 1rgq NS4A PEPTIDE : 8 hits 1rgq_c01 naa= 3 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 # 1 32 ASP A 82 ASP.? 12.57 OXT ACT A 123 35 SER B 7 SER^? 13.90 OXT ACT A 123 215 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 11.85 17.24 72.81 11.09 15.37 72.36 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 12.20 12.71 75.45 13.69 13.84 74.03 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 5.22 15.03 71.43 7.19 14.88 70.83 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 3 # 2 32 ASP B 82 ASP^? 7.08 O1 EDO B 123 35 SER A 7 SER.? 11.72 O1 EDO B 123 215 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 11.85 17.24 72.81 11.09 15.37 72.36 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 12.20 12.71 75.45 13.69 13.84 74.03 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 5.22 15.03 71.43 7.19 14.88 70.83 20.02 60.63 -18.97 20.31 59.23 -17.40 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 A 100 GLU^? 12.02 O1 EDO A 127 A 288 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 329 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 29.27 18.78 14.99 27.16 18.62 14.76 3.40 65.53 14.62 2.89 66.21 16.58 coo 49.52 10.06 10.36 50.99 9.65 8.92 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 57.80 12.92 13.83 53.77 8.42 12.15 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 2 3 # 2 A 137 GLU B 100 GLU^? 11.75 C1 EDO B 125 A 288 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 329 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 29.27 18.78 14.99 27.16 18.62 14.76 10.53 69.09 -5.55 11.13 70.44 -7.09 coo 49.52 10.06 10.36 50.99 9.65 8.92 6.89 48.41 3.38 5.73 47.19 2.13 coo 57.80 12.92 13.83 53.77 8.42 12.15 13.93 45.27 9.54 19.06 43.44 6.58 1roz_c00 source 1roz DEOXYHYPUSINE SYNTHASE : 2 hits 1roz_c00 naa= 3 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 B 137 GLU A 100 GLU^? 12.02 O1 EDO A 127 B 288 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 329 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 3.40 65.53 14.62 2.89 66.21 16.58 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 2 3 # 2 B 137 GLU B 100 GLU^? 11.75 C1 EDO B 125 B 288 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 329 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 10.53 69.09 -5.55 11.13 70.44 -7.09 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 6.89 48.41 3.38 5.73 47.19 2.13 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 13.93 45.27 9.54 19.06 43.44 6.58 1roz_c01 source 1roz DEOXYHYPUSINE SYNTHASE : 2 hits 1roz_c01 naa= 3 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 # 1 B 57 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 102 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 193 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo -4.60 27.52 42.88 -4.63 27.41 40.76 18.39 63.32 -4.14 17.16 64.86 -3.40 coo -0.27 31.24 43.51 -1.49 29.62 42.98 20.60 64.37 -9.63 20.20 65.77 -11.14 coo -6.81 22.81 34.74 -6.42 23.54 34.62 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 2 3 # 2 B 57 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 102 ASP A 94 ASP.? 16.52 O ACT A 123 B 193 GLY B 93 GLY^? 13.55 O1 EDO A 124 coo -4.60 27.52 42.88 -4.63 27.41 40.76 6.89 48.41 3.38 5.73 47.19 2.13 coo -0.27 31.24 43.51 -1.49 29.62 42.98 2.85 44.85 7.76 1.66 43.09 7.95 coo -6.81 22.81 34.74 -6.42 23.54 34.62 8.78 44.49 -3.21 8.81 45.00 -3.81 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 3 3 # 3 B 57 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 102 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 193 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo -4.60 27.52 42.88 -4.63 27.41 40.76 -4.28 60.61 11.46 -3.09 62.30 11.15 coo -0.27 31.24 43.51 -1.49 29.62 42.98 -6.45 59.57 16.94 -6.05 60.31 18.88 coo -6.81 22.81 34.74 -6.42 23.54 34.62 0.61 67.88 8.18 -0.15 67.82 7.90 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 4 3 # 4 B 57 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 102 ASP B 94 ASP^? 10.22 O1 EDO A 124 B 193 GLY A 93 GLY.? 17.43 O ACT A 123 coo -4.60 27.52 42.88 -4.63 27.41 40.76 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -0.27 31.24 43.51 -1.49 29.62 42.98 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -6.81 22.81 34.74 -6.42 23.54 34.62 5.07 43.20 3.81 5.07 43.46 4.54 1rtf_c06 source 1rtf TWO CHAIN TISSUE PLASMINOGEN ACTIVATOR : 4 hits 1rtf_c06 naa= 3 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 1 3 # 1 A 104 ILE A 12 ILE.? 6.76 O1 EDO A 124 A 106 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 142 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo -15.54 60.72 29.56 -16.71 61.53 30.10 14.80 51.86 -0.83 14.95 52.94 0.12 coo -17.00 64.03 23.46 -18.21 65.65 22.90 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -17.05 67.91 26.85 -18.66 66.47 26.76 11.18 47.39 -6.30 12.32 45.78 -7.12 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 2 3 # 2 A 104 ILE A 74 ILE^? 13.23 O1 EDO A 124 A 106 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 142 ASP A 94 ASP.? 16.52 O ACT A 123 coo -15.54 60.72 29.56 -16.71 61.53 30.10 11.84 44.77 4.28 12.65 45.97 3.96 coo -17.00 64.03 23.46 -18.21 65.65 22.90 6.89 48.41 3.38 5.73 47.19 2.13 coo -17.05 67.91 26.85 -18.66 66.47 26.76 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 3 3 # 3 A 104 ILE B 12 ILE^? 12.88 O1 EDO B 124 A 106 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 142 ASP A 94 ASP.? 16.52 O ACT A 123 coo -15.54 60.72 29.56 -16.71 61.53 30.10 -0.89 51.11 4.22 -1.16 52.44 3.78 coo -17.00 64.03 23.46 -18.21 65.65 22.90 6.89 48.41 3.38 5.73 47.19 2.13 coo -17.05 67.91 26.85 -18.66 66.47 26.76 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 4 3 # 4 A 104 ILE B 74 ILE^? 12.52 C2 EDO B 124 A 106 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 142 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo -15.54 60.72 29.56 -16.71 61.53 30.10 2.10 46.21 -3.15 1.28 47.20 -2.43 coo -17.00 64.03 23.46 -18.21 65.65 22.90 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -17.05 67.91 26.85 -18.66 66.47 26.76 11.18 47.39 -6.30 12.32 45.78 -7.12 1s3i_c00 source 1s3i 10-FORMYLTETRAHYDROFOLATE DEHYDROGENASE : 4 hits 1s3i_c00 naa= 3 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 1 3 # 1 A 57 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 102 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 193 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo 15.02 29.17 19.44 15.63 29.96 17.60 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 19.67 30.58 22.61 18.30 29.87 21.17 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 14.52 29.10 10.01 15.08 29.66 10.19 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 2 3 # 2 A 57 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 102 ASP A 94 ASP.? 16.52 O ACT A 123 A 193 GLY B 93 GLY^? 13.55 O1 EDO A 124 coo 15.02 29.17 19.44 15.63 29.96 17.60 6.89 48.41 3.38 5.73 47.19 2.13 coo 19.67 30.58 22.61 18.30 29.87 21.17 2.85 44.85 7.76 1.66 43.09 7.95 coo 14.52 29.10 10.01 15.08 29.66 10.19 8.78 44.49 -3.21 8.81 45.00 -3.81 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 3 3 # 3 A 57 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 102 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 193 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo 15.02 29.17 19.44 15.63 29.96 17.60 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 19.67 30.58 22.61 18.30 29.87 21.17 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 14.52 29.10 10.01 15.08 29.66 10.19 0.61 67.88 8.18 -0.15 67.82 7.90 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 4 3 # 4 A 57 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 102 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 193 GLY A 93 GLY.? 17.43 O ACT A 123 coo 15.02 29.17 19.44 15.63 29.96 17.60 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 19.67 30.58 22.61 18.30 29.87 21.17 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 14.52 29.10 10.01 15.08 29.66 10.19 5.07 43.20 3.81 5.07 43.46 4.54 1ssx_c02 source 1ssx ALPHA-LYTIC PROTEASE : 4 hits 1ssx_c02 naa= 3 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 1 3 # 1 B 8 HIS B 111 HIS^? 12.89 C3 PEG B 126 B 80 GLU B 54 GLU^? 12.15 C2 EDO B 124 B 223 ARG A 79 ARG^? -4.30 O1 EDO A 126s coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 -2.41 45.44 -12.93 -3.29 45.75 -11.05 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 2.90 41.63 20.04 5.49 40.23 20.98 1t0u_c01 source 1t0u URIDINE PHOSPHORYLASE : 1 hits 1t0u_c01 naa= 3 ULMN 3 1t7d_c00 SIGNAL PEPTIDASE I user 1 3 # 1 A 88 SER A 34 SER.? -3.56 C2 EDO A 125s A 90 SER A 55 SER^? 7.70 O ACT A 123 A 145 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo -3.31 40.95 15.56 -0.94 40.79 14.97 20.28 47.66 19.28 22.08 46.10 18.94 coo 1.47 40.03 18.48 2.45 41.37 16.68 16.48 46.12 15.51 15.38 46.59 17.63 coo 7.35 44.71 16.29 4.71 40.98 14.52 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1t7d_c00 SIGNAL PEPTIDASE I user 2 3 # 2 A 88 SER A 57 SER^? 6.85 O2 EDO A 126 A 90 SER A 55 SER^? 7.70 O ACT A 123 A 145 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo -3.31 40.95 15.56 -0.94 40.79 14.97 15.14 41.83 20.35 16.25 40.17 21.70 coo 1.47 40.03 18.48 2.45 41.37 16.68 16.48 46.12 15.51 15.38 46.59 17.63 coo 7.35 44.71 16.29 4.71 40.98 14.52 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1t7d_c00 SIGNAL PEPTIDASE I user 3 3 # 3 A 88 SER B 34 SER^? 13.24 C2 EDO B 124 A 90 SER B 55 SER^? 9.36 O2 PEG B 126 A 145 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -3.31 40.95 15.56 -0.94 40.79 14.97 -6.11 54.18 -16.40 -8.31 53.39 -15.87 coo 1.47 40.03 18.48 2.45 41.37 16.68 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo 7.35 44.71 16.29 4.71 40.98 14.52 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1t7d_c00 SIGNAL PEPTIDASE I user 4 3 # 4 A 88 SER B 57 SER^? 6.28 O4 PEG B 126 A 90 SER B 55 SER^? 9.36 O2 PEG B 126 A 145 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo -3.31 40.95 15.56 -0.94 40.79 14.97 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo 1.47 40.03 18.48 2.45 41.37 16.68 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo 7.35 44.71 16.29 4.71 40.98 14.52 0.03 48.55 -7.94 -5.29 45.92 -6.26 1t7d_c00 source 1t7d SIGNAL PEPTIDASE I : 4 hits 1t7d_c00 naa= 3 ULMN 3 1t7d_c01 SIGNAL PEPTIDASE I user 1 3 # 1 B 88 SER A 34 SER.? -3.56 C2 EDO A 125s B 90 SER A 55 SER^? 7.70 O ACT A 123 B 145 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 61.01 10.03 12.97 58.78 10.97 12.69 20.28 47.66 19.28 22.08 46.10 18.94 coo 56.85 12.22 16.37 55.62 11.34 14.45 16.48 46.12 15.51 15.38 46.59 17.63 coo 49.80 9.51 14.88 53.14 11.99 12.77 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1t7d_c01 SIGNAL PEPTIDASE I user 2 3 # 2 B 88 SER A 57 SER^? 6.85 O2 EDO A 126 B 90 SER A 55 SER^? 7.70 O ACT A 123 B 145 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 61.01 10.03 12.97 58.78 10.97 12.69 15.14 41.83 20.35 16.25 40.17 21.70 coo 56.85 12.22 16.37 55.62 11.34 14.45 16.48 46.12 15.51 15.38 46.59 17.63 coo 49.80 9.51 14.88 53.14 11.99 12.77 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 1t7d_c01 SIGNAL PEPTIDASE I user 3 3 # 3 B 88 SER B 34 SER^? 13.24 C2 EDO B 124 B 90 SER B 55 SER^? 9.36 O2 PEG B 126 B 145 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 61.01 10.03 12.97 58.78 10.97 12.69 -6.11 54.18 -16.40 -8.31 53.39 -15.87 coo 56.85 12.22 16.37 55.62 11.34 14.45 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo 49.80 9.51 14.88 53.14 11.99 12.77 0.03 48.55 -7.94 -5.29 45.92 -6.26 ULMN 3 1t7d_c01 SIGNAL PEPTIDASE I user 4 3 # 4 B 88 SER B 57 SER^? 6.28 O4 PEG B 126 B 90 SER B 55 SER^? 9.36 O2 PEG B 126 B 145 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 61.01 10.03 12.97 58.78 10.97 12.69 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo 56.85 12.22 16.37 55.62 11.34 14.45 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo 49.80 9.51 14.88 53.14 11.99 12.77 0.03 48.55 -7.94 -5.29 45.92 -6.26 1t7d_c01 source 1t7d SIGNAL PEPTIDASE I : 4 hits 1t7d_c01 naa= 3 ULMN 3 1thg_c00 LIPASE (E.C.3.1.1.3) TRIACYLGLYCEROLuser 1 3 # 1 217 SER A 55 SER^? 7.70 O ACT A 123 354 GLU A 75 GLU^? 16.23 O2 EDO A 124 463 HIS A 111 HIS^? 11.74 C2 EDO A 125 coo 48.87 13.74 2.81 48.49 11.54 3.93 16.48 46.12 15.51 15.38 46.59 17.63 coo 39.95 14.43 3.01 41.55 14.10 1.63 14.12 39.75 7.18 16.10 39.69 6.63 coo 43.90 10.50 2.81 45.63 11.48 3.27 16.68 40.80 13.52 18.19 42.09 12.84 ULMN 3 1thg_c00 LIPASE (E.C.3.1.1.3) TRIACYLGLYCEROLuser 2 3 # 2 217 SER A 57 SER^? 6.85 O2 EDO A 126 354 GLU A 54 GLU^? 10.26 O1 EDO A 125 463 HIS A 111 HIS^? 11.74 C2 EDO A 125 coo 48.87 13.74 2.81 48.49 11.54 3.93 15.14 41.83 20.35 16.25 40.17 21.70 coo 39.95 14.43 3.01 41.55 14.10 1.63 19.19 45.91 11.58 20.09 44.01 11.30 coo 43.90 10.50 2.81 45.63 11.48 3.27 16.68 40.80 13.52 18.19 42.09 12.84 ULMN 3 1thg_c00 LIPASE (E.C.3.1.1.3) TRIACYLGLYCEROLuser 3 3 # 3 217 SER B 57 SER^? 6.28 O4 PEG B 126 354 GLU B 54 GLU^? 12.15 C2 EDO B 124 463 HIS B 111 HIS^? 12.89 C3 PEG B 126 coo 48.87 13.74 2.81 48.49 11.54 3.93 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo 39.95 14.43 3.01 41.55 14.10 1.63 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 43.90 10.50 2.81 45.63 11.48 3.27 -2.41 45.44 -12.93 -3.29 45.75 -11.05 1thg_c00 source 1thg LIPASE (E.C.3.1.1.3) TRIACYLGLYCEROL HYDROLASE: 3 hits 1thg_c00 naa= 3 ULMN 3 1ti6_c06 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 A 144 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 404 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo 18.51 -77.38 -39.07 19.76 -78.71 -38.04 6.89 48.41 3.38 5.73 47.19 2.13 coo 27.58 -77.64 -39.00 25.78 -78.57 -39.64 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 14.43 -85.16 -40.78 16.47 -83.93 -39.31 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1ti6_c06 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 A 144 HIS A 88 HIS^? 13.90 OXT ACT A 123 A 174 ASP A 94 ASP.? 16.52 O ACT A 123 A 404 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo 18.51 -77.38 -39.07 19.76 -78.71 -38.04 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 27.58 -77.64 -39.00 25.78 -78.57 -39.64 2.85 44.85 7.76 1.66 43.09 7.95 coo 14.43 -85.16 -40.78 16.47 -83.93 -39.31 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 1ti6_c06 PYROGALLOL HYDROXYTRANSFERASE SMALL user 3 3 # 3 A 144 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 174 ASP A 94 ASP.? 16.52 O ACT A 123 A 404 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo 18.51 -77.38 -39.07 19.76 -78.71 -38.04 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 27.58 -77.64 -39.00 25.78 -78.57 -39.64 2.85 44.85 7.76 1.66 43.09 7.95 coo 14.43 -85.16 -40.78 16.47 -83.93 -39.31 0.65 57.23 -3.12 -1.98 58.01 -2.52 ULMN 3 1ti6_c06 PYROGALLOL HYDROXYTRANSFERASE SMALL user 4 3 # 4 A 144 HIS B 88 HIS^? 7.16 O1 EDO B 123 A 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 404 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo 18.51 -77.38 -39.07 19.76 -78.71 -38.04 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 27.58 -77.64 -39.00 25.78 -78.57 -39.64 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 14.43 -85.16 -40.78 16.47 -83.93 -39.31 11.57 61.77 -11.34 12.14 59.44 -12.79 1ti6_c06 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 4 hits 1ti6_c06 naa= 3 ULMN 3 1ti6_c07 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 C 144 HIS A 72 HIS^? 15.66 C2 EDO B 124 C 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 C 404 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo -15.55 89.08 -13.38 -16.05 90.98 -14.11 6.89 48.41 3.38 5.73 47.19 2.13 coo -23.98 91.31 -16.16 -21.94 90.86 -16.65 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -8.89 91.06 -18.89 -11.23 91.99 -17.67 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1ti6_c07 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 C 144 HIS A 88 HIS^? 13.90 OXT ACT A 123 C 174 ASP A 94 ASP.? 16.52 O ACT A 123 C 404 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo -15.55 89.08 -13.38 -16.05 90.98 -14.11 -1.51 48.14 15.79 -3.04 49.51 16.18 coo -23.98 91.31 -16.16 -21.94 90.86 -16.65 2.85 44.85 7.76 1.66 43.09 7.95 coo -8.89 91.06 -18.89 -11.23 91.99 -17.67 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 1ti6_c07 PYROGALLOL HYDROXYTRANSFERASE SMALL user 3 3 # 3 C 144 HIS B 72 HIS^? 13.54 O1 EDO A 124 C 174 ASP A 94 ASP.? 16.52 O ACT A 123 C 404 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo -15.55 89.08 -13.38 -16.05 90.98 -14.11 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -23.98 91.31 -16.16 -21.94 90.86 -16.65 2.85 44.85 7.76 1.66 43.09 7.95 coo -8.89 91.06 -18.89 -11.23 91.99 -17.67 0.65 57.23 -3.12 -1.98 58.01 -2.52 ULMN 3 1ti6_c07 PYROGALLOL HYDROXYTRANSFERASE SMALL user 4 3 # 4 C 144 HIS B 88 HIS^? 7.16 O1 EDO B 123 C 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 C 404 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo -15.55 89.08 -13.38 -16.05 90.98 -14.11 15.57 53.23 -12.61 17.12 54.63 -12.48 coo -23.98 91.31 -16.16 -21.94 90.86 -16.65 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -8.89 91.06 -18.89 -11.23 91.99 -17.67 11.57 61.77 -11.34 12.14 59.44 -12.79 1ti6_c07 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 4 hits 1ti6_c07 naa= 3 ULMN 3 1ti6_c08 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 E 144 HIS A 72 HIS^? 15.66 C2 EDO B 124 E 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 E 404 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo -7.53-107.59 75.19 -8.14-106.04 76.47 6.89 48.41 3.38 5.73 47.19 2.13 coo -3.55-105.39 83.13 -5.21-106.24 82.09 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -16.31-108.78 75.35 -14.20-107.14 76.16 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1ti6_c08 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 E 144 HIS A 88 HIS^? 13.90 OXT ACT A 123 E 174 ASP A 94 ASP.? 16.52 O ACT A 123 E 404 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo -7.53-107.59 75.19 -8.14-106.04 76.47 -1.51 48.14 15.79 -3.04 49.51 16.18 coo -3.55-105.39 83.13 -5.21-106.24 82.09 2.85 44.85 7.76 1.66 43.09 7.95 coo -16.31-108.78 75.35 -14.20-107.14 76.16 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 1ti6_c08 PYROGALLOL HYDROXYTRANSFERASE SMALL user 3 3 # 3 E 144 HIS B 72 HIS^? 13.54 O1 EDO A 124 E 174 ASP A 94 ASP.? 16.52 O ACT A 123 E 404 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo -7.53-107.59 75.19 -8.14-106.04 76.47 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -3.55-105.39 83.13 -5.21-106.24 82.09 2.85 44.85 7.76 1.66 43.09 7.95 coo -16.31-108.78 75.35 -14.20-107.14 76.16 0.65 57.23 -3.12 -1.98 58.01 -2.52 ULMN 3 1ti6_c08 PYROGALLOL HYDROXYTRANSFERASE SMALL user 4 3 # 4 E 144 HIS B 88 HIS^? 7.16 O1 EDO B 123 E 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 E 404 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo -7.53-107.59 75.19 -8.14-106.04 76.47 15.57 53.23 -12.61 17.12 54.63 -12.48 coo -3.55-105.39 83.13 -5.21-106.24 82.09 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -16.31-108.78 75.35 -14.20-107.14 76.16 11.57 61.77 -11.34 12.14 59.44 -12.79 1ti6_c08 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 4 hits 1ti6_c08 naa= 3 ULMN 3 1ti6_c09 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 G 144 HIS A 72 HIS^? 15.66 C2 EDO B 124 G 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 G 404 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo 60.48-101.16 45.95 60.56-101.20 43.85 6.89 48.41 3.38 5.73 47.19 2.13 coo 58.10-108.15 40.62 59.57-106.86 41.51 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 68.57 -97.60 44.49 66.22 -98.53 43.28 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1ti6_c09 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 G 144 HIS A 88 HIS^? 13.90 OXT ACT A 123 G 174 ASP A 94 ASP.? 16.52 O ACT A 123 G 404 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo 60.48-101.16 45.95 60.56-101.20 43.85 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 58.10-108.15 40.62 59.57-106.86 41.51 2.85 44.85 7.76 1.66 43.09 7.95 coo 68.57 -97.60 44.49 66.22 -98.53 43.28 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 1ti6_c09 PYROGALLOL HYDROXYTRANSFERASE SMALL user 3 3 # 3 G 144 HIS B 72 HIS^? 13.54 O1 EDO A 124 G 174 ASP A 94 ASP.? 16.52 O ACT A 123 G 404 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo 60.48-101.16 45.95 60.56-101.20 43.85 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 58.10-108.15 40.62 59.57-106.86 41.51 2.85 44.85 7.76 1.66 43.09 7.95 coo 68.57 -97.60 44.49 66.22 -98.53 43.28 0.65 57.23 -3.12 -1.98 58.01 -2.52 ULMN 3 1ti6_c09 PYROGALLOL HYDROXYTRANSFERASE SMALL user 4 3 # 4 G 144 HIS B 88 HIS^? 7.16 O1 EDO B 123 G 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 G 404 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo 60.48-101.16 45.95 60.56-101.20 43.85 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 58.10-108.15 40.62 59.57-106.86 41.51 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 68.57 -97.60 44.49 66.22 -98.53 43.28 11.57 61.77 -11.34 12.14 59.44 -12.79 1ti6_c09 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 4 hits 1ti6_c09 naa= 3 ULMN 3 1ti6_c10 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 I 144 HIS A 72 HIS^? 15.66 C2 EDO B 124 I 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 I 404 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo -12.68 -17.50 91.59 -12.79 -19.47 92.31 6.89 48.41 3.38 5.73 47.19 2.13 coo -20.27 -21.99 93.95 -18.47 -20.99 94.50 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -5.95 -17.59 97.43 -7.86 -19.17 96.13 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1ti6_c10 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 I 144 HIS A 88 HIS^? 13.90 OXT ACT A 123 I 174 ASP A 94 ASP.? 16.52 O ACT A 123 I 404 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo -12.68 -17.50 91.59 -12.79 -19.47 92.31 -1.51 48.14 15.79 -3.04 49.51 16.18 coo -20.27 -21.99 93.95 -18.47 -20.99 94.50 2.85 44.85 7.76 1.66 43.09 7.95 coo -5.95 -17.59 97.43 -7.86 -19.17 96.13 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 1ti6_c10 PYROGALLOL HYDROXYTRANSFERASE SMALL user 3 3 # 3 I 144 HIS B 72 HIS^? 13.54 O1 EDO A 124 I 174 ASP A 94 ASP.? 16.52 O ACT A 123 I 404 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo -12.68 -17.50 91.59 -12.79 -19.47 92.31 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -20.27 -21.99 93.95 -18.47 -20.99 94.50 2.85 44.85 7.76 1.66 43.09 7.95 coo -5.95 -17.59 97.43 -7.86 -19.17 96.13 0.65 57.23 -3.12 -1.98 58.01 -2.52 ULMN 3 1ti6_c10 PYROGALLOL HYDROXYTRANSFERASE SMALL user 4 3 # 4 I 144 HIS B 88 HIS^? 7.16 O1 EDO B 123 I 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 I 404 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo -12.68 -17.50 91.59 -12.79 -19.47 92.31 15.57 53.23 -12.61 17.12 54.63 -12.48 coo -20.27 -21.99 93.95 -18.47 -20.99 94.50 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -5.95 -17.59 97.43 -7.86 -19.17 96.13 11.57 61.77 -11.34 12.14 59.44 -12.79 1ti6_c10 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 4 hits 1ti6_c10 naa= 3 ULMN 3 1ti6_c11 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 K 144 HIS A 72 HIS^? 15.66 C2 EDO B 124 K 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 K 404 TYR A 116 TYR^? 6.05 O2 EDO A 127 coo 100.18 26.45 -1.32 99.24 26.12 0.53 6.89 48.41 3.38 5.73 47.19 2.13 coo 102.36 30.86 6.31 102.45 29.08 5.12 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 99.93 17.48 -0.85 99.14 19.86 0.39 13.42 55.06 8.10 16.05 56.03 7.83 ULMN 3 1ti6_c11 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 K 144 HIS A 88 HIS^? 13.90 OXT ACT A 123 K 174 ASP A 94 ASP.? 16.52 O ACT A 123 K 404 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo 100.18 26.45 -1.32 99.24 26.12 0.53 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 102.36 30.86 6.31 102.45 29.08 5.12 2.85 44.85 7.76 1.66 43.09 7.95 coo 99.93 17.48 -0.85 99.14 19.86 0.39 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 1ti6_c11 PYROGALLOL HYDROXYTRANSFERASE SMALL user 3 3 # 3 K 144 HIS B 72 HIS^? 13.54 O1 EDO A 124 K 174 ASP A 94 ASP.? 16.52 O ACT A 123 K 404 TYR B 116 TYR^? 3.94 O1 EDO B 124 coo 100.18 26.45 -1.32 99.24 26.12 0.53 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 102.36 30.86 6.31 102.45 29.08 5.12 2.85 44.85 7.76 1.66 43.09 7.95 coo 99.93 17.48 -0.85 99.14 19.86 0.39 0.65 57.23 -3.12 -1.98 58.01 -2.52 ULMN 3 1ti6_c11 PYROGALLOL HYDROXYTRANSFERASE SMALL user 4 3 # 4 K 144 HIS B 88 HIS^? 7.16 O1 EDO B 123 K 174 ASP B 94 ASP^? 10.22 O1 EDO A 124 K 404 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo 100.18 26.45 -1.32 99.24 26.12 0.53 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 102.36 30.86 6.31 102.45 29.08 5.12 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 99.93 17.48 -0.85 99.14 19.86 0.39 11.57 61.77 -11.34 12.14 59.44 -12.79 1ti6_c11 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 4 hits 1ti6_c11 naa= 3 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 # 1 A 250 ALA A 30 ALA^? 5.91 C2 EDO A 126 A 251 GLY A 31 GLY^? 7.19 O2 EDO A 126 A 252 ASP A 32 ASP.? 9.00 C2 EDO A 125 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 13.25 45.75 28.33 12.17 44.74 28.71 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 15.93 43.70 26.69 16.04 44.49 26.98 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 20.30 44.49 25.52 20.49 42.41 25.06 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 # 2 A 250 ALA A 92 ALA.? 17.17 O ACT A 123 A 251 GLY A 93 GLY.? 17.43 O ACT A 123 A 252 ASP A 94 ASP.? 16.52 O ACT A 123 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 7.18 41.33 6.36 8.11 40.19 5.85 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 5.07 43.20 3.81 5.07 43.46 4.54 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 3 3 # 3 A 250 ALA B 30 ALA^? 5.92 C2 PEG B 126 A 251 GLY B 31 GLY^? 6.91 C3 PEG B 126 A 252 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 0.82 55.62 -25.24 1.89 54.87 -26.04 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 4 3 # 4 A 250 ALA B 33 ALA^? 8.32 O2 PEG B 126 A 251 GLY B 31 GLY^? 6.91 C3 PEG B 126 A 252 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 -3.27 53.90 -18.94 -1.92 54.28 -18.39 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 5 3 # 5 A 250 ALA B 92 ALA^? 16.52 O2 EDO B 124 A 251 GLY B 93 GLY^? 13.55 O1 EDO A 124 A 252 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 6.78 43.61 -6.33 5.76 42.38 -6.21 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 8.78 44.49 -3.21 8.81 45.00 -3.81 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 11.18 47.39 -6.30 12.32 45.78 -7.12 1tz3_c02 source 1tz3 PUTATIVE SUGAR KINASE : 5 hits 1tz3_c02 naa= 3 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 # 1 B 250 ALA A 30 ALA^? 5.91 C2 EDO A 126 B 251 GLY A 31 GLY^? 7.19 O2 EDO A 126 B 252 ASP A 32 ASP.? 9.00 C2 EDO A 125 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 13.25 45.75 28.33 12.17 44.74 28.71 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 15.93 43.70 26.69 16.04 44.49 26.98 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 20.30 44.49 25.52 20.49 42.41 25.06 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 # 2 B 250 ALA A 92 ALA.? 17.17 O ACT A 123 B 251 GLY A 93 GLY.? 17.43 O ACT A 123 B 252 ASP A 94 ASP.? 16.52 O ACT A 123 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 7.18 41.33 6.36 8.11 40.19 5.85 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 5.07 43.20 3.81 5.07 43.46 4.54 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 3 3 # 3 B 250 ALA B 30 ALA^? 5.92 C2 PEG B 126 B 251 GLY B 31 GLY^? 6.91 C3 PEG B 126 B 252 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 0.82 55.62 -25.24 1.89 54.87 -26.04 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 4 3 # 4 B 250 ALA B 33 ALA^? 8.32 O2 PEG B 126 B 251 GLY B 31 GLY^? 6.91 C3 PEG B 126 B 252 ASP B 32 ASP^? 11.80 C3 PEG B 126 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 -3.27 53.90 -18.94 -1.92 54.28 -18.39 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -5.79 54.47 -23.19 -5.94 55.44 -25.07 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 5 3 # 5 B 250 ALA B 92 ALA^? 16.52 O2 EDO B 124 B 251 GLY B 93 GLY^? 13.55 O1 EDO A 124 B 252 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 6.78 43.61 -6.33 5.76 42.38 -6.21 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 8.78 44.49 -3.21 8.81 45.00 -3.81 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 11.18 47.39 -6.30 12.32 45.78 -7.12 1tz3_c03 source 1tz3 PUTATIVE SUGAR KINASE : 5 hits 1tz3_c03 naa= 3 ULMN 3 1uf7_c00 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 1 3 # 1 A 46 GLU A 75 GLU^? 16.23 O2 EDO A 124 A 126 LYS A 114 LYS^? 4.03 O ACT A 123 A 171 ALA A 92 ALA.? 17.17 O ACT A 123 coo 52.87 81.38 -9.32 53.05 81.09 -7.22 14.12 39.75 7.18 16.10 39.69 6.63 coo 51.43 89.29 -7.19 53.08 83.69 -4.74 11.95 48.07 7.92 11.03 52.28 12.68 coo 48.80 81.73 -5.45 50.30 81.43 -5.45 7.18 41.33 6.36 8.11 40.19 5.85 ULMN 3 1uf7_c00 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 2 3 # 2 A 46 GLU A 77 GLU^? 11.16 O2 EDO A 126 A 126 LYS A 113 LYS^? 12.75 O2 EDO A 124 A 171 ALA A 78 ALA^? 8.34 O2 EDO A 126 coo 52.87 81.38 -9.32 53.05 81.09 -7.22 8.02 38.51 14.00 9.59 37.31 13.17 coo 51.43 89.29 -7.19 53.08 83.69 -4.74 13.93 45.27 9.54 19.06 43.44 6.58 coo 48.80 81.73 -5.45 50.30 81.43 -5.45 7.30 43.06 15.76 8.05 44.38 15.61 ULMN 3 1uf7_c00 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 3 3 # 3 A 46 GLU B 75 GLU^? 16.27 C2 EDO B 124 A 126 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 171 ALA B 92 ALA^? 16.52 O2 EDO B 124 coo 52.87 81.38 -9.32 53.05 81.09 -7.22 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 51.43 89.29 -7.19 53.08 83.69 -4.74 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 48.80 81.73 -5.45 50.30 81.43 -5.45 6.78 43.61 -6.33 5.76 42.38 -6.21 ULMN 3 1uf7_c00 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 4 3 # 4 A 46 GLU B 77 GLU^? 10.85 O4 PEG B 126 A 126 LYS B 113 LYS^? 13.71 C2 EDO B 124 A 171 ALA B 78 ALA^? 8.57 O2 PEG B 126 coo 52.87 81.38 -9.32 53.05 81.09 -7.22 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 51.43 89.29 -7.19 53.08 83.69 -4.74 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 48.80 81.73 -5.45 50.30 81.43 -5.45 6.78 48.53 -14.43 6.13 49.77 -13.82 1uf7_c00 source 1uf7 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLASE : 4 hits 1uf7_c00 naa= 3 ULMN 3 1uf7_c01 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 1 3 # 1 B 46 GLU A 75 GLU^? 16.23 O2 EDO A 124 B 126 LYS A 114 LYS^? 4.03 O ACT A 123 B 171 ALA A 92 ALA.? 17.17 O ACT A 123 coo 20.47 87.42 16.54 20.16 87.17 14.45 14.12 39.75 7.18 16.10 39.69 6.63 coo 24.73 94.37 14.59 21.08 89.84 11.98 11.95 48.07 7.92 11.03 52.28 12.68 coo 24.38 86.32 12.71 22.88 86.54 12.71 7.18 41.33 6.36 8.11 40.19 5.85 ULMN 3 1uf7_c01 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 2 3 # 2 B 46 GLU A 77 GLU^? 11.16 O2 EDO A 126 B 126 LYS A 113 LYS^? 12.75 O2 EDO A 124 B 171 ALA A 78 ALA^? 8.34 O2 EDO A 126 coo 20.47 87.42 16.54 20.16 87.17 14.45 8.02 38.51 14.00 9.59 37.31 13.17 coo 24.73 94.37 14.59 21.08 89.84 11.98 13.93 45.27 9.54 19.06 43.44 6.58 coo 24.38 86.32 12.71 22.88 86.54 12.71 7.30 43.06 15.76 8.05 44.38 15.61 ULMN 3 1uf7_c01 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 3 3 # 3 B 46 GLU B 75 GLU^? 16.27 C2 EDO B 124 B 126 LYS B 114 LYS^? -2.62 O2 EDO B 124s B 171 ALA B 92 ALA^? 16.52 O2 EDO B 124 coo 20.47 87.42 16.54 20.16 87.17 14.45 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 24.73 94.37 14.59 21.08 89.84 11.98 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 24.38 86.32 12.71 22.88 86.54 12.71 6.78 43.61 -6.33 5.76 42.38 -6.21 ULMN 3 1uf7_c01 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLAuser 4 3 # 4 B 46 GLU B 77 GLU^? 10.85 O4 PEG B 126 B 126 LYS B 113 LYS^? 13.71 C2 EDO B 124 B 171 ALA B 78 ALA^? 8.57 O2 PEG B 126 coo 20.47 87.42 16.54 20.16 87.17 14.45 6.00 43.66 -14.33 4.35 42.35 -13.99 coo 24.73 94.37 14.59 21.08 89.84 11.98 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 24.38 86.32 12.71 22.88 86.54 12.71 6.78 48.53 -14.43 6.13 49.77 -13.82 1uf7_c01 source 1uf7 N-CARBAMYL-D-AMINO ACID AMIDOHYDROLASE : 4 hits 1uf7_c01 naa= 3 ULMN 3 1uk7_c00 3.07.01.0009 user 1 3 # 1 A 103 ALA A 89 ALA^? 11.47 O1 EDO A 126 A 224 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 252 HIS A 88 HIS^? 13.90 OXT ACT A 123 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 1.19 42.59 14.96 0.64 41.15 15.03 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 -1.51 48.14 15.79 -3.04 49.51 16.18 ULMN 3 1uk7_c00 3.07.01.0009 user 2 3 # 2 A 103 ALA B 89 ALA^? 11.41 O2 EDO B 123 A 224 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 252 HIS B 88 HIS^? 7.16 O1 EDO B 123 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 12.86 47.80 -13.77 13.41 46.50 -14.35 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 15.57 53.23 -12.61 17.12 54.63 -12.48 1uk7_c00 source 1uk7 3.07.01.0009 : 2 hits 1uk7_c00 naa= 3 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 5 ASP.? 11.32 O1 EDO B 123 218 GLU A 75 GLU^? 16.23 O2 EDO A 124 329 ASP B 82 ASP^? 7.08 O1 EDO B 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 70.09 11.71 8.46 70.56 12.89 6.77 14.12 39.75 7.18 16.10 39.69 6.63 coo 59.16 37.82 13.95 57.63 37.03 15.12 16.23 58.63 -15.55 16.12 57.73 -13.62 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 5 ASP.? 11.32 O1 EDO B 123 218 GLU B 75 GLU^? 16.27 C2 EDO B 124 329 ASP B 84 ASP^? 4.63 O1 EDO B 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 70.09 11.71 8.46 70.56 12.89 6.77 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 59.16 37.82 13.95 57.63 37.03 15.12 20.02 60.63 -18.97 20.31 59.23 -17.40 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP A 82 ASP.? 12.57 OXT ACT A 123 218 GLU B 54 GLU^? 12.15 C2 EDO B 124 329 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 70.09 11.71 8.46 70.56 12.89 6.77 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 59.16 37.82 13.95 57.63 37.03 15.12 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP A 82 ASP.? 12.57 OXT ACT A 123 218 GLU B 100 GLU^? 11.75 C1 EDO B 125 329 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 70.09 11.71 8.46 70.56 12.89 6.77 10.53 69.09 -5.55 11.13 70.44 -7.09 coo 59.16 37.82 13.95 57.63 37.03 15.12 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 5 3 # 5 199 ASP A 84 ASP.? 16.56 O1 EDO A 126 218 GLU A 42 GLU^? -4.18 C1 EDO A 128s 329 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 -5.66 53.01 24.37 -6.07 52.23 22.45 coo 70.09 11.71 8.46 70.56 12.89 6.77 19.47 62.47 4.05 21.30 62.78 5.02 coo 59.16 37.82 13.95 57.63 37.03 15.12 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 6 3 # 6 199 ASP A 84 ASP.? 16.56 O1 EDO A 126 218 GLU B 75 GLU^? 16.27 C2 EDO B 124 329 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 -5.66 53.01 24.37 -6.07 52.23 22.45 coo 70.09 11.71 8.46 70.56 12.89 6.77 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 59.16 37.82 13.95 57.63 37.03 15.12 -6.45 59.57 16.94 -6.05 60.31 18.88 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 7 3 # 7 199 ASP B 5 ASP^? 17.31 OXT ACT A 123 218 GLU A 75 GLU^? 16.23 O2 EDO A 124 329 ASP A 84 ASP.? 16.56 O1 EDO A 126 coo 49.16 35.16 15.19 51.08 34.43 15.65 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 70.09 11.71 8.46 70.56 12.89 6.77 14.12 39.75 7.18 16.10 39.69 6.63 coo 59.16 37.82 13.95 57.63 37.03 15.12 -5.66 53.01 24.37 -6.07 52.23 22.45 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 8 3 # 8 199 ASP B 5 ASP^? 17.31 OXT ACT A 123 218 GLU B 75 GLU^? 16.27 C2 EDO B 124 329 ASP A 82 ASP.? 12.57 OXT ACT A 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 70.09 11.71 8.46 70.56 12.89 6.77 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 59.16 37.82 13.95 57.63 37.03 15.12 -1.93 52.21 20.42 -1.91 52.01 18.28 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 9 3 # 9 199 ASP B 82 ASP^? 7.08 O1 EDO B 123 218 GLU A 54 GLU^? 10.26 O1 EDO A 125 329 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 70.09 11.71 8.46 70.56 12.89 6.77 19.19 45.91 11.58 20.09 44.01 11.30 coo 59.16 37.82 13.95 57.63 37.03 15.12 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 10 3 # 10 199 ASP B 82 ASP^? 7.08 O1 EDO B 123 218 GLU A 100 GLU^? 12.02 O1 EDO A 127 329 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 70.09 11.71 8.46 70.56 12.89 6.77 3.40 65.53 14.62 2.89 66.21 16.58 coo 59.16 37.82 13.95 57.63 37.03 15.12 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 11 3 # 11 199 ASP B 84 ASP^? 4.63 O1 EDO B 123 218 GLU A 54 GLU^? 10.26 O1 EDO A 125 329 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 70.09 11.71 8.46 70.56 12.89 6.77 19.19 45.91 11.58 20.09 44.01 11.30 coo 59.16 37.82 13.95 57.63 37.03 15.12 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 12 3 # 12 199 ASP B 84 ASP^? 4.63 O1 EDO B 123 218 GLU A 75 GLU^? 16.23 O2 EDO A 124 329 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 70.09 11.71 8.46 70.56 12.89 6.77 14.12 39.75 7.18 16.10 39.69 6.63 coo 59.16 37.82 13.95 57.63 37.03 15.12 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 13 3 # 13 199 ASP B 84 ASP^? 4.63 O1 EDO B 123 218 GLU B 42 GLU^? 9.23 O2 EDO B 125 329 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 70.09 11.71 8.46 70.56 12.89 6.77 -4.84 63.10 3.03 -6.17 64.39 2.00 coo 59.16 37.82 13.95 57.63 37.03 15.12 20.60 64.37 -9.63 20.20 65.77 -11.14 1uok_c04 source 1uok OLIGO-1,6-GLUCOSIDASE : 13 hits 1uok_c04 naa= 3 ULMN 3 1vzx_c02 2.04.01.0087 user 1 3 # 1 A 314 TYR A 67 TYR^? -4.09 C2 EDO A 127s A 317 GLU A 69 GLU^? 4.98 OXT ACT A 123 A 365 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 1.77 6.56 57.05 3.05 7.44 59.37 9.19 62.70 13.11 10.16 60.66 14.79 coo 3.06 2.85 52.79 4.83 3.89 53.24 8.76 56.68 10.43 10.20 56.07 11.84 coo 3.82 17.09 49.56 4.09 14.32 50.84 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1vzx_c02 2.04.01.0087 user 2 3 # 2 A 314 TYR A 67 TYR^? -4.09 C2 EDO A 127s A 317 GLU A 100 GLU^? 12.02 O1 EDO A 127 A 365 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 1.77 6.56 57.05 3.05 7.44 59.37 9.19 62.70 13.11 10.16 60.66 14.79 coo 3.06 2.85 52.79 4.83 3.89 53.24 3.40 65.53 14.62 2.89 66.21 16.58 coo 3.82 17.09 49.56 4.09 14.32 50.84 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1vzx_c02 2.04.01.0087 user 3 3 # 3 A 314 TYR A 70 TYR^? 13.06 C1 EDO B 124 A 317 GLU A 69 GLU^? 4.98 OXT ACT A 123 A 365 ARG B 11 ARG^? 15.69 O ACT A 123 coo 1.77 6.56 57.05 3.05 7.44 59.37 5.72 54.72 4.86 5.42 52.52 3.21 coo 3.06 2.85 52.79 4.83 3.89 53.24 8.76 56.68 10.43 10.20 56.07 11.84 coo 3.82 17.09 49.56 4.09 14.32 50.84 -2.30 47.71 11.46 -0.79 44.99 11.29 ULMN 3 1vzx_c02 2.04.01.0087 user 4 3 # 4 A 314 TYR A 116 TYR^? 6.05 O2 EDO A 127 A 317 GLU A 49 GLU^? 5.11 O2 EDO A 127 A 365 ARG A 36 ARG^? -3.17 O2 EDO A 125s coo 1.77 6.56 57.05 3.05 7.44 59.37 13.42 55.06 8.10 16.05 56.03 7.83 coo 3.06 2.85 52.79 4.83 3.89 53.24 16.74 60.19 6.60 17.85 60.24 8.39 coo 3.82 17.09 49.56 4.09 14.32 50.84 24.38 48.23 13.15 25.39 47.42 15.97 ULMN 3 1vzx_c02 2.04.01.0087 user 5 3 # 5 A 314 TYR B 67 TYR^? -3.57 C1 EDO B 125s A 317 GLU B 69 GLU^? -2.92 O2 EDO B 124s A 365 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 1.77 6.56 57.05 3.05 7.44 59.37 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 3.06 2.85 52.79 4.83 3.89 53.24 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 3.82 17.09 49.56 4.09 14.32 50.84 3.96 65.71 -18.47 3.56 68.28 -16.63 ULMN 3 1vzx_c02 2.04.01.0087 user 6 3 # 6 A 314 TYR B 67 TYR^? -3.57 C1 EDO B 125s A 317 GLU B 100 GLU^? 11.75 C1 EDO B 125 A 365 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 1.77 6.56 57.05 3.05 7.44 59.37 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 3.06 2.85 52.79 4.83 3.89 53.24 10.53 69.09 -5.55 11.13 70.44 -7.09 coo 3.82 17.09 49.56 4.09 14.32 50.84 3.96 65.71 -18.47 3.56 68.28 -16.63 ULMN 3 1vzx_c02 2.04.01.0087 user 7 3 # 7 A 314 TYR B 70 TYR^? 11.25 O2 EDO B 124 A 317 GLU B 69 GLU^? -2.92 O2 EDO B 124s A 365 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 1.77 6.56 57.05 3.05 7.44 59.37 8.28 55.71 -0.18 8.56 53.06 0.60 coo 3.06 2.85 52.79 4.83 3.89 53.24 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 3.82 17.09 49.56 4.09 14.32 50.84 16.32 51.23 -8.65 14.73 48.69 -9.52 ULMN 3 1vzx_c02 2.04.01.0087 user 8 3 # 8 A 314 TYR B 116 TYR^? 3.94 O1 EDO B 124 A 317 GLU B 49 GLU^? -4.87 O2 EDO B 125s A 365 ARG B 36 ARG^? 14.13 O1 EDO B 124 coo 1.77 6.56 57.05 3.05 7.44 59.37 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo 3.06 2.85 52.79 4.83 3.89 53.24 -2.74 61.61 0.34 -3.60 61.93 -1.53 coo 3.82 17.09 49.56 4.09 14.32 50.84 -10.17 52.84 -10.41 -11.23 53.10 -13.33 1vzx_c02 source 1vzx 2.04.01.0087 : 8 hits 1vzx_c02 naa= 3 ULMN 3 1vzx_c03 2.04.01.0087 user 1 3 # 1 B1314 TYR A 67 TYR^? -4.09 C2 EDO A 127s B1317 GLU A 69 GLU^? 4.98 OXT ACT A 123 B1365 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 9.19 62.70 13.11 10.16 60.66 14.79 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 8.76 56.68 10.43 10.20 56.07 11.84 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1vzx_c03 2.04.01.0087 user 2 3 # 2 B1314 TYR A 67 TYR^? -4.09 C2 EDO A 127s B1317 GLU A 100 GLU^? 12.02 O1 EDO A 127 B1365 ARG A 27 ARG.? 5.17 CH3 ACT A 123 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 9.19 62.70 13.11 10.16 60.66 14.79 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 3.40 65.53 14.62 2.89 66.21 16.58 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 10.94 57.70 24.22 11.90 58.81 21.49 ULMN 3 1vzx_c03 2.04.01.0087 user 3 3 # 3 B1314 TYR A 70 TYR^? 13.06 C1 EDO B 124 B1317 GLU A 69 GLU^? 4.98 OXT ACT A 123 B1365 ARG B 11 ARG^? 15.69 O ACT A 123 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 5.72 54.72 4.86 5.42 52.52 3.21 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 8.76 56.68 10.43 10.20 56.07 11.84 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 -2.30 47.71 11.46 -0.79 44.99 11.29 ULMN 3 1vzx_c03 2.04.01.0087 user 4 3 # 4 B1314 TYR A 116 TYR^? 6.05 O2 EDO A 127 B1317 GLU A 49 GLU^? 5.11 O2 EDO A 127 B1365 ARG A 36 ARG^? -3.17 O2 EDO A 125s coo 13.32 10.15 -9.20 12.07 11.36 -11.38 13.42 55.06 8.10 16.05 56.03 7.83 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 16.74 60.19 6.60 17.85 60.24 8.39 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 24.38 48.23 13.15 25.39 47.42 15.97 ULMN 3 1vzx_c03 2.04.01.0087 user 5 3 # 5 B1314 TYR B 67 TYR^? -3.57 C1 EDO B 125s B1317 GLU B 69 GLU^? -2.92 O2 EDO B 124s B1365 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 3.96 65.71 -18.47 3.56 68.28 -16.63 ULMN 3 1vzx_c03 2.04.01.0087 user 6 3 # 6 B1314 TYR B 67 TYR^? -3.57 C1 EDO B 125s B1317 GLU B 100 GLU^? 11.75 C1 EDO B 125 B1365 ARG B 27 ARG^? 11.58 C1 EDO B 125 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 10.53 69.09 -5.55 11.13 70.44 -7.09 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 3.96 65.71 -18.47 3.56 68.28 -16.63 ULMN 3 1vzx_c03 2.04.01.0087 user 7 3 # 7 B1314 TYR B 70 TYR^? 11.25 O2 EDO B 124 B1317 GLU B 69 GLU^? -2.92 O2 EDO B 124s B1365 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo 13.32 10.15 -9.20 12.07 11.36 -11.38 8.28 55.71 -0.18 8.56 53.06 0.60 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 5.26 59.46 -4.72 3.83 59.41 -6.26 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 16.32 51.23 -8.65 14.73 48.69 -9.52 ULMN 3 1vzx_c03 2.04.01.0087 user 8 3 # 8 B1314 TYR B 116 TYR^? 3.94 O1 EDO B 124 B1317 GLU B 49 GLU^? -4.87 O2 EDO B 125s B1365 ARG B 36 ARG^? 14.13 O1 EDO B 124 coo 13.32 10.15 -9.20 12.07 11.36 -11.38 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo 12.13 5.84 -5.49 10.31 6.88 -5.76 -2.74 61.61 0.34 -3.60 61.93 -1.53 coo 11.24 19.69 -0.67 10.92 17.07 -2.21 -10.17 52.84 -10.41 -11.23 53.10 -13.33 1vzx_c03 source 1vzx 2.04.01.0087 : 8 hits 1vzx_c03 naa= 3 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 102 TYR^? 8.02 OXT ACT A 123 A 40 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 103 LEU B 9 LEU^? 10.54 OXT ACT A 123 coo 12.09 16.13 10.57 11.28 18.80 10.73 2.53 56.58 17.48 2.05 53.90 18.03 coo 7.55 25.51 14.34 9.65 25.73 14.24 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 11.83 18.73 16.99 10.99 19.71 15.26 -0.60 52.07 14.72 1.41 51.51 14.02 ULMN 3 1vzz_c00 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR B 102 TYR^? 11.19 O2 EDO B 124 A 40 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 103 LEU A 9 LEU.? 9.77 O1 EDO A 124 coo 12.09 16.13 10.57 11.28 18.80 10.73 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 7.55 25.51 14.34 9.65 25.73 14.24 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 11.83 18.73 16.99 10.99 19.71 15.26 14.77 56.55 -10.22 12.76 55.82 -9.85 1vzz_c00 source 1vzz STEROID DELTA-ISOMERASE : 2 hits 1vzz_c00 naa= 3 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 102 TYR^? 8.02 OXT ACT A 123 B 40 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 103 LEU B 9 LEU^? 10.54 OXT ACT A 123 coo 14.25 20.09 37.35 13.48 17.40 37.38 2.53 56.58 17.48 2.05 53.90 18.03 coo 9.39 10.77 34.53 11.50 10.63 34.41 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 12.89 17.60 31.13 12.34 16.51 32.90 -0.60 52.07 14.72 1.41 51.51 14.02 ULMN 3 1vzz_c01 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR B 102 TYR^? 11.19 O2 EDO B 124 B 40 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 103 LEU A 9 LEU.? 9.77 O1 EDO A 124 coo 14.25 20.09 37.35 13.48 17.40 37.38 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 9.39 10.77 34.53 11.50 10.63 34.41 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 12.89 17.60 31.13 12.34 16.51 32.90 14.77 56.55 -10.22 12.76 55.82 -9.85 1vzz_c01 source 1vzz STEROID DELTA-ISOMERASE : 2 hits 1vzz_c01 naa= 3 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 1 3 # 1 A 183 GLY A 31 GLY^? 7.19 O2 EDO A 126 B 419 GLY A 58 GLY^? 4.54 O2 EDO A 126 B 420 ALA A 33 ALA.? 8.34 O2 EDO A 126 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 15.93 43.70 26.69 16.04 44.49 26.98 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 13.77 44.09 23.02 13.24 44.04 22.37 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 17.73 46.03 21.52 16.32 46.64 21.20 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 2 3 # 2 A 183 GLY A 58 GLY^? 4.54 O2 EDO A 126 B 419 GLY A 31 GLY^? 7.19 O2 EDO A 126 B 420 ALA A 30 ALA^? 5.91 C2 EDO A 126 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 13.77 44.09 23.02 13.24 44.04 22.37 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 15.93 43.70 26.69 16.04 44.49 26.98 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 13.25 45.75 28.33 12.17 44.74 28.71 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 3 3 # 3 A 183 GLY B 31 GLY^? 6.91 C3 PEG B 126 B 419 GLY B 58 GLY^? 4.51 C3 PEG B 126 B 420 ALA B 33 ALA^? 8.32 O2 PEG B 126 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 0.44 52.11 -20.97 0.96 51.82 -20.37 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 -3.27 53.90 -18.94 -1.92 54.28 -18.39 ULMN 3 1xny_c00 PROPIONYL-COA CARBOXYLASE COMPLEX B user 4 3 # 4 A 183 GLY B 58 GLY^? 4.51 C3 PEG B 126 B 419 GLY B 31 GLY^? 6.91 C3 PEG B 126 B 420 ALA B 30 ALA^? 5.92 C2 PEG B 126 coo 26.12 -67.67-130.71 26.18 -67.32-131.45 0.44 52.11 -20.97 0.96 51.82 -20.37 coo 25.10 -66.82-126.88 25.40 -66.55-126.17 -1.76 52.92 -24.37 -1.97 53.59 -24.25 coo 26.37 -68.04-123.51 27.50 -67.42-122.72 0.82 55.62 -25.24 1.89 54.87 -26.04 1xny_c00 source 1xny PROPIONYL-COA CARBOXYLASE COMPLEX B SUBUNIT : 4 hits 1xny_c00 naa= 3 ULMN 3 1xqd_c02 CYTOCHROME P450 55A1 user 1 3 # 1 A 243 THR A 14 THR.? 8.58 O1 EDO A 124 A 345 PHE B 96 PHE^? 9.36 O2 EDO B 124 A 352 CYH B 71 CYH^? 5.39 O2 EDO B 124 coo 9.58 21.79 21.50 11.25 23.03 20.90 17.20 46.38 0.71 15.18 46.20 -0.03 coo 19.40 19.75 18.58 17.39 17.81 18.80 10.95 53.66 -6.99 8.59 53.45 -8.41 coo 21.57 22.52 22.79 19.20 21.13 23.26 6.71 54.39 -4.07 6.30 55.99 -6.30 ULMN 3 1xqd_c02 CYTOCHROME P450 55A1 user 2 3 # 2 A 243 THR B 14 THR^? 15.08 C2 EDO B 124 A 345 PHE A 96 PHE^? 9.38 OXT ACT A 123 A 352 CYH A 71 CYH^? 6.77 OXT ACT A 123 coo 9.58 21.79 21.50 11.25 23.03 20.90 -3.15 46.62 0.75 -1.23 46.14 1.47 coo 19.40 19.75 18.58 17.39 17.81 18.80 3.05 50.53 10.55 5.47 49.81 11.76 coo 21.57 22.52 22.79 19.20 21.13 23.26 7.28 52.14 8.02 7.72 52.85 10.71 1xqd_c02 source 1xqd CYTOCHROME P450 55A1 : 2 hits 1xqd_c02 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 89 ALA^? 11.47 O1 EDO A 126 B 126 ARG B 11 ARG^? 15.69 O ACT A 123 B 138 GLU A 77 GLU^? 11.16 O2 EDO A 126 coo 2.11 4.00 19.31 3.14 4.86 19.99 1.19 42.59 14.96 0.64 41.15 15.03 coo 2.45 5.53 11.28 3.59 7.56 13.29 -2.30 47.71 11.46 -0.79 44.99 11.29 coo 6.10 2.00 25.24 6.12 1.84 23.13 8.02 38.51 14.00 9.59 37.31 13.17 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 B 124 ALA B 89 ALA^? 11.41 O2 EDO B 123 B 126 ARG A 11 ARG^? -8.10 O1 EDO A 124s B 138 GLU B 77 GLU^? 10.85 O4 PEG B 126 coo 2.11 4.00 19.31 3.14 4.86 19.99 12.86 47.80 -13.77 13.41 46.50 -14.35 coo 2.45 5.53 11.28 3.59 7.56 13.29 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 6.10 2.00 25.24 6.12 1.84 23.13 6.00 43.66 -14.33 4.35 42.35 -13.99 1xs1_c07 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 2 hits 1xs1_c07 naa= 3 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 C 124 ALA A 89 ALA^? 11.47 O1 EDO A 126 C 126 ARG B 11 ARG^? 15.69 O ACT A 123 C 138 GLU A 77 GLU^? 11.16 O2 EDO A 126 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 1.19 42.59 14.96 0.64 41.15 15.03 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -2.30 47.71 11.46 -0.79 44.99 11.29 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 8.02 38.51 14.00 9.59 37.31 13.17 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 C 124 ALA B 89 ALA^? 11.41 O2 EDO B 123 C 126 ARG A 11 ARG^? -8.10 O1 EDO A 124s C 138 GLU B 77 GLU^? 10.85 O4 PEG B 126 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 12.86 47.80 -13.77 13.41 46.50 -14.35 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 16.32 51.23 -8.65 14.73 48.69 -9.52 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 6.00 43.66 -14.33 4.35 42.35 -13.99 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 2 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 89 ALA^? 11.47 O1 EDO A 126 D 126 ARG B 11 ARG^? 15.69 O ACT A 123 D 138 GLU A 77 GLU^? 11.16 O2 EDO A 126 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 1.19 42.59 14.96 0.64 41.15 15.03 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -2.30 47.71 11.46 -0.79 44.99 11.29 coo 6.23 0.50 57.10 5.93 0.72 59.19 8.02 38.51 14.00 9.59 37.31 13.17 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 D 124 ALA B 89 ALA^? 11.41 O2 EDO B 123 D 126 ARG A 11 ARG^? -8.10 O1 EDO A 124s D 138 GLU B 77 GLU^? 10.85 O4 PEG B 126 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 12.86 47.80 -13.77 13.41 46.50 -14.35 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 16.32 51.23 -8.65 14.73 48.69 -9.52 coo 6.23 0.50 57.10 5.93 0.72 59.19 6.00 43.66 -14.33 4.35 42.35 -13.99 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 2 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 89 ALA^? 11.47 O1 EDO A 126 E 126 ARG B 11 ARG^? 15.69 O ACT A 123 E 138 GLU A 77 GLU^? 11.16 O2 EDO A 126 coo -4.56 10.03 62.36 -4.38 11.31 61.55 1.19 42.59 14.96 0.64 41.15 15.03 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -2.30 47.71 11.46 -0.79 44.99 11.29 coo -8.67 12.22 56.54 -8.68 12.09 58.65 8.02 38.51 14.00 9.59 37.31 13.17 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 E 124 ALA B 89 ALA^? 11.41 O2 EDO B 123 E 126 ARG A 11 ARG^? -8.10 O1 EDO A 124s E 138 GLU B 77 GLU^? 10.85 O4 PEG B 126 coo -4.56 10.03 62.36 -4.38 11.31 61.55 12.86 47.80 -13.77 13.41 46.50 -14.35 coo -3.02 12.00 70.07 -1.94 13.84 67.82 16.32 51.23 -8.65 14.73 48.69 -9.52 coo -8.67 12.22 56.54 -8.68 12.09 58.65 6.00 43.66 -14.33 4.35 42.35 -13.99 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 2 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 89 ALA^? 11.47 O1 EDO A 126 F 126 ARG B 11 ARG^? 15.69 O ACT A 123 F 138 GLU A 77 GLU^? 11.16 O2 EDO A 126 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 1.19 42.59 14.96 0.64 41.15 15.03 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -2.30 47.71 11.46 -0.79 44.99 11.29 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 8.02 38.51 14.00 9.59 37.31 13.17 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 F 124 ALA B 89 ALA^? 11.41 O2 EDO B 123 F 126 ARG A 11 ARG^? -8.10 O1 EDO A 124s F 138 GLU B 77 GLU^? 10.85 O4 PEG B 126 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 12.86 47.80 -13.77 13.41 46.50 -14.35 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 16.32 51.23 -8.65 14.73 48.69 -9.52 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 6.00 43.66 -14.33 4.35 42.35 -13.99 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 2 hits 1xs1_c11 naa= 3 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 1 3 # 1 B 137 GLY A 85 GLY.? 11.94 O1 EDO A 126 B 175 ARG B 8 ARG^? 17.13 OXT ACT A 123 B 242 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo 99.45 58.28 3.33 99.57 58.61 4.10 -2.98 48.97 24.74 -3.25 49.30 24.08 coo 106.37 63.53 0.89 108.02 63.40 -1.62 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 100.93 69.04 4.38 99.52 68.48 2.09 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 2 3 # 2 B 137 GLY B 85 GLY^? 6.90 C2 EDO B 123 B 175 ARG A 8 ARG.? -3.85 O1 EDO B 123s B 242 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo 99.45 58.28 3.33 99.57 58.61 4.10 17.33 56.99 -20.74 17.59 57.10 -19.99 coo 106.37 63.53 0.89 108.02 63.40 -1.62 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 100.93 69.04 4.38 99.52 68.48 2.09 11.57 61.77 -11.34 12.14 59.44 -12.79 1xva_c03 source 1xva GLYCINE N-METHYLTRANSFERASE : 2 hits 1xva_c03 naa= 3 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 # 1 142 TRP A 106 TRP^? 4.14 O ACT A 123 223 ASP A 82 ASP.? 12.57 OXT ACT A 123 258 ALA A 95 ALA^? 14.79 C2 EDO B 124 coo 128.40 33.01 26.67 128.12 36.28 28.81 8.32 51.05 18.05 8.68 49.61 14.39 coo 127.91 41.73 23.55 129.18 40.35 24.44 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 141.00 37.49 25.74 139.80 37.53 24.78 3.02 49.05 5.86 2.79 49.60 4.45 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 # 2 142 TRP B 106 TRP^? 6.57 O2 EDO B 124 223 ASP B 82 ASP^? 7.08 O1 EDO B 123 258 ALA B 95 ALA^? 9.56 O1 EDO A 124 coo 128.40 33.01 26.67 128.12 36.28 28.81 5.92 56.83 -13.86 5.41 54.26 -10.92 coo 127.91 41.73 23.55 129.18 40.35 24.44 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 141.00 37.49 25.74 139.80 37.53 24.78 10.94 50.69 -3.13 11.14 50.75 -1.62 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 2 hits 2aat_c01 naa= 3 ULMN 3 2ace_c00 ACETYLCHOLINESTERASE user 1 3 # 1 200 SER A 55 SER^? 7.70 O ACT A 123 327 GLU A 75 GLU^? 16.23 O2 EDO A 124 440 HIS A 111 HIS^? 11.74 C2 EDO A 125 coo 6.96 64.04 57.84 6.74 63.69 60.26 16.48 46.12 15.51 15.38 46.59 17.63 coo 14.82 64.63 62.37 13.47 65.72 61.17 14.12 39.75 7.18 16.10 39.69 6.63 coo 9.52 66.51 63.07 8.75 65.02 61.81 16.68 40.80 13.52 18.19 42.09 12.84 ULMN 3 2ace_c00 ACETYLCHOLINESTERASE user 2 3 # 2 200 SER A 57 SER^? 6.85 O2 EDO A 126 327 GLU A 54 GLU^? 10.26 O1 EDO A 125 440 HIS A 111 HIS^? 11.74 C2 EDO A 125 coo 6.96 64.04 57.84 6.74 63.69 60.26 15.14 41.83 20.35 16.25 40.17 21.70 coo 14.82 64.63 62.37 13.47 65.72 61.17 19.19 45.91 11.58 20.09 44.01 11.30 coo 9.52 66.51 63.07 8.75 65.02 61.81 16.68 40.80 13.52 18.19 42.09 12.84 ULMN 3 2ace_c00 ACETYLCHOLINESTERASE user 3 3 # 3 200 SER B 55 SER^? 9.36 O2 PEG B 126 327 GLU B 75 GLU^? 16.27 C2 EDO B 124 440 HIS B 111 HIS^? 12.89 C3 PEG B 126 coo 6.96 64.04 57.84 6.74 63.69 60.26 -2.31 51.65 -13.29 -1.27 52.80 -15.19 coo 14.82 64.63 62.37 13.47 65.72 61.17 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 9.52 66.51 63.07 8.75 65.02 61.81 -2.41 45.44 -12.93 -3.29 45.75 -11.05 ULMN 3 2ace_c00 ACETYLCHOLINESTERASE user 4 3 # 4 200 SER B 57 SER^? 6.28 O4 PEG B 126 327 GLU B 54 GLU^? 12.15 C2 EDO B 124 440 HIS B 111 HIS^? 12.89 C3 PEG B 126 coo 6.96 64.04 57.84 6.74 63.69 60.26 -1.05 49.09 -19.26 -2.38 47.97 -20.95 coo 14.82 64.63 62.37 13.47 65.72 61.17 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 9.52 66.51 63.07 8.75 65.02 61.81 -2.41 45.44 -12.93 -3.29 45.75 -11.05 2ace_c00 source 2ace ACETYLCHOLINESTERASE : 4 hits 2ace_c00 naa= 3 ULMN 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 1 3 # 1 A 43 ASP A 94 ASP.? 16.52 O ACT A 123 A 48 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 77 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 13.04 30.41 72.50 12.95 30.65 70.36 2.85 44.85 7.76 1.66 43.09 7.95 coo 12.77 23.50 68.33 13.58 25.42 68.49 6.89 48.41 3.38 5.73 47.19 2.13 coo 7.53 29.84 65.06 12.29 29.41 67.79 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 2 3 # 2 A 43 ASP A 94 ASP.? 16.52 O ACT A 123 A 48 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 77 LYS A 114 LYS^? 4.03 O ACT A 123 coo 13.04 30.41 72.50 12.95 30.65 70.36 2.85 44.85 7.76 1.66 43.09 7.95 coo 12.77 23.50 68.33 13.58 25.42 68.49 6.89 48.41 3.38 5.73 47.19 2.13 coo 7.53 29.84 65.06 12.29 29.41 67.79 11.95 48.07 7.92 11.03 52.28 12.68 ULMN 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 3 3 # 3 A 43 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 48 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 77 LYS B 114 LYS^? -2.62 O2 EDO B 124s coo 13.04 30.41 72.50 12.95 30.65 70.36 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 12.77 23.50 68.33 13.58 25.42 68.49 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 7.53 29.84 65.06 12.29 29.41 67.79 1.96 50.52 -5.38 3.03 56.08 -8.37 2acu_c01 source 2acu ALDOSE REDUCTASE (E.C.1.1.1.21) MUTANT WITH TY: 3 hits 2acu_c01 naa= 3 ULMN 3 2bhg_c02 FOOT-AND-MOUTH DISEASE VIRUS 3C PROTuser 1 3 # 1 B 46 HIS A 111 HIS^? 11.74 C2 EDO A 125 B 163 ALA A 33 ALA.? 8.34 O2 EDO A 126 B 182 SER A 55 SER^? 7.70 O ACT A 123 coo 30.42 1.98 4.36 29.07 0.41 4.68 16.68 40.80 13.52 18.19 42.09 12.84 coo 25.72 -4.33 3.52 26.60 -3.24 4.12 17.73 46.03 21.52 16.32 46.64 21.20 coo 24.00 -0.17 2.07 24.51 1.00 0.04 16.48 46.12 15.51 15.38 46.59 17.63 ULMN 3 2bhg_c02 FOOT-AND-MOUTH DISEASE VIRUS 3C PROTuser 2 3 # 2 B 46 HIS A 111 HIS^? 11.74 C2 EDO A 125 B 163 ALA A 33 ALA.? 8.34 O2 EDO A 126 B 182 SER A 57 SER^? 6.85 O2 EDO A 126 coo 30.42 1.98 4.36 29.07 0.41 4.68 16.68 40.80 13.52 18.19 42.09 12.84 coo 25.72 -4.33 3.52 26.60 -3.24 4.12 17.73 46.03 21.52 16.32 46.64 21.20 coo 24.00 -0.17 2.07 24.51 1.00 0.04 15.14 41.83 20.35 16.25 40.17 21.70 2bhg_c02 source 2bhg FOOT-AND-MOUTH DISEASE VIRUS 3C PROTEASE : 2 hits 2bhg_c02 naa= 3 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 150 TYR A 70 TYR^? 13.06 C1 EDO B 124 A 245 ASP A 94 ASP.? 16.52 O ACT A 123 A 273 LYS A 113 LYS^? 12.75 O2 EDO A 124 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 5.72 54.72 4.86 5.42 52.52 3.21 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 2.85 44.85 7.76 1.66 43.09 7.95 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 13.93 45.27 9.54 19.06 43.44 6.58 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 2 3 # 2 A 150 TYR B 70 TYR^? 11.25 O2 EDO B 124 A 245 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 273 LYS B 113 LYS^? 13.71 C2 EDO B 124 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 8.28 55.71 -0.18 8.56 53.06 0.60 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 0.03 48.55 -7.94 -5.29 45.92 -6.26 2gsa_c02 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 2 hits 2gsa_c02 naa= 3 ULMN 3 2hsa_c00 12-OXOPHYTODIENOATE REDUCTASE 3 user 1 3 # 1 B 185 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 188 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 190 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo -2.40 8.56 71.48 -2.16 8.28 69.42 6.89 48.41 3.38 5.73 47.19 2.13 coo -0.71 6.39 65.98 -1.92 4.69 66.21 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 0.03 12.24 67.96 -1.63 12.38 65.68 5.72 54.72 4.86 5.42 52.52 3.21 2hsa_c00 source 2hsa 12-OXOPHYTODIENOATE REDUCTASE 3 : 1 hits 2hsa_c00 naa= 3 ULMN 3 2hsa_c01 12-OXOPHYTODIENOATE REDUCTASE 3 user 1 3 # 1 A 185 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 188 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 190 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 17.28 -0.40 35.65 16.37 -0.39 37.54 6.89 48.41 3.38 5.73 47.19 2.13 coo 14.39 1.55 40.83 12.71 2.07 39.67 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 19.52 -1.97 40.54 17.56 -3.47 41.92 5.72 54.72 4.86 5.42 52.52 3.21 2hsa_c01 source 2hsa 12-OXOPHYTODIENOATE REDUCTASE 3 : 1 hits 2hsa_c01 naa= 3 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 1 3 # 1 A 57 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 102 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 193 GLY A 44 GLY.? 11.35 O1 EDO A 128 coo 14.96 29.22 19.55 15.62 29.93 17.67 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 19.64 30.69 22.61 18.18 29.94 21.25 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 14.54 28.99 9.76 15.06 29.59 10.02 13.50 68.96 1.57 14.29 68.84 1.77 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 2 3 # 2 A 57 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 102 ASP A 94 ASP.? 16.52 O ACT A 123 A 193 GLY B 93 GLY^? 13.55 O1 EDO A 124 coo 14.96 29.22 19.55 15.62 29.93 17.67 6.89 48.41 3.38 5.73 47.19 2.13 coo 19.64 30.69 22.61 18.18 29.94 21.25 2.85 44.85 7.76 1.66 43.09 7.95 coo 14.54 28.99 9.76 15.06 29.59 10.02 8.78 44.49 -3.21 8.81 45.00 -3.81 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 3 3 # 3 A 57 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 102 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 193 GLY B 44 GLY^? 13.85 O2 EDO B 125 coo 14.96 29.22 19.55 15.62 29.93 17.67 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 19.64 30.69 22.61 18.18 29.94 21.25 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 14.54 28.99 9.76 15.06 29.59 10.02 0.61 67.88 8.18 -0.15 67.82 7.90 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 4 3 # 4 A 57 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 102 ASP B 94 ASP^? 10.22 O1 EDO A 124 A 193 GLY A 93 GLY.? 17.43 O ACT A 123 coo 14.96 29.22 19.55 15.62 29.93 17.67 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 19.64 30.69 22.61 18.18 29.94 21.25 11.18 47.39 -6.30 12.32 45.78 -7.12 coo 14.54 28.99 9.76 15.06 29.59 10.02 5.07 43.20 3.81 5.07 43.46 4.54 2lpr_c02 source 2lpr ALPHA-LYTIC PROTEASE : 4 hits 2lpr_c02 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP A 5 ASP.? 11.32 O1 EDO B 123 166 GLY A 51 GLY^? 8.00 C2 EDO A 128 169 GLU A 69 GLU^? 4.98 OXT ACT A 123 coo 8.28 6.87 1.62 10.08 5.77 1.34 20.60 64.37 -9.63 20.20 65.77 -11.14 coo -8.58 13.22 3.21 -8.90 13.15 4.05 16.39 54.43 4.53 15.61 54.28 4.81 coo -16.67 7.89 2.78 -17.65 6.56 1.49 8.76 56.68 10.43 10.20 56.07 11.84 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 # 2 141 ASP A 94 ASP.? 16.52 O ACT A 123 166 GLY A 51 GLY^? 8.00 C2 EDO A 128 169 GLU A 42 GLU^? -4.18 C1 EDO A 128s coo 8.28 6.87 1.62 10.08 5.77 1.34 2.85 44.85 7.76 1.66 43.09 7.95 coo -8.58 13.22 3.21 -8.90 13.15 4.05 16.39 54.43 4.53 15.61 54.28 4.81 coo -16.67 7.89 2.78 -17.65 6.56 1.49 19.47 62.47 4.05 21.30 62.78 5.02 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 # 3 141 ASP B 5 ASP^? 17.31 OXT ACT A 123 166 GLY B 51 GLY^? 7.59 O1 EDO B 124 169 GLU B 69 GLU^? -2.92 O2 EDO B 124s coo 8.28 6.87 1.62 10.08 5.77 1.34 -6.45 59.57 16.94 -6.05 60.31 18.88 coo -8.58 13.22 3.21 -8.90 13.15 4.05 -2.37 55.43 0.00 -1.58 55.37 -0.28 coo -16.67 7.89 2.78 -17.65 6.56 1.49 5.26 59.46 -4.72 3.83 59.41 -6.26 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 # 4 141 ASP B 94 ASP^? 10.22 O1 EDO A 124 166 GLY B 51 GLY^? 7.59 O1 EDO B 124 169 GLU B 42 GLU^? 9.23 O2 EDO B 125 coo 8.28 6.87 1.62 10.08 5.77 1.34 11.18 47.39 -6.30 12.32 45.78 -7.12 coo -8.58 13.22 3.21 -8.90 13.15 4.05 -2.37 55.43 0.00 -1.58 55.37 -0.28 coo -16.67 7.89 2.78 -17.65 6.56 1.49 -4.84 63.10 3.03 -6.17 64.39 2.00 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 4 hits 2tdt_c00 naa= 3 ULMN 3 2tmd_c00 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 A 169 TYR A 70 TYR^? 13.06 C1 EDO B 124 A 172 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 267 ASP A 94 ASP.? 16.52 O ACT A 123 coo 26.78 20.44 0.03 28.51 18.26 0.09 5.72 54.72 4.86 5.42 52.52 3.21 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 6.89 48.41 3.38 5.73 47.19 2.13 coo 33.26 12.70 -5.86 33.92 14.66 -5.47 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 2tmd_c00 TRIMETHYLAMINE DEHYDROGENASE user 2 3 # 2 A 169 TYR B 70 TYR^? 11.25 O2 EDO B 124 A 172 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 267 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 26.78 20.44 0.03 28.51 18.26 0.09 8.28 55.71 -0.18 8.56 53.06 0.60 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 33.26 12.70 -5.86 33.92 14.66 -5.47 11.18 47.39 -6.30 12.32 45.78 -7.12 2tmd_c00 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 2 hits 2tmd_c00 naa= 3 ULMN 3 2tmd_c01 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 B 169 TYR A 70 TYR^? 13.06 C1 EDO B 124 B 172 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 267 ASP A 94 ASP.? 16.52 O ACT A 123 coo 44.86 1.98 33.27 42.75 1.12 31.67 5.72 54.72 4.86 5.42 52.52 3.21 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 6.89 48.41 3.38 5.73 47.19 2.13 coo 36.38 -5.89 31.55 36.22 -4.28 32.93 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 2tmd_c01 TRIMETHYLAMINE DEHYDROGENASE user 2 3 # 2 B 169 TYR B 70 TYR^? 11.25 O2 EDO B 124 B 172 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 267 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 44.86 1.98 33.27 42.75 1.12 31.67 8.28 55.71 -0.18 8.56 53.06 0.60 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 36.38 -5.89 31.55 36.22 -4.28 32.93 11.18 47.39 -6.30 12.32 45.78 -7.12 2tmd_c01 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 2 hits 2tmd_c01 naa= 3 ULMN 3 2tmd_c02 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 A 169 TYR A 70 TYR^? 13.06 C1 EDO B 124 A 172 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 174 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 26.78 20.44 0.03 28.51 18.26 0.09 5.72 54.72 4.86 5.42 52.52 3.21 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 24.73 15.69 1.93 26.72 14.32 3.31 8.28 55.71 -0.18 8.56 53.06 0.60 ULMN 3 2tmd_c02 TRIMETHYLAMINE DEHYDROGENASE user 2 3 # 2 A 169 TYR B 70 TYR^? 11.25 O2 EDO B 124 A 172 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 174 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 26.78 20.44 0.03 28.51 18.26 0.09 8.28 55.71 -0.18 8.56 53.06 0.60 coo 29.39 14.39 -1.75 31.15 15.06 -2.66 6.89 48.41 3.38 5.73 47.19 2.13 coo 24.73 15.69 1.93 26.72 14.32 3.31 5.72 54.72 4.86 5.42 52.52 3.21 2tmd_c02 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 2 hits 2tmd_c02 naa= 3 ULMN 3 2tmd_c03 TRIMETHYLAMINE DEHYDROGENASE user 1 3 # 1 B 169 TYR A 70 TYR^? 13.06 C1 EDO B 124 B 172 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 174 TYR B 70 TYR^? 11.25 O2 EDO B 124 coo 44.86 1.98 33.27 42.75 1.12 31.67 5.72 54.72 4.86 5.42 52.52 3.21 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 45.95 0.11 28.25 43.87 0.82 26.55 8.28 55.71 -0.18 8.56 53.06 0.60 ULMN 3 2tmd_c03 TRIMETHYLAMINE DEHYDROGENASE user 2 3 # 2 B 169 TYR B 70 TYR^? 11.25 O2 EDO B 124 B 172 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 174 TYR A 70 TYR^? 13.06 C1 EDO B 124 coo 44.86 1.98 33.27 42.75 1.12 31.67 8.28 55.71 -0.18 8.56 53.06 0.60 coo 40.83 -2.48 29.90 39.16 -2.39 31.17 6.89 48.41 3.38 5.73 47.19 2.13 coo 45.95 0.11 28.25 43.87 0.82 26.55 5.72 54.72 4.86 5.42 52.52 3.21 2tmd_c03 source 2tmd TRIMETHYLAMINE DEHYDROGENASE : 2 hits 2tmd_c03 naa= 3 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 1 3 # 1 18 ARG A 8 ARG.? -3.85 O1 EDO B 123s 195 HIS A 4 HIS.? 6.54 O1 EDO A 128 199 ASP A 5 ASP.? 11.32 O1 EDO B 123 coo 21.96 2.03 15.24 19.33 1.86 13.55 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 20.60 64.37 -9.63 20.20 65.77 -11.14 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 2 3 # 2 18 ARG B 8 ARG^? 17.13 OXT ACT A 123 195 HIS B 4 HIS^? 16.30 OXT ACT A 123 199 ASP B 5 ASP^? 17.31 OXT ACT A 123 coo 21.96 2.03 15.24 19.33 1.86 13.55 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 -6.45 59.57 16.94 -6.05 60.31 18.88 3cla_c00 source 3cla TYPE III CHLORAMPHENICOL ACETYLTRANSFERASE ( C: 2 hits 3cla_c00 naa= 3 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 # 1 A 158 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 161 ARG A 8 ARG.? -3.85 O1 EDO B 123s A 186 HIS A 4 HIS.? 6.54 O1 EDO A 128 coo 18.62 26.83 58.17 18.48 28.64 57.08 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 23.76 27.69 57.88 24.05 29.81 55.69 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 16.67 31.22 54.64 18.74 31.15 54.14 18.39 63.32 -4.14 17.16 64.86 -3.40 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 2 3 # 2 A 158 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 161 ARG B 8 ARG^? 17.13 OXT ACT A 123 A 186 HIS B 4 HIS^? 16.30 OXT ACT A 123 coo 18.62 26.83 58.17 18.48 28.64 57.08 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 23.76 27.69 57.88 24.05 29.81 55.69 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 16.67 31.22 54.64 18.74 31.15 54.14 -4.28 60.61 11.46 -3.09 62.30 11.15 4mdh_c02 source 4mdh CYTOPLASMIC MALATE DEHYDROGENASE (E.C.1.1.1.37: 2 hits 4mdh_c02 naa= 3 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 # 1 B 158 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 161 ARG A 8 ARG.? -3.85 O1 EDO B 123s B 186 HIS A 4 HIS.? 6.54 O1 EDO A 128 coo 44.53 16.44 28.54 44.89 18.45 28.77 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 39.64 19.27 28.15 40.19 21.74 29.94 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 48.32 20.00 31.44 46.45 20.91 31.50 18.39 63.32 -4.14 17.16 64.86 -3.40 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 2 3 # 2 B 158 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 161 ARG B 8 ARG^? 17.13 OXT ACT A 123 B 186 HIS B 4 HIS^? 16.30 OXT ACT A 123 coo 44.53 16.44 28.54 44.89 18.45 28.77 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 39.64 19.27 28.15 40.19 21.74 29.94 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 48.32 20.00 31.44 46.45 20.91 31.50 -4.28 60.61 11.46 -3.09 62.30 11.15 4mdh_c03 source 4mdh CYTOPLASMIC MALATE DEHYDROGENASE (E.C.1.1.1.37: 2 hits 4mdh_c03 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 19 ASN.? 11.41 C2 EDO A 128 coo 5.80 63.03 55.85 5.52 65.03 56.45 28.99 52.34 5.62 30.38 53.45 6.78 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 63 ASN.? 9.31 CH3 ACT A 123 coo 5.80 63.03 55.85 5.52 65.03 56.45 8.51 60.27 21.48 7.48 62.07 21.93 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN B 19 ASN^? 16.17 O1 EDO B 124 coo 5.80 63.03 55.85 5.52 65.03 56.45 -15.03 53.79 -2.23 -16.32 55.34 -2.93 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN B 63 ASN^? 10.45 C1 EDO B 125 coo 5.80 63.03 55.85 5.52 65.03 56.45 5.72 66.69 -14.07 6.70 68.56 -13.76 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 4 hits 1kbk_p00 naa= 1 ULMN 4 2g3n_p00 ALPHA-GLUCOSIDASE user 1 4 # 1 A 87 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 184 TYR B 70 TYR^? 11.25 O2 EDO B 124 A 400 ARG A 11 ARG^? -8.10 O1 EDO A 124s A 416 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo -0.32 21.89 76.95 -2.29 21.43 77.55 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -13.84 24.02 81.30 -13.39 23.42 78.61 8.28 55.71 -0.18 8.56 53.06 0.60 coo -2.45 25.99 82.19 -2.93 24.57 79.52 16.32 51.23 -8.65 14.73 48.69 -9.52 coo -5.39 20.15 83.91 -5.94 21.73 82.59 11.18 47.39 -6.30 12.32 45.78 -7.12 ULMN 4 2g3n_p00 ALPHA-GLUCOSIDASE user 2 4 # 2 A 87 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 184 TYR A 70 TYR^? 13.06 C1 EDO B 124 A 400 ARG B 11 ARG^? 15.69 O ACT A 123 A 416 ASP A 94 ASP.? 16.52 O ACT A 123 coo -0.32 21.89 76.95 -2.29 21.43 77.55 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -13.84 24.02 81.30 -13.39 23.42 78.61 5.72 54.72 4.86 5.42 52.52 3.21 coo -2.45 25.99 82.19 -2.93 24.57 79.52 -2.30 47.71 11.46 -0.79 44.99 11.29 coo -5.39 20.15 83.91 -5.94 21.73 82.59 2.85 44.85 7.76 1.66 43.09 7.95 2g3n_p00 source 2g3n ALPHA-GLUCOSIDASE : 2 hits 2g3n_p00 naa= 4 ULMN 3 2p3i_p00 VP4 user 1 3 # 1 A 101 ARG A 8 ARG.? -3.85 O1 EDO B 123s A 188 TYR B 102 TYR^? 11.19 O2 EDO B 124 A 190 SER A 7 SER.? 11.72 O1 EDO B 123 coo 37.69 7.64 13.51 38.82 8.84 16.11 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 47.14 12.10 13.73 48.75 12.33 16.01 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 43.77 6.93 15.46 45.49 7.21 17.11 16.55 63.58 -12.78 16.44 65.52 -14.23 ULMN 3 2p3i_p00 VP4 user 2 3 # 2 A 101 ARG A 27 ARG.? 5.17 CH3 ACT A 123 A 188 TYR A 102 TYR^? 8.02 OXT ACT A 123 A 190 SER A 62 SER.? -2.76 OXT ACT A 123s coo 37.69 7.64 13.51 38.82 8.84 16.11 10.94 57.70 24.22 11.90 58.81 21.49 coo 47.14 12.10 13.73 48.75 12.33 16.01 2.53 56.58 17.48 2.05 53.90 18.03 coo 43.77 6.93 15.46 45.49 7.21 17.11 8.49 55.74 20.24 8.16 54.20 18.38 ULMN 3 2p3i_p00 VP4 user 3 3 # 3 A 101 ARG B 8 ARG^? 17.13 OXT ACT A 123 A 188 TYR A 102 TYR^? 8.02 OXT ACT A 123 A 190 SER B 7 SER^? 13.90 OXT ACT A 123 coo 37.69 7.64 13.51 38.82 8.84 16.11 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 47.14 12.10 13.73 48.75 12.33 16.01 2.53 56.58 17.48 2.05 53.90 18.03 coo 43.77 6.93 15.46 45.49 7.21 17.11 -2.26 57.69 19.56 -2.09 59.00 21.60 ULMN 3 2p3i_p00 VP4 user 4 3 # 4 A 101 ARG B 27 ARG^? 11.58 C1 EDO B 125 A 188 TYR B 102 TYR^? 11.19 O2 EDO B 124 A 190 SER B 62 SER^? 7.18 O2 EDO B 124 coo 37.69 7.64 13.51 38.82 8.84 16.11 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 47.14 12.10 13.73 48.75 12.33 16.01 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 43.77 6.93 15.46 45.49 7.21 17.11 5.78 62.05 -14.51 6.16 59.94 -13.32 2p3i_p00 source 2p3i VP4 : 4 hits 2p3i_p00 naa= 3 ULMN 3 1b01_d00 GENE REGULATION/DNA user 1 3 # 1 B 4 ARG A 36 ARG^? -3.17 O2 EDO A 125s B 6 THR A 37 THR^? 8.48 O2 EDO A 127 B 8 THR A 39 THR^? -4.70 C2 EDO A 128s coo 40.52 16.08 100.90 37.97 16.41 102.60 24.38 48.23 13.15 25.39 47.42 15.97 coo 36.11 13.64 95.03 34.54 14.86 95.91 20.51 52.18 10.07 20.06 53.78 11.46 coo 32.72 8.05 92.39 31.25 9.11 91.35 20.17 56.36 5.00 20.21 58.43 5.73 ULMN 3 1b01_d00 GENE REGULATION/DNA user 2 3 # 2 B 4 ARG A 105 ARG^? 7.37 O1 EDO A 126 B 6 THR A 103 THR^? 10.25 OXT ACT A 123 B 8 THR A 64 THR.? 6.35 OXT ACT A 123 coo 40.52 16.08 100.90 37.97 16.41 102.60 5.55 48.74 25.05 2.82 47.97 26.30 coo 36.11 13.64 95.03 34.54 14.86 95.91 3.98 57.48 21.66 3.28 59.10 22.89 coo 32.72 8.05 92.39 31.25 9.11 91.35 7.24 60.99 16.88 6.03 59.56 15.82 ULMN 3 1b01_d00 GENE REGULATION/DNA user 3 3 # 3 B 4 ARG B 36 ARG^? 14.13 O1 EDO B 124 B 6 THR B 37 THR^? 4.69 O1 EDO B 124 B 8 THR B 39 THR^? 8.09 O1 EDO B 124 coo 40.52 16.08 100.90 37.97 16.41 102.60 -10.17 52.84 -10.41 -11.23 53.10 -13.33 coo 36.11 13.64 95.03 34.54 14.86 95.91 -6.36 55.52 -6.05 -5.05 57.25 -6.15 coo 32.72 8.05 92.39 31.25 9.11 91.35 -6.15 57.47 0.15 -6.22 59.63 0.17 ULMN 3 1b01_d00 GENE REGULATION/DNA user 4 3 # 4 B 4 ARG B 105 ARG^? 8.10 C1 PEG B 126 B 6 THR B 103 THR^? 13.94 C1 EDO B 125 B 8 THR B 64 THR^? 7.68 C1 EDO B 125 coo 40.52 16.08 100.90 37.97 16.41 102.60 8.93 56.93 -21.13 11.75 56.76 -22.27 coo 36.11 13.64 95.03 34.54 14.86 95.91 10.26 64.09 -15.02 10.94 66.08 -15.56 coo 32.72 8.05 92.39 31.25 9.11 91.35 6.89 65.75 -9.40 8.01 63.98 -8.88 1b01_d00 source 1b01 GENE REGULATION/DNA : 4 hits 1b01_d00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 67 TYR^? -4.09 C2 EDO A 127s I 306 VAL A 118 VAL^? 4.92 O2 EDO A 127 I 308 VAL A 48 VAL^? 9.60 O2 EDO A 127 coo 26.18 35.24 6.87 24.33 35.18 8.97 9.19 62.70 13.11 10.16 60.66 14.79 coo 23.55 29.53 9.81 23.15 27.39 10.24 10.24 60.43 7.70 11.28 60.39 9.69 coo 16.43 30.18 9.35 15.05 30.67 11.01 12.78 64.45 4.67 11.37 64.32 3.00 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 2 3 # 2 I 303 TYR A 70 TYR^? 13.06 C1 EDO B 124 I 306 VAL A 118 VAL^? 4.92 O2 EDO A 127 I 308 VAL A 48 VAL^? 9.60 O2 EDO A 127 coo 26.18 35.24 6.87 24.33 35.18 8.97 5.72 54.72 4.86 5.42 52.52 3.21 coo 23.55 29.53 9.81 23.15 27.39 10.24 10.24 60.43 7.70 11.28 60.39 9.69 coo 16.43 30.18 9.35 15.05 30.67 11.01 12.78 64.45 4.67 11.37 64.32 3.00 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 3 3 # 3 I 303 TYR A 116 TYR^? 6.05 O2 EDO A 127 I 306 VAL A 38 VAL^? 7.98 C2 EDO A 128 I 308 VAL A 21 VAL^? 8.71 O1 EDO A 125 coo 26.18 35.24 6.87 24.33 35.18 8.97 13.42 55.06 8.10 16.05 56.03 7.83 coo 23.55 29.53 9.81 23.15 27.39 10.24 21.46 53.10 6.50 22.60 51.84 5.16 coo 16.43 30.18 9.35 15.05 30.67 11.01 25.28 53.39 11.70 25.21 55.55 11.66 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 4 3 # 4 I 303 TYR A 116 TYR^? 6.05 O2 EDO A 127 I 306 VAL A 118 VAL^? 4.92 O2 EDO A 127 I 308 VAL A 48 VAL^? 9.60 O2 EDO A 127 coo 26.18 35.24 6.87 24.33 35.18 8.97 13.42 55.06 8.10 16.05 56.03 7.83 coo 23.55 29.53 9.81 23.15 27.39 10.24 10.24 60.43 7.70 11.28 60.39 9.69 coo 16.43 30.18 9.35 15.05 30.67 11.01 12.78 64.45 4.67 11.37 64.32 3.00 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 5 3 # 5 I 303 TYR B 67 TYR^? -3.57 C1 EDO B 125s I 306 VAL B 118 VAL^? -4.64 O2 EDO B 125s I 308 VAL B 48 VAL^? 9.35 O2 EDO B 125 coo 26.18 35.24 6.87 24.33 35.18 8.97 4.90 65.99 -5.12 3.99 64.76 -7.44 coo 23.55 29.53 9.81 23.15 27.39 10.24 3.98 62.01 -0.76 2.96 62.67 -2.65 coo 16.43 30.18 9.35 15.05 30.67 11.01 1.49 64.58 3.59 2.86 63.63 4.99 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 6 3 # 6 I 303 TYR B 70 TYR^? 11.25 O2 EDO B 124 I 306 VAL B 118 VAL^? -4.64 O2 EDO B 125s I 308 VAL B 48 VAL^? 9.35 O2 EDO B 125 coo 26.18 35.24 6.87 24.33 35.18 8.97 8.28 55.71 -0.18 8.56 53.06 0.60 coo 23.55 29.53 9.81 23.15 27.39 10.24 3.98 62.01 -0.76 2.96 62.67 -2.65 coo 16.43 30.18 9.35 15.05 30.67 11.01 1.49 64.58 3.59 2.86 63.63 4.99 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 7 3 # 7 I 303 TYR B 116 TYR^? 3.94 O1 EDO B 124 I 306 VAL B 38 VAL^? 9.81 O1 EDO B 124 I 308 VAL B 21 VAL^? 10.12 O1 EDO B 124 coo 26.18 35.24 6.87 24.33 35.18 8.97 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo 23.55 29.53 9.81 23.15 27.39 10.24 -7.41 54.92 -2.44 -8.61 53.21 -1.77 coo 16.43 30.18 9.35 15.05 30.67 11.01 -11.10 57.25 -7.26 -11.04 59.24 -6.44 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 8 3 # 8 I 303 TYR B 116 TYR^? 3.94 O1 EDO B 124 I 306 VAL B 118 VAL^? -4.64 O2 EDO B 125s I 308 VAL B 48 VAL^? 9.35 O2 EDO B 125 coo 26.18 35.24 6.87 24.33 35.18 8.97 0.65 57.23 -3.12 -1.98 58.01 -2.52 coo 23.55 29.53 9.81 23.15 27.39 10.24 3.98 62.01 -0.76 2.96 62.67 -2.65 coo 16.43 30.18 9.35 15.05 30.67 11.01 1.49 64.58 3.59 2.86 63.63 4.99 1cqt_d00 source 1cqt GENE REGULATION/DNA : 8 hits 1cqt_d00 naa= 3 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 1 3 # 1 A 40 LYS A 113 LYS^? 12.75 O2 EDO A 124 A 41 LYS A 114 LYS^? 4.03 O ACT A 123 A 42 ILE A 73 ILE^? 11.53 O ACT A 123 coo 36.07 63.73 124.22 32.72 60.75 122.39 13.93 45.27 9.54 19.06 43.44 6.58 coo 38.49 66.12 125.64 35.69 66.71 131.25 11.95 48.07 7.92 11.03 52.28 12.68 coo 41.08 63.27 123.17 40.13 62.43 122.44 7.64 44.96 8.49 8.31 45.31 9.70 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 2 3 # 2 A 40 LYS A 113 LYS^? 12.75 O2 EDO A 124 A 41 LYS A 114 LYS^? 4.03 O ACT A 123 A 42 ILE A 74 ILE^? 13.23 O1 EDO A 124 coo 36.07 63.73 124.22 32.72 60.75 122.39 13.93 45.27 9.54 19.06 43.44 6.58 coo 38.49 66.12 125.64 35.69 66.71 131.25 11.95 48.07 7.92 11.03 52.28 12.68 coo 41.08 63.27 123.17 40.13 62.43 122.44 11.84 44.77 4.28 12.65 45.97 3.96 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 3 3 # 3 A 40 LYS A 114 LYS^? 4.03 O ACT A 123 A 41 LYS A 113 LYS^? 12.75 O2 EDO A 124 A 42 ILE A 73 ILE^? 11.53 O ACT A 123 coo 36.07 63.73 124.22 32.72 60.75 122.39 11.95 48.07 7.92 11.03 52.28 12.68 coo 38.49 66.12 125.64 35.69 66.71 131.25 13.93 45.27 9.54 19.06 43.44 6.58 coo 41.08 63.27 123.17 40.13 62.43 122.44 7.64 44.96 8.49 8.31 45.31 9.70 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 4 3 # 4 A 40 LYS A 114 LYS^? 4.03 O ACT A 123 A 41 LYS A 113 LYS^? 12.75 O2 EDO A 124 A 42 ILE A 74 ILE^? 13.23 O1 EDO A 124 coo 36.07 63.73 124.22 32.72 60.75 122.39 11.95 48.07 7.92 11.03 52.28 12.68 coo 38.49 66.12 125.64 35.69 66.71 131.25 13.93 45.27 9.54 19.06 43.44 6.58 coo 41.08 63.27 123.17 40.13 62.43 122.44 11.84 44.77 4.28 12.65 45.97 3.96 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 5 3 # 5 A 40 LYS B 113 LYS^? 13.71 C2 EDO B 124 A 41 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 42 ILE B 73 ILE^? 11.04 O2 EDO B 124 coo 36.07 63.73 124.22 32.72 60.75 122.39 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 38.49 66.12 125.64 35.69 66.71 131.25 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 41.08 63.27 123.17 40.13 62.43 122.44 6.31 47.76 -6.93 5.67 48.52 -8.00 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 6 3 # 6 A 40 LYS B 113 LYS^? 13.71 C2 EDO B 124 A 41 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 42 ILE B 74 ILE^? 12.52 C2 EDO B 124 coo 36.07 63.73 124.22 32.72 60.75 122.39 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 38.49 66.12 125.64 35.69 66.71 131.25 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 41.08 63.27 123.17 40.13 62.43 122.44 2.10 46.21 -3.15 1.28 47.20 -2.43 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 7 3 # 7 A 40 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 41 LYS B 113 LYS^? 13.71 C2 EDO B 124 A 42 ILE B 73 ILE^? 11.04 O2 EDO B 124 coo 36.07 63.73 124.22 32.72 60.75 122.39 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 38.49 66.12 125.64 35.69 66.71 131.25 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 41.08 63.27 123.17 40.13 62.43 122.44 6.31 47.76 -6.93 5.67 48.52 -8.00 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 8 3 # 8 A 40 LYS B 114 LYS^? -2.62 O2 EDO B 124s A 41 LYS B 113 LYS^? 13.71 C2 EDO B 124 A 42 ILE B 74 ILE^? 12.52 C2 EDO B 124 coo 36.07 63.73 124.22 32.72 60.75 122.39 1.96 50.52 -5.38 3.03 56.08 -8.37 coo 38.49 66.12 125.64 35.69 66.71 131.25 0.03 48.55 -7.94 -5.29 45.92 -6.26 coo 41.08 63.27 123.17 40.13 62.43 122.44 2.10 46.21 -3.15 1.28 47.20 -2.43 1pyi_d00 source 1pyi PROTEIN (PYRIMIDINE PATHWAY REGULATOR 1) : 8 hits 1pyi_d00 naa= 3 ULMN 3 1r4i_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 563 LYS A 91 LYS^? 18.66 O2 EDO A 126 A 564 VAL A 90 VAL^? 12.33 O ACT A 123 A 568 ARG B 11 ARG^? 15.69 O ACT A 123 coo -6.60 80.79 55.64 -8.55 79.48 61.01 5.43 41.25 9.74 2.02 38.13 6.82 coo -9.25 78.14 55.31 -11.11 77.94 56.39 3.43 43.59 12.02 4.00 45.65 12.60 coo -12.31 74.86 52.32 -13.99 74.91 54.92 -2.30 47.71 11.46 -0.79 44.99 11.29 ULMN 3 1r4i_d00 TRANSCRIPTION/DNA user 2 3 # 2 A 563 LYS B 91 LYS^? 13.69 O1 EDO A 124 A 564 VAL B 90 VAL^? 12.13 O1 EDO A 124 A 568 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo -6.60 80.79 55.64 -8.55 79.48 61.01 8.58 44.72 -9.41 12.21 41.02 -7.65 coo -9.25 78.14 55.31 -11.11 77.94 56.39 10.54 47.65 -10.75 10.04 49.82 -10.56 coo -12.31 74.86 52.32 -13.99 74.91 54.92 16.32 51.23 -8.65 14.73 48.69 -9.52 1r4i_d00 source 1r4i TRANSCRIPTION/DNA : 2 hits 1r4i_d00 naa= 3 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 B 34 SER A 62 SER.? -2.76 OXT ACT A 123s B 37 ASN A 63 ASN.? 9.31 CH3 ACT A 123 B 45 THR A 119 THR^? 10.48 O2 EDO A 127 coo -19.49 41.97 71.08 -17.37 40.80 71.17 8.49 55.74 20.24 8.16 54.20 18.38 coo -23.05 39.62 69.74 -22.86 39.59 67.61 8.51 60.27 21.48 7.48 62.07 21.93 coo -30.87 34.84 80.57 -28.94 34.51 81.49 8.91 63.93 7.06 7.12 64.47 5.90 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 B 34 SER B 62 SER^? 7.18 O2 EDO B 124 B 37 ASN B 63 ASN^? 10.45 C1 EDO B 125 B 45 THR B 119 THR^? 9.92 O2 EDO B 125 coo -19.49 41.97 71.08 -17.37 40.80 71.17 5.78 62.05 -14.51 6.16 59.94 -13.32 coo -23.05 39.62 69.74 -22.86 39.59 67.61 5.72 66.69 -14.07 6.70 68.56 -13.76 coo -30.87 34.84 80.57 -28.94 34.51 81.49 5.45 65.01 1.07 7.18 64.15 1.99 2z3x_d00 source 2z3x DNA BINDING PROTEIN/DNA : 2 hits 2z3x_d00 naa= 3 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 G 386 ARG A 36 ARG^? -3.17 O2 EDO A 125s G 387 HIS A 111 HIS^? 11.74 C2 EDO A 125 G 390 SER A 55 SER^? 7.70 O ACT A 123 coo 93.17 52.97 31.81 95.66 54.71 32.14 24.38 48.23 13.15 25.39 47.42 15.97 coo 95.60 53.07 40.31 97.10 52.52 41.67 16.68 40.80 13.52 18.19 42.09 12.84 coo 93.25 46.91 38.79 94.12 47.43 36.62 16.48 46.12 15.51 15.38 46.59 17.63 3qrf_d00 source 3qrf DNA BINDING PROTEIN/DNA : 1 hits 3qrf_d00 naa= 3 ULMN 3 3s57_d00 OXIDOREDUCTASE/DNA user 1 3 # 1 A 101 VAL A 10 VAL^? 6.77 C1 EDO A 124 A 102 PHE A 41 PHE^? 6.84 C1 EDO A 128 A 169 CYH B 71 CYH^? 5.39 O2 EDO B 124 coo -0.48 2.03 12.21 0.64 0.32 12.97 16.57 56.93 -6.02 17.13 58.33 -4.45 coo 0.51 5.20 15.97 0.26 4.09 18.50 15.76 60.60 -0.51 14.59 62.89 -1.66 coo 4.56 -7.03 18.26 5.32 -4.76 16.88 6.71 54.39 -4.07 6.30 55.99 -6.30 ULMN 3 3s57_d00 OXIDOREDUCTASE/DNA user 2 3 # 2 A 101 VAL B 10 VAL^? 14.37 OXT ACT A 123 A 102 PHE B 41 PHE^? 12.86 O2 EDO B 125 A 169 CYH A 71 CYH^? 6.77 OXT ACT A 123 coo -0.48 2.03 12.21 0.64 0.32 12.97 -2.45 53.88 10.93 -3.01 55.76 9.98 coo 0.51 5.20 15.97 0.26 4.09 18.50 -1.73 59.31 6.86 -0.60 60.93 8.76 coo 4.56 -7.03 18.26 5.32 -4.76 16.88 7.28 52.14 8.02 7.72 52.85 10.71 ULMN 3 3s57_d00 OXIDOREDUCTASE/DNA user 3 3 # 3 A 101 VAL B 48 VAL^? 9.35 O2 EDO B 125 A 102 PHE B 41 PHE^? 12.86 O2 EDO B 125 A 169 CYH B 71 CYH^? 5.39 O2 EDO B 124 coo -0.48 2.03 12.21 0.64 0.32 12.97 1.49 64.58 3.59 2.86 63.63 4.99 coo 0.51 5.20 15.97 0.26 4.09 18.50 -1.73 59.31 6.86 -0.60 60.93 8.76 coo 4.56 -7.03 18.26 5.32 -4.76 16.88 6.71 54.39 -4.07 6.30 55.99 -6.30 3s57_d00 source 3s57 OXIDOREDUCTASE/DNA : 3 hits 3s57_d00 naa= 3 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 A 21 GLN A 61 GLN^? 9.36 CH3 ACT A 123 A 41 TYR A 102 TYR^? 8.02 OXT ACT A 123 A 43 ASN A 63 ASN.? 9.31 CH3 ACT A 123 coo 22.03 6.35 12.16 20.71 6.08 10.54 7.22 54.92 24.39 6.58 56.14 26.02 coo 18.67 0.21 9.03 16.70 -1.66 8.55 2.53 56.58 17.48 2.05 53.90 18.03 coo 14.90 7.30 8.78 14.25 8.14 6.97 8.51 60.27 21.48 7.48 62.07 21.93 ULMN 3 3ssc_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 A 21 GLN B 61 GLN^? 13.56 C2 PEG B 126 A 41 TYR B 102 TYR^? 11.19 O2 EDO B 124 A 43 ASN B 63 ASN^? 10.45 C1 EDO B 125 coo 22.03 6.35 12.16 20.71 6.08 10.54 7.29 62.74 -18.68 8.17 64.12 -20.04 coo 18.67 0.21 9.03 16.70 -1.66 8.55 11.57 61.77 -11.34 12.14 59.44 -12.79 coo 14.90 7.30 8.78 14.25 8.14 6.97 5.72 66.69 -14.07 6.70 68.56 -13.76 3ssc_d00 source 3ssc DNA BINDING PROTEIN/DNA : 2 hits 3ssc_d00 naa= 3 ULMN 3 4hn5_d00 TRANSCRIPTION/DNA user 1 3 # 1 B 442 LYS A 91 LYS^? 18.66 O2 EDO A 126 B 443 VAL A 90 VAL^? 12.33 O ACT A 123 B 447 ARG B 11 ARG^? 15.69 O ACT A 123 coo -11.49 8.72 29.13 -11.20 3.78 25.16 5.43 41.25 9.74 2.02 38.13 6.82 coo -11.96 6.22 31.96 -10.74 4.61 32.81 3.43 43.59 12.02 4.00 45.65 12.60 coo -14.58 4.58 36.41 -12.11 2.82 36.84 -2.30 47.71 11.46 -0.79 44.99 11.29 ULMN 3 4hn5_d00 TRANSCRIPTION/DNA user 2 3 # 2 B 442 LYS B 91 LYS^? 13.69 O1 EDO A 124 B 443 VAL B 90 VAL^? 12.13 O1 EDO A 124 B 447 ARG A 11 ARG^? -8.10 O1 EDO A 124s coo -11.49 8.72 29.13 -11.20 3.78 25.16 8.58 44.72 -9.41 12.21 41.02 -7.65 coo -11.96 6.22 31.96 -10.74 4.61 32.81 10.54 47.65 -10.75 10.04 49.82 -10.56 coo -14.58 4.58 36.41 -12.11 2.82 36.84 16.32 51.23 -8.65 14.73 48.69 -9.52 4hn5_d00 source 4hn5 TRANSCRIPTION/DNA : 2 hits 4hn5_d00 naa= 3 ULMN 3 1ukf_o00 AVIRULENCE PROTEIN AVRPPH3 user 1 3 # 1 A 98 CYH A 71 CYH^? 6.77 OXT ACT A 123 A 212 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 227 ASP A 94 ASP.? 16.52 O ACT A 123 coo 32.24 40.70 41.87 34.94 39.83 42.22 7.28 52.14 8.02 7.72 52.85 10.71 coo 35.63 37.64 46.24 33.55 37.41 46.24 6.89 48.41 3.38 5.73 47.19 2.13 coo 30.05 37.79 50.12 31.66 36.75 49.22 2.85 44.85 7.76 1.66 43.09 7.95 ULMN 3 1ukf_o00 AVIRULENCE PROTEIN AVRPPH3 user 2 3 # 2 A 98 CYH B 71 CYH^? 5.39 O2 EDO B 124 A 212 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 227 ASP B 94 ASP^? 10.22 O1 EDO A 124 coo 32.24 40.70 41.87 34.94 39.83 42.22 6.71 54.39 -4.07 6.30 55.99 -6.30 coo 35.63 37.64 46.24 33.55 37.41 46.24 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 30.05 37.79 50.12 31.66 36.75 49.22 11.18 47.39 -6.30 12.32 45.78 -7.12 1ukf_o00 source 1UKF AVIRULENCE PROTEIN AVRPPH3 : 2 hits 1ukf_o00 naa= 3 ULMN 3 2odj_o00 PORIN D user 1 3 # 1 A 156 HIS A 4 HIS.? 6.54 O1 EDO A 128 A 208 ASP B 84 ASP^? 4.63 O1 EDO B 123 A 296 SER B 26 SER^? 9.16 C1 EDO B 125 coo 12.72 17.48 24.71 12.80 19.37 23.81 18.39 63.32 -4.14 17.16 64.86 -3.40 coo 18.47 29.19 29.68 19.30 29.17 27.75 20.02 60.63 -18.97 20.31 59.23 -17.40 coo 6.89 17.22 46.63 5.08 16.21 47.91 -1.61 64.24 -17.01 -1.53 65.09 -14.75 ULMN 3 2odj_o00 PORIN D user 2 3 # 2 A 156 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 208 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 296 SER B 62 SER^? 7.18 O2 EDO B 124 coo 12.72 17.48 24.71 12.80 19.37 23.81 6.89 48.41 3.38 5.73 47.19 2.13 coo 18.47 29.19 29.68 19.30 29.17 27.75 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 6.89 17.22 46.63 5.08 16.21 47.91 5.78 62.05 -14.51 6.16 59.94 -13.32 ULMN 3 2odj_o00 PORIN D user 3 3 # 3 A 156 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 208 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 296 SER B 57 SER^? 6.28 O4 PEG B 126 coo 12.72 17.48 24.71 12.80 19.37 23.81 6.89 48.41 3.38 5.73 47.19 2.13 coo 18.47 29.19 29.68 19.30 29.17 27.75 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 6.89 17.22 46.63 5.08 16.21 47.91 -1.05 49.09 -19.26 -2.38 47.97 -20.95 ULMN 3 2odj_o00 PORIN D user 4 3 # 4 A 156 HIS A 72 HIS^? 15.66 C2 EDO B 124 A 208 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 296 SER B 62 SER^? 7.18 O2 EDO B 124 coo 12.72 17.48 24.71 12.80 19.37 23.81 6.89 48.41 3.38 5.73 47.19 2.13 coo 18.47 29.19 29.68 19.30 29.17 27.75 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 6.89 17.22 46.63 5.08 16.21 47.91 5.78 62.05 -14.51 6.16 59.94 -13.32 ULMN 3 2odj_o00 PORIN D user 5 3 # 5 A 156 HIS A 88 HIS^? 13.90 OXT ACT A 123 A 208 ASP A 109 ASP^? -4.58 O2 EDO A 126s A 296 SER A 50 SER^? 9.40 C1 EDO A 128 coo 12.72 17.48 24.71 12.80 19.37 23.81 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 18.47 29.19 29.68 19.30 29.17 27.75 9.63 38.15 19.81 7.90 38.49 20.93 coo 6.89 17.22 46.63 5.08 16.21 47.91 14.41 57.62 4.09 13.08 56.25 2.54 ULMN 3 2odj_o00 PORIN D user 6 3 # 6 A 156 HIS A 88 HIS^? 13.90 OXT ACT A 123 A 208 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 296 SER A 26 SER.? 6.11 CH3 ACT A 123 coo 12.72 17.48 24.71 12.80 19.37 23.81 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 18.47 29.19 29.68 19.30 29.17 27.75 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 6.89 17.22 46.63 5.08 16.21 47.91 16.53 56.39 23.63 15.06 57.90 22.49 ULMN 3 2odj_o00 PORIN D user 7 3 # 7 A 156 HIS A 88 HIS^? 13.90 OXT ACT A 123 A 208 ASP B 5 ASP^? 17.31 OXT ACT A 123 A 296 SER A 50 SER^? 9.40 C1 EDO A 128 coo 12.72 17.48 24.71 12.80 19.37 23.81 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 18.47 29.19 29.68 19.30 29.17 27.75 -6.45 59.57 16.94 -6.05 60.31 18.88 coo 6.89 17.22 46.63 5.08 16.21 47.91 14.41 57.62 4.09 13.08 56.25 2.54 ULMN 3 2odj_o00 PORIN D user 8 3 # 8 A 156 HIS A 88 HIS^? 13.90 OXT ACT A 123 A 208 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 296 SER A 50 SER^? 9.40 C1 EDO A 128 coo 12.72 17.48 24.71 12.80 19.37 23.81 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 18.47 29.19 29.68 19.30 29.17 27.75 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 6.89 17.22 46.63 5.08 16.21 47.91 14.41 57.62 4.09 13.08 56.25 2.54 ULMN 3 2odj_o00 PORIN D user 9 3 # 9 A 156 HIS B 4 HIS^? 16.30 OXT ACT A 123 A 208 ASP A 84 ASP.? 16.56 O1 EDO A 126 A 296 SER A 26 SER.? 6.11 CH3 ACT A 123 coo 12.72 17.48 24.71 12.80 19.37 23.81 -4.28 60.61 11.46 -3.09 62.30 11.15 coo 18.47 29.19 29.68 19.30 29.17 27.75 -5.66 53.01 24.37 -6.07 52.23 22.45 coo 6.89 17.22 46.63 5.08 16.21 47.91 16.53 56.39 23.63 15.06 57.90 22.49 ULMN 3 2odj_o00 PORIN D user 10 3 # 10 A 156 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 208 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 296 SER A 57 SER^? 6.85 O2 EDO A 126 coo 12.72 17.48 24.71 12.80 19.37 23.81 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 18.47 29.19 29.68 19.30 29.17 27.75 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 6.89 17.22 46.63 5.08 16.21 47.91 15.14 41.83 20.35 16.25 40.17 21.70 ULMN 3 2odj_o00 PORIN D user 11 3 # 11 A 156 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 208 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 296 SER A 62 SER.? -2.76 OXT ACT A 123s coo 12.72 17.48 24.71 12.80 19.37 23.81 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 18.47 29.19 29.68 19.30 29.17 27.75 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 6.89 17.22 46.63 5.08 16.21 47.91 8.49 55.74 20.24 8.16 54.20 18.38 ULMN 3 2odj_o00 PORIN D user 12 3 # 12 A 156 HIS B 72 HIS^? 13.54 O1 EDO A 124 A 208 ASP B 13 ASP^? 17.03 O1 EDO B 124 A 296 SER A 62 SER.? -2.76 OXT ACT A 123s coo 12.72 17.48 24.71 12.80 19.37 23.81 7.05 49.23 -1.00 8.21 47.66 -0.22 coo 18.47 29.19 29.68 19.30 29.17 27.75 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 6.89 17.22 46.63 5.08 16.21 47.91 8.49 55.74 20.24 8.16 54.20 18.38 ULMN 3 2odj_o00 PORIN D user 13 3 # 13 A 156 HIS B 88 HIS^? 7.16 O1 EDO B 123 A 208 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 296 SER B 26 SER^? 9.16 C1 EDO B 125 coo 12.72 17.48 24.71 12.80 19.37 23.81 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 18.47 29.19 29.68 19.30 29.17 27.75 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 6.89 17.22 46.63 5.08 16.21 47.91 -1.61 64.24 -17.01 -1.53 65.09 -14.75 ULMN 3 2odj_o00 PORIN D user 14 3 # 14 A 156 HIS B 88 HIS^? 7.16 O1 EDO B 123 A 208 ASP A 5 ASP.? 11.32 O1 EDO B 123 A 296 SER B 50 SER^? 9.43 C1 EDO B 124 coo 12.72 17.48 24.71 12.80 19.37 23.81 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 18.47 29.19 29.68 19.30 29.17 27.75 20.60 64.37 -9.63 20.20 65.77 -11.14 coo 6.89 17.22 46.63 5.08 16.21 47.91 -0.37 58.24 1.54 1.00 56.43 2.53 ULMN 3 2odj_o00 PORIN D user 15 3 # 15 A 156 HIS B 88 HIS^? 7.16 O1 EDO B 123 A 208 ASP A 13 ASP.? -3.81 O2 EDO A 124s A 296 SER B 50 SER^? 9.43 C1 EDO B 124 coo 12.72 17.48 24.71 12.80 19.37 23.81 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 18.47 29.19 29.68 19.30 29.17 27.75 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 6.89 17.22 46.63 5.08 16.21 47.91 -0.37 58.24 1.54 1.00 56.43 2.53 ULMN 3 2odj_o00 PORIN D user 16 3 # 16 A 156 HIS B 88 HIS^? 7.16 O1 EDO B 123 A 208 ASP B 109 ASP^? -4.16 O4 PEG B 126s A 296 SER B 50 SER^? 9.43 C1 EDO B 124 coo 12.72 17.48 24.71 12.80 19.37 23.81 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 18.47 29.19 29.68 19.30 29.17 27.75 4.45 45.35 -19.96 6.21 46.00 -20.89 coo 6.89 17.22 46.63 5.08 16.21 47.91 -0.37 58.24 1.54 1.00 56.43 2.53 2odj_o00 source 2ODJ PORIN D : 16 hits 2odj_o00 naa= 3 ULMN 3 2odj_o01 PORIN D user 1 3 # 1 B 156 HIS A 4 HIS.? 6.54 O1 EDO A 128 B 208 ASP B 84 ASP^? 4.63 O1 EDO B 123 B 296 SER B 26 SER^? 9.16 C1 EDO B 125 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 18.39 63.32 -4.14 17.16 64.86 -3.40 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 20.02 60.63 -18.97 20.31 59.23 -17.40 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 -1.61 64.24 -17.01 -1.53 65.09 -14.75 ULMN 3 2odj_o01 PORIN D user 2 3 # 2 B 156 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 208 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 296 SER B 62 SER^? 7.18 O2 EDO B 124 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 6.89 48.41 3.38 5.73 47.19 2.13 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 5.78 62.05 -14.51 6.16 59.94 -13.32 ULMN 3 2odj_o01 PORIN D user 3 3 # 3 B 156 HIS A 72 HIS^? 15.66 C2 EDO B 124 B 208 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 296 SER B 57 SER^? 6.28 O4 PEG B 126 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 6.89 48.41 3.38 5.73 47.19 2.13 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 -1.05 49.09 -19.26 -2.38 47.97 -20.95 ULMN 3 2odj_o01 PORIN D user 4 3 # 4 B 156 HIS A 88 HIS^? 13.90 OXT ACT A 123 B 208 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 296 SER A 26 SER.? 6.11 CH3 ACT A 123 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 -1.51 48.14 15.79 -3.04 49.51 16.18 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 -6.45 59.57 16.94 -6.05 60.31 18.88 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 16.53 56.39 23.63 15.06 57.90 22.49 ULMN 3 2odj_o01 PORIN D user 5 3 # 5 B 156 HIS A 88 HIS^? 13.90 OXT ACT A 123 B 208 ASP B 5 ASP^? 17.31 OXT ACT A 123 B 296 SER A 50 SER^? 9.40 C1 EDO A 128 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 -1.51 48.14 15.79 -3.04 49.51 16.18 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 -6.45 59.57 16.94 -6.05 60.31 18.88 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 14.41 57.62 4.09 13.08 56.25 2.54 ULMN 3 2odj_o01 PORIN D user 6 3 # 6 B 156 HIS A 88 HIS^? 13.90 OXT ACT A 123 B 208 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 296 SER A 50 SER^? 9.40 C1 EDO A 128 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 -1.51 48.14 15.79 -3.04 49.51 16.18 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 14.41 57.62 4.09 13.08 56.25 2.54 ULMN 3 2odj_o01 PORIN D user 7 3 # 7 B 156 HIS B 4 HIS^? 16.30 OXT ACT A 123 B 208 ASP A 84 ASP.? 16.56 O1 EDO A 126 B 296 SER A 26 SER.? 6.11 CH3 ACT A 123 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 -4.28 60.61 11.46 -3.09 62.30 11.15 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 -5.66 53.01 24.37 -6.07 52.23 22.45 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 16.53 56.39 23.63 15.06 57.90 22.49 ULMN 3 2odj_o01 PORIN D user 8 3 # 8 B 156 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 208 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 296 SER A 57 SER^? 6.85 O2 EDO A 126 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 15.14 41.83 20.35 16.25 40.17 21.70 ULMN 3 2odj_o01 PORIN D user 9 3 # 9 B 156 HIS B 72 HIS^? 13.54 O1 EDO A 124 B 208 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 296 SER A 62 SER.? -2.76 OXT ACT A 123s coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 7.05 49.23 -1.00 8.21 47.66 -0.22 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 8.49 55.74 20.24 8.16 54.20 18.38 ULMN 3 2odj_o01 PORIN D user 10 3 # 10 B 156 HIS B 88 HIS^? 7.16 O1 EDO B 123 B 208 ASP A 5 ASP.? 11.32 O1 EDO B 123 B 296 SER B 50 SER^? 9.43 C1 EDO B 124 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 15.57 53.23 -12.61 17.12 54.63 -12.48 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 20.60 64.37 -9.63 20.20 65.77 -11.14 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 -0.37 58.24 1.54 1.00 56.43 2.53 ULMN 3 2odj_o01 PORIN D user 11 3 # 11 B 156 HIS B 88 HIS^? 7.16 O1 EDO B 123 B 208 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 296 SER B 50 SER^? 9.43 C1 EDO B 124 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 15.57 53.23 -12.61 17.12 54.63 -12.48 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 -0.37 58.24 1.54 1.00 56.43 2.53 2odj_o01 source 2ODJ PORIN D : 11 hits 2odj_o01 naa= 3 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 86 HIS A 88 HIS^? 13.90 OXT ACT A 123 A 250 ALA A 89 ALA^? 11.47 O1 EDO A 126 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 1.19 42.59 14.96 0.64 41.15 15.03 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 86 HIS B 88 HIS^? 7.16 O1 EDO B 123 A 250 ALA B 89 ALA^? 11.41 O2 EDO B 123 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 12.86 47.80 -13.77 13.41 46.50 -14.35 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o00 naa= 3 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 B 49 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 86 HIS A 88 HIS^? 13.90 OXT ACT A 123 B 250 ALA A 89 ALA^? 11.47 O1 EDO A 126 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 -1.93 52.21 20.42 -1.91 52.01 18.28 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 -1.51 48.14 15.79 -3.04 49.51 16.18 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 1.19 42.59 14.96 0.64 41.15 15.03 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 B 49 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 86 HIS B 88 HIS^? 7.16 O1 EDO B 123 B 250 ALA B 89 ALA^? 11.41 O2 EDO B 123 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 16.23 58.63 -15.55 16.12 57.73 -13.62 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 15.57 53.23 -12.61 17.12 54.63 -12.48 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 12.86 47.80 -13.77 13.41 46.50 -14.35 2wwt_o01 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o01 naa= 3 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 C 49 ASP A 82 ASP.? 12.57 OXT ACT A 123 C 86 HIS A 88 HIS^? 13.90 OXT ACT A 123 C 250 ALA A 89 ALA^? 11.47 O1 EDO A 126 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 1.19 42.59 14.96 0.64 41.15 15.03 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 C 49 ASP B 82 ASP^? 7.08 O1 EDO B 123 C 86 HIS B 88 HIS^? 7.16 O1 EDO B 123 C 250 ALA B 89 ALA^? 11.41 O2 EDO B 123 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 12.86 47.80 -13.77 13.41 46.50 -14.35 2wwt_o02 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o02 naa= 3 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 D 49 ASP A 82 ASP.? 12.57 OXT ACT A 123 D 86 HIS A 88 HIS^? 13.90 OXT ACT A 123 D 250 ALA A 89 ALA^? 11.47 O1 EDO A 126 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 -1.51 48.14 15.79 -3.04 49.51 16.18 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 1.19 42.59 14.96 0.64 41.15 15.03 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 D 49 ASP B 82 ASP^? 7.08 O1 EDO B 123 D 86 HIS B 88 HIS^? 7.16 O1 EDO B 123 D 250 ALA B 89 ALA^? 11.41 O2 EDO B 123 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 15.57 53.23 -12.61 17.12 54.63 -12.48 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 12.86 47.80 -13.77 13.41 46.50 -14.35 2wwt_o03 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o03 naa= 3 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 E 49 ASP A 82 ASP.? 12.57 OXT ACT A 123 E 86 HIS A 88 HIS^? 13.90 OXT ACT A 123 E 250 ALA A 89 ALA^? 11.47 O1 EDO A 126 coo -36.18 24.97 18.78 -36.93 26.11 17.11 -1.93 52.21 20.42 -1.91 52.01 18.28 coo -36.85 29.32 15.06 -38.90 29.14 15.48 -1.51 48.14 15.79 -3.04 49.51 16.18 coo -44.49 29.68 13.98 -43.47 28.67 13.52 1.19 42.59 14.96 0.64 41.15 15.03 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 E 49 ASP B 82 ASP^? 7.08 O1 EDO B 123 E 86 HIS B 88 HIS^? 7.16 O1 EDO B 123 E 250 ALA B 89 ALA^? 11.41 O2 EDO B 123 coo -36.18 24.97 18.78 -36.93 26.11 17.11 16.23 58.63 -15.55 16.12 57.73 -13.62 coo -36.85 29.32 15.06 -38.90 29.14 15.48 15.57 53.23 -12.61 17.12 54.63 -12.48 coo -44.49 29.68 13.98 -43.47 28.67 13.52 12.86 47.80 -13.77 13.41 46.50 -14.35 2wwt_o04 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o04 naa= 3 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 F 49 ASP A 82 ASP.? 12.57 OXT ACT A 123 F 86 HIS A 88 HIS^? 13.90 OXT ACT A 123 F 250 ALA A 89 ALA^? 11.47 O1 EDO A 126 coo -82.12 8.55 35.60 -81.93 9.84 37.19 -1.93 52.21 20.42 -1.91 52.01 18.28 coo -84.21 11.81 39.90 -82.43 12.70 39.26 -1.51 48.14 15.79 -3.04 49.51 16.18 coo -78.49 17.13 41.31 -79.25 15.85 41.61 1.19 42.59 14.96 0.64 41.15 15.03 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 F 49 ASP B 82 ASP^? 7.08 O1 EDO B 123 F 86 HIS B 88 HIS^? 7.16 O1 EDO B 123 F 250 ALA B 89 ALA^? 11.41 O2 EDO B 123 coo -82.12 8.55 35.60 -81.93 9.84 37.19 16.23 58.63 -15.55 16.12 57.73 -13.62 coo -84.21 11.81 39.90 -82.43 12.70 39.26 15.57 53.23 -12.61 17.12 54.63 -12.48 coo -78.49 17.13 41.31 -79.25 15.85 41.61 12.86 47.80 -13.77 13.41 46.50 -14.35 2wwt_o05 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o05 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 107 GLU^? -3.18 O1 EDO A 126s A 44 ASP A 82 ASP.? 12.57 OXT ACT A 123 A 50 THR A 86 THR.? 15.12 O1 EDO A 126 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 6.31 45.06 22.90 4.64 44.18 23.93 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -1.93 52.21 20.42 -1.91 52.01 18.28 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 -4.19 48.24 21.18 -5.67 49.16 19.86 ULMN 3 3hde_o00 LYSOZYME user 2 3 # 2 A 35 GLU B 107 GLU^? -3.66 C1 PEG B 126s A 44 ASP B 82 ASP^? 7.08 O1 EDO B 123 A 50 THR B 86 THR^? -2.76 O1 EDO B 123s coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 7.84 52.79 -20.58 9.53 52.35 -21.72 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 16.23 58.63 -15.55 16.12 57.73 -13.62 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 18.42 55.14 -17.57 19.88 55.50 -16.03 3hde_o00 source 3HDE LYSOZYME : 2 hits 3hde_o00 naa= 3 ULMN 3 3hde_o01 LYSOZYME user 1 3 # 1 B 35 GLU A 54 GLU^? 10.26 O1 EDO A 125 B 44 ASP A 13 ASP.? -3.81 O2 EDO A 124s B 50 THR A 14 THR.? 8.58 O1 EDO A 124 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 19.19 45.91 11.58 20.09 44.01 11.30 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 20.17 49.39 -1.56 21.38 47.59 -1.63 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 17.20 46.38 0.71 15.18 46.20 -0.03 ULMN 3 3hde_o01 LYSOZYME user 2 3 # 2 B 35 GLU A 107 GLU^? -3.18 O1 EDO A 126s B 44 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 50 THR A 86 THR.? 15.12 O1 EDO A 126 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 6.31 45.06 22.90 4.64 44.18 23.93 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -1.93 52.21 20.42 -1.91 52.01 18.28 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 -4.19 48.24 21.18 -5.67 49.16 19.86 ULMN 3 3hde_o01 LYSOZYME user 3 3 # 3 B 35 GLU A 107 GLU^? -3.18 O1 EDO A 126s B 44 ASP A 82 ASP.? 12.57 OXT ACT A 123 B 50 THR A 103 THR^? 10.25 OXT ACT A 123 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 6.31 45.06 22.90 4.64 44.18 23.93 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -1.93 52.21 20.42 -1.91 52.01 18.28 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 3.98 57.48 21.66 3.28 59.10 22.89 ULMN 3 3hde_o01 LYSOZYME user 4 3 # 4 B 35 GLU B 54 GLU^? 12.15 C2 EDO B 124 B 44 ASP B 13 ASP^? 17.03 O1 EDO B 124 B 50 THR B 14 THR^? 15.08 C2 EDO B 124 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -6.23 48.66 3.73 -7.41 46.97 3.18 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 -3.15 46.62 0.75 -1.23 46.14 1.47 ULMN 3 3hde_o01 LYSOZYME user 5 3 # 5 B 35 GLU B 107 GLU^? -3.66 C1 PEG B 126s B 44 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 50 THR B 86 THR^? -2.76 O1 EDO B 123s coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 7.84 52.79 -20.58 9.53 52.35 -21.72 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 16.23 58.63 -15.55 16.12 57.73 -13.62 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 18.42 55.14 -17.57 19.88 55.50 -16.03 ULMN 3 3hde_o01 LYSOZYME user 6 3 # 6 B 35 GLU B 107 GLU^? -3.66 C1 PEG B 126s B 44 ASP B 82 ASP^? 7.08 O1 EDO B 123 B 50 THR B 103 THR^? 13.94 C1 EDO B 125 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 7.84 52.79 -20.58 9.53 52.35 -21.72 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 16.23 58.63 -15.55 16.12 57.73 -13.62 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 10.26 64.09 -15.02 10.94 66.08 -15.56 3hde_o01 source 3HDE LYSOZYME : 6 hits 3hde_o01 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU A 54 GLU^? 10.26 O1 EDO A 125 C 44 ASP A 13 ASP.? -3.81 O2 EDO A 124s C 50 THR A 14 THR.? 8.58 O1 EDO A 124 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 19.19 45.91 11.58 20.09 44.01 11.30 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 20.17 49.39 -1.56 21.38 47.59 -1.63 coo 25.48 4.87 1.60 23.90 4.95 0.15 17.20 46.38 0.71 15.18 46.20 -0.03 ULMN 3 3hde_o02 LYSOZYME user 2 3 # 2 C 35 GLU A 107 GLU^? -3.18 O1 EDO A 126s C 44 ASP A 82 ASP.? 12.57 OXT ACT A 123 C 50 THR A 86 THR.? 15.12 O1 EDO A 126 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 6.31 45.06 22.90 4.64 44.18 23.93 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 25.48 4.87 1.60 23.90 4.95 0.15 -4.19 48.24 21.18 -5.67 49.16 19.86 ULMN 3 3hde_o02 LYSOZYME user 3 3 # 3 C 35 GLU A 107 GLU^? -3.18 O1 EDO A 126s C 44 ASP A 82 ASP.? 12.57 OXT ACT A 123 C 50 THR A 103 THR^? 10.25 OXT ACT A 123 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 6.31 45.06 22.90 4.64 44.18 23.93 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -1.93 52.21 20.42 -1.91 52.01 18.28 coo 25.48 4.87 1.60 23.90 4.95 0.15 3.98 57.48 21.66 3.28 59.10 22.89 ULMN 3 3hde_o02 LYSOZYME user 4 3 # 4 C 35 GLU B 54 GLU^? 12.15 C2 EDO B 124 C 44 ASP B 13 ASP^? 17.03 O1 EDO B 124 C 50 THR B 14 THR^? 15.08 C2 EDO B 124 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 -5.07 50.29 -9.79 -6.20 48.55 -10.09 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 25.48 4.87 1.60 23.90 4.95 0.15 -3.15 46.62 0.75 -1.23 46.14 1.47 ULMN 3 3hde_o02 LYSOZYME user 5 3 # 5 C 35 GLU B 75 GLU^? 16.27 C2 EDO B 124 C 44 ASP B 13 ASP^? 17.03 O1 EDO B 124 C 50 THR B 14 THR^? 15.08 C2 EDO B 124 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 -0.17 42.47 -7.47 -2.17 42.28 -6.79 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -6.23 48.66 3.73 -7.41 46.97 3.18 coo 25.48 4.87 1.60 23.90 4.95 0.15 -3.15 46.62 0.75 -1.23 46.14 1.47 ULMN 3 3hde_o02 LYSOZYME user 6 3 # 6 C 35 GLU B 107 GLU^? -3.66 C1 PEG B 126s C 44 ASP B 82 ASP^? 7.08 O1 EDO B 123 C 50 THR B 86 THR^? -2.76 O1 EDO B 123s coo 15.89 -0.52 0.58 15.91 1.38 -0.35 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 25.48 4.87 1.60 23.90 4.95 0.15 18.42 55.14 -17.57 19.88 55.50 -16.03 ULMN 3 3hde_o02 LYSOZYME user 7 3 # 7 C 35 GLU B 107 GLU^? -3.66 C1 PEG B 126s C 44 ASP B 82 ASP^? 7.08 O1 EDO B 123 C 50 THR B 103 THR^? 13.94 C1 EDO B 125 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 7.84 52.79 -20.58 9.53 52.35 -21.72 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 16.23 58.63 -15.55 16.12 57.73 -13.62 coo 25.48 4.87 1.60 23.90 4.95 0.15 10.26 64.09 -15.02 10.94 66.08 -15.56 3hde_o02 source 3HDE LYSOZYME : 7 hits 3hde_o02 naa= 3 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 1 3 # 1 A 966 SER A 7 SER.? 11.72 O1 EDO B 123 A 967 ARG A 8 ARG.? -3.85 O1 EDO B 123s A 975 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo 82.02 40.88 31.11 79.88 41.56 30.18 16.55 63.58 -12.78 16.44 65.52 -14.23 coo 78.94 44.79 33.75 77.86 47.56 32.82 19.83 57.78 -11.68 20.81 58.85 -14.45 coo 83.57 40.86 25.45 83.15 43.18 26.91 11.57 61.77 -11.34 12.14 59.44 -12.79 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 2 3 # 2 A 966 SER A 62 SER.? -2.76 OXT ACT A 123s A 967 ARG A 27 ARG.? 5.17 CH3 ACT A 123 A 975 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo 82.02 40.88 31.11 79.88 41.56 30.18 8.49 55.74 20.24 8.16 54.20 18.38 coo 78.94 44.79 33.75 77.86 47.56 32.82 10.94 57.70 24.22 11.90 58.81 21.49 coo 83.57 40.86 25.45 83.15 43.18 26.91 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 3 3 # 3 A 966 SER B 7 SER^? 13.90 OXT ACT A 123 A 967 ARG B 8 ARG^? 17.13 OXT ACT A 123 A 975 TYR A 102 TYR^? 8.02 OXT ACT A 123 coo 82.02 40.88 31.11 79.88 41.56 30.18 -2.26 57.69 19.56 -2.09 59.00 21.60 coo 78.94 44.79 33.75 77.86 47.56 32.82 -5.69 52.78 16.51 -6.54 52.92 19.56 coo 83.57 40.86 25.45 83.15 43.18 26.91 2.53 56.58 17.48 2.05 53.90 18.03 ULMN 3 4dqk_o00 BIFUNCTIONAL P-450/NADPH-P450 REDUCTuser 4 3 # 4 A 966 SER B 62 SER^? 7.18 O2 EDO B 124 A 967 ARG B 27 ARG^? 11.58 C1 EDO B 125 A 975 TYR B 102 TYR^? 11.19 O2 EDO B 124 coo 82.02 40.88 31.11 79.88 41.56 30.18 5.78 62.05 -14.51 6.16 59.94 -13.32 coo 78.94 44.79 33.75 77.86 47.56 32.82 3.96 65.71 -18.47 3.56 68.28 -16.63 coo 83.57 40.86 25.45 83.15 43.18 26.91 11.57 61.77 -11.34 12.14 59.44 -12.79 4dqk_o00 source 4DQK BIFUNCTIONAL P-450/NADPH-P450 REDUCTASE : 4 hits 4dqk_o00 naa= 3