*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 250 ALA A 59 ALA^? 23.37 O2 GOL A 200 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 11.95 23.52 7.79 13.60 24.51 6.84 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 13.89 24.29 2.75 14.15 26.31 2.22 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 10.08 27.38 -1.00 11.44 28.06 -1.17 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 250 ALA A 122 ALA^? 22.22 O2 GOL A 200 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 11.95 23.52 7.79 13.60 24.51 6.84 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 13.89 24.29 2.75 14.15 26.31 2.22 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 14.40 16.69 2.00 13.38 15.62 1.82 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o00 naa= 3 ULMN 3 3uao_o00 PUTATIVE ISOCHORISMATASE user 1 3 # 1 A 29 ASP A 118 ASP^? 28.24 O2 GOL A 200 A 117 LYS A 92 LYS^? 33.34 O2 GOL A 200 A 150 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 37.97 47.82 5.46 38.65 48.02 7.40 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 41.02 51.33 13.36 40.18 47.06 9.99 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 39.17 42.30 8.54 40.94 44.26 7.78 8.07 32.08 0.96 5.72 33.61 0.99 3uao_o00 source 3UAO PUTATIVE ISOCHORISMATASE : 1 hits 3uao_o00 naa= 3 ULMN 4 1d8c_c00 MALATE SYNTHASE G user 1 4 # 1 A 270 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 272 GLU A 103 GLU.? 9.69 O2 GOL A 200 A 338 ARG A 100 ARG.? 12.49 O2 GOL A 200 A 631 ASP A 73 ASP.? 11.55 O2 GOL A 200 coo 15.32 0.58 -16.16 13.76 -0.65 -16.82 11.95 23.52 7.79 13.60 24.51 6.84 coo 11.90 -5.17 -18.46 9.90 -4.77 -17.84 5.18 20.01 12.20 7.16 20.80 12.53 coo 11.94 -3.39 -13.78 10.23 -1.14 -15.20 10.61 20.08 13.39 10.29 23.15 12.59 coo 8.71 2.50 -20.96 7.71 1.86 -19.18 7.80 28.72 11.54 7.47 28.46 13.63 1d8c_c00 source 1d8c MALATE SYNTHASE G : 1 hits 1d8c_c00 naa= 4 ULMN 4 1dgs_c02 DNA LIGASE user 1 4 # 1 A 116 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 118 ASP A 39 ASP^? -14.64 O1 GOL A 200s A 196 ARG A 44 ARG^? 10.85 O1 GOL A 200 A 312 LYS A 18 LYS.? 10.82 O1 GOL A 200 coo 28.15 14.26 17.66 24.32 10.53 19.45 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 21.81 17.20 14.31 21.99 17.18 16.45 -8.43 26.08 3.91 -10.39 26.34 4.84 coo 19.30 14.28 13.45 20.80 11.67 12.77 -5.22 29.17 7.22 -7.66 28.12 8.81 coo 26.32 10.33 25.16 21.66 11.07 21.98 -2.73 13.36 9.72 -7.58 13.32 13.61 1dgs_c02 source 1dgs DNA LIGASE : 1 hits 1dgs_c02 naa= 4 ULMN 4 1di1_c00 ARISTOLOCHENE SYNTHASE user 1 4 # 1 A 92 TYR A 27 TYR^? 22.06 O1 GOL A 200 A 112 PHE A 47 PHE^? 16.84 O2 GOL A 200 A 178 PHE A 30 PHE.? 23.27 O2 GOL A 200 A 333 TRP A 115 TRP^? 25.03 O1 GOL A 200 coo 36.26 31.30 22.39 35.67 33.02 24.49 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo 45.52 35.08 26.96 42.72 35.07 26.70 3.45 22.78 2.62 3.68 24.27 0.23 coo 43.67 42.67 22.02 43.98 41.21 24.38 9.13 16.01 -1.98 11.91 15.81 -1.58 coo 37.80 27.73 29.78 38.27 31.62 30.15 0.20 29.00 -7.44 1.47 25.44 -6.55 1di1_c00 source 1di1 ARISTOLOCHENE SYNTHASE : 1 hits 1di1_c00 naa= 4 ULMN 4 1di1_c01 ARISTOLOCHENE SYNTHASE user 1 4 # 1 B 92 TYR A 27 TYR^? 22.06 O1 GOL A 200 B 112 PHE A 47 PHE^? 16.84 O2 GOL A 200 B 178 PHE A 30 PHE.? 23.27 O2 GOL A 200 B 333 TRP A 115 TRP^? 25.03 O1 GOL A 200 coo 99.56 54.98 23.15 101.17 54.32 25.32 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo 95.53 46.26 28.54 97.54 48.18 28.09 3.45 22.78 2.62 3.68 24.27 0.23 coo 102.10 41.65 23.98 100.86 42.71 26.26 9.13 16.01 -1.98 11.91 15.81 -1.58 coo 96.01 57.16 30.39 98.35 54.06 31.01 0.20 29.00 -7.44 1.47 25.44 -6.55 1di1_c01 source 1di1 ARISTOLOCHENE SYNTHASE : 1 hits 1di1_c01 naa= 4 ULMN 4 1eag_c03 PEPTIDE INHIBITOR user 1 4 # 1 A 32 ASP A 63 ASP^? 31.81 O1 GOL A 200 A 33 THR A 113 THR.? 29.23 O1 GOL A 200 A 218 ASP A 65 ASP.? 32.24 O1 GOL A 200 A 219 SER A 66 SER.? 26.83 O1 GOL A 200 coo 47.22 22.34 8.57 45.16 22.02 9.13 3.02 36.19 -9.95 3.74 34.72 -11.31 coo 47.36 17.58 7.81 48.27 16.18 9.23 -2.06 34.24 -8.48 -1.59 36.33 -8.55 coo 44.05 16.99 12.67 44.05 18.89 11.74 -0.73 40.47 -9.40 -0.67 38.73 -10.58 coo 48.58 18.17 13.13 49.43 18.91 10.97 -0.43 37.87 -5.28 0.50 35.67 -5.90 ULMN 4 1eag_c03 PEPTIDE INHIBITOR user 2 4 # 2 A 32 ASP A 65 ASP.? 32.24 O1 GOL A 200 A 33 THR A 113 THR.? 29.23 O1 GOL A 200 A 218 ASP A 63 ASP^? 31.81 O1 GOL A 200 A 219 SER A 66 SER.? 26.83 O1 GOL A 200 coo 47.22 22.34 8.57 45.16 22.02 9.13 -0.73 40.47 -9.40 -0.67 38.73 -10.58 coo 47.36 17.58 7.81 48.27 16.18 9.23 -2.06 34.24 -8.48 -1.59 36.33 -8.55 coo 44.05 16.99 12.67 44.05 18.89 11.74 3.02 36.19 -9.95 3.74 34.72 -11.31 coo 48.58 18.17 13.13 49.43 18.91 10.97 -0.43 37.87 -5.28 0.50 35.67 -5.90 1eag_c03 source 1eag PEPTIDE INHIBITOR : 2 hits 1eag_c03 naa= 4 ULMN 4 1ohh_c04 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 4 # 1 C 373 ARG A 132 ARG.? 16.38 O3 GOL A 200 D 162 LYS A 52 LYS.? 20.79 O2 GOL A 200 D 188 GLU A 103 GLU.? 9.69 O2 GOL A 200 D 189 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo 98.85 -10.90 7.87 100.05 -8.42 6.51 15.71 15.59 15.34 14.57 17.73 13.37 coo 97.99 -7.86 -1.95 100.32 -4.54 0.96 8.29 9.60 9.80 7.06 4.86 8.55 coo 106.62 -10.53 0.39 105.71 -8.86 1.36 5.18 20.01 12.20 7.16 20.80 12.53 coo 104.29 -12.38 6.88 103.14 -9.63 6.18 10.61 20.08 13.39 10.29 23.15 12.59 1ohh_c04 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 1 hits 1ohh_c04 naa= 4 ULMN 4 1pma_c14 PROTEASOME user 1 4 # 1 A 35 SER A 66 SER.? 26.83 O1 GOL A 200 A 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 A 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 A 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 89.76 104.51 121.28 91.03 106.44 121.99 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 99.01 105.66 122.24 93.37 107.22 124.79 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 91.58 97.09 120.24 92.08 97.51 120.80 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 85.59 103.89 117.95 84.01 104.68 119.62 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c14 source 1pma PROTEASOME : 1 hits 1pma_c14 naa= 4 ULMN 4 1pma_c15 PROTEASOME user 1 4 # 1 C 35 SER A 66 SER.? 26.83 O1 GOL A 200 C 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 C 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 C 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 86.16 90.99 92.80 87.35 92.60 91.45 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 95.08 92.95 91.94 89.21 95.51 92.55 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 88.54 85.72 97.78 89.01 86.43 97.78 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 81.98 87.51 91.60 80.26 89.10 92.17 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c15 source 1pma PROTEASOME : 1 hits 1pma_c15 naa= 4 ULMN 4 1pma_c16 PROTEASOME user 1 4 # 1 D 35 SER A 66 SER.? 26.83 O1 GOL A 200 D 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 D 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 D 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 84.34 60.07 85.86 85.10 60.44 83.59 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 93.10 61.36 83.03 86.96 63.04 81.84 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 87.21 60.71 92.95 87.59 61.21 92.34 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 80.64 56.46 87.95 78.79 57.87 87.31 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c16 source 1pma PROTEASOME : 1 hits 1pma_c16 naa= 4 ULMN 4 1pma_c17 PROTEASOME user 1 4 # 1 E 35 SER A 66 SER.? 26.83 O1 GOL A 200 E 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 E 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 E 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 85.87 34.81 105.43 86.85 33.25 103.89 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 94.23 34.01 101.89 88.08 33.81 100.38 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 88.45 41.00 109.01 88.80 40.87 108.21 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 82.37 33.96 109.76 80.42 34.00 108.25 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c17 source 1pma PROTEASOME : 1 hits 1pma_c17 naa= 4 ULMN 4 1pma_c18 PROTEASOME user 1 4 # 1 F 35 SER A 66 SER.? 26.83 O1 GOL A 200 F 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 F 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 F 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 89.47 34.70 136.77 90.56 32.53 136.87 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 98.16 32.25 134.54 92.11 30.32 134.15 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 91.52 41.49 134.05 91.91 40.83 133.64 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 86.20 37.37 140.32 84.33 36.07 139.50 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c18 source 1pma PROTEASOME : 1 hits 1pma_c18 naa= 4 ULMN 4 1pma_c19 PROTEASOME user 1 4 # 1 G 35 SER A 66 SER.? 26.83 O1 GOL A 200 G 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 G 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 G 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 92.48 59.40 156.31 93.79 58.22 157.99 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 101.40 56.92 156.13 95.50 54.88 157.80 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 93.61 61.72 149.21 94.11 61.04 149.43 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 88.78 63.56 156.72 86.93 62.01 157.10 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c19 source 1pma PROTEASOME : 1 hits 1pma_c19 naa= 4 ULMN 4 1pma_c20 PROTEASOME user 1 4 # 1 H 35 SER A 66 SER.? 26.83 O1 GOL A 200 H 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 H 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 H 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 92.74 90.44 149.58 94.16 91.12 151.38 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 101.80 89.56 150.85 96.21 89.19 153.82 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 93.72 86.54 143.13 94.26 86.30 143.78 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 88.57 93.20 146.88 86.86 92.43 148.44 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c20 source 1pma PROTEASOME : 1 hits 1pma_c20 naa= 4 ULMN 4 1pma_c21 PROTEASOME user 1 4 # 1 I 35 SER A 66 SER.? 26.83 O1 GOL A 200 I 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 I 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 I 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 216.67 26.97 107.22 215.57 25.04 108.20 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 208.01 25.98 110.24 214.08 24.27 111.46 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 214.93 34.32 106.43 214.53 33.95 107.10 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 219.98 27.60 102.95 221.89 26.99 104.30 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c21 source 1pma PROTEASOME : 1 hits 1pma_c21 naa= 4 ULMN 4 1pma_c22 PROTEASOME user 1 4 # 1 J 35 SER A 66 SER.? 26.83 O1 GOL A 200 J 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 J 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 J 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 213.55 39.87 78.52 212.15 38.11 77.66 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 204.73 37.66 79.74 210.59 35.12 79.14 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 212.36 45.21 83.76 211.92 44.47 83.89 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 217.34 43.17 76.17 219.16 41.55 76.51 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c22 source 1pma PROTEASOME : 1 hits 1pma_c22 naa= 4 ULMN 4 1pma_c23 PROTEASOME user 1 4 # 1 K 35 SER A 66 SER.? 26.83 O1 GOL A 200 K 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 K 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 K 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 213.86 70.48 70.36 212.52 70.13 68.37 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 204.71 69.18 69.70 210.34 67.50 67.20 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 212.56 69.98 77.87 212.03 69.49 77.40 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 217.85 74.08 71.56 219.45 72.67 70.36 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c23 source 1pma PROTEASOME : 1 hits 1pma_c23 naa= 4 ULMN 4 1pma_c24 PROTEASOME user 1 4 # 1 L 35 SER A 66 SER.? 26.83 O1 GOL A 200 L 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 L 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 L 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 216.64 96.16 88.97 215.38 97.58 87.49 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 207.55 96.84 87.56 213.26 97.06 84.64 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 214.90 90.14 93.16 214.41 90.25 92.47 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 220.95 97.14 92.21 222.53 97.02 90.36 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c24 source 1pma PROTEASOME : 1 hits 1pma_c24 naa= 4 ULMN 4 1pma_c25 PROTEASOME user 1 4 # 1 M 35 SER A 66 SER.? 26.83 O1 GOL A 200 M 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 M 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 M 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 220.44 97.39 120.24 219.28 99.46 120.61 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 211.44 99.73 120.08 217.33 101.48 118.24 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 217.83 90.43 118.26 217.38 91.08 117.92 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 224.42 94.96 123.04 226.02 96.08 121.60 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c25 source 1pma PROTEASOME : 1 hits 1pma_c25 naa= 4 ULMN 4 1pma_c26 PROTEASOME user 1 4 # 1 N 35 SER A 66 SER.? 26.83 O1 GOL A 200 N 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 N 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 N 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 221.83 73.23 140.73 220.76 74.32 142.57 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 213.28 75.80 142.62 219.38 77.84 142.76 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 218.97 70.56 134.12 218.60 71.29 134.44 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 225.82 69.04 140.40 227.65 70.67 140.39 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c26 source 1pma PROTEASOME : 1 hits 1pma_c26 naa= 4 ULMN 4 1pma_c27 PROTEASOME user 1 4 # 1 O 35 SER A 66 SER.? 26.83 O1 GOL A 200 O 66 LYS A 92 LYS^? 33.34 O2 GOL A 200 O 80 GLY A 114 GLY.? 29.63 O1 GOL A 200 O 167 SER A 111 SER^? -25.66 O1 GOL A 200s coo 220.45 41.90 135.07 219.57 41.33 137.22 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 212.02 42.85 138.43 218.26 43.26 139.85 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 217.92 45.71 129.07 217.56 45.95 129.82 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 223.94 39.10 131.49 225.85 39.86 132.79 -4.95 35.61 -2.73 -5.10 37.96 -3.33 1pma_c27 source 1pma PROTEASOME : 1 hits 1pma_c27 naa= 4 ULMN 4 1sme_c02 PLASMEPSIN II user 1 4 # 1 A 34 ASP A 63 ASP^? 31.81 O1 GOL A 200 A 35 THR A 113 THR.? 29.23 O1 GOL A 200 A 214 ASP A 65 ASP.? 32.24 O1 GOL A 200 A 215 SER A 66 SER.? 26.83 O1 GOL A 200 coo 51.75 60.57 19.10 52.05 60.90 21.19 3.02 36.19 -9.95 3.74 34.72 -11.31 coo 47.08 60.98 20.23 45.92 59.29 20.80 -2.06 34.24 -8.48 -1.59 36.33 -8.55 coo 48.59 58.89 25.78 50.13 59.74 24.61 -0.73 40.47 -9.40 -0.67 38.73 -10.58 coo 48.32 55.94 22.14 47.80 57.34 20.24 -0.43 37.87 -5.28 0.50 35.67 -5.90 ULMN 4 1sme_c02 PLASMEPSIN II user 2 4 # 2 A 34 ASP A 65 ASP.? 32.24 O1 GOL A 200 A 35 THR A 113 THR.? 29.23 O1 GOL A 200 A 214 ASP A 63 ASP^? 31.81 O1 GOL A 200 A 215 SER A 66 SER.? 26.83 O1 GOL A 200 coo 51.75 60.57 19.10 52.05 60.90 21.19 -0.73 40.47 -9.40 -0.67 38.73 -10.58 coo 47.08 60.98 20.23 45.92 59.29 20.80 -2.06 34.24 -8.48 -1.59 36.33 -8.55 coo 48.59 58.89 25.78 50.13 59.74 24.61 3.02 36.19 -9.95 3.74 34.72 -11.31 coo 48.32 55.94 22.14 47.80 57.34 20.24 -0.43 37.87 -5.28 0.50 35.67 -5.90 1sme_c02 source 1sme PLASMEPSIN II : 2 hits 1sme_c02 naa= 4 ULMN 4 1uqr_c01 3-DEHYDROQUINATE DEHYDRATASE user 1 4 # 1 B 11 ASN A 49 ASN^? 15.73 O2 GOL A 200 B 98 GLU A 96 GLU^? 22.95 O2 GOL A 200 B 100 HIS A 57 HIS^? 21.61 O2 GOL A 200 B 107 ARG A 123 ARG^? 24.89 O2 GOL A 200 coo 11.27 31.84 18.77 11.89 32.18 16.76 6.06 16.51 6.44 7.78 15.19 6.31 coo 0.74 41.57 23.88 1.22 43.34 22.81 12.01 30.07 3.21 14.10 30.25 2.56 coo 5.47 40.65 25.28 4.49 41.10 23.48 13.89 24.29 2.75 14.15 26.31 2.22 coo 13.70 42.11 24.85 13.86 39.58 23.15 18.70 18.30 6.22 21.48 19.12 7.39 1uqr_c01 source 1uqr 3-DEHYDROQUINATE DEHYDRATASE : 1 hits 1uqr_c01 naa= 4 ULMN 4 1uqr_c11 3-DEHYDROQUINATE DEHYDRATASE user 1 4 # 1 L 11 ASN A 49 ASN^? 15.73 O2 GOL A 200 L 98 GLU A 96 GLU^? 22.95 O2 GOL A 200 L 100 HIS A 57 HIS^? 21.61 O2 GOL A 200 L 107 ARG A 123 ARG^? 24.89 O2 GOL A 200 coo 42.04 54.32 12.07 41.63 56.33 12.65 6.06 16.51 6.44 7.78 15.19 6.31 coo 32.45 49.34 1.33 30.73 50.49 1.78 12.01 30.07 3.21 14.10 30.25 2.56 coo 33.33 48.09 6.11 33.03 49.95 5.19 13.89 24.29 2.75 14.15 26.31 2.22 coo 31.55 48.56 14.27 34.11 50.22 14.46 18.70 18.30 6.22 21.48 19.12 7.39 1uqr_c11 source 1uqr 3-DEHYDROQUINATE DEHYDRATASE : 1 hits 1uqr_c11 naa= 4 ULMN 3 1a41_c01 TOPOISOMERASE I user 1 3 # 1 223 ARG A 100 ARG.? 12.49 O2 GOL A 200 265 HIS A 57 HIS^? 21.61 O2 GOL A 200 274 TYR A 35 TYR^? 18.28 O2 GOL A 200 coo -15.18 55.46 8.55 -14.82 52.98 10.38 10.61 20.08 13.39 10.29 23.15 12.59 coo -14.48 45.59 11.18 -14.02 47.49 10.42 13.89 24.29 2.75 14.15 26.31 2.22 coo 0.94 52.26 9.16 1.95 54.78 9.91 -0.13 15.22 1.35 0.07 12.52 0.73 ULMN 3 1a41_c01 TOPOISOMERASE I user 2 3 # 2 223 ARG A 123 ARG^? 24.89 O2 GOL A 200 265 HIS A 57 HIS^? 21.61 O2 GOL A 200 274 TYR A 48 TYR^? 12.35 O2 GOL A 200 coo -15.18 55.46 8.55 -14.82 52.98 10.38 18.70 18.30 6.22 21.48 19.12 7.39 coo -14.48 45.59 11.18 -14.02 47.49 10.42 13.89 24.29 2.75 14.15 26.31 2.22 coo 0.94 52.26 9.16 1.95 54.78 9.91 0.42 16.28 6.68 0.66 13.80 7.88 1a41_c01 source 1a41 TOPOISOMERASE I : 2 hits 1a41_c01 naa= 3 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 B 325 ARG A 44 ARG^? 10.85 O1 GOL A 200 B 342 ASP A 73 ASP.? 11.55 O2 GOL A 200 B 531 ARG A 36 ARG^? 21.82 O1 GOL A 200 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -5.22 29.17 7.22 -7.66 28.12 8.81 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 7.80 28.72 11.54 7.47 28.46 13.63 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 -0.18 23.83 -2.35 -2.28 23.74 -4.54 1asy_c00 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 1 hits 1asy_c00 naa= 3 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 A 325 ARG A 44 ARG^? 10.85 O1 GOL A 200 A 342 ASP A 73 ASP.? 11.55 O2 GOL A 200 A 531 ARG A 36 ARG^? 21.82 O1 GOL A 200 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -5.22 29.17 7.22 -7.66 28.12 8.81 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 7.80 28.72 11.54 7.47 28.46 13.63 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -0.18 23.83 -2.35 -2.28 23.74 -4.54 1asy_c01 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 1 hits 1asy_c01 naa= 3 ULMN 3 1ax4_c04 TRYPTOPHANASE user 1 3 # 1 A 130 PHE A 30 PHE.? 23.27 O2 GOL A 200 A 223 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 265 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 39.74 52.86 65.74 41.15 55.14 66.52 9.13 16.01 -1.98 11.91 15.81 -1.58 coo 30.70 47.50 67.53 29.83 49.47 67.39 2.55 11.74 5.01 1.42 10.07 5.73 coo 19.99 54.53 64.11 20.55 58.78 68.33 -8.73 20.02 6.97 -12.28 16.97 10.92 ULMN 3 1ax4_c04 TRYPTOPHANASE user 2 3 # 2 A 130 PHE A 30 PHE.? 23.27 O2 GOL A 200 A 223 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 265 LYS A 25 LYS^? 23.71 O1 GOL A 200 coo 39.74 52.86 65.74 41.15 55.14 66.52 9.13 16.01 -1.98 11.91 15.81 -1.58 coo 30.70 47.50 67.53 29.83 49.47 67.39 2.55 11.74 5.01 1.42 10.07 5.73 coo 19.99 54.53 64.11 20.55 58.78 68.33 -8.49 20.21 -0.96 -11.35 17.51 -4.55 ULMN 3 1ax4_c04 TRYPTOPHANASE user 3 3 # 3 A 130 PHE A 107 PHE^? 17.79 O2 GOL A 200 A 223 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 265 LYS A 52 LYS.? 20.79 O2 GOL A 200 coo 39.74 52.86 65.74 41.15 55.14 66.52 3.44 27.97 2.84 5.43 28.55 0.97 coo 30.70 47.50 67.53 29.83 49.47 67.39 11.95 23.52 7.79 13.60 24.51 6.84 coo 19.99 54.53 64.11 20.55 58.78 68.33 8.29 9.60 9.80 7.06 4.86 8.55 1ax4_c04 source 1ax4 TRYPTOPHANASE : 3 hits 1ax4_c04 naa= 3 ULMN 3 1ax4_c05 TRYPTOPHANASE user 1 3 # 1 B 130 PHE A 30 PHE.? 23.27 O2 GOL A 200 B 223 ASP A 50 ASP.? 16.78 O2 GOL A 200 B 265 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 7.48 54.94 99.62 7.67 52.27 100.42 9.13 16.01 -1.98 11.91 15.81 -1.58 coo 10.43 61.66 91.81 9.80 60.04 90.61 2.55 11.74 5.01 1.42 10.07 5.73 coo 5.43 58.06 80.08 8.57 53.00 79.37 -8.73 20.02 6.97 -12.28 16.97 10.92 ULMN 3 1ax4_c05 TRYPTOPHANASE user 2 3 # 2 B 130 PHE A 30 PHE.? 23.27 O2 GOL A 200 B 223 ASP A 50 ASP.? 16.78 O2 GOL A 200 B 265 LYS A 25 LYS^? 23.71 O1 GOL A 200 coo 7.48 54.94 99.62 7.67 52.27 100.42 9.13 16.01 -1.98 11.91 15.81 -1.58 coo 10.43 61.66 91.81 9.80 60.04 90.61 2.55 11.74 5.01 1.42 10.07 5.73 coo 5.43 58.06 80.08 8.57 53.00 79.37 -8.49 20.21 -0.96 -11.35 17.51 -4.55 ULMN 3 1ax4_c05 TRYPTOPHANASE user 3 3 # 3 B 130 PHE A 107 PHE^? 17.79 O2 GOL A 200 B 223 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 265 LYS A 52 LYS.? 20.79 O2 GOL A 200 coo 7.48 54.94 99.62 7.67 52.27 100.42 3.44 27.97 2.84 5.43 28.55 0.97 coo 10.43 61.66 91.81 9.80 60.04 90.61 11.95 23.52 7.79 13.60 24.51 6.84 coo 5.43 58.06 80.08 8.57 53.00 79.37 8.29 9.60 9.80 7.06 4.86 8.55 1ax4_c05 source 1ax4 TRYPTOPHANASE : 3 hits 1ax4_c05 naa= 3 ULMN 3 1ax4_c06 TRYPTOPHANASE user 1 3 # 1 C 130 PHE A 30 PHE.? 23.27 O2 GOL A 200 C 223 ASP A 50 ASP.? 16.78 O2 GOL A 200 C 265 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo -6.55 73.45 23.60 -6.77 71.48 21.66 9.13 16.01 -1.98 11.91 15.81 -1.58 coo -9.52 75.74 33.62 -8.85 73.74 33.93 2.55 11.74 5.01 1.42 10.07 5.73 coo -4.44 67.20 42.32 -7.50 62.41 40.49 -8.73 20.02 6.97 -12.28 16.97 10.92 ULMN 3 1ax4_c06 TRYPTOPHANASE user 2 3 # 2 C 130 PHE A 30 PHE.? 23.27 O2 GOL A 200 C 223 ASP A 50 ASP.? 16.78 O2 GOL A 200 C 265 LYS A 25 LYS^? 23.71 O1 GOL A 200 coo -6.55 73.45 23.60 -6.77 71.48 21.66 9.13 16.01 -1.98 11.91 15.81 -1.58 coo -9.52 75.74 33.62 -8.85 73.74 33.93 2.55 11.74 5.01 1.42 10.07 5.73 coo -4.44 67.20 42.32 -7.50 62.41 40.49 -8.49 20.21 -0.96 -11.35 17.51 -4.55 ULMN 3 1ax4_c06 TRYPTOPHANASE user 3 3 # 3 C 130 PHE A 107 PHE^? 17.79 O2 GOL A 200 C 223 ASP A 98 ASP^? 18.38 O2 GOL A 200 C 265 LYS A 52 LYS.? 20.79 O2 GOL A 200 coo -6.55 73.45 23.60 -6.77 71.48 21.66 3.44 27.97 2.84 5.43 28.55 0.97 coo -9.52 75.74 33.62 -8.85 73.74 33.93 11.95 23.52 7.79 13.60 24.51 6.84 coo -4.44 67.20 42.32 -7.50 62.41 40.49 8.29 9.60 9.80 7.06 4.86 8.55 1ax4_c06 source 1ax4 TRYPTOPHANASE : 3 hits 1ax4_c06 naa= 3 ULMN 3 1ax4_c07 TRYPTOPHANASE user 1 3 # 1 D 130 PHE A 30 PHE.? 23.27 O2 GOL A 200 D 223 ASP A 50 ASP.? 16.78 O2 GOL A 200 D 265 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo -38.60 55.38 52.70 -40.06 57.72 53.04 9.13 16.01 -1.98 11.91 15.81 -1.58 coo -29.46 51.67 48.51 -28.63 53.31 49.56 2.55 11.74 5.01 1.42 10.07 5.73 coo -18.87 56.53 54.79 -19.47 62.22 53.03 -8.73 20.02 6.97 -12.28 16.97 10.92 ULMN 3 1ax4_c07 TRYPTOPHANASE user 2 3 # 2 D 130 PHE A 30 PHE.? 23.27 O2 GOL A 200 D 223 ASP A 50 ASP.? 16.78 O2 GOL A 200 D 265 LYS A 25 LYS^? 23.71 O1 GOL A 200 coo -38.60 55.38 52.70 -40.06 57.72 53.04 9.13 16.01 -1.98 11.91 15.81 -1.58 coo -29.46 51.67 48.51 -28.63 53.31 49.56 2.55 11.74 5.01 1.42 10.07 5.73 coo -18.87 56.53 54.79 -19.47 62.22 53.03 -8.49 20.21 -0.96 -11.35 17.51 -4.55 ULMN 3 1ax4_c07 TRYPTOPHANASE user 3 3 # 3 D 130 PHE A 107 PHE^? 17.79 O2 GOL A 200 D 223 ASP A 98 ASP^? 18.38 O2 GOL A 200 D 265 LYS A 52 LYS.? 20.79 O2 GOL A 200 coo -38.60 55.38 52.70 -40.06 57.72 53.04 3.44 27.97 2.84 5.43 28.55 0.97 coo -29.46 51.67 48.51 -28.63 53.31 49.56 11.95 23.52 7.79 13.60 24.51 6.84 coo -18.87 56.53 54.79 -19.47 62.22 53.03 8.29 9.60 9.80 7.06 4.86 8.55 1ax4_c07 source 1ax4 TRYPTOPHANASE : 3 hits 1ax4_c07 naa= 3 ULMN 3 1b57_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 # 1 A 109 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 182 GLU A 53 GLU.? 23.34 O2 GOL A 200 A 286 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo 26.03 44.66 108.90 25.67 42.61 108.82 2.55 11.74 5.01 1.42 10.07 5.73 coo 18.06 44.02 105.38 18.08 45.37 107.03 11.74 7.72 7.91 12.92 5.90 7.68 coo 25.47 38.28 112.06 27.26 39.30 111.54 6.06 16.51 6.44 7.78 15.19 6.31 1b57_c00 source 1b57 FRUCTOSE-BISPHOSPHATE ALDOLASE II : 1 hits 1b57_c00 naa= 3 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 1 3 # 1 B 109 ASP A 50 ASP.? 16.78 O2 GOL A 200 B 182 GLU A 53 GLU.? 23.34 O2 GOL A 200 B 286 ASN A 32 ASN.? 25.03 O2 GOL A 200 coo 13.82 69.26 132.27 11.87 70.14 132.51 2.55 11.74 5.01 1.42 10.07 5.73 coo 8.74 63.05 136.42 9.87 62.19 134.79 11.74 7.72 7.91 12.92 5.90 7.68 coo 8.26 72.60 129.22 10.14 73.45 129.80 2.89 10.42 -2.40 2.49 10.28 -4.45 ULMN 3 1b57_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE II user 2 3 # 2 B 109 ASP A 50 ASP.? 16.78 O2 GOL A 200 B 182 GLU A 53 GLU.? 23.34 O2 GOL A 200 B 286 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo 13.82 69.26 132.27 11.87 70.14 132.51 2.55 11.74 5.01 1.42 10.07 5.73 coo 8.74 63.05 136.42 9.87 62.19 134.79 11.74 7.72 7.91 12.92 5.90 7.68 coo 8.26 72.60 129.22 10.14 73.45 129.80 6.06 16.51 6.44 7.78 15.19 6.31 1b57_c01 source 1b57 FRUCTOSE-BISPHOSPHATE ALDOLASE II : 2 hits 1b57_c01 naa= 3 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 1 3 # 1 A 88 PHE A 47 PHE^? 16.84 O2 GOL A 200 A 159 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 188 LYS A 25 LYS^? 23.71 O1 GOL A 200 coo 13.91 34.58 14.67 12.95 36.00 12.47 3.45 22.78 2.62 3.68 24.27 0.23 coo 20.97 28.40 16.26 20.19 30.15 15.34 2.55 11.74 5.01 1.42 10.07 5.73 coo 22.55 41.65 15.60 18.92 37.20 14.63 -8.49 20.21 -0.96 -11.35 17.51 -4.55 1b9h_c02 source 1b9h 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHASE : 1 hits 1b9h_c02 naa= 3 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 A 137 ARG A 36 ARG^? 21.82 O1 GOL A 200 A 141 THR A 26 THR^? 16.88 O1 GOL A 200 A 235 ASP A 63 ASP^? 31.81 O1 GOL A 200 coo 6.21 93.81 36.58 4.58 96.33 37.17 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 6.80 92.87 28.33 4.91 92.74 27.40 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 12.98 90.36 47.57 11.26 89.62 46.62 3.02 36.19 -9.95 3.74 34.72 -11.31 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 A 137 ARG A 36 ARG^? 21.82 O1 GOL A 200 A 141 THR A 26 THR^? 16.88 O1 GOL A 200 A 235 ASP A 118 ASP^? 28.24 O2 GOL A 200 coo 6.21 93.81 36.58 4.58 96.33 37.17 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 6.80 92.87 28.33 4.91 92.74 27.40 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 12.98 90.36 47.57 11.26 89.62 46.62 11.56 28.53 -5.39 13.56 29.26 -5.43 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 A 137 ARG A 43 ARG.? -22.33 O1 GOL A 200s A 141 THR A 40 THR.? 20.70 O1 GOL A 200 A 235 ASP A 65 ASP.? 32.24 O1 GOL A 200 coo 6.21 93.81 36.58 4.58 96.33 37.17 -9.68 34.50 0.13 -8.09 37.08 0.79 coo 6.80 92.87 28.33 4.91 92.74 27.40 -10.64 28.13 0.05 -11.89 26.87 -1.24 coo 12.98 90.36 47.57 11.26 89.62 46.62 -0.73 40.47 -9.40 -0.67 38.73 -10.58 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 A 137 ARG A 44 ARG^? 10.85 O1 GOL A 200 A 141 THR A 40 THR.? 20.70 O1 GOL A 200 A 235 ASP A 73 ASP.? 11.55 O2 GOL A 200 coo 6.21 93.81 36.58 4.58 96.33 37.17 -5.22 29.17 7.22 -7.66 28.12 8.81 coo 6.80 92.87 28.33 4.91 92.74 27.40 -10.64 28.13 0.05 -11.89 26.87 -1.24 coo 12.98 90.36 47.57 11.26 89.62 46.62 7.80 28.72 11.54 7.47 28.46 13.63 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 A 137 ARG A 100 ARG.? 12.49 O2 GOL A 200 A 141 THR A 104 THR^? 8.26 O2 GOL A 200 A 235 ASP A 127 ASP.? 23.55 O3 GOL A 200 coo 6.21 93.81 36.58 4.58 96.33 37.17 10.61 20.08 13.39 10.29 23.15 12.59 coo 6.80 92.87 28.33 4.91 92.74 27.40 1.57 20.47 9.68 -0.64 20.24 9.40 coo 12.98 90.36 47.57 11.26 89.62 46.62 21.64 16.51 15.04 22.41 14.94 16.29 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 A 137 ARG A 116 ARG^? 32.03 O2 GOL A 200 A 141 THR A 119 THR^? 25.97 O2 GOL A 200 A 235 ASP A 65 ASP.? 32.24 O1 GOL A 200 coo 6.21 93.81 36.58 4.58 96.33 37.17 8.24 29.33 -11.36 11.10 28.22 -11.40 coo 6.80 92.87 28.33 4.91 92.74 27.40 13.04 24.62 -3.89 14.83 25.20 -2.71 coo 12.98 90.36 47.57 11.26 89.62 46.62 -0.73 40.47 -9.40 -0.67 38.73 -10.58 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 36 ARG^? 21.82 O1 GOL A 200 D 141 THR A 26 THR^? 16.88 O1 GOL A 200 D 235 ASP A 63 ASP^? 31.81 O1 GOL A 200 coo -8.33 92.80 100.06 -7.71 95.33 98.44 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo -9.24 93.49 108.77 -7.37 94.21 109.61 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo -14.64 87.74 89.51 -12.89 87.43 90.65 3.02 36.19 -9.95 3.74 34.72 -11.31 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 D 137 ARG A 36 ARG^? 21.82 O1 GOL A 200 D 141 THR A 26 THR^? 16.88 O1 GOL A 200 D 235 ASP A 118 ASP^? 28.24 O2 GOL A 200 coo -8.33 92.80 100.06 -7.71 95.33 98.44 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo -9.24 93.49 108.77 -7.37 94.21 109.61 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo -14.64 87.74 89.51 -12.89 87.43 90.65 11.56 28.53 -5.39 13.56 29.26 -5.43 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 D 137 ARG A 44 ARG^? 10.85 O1 GOL A 200 D 141 THR A 40 THR.? 20.70 O1 GOL A 200 D 235 ASP A 73 ASP.? 11.55 O2 GOL A 200 coo -8.33 92.80 100.06 -7.71 95.33 98.44 -5.22 29.17 7.22 -7.66 28.12 8.81 coo -9.24 93.49 108.77 -7.37 94.21 109.61 -10.64 28.13 0.05 -11.89 26.87 -1.24 coo -14.64 87.74 89.51 -12.89 87.43 90.65 7.80 28.72 11.54 7.47 28.46 13.63 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 D 137 ARG A 100 ARG.? 12.49 O2 GOL A 200 D 141 THR A 104 THR^? 8.26 O2 GOL A 200 D 235 ASP A 127 ASP.? 23.55 O3 GOL A 200 coo -8.33 92.80 100.06 -7.71 95.33 98.44 10.61 20.08 13.39 10.29 23.15 12.59 coo -9.24 93.49 108.77 -7.37 94.21 109.61 1.57 20.47 9.68 -0.64 20.24 9.40 coo -14.64 87.74 89.51 -12.89 87.43 90.65 21.64 16.51 15.04 22.41 14.94 16.29 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 D 137 ARG A 116 ARG^? 32.03 O2 GOL A 200 D 141 THR A 119 THR^? 25.97 O2 GOL A 200 D 235 ASP A 65 ASP.? 32.24 O1 GOL A 200 coo -8.33 92.80 100.06 -7.71 95.33 98.44 8.24 29.33 -11.36 11.10 28.22 -11.40 coo -9.24 93.49 108.77 -7.37 94.21 109.61 13.04 24.62 -3.89 14.83 25.20 -2.71 coo -14.64 87.74 89.51 -12.89 87.43 90.65 -0.73 40.47 -9.40 -0.67 38.73 -10.58 1bd3_c01 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 5 hits 1bd3_c01 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG A 36 ARG^? 21.82 O1 GOL A 200 C 141 THR A 26 THR^? 16.88 O1 GOL A 200 C 235 ASP A 63 ASP^? 31.81 O1 GOL A 200 coo -5.79 67.26 36.83 -4.57 64.58 37.74 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo -6.81 68.31 28.28 -4.82 68.47 27.57 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo -13.01 70.96 47.58 -11.44 71.65 46.34 3.02 36.19 -9.95 3.74 34.72 -11.31 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 C 137 ARG A 36 ARG^? 21.82 O1 GOL A 200 C 141 THR A 26 THR^? 16.88 O1 GOL A 200 C 235 ASP A 118 ASP^? 28.24 O2 GOL A 200 coo -5.79 67.26 36.83 -4.57 64.58 37.74 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo -6.81 68.31 28.28 -4.82 68.47 27.57 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo -13.01 70.96 47.58 -11.44 71.65 46.34 11.56 28.53 -5.39 13.56 29.26 -5.43 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 C 137 ARG A 44 ARG^? 10.85 O1 GOL A 200 C 141 THR A 40 THR.? 20.70 O1 GOL A 200 C 235 ASP A 73 ASP.? 11.55 O2 GOL A 200 coo -5.79 67.26 36.83 -4.57 64.58 37.74 -5.22 29.17 7.22 -7.66 28.12 8.81 coo -6.81 68.31 28.28 -4.82 68.47 27.57 -10.64 28.13 0.05 -11.89 26.87 -1.24 coo -13.01 70.96 47.58 -11.44 71.65 46.34 7.80 28.72 11.54 7.47 28.46 13.63 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 C 137 ARG A 100 ARG.? 12.49 O2 GOL A 200 C 141 THR A 104 THR^? 8.26 O2 GOL A 200 C 235 ASP A 127 ASP.? 23.55 O3 GOL A 200 coo -5.79 67.26 36.83 -4.57 64.58 37.74 10.61 20.08 13.39 10.29 23.15 12.59 coo -6.81 68.31 28.28 -4.82 68.47 27.57 1.57 20.47 9.68 -0.64 20.24 9.40 coo -13.01 70.96 47.58 -11.44 71.65 46.34 21.64 16.51 15.04 22.41 14.94 16.29 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 C 137 ARG A 116 ARG^? 32.03 O2 GOL A 200 C 141 THR A 119 THR^? 25.97 O2 GOL A 200 C 235 ASP A 65 ASP.? 32.24 O1 GOL A 200 coo -5.79 67.26 36.83 -4.57 64.58 37.74 8.24 29.33 -11.36 11.10 28.22 -11.40 coo -6.81 68.31 28.28 -4.82 68.47 27.57 13.04 24.62 -3.89 14.83 25.20 -2.71 coo -13.01 70.96 47.58 -11.44 71.65 46.34 -0.73 40.47 -9.40 -0.67 38.73 -10.58 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 5 hits 1bd3_c02 naa= 3 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 B 137 ARG A 36 ARG^? 21.82 O1 GOL A 200 B 141 THR A 26 THR^? 16.88 O1 GOL A 200 B 235 ASP A 63 ASP^? 31.81 O1 GOL A 200 coo 8.13 67.41 100.27 7.18 68.35 97.45 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 8.28 67.78 108.81 6.22 67.65 109.43 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 14.55 73.52 89.47 12.81 73.95 90.56 3.02 36.19 -9.95 3.74 34.72 -11.31 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 B 137 ARG A 36 ARG^? 21.82 O1 GOL A 200 B 141 THR A 26 THR^? 16.88 O1 GOL A 200 B 235 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo 8.13 67.41 100.27 7.18 68.35 97.45 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 8.28 67.78 108.81 6.22 67.65 109.43 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 14.55 73.52 89.47 12.81 73.95 90.56 11.95 23.52 7.79 13.60 24.51 6.84 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 B 137 ARG A 36 ARG^? 21.82 O1 GOL A 200 B 141 THR A 26 THR^? 16.88 O1 GOL A 200 B 235 ASP A 118 ASP^? 28.24 O2 GOL A 200 coo 8.13 67.41 100.27 7.18 68.35 97.45 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 8.28 67.78 108.81 6.22 67.65 109.43 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 14.55 73.52 89.47 12.81 73.95 90.56 11.56 28.53 -5.39 13.56 29.26 -5.43 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 B 137 ARG A 44 ARG^? 10.85 O1 GOL A 200 B 141 THR A 40 THR.? 20.70 O1 GOL A 200 B 235 ASP A 73 ASP.? 11.55 O2 GOL A 200 coo 8.13 67.41 100.27 7.18 68.35 97.45 -5.22 29.17 7.22 -7.66 28.12 8.81 coo 8.28 67.78 108.81 6.22 67.65 109.43 -10.64 28.13 0.05 -11.89 26.87 -1.24 coo 14.55 73.52 89.47 12.81 73.95 90.56 7.80 28.72 11.54 7.47 28.46 13.63 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 B 137 ARG A 116 ARG^? 32.03 O2 GOL A 200 B 141 THR A 119 THR^? 25.97 O2 GOL A 200 B 235 ASP A 65 ASP.? 32.24 O1 GOL A 200 coo 8.13 67.41 100.27 7.18 68.35 97.45 8.24 29.33 -11.36 11.10 28.22 -11.40 coo 8.28 67.78 108.81 6.22 67.65 109.43 13.04 24.62 -3.89 14.83 25.20 -2.71 coo 14.55 73.52 89.47 12.81 73.95 90.56 -0.73 40.47 -9.40 -0.67 38.73 -10.58 1bd3_c03 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 5 hits 1bd3_c03 naa= 3 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 1 3 # 1 14 ASP A 98 ASP^? 18.38 O2 GOL A 200 16 HIS A 57 HIS^? 21.61 O2 GOL A 200 67 GLY A 110 GLY^? -20.67 O1 GOL A 200s coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 11.95 23.52 7.79 13.60 24.51 6.84 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 13.89 24.29 2.75 14.15 26.31 2.22 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 -4.49 35.49 1.04 -4.44 34.70 0.73 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 2 3 # 2 14 ASP A 98 ASP^? 18.38 O2 GOL A 200 16 HIS A 57 HIS^? 21.61 O2 GOL A 200 67 GLY A 114 GLY.? 29.63 O1 GOL A 200 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 11.95 23.52 7.79 13.60 24.51 6.84 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 13.89 24.29 2.75 14.15 26.31 2.22 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 0.86 32.61 -10.34 0.82 32.88 -9.52 1be1_c02 source 1be1 GLUTAMATE MUTASE : 2 hits 1be1_c02 naa= 3 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 # 1 A 461 GLU A 128 GLU.? 28.51 O3 GOL A 200 A 503 TYR A 131 TYR.? 25.39 O3 GOL A 200 A 537 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo 24.06 146.21 11.09 22.89 146.18 9.36 26.16 17.92 13.68 27.91 19.15 13.73 coo 15.91 140.69 8.32 15.71 143.39 9.13 22.02 11.39 18.51 23.94 9.93 19.85 coo 16.65 144.44 13.24 18.34 145.22 12.33 20.52 12.38 10.99 21.19 10.38 10.71 1bgl_c08 source 1bgl BETA-GALACTOSIDASE : 1 hits 1bgl_c08 naa= 3 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 1 3 # 1 A 451 GLU A 128 GLU.? 28.51 O3 GOL A 200 A 504 TYR A 131 TYR.? 25.39 O3 GOL A 200 A 540 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo 81.34 87.29 87.22 82.36 86.09 88.61 26.16 17.92 13.68 27.91 19.15 13.73 coo 80.85 81.34 94.77 81.70 80.16 92.41 22.02 11.39 18.51 23.94 9.93 19.85 coo 79.94 80.46 88.84 81.11 81.36 87.27 20.52 12.38 10.99 21.19 10.38 10.71 1bhg_c02 source 1bhg BETA-GLUCURONIDASE : 1 hits 1bhg_c02 naa= 3 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 1 3 # 1 B 451 GLU A 126 GLU.? 25.70 O3 GOL A 200 B 504 TYR A 131 TYR.? 25.39 O3 GOL A 200 B 540 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 86.52 35.28 112.74 87.08 36.38 110.99 20.52 12.38 10.99 21.19 10.38 10.71 coo 84.93 40.21 105.31 85.72 41.45 107.72 22.02 11.39 18.51 23.94 9.93 19.85 coo 83.38 41.19 112.55 85.47 40.59 112.72 26.16 17.92 13.68 27.91 19.15 13.73 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 2 3 # 2 B 451 GLU A 128 GLU.? 28.51 O3 GOL A 200 B 504 TYR A 131 TYR.? 25.39 O3 GOL A 200 B 540 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo 86.52 35.28 112.74 87.08 36.38 110.99 26.16 17.92 13.68 27.91 19.15 13.73 coo 84.93 40.21 105.31 85.72 41.45 107.72 22.02 11.39 18.51 23.94 9.93 19.85 coo 83.38 41.19 112.55 85.47 40.59 112.72 20.52 12.38 10.99 21.19 10.38 10.71 1bhg_c03 source 1bhg BETA-GLUCURONIDASE : 2 hits 1bhg_c03 naa= 3 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 1 3 # 1 A 382 ARG A 123 ARG^? 24.89 O2 GOL A 200 A 451 GLU A 128 GLU.? 28.51 O3 GOL A 200 A 540 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo 79.04 80.20 80.81 79.58 81.40 83.63 18.70 18.30 6.22 21.48 19.12 7.39 coo 81.34 87.29 87.22 82.36 86.09 88.61 26.16 17.92 13.68 27.91 19.15 13.73 coo 79.94 80.46 88.84 81.11 81.36 87.27 20.52 12.38 10.99 21.19 10.38 10.71 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 2 3 # 2 A 382 ARG A 132 ARG.? 16.38 O3 GOL A 200 A 451 GLU A 128 GLU.? 28.51 O3 GOL A 200 A 540 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo 79.04 80.20 80.81 79.58 81.40 83.63 15.71 15.59 15.34 14.57 17.73 13.37 coo 81.34 87.29 87.22 82.36 86.09 88.61 26.16 17.92 13.68 27.91 19.15 13.73 coo 79.94 80.46 88.84 81.11 81.36 87.27 20.52 12.38 10.99 21.19 10.38 10.71 1bhg_c04 source 1bhg BETA-GLUCURONIDASE : 2 hits 1bhg_c04 naa= 3 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 # 1 B 382 ARG A 123 ARG^? 24.89 O2 GOL A 200 B 451 GLU A 128 GLU.? 28.51 O3 GOL A 200 B 540 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo 82.21 41.07 119.14 83.95 40.66 116.59 18.70 18.30 6.22 21.48 19.12 7.39 coo 86.52 35.28 112.74 87.08 36.38 110.99 26.16 17.92 13.68 27.91 19.15 13.73 coo 83.38 41.19 112.55 85.47 40.59 112.72 20.52 12.38 10.99 21.19 10.38 10.71 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 2 3 # 2 B 382 ARG A 129 ARG.? 30.99 O3 GOL A 200 B 451 GLU A 126 GLU.? 25.70 O3 GOL A 200 B 540 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 82.21 41.07 119.14 83.95 40.66 116.59 27.76 15.07 17.76 29.89 12.98 18.66 coo 86.52 35.28 112.74 87.08 36.38 110.99 20.52 12.38 10.99 21.19 10.38 10.71 coo 83.38 41.19 112.55 85.47 40.59 112.72 26.16 17.92 13.68 27.91 19.15 13.73 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 3 3 # 3 B 382 ARG A 132 ARG.? 16.38 O3 GOL A 200 B 451 GLU A 128 GLU.? 28.51 O3 GOL A 200 B 540 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo 82.21 41.07 119.14 83.95 40.66 116.59 15.71 15.59 15.34 14.57 17.73 13.37 coo 86.52 35.28 112.74 87.08 36.38 110.99 26.16 17.92 13.68 27.91 19.15 13.73 coo 83.38 41.19 112.55 85.47 40.59 112.72 20.52 12.38 10.99 21.19 10.38 10.71 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 3 hits 1bhg_c05 naa= 3 ULMN 3 1bib_c00 BIRA BIFUNCTIONAL PROTEIN (ACTS AS Buser 1 3 # 1 118 ARG A 123 ARG^? 24.89 O2 GOL A 200 183 LYS A 52 LYS.? 20.79 O2 GOL A 200 317 ARG A 36 ARG^? 21.82 O1 GOL A 200 coo 76.57 109.19 73.41 73.86 110.26 72.16 18.70 18.30 6.22 21.48 19.12 7.39 coo 82.09 117.51 66.37 80.60 114.32 71.44 8.29 9.60 9.80 7.06 4.86 8.55 coo 65.21 120.62 58.76 63.62 123.14 59.66 -0.18 23.83 -2.35 -2.28 23.74 -4.54 1bib_c00 source 1bib BIRA BIFUNCTIONAL PROTEIN (ACTS AS BIOTIN OPER: 1 hits 1bib_c00 naa= 3 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 # 1 B 325 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 354 GLU A 96 GLU^? 22.95 O2 GOL A 200 B 421 ASP A 118 ASP^? 28.24 O2 GOL A 200 coo 25.90 8.19 53.87 25.36 6.97 52.29 11.95 23.52 7.79 13.60 24.51 6.84 coo 27.87 10.66 47.95 27.82 8.60 48.27 12.01 30.07 3.21 14.10 30.25 2.56 coo 26.02 1.87 43.38 25.90 1.97 45.49 11.56 28.53 -5.39 13.56 29.26 -5.43 1bvz_c09 source 1bvz ALPHA-AMYLASE II : 1 hits 1bvz_c09 naa= 3 ULMN 3 1bwd_c02 INOSAMINE-PHOSPHATE AMIDINOTRANSFERAuser 1 3 # 1 A 179 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 227 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 332 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 123.98 30.59 1.90 124.68 28.67 1.28 11.95 23.52 7.79 13.60 24.51 6.84 coo 119.16 28.51 2.63 120.67 28.31 1.13 13.89 24.29 2.75 14.15 26.31 2.22 coo 114.70 31.13 -3.42 115.96 29.28 -1.69 8.07 32.08 0.96 5.72 33.61 0.99 1bwd_c02 source 1bwd INOSAMINE-PHOSPHATE AMIDINOTRANSFERASE : 1 hits 1bwd_c02 naa= 3 ULMN 3 1bwd_c03 INOSAMINE-PHOSPHATE AMIDINOTRANSFERAuser 1 3 # 1 B 179 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 227 HIS A 57 HIS^? 21.61 O2 GOL A 200 B 332 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 94.18 76.57 24.23 93.74 77.97 22.66 11.95 23.52 7.79 13.60 24.51 6.84 coo 89.34 74.44 23.40 90.11 76.41 23.55 13.89 24.29 2.75 14.15 26.31 2.22 coo 85.03 76.39 29.77 85.85 76.14 27.06 8.07 32.08 0.96 5.72 33.61 0.99 1bwd_c03 source 1bwd INOSAMINE-PHOSPHATE AMIDINOTRANSFERASE : 1 hits 1bwd_c03 naa= 3 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 1 3 # 1 71 ARG A 100 ARG.? 12.49 O2 GOL A 200 127 ARG A 132 ARG.? 16.38 O3 GOL A 200 270 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -0.83 25.63 1.57 0.97 28.05 0.90 10.61 20.08 13.39 10.29 23.15 12.59 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 15.71 15.59 15.34 14.57 17.73 13.37 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 11.74 7.72 7.91 12.92 5.90 7.68 ULMN 3 1cbx_c01 CARBOXYPEPTIDASE A (E.C.3.4.17.1) COuser 2 3 # 2 71 ARG A 132 ARG.? 16.38 O3 GOL A 200 127 ARG A 100 ARG.? 12.49 O2 GOL A 200 270 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -0.83 25.63 1.57 0.97 28.05 0.90 15.71 15.59 15.34 14.57 17.73 13.37 coo 2.68 26.75 -2.61 1.18 28.07 -5.02 10.61 20.08 13.39 10.29 23.15 12.59 coo -7.78 30.85 -7.94 -6.11 29.80 -7.25 11.74 7.72 7.91 12.92 5.90 7.68 1cbx_c01 source 1cbx CARBOXYPEPTIDASE A (E.C.3.4.17.1) COMPLEX WITH: 2 hits 1cbx_c01 naa= 3 ULMN 3 1cjy_c00 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 A 198 GLY A 114 GLY.? 29.63 O1 GOL A 200 A 228 SER A 66 SER.? 26.83 O1 GOL A 200 A 549 ASP A 65 ASP.? 32.24 O1 GOL A 200 coo 43.62 -9.31 54.06 43.04 -9.29 54.58 0.86 32.61 -10.34 0.82 32.88 -9.52 coo 45.99 -4.81 58.63 47.02 -6.84 57.75 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 51.69 -5.84 58.91 49.67 -6.52 58.93 -0.73 40.47 -9.40 -0.67 38.73 -10.58 1cjy_c00 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 1 hits 1cjy_c00 naa= 3 ULMN 3 1cjy_c01 CYTOSOLIC PHOSPHOLIPASE A2 user 1 3 # 1 B1198 GLY A 110 GLY^? -20.67 O1 GOL A 200s B1228 SER A 66 SER.? 26.83 O1 GOL A 200 B1549 ASP A 65 ASP.? 32.24 O1 GOL A 200 coo 126.34 72.75 125.66 125.95 73.27 126.11 -4.49 35.49 1.04 -4.44 34.70 0.73 coo 131.65 74.68 129.41 130.31 72.73 128.82 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 134.72 69.43 130.42 133.03 70.65 130.08 -0.73 40.47 -9.40 -0.67 38.73 -10.58 1cjy_c01 source 1cjy CYTOSOLIC PHOSPHOLIPASE A2 : 1 hits 1cjy_c01 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 35 TYR^? 18.28 O2 GOL A 200 A 173 ASP A 50 ASP.? 16.78 O2 GOL A 200 C 48 ARG A 36 ARG^? 21.82 O1 GOL A 200 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 -0.13 15.22 1.35 0.07 12.52 0.73 coo 24.35 4.55 25.11 25.94 3.23 25.53 2.55 11.74 5.01 1.42 10.07 5.73 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 -0.18 23.83 -2.35 -2.28 23.74 -4.54 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c00 naa= 3 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 48 ARG A 36 ARG^? 21.82 O1 GOL A 200 C 101 TYR A 35 TYR^? 18.28 O2 GOL A 200 C 173 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 32.27 5.62 48.15 31.93 6.48 51.06 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 29.64 3.64 57.39 31.22 5.14 55.65 -0.13 15.22 1.35 0.07 12.52 0.73 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 2.55 11.74 5.01 1.42 10.07 5.73 1cs1_c01 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c01 naa= 3 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 48 ARG A 36 ARG^? 21.82 O1 GOL A 200 D 101 TYR A 35 TYR^? 18.28 O2 GOL A 200 D 173 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 69.08 8.58 32.60 69.70 10.81 30.58 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 71.77 11.86 24.26 70.23 12.22 26.56 -0.13 15.22 1.35 0.07 12.52 0.73 coo 71.60 6.14 19.25 70.26 6.87 20.69 2.55 11.74 5.01 1.42 10.07 5.73 1cs1_c02 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c02 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 35 TYR^? 18.28 O2 GOL A 200 B 173 ASP A 50 ASP.? 16.78 O2 GOL A 200 D 48 ARG A 36 ARG^? 21.82 O1 GOL A 200 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 -0.13 15.22 1.35 0.07 12.52 0.73 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 2.55 11.74 5.01 1.42 10.07 5.73 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 -0.18 23.83 -2.35 -2.28 23.74 -4.54 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1cs1_c03 naa= 3 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 # 1 A 37 ASP A 65 ASP.? 32.24 O1 GOL A 200 A 56 ILE A 68 ILE^? 22.01 O1 GOL A 200 A 82 TYR A 93 TYR^? 27.86 O1 GOL A 200 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 -0.73 40.47 -9.40 -0.67 38.73 -10.58 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 0.19 35.76 0.13 0.71 34.94 -0.79 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 5.50 38.33 -2.98 4.27 40.74 -3.60 1d6o_c00 source 1d6o FK506-BINDING PROTEIN : 1 hits 1d6o_c00 naa= 3 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 # 1 B 37 ASP A 65 ASP.? 32.24 O1 GOL A 200 B 56 ILE A 68 ILE^? 22.01 O1 GOL A 200 B 82 TYR A 93 TYR^? 27.86 O1 GOL A 200 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 -0.73 40.47 -9.40 -0.67 38.73 -10.58 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 0.19 35.76 0.13 0.71 34.94 -0.79 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 5.50 38.33 -2.98 4.27 40.74 -3.60 1d6o_c01 source 1d6o FK506-BINDING PROTEIN : 1 hits 1d6o_c01 naa= 3 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 A 145 LYS A 18 LYS.? 10.82 O1 GOL A 200 A 177 GLU A 103 GLU.? 9.69 O2 GOL A 200 A 201 LEU A 102 LEU.? 12.55 O2 GOL A 200 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 -2.73 13.36 9.72 -7.58 13.32 13.61 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 5.18 20.01 12.20 7.16 20.80 12.53 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 4.06 13.15 11.74 4.33 11.03 11.28 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 2 3 # 2 A 145 LYS A 52 LYS.? 20.79 O2 GOL A 200 A 177 GLU A 103 GLU.? 9.69 O2 GOL A 200 A 201 LEU A 102 LEU.? 12.55 O2 GOL A 200 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 8.29 9.60 9.80 7.06 4.86 8.55 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 5.18 20.01 12.20 7.16 20.80 12.53 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 4.06 13.15 11.74 4.33 11.03 11.28 1daa_c00 source 1daa D-AMINO ACID AMINOTRANSFERASE : 2 hits 1daa_c00 naa= 3 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 B 145 LYS A 18 LYS.? 10.82 O1 GOL A 200 B 177 GLU A 103 GLU.? 9.69 O2 GOL A 200 B 201 LEU A 102 LEU.? 12.55 O2 GOL A 200 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 -2.73 13.36 9.72 -7.58 13.32 13.61 coo 27.00 6.35 51.01 26.30 4.53 50.18 5.18 20.01 12.20 7.16 20.80 12.53 coo 23.74 1.68 49.50 22.87 -0.24 49.97 4.06 13.15 11.74 4.33 11.03 11.28 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 2 3 # 2 B 145 LYS A 52 LYS.? 20.79 O2 GOL A 200 B 177 GLU A 103 GLU.? 9.69 O2 GOL A 200 B 201 LEU A 102 LEU.? 12.55 O2 GOL A 200 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 8.29 9.60 9.80 7.06 4.86 8.55 coo 27.00 6.35 51.01 26.30 4.53 50.18 5.18 20.01 12.20 7.16 20.80 12.53 coo 23.74 1.68 49.50 22.87 -0.24 49.97 4.06 13.15 11.74 4.33 11.03 11.28 1daa_c01 source 1daa D-AMINO ACID AMINOTRANSFERASE : 2 hits 1daa_c01 naa= 3 ULMN 3 1db3_c01 GDP-MANNOSE 4,6-DEHYDRATASE user 1 3 # 1 A 132 THR A 13 THR.? 22.16 O2 GOL A 200 A 156 TYR A 48 TYR^? 12.35 O2 GOL A 200 A 160 LYS A 18 LYS.? 10.82 O1 GOL A 200 coo 10.50 56.87 17.73 11.24 57.93 19.43 -4.60 8.50 2.06 -5.42 6.45 2.07 coo 11.64 63.07 23.95 11.76 62.47 21.20 0.42 16.28 6.68 0.66 13.80 7.88 coo 5.78 61.30 21.65 8.04 62.89 17.54 -2.73 13.36 9.72 -7.58 13.32 13.61 ULMN 3 1db3_c01 GDP-MANNOSE 4,6-DEHYDRATASE user 2 3 # 2 A 132 THR A 20 THR.? 5.12 O2 GOL A 200 A 156 TYR A 48 TYR^? 12.35 O2 GOL A 200 A 160 LYS A 18 LYS.? 10.82 O1 GOL A 200 coo 10.50 56.87 17.73 11.24 57.93 19.43 -3.94 19.29 11.99 -2.19 20.21 12.75 coo 11.64 63.07 23.95 11.76 62.47 21.20 0.42 16.28 6.68 0.66 13.80 7.88 coo 5.78 61.30 21.65 8.04 62.89 17.54 -2.73 13.36 9.72 -7.58 13.32 13.61 1db3_c01 source 1db3 GDP-MANNOSE 4,6-DEHYDRATASE : 2 hits 1db3_c01 naa= 3 ULMN 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 57 GLU A 121 GLU^? 27.36 O2 GOL A 200 A 226 THR A 26 THR^? 16.88 O1 GOL A 200 A 229 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 9.66 102.78 70.07 9.79 101.18 71.42 16.93 19.57 -0.26 18.29 20.31 -1.73 coo 7.24 97.46 49.60 8.11 95.69 48.80 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 10.53 97.56 43.71 9.33 93.71 47.17 -8.73 20.02 6.97 -12.28 16.97 10.92 1dfo_c04 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c04 naa= 3 ULMN 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 57 GLU A 121 GLU^? 27.36 O2 GOL A 200 B 226 THR A 26 THR^? 16.88 O1 GOL A 200 B 229 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 15.90 87.61 49.61 13.92 86.96 49.36 16.93 19.57 -0.26 18.29 20.31 -1.73 coo 20.74 95.78 68.68 19.29 96.84 69.83 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 22.32 101.61 71.64 17.89 98.63 71.55 -8.73 20.02 6.97 -12.28 16.97 10.92 1dfo_c05 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c05 naa= 3 ULMN 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 57 GLU A 121 GLU^? 27.36 O2 GOL A 200 C 226 THR A 26 THR^? 16.88 O1 GOL A 200 C 229 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 5.43 40.40 61.63 4.27 41.99 60.90 16.93 19.57 -0.26 18.29 20.31 -1.73 coo 22.16 45.88 73.63 23.23 47.70 73.25 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 28.90 45.91 73.55 25.22 49.72 72.97 -8.73 20.02 6.97 -12.28 16.97 10.92 1dfo_c06 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c06 naa= 3 ULMN 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 57 GLU A 121 GLU^? 27.36 O2 GOL A 200 D 226 THR A 26 THR^? 16.88 O1 GOL A 200 D 229 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 26.07 55.89 66.14 25.33 56.50 68.01 16.93 19.57 -0.26 18.29 20.31 -1.73 coo 11.79 47.62 52.67 10.10 46.51 53.39 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 10.05 41.79 49.80 7.94 44.71 53.76 -8.73 20.02 6.97 -12.28 16.97 10.92 1dfo_c07 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c07 naa= 3 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 123 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 200 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 229 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 1.13 77.49 40.64 0.62 75.57 39.98 13.89 24.29 2.75 14.15 26.31 2.22 coo 0.84 91.24 49.01 2.91 91.61 49.23 2.55 11.74 5.01 1.42 10.07 5.73 coo 10.53 97.56 43.71 9.33 93.71 47.17 -8.73 20.02 6.97 -12.28 16.97 10.92 1dfo_c12 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c12 naa= 3 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 123 HIS A 57 HIS^? 21.61 O2 GOL A 200 B 200 ASP A 50 ASP.? 16.78 O2 GOL A 200 B 229 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 9.24 94.26 88.22 8.02 94.07 89.92 13.89 24.29 2.75 14.15 26.31 2.22 coo 17.54 90.31 75.01 17.17 92.01 73.80 2.55 11.74 5.01 1.42 10.07 5.73 coo 22.32 101.61 71.64 17.89 98.63 71.55 -8.73 20.02 6.97 -12.28 16.97 10.92 1dfo_c13 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c13 naa= 3 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 123 HIS A 57 HIS^? 21.61 O2 GOL A 200 C 200 ASP A 50 ASP.? 16.78 O2 GOL A 200 C 229 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 26.77 65.84 83.49 27.06 67.76 84.27 13.89 24.29 2.75 14.15 26.31 2.22 coo 19.52 52.01 79.59 20.28 51.65 77.65 2.55 11.74 5.01 1.42 10.07 5.73 coo 28.90 45.91 73.55 25.22 49.72 72.97 -8.73 20.02 6.97 -12.28 16.97 10.92 1dfo_c14 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c14 naa= 3 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 123 HIS A 57 HIS^? 21.61 O2 GOL A 200 D 200 ASP A 50 ASP.? 16.78 O2 GOL A 200 D 229 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo -10.90 48.74 53.41 -12.98 48.90 53.67 13.89 24.29 2.75 14.15 26.31 2.22 coo 4.60 52.95 52.50 5.57 51.29 53.40 2.55 11.74 5.01 1.42 10.07 5.73 coo 10.05 41.79 49.80 7.94 44.71 53.76 -8.73 20.02 6.97 -12.28 16.97 10.92 1dfo_c15 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c15 naa= 3 ULMN 3 1dhp_c02 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 A 44 THR A 75 THR^? 19.70 O2 GOL A 200 A 45 THR A 74 THR.? 16.16 O2 GOL A 200 A 161 LYS A 92 LYS^? 33.34 O2 GOL A 200 coo 26.16 88.25 79.16 25.22 89.47 80.71 9.82 33.32 6.14 11.61 32.26 6.74 coo 27.73 89.90 76.08 29.24 91.46 75.95 7.21 30.76 7.25 5.82 30.33 5.70 coo 33.83 91.15 88.62 31.07 91.06 83.02 8.12 38.10 -6.78 6.81 35.86 -11.65 1dhp_c02 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 1 hits 1dhp_c02 naa= 3 ULMN 3 1dhp_c03 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 B 44 THR A 75 THR^? 19.70 O2 GOL A 200 B 45 THR A 74 THR.? 16.16 O2 GOL A 200 B 161 LYS A 92 LYS^? 33.34 O2 GOL A 200 coo 7.39 128.28 94.56 8.34 126.36 94.79 9.82 33.32 6.14 11.61 32.26 6.74 coo 5.75 129.25 91.25 4.29 128.16 90.07 7.21 30.76 7.25 5.82 30.33 5.70 coo -0.17 119.75 99.65 2.51 123.83 95.70 8.12 38.10 -6.78 6.81 35.86 -11.65 1dhp_c03 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 1 hits 1dhp_c03 naa= 3 ULMN 3 1dhr_c00 DIHYDROPTERIDINE REDUCTASE (DHPR) (Euser 1 3 # 1 146 TYR A 27 TYR^? 22.06 O1 GOL A 200 150 LYS A 25 LYS^? 23.71 O1 GOL A 200 186 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo 32.88 50.55 24.33 31.89 51.78 26.65 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo 27.04 52.42 22.30 26.88 49.99 27.00 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 36.98 50.30 37.29 35.85 50.29 35.50 6.06 16.51 6.44 7.78 15.19 6.31 1dhr_c00 source 1dhr DIHYDROPTERIDINE REDUCTASE (DHPR) (E.C.1.6.99.: 1 hits 1dhr_c00 naa= 3 ULMN 3 1do8_c00 MALIC ENZYME user 1 3 # 1 A 112 TYR A 27 TYR^? 22.06 O1 GOL A 200 A 183 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 278 ASP A 39 ASP^? -14.64 O1 GOL A 200s coo 19.43 18.53 42.32 17.66 18.80 40.15 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo 21.92 15.80 36.19 17.64 19.44 36.35 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 15.46 19.03 31.40 15.01 18.25 33.31 -8.43 26.08 3.91 -10.39 26.34 4.84 1do8_c00 source 1do8 MALIC ENZYME : 1 hits 1do8_c00 naa= 3 ULMN 3 1do8_c01 MALIC ENZYME user 1 3 # 1 B 112 TYR A 27 TYR^? 22.06 O1 GOL A 200 B 183 LYS A 25 LYS^? 23.71 O1 GOL A 200 B 278 ASP A 39 ASP^? -14.64 O1 GOL A 200s coo 58.62 15.99 58.34 60.98 14.60 58.93 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo 60.11 10.60 53.63 62.59 10.74 58.67 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 66.50 7.32 58.45 66.26 9.42 58.23 -8.43 26.08 3.91 -10.39 26.34 4.84 1do8_c01 source 1do8 MALIC ENZYME : 1 hits 1do8_c01 naa= 3 ULMN 3 1do8_c02 MALIC ENZYME user 1 3 # 1 C 112 TYR A 27 TYR^? 22.06 O1 GOL A 200 C 183 LYS A 25 LYS^? 23.71 O1 GOL A 200 C 278 ASP A 39 ASP^? -14.64 O1 GOL A 200s coo 76.02 -16.57 8.89 78.24 -15.17 9.87 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo 74.18 -11.17 13.22 79.08 -11.19 10.47 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 82.27 -7.93 13.54 81.93 -10.04 13.72 -8.43 26.08 3.91 -10.39 26.34 4.84 1do8_c02 source 1do8 MALIC ENZYME : 1 hits 1do8_c02 naa= 3 ULMN 3 1do8_c03 MALIC ENZYME user 1 3 # 1 D 112 TYR A 27 TYR^? 22.06 O1 GOL A 200 D 183 LYS A 25 LYS^? 23.71 O1 GOL A 200 D 278 ASP A 39 ASP^? -14.64 O1 GOL A 200s coo 35.64 -19.32 -3.24 32.92 -19.55 -2.64 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo 33.51 -16.63 3.10 30.11 -20.23 0.26 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 25.62 -19.94 2.86 26.44 -19.16 1.09 -8.43 26.08 3.91 -10.39 26.34 4.84 1do8_c03 source 1do8 MALIC ENZYME : 1 hits 1do8_c03 naa= 3 ULMN 3 1dub_c13 2-ENOYL-COA HYDRATASE user 1 3 # 1 B 141 GLY A 130 GLY.? 26.17 O3 GOL A 200 B 144 GLU A 126 GLU.? 25.70 O3 GOL A 200 B 164 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 88.87 114.43 152.30 88.45 115.15 152.32 23.18 11.09 13.68 23.06 11.47 14.30 coo 85.20 111.99 152.05 86.60 110.89 150.91 20.52 12.38 10.99 21.19 10.38 10.71 coo 88.14 113.46 145.73 86.79 113.92 147.30 26.16 17.92 13.68 27.91 19.15 13.73 1dub_c13 source 1dub 2-ENOYL-COA HYDRATASE : 1 hits 1dub_c13 naa= 3 ULMN 3 1dub_c14 2-ENOYL-COA HYDRATASE user 1 3 # 1 C 141 GLY A 130 GLY.? 26.17 O3 GOL A 200 C 144 GLU A 126 GLU.? 25.70 O3 GOL A 200 C 164 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 56.28 104.55 135.84 56.09 105.34 136.05 23.18 11.09 13.68 23.06 11.47 14.30 coo 58.46 103.90 139.48 57.57 102.00 139.16 20.52 12.38 10.99 21.19 10.38 10.71 coo 51.71 102.03 140.09 53.02 103.62 140.54 26.16 17.92 13.68 27.91 19.15 13.73 1dub_c14 source 1dub 2-ENOYL-COA HYDRATASE : 1 hits 1dub_c14 naa= 3 ULMN 3 1dub_c15 2-ENOYL-COA HYDRATASE user 1 3 # 1 D 141 GLY A 130 GLY.? 26.17 O3 GOL A 200 D 144 GLU A 126 GLU.? 25.70 O3 GOL A 200 D 164 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 86.19 80.64 132.77 86.38 79.85 132.93 23.18 11.09 13.68 23.06 11.47 14.30 coo 84.75 81.24 136.88 85.62 83.14 136.43 20.52 12.38 10.99 21.19 10.38 10.71 coo 91.47 83.05 136.24 90.35 81.38 136.84 26.16 17.92 13.68 27.91 19.15 13.73 1dub_c15 source 1dub 2-ENOYL-COA HYDRATASE : 1 hits 1dub_c15 naa= 3 ULMN 3 1dub_c16 2-ENOYL-COA HYDRATASE user 1 3 # 1 E 141 GLY A 130 GLY.? 26.17 O3 GOL A 200 E 144 GLU A 126 GLU.? 25.70 O3 GOL A 200 E 164 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 90.07 81.07 170.50 90.23 80.26 170.38 23.18 11.09 13.68 23.06 11.47 14.30 coo 87.05 81.30 167.53 86.38 82.74 168.94 20.52 12.38 10.99 21.19 10.38 10.71 coo 84.40 80.02 173.80 85.08 79.06 172.03 26.16 17.92 13.68 27.91 19.15 13.73 1dub_c16 source 1dub 2-ENOYL-COA HYDRATASE : 1 hits 1dub_c16 naa= 3 ULMN 3 1dub_c17 2-ENOYL-COA HYDRATASE user 1 3 # 1 F 141 GLY A 130 GLY.? 26.17 O3 GOL A 200 F 144 GLU A 126 GLU.? 25.70 O3 GOL A 200 F 164 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 57.12 70.68 155.10 57.52 69.95 155.02 23.18 11.09 13.68 23.06 11.47 14.30 coo 60.62 73.13 154.21 59.05 74.26 153.35 20.52 12.38 10.99 21.19 10.38 10.71 coo 56.75 71.71 148.46 58.44 71.01 149.54 26.16 17.92 13.68 27.91 19.15 13.73 1dub_c17 source 1dub 2-ENOYL-COA HYDRATASE : 1 hits 1dub_c17 naa= 3 ULMN 3 1e19_c00 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 1 3 # 1 A 131 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 215 LYS A 18 LYS.? 10.82 O1 GOL A 200 A 277 LYS A 15 LYS.? 25.07 O2 GOL A 200 coo 0.50 24.09 51.68 1.51 29.34 52.35 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 13.06 30.79 51.73 11.40 35.76 53.48 -2.73 13.36 9.72 -7.58 13.32 13.61 coo 13.04 31.88 60.72 10.57 35.34 57.49 0.11 6.41 5.99 2.13 3.29 0.85 1e19_c00 source 1e19 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPHATE SYNTH: 1 hits 1e19_c00 naa= 3 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 1 3 # 1 B 131 LYS A 25 LYS^? 23.71 O1 GOL A 200 B 215 LYS A 18 LYS.? 10.82 O1 GOL A 200 B 277 LYS A 15 LYS.? 25.07 O2 GOL A 200 coo 6.78 45.91 16.15 7.82 40.81 15.84 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 17.88 38.77 19.81 16.38 34.23 17.24 -2.73 13.36 9.72 -7.58 13.32 13.61 coo 20.33 37.78 11.20 16.77 34.53 13.47 0.11 6.41 5.99 2.13 3.29 0.85 1e19_c01 source 1e19 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPHATE SYNTH: 1 hits 1e19_c01 naa= 3 ULMN 3 1ehy_c00 SOLUBLE EPOXIDE HYDROLASE user 1 3 # 1 A 107 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 246 ASP A 118 ASP^? 28.24 O2 GOL A 200 A 275 HIS A 57 HIS^? 21.61 O2 GOL A 200 coo 28.44 37.56 46.79 26.87 37.11 48.10 11.95 23.52 7.79 13.60 24.51 6.84 coo 22.84 50.35 52.24 23.24 48.32 52.90 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 26.67 42.94 48.26 27.49 41.07 48.73 13.89 24.29 2.75 14.15 26.31 2.22 1ehy_c00 source 1ehy SOLUBLE EPOXIDE HYDROLASE : 1 hits 1ehy_c00 naa= 3 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 38 THR A 26 THR^? 16.88 O1 GOL A 200 A 159 LYS A 18 LYS.? 10.82 O1 GOL A 200 A 193 GLU A 103 GLU.? 9.69 O2 GOL A 200 coo -2.58 16.31 54.79 -4.02 14.93 55.64 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 2.10 10.68 61.44 -2.14 13.16 60.61 -2.73 13.36 9.72 -7.58 13.32 13.61 coo -5.33 11.71 69.72 -4.62 11.92 67.73 5.18 20.01 12.20 7.16 20.80 12.53 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 2 3 # 2 A 38 THR A 26 THR^? 16.88 O1 GOL A 200 A 159 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 193 GLU A 41 GLU.? 19.50 O1 GOL A 200 coo -2.58 16.31 54.79 -4.02 14.93 55.64 -5.29 18.27 -0.47 -5.00 17.12 1.36 coo 2.10 10.68 61.44 -2.14 13.16 60.61 -8.73 20.02 6.97 -12.28 16.97 10.92 coo -5.33 11.71 69.72 -4.62 11.92 67.73 -14.51 29.62 4.94 -16.64 30.06 4.84 ULMN 3 1et0_c02 4-AMINO-4-DEOXYCHORISMATE LYASE user 3 3 # 3 A 38 THR A 124 THR^? 24.56 O2 GOL A 200 A 159 LYS A 52 LYS.? 20.79 O2 GOL A 200 A 193 GLU A 103 GLU.? 9.69 O2 GOL A 200 coo -2.58 16.31 54.79 -4.02 14.93 55.64 16.78 12.69 7.16 18.55 11.42 7.01 coo 2.10 10.68 61.44 -2.14 13.16 60.61 8.29 9.60 9.80 7.06 4.86 8.55 coo -5.33 11.71 69.72 -4.62 11.92 67.73 5.18 20.01 12.20 7.16 20.80 12.53 1et0_c02 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 3 hits 1et0_c02 naa= 3 ULMN 3 1euy_c00 GLUTAMINYL-TRNA SYNTHETASE user 1 3 # 1 A 34 GLU A 41 GLU.? 19.50 O1 GOL A 200 A 260 ARG A 36 ARG^? 21.82 O1 GOL A 200 A 270 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 50.99 29.43 12.86 52.11 29.45 14.65 -14.51 29.62 4.94 -16.64 30.06 4.84 coo 39.80 27.50 22.98 42.20 26.56 21.34 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 48.83 21.70 19.50 47.44 24.99 15.25 -8.73 20.02 6.97 -12.28 16.97 10.92 1euy_c00 source 1euy GLUTAMINYL-TRNA SYNTHETASE : 1 hits 1euy_c00 naa= 3 ULMN 3 1fc4_c02 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 112 PHE A 47 PHE^? 16.84 O2 GOL A 200 A 210 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 244 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 9.23 46.77 25.11 11.48 48.39 24.76 3.45 22.78 2.62 3.68 24.27 0.23 coo 10.51 37.86 19.71 9.07 39.38 20.04 2.55 11.74 5.01 1.42 10.07 5.73 coo -1.20 42.34 17.67 3.19 45.13 19.06 -8.73 20.02 6.97 -12.28 16.97 10.92 1fc4_c02 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 1 hits 1fc4_c02 naa= 3 ULMN 3 1fc4_c03 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 112 PHE A 47 PHE^? 16.84 O2 GOL A 200 B 210 ASP A 50 ASP.? 16.78 O2 GOL A 200 B 244 LYS A 22 LYS.? 12.21 O1 GOL A 200 coo 8.76 47.85 34.91 11.08 46.36 35.41 3.45 22.78 2.62 3.68 24.27 0.23 coo 9.06 56.85 40.30 7.71 55.27 39.90 2.55 11.74 5.01 1.42 10.07 5.73 coo -2.38 51.82 41.62 2.07 49.19 40.42 -8.73 20.02 6.97 -12.28 16.97 10.92 1fc4_c03 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 1 hits 1fc4_c03 naa= 3 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 137 TYR A 27 TYR^? 22.06 O1 GOL A 200 A 142 LEU A 34 LEU^? 17.94 O2 GOL A 200 A 165 LYS A 25 LYS^? 23.71 O1 GOL A 200 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 5.48 17.42 0.72 5.75 19.38 1.71 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 -8.49 20.21 -0.96 -11.35 17.51 -4.55 ULMN 3 1fdy_c00 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 137 TYR A 48 TYR^? 12.35 O2 GOL A 200 A 142 LEU A 34 LEU^? 17.94 O2 GOL A 200 A 165 LYS A 18 LYS.? 10.82 O1 GOL A 200 coo -38.10 -88.84 -25.29 -37.86 -86.12 -24.64 0.42 16.28 6.68 0.66 13.80 7.88 coo -32.09 -82.74 -22.70 -32.91 -80.79 -22.33 5.48 17.42 0.72 5.75 19.38 1.71 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 -2.73 13.36 9.72 -7.58 13.32 13.61 1fdy_c00 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c00 naa= 3 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 137 TYR A 27 TYR^? 22.06 O1 GOL A 200 B 142 LEU A 34 LEU^? 17.94 O2 GOL A 200 B 165 LYS A 25 LYS^? 23.71 O1 GOL A 200 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 5.48 17.42 0.72 5.75 19.38 1.71 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 -8.49 20.21 -0.96 -11.35 17.51 -4.55 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 137 TYR A 48 TYR^? 12.35 O2 GOL A 200 B 142 LEU A 34 LEU^? 17.94 O2 GOL A 200 B 165 LYS A 18 LYS.? 10.82 O1 GOL A 200 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 0.42 16.28 6.68 0.66 13.80 7.88 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 5.48 17.42 0.72 5.75 19.38 1.71 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 -2.73 13.36 9.72 -7.58 13.32 13.61 1fdy_c01 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c01 naa= 3 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 137 TYR A 48 TYR^? 12.35 O2 GOL A 200 C 142 LEU A 34 LEU^? 17.94 O2 GOL A 200 C 165 LYS A 18 LYS.? 10.82 O1 GOL A 200 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 0.42 16.28 6.68 0.66 13.80 7.88 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 5.48 17.42 0.72 5.75 19.38 1.71 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 -2.73 13.36 9.72 -7.58 13.32 13.61 1fdy_c02 source 1fdy N-ACETYLNEURAMINATE LYASE : 1 hits 1fdy_c02 naa= 3 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 D 137 TYR A 27 TYR^? 22.06 O1 GOL A 200 D 142 LEU A 34 LEU^? 17.94 O2 GOL A 200 D 165 LYS A 25 LYS^? 23.71 O1 GOL A 200 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 5.48 17.42 0.72 5.75 19.38 1.71 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 -8.49 20.21 -0.96 -11.35 17.51 -4.55 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 137 TYR A 48 TYR^? 12.35 O2 GOL A 200 D 142 LEU A 34 LEU^? 17.94 O2 GOL A 200 D 165 LYS A 18 LYS.? 10.82 O1 GOL A 200 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 0.42 16.28 6.68 0.66 13.80 7.88 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 5.48 17.42 0.72 5.75 19.38 1.71 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 -2.73 13.36 9.72 -7.58 13.32 13.61 1fdy_c03 source 1fdy N-ACETYLNEURAMINATE LYASE : 2 hits 1fdy_c03 naa= 3 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 129 ARG.? 30.99 O3 GOL A 200 A 136 GLU A 126 GLU.? 25.70 O3 GOL A 200 A 246 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 13.48 30.30 107.06 11.75 30.99 109.44 27.76 15.07 17.76 29.89 12.98 18.66 coo 9.46 32.37 115.82 8.50 34.20 115.47 20.52 12.38 10.99 21.19 10.38 10.71 coo 11.99 34.33 109.92 10.08 34.19 110.77 26.16 17.92 13.68 27.91 19.15 13.73 1fhl_c00 source 1fhl BETA-1,4-GALACTANASE : 1 hits 1fhl_c00 naa= 3 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 129 ARG.? 30.99 O3 GOL A 200 A 136 GLU A 126 GLU.? 25.70 O3 GOL A 200 A 246 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 13.94 29.84 106.80 11.67 30.40 108.79 27.76 15.07 17.76 29.89 12.98 18.66 coo 9.52 31.97 115.23 8.45 33.74 114.72 20.52 12.38 10.99 21.19 10.38 10.71 coo 11.92 33.82 109.35 10.10 33.50 110.39 26.16 17.92 13.68 27.91 19.15 13.73 1fob_c00 source 1fob BETA-1,4-GALACTANASE : 1 hits 1fob_c00 naa= 3 ULMN 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 A 317 GLU A 96 GLU^? 22.95 O2 GOL A 200 A 319 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 359 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo 14.41 12.40 16.42 12.92 13.74 15.71 12.01 30.07 3.21 14.10 30.25 2.56 coo 12.25 13.04 23.85 11.56 15.02 23.93 11.95 23.52 7.79 13.60 24.51 6.84 coo 10.89 14.95 28.28 12.39 12.53 29.31 10.61 20.08 13.39 10.29 23.15 12.59 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 96 GLU^? 22.95 O2 GOL A 200 B 319 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 359 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo 10.77 13.13 40.94 11.03 14.73 39.51 12.01 30.07 3.21 14.10 30.25 2.56 coo 3.77 12.64 38.21 3.35 14.53 37.39 11.95 23.52 7.79 13.60 24.51 6.84 coo -1.16 15.32 35.60 -3.32 13.56 36.98 10.61 20.08 13.39 10.29 23.15 12.59 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 2 3 # 2 B 317 GLU A 96 GLU^? 22.95 O2 GOL A 200 B 319 ASP A 118 ASP^? 28.24 O2 GOL A 200 B 359 ARG A 116 ARG^? 32.03 O2 GOL A 200 coo 10.77 13.13 40.94 11.03 14.73 39.51 12.01 30.07 3.21 14.10 30.25 2.56 coo 3.77 12.64 38.21 3.35 14.53 37.39 11.56 28.53 -5.39 13.56 29.26 -5.43 coo -1.16 15.32 35.60 -3.32 13.56 36.98 8.24 29.33 -11.36 11.10 28.22 -11.40 1fr8_c01 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 2 hits 1fr8_c01 naa= 3 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 1 3 # 1 160 LYS A 15 LYS.? 25.07 O2 GOL A 200 210 ARG A 132 ARG.? 16.38 O3 GOL A 200 225 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo 17.51 28.50 73.42 17.24 23.02 75.86 0.11 6.41 5.99 2.13 3.29 0.85 coo 24.74 11.56 73.05 25.29 14.32 71.80 15.71 15.59 15.34 14.57 17.73 13.37 coo 27.81 15.44 77.10 25.66 16.50 75.19 10.61 20.08 13.39 10.29 23.15 12.59 ULMN 3 1gsa_c00 GLUTATHIONE SYNTHETASE user 2 3 # 2 160 LYS A 18 LYS.? 10.82 O1 GOL A 200 210 ARG A 132 ARG.? 16.38 O3 GOL A 200 225 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo 17.51 28.50 73.42 17.24 23.02 75.86 -2.73 13.36 9.72 -7.58 13.32 13.61 coo 24.74 11.56 73.05 25.29 14.32 71.80 15.71 15.59 15.34 14.57 17.73 13.37 coo 27.81 15.44 77.10 25.66 16.50 75.19 10.61 20.08 13.39 10.29 23.15 12.59 1gsa_c00 source 1gsa GLUTATHIONE SYNTHETASE : 2 hits 1gsa_c00 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL A 108 VAL^? 17.74 O1 GOL A 200 A 200 ASP A 39 ASP^? -14.64 O1 GOL A 200s A 226 LYS A 18 LYS.? 10.82 O1 GOL A 200 coo 19.13 38.05 1.41 19.72 38.80 -0.53 0.51 31.57 3.49 1.39 31.42 1.49 coo 24.51 43.28 11.18 25.17 44.50 9.58 -8.43 26.08 3.91 -10.39 26.34 4.84 coo 34.47 51.09 7.19 28.58 51.18 7.53 -2.73 13.36 9.72 -7.58 13.32 13.61 1i29_c03 source 1i29 CSDB : 1 hits 1i29_c03 naa= 3 ULMN 3 1idt_c00 MINOR FMN-DEPENDENT NITROREDUCTASE user 1 3 # 1 A 14 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 74 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 25.34 -34.49 45.28 21.58 -36.23 48.72 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 27.69 -28.18 47.27 24.45 -33.01 49.69 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 15.58 -28.67 55.46 14.00 -29.94 56.12 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1idt_c00 MINOR FMN-DEPENDENT NITROREDUCTASE user 2 3 # 2 A 14 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 74 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 25.34 -34.49 45.28 21.58 -36.23 48.72 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 27.69 -28.18 47.27 24.45 -33.01 49.69 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 15.58 -28.67 55.46 14.00 -29.94 56.12 -4.71 33.85 5.16 -5.48 33.44 7.13 1idt_c00 source 1idt MINOR FMN-DEPENDENT NITROREDUCTASE : 2 hits 1idt_c00 naa= 3 ULMN 3 1idt_c01 MINOR FMN-DEPENDENT NITROREDUCTASE user 1 3 # 1 B 14 LYS A 22 LYS.? 12.21 O1 GOL A 200 B 74 LYS A 25 LYS^? 23.71 O1 GOL A 200 B 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo -11.70 -18.16 41.28 -8.37 -16.95 44.27 -8.73 20.02 6.97 -12.28 16.97 10.92 coo -14.25 -24.10 43.55 -12.53 -18.94 44.42 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo -3.83 -22.11 54.11 -2.14 -20.82 54.20 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1idt_c01 MINOR FMN-DEPENDENT NITROREDUCTASE user 2 3 # 2 B 14 LYS A 25 LYS^? 23.71 O1 GOL A 200 B 74 LYS A 22 LYS.? 12.21 O1 GOL A 200 B 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo -11.70 -18.16 41.28 -8.37 -16.95 44.27 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo -14.25 -24.10 43.55 -12.53 -18.94 44.42 -8.73 20.02 6.97 -12.28 16.97 10.92 coo -3.83 -22.11 54.11 -2.14 -20.82 54.20 -4.71 33.85 5.16 -5.48 33.44 7.13 1idt_c01 source 1idt MINOR FMN-DEPENDENT NITROREDUCTASE : 2 hits 1idt_c01 naa= 3 ULMN 3 1ig8_c00 HEXOKINASE PII user 1 3 # 1 A 158 SER A 51 SER.? 19.11 O2 GOL A 200 A 173 ARG A 123 ARG^? 24.89 O2 GOL A 200 A 211 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 22.72 76.24 0.23 24.60 76.86 -1.25 7.12 10.94 6.45 9.44 10.63 6.09 coo 18.77 77.82 11.69 20.55 80.22 10.73 18.70 18.30 6.22 21.48 19.12 7.39 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 2.55 11.74 5.01 1.42 10.07 5.73 ULMN 3 1ig8_c00 HEXOKINASE PII user 2 3 # 2 A 158 SER A 51 SER.? 19.11 O2 GOL A 200 A 173 ARG A 132 ARG.? 16.38 O3 GOL A 200 A 211 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 22.72 76.24 0.23 24.60 76.86 -1.25 7.12 10.94 6.45 9.44 10.63 6.09 coo 18.77 77.82 11.69 20.55 80.22 10.73 15.71 15.59 15.34 14.57 17.73 13.37 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 2.55 11.74 5.01 1.42 10.07 5.73 ULMN 3 1ig8_c00 HEXOKINASE PII user 3 3 # 3 A 158 SER A 66 SER.? 26.83 O1 GOL A 200 A 173 ARG A 43 ARG.? -22.33 O1 GOL A 200s A 211 ASP A 63 ASP^? 31.81 O1 GOL A 200 coo 22.72 76.24 0.23 24.60 76.86 -1.25 -0.43 37.87 -5.28 0.50 35.67 -5.90 coo 18.77 77.82 11.69 20.55 80.22 10.73 -9.68 34.50 0.13 -8.09 37.08 0.79 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 3.02 36.19 -9.95 3.74 34.72 -11.31 1ig8_c00 source 1ig8 HEXOKINASE PII : 3 hits 1ig8_c00 naa= 3 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 1 3 # 1 54 ASP A 50 ASP.? 16.78 O2 GOL A 200 158 THR A 104 THR^? 8.26 O2 GOL A 200 317 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -2.63 8.40 35.07 -3.66 9.81 36.17 2.55 11.74 5.01 1.42 10.07 5.73 coo -5.30 12.75 41.86 -4.34 13.05 39.99 1.57 20.47 9.68 -0.64 20.24 9.40 coo -12.63 17.64 33.66 -10.65 17.90 34.40 11.95 23.52 7.79 13.60 24.51 6.84 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 2 3 # 2 54 ASP A 98 ASP^? 18.38 O2 GOL A 200 158 THR A 74 THR.? 16.16 O2 GOL A 200 317 ASP A 118 ASP^? 28.24 O2 GOL A 200 coo -2.63 8.40 35.07 -3.66 9.81 36.17 11.95 23.52 7.79 13.60 24.51 6.84 coo -5.30 12.75 41.86 -4.34 13.05 39.99 7.21 30.76 7.25 5.82 30.33 5.70 coo -12.63 17.64 33.66 -10.65 17.90 34.40 11.56 28.53 -5.39 13.56 29.26 -5.43 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 3 3 # 3 54 ASP A 98 ASP^? 18.38 O2 GOL A 200 158 THR A 75 THR^? 19.70 O2 GOL A 200 317 ASP A 118 ASP^? 28.24 O2 GOL A 200 coo -2.63 8.40 35.07 -3.66 9.81 36.17 11.95 23.52 7.79 13.60 24.51 6.84 coo -5.30 12.75 41.86 -4.34 13.05 39.99 9.82 33.32 6.14 11.61 32.26 6.74 coo -12.63 17.64 33.66 -10.65 17.90 34.40 11.56 28.53 -5.39 13.56 29.26 -5.43 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 4 3 # 4 54 ASP A 127 ASP.? 23.55 O3 GOL A 200 158 THR A 124 THR^? 24.56 O2 GOL A 200 317 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -2.63 8.40 35.07 -3.66 9.81 36.17 21.64 16.51 15.04 22.41 14.94 16.29 coo -5.30 12.75 41.86 -4.34 13.05 39.99 16.78 12.69 7.16 18.55 11.42 7.01 coo -12.63 17.64 33.66 -10.65 17.90 34.40 11.95 23.52 7.79 13.60 24.51 6.84 1inp_c02 source 1inp INOSITOL POLYPHOSPHATE 1-PHOSPHATASE (1-PTASE): 4 hits 1inp_c02 naa= 3 ULMN 3 1j7g_c00 D-TYROSYL-TRNA(TYR) DEACYLASE user 1 3 # 1 A 78 GLN A 105 GLN^? 10.36 O2 GOL A 200 A 79 PHE A 47 PHE^? 16.84 O2 GOL A 200 A 80 THR A 104 THR^? 8.26 O2 GOL A 200 coo 18.18 6.97 -1.14 17.20 5.70 -2.56 5.52 23.54 9.33 6.09 25.02 10.81 coo 24.87 4.39 -2.11 26.74 2.89 -0.67 3.45 22.78 2.62 3.68 24.27 0.23 coo 21.26 8.65 -4.24 19.54 7.67 -5.04 1.57 20.47 9.68 -0.64 20.24 9.40 1j7g_c00 source 1j7g D-TYROSYL-TRNA(TYR) DEACYLASE : 1 hits 1j7g_c00 naa= 3 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 # 1 A 55 ASP A 73 ASP.? 11.55 O2 GOL A 200 A 58 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 424 GLU A 96 GLU^? 22.95 O2 GOL A 200 coo 58.42 47.76 20.67 58.01 49.10 19.12 7.80 28.72 11.54 7.47 28.46 13.63 coo 58.59 41.80 18.81 58.94 43.89 18.94 11.95 23.52 7.79 13.60 24.51 6.84 coo 52.85 46.34 13.34 54.09 44.97 14.42 12.01 30.07 3.21 14.10 30.25 2.56 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 2 3 # 2 A 55 ASP A 73 ASP.? 11.55 O2 GOL A 200 A 58 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 424 GLU A 103 GLU.? 9.69 O2 GOL A 200 coo 58.42 47.76 20.67 58.01 49.10 19.12 7.80 28.72 11.54 7.47 28.46 13.63 coo 58.59 41.80 18.81 58.94 43.89 18.94 11.95 23.52 7.79 13.60 24.51 6.84 coo 52.85 46.34 13.34 54.09 44.97 14.42 5.18 20.01 12.20 7.16 20.80 12.53 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 3 3 # 3 A 55 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 58 ASP A 73 ASP.? 11.55 O2 GOL A 200 A 424 GLU A 96 GLU^? 22.95 O2 GOL A 200 coo 58.42 47.76 20.67 58.01 49.10 19.12 11.95 23.52 7.79 13.60 24.51 6.84 coo 58.59 41.80 18.81 58.94 43.89 18.94 7.80 28.72 11.54 7.47 28.46 13.63 coo 52.85 46.34 13.34 54.09 44.97 14.42 12.01 30.07 3.21 14.10 30.25 2.56 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 4 3 # 4 A 55 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 58 ASP A 73 ASP.? 11.55 O2 GOL A 200 A 424 GLU A 103 GLU.? 9.69 O2 GOL A 200 coo 58.42 47.76 20.67 58.01 49.10 19.12 11.95 23.52 7.79 13.60 24.51 6.84 coo 58.59 41.80 18.81 58.94 43.89 18.94 7.80 28.72 11.54 7.47 28.46 13.63 coo 52.85 46.34 13.34 54.09 44.97 14.42 5.18 20.01 12.20 7.16 20.80 12.53 1js4_c00 source 1js4 ENDO-EXOCELLULASE E4 : 4 hits 1js4_c00 naa= 3 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 # 1 B 55 ASP A 73 ASP.? 11.55 O2 GOL A 200 B 58 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 424 GLU A 96 GLU^? 22.95 O2 GOL A 200 coo 112.10 61.46 19.99 111.82 60.65 18.07 7.80 28.72 11.54 7.47 28.46 13.63 coo 117.85 63.62 21.08 115.96 63.25 20.18 11.95 23.52 7.79 13.60 24.51 6.84 coo 118.47 57.23 15.57 119.32 58.77 16.73 12.01 30.07 3.21 14.10 30.25 2.56 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 2 3 # 2 B 55 ASP A 73 ASP.? 11.55 O2 GOL A 200 B 58 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 424 GLU A 103 GLU.? 9.69 O2 GOL A 200 coo 112.10 61.46 19.99 111.82 60.65 18.07 7.80 28.72 11.54 7.47 28.46 13.63 coo 117.85 63.62 21.08 115.96 63.25 20.18 11.95 23.52 7.79 13.60 24.51 6.84 coo 118.47 57.23 15.57 119.32 58.77 16.73 5.18 20.01 12.20 7.16 20.80 12.53 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 3 3 # 3 B 55 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 58 ASP A 73 ASP.? 11.55 O2 GOL A 200 B 424 GLU A 96 GLU^? 22.95 O2 GOL A 200 coo 112.10 61.46 19.99 111.82 60.65 18.07 11.95 23.52 7.79 13.60 24.51 6.84 coo 117.85 63.62 21.08 115.96 63.25 20.18 7.80 28.72 11.54 7.47 28.46 13.63 coo 118.47 57.23 15.57 119.32 58.77 16.73 12.01 30.07 3.21 14.10 30.25 2.56 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 4 3 # 4 B 55 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 58 ASP A 73 ASP.? 11.55 O2 GOL A 200 B 424 GLU A 103 GLU.? 9.69 O2 GOL A 200 coo 112.10 61.46 19.99 111.82 60.65 18.07 11.95 23.52 7.79 13.60 24.51 6.84 coo 117.85 63.62 21.08 115.96 63.25 20.18 7.80 28.72 11.54 7.47 28.46 13.63 coo 118.47 57.23 15.57 119.32 58.77 16.73 5.18 20.01 12.20 7.16 20.80 12.53 1js4_c01 source 1js4 ENDO-EXOCELLULASE E4 : 4 hits 1js4_c01 naa= 3 ULMN 3 1kim_c00 THYMIDINE KINASE user 1 3 # 1 A 83 GLU A 109 GLU^? 14.90 O1 GOL A 200 A 163 ARG A 43 ARG.? -22.33 O1 GOL A 200s A 222 ARG A 44 ARG^? 10.85 O1 GOL A 200 coo 51.27 81.34 48.31 51.67 80.79 50.28 -4.71 33.85 5.16 -5.48 33.44 7.13 coo 48.06 78.22 50.94 48.51 78.27 53.98 -9.68 34.50 0.13 -8.09 37.08 0.79 coo 54.85 84.16 52.60 54.26 81.23 53.34 -5.22 29.17 7.22 -7.66 28.12 8.81 ULMN 3 1kim_c00 THYMIDINE KINASE user 2 3 # 2 A 83 GLU A 109 GLU^? 14.90 O1 GOL A 200 A 163 ARG A 44 ARG^? 10.85 O1 GOL A 200 A 222 ARG A 43 ARG.? -22.33 O1 GOL A 200s coo 51.27 81.34 48.31 51.67 80.79 50.28 -4.71 33.85 5.16 -5.48 33.44 7.13 coo 48.06 78.22 50.94 48.51 78.27 53.98 -5.22 29.17 7.22 -7.66 28.12 8.81 coo 54.85 84.16 52.60 54.26 81.23 53.34 -9.68 34.50 0.13 -8.09 37.08 0.79 1kim_c00 source 1kim THYMIDINE KINASE : 2 hits 1kim_c00 naa= 3 ULMN 3 1kqc_c00 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 A 14 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 74 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 24.97 5.82 58.78 26.79 1.97 55.46 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 19.46 3.44 61.93 23.95 1.12 60.13 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 19.32 -6.09 50.65 20.51 -6.62 48.98 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1kqc_c00 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 2 3 # 2 A 14 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 74 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 24.97 5.82 58.78 26.79 1.97 55.46 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 19.46 3.44 61.93 23.95 1.12 60.13 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 19.32 -6.09 50.65 20.51 -6.62 48.98 -4.71 33.85 5.16 -5.48 33.44 7.13 1kqc_c00 source 1kqc OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 2 hits 1kqc_c00 naa= 3 ULMN 3 1kqc_c01 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 B 14 LYS A 22 LYS.? 12.21 O1 GOL A 200 B 74 LYS A 25 LYS^? 23.71 O1 GOL A 200 B 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 4.84 5.09 23.75 3.30 1.39 27.48 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 10.43 2.88 20.75 5.72 0.41 23.95 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 10.70 -6.39 32.24 9.53 -6.89 33.94 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1kqc_c01 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 2 3 # 2 B 14 LYS A 25 LYS^? 23.71 O1 GOL A 200 B 74 LYS A 22 LYS.? 12.21 O1 GOL A 200 B 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 4.84 5.09 23.75 3.30 1.39 27.48 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 10.43 2.88 20.75 5.72 0.41 23.95 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 10.70 -6.39 32.24 9.53 -6.89 33.94 -4.71 33.85 5.16 -5.48 33.44 7.13 1kqc_c01 source 1kqc OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 2 hits 1kqc_c01 naa= 3 ULMN 3 1kqc_c02 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 C 14 LYS A 22 LYS.? 12.21 O1 GOL A 200 C 74 LYS A 25 LYS^? 23.71 O1 GOL A 200 C 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 17.59 37.25 25.80 19.64 34.15 21.60 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 12.29 34.52 28.11 16.84 32.47 25.43 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 12.06 27.10 15.56 13.23 27.02 13.80 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1kqc_c02 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 2 3 # 2 C 14 LYS A 25 LYS^? 23.71 O1 GOL A 200 C 74 LYS A 22 LYS.? 12.21 O1 GOL A 200 C 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 17.59 37.25 25.80 19.64 34.15 21.60 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 12.29 34.52 28.11 16.84 32.47 25.43 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 12.06 27.10 15.56 13.23 27.02 13.80 -4.71 33.85 5.16 -5.48 33.44 7.13 1kqc_c02 source 1kqc OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 2 hits 1kqc_c02 naa= 3 ULMN 3 1kqc_c03 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 D 14 LYS A 22 LYS.? 12.21 O1 GOL A 200 D 74 LYS A 25 LYS^? 23.71 O1 GOL A 200 D 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo -2.23 43.20 -8.84 -3.98 39.03 -6.02 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 3.33 41.47 -12.31 -1.15 38.64 -10.07 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 3.51 30.30 -2.73 2.31 29.63 -1.11 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1kqc_c03 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 2 3 # 2 D 14 LYS A 25 LYS^? 23.71 O1 GOL A 200 D 74 LYS A 22 LYS.? 12.21 O1 GOL A 200 D 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo -2.23 43.20 -8.84 -3.98 39.03 -6.02 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 3.33 41.47 -12.31 -1.15 38.64 -10.07 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 3.51 30.30 -2.73 2.31 29.63 -1.11 -4.71 33.85 5.16 -5.48 33.44 7.13 1kqc_c03 source 1kqc OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 2 hits 1kqc_c03 naa= 3 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 # 1 255 ASP A 50 ASP.? 16.78 O2 GOL A 200 262 LYS A 18 LYS.? 10.82 O1 GOL A 200 336 ARG A 36 ARG^? 21.82 O1 GOL A 200 coo 61.88 50.78 12.96 63.84 50.60 13.71 2.55 11.74 5.01 1.42 10.07 5.73 coo 63.59 44.40 18.32 63.20 49.74 17.95 -2.73 13.36 9.72 -7.58 13.32 13.61 coo 72.60 57.42 15.86 71.61 56.68 18.70 -0.18 23.83 -2.35 -2.28 23.74 -4.54 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP A 50 ASP.? 16.78 O2 GOL A 200 262 LYS A 18 LYS.? 10.82 O1 GOL A 200 336 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo 61.88 50.78 12.96 63.84 50.60 13.71 2.55 11.74 5.01 1.42 10.07 5.73 coo 63.59 44.40 18.32 63.20 49.74 17.95 -2.73 13.36 9.72 -7.58 13.32 13.61 coo 72.60 57.42 15.86 71.61 56.68 18.70 10.61 20.08 13.39 10.29 23.15 12.59 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 3 3 # 3 255 ASP A 118 ASP^? 28.24 O2 GOL A 200 262 LYS A 92 LYS^? 33.34 O2 GOL A 200 336 ARG A 36 ARG^? 21.82 O1 GOL A 200 coo 61.88 50.78 12.96 63.84 50.60 13.71 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 63.59 44.40 18.32 63.20 49.74 17.95 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 72.60 57.42 15.86 71.61 56.68 18.70 -0.18 23.83 -2.35 -2.28 23.74 -4.54 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 3 hits 1lam_c00 naa= 3 ULMN 3 1lci_c00 LUCIFERASE user 1 3 # 1 218 ARG A 36 ARG^? 21.82 O1 GOL A 200 245 HIS A 57 HIS^? 21.61 O2 GOL A 200 343 THR A 119 THR^? 25.97 O2 GOL A 200 coo 18.11 85.25 41.19 18.04 83.33 43.59 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 5.34 86.23 43.48 6.16 87.26 45.12 13.89 24.29 2.75 14.15 26.31 2.22 coo 9.06 92.76 42.80 7.04 92.63 42.14 13.04 24.62 -3.89 14.83 25.20 -2.71 1lci_c00 source 1lci LUCIFERASE : 1 hits 1lci_c00 naa= 3 ULMN 3 1lij_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 38 ALA^? 18.33 O1 GOL A 200 A 317 GLY A 23 GLY.? 14.14 O1 GOL A 200 A 318 ASP A 39 ASP^? -14.64 O1 GOL A 200s coo 144.15 17.54 -4.21 144.96 16.79 -5.26 -5.56 24.41 0.63 -5.61 24.59 -0.88 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 -8.93 22.43 4.17 -9.31 21.61 4.20 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 -8.43 26.08 3.91 -10.39 26.34 4.84 1lij_c01 source 1lij ADENOSINE KINASE : 1 hits 1lij_c01 naa= 3 ULMN 3 1lio_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 38 ALA^? 18.33 O1 GOL A 200 A 317 GLY A 23 GLY.? 14.14 O1 GOL A 200 A 318 ASP A 39 ASP^? -14.64 O1 GOL A 200s coo 27.04 23.54 41.85 25.72 24.19 42.18 -5.56 24.41 0.63 -5.61 24.59 -0.88 coo 27.87 23.16 38.17 28.43 22.97 38.87 -8.93 22.43 4.17 -9.31 21.61 4.20 coo 32.11 22.71 40.58 33.42 24.22 39.78 -8.43 26.08 3.91 -10.39 26.34 4.84 1lio_c01 source 1lio ADENOSINE KINASE : 1 hits 1lio_c01 naa= 3 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 A 114 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 197 ASP A 118 ASP^? 28.24 O2 GOL A 200 A 223 ALA A 76 ALA^? 21.92 O2 GOL A 200 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 13.89 24.29 2.75 14.15 26.31 2.22 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 11.56 28.53 -5.39 13.56 29.26 -5.43 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 8.98 35.56 3.23 7.58 35.96 3.25 1n2t_c02 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 1 hits 1n2t_c02 naa= 3 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 B 114 HIS A 57 HIS^? 21.61 O2 GOL A 200 B 197 ASP A 118 ASP^? 28.24 O2 GOL A 200 B 223 ALA A 76 ALA^? 21.92 O2 GOL A 200 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 13.89 24.29 2.75 14.15 26.31 2.22 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 11.56 28.53 -5.39 13.56 29.26 -5.43 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 8.98 35.56 3.23 7.58 35.96 3.25 1n2t_c03 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 1 hits 1n2t_c03 naa= 3 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 100 ARG.? 12.49 O2 GOL A 200 A 101 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 132 ASP A 73 ASP.? 11.55 O2 GOL A 200 coo 11.61 22.83 17.30 14.06 21.71 15.78 10.61 20.08 13.39 10.29 23.15 12.59 coo 11.37 24.94 11.48 12.48 24.45 13.28 11.95 23.52 7.79 13.60 24.51 6.84 coo 16.14 18.17 13.37 15.92 19.81 14.71 7.80 28.72 11.54 7.47 28.46 13.63 1nu3_c00 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nu3_c00 naa= 3 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 100 ARG.? 12.49 O2 GOL A 200 B 101 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 132 ASP A 73 ASP.? 11.55 O2 GOL A 200 coo 11.61 3.43 18.38 9.11 4.29 16.86 10.61 20.08 13.39 10.29 23.15 12.59 coo 11.74 0.51 12.98 10.75 1.32 14.67 11.95 23.52 7.79 13.60 24.51 6.84 coo 6.93 7.52 14.08 7.18 6.08 15.65 7.80 28.72 11.54 7.47 28.46 13.63 1nu3_c01 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nu3_c01 naa= 3 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 100 ARG.? 12.49 O2 GOL A 200 A 101 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 132 ASP A 73 ASP.? 11.55 O2 GOL A 200 coo 11.50 22.77 17.24 14.00 21.62 15.86 10.61 20.08 13.39 10.29 23.15 12.59 coo 11.19 25.00 11.76 12.16 24.45 13.59 11.95 23.52 7.79 13.60 24.51 6.84 coo 16.04 18.11 13.43 15.88 19.70 14.83 7.80 28.72 11.54 7.47 28.46 13.63 1nww_c02 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nww_c02 naa= 3 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 100 ARG.? 12.49 O2 GOL A 200 B 101 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 132 ASP A 73 ASP.? 11.55 O2 GOL A 200 coo 11.48 3.09 18.25 9.01 4.07 16.77 10.61 20.08 13.39 10.29 23.15 12.59 coo 11.83 0.33 13.01 10.88 1.04 14.81 11.95 23.52 7.79 13.60 24.51 6.84 coo 6.85 7.33 14.07 7.10 5.88 15.60 7.80 28.72 11.54 7.47 28.46 13.63 1nww_c03 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 1 hits 1nww_c03 naa= 3 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 # 1 A 62 SER A 111 SER^? -25.66 O1 GOL A 200s A 154 ASP A 39 ASP^? -14.64 O1 GOL A 200s A 261 ARG A 43 ARG.? -22.33 O1 GOL A 200s coo 16.10 74.10 3.11 17.18 73.52 5.20 -4.95 35.61 -2.73 -5.10 37.96 -3.33 coo 16.07 84.71 8.14 15.20 82.81 8.14 -8.43 26.08 3.91 -10.39 26.34 4.84 coo 10.59 77.85 4.81 13.09 76.36 5.76 -9.68 34.50 0.13 -8.09 37.08 0.79 1o98_c00 source 1o98 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT PHOSPHOGLY: 1 hits 1o98_c00 naa= 3 ULMN 3 1oyg_c00 LEVANSUCRASE user 1 3 # 1 A 86 ASP A 73 ASP.? 11.55 O2 GOL A 200 A 247 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 342 GLU A 96 GLU^? 22.95 O2 GOL A 200 coo 44.36 35.68 9.71 43.29 36.20 11.51 7.80 28.72 11.54 7.47 28.46 13.63 coo 41.40 28.81 12.91 40.82 30.90 12.97 11.95 23.52 7.79 13.60 24.51 6.84 coo 40.37 33.11 18.06 39.99 34.93 17.06 12.01 30.07 3.21 14.10 30.25 2.56 1oyg_c00 source 1oyg LEVANSUCRASE : 1 hits 1oyg_c00 naa= 3 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 A 70 ALA A 46 ALA^? 11.57 O1 GOL A 200 A 126 LEU A 71 LEU.? 13.34 O1 GOL A 200 A 158 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -0.56 24.57 4.78 -1.35 24.11 5.95 coo -4.62 32.83 147.14 -5.50 32.85 149.12 0.76 31.32 8.10 -1.27 31.99 7.73 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA A 59 ALA^? 23.37 O2 GOL A 200 A 126 LEU A 120 LEU^? 23.25 O2 GOL A 200 A 158 GLU A 121 GLU^? 27.36 O2 GOL A 200 coo -2.29 37.66 144.73 -1.46 37.12 145.87 10.08 27.38 -1.00 11.44 28.06 -1.17 coo -4.62 32.83 147.14 -5.50 32.85 149.12 10.73 20.77 -3.45 8.80 20.20 -2.57 coo -0.83 29.57 149.77 -0.39 31.47 148.95 16.93 19.57 -0.26 18.29 20.31 -1.73 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 A 70 ALA A 122 ALA^? 22.22 O2 GOL A 200 A 126 LEU A 54 LEU^? 20.84 O2 GOL A 200 A 158 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -2.29 37.66 144.73 -1.46 37.12 145.87 14.40 16.69 2.00 13.38 15.62 1.82 coo -4.62 32.83 147.14 -5.50 32.85 149.12 11.86 13.17 5.21 12.73 11.82 3.79 coo -0.83 29.57 149.77 -0.39 31.47 148.95 11.74 7.72 7.91 12.92 5.90 7.68 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 A 70 ALA A 125 ALA.? 18.28 O2 GOL A 200 A 126 LEU A 54 LEU^? 20.84 O2 GOL A 200 A 158 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -2.29 37.66 144.73 -1.46 37.12 145.87 15.51 14.21 10.32 14.09 14.21 10.70 coo -4.62 32.83 147.14 -5.50 32.85 149.12 11.86 13.17 5.21 12.73 11.82 3.79 coo -0.83 29.57 149.77 -0.39 31.47 148.95 11.74 7.72 7.91 12.92 5.90 7.68 1pjh_c00 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 4 hits 1pjh_c00 naa= 3 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 B 70 ALA A 46 ALA^? 11.57 O1 GOL A 200 B 126 LEU A 71 LEU.? 13.34 O1 GOL A 200 B 158 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -0.56 24.57 4.78 -1.35 24.11 5.95 coo -34.22 5.06 149.25 -33.65 4.24 151.15 0.76 31.32 8.10 -1.27 31.99 7.73 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA A 59 ALA^? 23.37 O2 GOL A 200 B 126 LEU A 120 LEU^? 23.25 O2 GOL A 200 B 158 GLU A 121 GLU^? 27.36 O2 GOL A 200 coo -39.79 4.61 147.27 -39.61 5.56 148.47 10.08 27.38 -1.00 11.44 28.06 -1.17 coo -34.22 5.06 149.25 -33.65 4.24 151.15 10.73 20.77 -3.45 8.80 20.20 -2.57 coo -33.03 9.93 151.71 -34.98 9.38 151.11 16.93 19.57 -0.26 18.29 20.31 -1.73 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 B 70 ALA A 122 ALA^? 22.22 O2 GOL A 200 B 126 LEU A 54 LEU^? 20.84 O2 GOL A 200 B 158 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -39.79 4.61 147.27 -39.61 5.56 148.47 14.40 16.69 2.00 13.38 15.62 1.82 coo -34.22 5.06 149.25 -33.65 4.24 151.15 11.86 13.17 5.21 12.73 11.82 3.79 coo -33.03 9.93 151.71 -34.98 9.38 151.11 11.74 7.72 7.91 12.92 5.90 7.68 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 B 70 ALA A 125 ALA.? 18.28 O2 GOL A 200 B 126 LEU A 54 LEU^? 20.84 O2 GOL A 200 B 158 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -39.79 4.61 147.27 -39.61 5.56 148.47 15.51 14.21 10.32 14.09 14.21 10.70 coo -34.22 5.06 149.25 -33.65 4.24 151.15 11.86 13.17 5.21 12.73 11.82 3.79 coo -33.03 9.93 151.71 -34.98 9.38 151.11 11.74 7.72 7.91 12.92 5.90 7.68 1pjh_c01 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 4 hits 1pjh_c01 naa= 3 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 C 70 ALA A 46 ALA^? 11.57 O1 GOL A 200 C 126 LEU A 71 LEU.? 13.34 O1 GOL A 200 C 158 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -0.56 24.57 4.78 -1.35 24.11 5.95 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 0.76 31.32 8.10 -1.27 31.99 7.73 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA A 59 ALA^? 23.37 O2 GOL A 200 C 126 LEU A 120 LEU^? 23.25 O2 GOL A 200 C 158 GLU A 121 GLU^? 27.36 O2 GOL A 200 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 10.08 27.38 -1.00 11.44 28.06 -1.17 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 10.73 20.77 -3.45 8.80 20.20 -2.57 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 16.93 19.57 -0.26 18.29 20.31 -1.73 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 C 70 ALA A 122 ALA^? 22.22 O2 GOL A 200 C 126 LEU A 54 LEU^? 20.84 O2 GOL A 200 C 158 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 14.40 16.69 2.00 13.38 15.62 1.82 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 11.86 13.17 5.21 12.73 11.82 3.79 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 11.74 7.72 7.91 12.92 5.90 7.68 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 C 70 ALA A 125 ALA.? 18.28 O2 GOL A 200 C 126 LEU A 54 LEU^? 20.84 O2 GOL A 200 C 158 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 15.51 14.21 10.32 14.09 14.21 10.70 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 11.86 13.17 5.21 12.73 11.82 3.79 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 11.74 7.72 7.91 12.92 5.90 7.68 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 4 hits 1pjh_c02 naa= 3 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 1 3 # 1 A 248 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 270 LYS A 52 LYS.? 20.79 O2 GOL A 200 A 382 MET A 106 MET^? 9.54 O1 GOL A 200 coo -27.63 121.99 45.48 -26.66 123.86 45.68 2.55 11.74 5.01 1.42 10.07 5.73 coo -32.20 115.91 49.56 -31.37 121.03 53.12 8.29 9.60 9.80 7.06 4.86 8.55 coo -23.75 127.89 58.42 -26.02 128.79 55.12 0.80 26.93 8.05 -2.34 26.80 8.71 1pjq_c02 source 1pjq SIROHEME SYNTHASE : 1 hits 1pjq_c02 naa= 3 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 1 3 # 1 B 248 ASP A 50 ASP.? 16.78 O2 GOL A 200 B 270 LYS A 18 LYS.? 10.82 O1 GOL A 200 B 382 MET A 106 MET^? 9.54 O1 GOL A 200 coo -11.82 154.51 43.38 -12.86 152.74 43.79 2.55 11.74 5.01 1.42 10.07 5.73 coo -5.09 158.39 43.41 -0.74 158.80 47.15 -2.73 13.36 9.72 -7.58 13.32 13.61 coo -2.79 145.52 50.38 -5.75 148.14 51.66 0.80 26.93 8.05 -2.34 26.80 8.71 1pjq_c03 source 1pjq SIROHEME SYNTHASE : 1 hits 1pjq_c03 naa= 3 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 1 3 # 1 111 GLN A 105 GLN^? 10.36 O2 GOL A 200 294 GLU A 96 GLU^? 22.95 O2 GOL A 200 304 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo 15.89 18.45 46.53 15.82 16.91 48.02 5.52 23.54 9.33 6.09 25.02 10.81 coo 22.84 13.44 52.91 20.84 13.18 52.38 12.01 30.07 3.21 14.10 30.25 2.56 coo 8.71 17.11 46.51 7.23 17.64 49.20 10.61 20.08 13.39 10.29 23.15 12.59 1pmi_c00 source 1pmi PHOSPHOMANNOSE ISOMERASE : 1 hits 1pmi_c00 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 118 ASP^? 28.24 O2 GOL A 200 A 68 ALA A 59 ALA^? 23.37 O2 GOL A 200 A 72 LEU A 94 LEU^? 26.21 O2 GOL A 200 coo 46.76 7.59 18.65 45.27 6.01 18.52 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 48.88 4.35 16.59 48.73 5.09 15.20 10.08 27.38 -1.00 11.44 28.06 -1.17 coo 53.89 6.25 15.09 52.88 7.92 14.14 11.04 33.97 -2.16 12.27 32.29 -2.55 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP A 118 ASP^? 28.24 O2 GOL A 200 A 68 ALA A 59 ALA^? 23.37 O2 GOL A 200 A 72 LEU A 120 LEU^? 23.25 O2 GOL A 200 coo 46.76 7.59 18.65 45.27 6.01 18.52 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 48.88 4.35 16.59 48.73 5.09 15.20 10.08 27.38 -1.00 11.44 28.06 -1.17 coo 53.89 6.25 15.09 52.88 7.92 14.14 10.73 20.77 -3.45 8.80 20.20 -2.57 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 2 hits 1q6l_c05 naa= 3 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 1 3 # 1 A 396 ARG A 100 ARG.? 12.49 O2 GOL A 200 A 581 ARG A 132 ARG.? 16.38 O3 GOL A 200 A 713 ARG A 123 ARG^? 24.89 O2 GOL A 200 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 10.61 20.08 13.39 10.29 23.15 12.59 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 15.71 15.59 15.34 14.57 17.73 13.37 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 18.70 18.30 6.22 21.48 19.12 7.39 ULMN 3 1qb4_c01 PHOSPHOENOLPYRUVATE CARBOXYLASE user 2 3 # 2 A 396 ARG A 132 ARG.? 16.38 O3 GOL A 200 A 581 ARG A 100 ARG.? 12.49 O2 GOL A 200 A 713 ARG A 123 ARG^? 24.89 O2 GOL A 200 coo 23.94 27.00 -9.66 23.90 28.89 -12.21 15.71 15.59 15.34 14.57 17.73 13.37 coo 24.10 34.79 -11.24 24.18 32.99 -13.65 10.61 20.08 13.39 10.29 23.15 12.59 coo 24.26 28.71 -19.68 23.74 27.73 -16.81 18.70 18.30 6.22 21.48 19.12 7.39 1qb4_c01 source 1qb4 PHOSPHOENOLPYRUVATE CARBOXYLASE : 2 hits 1qb4_c01 naa= 3 ULMN 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 A 51 ALA A 59 ALA^? 23.37 O2 GOL A 200 A 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo 1.42 19.18 21.84 1.11 19.57 23.28 10.08 27.38 -1.00 11.44 28.06 -1.17 coo 0.71 19.67 27.92 2.43 19.16 26.83 13.89 24.29 2.75 14.15 26.31 2.22 coo 7.15 16.22 27.50 6.15 18.00 27.94 11.95 23.52 7.79 13.60 24.51 6.84 ULMN 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 A 51 ALA A 122 ALA^? 22.22 O2 GOL A 200 A 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo 1.42 19.18 21.84 1.11 19.57 23.28 14.40 16.69 2.00 13.38 15.62 1.82 coo 0.71 19.67 27.92 2.43 19.16 26.83 13.89 24.29 2.75 14.15 26.31 2.22 coo 7.15 16.22 27.50 6.15 18.00 27.94 11.95 23.52 7.79 13.60 24.51 6.84 1qol_c00 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c00 naa= 3 ULMN 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 C 51 ALA A 59 ALA^? 23.37 O2 GOL A 200 C 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 C 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -26.36 -19.12 21.15 -25.71 -19.49 22.47 10.08 27.38 -1.00 11.44 28.06 -1.17 coo -25.01 -20.21 26.78 -26.91 -20.55 25.93 13.89 24.29 2.75 14.15 26.31 2.22 coo -32.17 -20.34 27.36 -30.15 -20.93 27.54 11.95 23.52 7.79 13.60 24.51 6.84 ULMN 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 C 51 ALA A 122 ALA^? 22.22 O2 GOL A 200 C 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 C 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -26.36 -19.12 21.15 -25.71 -19.49 22.47 14.40 16.69 2.00 13.38 15.62 1.82 coo -25.01 -20.21 26.78 -26.91 -20.55 25.93 13.89 24.29 2.75 14.15 26.31 2.22 coo -32.17 -20.34 27.36 -30.15 -20.93 27.54 11.95 23.52 7.79 13.60 24.51 6.84 1qol_c02 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c02 naa= 3 ULMN 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 D 51 ALA A 59 ALA^? 23.37 O2 GOL A 200 D 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 D 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -6.15 -19.18 55.49 -6.70 -19.60 54.15 10.08 27.38 -1.00 11.44 28.06 -1.17 coo -7.62 -20.32 49.70 -5.89 -20.86 50.74 13.89 24.29 2.75 14.15 26.31 2.22 coo -0.41 -20.05 49.27 -2.21 -21.16 49.24 11.95 23.52 7.79 13.60 24.51 6.84 ULMN 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 D 51 ALA A 122 ALA^? 22.22 O2 GOL A 200 D 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 D 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -6.15 -19.18 55.49 -6.70 -19.60 54.15 14.40 16.69 2.00 13.38 15.62 1.82 coo -7.62 -20.32 49.70 -5.89 -20.86 50.74 13.89 24.29 2.75 14.15 26.31 2.22 coo -0.41 -20.05 49.27 -2.21 -21.16 49.24 11.95 23.52 7.79 13.60 24.51 6.84 1qol_c03 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c03 naa= 3 ULMN 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 E 51 ALA A 59 ALA^? 23.37 O2 GOL A 200 E 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 E 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo 5.48 -16.06 -47.92 6.03 -15.45 -46.65 10.08 27.38 -1.00 11.44 28.06 -1.17 coo 5.81 -16.05 -42.05 5.54 -17.84 -43.11 13.89 24.29 2.75 14.15 26.31 2.22 coo 2.75 -22.21 -43.08 4.67 -21.31 -42.96 11.95 23.52 7.79 13.60 24.51 6.84 ULMN 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 E 51 ALA A 122 ALA^? 22.22 O2 GOL A 200 E 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 E 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo 5.48 -16.06 -47.92 6.03 -15.45 -46.65 14.40 16.69 2.00 13.38 15.62 1.82 coo 5.81 -16.05 -42.05 5.54 -17.84 -43.11 13.89 24.29 2.75 14.15 26.31 2.22 coo 2.75 -22.21 -43.08 4.67 -21.31 -42.96 11.95 23.52 7.79 13.60 24.51 6.84 1qol_c04 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c04 naa= 3 ULMN 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 F 51 ALA A 59 ALA^? 23.37 O2 GOL A 200 F 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 F 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo 5.33 15.59 -14.28 5.80 15.15 -15.64 10.08 27.38 -1.00 11.44 28.06 -1.17 coo 5.79 15.50 -20.13 5.50 17.28 -19.05 13.89 24.29 2.75 14.15 26.31 2.22 coo 2.42 22.00 -18.97 4.23 20.92 -19.18 11.95 23.52 7.79 13.60 24.51 6.84 ULMN 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 F 51 ALA A 122 ALA^? 22.22 O2 GOL A 200 F 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 F 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo 5.33 15.59 -14.28 5.80 15.15 -15.64 14.40 16.69 2.00 13.38 15.62 1.82 coo 5.79 15.50 -20.13 5.50 17.28 -19.05 13.89 24.29 2.75 14.15 26.31 2.22 coo 2.42 22.00 -18.97 4.23 20.92 -19.18 11.95 23.52 7.79 13.60 24.51 6.84 1qol_c05 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c05 naa= 3 ULMN 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 G 51 ALA A 59 ALA^? 23.37 O2 GOL A 200 G 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 G 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -33.28 -11.88 -14.46 -33.66 -11.38 -15.87 10.08 27.38 -1.00 11.44 28.06 -1.17 coo -34.88 -9.77 -20.15 -35.41 -11.60 -19.26 13.89 24.29 2.75 14.15 26.31 2.22 coo -34.41 -16.73 -21.11 -35.66 -15.03 -20.96 11.95 23.52 7.79 13.60 24.51 6.84 ULMN 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 G 51 ALA A 122 ALA^? 22.22 O2 GOL A 200 G 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 G 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -33.28 -11.88 -14.46 -33.66 -11.38 -15.87 14.40 16.69 2.00 13.38 15.62 1.82 coo -34.88 -9.77 -20.15 -35.41 -11.60 -19.26 13.89 24.29 2.75 14.15 26.31 2.22 coo -34.41 -16.73 -21.11 -35.66 -15.03 -20.96 11.95 23.52 7.79 13.60 24.51 6.84 1qol_c06 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c06 naa= 3 ULMN 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 H 51 ALA A 59 ALA^? 23.37 O2 GOL A 200 H 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 H 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -33.97 9.40 -47.46 -34.31 8.55 -46.23 10.08 27.38 -1.00 11.44 28.06 -1.17 coo -35.28 7.86 -41.76 -36.20 9.51 -42.67 13.89 24.29 2.75 14.15 26.31 2.22 coo -35.25 15.19 -41.05 -35.81 13.11 -41.05 11.95 23.52 7.79 13.60 24.51 6.84 ULMN 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 H 51 ALA A 122 ALA^? 22.22 O2 GOL A 200 H 148 HIS A 57 HIS^? 21.61 O2 GOL A 200 H 163 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -33.97 9.40 -47.46 -34.31 8.55 -46.23 14.40 16.69 2.00 13.38 15.62 1.82 coo -35.28 7.86 -41.76 -36.20 9.51 -42.67 13.89 24.29 2.75 14.15 26.31 2.22 coo -35.25 15.19 -41.05 -35.81 13.11 -41.05 11.95 23.52 7.79 13.60 24.51 6.84 1qol_c07 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c07 naa= 3 ULMN 3 1qrr_c01 SULFOLIPID BIOSYNTHESIS (SQD1) PROTEuser 1 3 # 1 A 145 THR A 20 THR.? 5.12 O2 GOL A 200 A 182 TYR A 48 TYR^? 12.35 O2 GOL A 200 A 186 LYS A 18 LYS.? 10.82 O1 GOL A 200 coo 69.38 87.38 24.64 71.11 88.47 25.40 -3.94 19.29 11.99 -2.19 20.21 12.75 coo 73.61 90.42 31.12 71.36 89.66 29.64 0.42 16.28 6.68 0.66 13.80 7.88 coo 73.54 84.00 28.64 69.01 86.68 29.71 -2.73 13.36 9.72 -7.58 13.32 13.61 1qrr_c01 source 1qrr SULFOLIPID BIOSYNTHESIS (SQD1) PROTEIN : 1 hits 1qrr_c01 naa= 3 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 1 3 # 1 A 10 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 186 ASN A 49 ASN^? 15.73 O2 GOL A 200 A 260 ALA A 46 ALA^? 11.57 O1 GOL A 200 coo 11.81 33.10 11.71 13.07 31.45 11.40 2.55 11.74 5.01 1.42 10.07 5.73 coo 11.43 26.53 7.41 13.01 27.56 8.43 6.06 16.51 6.44 7.78 15.19 6.31 coo 21.53 26.33 6.96 20.26 25.69 7.52 -0.56 24.57 4.78 -1.35 24.11 5.95 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 2 3 # 2 A 10 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 186 ASN A 49 ASN^? 15.73 O2 GOL A 200 A 260 ALA A 122 ALA^? 22.22 O2 GOL A 200 coo 11.81 33.10 11.71 13.07 31.45 11.40 2.55 11.74 5.01 1.42 10.07 5.73 coo 11.43 26.53 7.41 13.01 27.56 8.43 6.06 16.51 6.44 7.78 15.19 6.31 coo 21.53 26.33 6.96 20.26 25.69 7.52 14.40 16.69 2.00 13.38 15.62 1.82 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 3 3 # 3 A 10 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 186 ASN A 49 ASN^? 15.73 O2 GOL A 200 A 260 ALA A 125 ALA.? 18.28 O2 GOL A 200 coo 11.81 33.10 11.71 13.07 31.45 11.40 2.55 11.74 5.01 1.42 10.07 5.73 coo 11.43 26.53 7.41 13.01 27.56 8.43 6.06 16.51 6.44 7.78 15.19 6.31 coo 21.53 26.33 6.96 20.26 25.69 7.52 15.51 14.21 10.32 14.09 14.21 10.70 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 4 3 # 4 A 10 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 186 ASN A 49 ASN^? 15.73 O2 GOL A 200 A 260 ALA A 46 ALA^? 11.57 O1 GOL A 200 coo 11.81 33.10 11.71 13.07 31.45 11.40 11.95 23.52 7.79 13.60 24.51 6.84 coo 11.43 26.53 7.41 13.01 27.56 8.43 6.06 16.51 6.44 7.78 15.19 6.31 coo 21.53 26.33 6.96 20.26 25.69 7.52 -0.56 24.57 4.78 -1.35 24.11 5.95 1r4f_c00 source 1r4f IAG-NUCLEOSIDE HYDROLASE : 4 hits 1r4f_c00 naa= 3 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 1 3 # 1 A 104 ILE A 55 ILE^? 17.90 O2 GOL A 200 A 106 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 142 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -15.54 60.72 29.56 -16.71 61.53 30.10 13.41 17.80 8.15 14.34 18.88 8.52 coo -17.00 64.03 23.46 -18.21 65.65 22.90 13.89 24.29 2.75 14.15 26.31 2.22 coo -17.05 67.91 26.85 -18.66 66.47 26.76 11.95 23.52 7.79 13.60 24.51 6.84 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 2 3 # 2 A 104 ILE A 56 ILE^? 18.30 O2 GOL A 200 A 106 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 142 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -15.54 60.72 29.56 -16.71 61.53 30.10 9.94 18.39 3.51 9.10 17.70 2.66 coo -17.00 64.03 23.46 -18.21 65.65 22.90 13.89 24.29 2.75 14.15 26.31 2.22 coo -17.05 67.91 26.85 -18.66 66.47 26.76 11.95 23.52 7.79 13.60 24.51 6.84 1s3i_c00 source 1s3i 10-FORMYLTETRAHYDROFOLATE DEHYDROGENASE : 2 hits 1s3i_c00 naa= 3 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 1 3 # 1 E 166 ASP A 39 ASP^? -14.64 O1 GOL A 200s E 168 LYS A 22 LYS.? 12.21 O1 GOL A 200 E 201 THR A 26 THR^? 16.88 O1 GOL A 200 coo 5.36 16.20 22.10 3.88 17.00 23.31 -8.43 26.08 3.91 -10.39 26.34 4.84 coo 5.06 22.32 18.11 1.02 22.08 22.74 -8.73 20.02 6.97 -12.28 16.97 10.92 coo -1.79 18.29 19.05 -1.19 20.28 19.71 -5.29 18.27 -0.47 -5.00 17.12 1.36 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 2 3 # 2 E 166 ASP A 50 ASP.? 16.78 O2 GOL A 200 E 168 LYS A 15 LYS.? 25.07 O2 GOL A 200 E 201 THR A 13 THR.? 22.16 O2 GOL A 200 coo 5.36 16.20 22.10 3.88 17.00 23.31 2.55 11.74 5.01 1.42 10.07 5.73 coo 5.06 22.32 18.11 1.02 22.08 22.74 0.11 6.41 5.99 2.13 3.29 0.85 coo -1.79 18.29 19.05 -1.19 20.28 19.71 -4.60 8.50 2.06 -5.42 6.45 2.07 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 3 3 # 3 E 166 ASP A 50 ASP.? 16.78 O2 GOL A 200 E 168 LYS A 18 LYS.? 10.82 O1 GOL A 200 E 201 THR A 13 THR.? 22.16 O2 GOL A 200 coo 5.36 16.20 22.10 3.88 17.00 23.31 2.55 11.74 5.01 1.42 10.07 5.73 coo 5.06 22.32 18.11 1.02 22.08 22.74 -2.73 13.36 9.72 -7.58 13.32 13.61 coo -1.79 18.29 19.05 -1.19 20.28 19.71 -4.60 8.50 2.06 -5.42 6.45 2.07 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 4 3 # 4 E 166 ASP A 50 ASP.? 16.78 O2 GOL A 200 E 168 LYS A 18 LYS.? 10.82 O1 GOL A 200 E 201 THR A 104 THR^? 8.26 O2 GOL A 200 coo 5.36 16.20 22.10 3.88 17.00 23.31 2.55 11.74 5.01 1.42 10.07 5.73 coo 5.06 22.32 18.11 1.02 22.08 22.74 -2.73 13.36 9.72 -7.58 13.32 13.61 coo -1.79 18.29 19.05 -1.19 20.28 19.71 1.57 20.47 9.68 -0.64 20.24 9.40 1stc_c02 source 1stc CAMP-DEPENDENT PROTEIN KINASE : 4 hits 1stc_c02 naa= 3 ULMN 3 1stc_c03 CAMP-DEPENDENT PROTEIN KINASE user 1 3 # 1 E 166 ASP A 50 ASP.? 16.78 O2 GOL A 200 E 168 LYS A 15 LYS.? 25.07 O2 GOL A 200 E 171 ASN A 16 ASN.? 18.73 O2 GOL A 200 coo 5.36 16.20 22.10 3.88 17.00 23.31 2.55 11.74 5.01 1.42 10.07 5.73 coo 5.06 22.32 18.11 1.02 22.08 22.74 0.11 6.41 5.99 2.13 3.29 0.85 coo 6.68 21.78 22.39 5.28 20.74 23.60 3.16 8.10 8.93 4.04 6.63 7.72 ULMN 3 1stc_c03 CAMP-DEPENDENT PROTEIN KINASE user 2 3 # 2 E 166 ASP A 50 ASP.? 16.78 O2 GOL A 200 E 168 LYS A 52 LYS.? 20.79 O2 GOL A 200 E 171 ASN A 16 ASN.? 18.73 O2 GOL A 200 coo 5.36 16.20 22.10 3.88 17.00 23.31 2.55 11.74 5.01 1.42 10.07 5.73 coo 5.06 22.32 18.11 1.02 22.08 22.74 8.29 9.60 9.80 7.06 4.86 8.55 coo 6.68 21.78 22.39 5.28 20.74 23.60 3.16 8.10 8.93 4.04 6.63 7.72 1stc_c03 source 1stc CAMP-DEPENDENT PROTEIN KINASE : 2 hits 1stc_c03 naa= 3 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 # 1 A 250 ALA A 38 ALA^? 18.33 O1 GOL A 200 A 251 GLY A 23 GLY.? 14.14 O1 GOL A 200 A 252 ASP A 39 ASP^? -14.64 O1 GOL A 200s coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 -5.56 24.41 0.63 -5.61 24.59 -0.88 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 -8.93 22.43 4.17 -9.31 21.61 4.20 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 -8.43 26.08 3.91 -10.39 26.34 4.84 1tz3_c02 source 1tz3 PUTATIVE SUGAR KINASE : 1 hits 1tz3_c02 naa= 3 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 # 1 B 250 ALA A 38 ALA^? 18.33 O1 GOL A 200 B 251 GLY A 23 GLY.? 14.14 O1 GOL A 200 B 252 ASP A 39 ASP^? -14.64 O1 GOL A 200s coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 -5.56 24.41 0.63 -5.61 24.59 -0.88 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 -8.93 22.43 4.17 -9.31 21.61 4.20 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 -8.43 26.08 3.91 -10.39 26.34 4.84 1tz3_c03 source 1tz3 PUTATIVE SUGAR KINASE : 1 hits 1tz3_c03 naa= 3 ULMN 3 1uk7_c00 3.07.01.0009 user 1 3 # 1 A 103 ALA A 59 ALA^? 23.37 O2 GOL A 200 A 224 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 252 HIS A 57 HIS^? 21.61 O2 GOL A 200 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 10.08 27.38 -1.00 11.44 28.06 -1.17 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 11.95 23.52 7.79 13.60 24.51 6.84 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 13.89 24.29 2.75 14.15 26.31 2.22 ULMN 3 1uk7_c00 3.07.01.0009 user 2 3 # 2 A 103 ALA A 122 ALA^? 22.22 O2 GOL A 200 A 224 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 252 HIS A 57 HIS^? 21.61 O2 GOL A 200 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 14.40 16.69 2.00 13.38 15.62 1.82 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 11.95 23.52 7.79 13.60 24.51 6.84 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 13.89 24.29 2.75 14.15 26.31 2.22 1uk7_c00 source 1uk7 3.07.01.0009 : 2 hits 1uk7_c00 naa= 3 ULMN 3 1un1_c00 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 1 3 # 1 A 85 GLU A 126 GLU.? 25.70 O3 GOL A 200 A 87 ASP A 127 ASP.? 23.55 O3 GOL A 200 A 89 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 22.84 137.30 -8.23 24.70 136.75 -9.08 20.52 12.38 10.99 21.19 10.38 10.71 coo 25.07 140.95 -5.73 24.98 139.34 -7.10 21.64 16.51 15.04 22.41 14.94 16.29 coo 29.50 140.95 -4.45 30.03 140.88 -6.51 26.16 17.92 13.68 27.91 19.15 13.73 ULMN 3 1un1_c00 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 2 3 # 2 A 85 GLU A 128 GLU.? 28.51 O3 GOL A 200 A 87 ASP A 127 ASP.? 23.55 O3 GOL A 200 A 89 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo 22.84 137.30 -8.23 24.70 136.75 -9.08 26.16 17.92 13.68 27.91 19.15 13.73 coo 25.07 140.95 -5.73 24.98 139.34 -7.10 21.64 16.51 15.04 22.41 14.94 16.29 coo 29.50 140.95 -4.45 30.03 140.88 -6.51 20.52 12.38 10.99 21.19 10.38 10.71 1un1_c00 source 1un1 XYLOGLUCAN ENDOTRANSGLYCOSYLASE : 2 hits 1un1_c00 naa= 3 ULMN 3 1un1_c01 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 1 3 # 1 B 85 GLU A 126 GLU.? 25.70 O3 GOL A 200 B 87 ASP A 127 ASP.? 23.55 O3 GOL A 200 B 89 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 19.32 178.30 3.72 20.56 176.87 2.77 20.52 12.38 10.99 21.19 10.38 10.71 coo 22.91 179.81 6.56 22.10 178.65 5.00 21.64 16.51 15.04 22.41 14.94 16.29 coo 26.74 177.55 7.48 27.16 177.47 5.41 26.16 17.92 13.68 27.91 19.15 13.73 ULMN 3 1un1_c01 XYLOGLUCAN ENDOTRANSGLYCOSYLASE user 2 3 # 2 B 85 GLU A 128 GLU.? 28.51 O3 GOL A 200 B 87 ASP A 127 ASP.? 23.55 O3 GOL A 200 B 89 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo 19.32 178.30 3.72 20.56 176.87 2.77 26.16 17.92 13.68 27.91 19.15 13.73 coo 22.91 179.81 6.56 22.10 178.65 5.00 21.64 16.51 15.04 22.41 14.94 16.29 coo 26.74 177.55 7.48 27.16 177.47 5.41 20.52 12.38 10.99 21.19 10.38 10.71 1un1_c01 source 1un1 XYLOGLUCAN ENDOTRANSGLYCOSYLASE : 2 hits 1un1_c01 naa= 3 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 1 3 # 1 A 581 GLU A 103 GLU.? 9.69 O2 GOL A 200 A 596 ARG A 100 ARG.? 12.49 O2 GOL A 200 A 647 ARG A 132 ARG.? 16.38 O3 GOL A 200 coo 69.13 32.20 28.58 68.39 32.96 30.44 5.18 20.01 12.20 7.16 20.80 12.53 coo 70.89 37.31 29.70 69.54 36.29 32.39 10.61 20.08 13.39 10.29 23.15 12.59 coo 66.09 40.54 34.70 66.92 37.69 35.49 15.71 15.59 15.34 14.57 17.73 13.37 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 2 3 # 2 A 581 GLU A 126 GLU.? 25.70 O3 GOL A 200 A 596 ARG A 132 ARG.? 16.38 O3 GOL A 200 A 647 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo 69.13 32.20 28.58 68.39 32.96 30.44 20.52 12.38 10.99 21.19 10.38 10.71 coo 70.89 37.31 29.70 69.54 36.29 32.39 15.71 15.59 15.34 14.57 17.73 13.37 coo 66.09 40.54 34.70 66.92 37.69 35.49 10.61 20.08 13.39 10.29 23.15 12.59 1v0e_c00 source 1v0e ENDO-ALPHA-SIALIDASE : 2 hits 1v0e_c00 naa= 3 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 1 3 # 1 B 581 GLU A 103 GLU.? 9.69 O2 GOL A 200 B 596 ARG A 100 ARG.? 12.49 O2 GOL A 200 B 647 ARG A 132 ARG.? 16.38 O3 GOL A 200 coo 38.22 57.83 70.36 36.82 56.74 69.18 5.18 20.01 12.20 7.16 20.80 12.53 coo 34.24 60.89 68.08 33.31 57.93 67.63 10.61 20.08 13.39 10.29 23.15 12.59 coo 31.43 57.38 61.97 31.90 55.58 64.41 15.71 15.59 15.34 14.57 17.73 13.37 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 2 3 # 2 B 581 GLU A 126 GLU.? 25.70 O3 GOL A 200 B 596 ARG A 132 ARG.? 16.38 O3 GOL A 200 B 647 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo 38.22 57.83 70.36 36.82 56.74 69.18 20.52 12.38 10.99 21.19 10.38 10.71 coo 34.24 60.89 68.08 33.31 57.93 67.63 15.71 15.59 15.34 14.57 17.73 13.37 coo 31.43 57.38 61.97 31.90 55.58 64.41 10.61 20.08 13.39 10.29 23.15 12.59 1v0e_c01 source 1v0e ENDO-ALPHA-SIALIDASE : 2 hits 1v0e_c01 naa= 3 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 1 3 # 1 C 581 GLU A 103 GLU.? 9.69 O2 GOL A 200 C 596 ARG A 100 ARG.? 12.49 O2 GOL A 200 C 647 ARG A 132 ARG.? 16.38 O3 GOL A 200 coo 11.31 31.26 27.00 13.31 30.71 26.58 5.18 20.01 12.20 7.16 20.80 12.53 coo 13.44 32.78 22.07 15.56 30.91 23.37 10.61 20.08 13.39 10.29 23.15 12.59 coo 21.00 33.35 22.82 19.83 30.82 24.09 15.71 15.59 15.34 14.57 17.73 13.37 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 2 3 # 2 C 581 GLU A 126 GLU.? 25.70 O3 GOL A 200 C 596 ARG A 132 ARG.? 16.38 O3 GOL A 200 C 647 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo 11.31 31.26 27.00 13.31 30.71 26.58 20.52 12.38 10.99 21.19 10.38 10.71 coo 13.44 32.78 22.07 15.56 30.91 23.37 15.71 15.59 15.34 14.57 17.73 13.37 coo 21.00 33.35 22.82 19.83 30.82 24.09 10.61 20.08 13.39 10.29 23.15 12.59 1v0e_c02 source 1v0e ENDO-ALPHA-SIALIDASE : 2 hits 1v0e_c02 naa= 3 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 1 3 # 1 D 581 GLU A 103 GLU.? 9.69 O2 GOL A 200 D 596 ARG A 100 ARG.? 12.49 O2 GOL A 200 D 647 ARG A 132 ARG.? 16.38 O3 GOL A 200 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 5.18 20.01 12.20 7.16 20.80 12.53 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 10.61 20.08 13.39 10.29 23.15 12.59 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 15.71 15.59 15.34 14.57 17.73 13.37 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 2 3 # 2 D 581 GLU A 126 GLU.? 25.70 O3 GOL A 200 D 596 ARG A 132 ARG.? 16.38 O3 GOL A 200 D 647 ARG A 100 ARG.? 12.49 O2 GOL A 200 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 20.52 12.38 10.99 21.19 10.38 10.71 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 15.71 15.59 15.34 14.57 17.73 13.37 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 10.61 20.08 13.39 10.29 23.15 12.59 1v0e_c03 source 1v0e ENDO-ALPHA-SIALIDASE : 2 hits 1v0e_c03 naa= 3 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 1 3 # 1 E 581 GLU A 103 GLU.? 9.69 O2 GOL A 200 E 596 ARG A 100 ARG.? 12.49 O2 GOL A 200 E 647 ARG A 132 ARG.? 16.38 O3 GOL A 200 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 5.18 20.01 12.20 7.16 20.80 12.53 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 10.61 20.08 13.39 10.29 23.15 12.59 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 15.71 15.59 15.34 14.57 17.73 13.37 1v0e_c04 source 1v0e ENDO-ALPHA-SIALIDASE : 1 hits 1v0e_c04 naa= 3 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 1 3 # 1 F 581 GLU A 103 GLU.? 9.69 O2 GOL A 200 F 596 ARG A 100 ARG.? 12.49 O2 GOL A 200 F 647 ARG A 132 ARG.? 16.38 O3 GOL A 200 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 5.18 20.01 12.20 7.16 20.80 12.53 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 10.61 20.08 13.39 10.29 23.15 12.59 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 15.71 15.59 15.34 14.57 17.73 13.37 1v0e_c05 source 1v0e ENDO-ALPHA-SIALIDASE : 1 hits 1v0e_c05 naa= 3 ULMN 3 1vq1_c00 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 1 3 # 1 A 100 PHE A 14 PHE.? 15.76 O2 GOL A 200 A 197 ASN A 32 ASN.? 25.03 O2 GOL A 200 A 198 PRO A 28 PRO^? 22.38 O2 GOL A 200 coo 5.24 -2.19 28.74 3.83 -0.30 30.29 -2.87 11.64 5.25 -3.74 14.04 4.14 coo 6.86 -1.03 36.13 5.08 -0.39 35.24 2.89 10.42 -2.40 2.49 10.28 -4.45 coo 3.80 -4.83 39.13 4.75 -4.51 37.10 -1.02 14.03 -4.43 -0.42 15.83 -3.19 ULMN 3 1vq1_c00 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 2 3 # 2 A 100 PHE A 30 PHE.? 23.27 O2 GOL A 200 A 197 ASN A 32 ASN.? 25.03 O2 GOL A 200 A 198 PRO A 28 PRO^? 22.38 O2 GOL A 200 coo 5.24 -2.19 28.74 3.83 -0.30 30.29 9.13 16.01 -1.98 11.91 15.81 -1.58 coo 6.86 -1.03 36.13 5.08 -0.39 35.24 2.89 10.42 -2.40 2.49 10.28 -4.45 coo 3.80 -4.83 39.13 4.75 -4.51 37.10 -1.02 14.03 -4.43 -0.42 15.83 -3.19 1vq1_c00 source 1vq1 N5-GLUTAMINE METHYLTRANSFERASE, HEMK : 2 hits 1vq1_c00 naa= 3 ULMN 3 1vq1_c01 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 1 3 # 1 B 100 PHE A 30 PHE.? 23.27 O2 GOL A 200 B 197 ASN A 32 ASN.? 25.03 O2 GOL A 200 B 198 PRO A 28 PRO^? 22.38 O2 GOL A 200 coo 15.92 -14.38 -0.49 15.85 -16.40 -2.42 9.13 16.01 -1.98 11.91 15.81 -1.58 coo 21.71 -15.65 -5.30 19.75 -16.44 -5.47 2.89 10.42 -2.40 2.49 10.28 -4.45 coo 21.24 -11.77 -9.43 20.56 -12.14 -7.31 -1.02 14.03 -4.43 -0.42 15.83 -3.19 1vq1_c01 source 1vq1 N5-GLUTAMINE METHYLTRANSFERASE, HEMK : 1 hits 1vq1_c01 naa= 3 ULMN 3 1xqd_c02 CYTOCHROME P450 55A1 user 1 3 # 1 A 243 THR A 119 THR^? 25.97 O2 GOL A 200 A 345 PHE A 107 PHE^? 17.79 O2 GOL A 200 A 352 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 9.58 21.79 21.50 11.25 23.03 20.90 13.04 24.62 -3.89 14.83 25.20 -2.71 coo 19.40 19.75 18.58 17.39 17.81 18.80 3.44 27.97 2.84 5.43 28.55 0.97 coo 21.57 22.52 22.79 19.20 21.13 23.26 8.07 32.08 0.96 5.72 33.61 0.99 1xqd_c02 source 1xqd CYTOCHROME P450 55A1 : 1 hits 1xqd_c02 naa= 3 ULMN 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 1 3 # 1 A 105 ALA A 59 ALA^? 23.37 O2 GOL A 200 A 244 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 271 HIS A 57 HIS^? 21.61 O2 GOL A 200 coo 15.05 3.71 6.93 14.58 4.88 7.78 10.08 27.38 -1.00 11.44 28.06 -1.17 coo 9.85 8.15 0.76 10.61 7.04 2.39 11.95 23.52 7.79 13.60 24.51 6.84 coo 10.61 7.65 6.01 12.39 6.55 6.23 13.89 24.29 2.75 14.15 26.31 2.22 ULMN 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 2 3 # 2 A 105 ALA A 122 ALA^? 22.22 O2 GOL A 200 A 244 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 271 HIS A 57 HIS^? 21.61 O2 GOL A 200 coo 15.05 3.71 6.93 14.58 4.88 7.78 14.40 16.69 2.00 13.38 15.62 1.82 coo 9.85 8.15 0.76 10.61 7.04 2.39 11.95 23.52 7.79 13.60 24.51 6.84 coo 10.61 7.65 6.01 12.39 6.55 6.23 13.89 24.29 2.75 14.15 26.31 2.22 1xqw_c00 source 1xqw PROLINE IMINOPEPTIDASE : 2 hits 1xqw_c00 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 76 ALA^? 21.92 O2 GOL A 200 B 126 ARG A 78 ARG^? 28.55 O1 GOL A 200 B 138 GLU A 96 GLU^? 22.95 O2 GOL A 200 coo 2.11 4.00 19.31 3.14 4.86 19.99 8.98 35.56 3.23 7.58 35.96 3.25 coo 2.45 5.53 11.28 3.59 7.56 13.29 8.68 43.58 -0.60 5.77 43.81 0.43 coo 6.10 2.00 25.24 6.12 1.84 23.13 12.01 30.07 3.21 14.10 30.25 2.56 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 B 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 B 126 ARG A 100 ARG.? 12.49 O2 GOL A 200 B 138 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo 2.11 4.00 19.31 3.14 4.86 19.99 15.51 14.21 10.32 14.09 14.21 10.70 coo 2.45 5.53 11.28 3.59 7.56 13.29 10.61 20.08 13.39 10.29 23.15 12.59 coo 6.10 2.00 25.24 6.12 1.84 23.13 11.74 7.72 7.91 12.92 5.90 7.68 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 76 ALA^? 21.92 O2 GOL A 200 C 126 ARG A 78 ARG^? 28.55 O1 GOL A 200 C 138 GLU A 96 GLU^? 22.95 O2 GOL A 200 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 8.98 35.56 3.23 7.58 35.96 3.25 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 8.68 43.58 -0.60 5.77 43.81 0.43 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 12.01 30.07 3.21 14.10 30.25 2.56 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 C 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 C 126 ARG A 100 ARG.? 12.49 O2 GOL A 200 C 138 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 15.51 14.21 10.32 14.09 14.21 10.70 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 10.61 20.08 13.39 10.29 23.15 12.59 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 11.74 7.72 7.91 12.92 5.90 7.68 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 C 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 C 126 ARG A 100 ARG.? 12.49 O2 GOL A 200 C 138 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 15.51 14.21 10.32 14.09 14.21 10.70 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 10.61 20.08 13.39 10.29 23.15 12.59 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 20.52 12.38 10.99 21.19 10.38 10.71 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 C 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 C 126 ARG A 123 ARG^? 24.89 O2 GOL A 200 C 138 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 15.51 14.21 10.32 14.09 14.21 10.70 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 18.70 18.30 6.22 21.48 19.12 7.39 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 11.74 7.72 7.91 12.92 5.90 7.68 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 4 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 76 ALA^? 21.92 O2 GOL A 200 D 126 ARG A 78 ARG^? 28.55 O1 GOL A 200 D 138 GLU A 96 GLU^? 22.95 O2 GOL A 200 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 8.98 35.56 3.23 7.58 35.96 3.25 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 8.68 43.58 -0.60 5.77 43.81 0.43 coo 6.23 0.50 57.10 5.93 0.72 59.19 12.01 30.07 3.21 14.10 30.25 2.56 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 D 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 D 126 ARG A 100 ARG.? 12.49 O2 GOL A 200 D 138 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 15.51 14.21 10.32 14.09 14.21 10.70 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 10.61 20.08 13.39 10.29 23.15 12.59 coo 6.23 0.50 57.10 5.93 0.72 59.19 11.74 7.72 7.91 12.92 5.90 7.68 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 D 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 D 126 ARG A 123 ARG^? 24.89 O2 GOL A 200 D 138 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 15.51 14.21 10.32 14.09 14.21 10.70 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 18.70 18.30 6.22 21.48 19.12 7.39 coo 6.23 0.50 57.10 5.93 0.72 59.19 11.74 7.72 7.91 12.92 5.90 7.68 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 3 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 76 ALA^? 21.92 O2 GOL A 200 E 126 ARG A 78 ARG^? 28.55 O1 GOL A 200 E 138 GLU A 96 GLU^? 22.95 O2 GOL A 200 coo -4.56 10.03 62.36 -4.38 11.31 61.55 8.98 35.56 3.23 7.58 35.96 3.25 coo -3.02 12.00 70.07 -1.94 13.84 67.82 8.68 43.58 -0.60 5.77 43.81 0.43 coo -8.67 12.22 56.54 -8.68 12.09 58.65 12.01 30.07 3.21 14.10 30.25 2.56 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 E 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 E 126 ARG A 100 ARG.? 12.49 O2 GOL A 200 E 138 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -4.56 10.03 62.36 -4.38 11.31 61.55 15.51 14.21 10.32 14.09 14.21 10.70 coo -3.02 12.00 70.07 -1.94 13.84 67.82 10.61 20.08 13.39 10.29 23.15 12.59 coo -8.67 12.22 56.54 -8.68 12.09 58.65 11.74 7.72 7.91 12.92 5.90 7.68 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 E 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 E 126 ARG A 123 ARG^? 24.89 O2 GOL A 200 E 138 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -4.56 10.03 62.36 -4.38 11.31 61.55 15.51 14.21 10.32 14.09 14.21 10.70 coo -3.02 12.00 70.07 -1.94 13.84 67.82 18.70 18.30 6.22 21.48 19.12 7.39 coo -8.67 12.22 56.54 -8.68 12.09 58.65 11.74 7.72 7.91 12.92 5.90 7.68 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 3 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 76 ALA^? 21.92 O2 GOL A 200 F 126 ARG A 78 ARG^? 28.55 O1 GOL A 200 F 138 GLU A 96 GLU^? 22.95 O2 GOL A 200 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 8.98 35.56 3.23 7.58 35.96 3.25 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 8.68 43.58 -0.60 5.77 43.81 0.43 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 12.01 30.07 3.21 14.10 30.25 2.56 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 F 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 F 126 ARG A 100 ARG.? 12.49 O2 GOL A 200 F 138 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 15.51 14.21 10.32 14.09 14.21 10.70 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 10.61 20.08 13.39 10.29 23.15 12.59 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 11.74 7.72 7.91 12.92 5.90 7.68 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 3 3 # 3 F 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 F 126 ARG A 100 ARG.? 12.49 O2 GOL A 200 F 138 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 15.51 14.21 10.32 14.09 14.21 10.70 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 10.61 20.08 13.39 10.29 23.15 12.59 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 20.52 12.38 10.99 21.19 10.38 10.71 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 4 3 # 4 F 124 ALA A 125 ALA.? 18.28 O2 GOL A 200 F 126 ARG A 123 ARG^? 24.89 O2 GOL A 200 F 138 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 15.51 14.21 10.32 14.09 14.21 10.70 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 18.70 18.30 6.22 21.48 19.12 7.39 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 11.74 7.72 7.91 12.92 5.90 7.68 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 4 hits 1xs1_c11 naa= 3 ULMN 3 1ylu_c00 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 A 14 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 74 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 18.28 7.83 36.39 22.82 8.75 39.52 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 14.16 13.09 37.03 20.00 12.44 37.49 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 22.22 16.06 48.76 23.94 15.33 49.78 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1ylu_c00 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 2 3 # 2 A 14 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 74 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 18.28 7.83 36.39 22.82 8.75 39.52 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 14.16 13.09 37.03 20.00 12.44 37.49 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 22.22 16.06 48.76 23.94 15.33 49.78 -4.71 33.85 5.16 -5.48 33.44 7.13 1ylu_c00 source 1ylu OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 2 hits 1ylu_c00 naa= 3 ULMN 3 1ylu_c01 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 1 3 # 1 B 14 LYS A 22 LYS.? 12.21 O1 GOL A 200 B 74 LYS A 25 LYS^? 23.71 O1 GOL A 200 B 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 13.51 0.92 76.10 12.98 6.13 74.68 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 19.89 -0.55 76.51 17.10 4.32 77.43 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 21.39 11.56 68.52 20.24 13.13 67.73 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 1ylu_c01 OXYGEN-INSENSITIVE NAD(P)H NITROREDUuser 2 3 # 2 B 14 LYS A 25 LYS^? 23.71 O1 GOL A 200 B 74 LYS A 22 LYS.? 12.21 O1 GOL A 200 B 165 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 13.51 0.92 76.10 12.98 6.13 74.68 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 19.89 -0.55 76.51 17.10 4.32 77.43 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 21.39 11.56 68.52 20.24 13.13 67.73 -4.71 33.85 5.16 -5.48 33.44 7.13 1ylu_c01 source 1ylu OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE : 2 hits 1ylu_c01 naa= 3 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 1 3 # 1 A 369 ASP A 39 ASP^? -14.64 O1 GOL A 200s A 371 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 407 THR A 24 THR.? 18.30 O1 GOL A 200 coo -5.17 31.09 15.73 -7.07 31.12 16.73 -8.43 26.08 3.91 -10.39 26.34 4.84 coo -4.43 30.92 22.89 -6.61 31.91 19.71 -8.73 20.02 6.97 -12.28 16.97 10.92 coo -8.38 36.02 19.06 -8.83 34.10 19.89 -11.17 21.80 1.28 -11.84 23.84 0.97 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 2 3 # 2 A 369 ASP A 39 ASP^? -14.64 O1 GOL A 200s A 371 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 407 THR A 40 THR.? 20.70 O1 GOL A 200 coo -5.17 31.09 15.73 -7.07 31.12 16.73 -8.43 26.08 3.91 -10.39 26.34 4.84 coo -4.43 30.92 22.89 -6.61 31.91 19.71 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo -8.38 36.02 19.06 -8.83 34.10 19.89 -10.64 28.13 0.05 -11.89 26.87 -1.24 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 3 3 # 3 A 369 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 371 LYS A 15 LYS.? 25.07 O2 GOL A 200 A 407 THR A 13 THR.? 22.16 O2 GOL A 200 coo -5.17 31.09 15.73 -7.07 31.12 16.73 2.55 11.74 5.01 1.42 10.07 5.73 coo -4.43 30.92 22.89 -6.61 31.91 19.71 0.11 6.41 5.99 2.13 3.29 0.85 coo -8.38 36.02 19.06 -8.83 34.10 19.89 -4.60 8.50 2.06 -5.42 6.45 2.07 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 4 3 # 4 A 369 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 371 LYS A 18 LYS.? 10.82 O1 GOL A 200 A 407 THR A 13 THR.? 22.16 O2 GOL A 200 coo -5.17 31.09 15.73 -7.07 31.12 16.73 2.55 11.74 5.01 1.42 10.07 5.73 coo -4.43 30.92 22.89 -6.61 31.91 19.71 -2.73 13.36 9.72 -7.58 13.32 13.61 coo -8.38 36.02 19.06 -8.83 34.10 19.89 -4.60 8.50 2.06 -5.42 6.45 2.07 1zrz_c02 source 1zrz PROTEIN KINASE C, IOTA : 4 hits 1zrz_c02 naa= 3 ULMN 3 1zrz_c03 PROTEIN KINASE C, IOTA user 1 3 # 1 A 369 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 371 LYS A 15 LYS.? 25.07 O2 GOL A 200 A 374 ASN A 16 ASN.? 18.73 O2 GOL A 200 coo -5.17 31.09 15.73 -7.07 31.12 16.73 2.55 11.74 5.01 1.42 10.07 5.73 coo -4.43 30.92 22.89 -6.61 31.91 19.71 0.11 6.41 5.99 2.13 3.29 0.85 coo -4.84 27.04 20.49 -6.40 27.76 19.26 3.16 8.10 8.93 4.04 6.63 7.72 ULMN 3 1zrz_c03 PROTEIN KINASE C, IOTA user 2 3 # 2 A 369 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 371 LYS A 52 LYS.? 20.79 O2 GOL A 200 A 374 ASN A 16 ASN.? 18.73 O2 GOL A 200 coo -5.17 31.09 15.73 -7.07 31.12 16.73 2.55 11.74 5.01 1.42 10.07 5.73 coo -4.43 30.92 22.89 -6.61 31.91 19.71 8.29 9.60 9.80 7.06 4.86 8.55 coo -4.84 27.04 20.49 -6.40 27.76 19.26 3.16 8.10 8.93 4.04 6.63 7.72 1zrz_c03 source 1zrz PROTEIN KINASE C, IOTA : 2 hits 1zrz_c03 naa= 3 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 # 1 142 TRP A 115 TRP^? 25.03 O1 GOL A 200 223 ASP A 63 ASP^? 31.81 O1 GOL A 200 258 ALA A 59 ALA^? 23.37 O2 GOL A 200 coo 128.40 33.01 26.67 128.12 36.28 28.81 0.20 29.00 -7.44 1.47 25.44 -6.55 coo 127.91 41.73 23.55 129.18 40.35 24.44 3.02 36.19 -9.95 3.74 34.72 -11.31 coo 141.00 37.49 25.74 139.80 37.53 24.78 10.08 27.38 -1.00 11.44 28.06 -1.17 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 # 2 142 TRP A 115 TRP^? 25.03 O1 GOL A 200 223 ASP A 63 ASP^? 31.81 O1 GOL A 200 258 ALA A 76 ALA^? 21.92 O2 GOL A 200 coo 128.40 33.01 26.67 128.12 36.28 28.81 0.20 29.00 -7.44 1.47 25.44 -6.55 coo 127.91 41.73 23.55 129.18 40.35 24.44 3.02 36.19 -9.95 3.74 34.72 -11.31 coo 141.00 37.49 25.74 139.80 37.53 24.78 8.98 35.56 3.23 7.58 35.96 3.25 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 2 hits 2aat_c01 naa= 3 ULMN 3 2adm_c00 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 1 3 # 1 A 105 ASN A 32 ASN.? 25.03 O2 GOL A 200 A 106 PRO A 28 PRO^? 22.38 O2 GOL A 200 A 108 TYR A 35 TYR^? 18.28 O2 GOL A 200 coo 34.91 38.94 20.48 33.53 38.20 19.00 2.89 10.42 -2.40 2.49 10.28 -4.45 coo 36.18 33.51 20.99 37.11 35.33 20.14 -1.02 14.03 -4.43 -0.42 15.83 -3.19 coo 33.01 33.46 15.68 31.96 34.97 17.80 -0.13 15.22 1.35 0.07 12.52 0.73 2adm_c00 source 2adm ADENINE-N6-DNA-METHYLTRANSFERASE TAQI : 1 hits 2adm_c00 naa= 3 ULMN 3 2adm_c01 ADENINE-N6-DNA-METHYLTRANSFERASE TAQuser 1 3 # 1 B 105 ASN A 32 ASN.? 25.03 O2 GOL A 200 B 106 PRO A 28 PRO^? 22.38 O2 GOL A 200 B 108 TYR A 35 TYR^? 18.28 O2 GOL A 200 coo 5.98 38.14 46.94 7.30 38.92 45.46 2.89 10.42 -2.40 2.49 10.28 -4.45 coo 4.66 43.53 47.47 3.74 41.73 46.59 -1.02 14.03 -4.43 -0.42 15.83 -3.19 coo 7.86 43.80 42.15 8.87 42.26 44.27 -0.13 15.22 1.35 0.07 12.52 0.73 2adm_c01 source 2adm ADENINE-N6-DNA-METHYLTRANSFERASE TAQI : 1 hits 2adm_c01 naa= 3 ULMN 3 2ayh_c00 1,3-1,4-BETA-D-GLUCAN 4 GLUCANOHYDROuser 1 3 # 1 105 GLU A 126 GLU.? 25.70 O3 GOL A 200 107 ASP A 127 ASP.? 23.55 O3 GOL A 200 109 GLU A 128 GLU.? 28.51 O3 GOL A 200 coo 15.97 13.58 10.29 15.12 15.36 9.48 20.52 12.38 10.99 21.19 10.38 10.71 coo 20.07 16.34 11.47 18.03 16.15 11.04 21.64 16.51 15.04 22.41 14.94 16.29 coo 20.99 19.84 9.56 19.07 20.34 10.22 26.16 17.92 13.68 27.91 19.15 13.73 ULMN 3 2ayh_c00 1,3-1,4-BETA-D-GLUCAN 4 GLUCANOHYDROuser 2 3 # 2 105 GLU A 128 GLU.? 28.51 O3 GOL A 200 107 ASP A 127 ASP.? 23.55 O3 GOL A 200 109 GLU A 126 GLU.? 25.70 O3 GOL A 200 coo 15.97 13.58 10.29 15.12 15.36 9.48 26.16 17.92 13.68 27.91 19.15 13.73 coo 20.07 16.34 11.47 18.03 16.15 11.04 21.64 16.51 15.04 22.41 14.94 16.29 coo 20.99 19.84 9.56 19.07 20.34 10.22 20.52 12.38 10.99 21.19 10.38 10.71 2ayh_c00 source 2ayh 1,3-1,4-BETA-D-GLUCAN 4 GLUCANOHYDROLASE (E.C.: 2 hits 2ayh_c00 naa= 3 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 1 3 # 1 A 14 ARG A 36 ARG^? 21.82 O1 GOL A 200 A 161 ASP A 63 ASP^? 31.81 O1 GOL A 200 A 174 TYR A 93 TYR^? 27.86 O1 GOL A 200 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 3.02 36.19 -9.95 3.74 34.72 -11.31 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 5.50 38.33 -2.98 4.27 40.74 -3.60 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 2 3 # 2 A 14 ARG A 43 ARG.? -22.33 O1 GOL A 200s A 161 ASP A 63 ASP^? 31.81 O1 GOL A 200 A 174 TYR A 93 TYR^? 27.86 O1 GOL A 200 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 -9.68 34.50 0.13 -8.09 37.08 0.79 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 3.02 36.19 -9.95 3.74 34.72 -11.31 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 5.50 38.33 -2.98 4.27 40.74 -3.60 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 3 3 # 3 A 14 ARG A 100 ARG.? 12.49 O2 GOL A 200 A 161 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 174 TYR A 48 TYR^? 12.35 O2 GOL A 200 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 10.61 20.08 13.39 10.29 23.15 12.59 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 2.55 11.74 5.01 1.42 10.07 5.73 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 0.42 16.28 6.68 0.66 13.80 7.88 2c7v_c08 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c08 naa= 3 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 1 3 # 1 B 14 ARG A 36 ARG^? 21.82 O1 GOL A 200 B 161 ASP A 63 ASP^? 31.81 O1 GOL A 200 B 174 TYR A 93 TYR^? 27.86 O1 GOL A 200 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo -14.86 10.19 8.14 -14.82 12.31 8.42 3.02 36.19 -9.95 3.74 34.72 -11.31 coo -21.46 12.70 8.53 -19.04 12.30 7.24 5.50 38.33 -2.98 4.27 40.74 -3.60 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 2 3 # 2 B 14 ARG A 43 ARG.? -22.33 O1 GOL A 200s B 161 ASP A 63 ASP^? 31.81 O1 GOL A 200 B 174 TYR A 93 TYR^? 27.86 O1 GOL A 200 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 -9.68 34.50 0.13 -8.09 37.08 0.79 coo -14.86 10.19 8.14 -14.82 12.31 8.42 3.02 36.19 -9.95 3.74 34.72 -11.31 coo -21.46 12.70 8.53 -19.04 12.30 7.24 5.50 38.33 -2.98 4.27 40.74 -3.60 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 3 3 # 3 B 14 ARG A 100 ARG.? 12.49 O2 GOL A 200 B 161 ASP A 50 ASP.? 16.78 O2 GOL A 200 B 174 TYR A 48 TYR^? 12.35 O2 GOL A 200 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 10.61 20.08 13.39 10.29 23.15 12.59 coo -14.86 10.19 8.14 -14.82 12.31 8.42 2.55 11.74 5.01 1.42 10.07 5.73 coo -21.46 12.70 8.53 -19.04 12.30 7.24 0.42 16.28 6.68 0.66 13.80 7.88 2c7v_c09 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c09 naa= 3 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 1 3 # 1 C 14 ARG A 36 ARG^? 21.82 O1 GOL A 200 C 161 ASP A 63 ASP^? 31.81 O1 GOL A 200 C 174 TYR A 93 TYR^? 27.86 O1 GOL A 200 coo 2.84 19.43 40.34 1.59 20.35 37.65 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo -0.62 11.10 28.05 -0.65 13.15 27.46 3.02 36.19 -9.95 3.74 34.72 -11.31 coo 5.94 13.28 27.17 3.53 13.05 28.58 5.50 38.33 -2.98 4.27 40.74 -3.60 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 2 3 # 2 C 14 ARG A 43 ARG.? -22.33 O1 GOL A 200s C 161 ASP A 63 ASP^? 31.81 O1 GOL A 200 C 174 TYR A 93 TYR^? 27.86 O1 GOL A 200 coo 2.84 19.43 40.34 1.59 20.35 37.65 -9.68 34.50 0.13 -8.09 37.08 0.79 coo -0.62 11.10 28.05 -0.65 13.15 27.46 3.02 36.19 -9.95 3.74 34.72 -11.31 coo 5.94 13.28 27.17 3.53 13.05 28.58 5.50 38.33 -2.98 4.27 40.74 -3.60 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 3 3 # 3 C 14 ARG A 100 ARG.? 12.49 O2 GOL A 200 C 161 ASP A 50 ASP.? 16.78 O2 GOL A 200 C 174 TYR A 35 TYR^? 18.28 O2 GOL A 200 coo 2.84 19.43 40.34 1.59 20.35 37.65 10.61 20.08 13.39 10.29 23.15 12.59 coo -0.62 11.10 28.05 -0.65 13.15 27.46 2.55 11.74 5.01 1.42 10.07 5.73 coo 5.94 13.28 27.17 3.53 13.05 28.58 -0.13 15.22 1.35 0.07 12.52 0.73 2c7v_c10 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c10 naa= 3 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 1 3 # 1 D 14 ARG A 36 ARG^? 21.82 O1 GOL A 200 D 161 ASP A 63 ASP^? 31.81 O1 GOL A 200 D 174 TYR A 93 TYR^? 27.86 O1 GOL A 200 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 3.02 36.19 -9.95 3.74 34.72 -11.31 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 5.50 38.33 -2.98 4.27 40.74 -3.60 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 2 3 # 2 D 14 ARG A 43 ARG.? -22.33 O1 GOL A 200s D 161 ASP A 63 ASP^? 31.81 O1 GOL A 200 D 174 TYR A 93 TYR^? 27.86 O1 GOL A 200 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 -9.68 34.50 0.13 -8.09 37.08 0.79 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 3.02 36.19 -9.95 3.74 34.72 -11.31 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 5.50 38.33 -2.98 4.27 40.74 -3.60 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 3 3 # 3 D 14 ARG A 100 ARG.? 12.49 O2 GOL A 200 D 161 ASP A 50 ASP.? 16.78 O2 GOL A 200 D 174 TYR A 48 TYR^? 12.35 O2 GOL A 200 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 10.61 20.08 13.39 10.29 23.15 12.59 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 2.55 11.74 5.01 1.42 10.07 5.73 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 0.42 16.28 6.68 0.66 13.80 7.88 2c7v_c11 source 2c7v PTERIDINE REDUCTASE : 3 hits 2c7v_c11 naa= 3 ULMN 3 2dbt_c00 CHITINASE C user 1 3 # 1 A 147 GLU A 121 GLU^? 27.36 O2 GOL A 200 A 156 GLU A 96 GLU^? 22.95 O2 GOL A 200 A 194 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo 74.14 15.91 8.55 72.08 15.36 8.63 16.93 19.57 -0.26 18.29 20.31 -1.73 coo 67.47 20.07 1.34 65.99 20.06 2.88 12.01 30.07 3.21 14.10 30.25 2.56 coo 67.44 25.26 13.91 67.54 23.65 15.28 6.06 16.51 6.44 7.78 15.19 6.31 2dbt_c00 source 2dbt CHITINASE C : 1 hits 2dbt_c00 naa= 3 ULMN 3 2dbt_c01 CHITINASE C user 1 3 # 1 B 147 GLU A 121 GLU^? 27.36 O2 GOL A 200 B 156 GLU A 96 GLU^? 22.95 O2 GOL A 200 B 194 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo 45.64 63.11 17.20 47.48 62.43 16.45 16.93 19.57 -0.26 18.29 20.31 -1.73 coo 54.43 67.89 19.82 55.62 67.90 18.07 12.01 30.07 3.21 14.10 30.25 2.56 coo 49.79 70.75 7.78 50.10 68.90 6.86 6.06 16.51 6.44 7.78 15.19 6.31 2dbt_c01 source 2dbt CHITINASE C : 1 hits 2dbt_c01 naa= 3 ULMN 3 2dbt_c02 CHITINASE C user 1 3 # 1 C 147 GLU A 121 GLU^? 27.36 O2 GOL A 200 C 156 GLU A 96 GLU^? 22.95 O2 GOL A 200 C 194 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo 41.23 29.31 13.28 43.03 29.85 12.29 16.93 19.57 -0.26 18.29 20.31 -1.73 coo 44.75 23.09 5.51 46.77 22.91 6.12 12.01 30.07 3.21 14.10 30.25 2.56 coo 49.75 21.00 18.12 50.45 23.02 18.26 6.06 16.51 6.44 7.78 15.19 6.31 2dbt_c02 source 2dbt CHITINASE C : 1 hits 2dbt_c02 naa= 3 ULMN 3 2dw7_c32 BLL6730 PROTEIN user 1 3 # 1 A 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 5.98 42.76 7.73 10.19 38.62 9.02 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 2.77 37.17 4.99 6.33 34.76 8.06 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 0.07 40.30 18.65 -0.21 42.34 18.18 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c32 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c32 naa= 3 ULMN 3 2dw7_c33 BLL6730 PROTEIN user 1 3 # 1 B 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 B 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 B 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 38.76 2.27 4.00 34.00 5.99 4.37 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 40.63 7.13 9.06 35.85 7.36 8.95 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 34.36 -6.33 13.69 36.02 -6.07 12.41 2.55 11.74 5.01 1.42 10.07 5.73 ULMN 3 2dw7_c33 BLL6730 PROTEIN user 2 3 # 2 B 182 LYS A 25 LYS^? 23.71 O1 GOL A 200 B 184 LYS A 22 LYS.? 12.21 O1 GOL A 200 B 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 38.76 2.27 4.00 34.00 5.99 4.37 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 40.63 7.13 9.06 35.85 7.36 8.95 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 34.36 -6.33 13.69 36.02 -6.07 12.41 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c33 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c33 naa= 3 ULMN 3 2dw7_c34 BLL6730 PROTEIN user 1 3 # 1 C 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 C 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 C 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo -5.66 12.40 71.13 -2.66 9.98 66.50 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 0.95 12.72 73.51 1.58 12.72 68.31 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo -4.59 24.28 66.67 -6.26 24.34 67.99 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c34 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c34 naa= 3 ULMN 3 2dw7_c35 BLL6730 PROTEIN user 1 3 # 1 D 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 D 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 D 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 29.31 -12.29 40.88 26.50 -8.82 44.94 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 23.25 -10.73 37.68 24.08 -6.91 41.08 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 35.01 -2.71 35.14 36.51 -4.14 34.87 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c35 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c35 naa= 3 ULMN 3 2dw7_c36 BLL6730 PROTEIN user 1 3 # 1 E 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 E 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 E 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo -21.16 62.58 121.86 -16.35 60.33 119.23 -8.73 20.02 6.97 -12.28 16.97 10.92 coo -23.22 55.98 120.74 -18.11 55.31 120.43 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo -17.15 59.71 133.33 -17.96 61.54 134.01 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c36 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c36 naa= 3 ULMN 3 2dw7_c37 BLL6730 PROTEIN user 1 3 # 1 F 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 F 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 F 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 10.64 34.02 91.30 6.30 35.60 95.11 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 13.75 39.76 94.12 11.42 37.23 97.89 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 16.35 26.90 99.56 16.81 25.90 97.75 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c37 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c37 naa= 3 ULMN 3 2dw7_c38 BLL6730 PROTEIN user 1 3 # 1 G 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 G 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 G 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 39.68 42.04 76.11 43.42 46.43 74.96 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 36.69 47.69 78.93 39.38 50.40 75.35 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 33.43 44.37 65.47 33.10 42.30 65.37 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c38 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c38 naa= 3 ULMN 3 2dw7_c39 BLL6730 PROTEIN user 1 3 # 1 H 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 H 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 H 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 71.58 83.18 80.51 66.88 79.77 79.84 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 73.65 78.64 75.66 68.14 79.07 75.04 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 67.43 90.73 71.39 68.27 92.30 72.52 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c39 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c39 naa= 3 ULMN 3 2dw7_c40 BLL6730 PROTEIN user 1 3 # 1 I 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 I 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 I 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 60.20 96.92 42.53 57.60 93.13 38.67 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 54.31 95.46 46.01 55.34 91.59 42.65 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 66.35 87.81 48.53 68.10 89.01 48.77 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c40 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c40 naa= 3 ULMN 3 2dw7_c41 BLL6730 PROTEIN user 1 3 # 1 J 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 J 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 J 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 25.22 70.55 14.03 27.64 73.07 18.65 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 31.73 69.87 11.50 32.73 70.19 16.40 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 25.87 58.42 18.79 23.95 58.54 17.90 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c41 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c41 naa= 3 ULMN 3 2dw7_c42 BLL6730 PROTEIN user 1 3 # 1 K 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 K 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 K 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 51.91 50.98 -7.18 47.83 49.38 -11.15 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 54.95 45.24 -9.88 51.94 46.65 -13.66 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 58.09 58.36 -15.39 58.48 59.93 -14.05 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c42 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c42 naa= 3 ULMN 3 2dw7_c43 BLL6730 PROTEIN user 1 3 # 1 L 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 L 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 L 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 20.72 21.86 -37.85 25.46 24.17 -34.95 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 18.47 28.51 -37.00 23.90 28.36 -37.29 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 25.62 23.75 -50.41 24.07 23.21 -49.03 2.55 11.74 5.01 1.42 10.07 5.73 ULMN 3 2dw7_c43 BLL6730 PROTEIN user 2 3 # 2 L 182 LYS A 25 LYS^? 23.71 O1 GOL A 200 L 184 LYS A 22 LYS.? 12.21 O1 GOL A 200 L 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 20.72 21.86 -37.85 25.46 24.17 -34.95 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 18.47 28.51 -37.00 23.90 28.36 -37.29 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 25.62 23.75 -50.41 24.07 23.21 -49.03 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c43 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c43 naa= 3 ULMN 3 2dw7_c44 BLL6730 PROTEIN user 1 3 # 1 M 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 M 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 M 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo -16.84 -32.78 53.48 -13.51 -32.22 58.34 -8.73 20.02 6.97 -12.28 16.97 10.92 coo -11.12 -36.54 51.97 -12.06 -36.49 56.95 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo -23.86 -43.59 58.54 -23.60 -42.14 57.00 2.55 11.74 5.01 1.42 10.07 5.73 ULMN 3 2dw7_c44 BLL6730 PROTEIN user 2 3 # 2 M 182 LYS A 25 LYS^? 23.71 O1 GOL A 200 M 184 LYS A 22 LYS.? 12.21 O1 GOL A 200 M 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo -16.84 -32.78 53.48 -13.51 -32.22 58.34 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo -11.12 -36.54 51.97 -12.06 -36.49 56.95 -8.73 20.02 6.97 -12.28 16.97 10.92 coo -23.86 -43.59 58.54 -23.60 -42.14 57.00 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c44 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c44 naa= 3 ULMN 3 2dw7_c45 BLL6730 PROTEIN user 1 3 # 1 N 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 N 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 N 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 22.75 -28.13 87.31 18.89 -29.87 83.00 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 16.58 -26.28 90.12 15.40 -29.80 86.61 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 22.32 -38.59 93.74 24.34 -38.41 94.32 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c45 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c45 naa= 3 ULMN 3 2dw7_c46 BLL6730 PROTEIN user 1 3 # 1 O 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 O 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 O 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 54.57 -51.89 -4.22 51.14 -49.62 0.15 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 48.40 -53.90 -6.78 48.57 -49.84 -4.13 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 54.15 -41.12 -10.77 56.24 -41.47 -10.94 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c46 source 2dw7 BLL6730 PROTEIN : 1 hits 2dw7_c46 naa= 3 ULMN 3 2dw7_c47 BLL6730 PROTEIN user 1 3 # 1 P 182 LYS A 22 LYS.? 12.21 O1 GOL A 200 P 184 LYS A 25 LYS^? 23.71 O1 GOL A 200 P 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 14.97 -47.15 29.92 18.26 -47.80 24.89 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 20.57 -43.13 31.26 20.62 -43.22 26.05 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 7.60 -36.55 24.79 7.77 -37.99 26.35 2.55 11.74 5.01 1.42 10.07 5.73 ULMN 3 2dw7_c47 BLL6730 PROTEIN user 2 3 # 2 P 182 LYS A 25 LYS^? 23.71 O1 GOL A 200 P 184 LYS A 22 LYS.? 12.21 O1 GOL A 200 P 345 ASP A 50 ASP.? 16.78 O2 GOL A 200 coo 14.97 -47.15 29.92 18.26 -47.80 24.89 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 20.57 -43.13 31.26 20.62 -43.22 26.05 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 7.60 -36.55 24.79 7.77 -37.99 26.35 2.55 11.74 5.01 1.42 10.07 5.73 2dw7_c47 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c47 naa= 3 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 177 PHE A 107 PHE^? 17.79 O2 GOL A 200 A 263 ASP A 118 ASP^? 28.24 O2 GOL A 200 A 292 LYS A 92 LYS^? 33.34 O2 GOL A 200 coo 51.51 50.32 16.39 52.13 49.68 13.75 3.44 27.97 2.84 5.43 28.55 0.97 coo 54.43 44.82 23.74 55.21 45.06 21.80 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 63.95 45.30 16.71 59.11 49.15 16.05 8.12 38.10 -6.78 6.81 35.86 -11.65 2oat_c03 source 2oat ORNITHINE AMINOTRANSFERASE : 1 hits 2oat_c03 naa= 3 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 177 PHE A 107 PHE^? 17.79 O2 GOL A 200 C 263 ASP A 118 ASP^? 28.24 O2 GOL A 200 C 292 LYS A 92 LYS^? 33.34 O2 GOL A 200 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 3.44 27.97 2.84 5.43 28.55 0.97 coo 19.84 12.02 9.33 18.68 11.23 7.75 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 12.82 3.49 4.98 17.80 5.59 1.90 8.12 38.10 -6.78 6.81 35.86 -11.65 2oat_c05 source 2oat ORNITHINE AMINOTRANSFERASE : 1 hits 2oat_c05 naa= 3 ULMN 3 2phk_c02 MC-PEPTIDE user 1 3 # 1 A 149 ASP A 39 ASP^? -14.64 O1 GOL A 200s A 151 LYS A 22 LYS.? 12.21 O1 GOL A 200 A 186 THR A 24 THR.? 18.30 O1 GOL A 200 coo 41.42 17.90 44.98 43.39 18.36 45.61 -8.43 26.08 3.91 -10.39 26.34 4.84 coo 45.75 16.58 39.61 47.43 18.26 45.54 -8.73 20.02 6.97 -12.28 16.97 10.92 coo 45.88 23.02 44.72 46.99 21.16 44.68 -11.17 21.80 1.28 -11.84 23.84 0.97 ULMN 3 2phk_c02 MC-PEPTIDE user 2 3 # 2 A 149 ASP A 39 ASP^? -14.64 O1 GOL A 200s A 151 LYS A 25 LYS^? 23.71 O1 GOL A 200 A 186 THR A 40 THR.? 20.70 O1 GOL A 200 coo 41.42 17.90 44.98 43.39 18.36 45.61 -8.43 26.08 3.91 -10.39 26.34 4.84 coo 45.75 16.58 39.61 47.43 18.26 45.54 -8.49 20.21 -0.96 -11.35 17.51 -4.55 coo 45.88 23.02 44.72 46.99 21.16 44.68 -10.64 28.13 0.05 -11.89 26.87 -1.24 ULMN 3 2phk_c02 MC-PEPTIDE user 3 3 # 3 A 149 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 151 LYS A 15 LYS.? 25.07 O2 GOL A 200 A 186 THR A 13 THR.? 22.16 O2 GOL A 200 coo 41.42 17.90 44.98 43.39 18.36 45.61 2.55 11.74 5.01 1.42 10.07 5.73 coo 45.75 16.58 39.61 47.43 18.26 45.54 0.11 6.41 5.99 2.13 3.29 0.85 coo 45.88 23.02 44.72 46.99 21.16 44.68 -4.60 8.50 2.06 -5.42 6.45 2.07 ULMN 3 2phk_c02 MC-PEPTIDE user 4 3 # 4 A 149 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 151 LYS A 18 LYS.? 10.82 O1 GOL A 200 A 186 THR A 13 THR.? 22.16 O2 GOL A 200 coo 41.42 17.90 44.98 43.39 18.36 45.61 2.55 11.74 5.01 1.42 10.07 5.73 coo 45.75 16.58 39.61 47.43 18.26 45.54 -2.73 13.36 9.72 -7.58 13.32 13.61 coo 45.88 23.02 44.72 46.99 21.16 44.68 -4.60 8.50 2.06 -5.42 6.45 2.07 2phk_c02 source 2phk MC-PEPTIDE : 4 hits 2phk_c02 naa= 3 ULMN 3 2phk_c03 MC-PEPTIDE user 1 3 # 1 A 149 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 151 LYS A 15 LYS.? 25.07 O2 GOL A 200 A 154 ASN A 16 ASN.? 18.73 O2 GOL A 200 coo 41.42 17.90 44.98 43.39 18.36 45.61 2.55 11.74 5.01 1.42 10.07 5.73 coo 45.75 16.58 39.61 47.43 18.26 45.54 0.11 6.41 5.99 2.13 3.29 0.85 coo 44.77 13.10 43.25 45.01 14.21 45.03 3.16 8.10 8.93 4.04 6.63 7.72 ULMN 3 2phk_c03 MC-PEPTIDE user 2 3 # 2 A 149 ASP A 50 ASP.? 16.78 O2 GOL A 200 A 151 LYS A 52 LYS.? 20.79 O2 GOL A 200 A 154 ASN A 16 ASN.? 18.73 O2 GOL A 200 coo 41.42 17.90 44.98 43.39 18.36 45.61 2.55 11.74 5.01 1.42 10.07 5.73 coo 45.75 16.58 39.61 47.43 18.26 45.54 8.29 9.60 9.80 7.06 4.86 8.55 coo 44.77 13.10 43.25 45.01 14.21 45.03 3.16 8.10 8.93 4.04 6.63 7.72 2phk_c03 source 2phk MC-PEPTIDE : 2 hits 2phk_c03 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP A 50 ASP.? 16.78 O2 GOL A 200 166 GLY A 72 GLY.? 11.81 O2 GOL A 200 169 GLU A 109 GLU^? 14.90 O1 GOL A 200 coo 8.28 6.87 1.62 10.08 5.77 1.34 2.55 11.74 5.01 1.42 10.07 5.73 coo -8.58 13.22 3.21 -8.90 13.15 4.05 3.49 30.70 11.33 3.86 31.31 10.94 coo -16.67 7.89 2.78 -17.65 6.56 1.49 -4.71 33.85 5.16 -5.48 33.44 7.13 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 # 2 141 ASP A 73 ASP.? 11.55 O2 GOL A 200 166 GLY A 23 GLY.? 14.14 O1 GOL A 200 169 GLU A 41 GLU.? 19.50 O1 GOL A 200 coo 8.28 6.87 1.62 10.08 5.77 1.34 7.80 28.72 11.54 7.47 28.46 13.63 coo -8.58 13.22 3.21 -8.90 13.15 4.05 -8.93 22.43 4.17 -9.31 21.61 4.20 coo -16.67 7.89 2.78 -17.65 6.56 1.49 -14.51 29.62 4.94 -16.64 30.06 4.84 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 2 hits 2tdt_c00 naa= 3 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 1 3 # 1 71 ARG A 100 ARG.? 12.49 O2 GOL A 200 127 ARG A 132 ARG.? 16.38 O3 GOL A 200 270 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -1.14 25.72 1.64 0.76 28.10 1.50 10.61 20.08 13.39 10.29 23.15 12.59 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 15.71 15.59 15.34 14.57 17.73 13.37 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 11.74 7.72 7.91 12.92 5.90 7.68 ULMN 3 5cpa_c01 CARBOXYPEPTIDASE A=ALPHA= (COX) (E.Cuser 2 3 # 2 71 ARG A 132 ARG.? 16.38 O3 GOL A 200 127 ARG A 100 ARG.? 12.49 O2 GOL A 200 270 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo -1.14 25.72 1.64 0.76 28.10 1.50 15.71 15.59 15.34 14.57 17.73 13.37 coo 2.87 25.67 -2.58 1.96 27.95 -4.18 10.61 20.08 13.39 10.29 23.15 12.59 coo -7.41 30.69 -7.56 -5.96 29.61 -6.39 11.74 7.72 7.91 12.92 5.90 7.68 5cpa_c01 source 5cpa CARBOXYPEPTIDASE A=ALPHA= (COX) (E.C.3.4.17.1): 2 hits 5cpa_c01 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 16 ASN.? 18.73 O2 GOL A 200 coo 5.80 63.03 55.85 5.52 65.03 56.45 3.16 8.10 8.93 4.04 6.63 7.72 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 32 ASN.? 25.03 O2 GOL A 200 coo 5.80 63.03 55.85 5.52 65.03 56.45 2.89 10.42 -2.40 2.49 10.28 -4.45 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo 5.80 63.03 55.85 5.52 65.03 56.45 6.06 16.51 6.44 7.78 15.19 6.31 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 3 hits 1kbk_p00 naa= 1 ULMN 3 1uy4_p00 ENDO-1,4-BETA-XYLANASE A user 1 3 # 1 A 51 TYR A 35 TYR^? 18.28 O2 GOL A 200 A 108 ASN A 16 ASN.? 18.73 O2 GOL A 200 A 135 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo 17.50 4.57 17.85 15.28 5.88 18.97 -0.13 15.22 1.35 0.07 12.52 0.73 coo 12.22 15.98 15.24 11.94 14.05 16.09 3.16 8.10 8.93 4.04 6.63 7.72 coo 17.94 11.43 12.65 17.42 10.61 14.53 6.06 16.51 6.44 7.78 15.19 6.31 1uy4_p00 source 1uy4 ENDO-1,4-BETA-XYLANASE A : 1 hits 1uy4_p00 naa= 3 ULMN 3 1wbf_p00 PROTEIN (AGGLUTININ) user 1 3 # 1 A 44 ASN A 32 ASN.? 25.03 O2 GOL A 200 A 213 PRO A 28 PRO^? 22.38 O2 GOL A 200 A 219 ASN A 16 ASN.? 18.73 O2 GOL A 200 coo -7.34 -5.74 33.55 -6.42 -4.32 34.85 2.89 10.42 -2.40 2.49 10.28 -4.45 coo -10.08 -3.19 35.19 -11.51 -3.72 33.58 -1.02 14.03 -4.43 -0.42 15.83 -3.19 coo -15.60 -12.66 27.15 -15.94 -14.47 28.23 3.16 8.10 8.93 4.04 6.63 7.72 ULMN 3 1wbf_p00 PROTEIN (AGGLUTININ) user 2 3 # 2 A 44 ASN A 32 ASN.? 25.03 O2 GOL A 200 A 213 PRO A 28 PRO^? 22.38 O2 GOL A 200 A 219 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo -7.34 -5.74 33.55 -6.42 -4.32 34.85 2.89 10.42 -2.40 2.49 10.28 -4.45 coo -10.08 -3.19 35.19 -11.51 -3.72 33.58 -1.02 14.03 -4.43 -0.42 15.83 -3.19 coo -15.60 -12.66 27.15 -15.94 -14.47 28.23 6.06 16.51 6.44 7.78 15.19 6.31 1wbf_p00 source 1wbf PROTEIN (AGGLUTININ) : 2 hits 1wbf_p00 naa= 3 ULMN 3 1b01_d00 GENE REGULATION/DNA user 1 3 # 1 B 4 ARG A 43 ARG.? -22.33 O1 GOL A 200s B 6 THR A 40 THR.? 20.70 O1 GOL A 200 B 8 THR A 24 THR.? 18.30 O1 GOL A 200 coo 40.52 16.08 100.90 37.97 16.41 102.60 -9.68 34.50 0.13 -8.09 37.08 0.79 coo 36.11 13.64 95.03 34.54 14.86 95.91 -10.64 28.13 0.05 -11.89 26.87 -1.24 coo 32.72 8.05 92.39 31.25 9.11 91.35 -11.17 21.80 1.28 -11.84 23.84 0.97 1b01_d00 source 1b01 GENE REGULATION/DNA : 1 hits 1b01_d00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 93 TYR^? 27.86 O1 GOL A 200 I 306 VAL A 69 VAL^? 19.86 O1 GOL A 200 I 308 VAL A 108 VAL^? 17.74 O1 GOL A 200 coo 26.18 35.24 6.87 24.33 35.18 8.97 5.50 38.33 -2.98 4.27 40.74 -3.60 coo 23.55 29.53 9.81 23.15 27.39 10.24 1.08 37.12 4.08 -0.33 38.09 5.37 coo 16.43 30.18 9.35 15.05 30.67 11.01 0.51 31.57 3.49 1.39 31.42 1.49 1cqt_d00 source 1cqt GENE REGULATION/DNA : 1 hits 1cqt_d00 naa= 3 ULMN 3 1emh_d00 HYDROLASE/DNA user 1 3 # 1 A 271 PRO A 70 PRO^? 18.89 O1 GOL A 200 A 272 LEU A 71 LEU.? 13.34 O1 GOL A 200 A 276 ARG A 44 ARG^? 10.85 O1 GOL A 200 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 4.90 36.10 6.03 3.05 35.01 5.22 coo 10.97 0.43 16.73 11.31 2.11 18.06 0.76 31.32 8.10 -1.27 31.99 7.73 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 -5.22 29.17 7.22 -7.66 28.12 8.81 ULMN 3 1emh_d00 HYDROLASE/DNA user 2 3 # 2 A 271 PRO A 101 PRO.? 14.55 O2 GOL A 200 A 272 LEU A 54 LEU^? 20.84 O2 GOL A 200 A 276 ARG A 123 ARG^? 24.89 O2 GOL A 200 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 10.38 14.00 10.71 8.52 15.20 10.30 coo 10.97 0.43 16.73 11.31 2.11 18.06 11.86 13.17 5.21 12.73 11.82 3.79 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 18.70 18.30 6.22 21.48 19.12 7.39 1emh_d00 source 1emh HYDROLASE/DNA : 2 hits 1emh_d00 naa= 3 ULMN 5 1fjl_d00 TRANSCRIPTION/DNA user 1 5 # 1 B 2 ARG A 132 ARG.? 16.38 O3 GOL A 200 B 5 ARG A 123 ARG^? 24.89 O2 GOL A 200 B 47 VAL A 99 VAL^? 13.42 O2 GOL A 200 B 50 GLN A 105 GLN^? 10.36 O2 GOL A 200 B 51 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo 25.18 129.15 1.08 26.79 128.14 3.51 15.71 15.59 15.34 14.57 17.73 13.37 coo 20.01 134.39 4.78 20.48 133.92 7.77 18.70 18.30 6.22 21.48 19.12 7.39 coo 16.97 122.50 8.58 18.22 123.38 6.95 8.24 20.82 7.72 6.45 20.79 6.53 coo 18.86 119.62 11.06 19.68 119.49 9.05 5.52 23.54 9.33 6.09 25.02 10.81 coo 19.47 125.99 12.66 20.51 125.78 10.85 6.06 16.51 6.44 7.78 15.19 6.31 1fjl_d00 source 1fjl TRANSCRIPTION/DNA : 1 hits 1fjl_d00 naa= 5 ULMN 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 1 3 # 1 A1290 LYS A 15 LYS.? 25.07 O2 GOL A 200 A1294 ASN A 16 ASN.? 18.73 O2 GOL A 200 A1297 GLU A 53 GLU.? 23.34 O2 GOL A 200 coo 39.24 18.84-161.99 36.62 21.47-165.99 0.11 6.41 5.99 2.13 3.29 0.85 coo 33.53 17.37-161.81 34.31 17.81-163.76 3.16 8.10 8.93 4.04 6.63 7.72 coo 29.78 23.31-161.30 31.23 23.66-162.84 11.74 7.72 7.91 12.92 5.90 7.68 1xpx_d00 source 1xpx TRANSCRIPTION REGULATION/DNA : 1 hits 1xpx_d00 naa= 3 ULMN 4 2p0j_d00 HYDROLASE/DNA user 1 4 # 1 A 46 GLU A 53 GLU.? 23.34 O2 GOL A 200 A 133 LYS A 18 LYS.? 10.82 O1 GOL A 200 A 134 TYR A 48 TYR^? 12.35 O2 GOL A 200 A 172 SER A 51 SER.? 19.11 O2 GOL A 200 coo 29.36 7.53 2.81 27.47 7.30 3.73 11.74 7.72 7.91 12.92 5.90 7.68 coo 20.43 15.67 9.20 23.49 12.62 10.53 -2.73 13.36 9.72 -7.58 13.32 13.61 coo 18.60 12.45 12.36 19.78 10.10 11.41 0.42 16.28 6.68 0.66 13.80 7.88 coo 23.78 7.59 5.40 26.01 7.14 6.26 7.12 10.94 6.45 9.44 10.63 6.09 2p0j_d00 source 2p0j HYDROLASE/DNA : 1 hits 2p0j_d00 naa= 4 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 B 34 SER A 31 SER.? 27.02 O2 GOL A 200 B 37 ASN A 32 ASN.? 25.03 O2 GOL A 200 B 45 THR A 104 THR^? 8.26 O2 GOL A 200 coo -19.49 41.97 71.08 -17.37 40.80 71.17 6.64 11.66 -4.30 8.11 9.80 -4.91 coo -23.05 39.62 69.74 -22.86 39.59 67.61 2.89 10.42 -2.40 2.49 10.28 -4.45 coo -30.87 34.84 80.57 -28.94 34.51 81.49 1.57 20.47 9.68 -0.64 20.24 9.40 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 B 34 SER A 51 SER.? 19.11 O2 GOL A 200 B 37 ASN A 16 ASN.? 18.73 O2 GOL A 200 B 45 THR A 20 THR.? 5.12 O2 GOL A 200 coo -19.49 41.97 71.08 -17.37 40.80 71.17 7.12 10.94 6.45 9.44 10.63 6.09 coo -23.05 39.62 69.74 -22.86 39.59 67.61 3.16 8.10 8.93 4.04 6.63 7.72 coo -30.87 34.84 80.57 -28.94 34.51 81.49 -3.94 19.29 11.99 -2.19 20.21 12.75 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 B 34 SER A 51 SER.? 19.11 O2 GOL A 200 B 37 ASN A 49 ASN^? 15.73 O2 GOL A 200 B 45 THR A 26 THR^? 16.88 O1 GOL A 200 coo -19.49 41.97 71.08 -17.37 40.80 71.17 7.12 10.94 6.45 9.44 10.63 6.09 coo -23.05 39.62 69.74 -22.86 39.59 67.61 6.06 16.51 6.44 7.78 15.19 6.31 coo -30.87 34.84 80.57 -28.94 34.51 81.49 -5.29 18.27 -0.47 -5.00 17.12 1.36 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 4 3 # 4 B 34 SER A 51 SER.? 19.11 O2 GOL A 200 B 37 ASN A 49 ASN^? 15.73 O2 GOL A 200 B 45 THR A 119 THR^? 25.97 O2 GOL A 200 coo -19.49 41.97 71.08 -17.37 40.80 71.17 7.12 10.94 6.45 9.44 10.63 6.09 coo -23.05 39.62 69.74 -22.86 39.59 67.61 6.06 16.51 6.44 7.78 15.19 6.31 coo -30.87 34.84 80.57 -28.94 34.51 81.49 13.04 24.62 -3.89 14.83 25.20 -2.71 2z3x_d00 source 2z3x DNA BINDING PROTEIN/DNA : 4 hits 2z3x_d00 naa= 3 ULMN 5 3lnq_d00 GENE REGULATION/DNA user 1 5 # 1 A 87 ARG A 132 ARG.? 16.38 O3 GOL A 200 A 89 ARG A 123 ARG^? 24.89 O2 GOL A 200 A 131 VAL A 99 VAL^? 13.42 O2 GOL A 200 A 134 GLN A 105 GLN^? 10.36 O2 GOL A 200 A 135 ASN A 49 ASN^? 15.73 O2 GOL A 200 coo -2.58 21.44 -8.66 -1.48 18.56 -8.33 15.71 15.59 15.34 14.57 17.73 13.37 coo -10.26 19.51 -5.29 -9.57 16.57 -4.68 18.70 18.30 6.22 21.48 19.12 7.39 coo -9.97 12.49 -15.73 -8.62 14.12 -15.04 8.24 20.82 7.72 6.45 20.79 6.53 coo -8.05 8.85 -16.86 -6.59 10.35 -17.29 5.52 23.54 9.33 6.09 25.02 10.81 coo -9.85 9.44 -10.44 -8.30 10.86 -10.67 6.06 16.51 6.44 7.78 15.19 6.31 3lnq_d00 source 3lnq GENE REGULATION/DNA : 1 hits 3lnq_d00 naa= 5 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 1 4 # 1 B 122 ARG A 36 ARG^? 21.82 O1 GOL A 200 B 148 LYS A 52 LYS.? 20.79 O2 GOL A 200 B 151 LEU A 54 LEU^? 20.84 O2 GOL A 200 B 154 ILE A 33 ILE.? 20.67 O2 GOL A 200 coo 13.00 32.05 60.31 16.02 31.73 59.80 -0.18 23.83 -2.35 -2.28 23.74 -4.54 coo 11.05 44.13 44.68 12.77 44.45 49.56 8.29 9.60 9.80 7.06 4.86 8.55 coo 11.72 38.91 44.77 13.11 39.67 46.23 11.86 13.17 5.21 12.73 11.82 3.79 coo 7.03 36.97 46.99 7.83 37.90 47.52 7.06 12.70 1.18 8.25 12.20 1.33 3odc_d00 source 3odc DNA BINDING PROTEIN/DNA : 1 hits 3odc_d00 naa= 4 ULMN 3 3uby_d00 HYDROLASE/DNA user 1 3 # 1 A 162 TYR A 27 TYR^? 22.06 O1 GOL A 200 A 164 MET A 29 MET.? 20.91 O2 GOL A 200 A 165 TYR A 35 TYR^? 18.28 O2 GOL A 200 coo 9.07 -0.64 37.53 6.51 -1.49 38.21 -3.67 20.11 -4.39 -5.89 21.69 -5.06 coo 15.31 0.97 33.48 17.04 -1.81 36.11 3.62 16.97 -4.05 3.17 20.64 -2.93 coo 12.73 -3.12 32.95 14.22 -4.94 34.46 -0.13 15.22 1.35 0.07 12.52 0.73 3uby_d00 source 3uby HYDROLASE/DNA : 1 hits 3uby_d00 naa= 3 ULMN 3 2ebf_o00 DERMONECROTIC TOXIN user 1 3 # 1 X1165 CYH A 95 CYH^? 21.45 O2 GOL A 200 X1205 HIS A 57 HIS^? 21.61 O2 GOL A 200 X1220 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo -26.56 24.53 92.56 -24.57 23.58 94.36 8.07 32.08 0.96 5.72 33.61 0.99 coo -19.40 30.09 91.63 -20.33 29.86 93.49 13.89 24.29 2.75 14.15 26.31 2.22 coo -21.03 32.79 97.44 -20.59 31.13 96.21 11.95 23.52 7.79 13.60 24.51 6.84 2ebf_o00 source 2EBF DERMONECROTIC TOXIN : 1 hits 2ebf_o00 naa= 3 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 1 3 # 1 A 130 SER A 51 SER.? 19.11 O2 GOL A 200 A 166 PHE A 30 PHE.? 23.27 O2 GOL A 200 A 182 PHE A 47 PHE^? 16.84 O2 GOL A 200 coo -46.28 37.24 81.97 -44.96 39.32 82.40 7.12 10.94 6.45 9.44 10.63 6.09 coo -36.62 39.62 84.60 -38.76 41.24 85.25 9.13 16.01 -1.98 11.91 15.81 -1.58 coo -36.55 45.66 79.22 -38.34 43.94 80.53 3.45 22.78 2.62 3.68 24.27 0.23 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 2 3 # 2 A 130 SER A 111 SER^? -25.66 O1 GOL A 200s A 166 PHE A 62 PHE^? 23.24 O1 GOL A 200 A 182 PHE A 107 PHE^? 17.79 O2 GOL A 200 coo -46.28 37.24 81.97 -44.96 39.32 82.40 -4.95 35.61 -2.73 -5.10 37.96 -3.33 coo -36.62 39.62 84.60 -38.76 41.24 85.25 3.47 33.02 -3.87 2.77 30.99 -2.12 coo -36.55 45.66 79.22 -38.34 43.94 80.53 3.44 27.97 2.84 5.43 28.55 0.97 2r11_o00 source 2R11 CARBOXYLESTERASE NP : 2 hits 2r11_o00 naa= 3 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 1 3 # 1 B 130 SER A 51 SER.? 19.11 O2 GOL A 200 B 166 PHE A 30 PHE.? 23.27 O2 GOL A 200 B 182 PHE A 47 PHE^? 16.84 O2 GOL A 200 coo -19.94 46.29 97.83 -22.38 46.56 97.60 7.12 10.94 6.45 9.44 10.63 6.09 coo -29.59 43.40 95.66 -28.22 45.54 94.50 9.13 16.01 -1.98 11.91 15.81 -1.58 coo -32.72 50.15 98.46 -30.32 48.85 97.77 3.45 22.78 2.62 3.68 24.27 0.23 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 2 3 # 2 B 130 SER A 111 SER^? -25.66 O1 GOL A 200s B 166 PHE A 62 PHE^? 23.24 O1 GOL A 200 B 182 PHE A 107 PHE^? 17.79 O2 GOL A 200 coo -19.94 46.29 97.83 -22.38 46.56 97.60 -4.95 35.61 -2.73 -5.10 37.96 -3.33 coo -29.59 43.40 95.66 -28.22 45.54 94.50 3.47 33.02 -3.87 2.77 30.99 -2.12 coo -32.72 50.15 98.46 -30.32 48.85 97.77 3.44 27.97 2.84 5.43 28.55 0.97 2r11_o01 source 2R11 CARBOXYLESTERASE NP : 2 hits 2r11_o01 naa= 3 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 1 3 # 1 C 130 SER A 51 SER.? 19.11 O2 GOL A 200 C 166 PHE A 30 PHE.? 23.27 O2 GOL A 200 C 182 PHE A 47 PHE^? 16.84 O2 GOL A 200 coo -2.19 64.27 51.12 -3.34 62.10 50.60 7.12 10.94 6.45 9.44 10.63 6.09 coo -11.14 61.91 46.89 -9.88 60.30 48.76 9.13 16.01 -1.98 11.91 15.81 -1.58 coo -7.71 55.92 42.70 -7.18 57.60 44.85 3.45 22.78 2.62 3.68 24.27 0.23 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 2 3 # 2 C 130 SER A 111 SER^? -25.66 O1 GOL A 200s C 166 PHE A 62 PHE^? 23.24 O1 GOL A 200 C 182 PHE A 107 PHE^? 17.79 O2 GOL A 200 coo -2.19 64.27 51.12 -3.34 62.10 50.60 -4.95 35.61 -2.73 -5.10 37.96 -3.33 coo -11.14 61.91 46.89 -9.88 60.30 48.76 3.47 33.02 -3.87 2.77 30.99 -2.12 coo -7.71 55.92 42.70 -7.18 57.60 44.85 3.44 27.97 2.84 5.43 28.55 0.97 2r11_o02 source 2R11 CARBOXYLESTERASE NP : 2 hits 2r11_o02 naa= 3 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 1 3 # 1 D 130 SER A 111 SER^? -25.66 O1 GOL A 200s D 166 PHE A 62 PHE^? 23.24 O1 GOL A 200 D 182 PHE A 107 PHE^? 17.79 O2 GOL A 200 coo -32.42 55.27 46.18 -30.51 54.94 47.67 -4.95 35.61 -2.73 -5.10 37.96 -3.33 coo -23.62 58.20 50.84 -23.76 56.14 48.96 3.47 33.02 -3.87 2.77 30.99 -2.12 coo -23.08 51.44 54.96 -24.43 52.71 52.88 3.44 27.97 2.84 5.43 28.55 0.97 2r11_o03 source 2R11 CARBOXYLESTERASE NP : 1 hits 2r11_o03 naa= 3 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 250 ALA A 59 ALA^? 23.37 O2 GOL A 200 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 11.95 23.52 7.79 13.60 24.51 6.84 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 13.89 24.29 2.75 14.15 26.31 2.22 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 10.08 27.38 -1.00 11.44 28.06 -1.17 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP A 98 ASP^? 18.38 O2 GOL A 200 A 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 250 ALA A 122 ALA^? 22.22 O2 GOL A 200 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 11.95 23.52 7.79 13.60 24.51 6.84 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 13.89 24.29 2.75 14.15 26.31 2.22 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 14.40 16.69 2.00 13.38 15.62 1.82 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 98 ASP^? 18.38 O2 GOL A 200 B 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 B 250 ALA A 59 ALA^? 23.37 O2 GOL A 200 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 11.95 23.52 7.79 13.60 24.51 6.84 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 13.89 24.29 2.75 14.15 26.31 2.22 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 10.08 27.38 -1.00 11.44 28.06 -1.17 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 B 49 ASP A 98 ASP^? 18.38 O2 GOL A 200 B 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 B 250 ALA A 122 ALA^? 22.22 O2 GOL A 200 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 11.95 23.52 7.79 13.60 24.51 6.84 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 13.89 24.29 2.75 14.15 26.31 2.22 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 14.40 16.69 2.00 13.38 15.62 1.82 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 98 ASP^? 18.38 O2 GOL A 200 C 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 C 250 ALA A 59 ALA^? 23.37 O2 GOL A 200 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 11.95 23.52 7.79 13.60 24.51 6.84 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 13.89 24.29 2.75 14.15 26.31 2.22 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 10.08 27.38 -1.00 11.44 28.06 -1.17 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 C 49 ASP A 98 ASP^? 18.38 O2 GOL A 200 C 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 C 250 ALA A 122 ALA^? 22.22 O2 GOL A 200 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 11.95 23.52 7.79 13.60 24.51 6.84 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 13.89 24.29 2.75 14.15 26.31 2.22 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 14.40 16.69 2.00 13.38 15.62 1.82 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 98 ASP^? 18.38 O2 GOL A 200 D 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 D 250 ALA A 59 ALA^? 23.37 O2 GOL A 200 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 11.95 23.52 7.79 13.60 24.51 6.84 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 13.89 24.29 2.75 14.15 26.31 2.22 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 10.08 27.38 -1.00 11.44 28.06 -1.17 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 D 49 ASP A 98 ASP^? 18.38 O2 GOL A 200 D 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 D 250 ALA A 122 ALA^? 22.22 O2 GOL A 200 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 11.95 23.52 7.79 13.60 24.51 6.84 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 13.89 24.29 2.75 14.15 26.31 2.22 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 14.40 16.69 2.00 13.38 15.62 1.82 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 98 ASP^? 18.38 O2 GOL A 200 E 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 E 250 ALA A 59 ALA^? 23.37 O2 GOL A 200 coo -36.18 24.97 18.78 -36.93 26.11 17.11 11.95 23.52 7.79 13.60 24.51 6.84 coo -36.85 29.32 15.06 -38.90 29.14 15.48 13.89 24.29 2.75 14.15 26.31 2.22 coo -44.49 29.68 13.98 -43.47 28.67 13.52 10.08 27.38 -1.00 11.44 28.06 -1.17 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 E 49 ASP A 98 ASP^? 18.38 O2 GOL A 200 E 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 E 250 ALA A 122 ALA^? 22.22 O2 GOL A 200 coo -36.18 24.97 18.78 -36.93 26.11 17.11 11.95 23.52 7.79 13.60 24.51 6.84 coo -36.85 29.32 15.06 -38.90 29.14 15.48 13.89 24.29 2.75 14.15 26.31 2.22 coo -44.49 29.68 13.98 -43.47 28.67 13.52 14.40 16.69 2.00 13.38 15.62 1.82 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 98 ASP^? 18.38 O2 GOL A 200 F 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 F 250 ALA A 59 ALA^? 23.37 O2 GOL A 200 coo -82.12 8.55 35.60 -81.93 9.84 37.19 11.95 23.52 7.79 13.60 24.51 6.84 coo -84.21 11.81 39.90 -82.43 12.70 39.26 13.89 24.29 2.75 14.15 26.31 2.22 coo -78.49 17.13 41.31 -79.25 15.85 41.61 10.08 27.38 -1.00 11.44 28.06 -1.17 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 F 49 ASP A 98 ASP^? 18.38 O2 GOL A 200 F 86 HIS A 57 HIS^? 21.61 O2 GOL A 200 F 250 ALA A 122 ALA^? 22.22 O2 GOL A 200 coo -82.12 8.55 35.60 -81.93 9.84 37.19 11.95 23.52 7.79 13.60 24.51 6.84 coo -84.21 11.81 39.90 -82.43 12.70 39.26 13.89 24.29 2.75 14.15 26.31 2.22 coo -78.49 17.13 41.31 -79.25 15.85 41.61 14.40 16.69 2.00 13.38 15.62 1.82 2wwt_o05 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o05 naa= 3 ULMN 3 3b21_o00 SHIGELLA FLEXNERI EFFECTOR OSPI user 1 3 # 1 A 62 CYH A 95 CYH^? 21.45 O2 GOL A 200 A 145 HIS A 57 HIS^? 21.61 O2 GOL A 200 A 160 ASP A 98 ASP^? 18.38 O2 GOL A 200 coo 9.35 16.69 -4.00 10.08 14.08 -3.37 8.07 32.08 0.96 5.72 33.61 0.99 coo 12.85 24.01 -5.47 14.14 22.37 -5.23 13.89 24.29 2.75 14.15 26.31 2.22 coo 18.70 21.56 -2.53 17.15 21.34 -3.98 11.95 23.52 7.79 13.60 24.51 6.84 3b21_o00 source 3B21 SHIGELLA FLEXNERI EFFECTOR OSPI : 1 hits 3b21_o00 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 96 GLU^? 22.95 O2 GOL A 200 A 44 ASP A 118 ASP^? 28.24 O2 GOL A 200 A 50 THR A 119 THR^? 25.97 O2 GOL A 200 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 12.01 30.07 3.21 14.10 30.25 2.56 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 11.56 28.53 -5.39 13.56 29.26 -5.43 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 13.04 24.62 -3.89 14.83 25.20 -2.71 ULMN 3 3hde_o00 LYSOZYME user 2 3 # 2 A 35 GLU A 109 GLU^? 14.90 O1 GOL A 200 A 44 ASP A 39 ASP^? -14.64 O1 GOL A 200s A 50 THR A 40 THR.? 20.70 O1 GOL A 200 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -4.71 33.85 5.16 -5.48 33.44 7.13 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -8.43 26.08 3.91 -10.39 26.34 4.84 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 -10.64 28.13 0.05 -11.89 26.87 -1.24 3hde_o00 source 3HDE LYSOZYME : 2 hits 3hde_o00 naa= 3 ULMN 3 3uao_o00 PUTATIVE ISOCHORISMATASE user 1 3 # 1 A 29 ASP A 118 ASP^? 28.24 O2 GOL A 200 A 117 LYS A 92 LYS^? 33.34 O2 GOL A 200 A 150 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 37.97 47.82 5.46 38.65 48.02 7.40 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 41.02 51.33 13.36 40.18 47.06 9.99 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 39.17 42.30 8.54 40.94 44.26 7.78 8.07 32.08 0.96 5.72 33.61 0.99 3uao_o00 source 3UAO PUTATIVE ISOCHORISMATASE : 1 hits 3uao_o00 naa= 3 ULMN 3 3uao_o01 PUTATIVE ISOCHORISMATASE user 1 3 # 1 B 29 ASP A 118 ASP^? 28.24 O2 GOL A 200 B 117 LYS A 92 LYS^? 33.34 O2 GOL A 200 B 150 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 33.94 43.16 45.29 35.02 43.05 43.47 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 38.53 39.60 38.22 36.76 43.89 41.37 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 35.77 48.61 42.57 37.40 46.62 43.48 8.07 32.08 0.96 5.72 33.61 0.99 3uao_o01 source 3UAO PUTATIVE ISOCHORISMATASE : 1 hits 3uao_o01 naa= 3 ULMN 3 3uao_o02 PUTATIVE ISOCHORISMATASE user 1 3 # 1 C 29 ASP A 118 ASP^? 28.24 O2 GOL A 200 C 117 LYS A 92 LYS^? 33.34 O2 GOL A 200 C 150 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 54.62 -9.81 68.84 52.97 -9.23 67.61 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 46.74 -10.34 64.36 51.80 -7.96 65.19 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 55.78 -5.03 64.48 55.52 -7.79 64.07 8.07 32.08 0.96 5.72 33.61 0.99 3uao_o02 source 3UAO PUTATIVE ISOCHORISMATASE : 1 hits 3uao_o02 naa= 3 ULMN 3 3uao_o03 PUTATIVE ISOCHORISMATASE user 1 3 # 1 D 29 ASP A 118 ASP^? 28.24 O2 GOL A 200 D 117 LYS A 92 LYS^? 33.34 O2 GOL A 200 D 150 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 25.05 13.27 54.10 26.66 12.10 53.60 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 33.45 10.03 51.76 28.31 9.37 53.37 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 24.32 7.20 55.59 24.80 8.07 53.08 8.07 32.08 0.96 5.72 33.61 0.99 3uao_o03 source 3UAO PUTATIVE ISOCHORISMATASE : 1 hits 3uao_o03 naa= 3 ULMN 3 3uao_o04 PUTATIVE ISOCHORISMATASE user 1 3 # 1 E 29 ASP A 118 ASP^? 28.24 O2 GOL A 200 E 117 LYS A 92 LYS^? 33.34 O2 GOL A 200 E 150 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 54.17 11.77 49.20 52.64 11.40 50.63 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 45.83 11.66 53.42 50.97 10.25 52.77 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 55.28 7.50 53.67 54.71 10.14 54.01 8.07 32.08 0.96 5.72 33.61 0.99 3uao_o04 source 3UAO PUTATIVE ISOCHORISMATASE : 1 hits 3uao_o04 naa= 3 ULMN 3 3uao_o05 PUTATIVE ISOCHORISMATASE user 1 3 # 1 F 29 ASP A 118 ASP^? 28.24 O2 GOL A 200 F 117 LYS A 92 LYS^? 33.34 O2 GOL A 200 F 150 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 41.67 65.37 28.64 40.76 63.70 27.74 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 38.34 58.97 23.05 39.26 61.42 28.02 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 39.64 61.25 32.92 38.08 62.62 31.22 8.07 32.08 0.96 5.72 33.61 0.99 3uao_o05 source 3UAO PUTATIVE ISOCHORISMATASE : 1 hits 3uao_o05 naa= 3 ULMN 3 3uao_o06 PUTATIVE ISOCHORISMATASE user 1 3 # 1 G 29 ASP A 118 ASP^? 28.24 O2 GOL A 200 G 117 LYS A 92 LYS^? 33.34 O2 GOL A 200 G 150 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 26.53 -14.13 63.27 28.07 -12.63 63.49 11.56 28.53 -5.39 13.56 29.26 -5.43 coo 34.28 -10.03 65.81 29.08 -9.98 63.85 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 25.24 -8.30 61.46 25.55 -9.17 63.98 8.07 32.08 0.96 5.72 33.61 0.99 3uao_o06 source 3UAO PUTATIVE ISOCHORISMATASE : 1 hits 3uao_o06 naa= 3 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 1 3 # 1 H 28 VAL A 60 VAL^? 23.13 O2 GOL A 200 H 117 LYS A 92 LYS^? 33.34 O2 GOL A 200 H 150 CYH A 95 CYH^? 21.45 O2 GOL A 200 coo 45.82 27.58 23.40 45.30 28.87 21.66 7.51 28.82 -3.33 5.48 28.00 -3.26 coo 38.01 32.08 28.20 39.46 29.85 23.57 8.12 38.10 -6.78 6.81 35.86 -11.65 coo 41.19 29.62 18.76 39.21 28.51 20.32 8.07 32.08 0.96 5.72 33.61 0.99 3uao_o07 source 3UAO PUTATIVE ISOCHORISMATASE : 1 hits 3uao_o07 naa= 3