*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 4 1moq_c00 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 1 4 # 1 481 GLU A 101 GLU~? 1000.00 485 LYS A 98 LYS~? 1000.00 488 GLU A 94 GLU~? 1000.00 603 LYS A 86 LYS^? 1000.00 coo 24.49 18.95 6.71 25.16 18.17 4.85 30.15 10.80 -12.01 29.56 9.58 -10.37 coo 21.77 13.74 4.55 26.03 15.07 4.05 33.88 9.40 -9.57 30.19 10.21 -6.88 coo 22.93 13.34 0.22 24.67 14.21 1.12 33.73 4.64 -5.66 31.71 5.23 -5.97 coo 31.74 12.46 -4.74 33.15 13.34 0.17 29.45 2.33 2.56 27.22 6.18 5.41 ULMN 4 1moq_c00 GLUCOSAMINE 6-PHOSPHATE SYNTHASE user 2 4 # 2 481 GLU B 101 GLU~? 1000.00 485 LYS B 98 LYS~? 1000.00 488 GLU B 94 GLU~? 1000.00 603 LYS B 86 LYS^? 1000.00 coo 24.49 18.95 6.71 25.16 18.17 4.85 31.45 -15.60 28.20 32.65 -14.70 26.72 coo 21.77 13.74 4.55 26.03 15.07 4.05 32.73 -19.13 25.55 34.27 -15.53 22.56 coo 22.93 13.34 0.22 24.67 14.21 1.12 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 31.74 12.46 -4.74 33.15 13.34 0.17 40.69 -14.41 14.48 36.91 -13.49 19.50 1moq_c00 source 1moq GLUCOSAMINE 6-PHOSPHATE SYNTHASE : 2 hits 1moq_c00 naa= 4 ULMN 4 1nlu_c00 PSEUDO-IODOTYROSTATIN user 1 4 # 1 A 80 GLU A 55 GLU~? 1000.00 A 84 ASP A 56 ASP~? 1000.00 A 170 ASP A 49 ASP.? 1000.00 A 287 SER A 52 SER~? 1000.00 coo 23.89 18.61 12.79 25.29 17.35 13.81 34.72 5.65 14.40 34.53 4.90 16.37 coo 27.00 22.87 14.47 26.64 20.92 13.76 37.70 11.70 13.69 37.98 13.80 13.68 coo 27.92 8.51 14.90 28.11 10.58 15.35 45.31 0.34 15.16 45.91 -1.47 16.07 coo 29.00 16.00 15.34 27.04 15.11 14.25 38.79 6.40 16.02 40.97 6.72 17.08 ULMN 4 1nlu_c00 PSEUDO-IODOTYROSTATIN user 2 4 # 2 A 80 GLU B 55 GLU~? 1000.00 A 84 ASP B 56 ASP~? 1000.00 A 170 ASP B 49 ASP.? 1000.00 A 287 SER B 52 SER~? 1000.00 coo 23.89 18.61 12.79 25.29 17.35 13.81 38.74 -18.72 2.21 39.87 -17.75 0.71 coo 27.00 22.87 14.47 26.64 20.92 13.76 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 27.92 8.51 14.90 28.11 10.58 15.35 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo 29.00 16.00 15.34 27.04 15.11 14.25 37.53 -22.71 -0.30 38.30 -23.28 -2.54 1nlu_c00 source 1nlu PSEUDO-IODOTYROSTATIN : 2 hits 1nlu_c00 naa= 4 ULMN 4 1oqz_c02 GLUTARYL ACYLASE user 1 4 # 1 A 170 SER A 77 SER~? 1000.00 A 192 HIS A 78 HIS~? 1000.00 A 413 ASN B 61 ASN.? 1000.00 A 624 GLU A 68 GLU~? 1000.00 coo 80.14 40.76 52.28 77.73 40.59 51.94 32.56 -10.06 6.91 30.65 -10.82 8.21 coo 81.57 42.83 49.15 82.94 43.59 50.55 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 81.75 35.21 52.13 80.92 37.12 51.69 27.99 -14.15 9.15 27.59 -12.59 7.76 coo 83.99 48.41 48.69 83.76 47.49 50.58 31.73 -6.96 -2.64 30.98 -7.61 -0.78 1oqz_c02 source 1oqz GLUTARYL ACYLASE : 1 hits 1oqz_c02 naa= 4 ULMN 4 1oqz_c03 GLUTARYL ACYLASE user 1 4 # 1 B 170 SER A 77 SER~? 1000.00 B 192 HIS A 78 HIS~? 1000.00 B 413 ASN B 61 ASN.? 1000.00 B 624 GLU A 68 GLU~? 1000.00 coo 25.22 6.41 2.90 27.67 6.33 3.11 32.56 -10.06 6.91 30.65 -10.82 8.21 coo 23.93 8.35 6.08 22.44 9.05 4.78 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 23.72 0.88 2.95 24.56 2.79 3.34 27.99 -14.15 9.15 27.59 -12.59 7.76 coo 21.54 14.04 6.66 21.69 13.21 4.74 31.73 -6.96 -2.64 30.98 -7.61 -0.78 1oqz_c03 source 1oqz GLUTARYL ACYLASE : 1 hits 1oqz_c03 naa= 4 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 140 TYR A 24 TYR~? 1000.00 B 190 LYS A 59 LYS~? 1000.00 B 222 ASP A 56 ASP~? 1000.00 coo 7.17 16.59 41.26 8.01 19.20 40.73 38.31 18.23 6.93 36.20 19.30 8.42 coo 13.38 20.00 35.06 11.43 22.49 39.53 31.90 13.00 11.85 28.95 14.22 16.49 coo 9.76 26.58 38.10 11.63 25.78 38.76 37.70 11.70 13.69 37.98 13.80 13.68 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 140 TYR B 24 TYR~? 1000.00 B 190 LYS B 59 LYS~? 1000.00 B 222 ASP B 56 ASP~? 1000.00 coo 7.17 16.59 41.26 8.01 19.20 40.73 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 13.38 20.00 35.06 11.43 22.49 39.53 30.97 -15.57 3.92 34.16 -17.16 -0.27 coo 9.76 26.58 38.10 11.63 25.78 38.76 32.42 -21.29 1.64 30.34 -21.41 1.35 1a05_c00 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 2 hits 1a05_c00 naa= 3 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 190 LYS A 59 LYS~? 1000.00 A 222 ASP A 56 ASP~? 1000.00 B 140 TYR A 24 TYR~? 1000.00 coo -4.61 20.12 30.34 -2.74 22.65 25.95 31.90 13.00 11.85 28.95 14.22 16.49 coo -1.04 26.60 27.37 -2.94 25.93 26.69 37.70 11.70 13.69 37.98 13.80 13.68 coo 1.51 16.60 24.17 0.82 19.23 24.79 38.31 18.23 6.93 36.20 19.30 8.42 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 190 LYS B 59 LYS~? 1000.00 A 222 ASP B 56 ASP~? 1000.00 B 140 TYR B 24 TYR~? 1000.00 coo -4.61 20.12 30.34 -2.74 22.65 25.95 30.97 -15.57 3.92 34.16 -17.16 -0.27 coo -1.04 26.60 27.37 -2.94 25.93 26.69 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 1.51 16.60 24.17 0.82 19.23 24.79 24.95 -21.91 8.04 24.30 -19.58 6.61 1a05_c01 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 2 hits 1a05_c01 naa= 3 ULMN 3 1a0j_c12 TRYPSIN user 1 3 # 1 A 57 HIS A 78 HIS~? 1000.00 A 102 ASP A 79 ASP~? 1000.00 A 193 GLY A 66 GLY^? 1000.00 coo 25.57 41.22 61.68 24.18 39.98 62.50 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 22.33 45.48 59.73 23.35 43.67 60.06 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 22.57 32.23 64.13 21.98 32.82 64.22 35.16 0.03 1.24 34.60 0.21 0.65 ULMN 3 1a0j_c12 TRYPSIN user 2 3 # 2 A 57 HIS A 78 HIS~? 1000.00 A 102 ASP A 79 ASP~? 1000.00 A 193 GLY A 84 GLY.? 1000.00 coo 25.57 41.22 61.68 24.18 39.98 62.50 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 22.33 45.48 59.73 23.35 43.67 60.06 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 22.57 32.23 64.13 21.98 32.82 64.22 28.24 3.53 8.75 28.74 2.92 8.51 ULMN 3 1a0j_c12 TRYPSIN user 3 3 # 3 A 57 HIS B 78 HIS~? 1000.00 A 102 ASP B 79 ASP~? 1000.00 A 193 GLY B 66 GLY^? 1000.00 coo 25.57 41.22 61.68 24.18 39.98 62.50 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 22.33 45.48 59.73 23.35 43.67 60.06 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 22.57 32.23 64.13 21.98 32.82 64.22 42.82 -20.03 15.19 42.57 -19.59 15.86 ULMN 3 1a0j_c12 TRYPSIN user 4 3 # 4 A 57 HIS B 78 HIS~? 1000.00 A 102 ASP B 79 ASP~? 1000.00 A 193 GLY B 84 GLY.? 1000.00 coo 25.57 41.22 61.68 24.18 39.98 62.50 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 22.33 45.48 59.73 23.35 43.67 60.06 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 22.57 32.23 64.13 21.98 32.82 64.22 40.56 -13.02 8.08 41.12 -13.48 8.40 1a0j_c12 source 1a0j TRYPSIN : 4 hits 1a0j_c12 naa= 3 ULMN 3 1a0j_c13 TRYPSIN user 1 3 # 1 B 57 HIS A 78 HIS~? 1000.00 B 102 ASP A 79 ASP~? 1000.00 B 193 GLY A 66 GLY^? 1000.00 coo 44.08 45.58 52.81 45.86 46.55 52.85 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 43.04 44.75 47.18 43.31 45.51 49.13 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 50.46 51.91 56.90 50.65 51.62 56.14 35.16 0.03 1.24 34.60 0.21 0.65 ULMN 3 1a0j_c13 TRYPSIN user 2 3 # 2 B 57 HIS A 78 HIS~? 1000.00 B 102 ASP A 79 ASP~? 1000.00 B 193 GLY A 84 GLY.? 1000.00 coo 44.08 45.58 52.81 45.86 46.55 52.85 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 43.04 44.75 47.18 43.31 45.51 49.13 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 50.46 51.91 56.90 50.65 51.62 56.14 28.24 3.53 8.75 28.74 2.92 8.51 ULMN 3 1a0j_c13 TRYPSIN user 3 3 # 3 B 57 HIS B 78 HIS~? 1000.00 B 102 ASP B 79 ASP~? 1000.00 B 193 GLY B 66 GLY^? 1000.00 coo 44.08 45.58 52.81 45.86 46.55 52.85 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 43.04 44.75 47.18 43.31 45.51 49.13 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 50.46 51.91 56.90 50.65 51.62 56.14 42.82 -20.03 15.19 42.57 -19.59 15.86 ULMN 3 1a0j_c13 TRYPSIN user 4 3 # 4 B 57 HIS B 78 HIS~? 1000.00 B 102 ASP B 79 ASP~? 1000.00 B 193 GLY B 84 GLY.? 1000.00 coo 44.08 45.58 52.81 45.86 46.55 52.85 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 43.04 44.75 47.18 43.31 45.51 49.13 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 50.46 51.91 56.90 50.65 51.62 56.14 40.56 -13.02 8.08 41.12 -13.48 8.40 1a0j_c13 source 1a0j TRYPSIN : 4 hits 1a0j_c13 naa= 3 ULMN 3 1a0j_c14 TRYPSIN user 1 3 # 1 C 57 HIS A 78 HIS~? 1000.00 C 102 ASP A 79 ASP~? 1000.00 C 193 GLY A 66 GLY^? 1000.00 coo 34.37 41.18 73.21 34.04 43.09 73.87 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 34.89 38.34 78.12 35.11 39.59 76.42 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 35.43 51.03 72.12 35.20 50.72 72.87 35.16 0.03 1.24 34.60 0.21 0.65 ULMN 3 1a0j_c14 TRYPSIN user 2 3 # 2 C 57 HIS A 78 HIS~? 1000.00 C 102 ASP A 79 ASP~? 1000.00 C 193 GLY A 84 GLY.? 1000.00 coo 34.37 41.18 73.21 34.04 43.09 73.87 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 34.89 38.34 78.12 35.11 39.59 76.42 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 35.43 51.03 72.12 35.20 50.72 72.87 28.24 3.53 8.75 28.74 2.92 8.51 ULMN 3 1a0j_c14 TRYPSIN user 3 3 # 3 C 57 HIS B 78 HIS~? 1000.00 C 102 ASP B 79 ASP~? 1000.00 C 193 GLY B 66 GLY^? 1000.00 coo 34.37 41.18 73.21 34.04 43.09 73.87 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 34.89 38.34 78.12 35.11 39.59 76.42 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 35.43 51.03 72.12 35.20 50.72 72.87 42.82 -20.03 15.19 42.57 -19.59 15.86 ULMN 3 1a0j_c14 TRYPSIN user 4 3 # 4 C 57 HIS B 78 HIS~? 1000.00 C 102 ASP B 79 ASP~? 1000.00 C 193 GLY B 84 GLY.? 1000.00 coo 34.37 41.18 73.21 34.04 43.09 73.87 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 34.89 38.34 78.12 35.11 39.59 76.42 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 35.43 51.03 72.12 35.20 50.72 72.87 40.56 -13.02 8.08 41.12 -13.48 8.40 1a0j_c14 source 1a0j TRYPSIN : 4 hits 1a0j_c14 naa= 3 ULMN 3 1a0j_c15 TRYPSIN user 1 3 # 1 D 57 HIS A 78 HIS~? 1000.00 D 102 ASP A 79 ASP~? 1000.00 D 193 GLY A 66 GLY^? 1000.00 coo 8.19 15.01 95.72 7.78 16.53 97.01 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 13.53 16.28 93.98 11.45 16.21 94.40 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 1.80 21.25 100.04 2.61 21.42 100.18 35.16 0.03 1.24 34.60 0.21 0.65 ULMN 3 1a0j_c15 TRYPSIN user 2 3 # 2 D 57 HIS A 78 HIS~? 1000.00 D 102 ASP A 79 ASP~? 1000.00 D 193 GLY A 84 GLY.? 1000.00 coo 8.19 15.01 95.72 7.78 16.53 97.01 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 13.53 16.28 93.98 11.45 16.21 94.40 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 1.80 21.25 100.04 2.61 21.42 100.18 28.24 3.53 8.75 28.74 2.92 8.51 ULMN 3 1a0j_c15 TRYPSIN user 3 3 # 3 D 57 HIS B 78 HIS~? 1000.00 D 102 ASP B 79 ASP~? 1000.00 D 193 GLY B 66 GLY^? 1000.00 coo 8.19 15.01 95.72 7.78 16.53 97.01 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 13.53 16.28 93.98 11.45 16.21 94.40 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 1.80 21.25 100.04 2.61 21.42 100.18 42.82 -20.03 15.19 42.57 -19.59 15.86 ULMN 3 1a0j_c15 TRYPSIN user 4 3 # 4 D 57 HIS B 78 HIS~? 1000.00 D 102 ASP B 79 ASP~? 1000.00 D 193 GLY B 84 GLY.? 1000.00 coo 8.19 15.01 95.72 7.78 16.53 97.01 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 13.53 16.28 93.98 11.45 16.21 94.40 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 1.80 21.25 100.04 2.61 21.42 100.18 40.56 -13.02 8.08 41.12 -13.48 8.40 1a0j_c15 source 1a0j TRYPSIN : 4 hits 1a0j_c15 naa= 3 ULMN 3 1a41_c01 TOPOISOMERASE I user 1 3 # 1 223 ARG A 72 ARG~? 1000.00 265 HIS A 78 HIS~? 1000.00 274 TYR B 24 TYR~? 1000.00 coo -15.18 55.46 8.55 -14.82 52.98 10.38 33.22 -10.92 -2.70 30.57 -10.95 -4.25 coo -14.48 45.59 11.18 -14.02 47.49 10.42 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 0.94 52.26 9.16 1.95 54.78 9.91 24.95 -21.91 8.04 24.30 -19.58 6.61 1a41_c01 source 1a41 TOPOISOMERASE I : 1 hits 1a41_c01 naa= 3 ULMN 3 1a4s_c00 BETAINE ALDEHYDE DEHYDROGENASE user 1 3 # 1 A 166 ASN A 69 ASN~? 1000.00 A 263 GLU A 94 GLU~? 1000.00 A 297 CYH A 67 CYH^? 1000.00 coo -29.12 -17.91 -4.01 -27.90 -16.18 -4.17 36.86 -6.86 -5.26 35.56 -6.98 -6.93 coo -22.63 -7.00 -2.71 -20.98 -7.55 -3.90 33.73 4.64 -5.66 31.71 5.23 -5.97 coo -26.23 -13.20 -9.20 -24.31 -12.88 -7.19 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1a4s_c00 BETAINE ALDEHYDE DEHYDROGENASE user 2 3 # 2 A 166 ASN B 69 ASN~? 1000.00 A 263 GLU B 94 GLU~? 1000.00 A 297 CYH B 67 CYH^? 1000.00 coo -29.12 -17.91 -4.01 -27.90 -16.18 -4.17 48.97 -22.65 22.06 48.94 -21.42 23.79 coo -22.63 -7.00 -2.71 -20.98 -7.55 -3.90 37.91 -18.85 21.91 37.52 -16.89 22.58 coo -26.23 -13.20 -9.20 -24.31 -12.88 -7.19 44.74 -21.15 18.29 45.66 -22.86 20.37 1a4s_c00 source 1a4s BETAINE ALDEHYDE DEHYDROGENASE : 2 hits 1a4s_c00 naa= 3 ULMN 3 1a4s_c01 BETAINE ALDEHYDE DEHYDROGENASE user 1 3 # 1 B 166 ASN A 69 ASN~? 1000.00 B 263 GLU A 94 GLU~? 1000.00 B 297 CYH A 67 CYH^? 1000.00 coo -17.71 28.81 3.98 -17.49 26.70 4.16 36.86 -6.86 -5.26 35.56 -6.98 -6.93 coo -16.93 16.15 2.64 -15.22 15.89 3.84 33.73 4.64 -5.66 31.71 5.23 -5.97 coo -17.36 23.25 9.07 -15.77 22.09 7.09 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1a4s_c01 BETAINE ALDEHYDE DEHYDROGENASE user 2 3 # 2 B 166 ASN B 69 ASN~? 1000.00 B 263 GLU B 94 GLU~? 1000.00 B 297 CYH B 67 CYH^? 1000.00 coo -17.71 28.81 3.98 -17.49 26.70 4.16 48.97 -22.65 22.06 48.94 -21.42 23.79 coo -16.93 16.15 2.64 -15.22 15.89 3.84 37.91 -18.85 21.91 37.52 -16.89 22.58 coo -17.36 23.25 9.07 -15.77 22.09 7.09 44.74 -21.15 18.29 45.66 -22.86 20.37 1a4s_c01 source 1a4s BETAINE ALDEHYDE DEHYDROGENASE : 2 hits 1a4s_c01 naa= 3 ULMN 3 1a4s_c02 BETAINE ALDEHYDE DEHYDROGENASE user 1 3 # 1 C 166 ASN A 69 ASN~? 1000.00 C 263 GLU A 94 GLU~? 1000.00 C 297 CYH A 67 CYH^? 1000.00 coo 21.46 -14.18 22.47 21.02 -12.84 20.88 36.86 -6.86 -5.26 35.56 -6.98 -6.93 coo 18.98 -8.30 11.46 17.52 -6.95 12.17 33.73 4.64 -5.66 31.71 5.23 -5.97 coo 21.48 -6.84 20.62 19.38 -7.54 18.90 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1a4s_c02 BETAINE ALDEHYDE DEHYDROGENASE user 2 3 # 2 C 166 ASN B 69 ASN~? 1000.00 C 263 GLU B 94 GLU~? 1000.00 C 297 CYH B 67 CYH^? 1000.00 coo 21.46 -14.18 22.47 21.02 -12.84 20.88 48.97 -22.65 22.06 48.94 -21.42 23.79 coo 18.98 -8.30 11.46 17.52 -6.95 12.17 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 21.48 -6.84 20.62 19.38 -7.54 18.90 44.74 -21.15 18.29 45.66 -22.86 20.37 1a4s_c02 source 1a4s BETAINE ALDEHYDE DEHYDROGENASE : 2 hits 1a4s_c02 naa= 3 ULMN 3 1a4s_c03 BETAINE ALDEHYDE DEHYDROGENASE user 1 3 # 1 D 166 ASN A 69 ASN~? 1000.00 D 263 GLU A 94 GLU~? 1000.00 D 297 CYH A 67 CYH^? 1000.00 coo 25.54 3.42 -22.59 24.52 2.45 -20.95 36.86 -6.86 -5.26 35.56 -6.98 -6.93 coo 20.72 -0.76 -11.60 18.80 -1.24 -12.34 33.73 4.64 -5.66 31.71 5.23 -5.97 coo 22.24 -3.13 -20.79 20.78 -1.47 -19.04 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1a4s_c03 BETAINE ALDEHYDE DEHYDROGENASE user 2 3 # 2 D 166 ASN B 69 ASN~? 1000.00 D 263 GLU B 94 GLU~? 1000.00 D 297 CYH B 67 CYH^? 1000.00 coo 25.54 3.42 -22.59 24.52 2.45 -20.95 48.97 -22.65 22.06 48.94 -21.42 23.79 coo 20.72 -0.76 -11.60 18.80 -1.24 -12.34 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 22.24 -3.13 -20.79 20.78 -1.47 -19.04 44.74 -21.15 18.29 45.66 -22.86 20.37 1a4s_c03 source 1a4s BETAINE ALDEHYDE DEHYDROGENASE : 2 hits 1a4s_c03 naa= 3 ULMN 3 1ald_c00 ALDOLASE A (E.C.4.1.2.13) user 1 3 # 1 33 ASP A 79 ASP~? 1000.00 187 GLU B 31 GLU^? 1000.00 229 LYS B 2 LYS^? 1000.00 coo -52.57 56.60 47.75 -51.52 54.87 46.95 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -45.08 48.37 46.81 -46.53 49.74 45.96 27.17 -15.62 16.86 27.14 -13.84 18.01 coo -47.40 44.36 48.48 -50.80 49.18 46.20 25.35 -19.21 20.13 23.65 -14.85 22.59 1ald_c00 source 1ald ALDOLASE A (E.C.4.1.2.13) : 1 hits 1ald_c00 naa= 3 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 29 ASP.? 1000.00 214 ASP A 11 ASP~? 1000.00 289 ASP A 26 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.08 24.05 1.29 32.31 25.48 2.63 coo 26.86 59.76 46.36 25.42 58.23 45.92 52.21 -0.96 5.64 52.68 -0.78 3.58 coo 9.42 68.07 30.27 7.35 68.27 30.10 44.41 22.27 3.14 45.59 23.72 2.16 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP B 11 ASP~? 1000.00 214 ASP A 79 ASP~? 1000.00 289 ASP B 49 ASP.? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 42.92 -37.03 9.64 45.02 -37.19 9.59 coo 26.86 59.76 46.36 25.42 58.23 45.92 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 9.42 68.07 30.27 7.35 68.27 30.10 42.86 -29.77 0.45 44.61 -30.51 -0.48 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP B 29 ASP.? 1000.00 214 ASP B 11 ASP~? 1000.00 289 ASP B 26 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 26.86 59.76 46.36 25.42 58.23 45.92 42.92 -37.03 9.64 45.02 -37.19 9.59 coo 9.42 68.07 30.27 7.35 68.27 30.10 20.05 -27.91 11.23 18.50 -28.91 12.26 1amy_c01 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 3 hits 1amy_c01 naa= 3 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 29 ASP.? 1000.00 227 GLU A 33 GLU^? 1000.00 289 ASP A 26 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.08 24.05 1.29 32.31 25.48 2.63 coo 3.96 55.76 41.24 4.83 57.69 41.17 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 9.42 68.07 30.27 7.35 68.27 30.10 44.41 22.27 3.14 45.59 23.72 2.16 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP B 29 ASP.? 1000.00 227 GLU B 33 GLU^? 1000.00 289 ASP B 26 ASP~? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 3.96 55.76 41.24 4.83 57.69 41.17 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 9.42 68.07 30.27 7.35 68.27 30.10 20.05 -27.91 11.23 18.50 -28.91 12.26 1amy_c06 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 2 hits 1amy_c06 naa= 3 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 1 3 # 1 E 33 ASP A 9 ASP~? 1000.00 E 36 SER A 39 SER~? 1000.00 E 213 ASP A 11 ASP~? 1000.00 coo 26.30 12.96 16.78 25.46 12.99 18.72 49.66 0.41 0.84 50.15 0.20 -1.21 coo 28.33 15.15 21.27 28.70 13.12 19.97 44.91 -4.59 1.85 47.19 -3.74 1.94 coo 20.15 16.04 19.79 21.65 14.49 19.86 52.21 -0.96 5.64 52.68 -0.78 3.58 ULMN 3 1apt_c04 ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET user 2 3 # 2 E 33 ASP B 9 ASP~? 1000.00 E 36 SER B 39 SER~? 1000.00 E 213 ASP B 11 ASP~? 1000.00 coo 26.30 12.96 16.78 25.46 12.99 18.72 41.34 -34.74 14.44 41.31 -35.37 16.46 coo 28.33 15.15 21.27 28.70 13.12 19.97 46.85 -30.26 14.14 45.82 -32.43 13.84 coo 20.15 16.04 19.79 21.65 14.49 19.86 42.92 -37.03 9.64 45.02 -37.19 9.59 1apt_c04 source 1apt ISOVALERYL (IVA)-VAL-VAL-LYSTA-O-ET (LYSTA IS : 2 hits 1apt_c04 naa= 3 ULMN 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 # 1 A 194 SER B 77 SER~? 1000.00 A 292 ASP A 9 ASP~? 1000.00 A 322 HIS B 37 HIS.? 1000.00 coo 36.34 32.23 39.60 36.43 34.62 39.93 53.69 -18.22 10.70 56.03 -18.39 10.07 coo 19.73 19.18 41.39 21.50 18.65 40.34 49.66 0.41 0.84 50.15 0.20 -1.21 coo 41.69 45.14 46.60 41.78 47.19 46.18 42.39 -26.87 19.72 41.38 -28.37 20.76 1aql_c02 source 1aql BILE-SALT ACTIVATED LIPASE : 1 hits 1aql_c02 naa= 3 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 # 1 B 194 SER B 77 SER~? 1000.00 B 292 ASP A 9 ASP~? 1000.00 B 322 HIS B 37 HIS.? 1000.00 coo 35.42 71.28 22.94 36.24 69.06 22.37 53.69 -18.22 10.70 56.03 -18.39 10.07 coo 24.74 78.07 5.59 24.32 79.03 7.46 49.66 0.41 0.84 50.15 0.20 -1.21 coo 48.81 64.16 26.34 49.30 62.16 26.73 42.39 -26.87 19.72 41.38 -28.37 20.76 1aql_c03 source 1aql BILE-SALT ACTIVATED LIPASE : 1 hits 1aql_c03 naa= 3 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 1 3 # 1 A 85 HIS A 78 HIS~? 1000.00 A 171 ARG A 51 ARG~? 1000.00 A 190 LYS A 86 LYS^? 1000.00 coo 22.59 2.26 43.22 21.17 3.47 42.27 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 13.63 3.81 28.83 14.49 2.91 31.59 36.08 1.17 15.71 33.32 0.07 16.46 coo 24.97 7.47 37.69 21.24 10.69 35.89 29.45 2.33 2.56 27.22 6.18 5.41 ULMN 3 1azy_c00 THYMIDINE PHOSPHORYLASE user 2 3 # 2 A 85 HIS B 78 HIS~? 1000.00 A 171 ARG B 51 ARG~? 1000.00 A 190 LYS B 86 LYS^? 1000.00 coo 22.59 2.26 43.22 21.17 3.47 42.27 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 13.63 3.81 28.83 14.49 2.91 31.59 42.92 -20.45 0.43 44.35 -17.75 0.22 coo 24.97 7.47 37.69 21.24 10.69 35.89 40.69 -14.41 14.48 36.91 -13.49 19.50 1azy_c00 source 1azy THYMIDINE PHOSPHORYLASE : 2 hits 1azy_c00 naa= 3 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 1 3 # 1 B 85 HIS A 78 HIS~? 1000.00 B 171 ARG A 51 ARG~? 1000.00 B 190 LYS A 86 LYS^? 1000.00 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 2.83 4.83 10.84 1.96 4.32 7.97 36.08 1.17 15.71 33.32 0.07 16.46 coo -8.96 9.04 2.88 -5.39 12.11 5.08 29.45 2.33 2.56 27.22 6.18 5.41 ULMN 3 1azy_c01 THYMIDINE PHOSPHORYLASE user 2 3 # 2 B 85 HIS B 78 HIS~? 1000.00 B 171 ARG B 51 ARG~? 1000.00 B 190 LYS B 86 LYS^? 1000.00 coo -6.44 4.86 -3.45 -5.03 5.97 -2.36 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 2.83 4.83 10.84 1.96 4.32 7.97 42.92 -20.45 0.43 44.35 -17.75 0.22 coo -8.96 9.04 2.88 -5.39 12.11 5.08 40.69 -14.41 14.48 36.91 -13.49 19.50 1azy_c01 source 1azy THYMIDINE PHOSPHORYLASE : 2 hits 1azy_c01 naa= 3 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 A 145 TYR A 24 TYR~? 1000.00 A 230 ASP A 26 ASP~? 1000.00 A 273 LYS A 2 LYS^? 1000.00 coo 9.23 21.44 106.88 10.18 19.34 105.31 38.31 18.23 6.93 36.20 19.30 8.42 coo 1.45 22.80 104.16 2.58 21.02 104.01 44.41 22.27 3.14 45.59 23.72 2.16 coo 2.97 11.64 107.87 6.59 15.13 107.03 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 2 3 # 2 A 145 TYR B 24 TYR~? 1000.00 A 230 ASP B 26 ASP~? 1000.00 A 273 LYS B 2 LYS^? 1000.00 coo 9.23 21.44 106.88 10.18 19.34 105.31 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 1.45 22.80 104.16 2.58 21.02 104.01 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 2.97 11.64 107.87 6.59 15.13 107.03 25.35 -19.21 20.13 23.65 -14.85 22.59 ULMN 3 1b8g_c04 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 3 3 # 3 A 145 TYR B 24 TYR~? 1000.00 A 230 ASP B 29 ASP.? 1000.00 A 273 LYS B 2 LYS^? 1000.00 coo 9.23 21.44 106.88 10.18 19.34 105.31 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 1.45 22.80 104.16 2.58 21.02 104.01 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 2.97 11.64 107.87 6.59 15.13 107.03 25.35 -19.21 20.13 23.65 -14.85 22.59 1b8g_c04 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 3 hits 1b8g_c04 naa= 3 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 1 3 # 1 B 145 TYR A 24 TYR~? 1000.00 B 230 ASP A 26 ASP~? 1000.00 B 273 LYS A 2 LYS^? 1000.00 coo 11.81 13.41 73.03 10.00 13.03 75.12 38.31 18.23 6.93 36.20 19.30 8.42 coo 19.17 11.01 76.14 17.26 10.42 76.77 44.41 22.27 3.14 45.59 23.72 2.16 coo 11.10 2.31 76.60 10.24 7.24 75.62 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 2 3 # 2 B 145 TYR B 24 TYR~? 1000.00 B 230 ASP B 26 ASP~? 1000.00 B 273 LYS B 2 LYS^? 1000.00 coo 11.81 13.41 73.03 10.00 13.03 75.12 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 19.17 11.01 76.14 17.26 10.42 76.77 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 11.10 2.31 76.60 10.24 7.24 75.62 25.35 -19.21 20.13 23.65 -14.85 22.59 ULMN 3 1b8g_c05 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYuser 3 3 # 3 B 145 TYR B 24 TYR~? 1000.00 B 230 ASP B 29 ASP.? 1000.00 B 273 LYS B 2 LYS^? 1000.00 coo 11.81 13.41 73.03 10.00 13.03 75.12 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 19.17 11.01 76.14 17.26 10.42 76.77 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 11.10 2.31 76.60 10.24 7.24 75.62 25.35 -19.21 20.13 23.65 -14.85 22.59 1b8g_c05 source 1b8g 1-AMINOCYCLOPROPANE-1-CARBOXYLATE SYNTHASE : 3 hits 1b8g_c05 naa= 3 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 A 137 ARG A 51 ARG~? 1000.00 A 141 THR A 50 THR~? 1000.00 A 235 ASP A 79 ASP~? 1000.00 coo 6.21 93.81 36.58 4.58 96.33 37.17 36.08 1.17 15.71 33.32 0.07 16.46 coo 6.80 92.87 28.33 4.91 92.74 27.40 42.63 3.53 13.14 43.65 3.28 11.23 coo 12.98 90.36 47.57 11.26 89.62 46.62 29.04 -9.02 10.71 27.15 -9.65 10.03 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 A 137 ARG B 51 ARG~? 1000.00 A 141 THR B 50 THR~? 1000.00 A 235 ASP B 79 ASP~? 1000.00 coo 6.21 93.81 36.58 4.58 96.33 37.17 42.92 -20.45 0.43 44.35 -17.75 0.22 coo 6.80 92.87 28.33 4.91 92.74 27.40 39.90 -26.91 2.51 40.07 -28.04 4.36 coo 12.98 90.36 47.57 11.26 89.62 46.62 53.02 -14.22 6.66 54.72 -15.42 7.04 1bd3_c00 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 2 hits 1bd3_c00 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG A 51 ARG~? 1000.00 C 141 THR A 50 THR~? 1000.00 C 235 ASP A 79 ASP~? 1000.00 coo -5.79 67.26 36.83 -4.57 64.58 37.74 36.08 1.17 15.71 33.32 0.07 16.46 coo -6.81 68.31 28.28 -4.82 68.47 27.57 42.63 3.53 13.14 43.65 3.28 11.23 coo -13.01 70.96 47.58 -11.44 71.65 46.34 29.04 -9.02 10.71 27.15 -9.65 10.03 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 C 137 ARG B 51 ARG~? 1000.00 C 141 THR B 50 THR~? 1000.00 C 235 ASP B 79 ASP~? 1000.00 coo -5.79 67.26 36.83 -4.57 64.58 37.74 42.92 -20.45 0.43 44.35 -17.75 0.22 coo -6.81 68.31 28.28 -4.82 68.47 27.57 39.90 -26.91 2.51 40.07 -28.04 4.36 coo -13.01 70.96 47.58 -11.44 71.65 46.34 53.02 -14.22 6.66 54.72 -15.42 7.04 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 2 hits 1bd3_c02 naa= 3 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 1 3 # 1 A 382 ARG A 97 ARG~? 1000.00 A 451 GLU A 33 GLU^? 1000.00 A 540 GLU A 94 GLU~? 1000.00 coo 79.04 80.20 80.81 79.58 81.40 83.63 30.73 3.85 -12.02 31.57 1.08 -11.03 coo 81.34 87.29 87.22 82.36 86.09 88.61 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 79.94 80.46 88.84 81.11 81.36 87.27 33.73 4.64 -5.66 31.71 5.23 -5.97 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 2 3 # 2 A 382 ARG B 97 ARG~? 1000.00 A 451 GLU B 33 GLU^? 1000.00 A 540 GLU B 94 GLU~? 1000.00 coo 79.04 80.20 80.81 79.58 81.40 83.63 37.89 -16.06 27.72 40.60 -17.32 27.02 coo 81.34 87.29 87.22 82.36 86.09 88.61 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 79.94 80.46 88.84 81.11 81.36 87.27 37.91 -18.85 21.91 37.52 -16.89 22.58 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 B 97 ARG~? 1000.00 B 451 GLU B 33 GLU^? 1000.00 B 540 GLU B 94 GLU~? 1000.00 coo 82.21 41.07 119.14 83.95 40.66 116.59 37.89 -16.06 27.72 40.60 -17.32 27.02 coo 86.52 35.28 112.74 87.08 36.38 110.99 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 83.38 41.19 112.55 85.47 40.59 112.72 37.91 -18.85 21.91 37.52 -16.89 22.58 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 1 hits 1bhg_c05 naa= 3 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 1 3 # 1 30 GLY A 66 GLY^? 1000.00 48 HIS A 78 HIS~? 1000.00 99 ASP A 79 ASP~? 1000.00 coo 12.38 5.55 24.25 13.27 5.59 24.39 35.16 0.03 1.24 34.60 0.21 0.65 coo 18.80 12.68 24.53 17.69 13.54 26.08 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 17.07 18.51 26.62 16.67 17.07 28.09 29.04 -9.02 10.71 27.15 -9.65 10.03 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 2 3 # 2 30 GLY A 84 GLY.? 1000.00 48 HIS A 78 HIS~? 1000.00 99 ASP A 79 ASP~? 1000.00 coo 12.38 5.55 24.25 13.27 5.59 24.39 28.24 3.53 8.75 28.74 2.92 8.51 coo 18.80 12.68 24.53 17.69 13.54 26.08 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 17.07 18.51 26.62 16.67 17.07 28.09 29.04 -9.02 10.71 27.15 -9.65 10.03 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 3 3 # 3 30 GLY B 66 GLY^? 1000.00 48 HIS B 78 HIS~? 1000.00 99 ASP B 79 ASP~? 1000.00 coo 12.38 5.55 24.25 13.27 5.59 24.39 42.82 -20.03 15.19 42.57 -19.59 15.86 coo 18.80 12.68 24.53 17.69 13.54 26.08 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 17.07 18.51 26.62 16.67 17.07 28.09 53.02 -14.22 6.66 54.72 -15.42 7.04 ULMN 3 1bp2_c00 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSuser 4 3 # 4 30 GLY B 84 GLY.? 1000.00 48 HIS B 78 HIS~? 1000.00 99 ASP B 79 ASP~? 1000.00 coo 12.38 5.55 24.25 13.27 5.59 24.39 40.56 -13.02 8.08 41.12 -13.48 8.40 coo 18.80 12.68 24.53 17.69 13.54 26.08 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 17.07 18.51 26.62 16.67 17.07 28.09 53.02 -14.22 6.66 54.72 -15.42 7.04 1bp2_c00 source 1bp2 PHOSPHOLIPASE A2 (E.C.3.1.1.4) (PHOSPHATIDE AC: 4 hits 1bp2_c00 naa= 3 ULMN 3 1bqc_c01 BETA-MANNANASE user 1 3 # 1 A 50 ARG B 97 ARG~? 1000.00 A 128 GLU B 33 GLU^? 1000.00 A 225 GLU B 94 GLU~? 1000.00 coo 38.56 19.11 14.83 37.12 21.00 16.76 37.89 -16.06 27.72 40.60 -17.32 27.02 coo 36.48 24.43 22.02 36.86 26.34 21.13 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 40.16 23.71 17.01 38.52 24.96 17.40 37.91 -18.85 21.91 37.52 -16.89 22.58 1bqc_c01 source 1bqc BETA-MANNANASE : 1 hits 1bqc_c01 naa= 3 ULMN 3 1brm_c00 ASPARTATE-SEMIALDEHYDE DEHYDROGENASEuser 1 3 # 1 A 135 CYH A 67 CYH^? 1000.00 A 162 GLN A 38 GLN~? 1000.00 A 274 HIS A 37 HIS.? 1000.00 coo 52.42 33.59 17.02 55.28 33.37 16.97 35.78 -2.24 -1.76 37.21 -3.54 -3.81 coo 57.00 27.92 14.37 57.48 27.87 16.44 44.60 -3.31 -3.72 46.52 -2.95 -4.59 coo 54.63 30.32 12.43 56.34 31.22 13.26 41.42 -0.42 -3.75 42.78 0.47 -5.09 ULMN 3 1brm_c00 ASPARTATE-SEMIALDEHYDE DEHYDROGENASEuser 2 3 # 2 A 135 CYH B 67 CYH^? 1000.00 A 162 GLN B 38 GLN~? 1000.00 A 274 HIS B 37 HIS.? 1000.00 coo 52.42 33.59 17.02 55.28 33.37 16.97 44.74 -21.15 18.29 45.66 -22.86 20.37 coo 57.00 27.92 14.37 57.48 27.87 16.44 45.23 -30.31 19.55 44.55 -32.25 20.14 coo 54.63 30.32 12.43 56.34 31.22 13.26 42.39 -26.87 19.72 41.38 -28.37 20.76 1brm_c00 source 1brm ASPARTATE-SEMIALDEHYDE DEHYDROGENASE : 2 hits 1brm_c00 naa= 3 ULMN 3 1brm_c01 ASPARTATE-SEMIALDEHYDE DEHYDROGENASEuser 1 3 # 1 B 135 CYH A 67 CYH^? 1000.00 B 162 GLN A 38 GLN~? 1000.00 B 274 HIS A 37 HIS.? 1000.00 coo 61.27 4.99 5.24 60.25 6.66 3.16 35.78 -2.24 -1.76 37.21 -3.54 -3.81 coo 58.84 12.34 5.39 57.02 11.39 4.86 44.60 -3.31 -3.72 46.52 -2.95 -4.59 coo 62.40 10.87 5.94 61.65 10.75 3.98 41.42 -0.42 -3.75 42.78 0.47 -5.09 ULMN 3 1brm_c01 ASPARTATE-SEMIALDEHYDE DEHYDROGENASEuser 2 3 # 2 B 135 CYH B 67 CYH^? 1000.00 B 162 GLN B 38 GLN~? 1000.00 B 274 HIS B 37 HIS.? 1000.00 coo 61.27 4.99 5.24 60.25 6.66 3.16 44.74 -21.15 18.29 45.66 -22.86 20.37 coo 58.84 12.34 5.39 57.02 11.39 4.86 45.23 -30.31 19.55 44.55 -32.25 20.14 coo 62.40 10.87 5.94 61.65 10.75 3.98 42.39 -26.87 19.72 41.38 -28.37 20.76 1brm_c01 source 1brm ASPARTATE-SEMIALDEHYDE DEHYDROGENASE : 2 hits 1brm_c01 naa= 3 ULMN 3 1brm_c02 ASPARTATE-SEMIALDEHYDE DEHYDROGENASEuser 1 3 # 1 C 135 CYH A 67 CYH^? 1000.00 C 162 GLN A 38 GLN~? 1000.00 C 274 HIS A 37 HIS.? 1000.00 coo 89.90 42.69 32.84 87.62 43.25 31.21 35.78 -2.24 -1.76 37.21 -3.54 -3.81 coo 86.85 49.48 30.99 85.25 48.65 32.11 44.60 -3.31 -3.72 46.52 -2.95 -4.59 coo 90.27 47.92 29.96 88.56 47.03 29.11 41.42 -0.42 -3.75 42.78 0.47 -5.09 ULMN 3 1brm_c02 ASPARTATE-SEMIALDEHYDE DEHYDROGENASEuser 2 3 # 2 C 135 CYH B 67 CYH^? 1000.00 C 162 GLN B 38 GLN~? 1000.00 C 274 HIS B 37 HIS.? 1000.00 coo 89.90 42.69 32.84 87.62 43.25 31.21 44.74 -21.15 18.29 45.66 -22.86 20.37 coo 86.85 49.48 30.99 85.25 48.65 32.11 45.23 -30.31 19.55 44.55 -32.25 20.14 coo 90.27 47.92 29.96 88.56 47.03 29.11 42.39 -26.87 19.72 41.38 -28.37 20.76 1brm_c02 source 1brm ASPARTATE-SEMIALDEHYDE DEHYDROGENASE : 2 hits 1brm_c02 naa= 3 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 # 1 A 82 HIS A 78 HIS~? 1000.00 A 168 ARG A 51 ARG~? 1000.00 A 187 LYS A 86 LYS^? 1000.00 coo 62.47 12.00 59.65 61.76 10.14 60.31 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 55.10 8.37 73.00 55.48 9.59 70.20 36.08 1.17 15.71 33.32 0.07 16.46 coo 66.76 10.09 66.23 61.80 8.06 65.82 29.45 2.33 2.56 27.22 6.18 5.41 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 2 3 # 2 A 82 HIS B 78 HIS~? 1000.00 A 168 ARG B 51 ARG~? 1000.00 A 187 LYS B 86 LYS^? 1000.00 coo 62.47 12.00 59.65 61.76 10.14 60.31 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 55.10 8.37 73.00 55.48 9.59 70.20 42.92 -20.45 0.43 44.35 -17.75 0.22 coo 66.76 10.09 66.23 61.80 8.06 65.82 40.69 -14.41 14.48 36.91 -13.49 19.50 1brw_c00 source 1brw PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE : 2 hits 1brw_c00 naa= 3 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 6 GLN^? 1000.00 A 91 LEU A 36 LEU^? 1000.00 A 133 GLU A 94 GLU~? 1000.00 coo 43.58 43.67 66.73 42.32 42.78 68.15 43.42 4.45 -4.29 44.63 4.11 -6.01 coo 38.58 45.09 70.44 38.28 45.21 72.59 39.85 1.67 2.06 39.69 3.15 3.64 coo 44.05 36.87 70.65 43.15 38.64 69.97 33.73 4.64 -5.66 31.71 5.23 -5.97 1bs4_c00 source 1bs4 PEPTIDE DEFORMYLASE : 1 hits 1bs4_c00 naa= 3 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 # 1 B 550 GLN A 6 GLN^? 1000.00 B 591 LEU A 36 LEU^? 1000.00 B 633 GLU A 94 GLU~? 1000.00 coo 88.06 44.34 57.19 89.06 45.53 55.74 43.42 4.45 -4.29 44.63 4.11 -6.01 coo 86.70 48.66 52.61 87.15 48.69 50.51 39.85 1.67 2.06 39.69 3.15 3.64 coo 95.42 44.52 54.43 93.46 45.31 54.70 33.73 4.64 -5.66 31.71 5.23 -5.97 1bs4_c01 source 1bs4 PEPTIDE DEFORMYLASE : 1 hits 1bs4_c01 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 6 GLN^? 1000.00 C1091 LEU A 36 LEU^? 1000.00 C1133 GLU A 94 GLU~? 1000.00 coo 68.29 34.44 43.03 66.67 34.74 44.37 43.42 4.45 -4.29 44.63 4.11 -6.01 coo 65.83 38.95 47.05 65.46 38.90 49.20 39.85 1.67 2.06 39.69 3.15 3.64 coo 63.14 29.39 46.25 63.84 31.31 45.74 33.73 4.64 -5.66 31.71 5.23 -5.97 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 1 hits 1bs4_c02 naa= 3 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 6 GLN^? 1000.00 A 91 LEU A 36 LEU^? 1000.00 A 133 GLU A 94 GLU~? 1000.00 coo 38.23 53.34 67.59 38.84 53.87 69.56 43.42 4.45 -4.29 44.63 4.11 -6.01 coo 35.40 53.22 73.30 35.37 54.87 74.74 39.85 1.67 2.06 39.69 3.15 3.64 coo 45.08 56.04 70.60 43.15 55.19 70.77 33.73 4.64 -5.66 31.71 5.23 -5.97 1bsj_c00 source 1bsj PEPTIDE DEFORMYLASE : 1 hits 1bsj_c00 naa= 3 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 # 1 B 325 ASP A 56 ASP~? 1000.00 B 354 GLU A 55 GLU~? 1000.00 B 421 ASP A 49 ASP.? 1000.00 coo 25.90 8.19 53.87 25.36 6.97 52.29 37.70 11.70 13.69 37.98 13.80 13.68 coo 27.87 10.66 47.95 27.82 8.60 48.27 34.72 5.65 14.40 34.53 4.90 16.37 coo 26.02 1.87 43.38 25.90 1.97 45.49 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 2 3 # 2 B 325 ASP B 56 ASP~? 1000.00 B 354 GLU B 55 GLU~? 1000.00 B 421 ASP B 49 ASP.? 1000.00 coo 25.90 8.19 53.87 25.36 6.97 52.29 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 27.87 10.66 47.95 27.82 8.60 48.27 38.74 -18.72 2.21 39.87 -17.75 0.71 coo 26.02 1.87 43.38 25.90 1.97 45.49 42.86 -29.77 0.45 44.61 -30.51 -0.48 1bvz_c09 source 1bvz ALPHA-AMYLASE II : 2 hits 1bvz_c09 naa= 3 ULMN 3 1bwp_c01 PLATELET-ACTIVATING FACTOR ACETYLHYDuser 1 3 # 1 104 ASN A 75 ASN.? 1000.00 192 ASP A 79 ASP~? 1000.00 195 HIS A 78 HIS~? 1000.00 coo 48.26 -8.64 25.32 50.17 -7.72 25.52 38.85 -14.15 4.51 39.52 -15.44 2.97 coo 56.18 0.19 32.76 56.16 -1.23 31.19 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 56.71 -3.36 28.21 54.80 -3.08 27.37 29.48 -7.00 4.25 30.06 -7.33 2.26 ULMN 3 1bwp_c01 PLATELET-ACTIVATING FACTOR ACETYLHYDuser 2 3 # 2 104 ASN B 75 ASN.? 1000.00 192 ASP B 79 ASP~? 1000.00 195 HIS B 78 HIS~? 1000.00 coo 48.26 -8.64 25.32 50.17 -7.72 25.52 57.03 -25.03 13.17 58.00 -25.84 14.88 coo 56.18 0.19 32.76 56.16 -1.23 31.19 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 56.71 -3.36 28.21 54.80 -3.08 27.37 50.43 -14.84 12.90 50.32 -15.37 14.93 1bwp_c01 source 1bwp PLATELET-ACTIVATING FACTOR ACETYLHYDROLASE : 2 hits 1bwp_c01 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 26 ASP~? 1000.00 264 GLU A 33 GLU^? 1000.00 328 ASP A 29 ASP.? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 44.41 22.27 3.14 45.59 23.72 2.16 coo 59.69 92.71 39.85 58.53 92.03 41.47 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 45.39 90.72 40.63 45.07 89.14 41.90 33.08 24.05 1.29 32.31 25.48 2.63 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP A 47 ASP.? 1000.00 264 GLU A 68 GLU~? 1000.00 328 ASP A 79 ASP~? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 59.69 92.71 39.85 58.53 92.03 41.47 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 45.39 90.72 40.63 45.07 89.14 41.90 29.04 -9.02 10.71 27.15 -9.65 10.03 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 # 3 229 ASP A 47 ASP.? 1000.00 264 GLU B 55 GLU~? 1000.00 328 ASP A 79 ASP~? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 59.69 92.71 39.85 58.53 92.03 41.47 38.74 -18.72 2.21 39.87 -17.75 0.71 coo 45.39 90.72 40.63 45.07 89.14 41.90 29.04 -9.02 10.71 27.15 -9.65 10.03 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 4 3 # 4 229 ASP A 79 ASP~? 1000.00 264 GLU B 94 GLU~? 1000.00 328 ASP A 47 ASP.? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 59.69 92.71 39.85 58.53 92.03 41.47 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 45.39 90.72 40.63 45.07 89.14 41.90 39.23 -5.09 16.44 39.94 -6.30 14.86 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 5 3 # 5 229 ASP B 26 ASP~? 1000.00 264 GLU B 33 GLU^? 1000.00 328 ASP B 29 ASP.? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 59.69 92.71 39.85 58.53 92.03 41.47 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 45.39 90.72 40.63 45.07 89.14 41.90 18.76 -16.66 13.02 17.62 -16.03 11.36 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 6 3 # 6 229 ASP B 47 ASP.? 1000.00 264 GLU B 68 GLU~? 1000.00 328 ASP B 79 ASP~? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 48.90 -24.15 -0.05 49.90 -25.19 1.49 coo 59.69 92.71 39.85 58.53 92.03 41.47 49.52 -17.32 19.57 50.21 -16.89 17.61 coo 45.39 90.72 40.63 45.07 89.14 41.90 53.02 -14.22 6.66 54.72 -15.42 7.04 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 6 hits 1cdg_c00 naa= 3 ULMN 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 1 3 # 1 A 232 HIS A 37 HIS.? 1000.00 A 262 GLU A 94 GLU~? 1000.00 A 358 GLU A 33 GLU^? 1000.00 coo 26.19 60.87 43.98 27.48 59.27 43.30 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 27.13 54.07 50.45 26.96 54.19 48.35 33.73 4.64 -5.66 31.71 5.23 -5.97 coo 27.06 50.43 44.36 27.99 52.27 44.74 33.95 8.51 -1.79 32.88 7.84 -3.49 ULMN 3 1chm_c00 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 2 3 # 2 A 232 HIS B 37 HIS.? 1000.00 A 262 GLU B 94 GLU~? 1000.00 A 358 GLU B 33 GLU^? 1000.00 coo 26.19 60.87 43.98 27.48 59.27 43.30 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 27.13 54.07 50.45 26.96 54.19 48.35 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 27.06 50.43 44.36 27.99 52.27 44.74 33.92 -18.51 17.58 34.21 -17.51 19.41 1chm_c00 source 1chm CREATINE AMIDINOHYDROLASE (E.C.3.5.3.3) : 2 hits 1chm_c00 naa= 3 ULMN 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 1 3 # 1 B 232 HIS A 37 HIS.? 1000.00 B 262 GLU A 94 GLU~? 1000.00 B 358 GLU A 33 GLU^? 1000.00 coo 44.98 77.01 48.39 44.42 78.67 47.18 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 41.60 83.57 54.16 42.46 83.24 52.25 33.73 4.64 -5.66 31.71 5.23 -5.97 coo 44.05 87.61 48.73 43.15 85.67 48.52 33.95 8.51 -1.79 32.88 7.84 -3.49 ULMN 3 1chm_c01 CREATINE AMIDINOHYDROLASE (E.C.3.5.3user 2 3 # 2 B 232 HIS B 37 HIS.? 1000.00 B 262 GLU B 94 GLU~? 1000.00 B 358 GLU B 33 GLU^? 1000.00 coo 44.98 77.01 48.39 44.42 78.67 47.18 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 41.60 83.57 54.16 42.46 83.24 52.25 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 44.05 87.61 48.73 43.15 85.67 48.52 33.92 -18.51 17.58 34.21 -17.51 19.41 1chm_c01 source 1chm CREATINE AMIDINOHYDROLASE (E.C.3.5.3.3) : 2 hits 1chm_c01 naa= 3 ULMN 3 1cns_c01 CHITINASE user 1 3 # 1 B 67 GLU A 94 GLU~? 1000.00 B 89 GLU A 68 GLU~? 1000.00 B 120 SER A 70 SER~? 1000.00 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 33.73 4.64 -5.66 31.71 5.23 -5.97 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 38.84 -6.45 -1.32 39.90 -4.51 -2.28 ULMN 3 1cns_c01 CHITINASE user 2 3 # 2 B 67 GLU B 94 GLU~? 1000.00 B 89 GLU B 68 GLU~? 1000.00 B 120 SER B 70 SER~? 1000.00 coo 9.89 -17.65 45.79 9.28 -17.39 43.77 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 19.53 -19.89 39.46 19.21 -18.09 38.37 49.52 -17.32 19.57 50.21 -16.89 17.61 coo 18.32 -11.51 42.26 16.65 -12.32 40.69 48.76 -24.45 18.03 46.63 -25.35 18.72 1cns_c01 source 1cns CHITINASE : 2 hits 1cns_c01 naa= 3 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 # 1 A 37 ASP A 29 ASP.? 1000.00 A 56 ILE A 32 ILE^? 1000.00 A 82 TYR A 24 TYR~? 1000.00 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 33.08 24.05 1.29 32.31 25.48 2.63 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 36.69 14.28 1.23 37.90 14.63 1.74 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 38.31 18.23 6.93 36.20 19.30 8.42 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 # 2 A 37 ASP A 29 ASP.? 1000.00 A 56 ILE A 62 ILE.? 1000.00 A 82 TYR A 24 TYR~? 1000.00 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 33.08 24.05 1.29 32.31 25.48 2.63 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 35.03 12.45 5.27 36.43 12.77 5.06 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 38.31 18.23 6.93 36.20 19.30 8.42 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 3 3 # 3 A 37 ASP A 56 ASP~? 1000.00 A 56 ILE A 32 ILE^? 1000.00 A 82 TYR A 24 TYR~? 1000.00 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 37.70 11.70 13.69 37.98 13.80 13.68 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 36.69 14.28 1.23 37.90 14.63 1.74 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 38.31 18.23 6.93 36.20 19.30 8.42 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 4 3 # 4 A 37 ASP B 29 ASP.? 1000.00 A 56 ILE B 32 ILE^? 1000.00 A 82 TYR B 24 TYR~? 1000.00 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 28.43 -20.79 13.89 28.05 -22.08 13.32 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 24.95 -21.91 8.04 24.30 -19.58 6.61 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 5 3 # 5 A 37 ASP B 29 ASP.? 1000.00 A 56 ILE B 62 ILE.? 1000.00 A 82 TYR B 24 TYR~? 1000.00 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 30.73 -19.34 10.22 30.27 -20.69 10.26 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 24.95 -21.91 8.04 24.30 -19.58 6.61 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 6 3 # 6 A 37 ASP B 56 ASP~? 1000.00 A 56 ILE B 32 ILE^? 1000.00 A 82 TYR B 24 TYR~? 1000.00 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 28.43 -20.79 13.89 28.05 -22.08 13.32 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 24.95 -21.91 8.04 24.30 -19.58 6.61 1d6o_c00 source 1d6o FK506-BINDING PROTEIN : 6 hits 1d6o_c00 naa= 3 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 1 3 # 1 B 37 ASP A 29 ASP.? 1000.00 B 56 ILE A 32 ILE^? 1000.00 B 82 TYR A 24 TYR~? 1000.00 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 33.08 24.05 1.29 32.31 25.48 2.63 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 36.69 14.28 1.23 37.90 14.63 1.74 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 38.31 18.23 6.93 36.20 19.30 8.42 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 # 2 B 37 ASP A 29 ASP.? 1000.00 B 56 ILE A 62 ILE.? 1000.00 B 82 TYR A 24 TYR~? 1000.00 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 33.08 24.05 1.29 32.31 25.48 2.63 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 35.03 12.45 5.27 36.43 12.77 5.06 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 38.31 18.23 6.93 36.20 19.30 8.42 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 3 3 # 3 B 37 ASP A 56 ASP~? 1000.00 B 56 ILE A 32 ILE^? 1000.00 B 82 TYR A 24 TYR~? 1000.00 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 37.70 11.70 13.69 37.98 13.80 13.68 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 36.69 14.28 1.23 37.90 14.63 1.74 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 38.31 18.23 6.93 36.20 19.30 8.42 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 4 3 # 4 B 37 ASP B 29 ASP.? 1000.00 B 56 ILE B 32 ILE^? 1000.00 B 82 TYR B 24 TYR~? 1000.00 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 28.43 -20.79 13.89 28.05 -22.08 13.32 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 24.95 -21.91 8.04 24.30 -19.58 6.61 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 5 3 # 5 B 37 ASP B 29 ASP.? 1000.00 B 56 ILE B 62 ILE.? 1000.00 B 82 TYR B 24 TYR~? 1000.00 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 30.73 -19.34 10.22 30.27 -20.69 10.26 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 24.95 -21.91 8.04 24.30 -19.58 6.61 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 6 3 # 6 B 37 ASP B 56 ASP~? 1000.00 B 56 ILE B 32 ILE^? 1000.00 B 82 TYR B 24 TYR~? 1000.00 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 28.43 -20.79 13.89 28.05 -22.08 13.32 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 24.95 -21.91 8.04 24.30 -19.58 6.61 1d6o_c01 source 1d6o FK506-BINDING PROTEIN : 6 hits 1d6o_c01 naa= 3 ULMN 3 1d7r_c02 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYuser 1 3 # 1 A 173 TYR B 105 TYR^? 1000.00 A 243 ASP A 79 ASP~? 1000.00 A 272 LYS A 46 LYS.? 1000.00 coo 2.03 68.31 21.46 0.66 68.36 23.90 31.74 -27.89 23.83 34.05 -29.43 23.52 coo 16.93 55.67 9.65 17.16 54.23 11.19 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 14.13 45.79 13.40 14.25 49.41 18.30 35.76 -2.84 14.03 29.74 -4.84 14.37 1d7r_c02 source 1d7r 2,2-DIALKYLGLYCINE DECARBOXYLASE (PYRUVATE) : 1 hits 1d7r_c02 naa= 3 ULMN 3 1daa_c00 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 A 145 LYS B 60 LYS~? 1000.00 A 177 GLU B 55 GLU~? 1000.00 A 201 LEU B 57 LEU~? 1000.00 coo 46.63 -7.12 50.78 48.41 -11.39 47.79 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 47.18 -4.46 40.10 47.54 -4.70 42.20 38.74 -18.72 2.21 39.87 -17.75 0.71 coo 49.45 -5.57 45.73 49.73 -6.78 47.47 32.59 -21.28 6.99 32.17 -23.39 7.22 1daa_c00 source 1daa D-AMINO ACID AMINOTRANSFERASE : 1 hits 1daa_c00 naa= 3 ULMN 3 1daa_c01 D-AMINO ACID AMINOTRANSFERASE user 1 3 # 1 B 145 LYS A 86 LYS^? 1000.00 B 177 GLU A 33 GLU^? 1000.00 B 201 LEU A 63 LEU^? 1000.00 coo 25.29 -4.12 49.41 22.68 -2.48 54.25 29.45 2.33 2.56 27.22 6.18 5.41 coo 27.00 6.35 51.01 26.30 4.53 50.18 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 23.74 1.68 49.50 22.87 -0.24 49.97 31.62 9.66 1.45 30.17 8.27 0.62 1daa_c01 source 1daa D-AMINO ACID AMINOTRANSFERASE : 1 hits 1daa_c01 naa= 3 ULMN 3 1ddj_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 78 HIS~? 1000.00 A 646 ASP A 79 ASP~? 1000.00 A 739 GLY A 84 GLY.? 1000.00 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 11.37 50.89 2.29 11.05 51.63 2.25 28.24 3.53 8.75 28.74 2.92 8.51 ULMN 3 1ddj_c12 PLASMINOGEN user 2 3 # 2 A 603 HIS A 78 HIS~? 1000.00 A 646 ASP A 79 ASP~? 1000.00 A 739 GLY B 84 GLY.? 1000.00 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 11.37 50.89 2.29 11.05 51.63 2.25 40.56 -13.02 8.08 41.12 -13.48 8.40 ULMN 3 1ddj_c12 PLASMINOGEN user 3 3 # 3 A 603 HIS B 78 HIS~? 1000.00 A 646 ASP B 79 ASP~? 1000.00 A 739 GLY B 84 GLY.? 1000.00 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 11.37 50.89 2.29 11.05 51.63 2.25 40.56 -13.02 8.08 41.12 -13.48 8.40 1ddj_c12 source 1ddj PLASMINOGEN : 3 hits 1ddj_c12 naa= 3 ULMN 3 1ddj_c13 PLASMINOGEN user 1 3 # 1 B 603 HIS A 78 HIS~? 1000.00 B 646 ASP A 79 ASP~? 1000.00 B 739 GLY A 84 GLY.? 1000.00 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 29.48 -7.00 4.25 30.06 -7.33 2.26 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 28.24 3.53 8.75 28.74 2.92 8.51 ULMN 3 1ddj_c13 PLASMINOGEN user 2 3 # 2 B 603 HIS B 78 HIS~? 1000.00 B 646 ASP B 79 ASP~? 1000.00 B 739 GLY B 84 GLY.? 1000.00 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 50.43 -14.84 12.90 50.32 -15.37 14.93 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 53.02 -14.22 6.66 54.72 -15.42 7.04 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 40.56 -13.02 8.08 41.12 -13.48 8.40 1ddj_c13 source 1ddj PLASMINOGEN : 2 hits 1ddj_c13 naa= 3 ULMN 3 1ddj_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 78 HIS~? 1000.00 C 646 ASP A 79 ASP~? 1000.00 C 739 GLY A 84 GLY.? 1000.00 coo 15.33 59.81 59.60 13.98 60.99 60.69 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 16.06 55.72 54.73 15.97 56.49 56.70 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 9.38 49.29 65.28 9.01 50.03 65.31 28.24 3.53 8.75 28.74 2.92 8.51 ULMN 3 1ddj_c14 PLASMINOGEN user 2 3 # 2 C 603 HIS A 78 HIS~? 1000.00 C 646 ASP A 79 ASP~? 1000.00 C 739 GLY B 84 GLY.? 1000.00 coo 15.33 59.81 59.60 13.98 60.99 60.69 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 16.06 55.72 54.73 15.97 56.49 56.70 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 9.38 49.29 65.28 9.01 50.03 65.31 40.56 -13.02 8.08 41.12 -13.48 8.40 1ddj_c14 source 1ddj PLASMINOGEN : 2 hits 1ddj_c14 naa= 3 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 123 HIS A 78 HIS~? 1000.00 A 200 ASP B 56 ASP~? 1000.00 A 229 LYS B 46 LYS.? 1000.00 coo 1.13 77.49 40.64 0.62 75.57 39.98 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 0.84 91.24 49.01 2.91 91.61 49.23 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 10.53 97.56 43.71 9.33 93.71 47.17 47.02 -20.54 2.38 49.97 -14.91 2.65 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 78 HIS~? 1000.00 B 200 ASP B 56 ASP~? 1000.00 B 229 LYS B 46 LYS.? 1000.00 coo 9.24 94.26 88.22 8.02 94.07 89.92 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 17.54 90.31 75.01 17.17 92.01 73.80 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 22.32 101.61 71.64 17.89 98.63 71.55 47.02 -20.54 2.38 49.97 -14.91 2.65 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 78 HIS~? 1000.00 C 200 ASP B 56 ASP~? 1000.00 C 229 LYS B 46 LYS.? 1000.00 coo 26.77 65.84 83.49 27.06 67.76 84.27 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 19.52 52.01 79.59 20.28 51.65 77.65 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 28.90 45.91 73.55 25.22 49.72 72.97 47.02 -20.54 2.38 49.97 -14.91 2.65 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 78 HIS~? 1000.00 D 200 ASP B 56 ASP~? 1000.00 D 229 LYS B 46 LYS.? 1000.00 coo -10.90 48.74 53.41 -12.98 48.90 53.67 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 4.60 52.95 52.50 5.57 51.29 53.40 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 10.05 41.79 49.80 7.94 44.71 53.76 47.02 -20.54 2.38 49.97 -14.91 2.65 1dfo_c15 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 1 hits 1dfo_c15 naa= 3 ULMN 3 1do8_c00 MALIC ENZYME user 1 3 # 1 A 112 TYR B 24 TYR~? 1000.00 A 183 LYS B 60 LYS~? 1000.00 A 278 ASP B 56 ASP~? 1000.00 coo 19.43 18.53 42.32 17.66 18.80 40.15 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 21.92 15.80 36.19 17.64 19.44 36.35 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 15.46 19.03 31.40 15.01 18.25 33.31 32.42 -21.29 1.64 30.34 -21.41 1.35 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 B 24 TYR~? 1000.00 B 183 LYS B 60 LYS~? 1000.00 B 278 ASP B 56 ASP~? 1000.00 coo 58.62 15.99 58.34 60.98 14.60 58.93 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 60.11 10.60 53.63 62.59 10.74 58.67 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 66.50 7.32 58.45 66.26 9.42 58.23 32.42 -21.29 1.64 30.34 -21.41 1.35 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 B 24 TYR~? 1000.00 C 183 LYS B 60 LYS~? 1000.00 C 278 ASP B 56 ASP~? 1000.00 coo 76.02 -16.57 8.89 78.24 -15.17 9.87 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 74.18 -11.17 13.22 79.08 -11.19 10.47 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 82.27 -7.93 13.54 81.93 -10.04 13.72 32.42 -21.29 1.64 30.34 -21.41 1.35 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 B 24 TYR~? 1000.00 D 183 LYS B 60 LYS~? 1000.00 D 278 ASP B 56 ASP~? 1000.00 coo 35.64 -19.32 -3.24 32.92 -19.55 -2.64 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 33.51 -16.63 3.10 30.11 -20.23 0.26 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 25.62 -19.94 2.86 26.44 -19.16 1.09 32.42 -21.29 1.64 30.34 -21.41 1.35 1do8_c03 source 1do8 MALIC ENZYME : 1 hits 1do8_c03 naa= 3 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 1 3 # 1 E 57 HIS A 78 HIS~? 1000.00 E 102 ASP A 79 ASP~? 1000.00 E 193 GLY A 66 GLY^? 1000.00 coo 11.39 26.86 25.95 9.85 26.64 27.36 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 10.90 32.83 25.96 10.83 30.68 25.98 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 4.57 20.60 30.29 4.74 21.36 30.66 35.16 0.03 1.24 34.60 0.21 0.65 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 2 3 # 2 E 57 HIS A 78 HIS~? 1000.00 E 102 ASP A 79 ASP~? 1000.00 E 193 GLY A 84 GLY.? 1000.00 coo 11.39 26.86 25.95 9.85 26.64 27.36 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 10.90 32.83 25.96 10.83 30.68 25.98 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 4.57 20.60 30.29 4.74 21.36 30.66 28.24 3.53 8.75 28.74 2.92 8.51 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 3 3 # 3 E 57 HIS B 78 HIS~? 1000.00 E 102 ASP B 79 ASP~? 1000.00 E 193 GLY B 66 GLY^? 1000.00 coo 11.39 26.86 25.95 9.85 26.64 27.36 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 10.90 32.83 25.96 10.83 30.68 25.98 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 4.57 20.60 30.29 4.74 21.36 30.66 42.82 -20.03 15.19 42.57 -19.59 15.86 ULMN 3 1ds2_c02 PROTEINASE B (SGPB user 4 3 # 4 E 57 HIS B 78 HIS~? 1000.00 E 102 ASP B 79 ASP~? 1000.00 E 193 GLY B 84 GLY.? 1000.00 coo 11.39 26.86 25.95 9.85 26.64 27.36 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 10.90 32.83 25.96 10.83 30.68 25.98 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 4.57 20.60 30.29 4.74 21.36 30.66 40.56 -13.02 8.08 41.12 -13.48 8.40 1ds2_c02 source 1ds2 PROTEINASE B (SGPB : 4 hits 1ds2_c02 naa= 3 ULMN 3 1e19_c00 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 1 3 # 1 A 131 LYS A 59 LYS~? 1000.00 A 215 LYS A 28 LYS.? 1000.00 A 277 LYS A 2 LYS^? 1000.00 coo 0.50 24.09 51.68 1.51 29.34 52.35 31.90 13.00 11.85 28.95 14.22 16.49 coo 13.06 30.79 51.73 11.40 35.76 53.48 37.25 24.93 2.50 34.30 30.45 3.54 coo 13.04 31.88 60.72 10.57 35.34 57.49 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1e19_c00 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 2 3 # 2 A 131 LYS A 86 LYS^? 1000.00 A 215 LYS A 42 LYS~? 1000.00 A 277 LYS A 8 LYS.? 1000.00 coo 0.50 24.09 51.68 1.51 29.34 52.35 29.45 2.33 2.56 27.22 6.18 5.41 coo 13.06 30.79 51.73 11.40 35.76 53.48 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 13.04 31.88 60.72 10.57 35.34 57.49 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1e19_c00 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 3 3 # 3 A 131 LYS A 86 LYS^? 1000.00 A 215 LYS A 98 LYS~? 1000.00 A 277 LYS A 2 LYS^? 1000.00 coo 0.50 24.09 51.68 1.51 29.34 52.35 29.45 2.33 2.56 27.22 6.18 5.41 coo 13.06 30.79 51.73 11.40 35.76 53.48 33.88 9.40 -9.57 30.19 10.21 -6.88 coo 13.04 31.88 60.72 10.57 35.34 57.49 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1e19_c00 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 4 3 # 4 A 131 LYS B 59 LYS~? 1000.00 A 215 LYS A 42 LYS~? 1000.00 A 277 LYS A 46 LYS.? 1000.00 coo 0.50 24.09 51.68 1.51 29.34 52.35 30.97 -15.57 3.92 34.16 -17.16 -0.27 coo 13.06 30.79 51.73 11.40 35.76 53.48 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 13.04 31.88 60.72 10.57 35.34 57.49 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 1e19_c00 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 5 3 # 5 A 131 LYS B 86 LYS^? 1000.00 A 215 LYS B 42 LYS~? 1000.00 A 277 LYS B 8 LYS.? 1000.00 coo 0.50 24.09 51.68 1.51 29.34 52.35 40.69 -14.41 14.48 36.91 -13.49 19.50 coo 13.06 30.79 51.73 11.40 35.76 53.48 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 13.04 31.88 60.72 10.57 35.34 57.49 41.30 -30.41 16.51 39.51 -34.44 19.49 ULMN 3 1e19_c00 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 6 3 # 6 A 131 LYS B 86 LYS^? 1000.00 A 215 LYS B 98 LYS~? 1000.00 A 277 LYS B 2 LYS^? 1000.00 coo 0.50 24.09 51.68 1.51 29.34 52.35 40.69 -14.41 14.48 36.91 -13.49 19.50 coo 13.06 30.79 51.73 11.40 35.76 53.48 32.73 -19.13 25.55 34.27 -15.53 22.56 coo 13.04 31.88 60.72 10.57 35.34 57.49 25.35 -19.21 20.13 23.65 -14.85 22.59 1e19_c00 source 1e19 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPHATE SYNTH: 6 hits 1e19_c00 naa= 3 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 1 3 # 1 B 131 LYS A 60 LYS~? 1000.00 B 215 LYS A 28 LYS.? 1000.00 B 277 LYS A 2 LYS^? 1000.00 coo 6.78 45.91 16.15 7.82 40.81 15.84 33.44 15.58 9.51 37.67 16.47 12.82 coo 17.88 38.77 19.81 16.38 34.23 17.24 37.25 24.93 2.50 34.30 30.45 3.54 coo 20.33 37.78 11.20 16.77 34.53 13.47 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 2 3 # 2 B 131 LYS A 86 LYS^? 1000.00 B 215 LYS A 42 LYS~? 1000.00 B 277 LYS A 8 LYS.? 1000.00 coo 6.78 45.91 16.15 7.82 40.81 15.84 29.45 2.33 2.56 27.22 6.18 5.41 coo 17.88 38.77 19.81 16.38 34.23 17.24 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 20.33 37.78 11.20 16.77 34.53 13.47 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 3 3 # 3 B 131 LYS A 86 LYS^? 1000.00 B 215 LYS A 98 LYS~? 1000.00 B 277 LYS A 2 LYS^? 1000.00 coo 6.78 45.91 16.15 7.82 40.81 15.84 29.45 2.33 2.56 27.22 6.18 5.41 coo 17.88 38.77 19.81 16.38 34.23 17.24 33.88 9.40 -9.57 30.19 10.21 -6.88 coo 20.33 37.78 11.20 16.77 34.53 13.47 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 4 3 # 4 B 131 LYS B 86 LYS^? 1000.00 B 215 LYS B 42 LYS~? 1000.00 B 277 LYS B 8 LYS.? 1000.00 coo 6.78 45.91 16.15 7.82 40.81 15.84 40.69 -14.41 14.48 36.91 -13.49 19.50 coo 17.88 38.77 19.81 16.38 34.23 17.24 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 20.33 37.78 11.20 16.77 34.53 13.47 41.30 -30.41 16.51 39.51 -34.44 19.49 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 5 3 # 5 B 131 LYS B 86 LYS^? 1000.00 B 215 LYS B 42 LYS~? 1000.00 B 277 LYS B 46 LYS.? 1000.00 coo 6.78 45.91 16.15 7.82 40.81 15.84 40.69 -14.41 14.48 36.91 -13.49 19.50 coo 17.88 38.77 19.81 16.38 34.23 17.24 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 20.33 37.78 11.20 16.77 34.53 13.47 47.02 -20.54 2.38 49.97 -14.91 2.65 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 6 3 # 6 B 131 LYS B 86 LYS^? 1000.00 B 215 LYS B 46 LYS.? 1000.00 B 277 LYS B 42 LYS~? 1000.00 coo 6.78 45.91 16.15 7.82 40.81 15.84 40.69 -14.41 14.48 36.91 -13.49 19.50 coo 17.88 38.77 19.81 16.38 34.23 17.24 47.02 -20.54 2.38 49.97 -14.91 2.65 coo 20.33 37.78 11.20 16.77 34.53 13.47 47.01 -26.65 9.40 48.95 -31.25 10.40 ULMN 3 1e19_c01 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPuser 7 3 # 7 B 131 LYS B 86 LYS^? 1000.00 B 215 LYS B 98 LYS~? 1000.00 B 277 LYS B 2 LYS^? 1000.00 coo 6.78 45.91 16.15 7.82 40.81 15.84 40.69 -14.41 14.48 36.91 -13.49 19.50 coo 17.88 38.77 19.81 16.38 34.23 17.24 32.73 -19.13 25.55 34.27 -15.53 22.56 coo 20.33 37.78 11.20 16.77 34.53 13.47 25.35 -19.21 20.13 23.65 -14.85 22.59 1e19_c01 source 1e19 CARBAMATE KINASE-LIKE CARBAMOYLPHOSPHATE SYNTH: 7 hits 1e19_c01 naa= 3 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 1 3 # 1 A 107 ALA A 30 ALA.? 1000.00 A 136 TYR A 24 TYR~? 1000.00 A 140 LYS A 28 LYS.? 1000.00 coo 55.90 7.49 23.83 56.71 8.23 22.76 35.80 20.08 0.42 37.16 19.53 0.84 coo 59.38 10.02 17.51 59.95 9.89 20.21 38.31 18.23 6.93 36.20 19.30 8.42 coo 59.52 3.69 18.67 62.31 6.19 22.58 37.25 24.93 2.50 34.30 30.45 3.54 ULMN 3 1e7q_c01 GDP-FUCOSE SYNTHETASE user 2 3 # 2 A 107 ALA B 30 ALA.? 1000.00 A 136 TYR B 24 TYR~? 1000.00 A 140 LYS B 28 LYS.? 1000.00 coo 55.90 7.49 23.83 56.71 8.23 22.76 22.46 -19.17 14.94 22.70 -20.67 14.99 coo 59.38 10.02 17.51 59.95 9.89 20.21 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 59.52 3.69 18.67 62.31 6.19 22.58 18.42 -20.77 11.45 12.91 -21.38 9.53 1e7q_c01 source 1e7q GDP-FUCOSE SYNTHETASE : 2 hits 1e7q_c01 naa= 3 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 1 3 # 1 A 32 ASP A 9 ASP~? 1000.00 A 35 SER A 39 SER~? 1000.00 A 218 ASP A 11 ASP~? 1000.00 coo 47.22 22.34 8.57 45.16 22.02 9.13 49.66 0.41 0.84 50.15 0.20 -1.21 coo 43.58 20.85 5.15 44.62 23.01 5.76 44.91 -4.59 1.85 47.19 -3.74 1.94 coo 44.05 16.99 12.67 44.05 18.89 11.74 52.21 -0.96 5.64 52.68 -0.78 3.58 ULMN 3 1eag_c04 PEPTIDE INHIBITOR user 2 3 # 2 A 32 ASP B 9 ASP~? 1000.00 A 35 SER B 39 SER~? 1000.00 A 218 ASP B 11 ASP~? 1000.00 coo 47.22 22.34 8.57 45.16 22.02 9.13 41.34 -34.74 14.44 41.31 -35.37 16.46 coo 43.58 20.85 5.15 44.62 23.01 5.76 46.85 -30.26 14.14 45.82 -32.43 13.84 coo 44.05 16.99 12.67 44.05 18.89 11.74 42.92 -37.03 9.64 45.02 -37.19 9.59 1eag_c04 source 1eag PEPTIDE INHIBITOR : 2 hits 1eag_c04 naa= 3 ULMN 3 1ecx_c02 AMINOTRANSFERASE user 1 3 # 1 A 99 HIS A 78 HIS~? 1000.00 A 177 ASP A 79 ASP~? 1000.00 A 203 LYS A 42 LYS~? 1000.00 coo 8.74 45.76 47.19 9.33 46.93 45.56 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 11.68 42.31 52.96 12.05 43.92 51.65 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 18.07 52.81 49.62 14.17 49.99 48.07 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1ecx_c02 AMINOTRANSFERASE user 2 3 # 2 A 99 HIS B 78 HIS~? 1000.00 A 177 ASP B 79 ASP~? 1000.00 A 203 LYS B 42 LYS~? 1000.00 coo 8.74 45.76 47.19 9.33 46.93 45.56 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 11.68 42.31 52.96 12.05 43.92 51.65 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 18.07 52.81 49.62 14.17 49.99 48.07 47.01 -26.65 9.40 48.95 -31.25 10.40 1ecx_c02 source 1ecx AMINOTRANSFERASE : 2 hits 1ecx_c02 naa= 3 ULMN 3 1ecx_c03 AMINOTRANSFERASE user 1 3 # 1 B 99 HIS A 78 HIS~? 1000.00 B 177 ASP A 79 ASP~? 1000.00 B 203 LYS A 42 LYS~? 1000.00 coo 14.87 88.04 21.51 13.64 87.90 19.81 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 15.87 92.46 27.37 14.46 91.76 25.94 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 3.60 91.42 23.52 8.20 89.55 22.63 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1ecx_c03 AMINOTRANSFERASE user 2 3 # 2 B 99 HIS B 78 HIS~? 1000.00 B 177 ASP B 79 ASP~? 1000.00 B 203 LYS B 42 LYS~? 1000.00 coo 14.87 88.04 21.51 13.64 87.90 19.81 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 15.87 92.46 27.37 14.46 91.76 25.94 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 3.60 91.42 23.52 8.20 89.55 22.63 47.01 -26.65 9.40 48.95 -31.25 10.40 1ecx_c03 source 1ecx AMINOTRANSFERASE : 2 hits 1ecx_c03 naa= 3 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 1 3 # 1 A 114 HIS A 78 HIS~? 1000.00 A 197 ASP A 79 ASP~? 1000.00 A 223 LYS A 42 LYS~? 1000.00 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 29.48 -7.00 4.25 30.06 -7.33 2.26 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1elq_c02 L-CYSTEINE/L-CYSTINE C-S LYASE user 2 3 # 2 A 114 HIS B 78 HIS~? 1000.00 A 197 ASP B 79 ASP~? 1000.00 A 223 LYS B 42 LYS~? 1000.00 coo -61.07 -8.57 -27.49 -61.31 -7.57 -25.66 50.43 -14.84 12.90 50.32 -15.37 14.93 coo -56.76 -14.14 -29.82 -57.30 -12.99 -28.11 53.02 -14.22 6.66 54.72 -15.42 7.04 coo -56.15 -13.54 -16.74 -58.44 -10.91 -21.86 47.01 -26.65 9.40 48.95 -31.25 10.40 1elq_c02 source 1elq L-CYSTEINE/L-CYSTINE C-S LYASE : 2 hits 1elq_c02 naa= 3 ULMN 3 1elq_c03 L-CYSTEINE/L-CYSTINE C-S LYASE user 1 3 # 1 B 114 HIS A 78 HIS~? 1000.00 B 197 ASP A 79 ASP~? 1000.00 B 223 LYS A 42 LYS~? 1000.00 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 29.48 -7.00 4.25 30.06 -7.33 2.26 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1elq_c03 L-CYSTEINE/L-CYSTINE C-S LYASE user 2 3 # 2 B 114 HIS B 78 HIS~? 1000.00 B 197 ASP B 79 ASP~? 1000.00 B 223 LYS B 42 LYS~? 1000.00 coo -32.28 6.89 -26.40 -32.14 5.42 -24.92 50.43 -14.84 12.90 50.32 -15.37 14.93 coo -36.60 12.85 -27.61 -36.03 11.43 -26.18 53.02 -14.22 6.66 54.72 -15.42 7.04 coo -37.05 10.01 -14.84 -34.42 8.53 -20.24 47.01 -26.65 9.40 48.95 -31.25 10.40 1elq_c03 source 1elq L-CYSTEINE/L-CYSTINE C-S LYASE : 2 hits 1elq_c03 naa= 3 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 1 3 # 1 A 229 ALA A 40 ALA~? 1000.00 A 257 ALA A 43 ALA~? 1000.00 A 328 ASP A 11 ASP~? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 43.87 -1.17 3.12 43.94 0.15 2.33 coo 43.22 26.73 5.37 41.81 27.09 5.79 41.57 -0.50 8.30 42.20 0.73 7.66 coo 38.17 34.10 6.67 37.72 32.06 6.84 52.21 -0.96 5.64 52.68 -0.78 3.58 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 2 3 # 2 A 229 ALA A 40 ALA~? 1000.00 A 257 ALA A 43 ALA~? 1000.00 A 328 ASP A 49 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 43.87 -1.17 3.12 43.94 0.15 2.33 coo 43.22 26.73 5.37 41.81 27.09 5.79 41.57 -0.50 8.30 42.20 0.73 7.66 coo 38.17 34.10 6.67 37.72 32.06 6.84 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 3 3 # 3 A 229 ALA A 43 ALA~? 1000.00 A 257 ALA A 40 ALA~? 1000.00 A 328 ASP A 11 ASP~? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 41.57 -0.50 8.30 42.20 0.73 7.66 coo 43.22 26.73 5.37 41.81 27.09 5.79 43.87 -1.17 3.12 43.94 0.15 2.33 coo 38.17 34.10 6.67 37.72 32.06 6.84 52.21 -0.96 5.64 52.68 -0.78 3.58 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 4 3 # 4 A 229 ALA B 40 ALA~? 1000.00 A 257 ALA B 43 ALA~? 1000.00 A 328 ASP B 11 ASP~? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 43.58 -28.94 12.69 42.22 -28.95 13.38 coo 43.22 26.73 5.37 41.81 27.09 5.79 43.67 -26.34 7.62 42.33 -26.82 8.16 coo 38.17 34.10 6.67 37.72 32.06 6.84 42.92 -37.03 9.64 45.02 -37.19 9.59 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 5 3 # 5 A 229 ALA B 40 ALA~? 1000.00 A 257 ALA B 43 ALA~? 1000.00 A 328 ASP B 49 ASP.? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 43.58 -28.94 12.69 42.22 -28.95 13.38 coo 43.22 26.73 5.37 41.81 27.09 5.79 43.67 -26.34 7.62 42.33 -26.82 8.16 coo 38.17 34.10 6.67 37.72 32.06 6.84 42.86 -29.77 0.45 44.61 -30.51 -0.48 ULMN 3 1eo7_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE user 6 3 # 6 A 229 ALA B 43 ALA~? 1000.00 A 257 ALA B 40 ALA~? 1000.00 A 328 ASP B 11 ASP~? 1000.00 coo 39.84 24.12 8.44 38.50 24.23 9.11 43.67 -26.34 7.62 42.33 -26.82 8.16 coo 43.22 26.73 5.37 41.81 27.09 5.79 43.58 -28.94 12.69 42.22 -28.95 13.38 coo 38.17 34.10 6.67 37.72 32.06 6.84 42.92 -37.03 9.64 45.02 -37.19 9.59 1eo7_c00 source 1eo7 CYCLODEXTRIN GLYCOSYLTRANSFERASE : 6 hits 1eo7_c00 naa= 3 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 1 3 # 1 A 159 LYS A 2 LYS^? 1000.00 A 193 GLU A 33 GLU^? 1000.00 A 217 VAL A 3 VAL^? 1000.00 coo 2.10 10.68 61.44 -2.14 13.16 60.61 35.00 17.20 -4.95 29.82 18.43 -6.05 coo -5.33 11.71 69.72 -4.62 11.92 67.73 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 0.07 12.29 66.53 -0.24 11.95 64.38 37.90 14.85 -4.19 39.70 15.76 -3.32 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 2 3 # 2 A 159 LYS A 2 LYS^? 1000.00 A 193 GLU A 33 GLU^? 1000.00 A 217 VAL A 4 VAL^? 1000.00 coo 2.10 10.68 61.44 -2.14 13.16 60.61 35.00 17.20 -4.95 29.82 18.43 -6.05 coo -5.33 11.71 69.72 -4.62 11.92 67.73 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 0.07 12.29 66.53 -0.24 11.95 64.38 37.94 11.07 -4.50 37.75 9.65 -6.16 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 3 3 # 3 A 159 LYS A 2 LYS^? 1000.00 A 193 GLU A 94 GLU~? 1000.00 A 217 VAL A 4 VAL^? 1000.00 coo 2.10 10.68 61.44 -2.14 13.16 60.61 35.00 17.20 -4.95 29.82 18.43 -6.05 coo -5.33 11.71 69.72 -4.62 11.92 67.73 33.73 4.64 -5.66 31.71 5.23 -5.97 coo 0.07 12.29 66.53 -0.24 11.95 64.38 37.94 11.07 -4.50 37.75 9.65 -6.16 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 4 3 # 4 A 159 LYS A 86 LYS^? 1000.00 A 193 GLU A 68 GLU~? 1000.00 A 217 VAL A 88 VAL^? 1000.00 coo 2.10 10.68 61.44 -2.14 13.16 60.61 29.45 2.33 2.56 27.22 6.18 5.41 coo -5.33 11.71 69.72 -4.62 11.92 67.73 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 0.07 12.29 66.53 -0.24 11.95 64.38 30.92 -0.52 -3.57 32.16 1.25 -3.91 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 5 3 # 5 A 159 LYS A 86 LYS^? 1000.00 A 193 GLU A 94 GLU~? 1000.00 A 217 VAL A 65 VAL^? 1000.00 coo 2.10 10.68 61.44 -2.14 13.16 60.61 29.45 2.33 2.56 27.22 6.18 5.41 coo -5.33 11.71 69.72 -4.62 11.92 67.73 33.73 4.64 -5.66 31.71 5.23 -5.97 coo 0.07 12.29 66.53 -0.24 11.95 64.38 33.90 3.61 1.17 32.92 4.01 -0.75 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 6 3 # 6 A 159 LYS A 86 LYS^? 1000.00 A 193 GLU A 94 GLU~? 1000.00 A 217 VAL A 88 VAL^? 1000.00 coo 2.10 10.68 61.44 -2.14 13.16 60.61 29.45 2.33 2.56 27.22 6.18 5.41 coo -5.33 11.71 69.72 -4.62 11.92 67.73 33.73 4.64 -5.66 31.71 5.23 -5.97 coo 0.07 12.29 66.53 -0.24 11.95 64.38 30.92 -0.52 -3.57 32.16 1.25 -3.91 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 7 3 # 7 A 159 LYS B 2 LYS^? 1000.00 A 193 GLU B 94 GLU~? 1000.00 A 217 VAL B 4 VAL^? 1000.00 coo 2.10 10.68 61.44 -2.14 13.16 60.61 25.35 -19.21 20.13 23.65 -14.85 22.59 coo -5.33 11.71 69.72 -4.62 11.92 67.73 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 0.07 12.29 66.53 -0.24 11.95 64.38 31.18 -22.68 19.84 32.44 -22.74 21.64 ULMN 3 1et0_c00 4-AMINO-4-DEOXYCHORISMATE LYASE user 8 3 # 8 A 159 LYS B 86 LYS^? 1000.00 A 193 GLU B 68 GLU~? 1000.00 A 217 VAL B 88 VAL^? 1000.00 coo 2.10 10.68 61.44 -2.14 13.16 60.61 40.69 -14.41 14.48 36.91 -13.49 19.50 coo -5.33 11.71 69.72 -4.62 11.92 67.73 49.52 -17.32 19.57 50.21 -16.89 17.61 coo 0.07 12.29 66.53 -0.24 11.95 64.38 43.26 -16.31 20.26 41.40 -17.45 20.28 1et0_c00 source 1et0 4-AMINO-4-DEOXYCHORISMATE LYASE : 8 hits 1et0_c00 naa= 3 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 1 3 # 1 A 105 HIS A 78 HIS~? 1000.00 C 62 LYS A 42 LYS~? 1000.00 F 35 ASP A 79 ASP~? 1000.00 coo 15.40 22.79 16.66 13.93 24.10 15.98 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 19.95 18.98 4.81 18.82 20.94 10.49 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 16.32 15.30 17.19 17.71 14.73 18.69 29.04 -9.02 10.71 27.15 -9.65 10.03 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 2 3 # 2 A 105 HIS B 78 HIS~? 1000.00 C 62 LYS A 42 LYS~? 1000.00 F 35 ASP B 79 ASP~? 1000.00 coo 15.40 22.79 16.66 13.93 24.10 15.98 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 19.95 18.98 4.81 18.82 20.94 10.49 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 16.32 15.30 17.19 17.71 14.73 18.69 53.02 -14.22 6.66 54.72 -15.42 7.04 ULMN 3 1f80_c03 ACYL CARRIER PROTEIN user 3 3 # 3 A 105 HIS B 78 HIS~? 1000.00 C 62 LYS B 42 LYS~? 1000.00 F 35 ASP B 79 ASP~? 1000.00 coo 15.40 22.79 16.66 13.93 24.10 15.98 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 19.95 18.98 4.81 18.82 20.94 10.49 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 16.32 15.30 17.19 17.71 14.73 18.69 53.02 -14.22 6.66 54.72 -15.42 7.04 1f80_c03 source 1f80 ACYL CARRIER PROTEIN : 3 hits 1f80_c03 naa= 3 ULMN 3 1f80_c04 ACYL CARRIER PROTEIN user 1 3 # 1 B 62 LYS A 42 LYS~? 1000.00 C 105 HIS A 78 HIS~? 1000.00 D 35 ASP A 79 ASP~? 1000.00 coo 38.76 28.25 7.87 36.33 26.41 13.58 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 34.93 19.72 17.37 34.72 18.17 15.98 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 41.01 23.02 20.83 40.65 24.26 22.55 29.04 -9.02 10.71 27.15 -9.65 10.03 ULMN 3 1f80_c04 ACYL CARRIER PROTEIN user 2 3 # 2 B 62 LYS A 42 LYS~? 1000.00 C 105 HIS B 78 HIS~? 1000.00 D 35 ASP B 79 ASP~? 1000.00 coo 38.76 28.25 7.87 36.33 26.41 13.58 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 34.93 19.72 17.37 34.72 18.17 15.98 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 41.01 23.02 20.83 40.65 24.26 22.55 53.02 -14.22 6.66 54.72 -15.42 7.04 ULMN 3 1f80_c04 ACYL CARRIER PROTEIN user 3 3 # 3 B 62 LYS B 42 LYS~? 1000.00 C 105 HIS B 78 HIS~? 1000.00 D 35 ASP B 79 ASP~? 1000.00 coo 38.76 28.25 7.87 36.33 26.41 13.58 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 34.93 19.72 17.37 34.72 18.17 15.98 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 41.01 23.02 20.83 40.65 24.26 22.55 53.02 -14.22 6.66 54.72 -15.42 7.04 1f80_c04 source 1f80 ACYL CARRIER PROTEIN : 3 hits 1f80_c04 naa= 3 ULMN 3 1f80_c05 ACYL CARRIER PROTEIN user 1 3 # 1 A 62 LYS A 42 LYS~? 1000.00 B 105 HIS A 78 HIS~? 1000.00 E 35 ASP A 79 ASP~? 1000.00 coo 20.51 39.76 8.83 21.23 37.38 14.18 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 27.18 37.56 20.68 29.07 38.28 20.13 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 19.97 40.39 22.03 18.53 39.30 23.18 29.04 -9.02 10.71 27.15 -9.65 10.03 ULMN 3 1f80_c05 ACYL CARRIER PROTEIN user 2 3 # 2 A 62 LYS B 42 LYS~? 1000.00 B 105 HIS B 78 HIS~? 1000.00 E 35 ASP B 79 ASP~? 1000.00 coo 20.51 39.76 8.83 21.23 37.38 14.18 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 27.18 37.56 20.68 29.07 38.28 20.13 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 19.97 40.39 22.03 18.53 39.30 23.18 53.02 -14.22 6.66 54.72 -15.42 7.04 1f80_c05 source 1f80 ACYL CARRIER PROTEIN : 2 hits 1f80_c05 naa= 3 ULMN 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 A 136 HIS A 78 HIS~? 1000.00 A 210 ASP A 79 ASP~? 1000.00 A 244 LYS A 42 LYS~? 1000.00 coo 11.28 44.53 18.60 9.91 46.00 19.20 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 10.51 37.86 19.71 9.07 39.38 20.04 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -1.20 42.34 17.67 3.19 45.13 19.06 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1fc4_c04 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 A 136 HIS B 78 HIS~? 1000.00 A 210 ASP B 79 ASP~? 1000.00 A 244 LYS B 42 LYS~? 1000.00 coo 11.28 44.53 18.60 9.91 46.00 19.20 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 10.51 37.86 19.71 9.07 39.38 20.04 53.02 -14.22 6.66 54.72 -15.42 7.04 coo -1.20 42.34 17.67 3.19 45.13 19.06 47.01 -26.65 9.40 48.95 -31.25 10.40 1fc4_c04 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c04 naa= 3 ULMN 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 1 3 # 1 B 136 HIS A 78 HIS~? 1000.00 B 210 ASP A 79 ASP~? 1000.00 B 244 LYS A 42 LYS~? 1000.00 coo 10.08 50.18 41.78 8.91 48.61 41.04 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 9.06 56.85 40.30 7.71 55.27 39.90 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -2.38 51.82 41.62 2.07 49.19 40.42 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1fc4_c05 2-AMINO-3-KETOBUTYRATE CONENZYME A Luser 2 3 # 2 B 136 HIS B 78 HIS~? 1000.00 B 210 ASP B 79 ASP~? 1000.00 B 244 LYS B 42 LYS~? 1000.00 coo 10.08 50.18 41.78 8.91 48.61 41.04 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 9.06 56.85 40.30 7.71 55.27 39.90 53.02 -14.22 6.66 54.72 -15.42 7.04 coo -2.38 51.82 41.62 2.07 49.19 40.42 47.01 -26.65 9.40 48.95 -31.25 10.40 1fc4_c05 source 1fc4 2-AMINO-3-KETOBUTYRATE CONENZYME A LIGASE : 2 hits 1fc4_c05 naa= 3 ULMN 3 1fdy_c01 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 137 TYR B 24 TYR~? 1000.00 B 142 LEU B 57 LEU~? 1000.00 B 165 LYS B 28 LYS.? 1000.00 coo 1.63 -78.98 -34.99 0.64 -76.54 -34.02 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -5.98 -74.54 -33.87 -5.92 -72.62 -32.92 32.59 -21.28 6.99 32.17 -23.39 7.22 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 18.42 -20.77 11.45 12.91 -21.38 9.53 1fdy_c01 source 1fdy N-ACETYLNEURAMINATE LYASE : 1 hits 1fdy_c01 naa= 3 ULMN 3 1fdy_c02 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 137 TYR B 24 TYR~? 1000.00 C 142 LEU B 57 LEU~? 1000.00 C 165 LYS B 28 LYS.? 1000.00 coo -19.42 -69.79 -47.15 -19.24 -72.58 -47.52 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -15.96 -76.69 -42.83 -16.62 -78.73 -42.99 32.59 -21.28 6.99 32.17 -23.39 7.22 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 18.42 -20.77 11.45 12.91 -21.38 9.53 1fdy_c02 source 1fdy N-ACETYLNEURAMINATE LYASE : 1 hits 1fdy_c02 naa= 3 ULMN 3 1fdy_c03 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 D 137 TYR B 24 TYR~? 1000.00 D 142 LEU B 57 LEU~? 1000.00 D 165 LYS B 28 LYS.? 1000.00 coo -19.43 -82.92 -7.62 -19.06 -85.28 -9.04 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -21.22 -86.47 -15.56 -20.39 -88.44 -15.62 32.59 -21.28 6.99 32.17 -23.39 7.22 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 18.42 -20.77 11.45 12.91 -21.38 9.53 1fdy_c03 source 1fdy N-ACETYLNEURAMINATE LYASE : 1 hits 1fdy_c03 naa= 3 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 A 47 SER A 52 SER~? 1000.00 A 48 THR A 50 THR~? 1000.00 A 165 LYS A 59 LYS~? 1000.00 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 38.79 6.40 16.02 40.97 6.72 17.08 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 42.63 3.53 13.14 43.65 3.28 11.23 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 31.90 13.00 11.85 28.95 14.22 16.49 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 A 47 SER A 90 SER~? 1000.00 A 48 THR A 89 THR.? 1000.00 A 165 LYS A 8 LYS.? 1000.00 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 31.21 -3.52 -5.87 29.84 -3.24 -7.53 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 A 47 SER A 90 SER~? 1000.00 A 48 THR A 89 THR.? 1000.00 A 165 LYS A 98 LYS~? 1000.00 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 31.21 -3.52 -5.87 29.84 -3.24 -7.53 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 33.88 9.40 -9.57 30.19 10.21 -6.88 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 A 47 SER B 52 SER~? 1000.00 A 48 THR B 50 THR~? 1000.00 A 165 LYS B 59 LYS~? 1000.00 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 37.53 -22.71 -0.30 38.30 -23.28 -2.54 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 39.90 -26.91 2.51 40.07 -28.04 4.36 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 30.97 -15.57 3.92 34.16 -17.16 -0.27 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 5 3 # 5 A 47 SER B 90 SER~? 1000.00 A 48 THR B 89 THR.? 1000.00 A 165 LYS B 8 LYS.? 1000.00 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 44.56 -20.57 23.40 44.28 -22.26 25.12 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 46.02 -17.12 22.73 45.78 -15.87 24.48 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 41.30 -30.41 16.51 39.51 -34.44 19.49 ULMN 3 1fdy_c04 N-ACETYLNEURAMINATE LYASE user 6 3 # 6 A 47 SER B 90 SER~? 1000.00 A 48 THR B 89 THR.? 1000.00 A 165 LYS B 98 LYS~? 1000.00 coo -39.09 -83.21 -19.79 -37.33 -83.94 -21.38 44.56 -20.57 23.40 44.28 -22.26 25.12 coo -41.85 -80.60 -20.11 -42.94 -79.78 -21.77 46.02 -17.12 22.73 45.78 -15.87 24.48 coo -39.97 -88.99 -30.53 -40.75 -85.40 -25.70 32.73 -19.13 25.55 34.27 -15.53 22.56 1fdy_c04 source 1fdy N-ACETYLNEURAMINATE LYASE : 6 hits 1fdy_c04 naa= 3 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 B 47 SER A 52 SER~? 1000.00 B 48 THR A 50 THR~? 1000.00 B 165 LYS A 59 LYS~? 1000.00 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 38.79 6.40 16.02 40.97 6.72 17.08 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 42.63 3.53 13.14 43.65 3.28 11.23 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 31.90 13.00 11.85 28.95 14.22 16.49 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 B 47 SER A 90 SER~? 1000.00 B 48 THR A 89 THR.? 1000.00 B 165 LYS A 8 LYS.? 1000.00 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 31.21 -3.52 -5.87 29.84 -3.24 -7.53 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 B 47 SER A 90 SER~? 1000.00 B 48 THR A 89 THR.? 1000.00 B 165 LYS A 98 LYS~? 1000.00 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 31.21 -3.52 -5.87 29.84 -3.24 -7.53 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 33.88 9.40 -9.57 30.19 10.21 -6.88 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 B 47 SER B 52 SER~? 1000.00 B 48 THR B 50 THR~? 1000.00 B 165 LYS B 59 LYS~? 1000.00 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 37.53 -22.71 -0.30 38.30 -23.28 -2.54 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 39.90 -26.91 2.51 40.07 -28.04 4.36 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 30.97 -15.57 3.92 34.16 -17.16 -0.27 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 5 3 # 5 B 47 SER B 90 SER~? 1000.00 B 48 THR B 89 THR.? 1000.00 B 165 LYS B 8 LYS.? 1000.00 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 44.56 -20.57 23.40 44.28 -22.26 25.12 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 46.02 -17.12 22.73 45.78 -15.87 24.48 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 41.30 -30.41 16.51 39.51 -34.44 19.49 ULMN 3 1fdy_c05 N-ACETYLNEURAMINATE LYASE user 6 3 # 6 B 47 SER B 90 SER~? 1000.00 B 48 THR B 89 THR.? 1000.00 B 165 LYS B 98 LYS~? 1000.00 coo 0.74 -71.26 -35.87 -0.36 -73.34 -35.30 44.56 -20.57 23.40 44.28 -22.26 25.12 coo 2.65 -68.72 -33.78 3.66 -68.93 -31.87 46.02 -17.12 22.73 45.78 -15.87 24.48 coo 4.26 -81.75 -30.55 3.40 -75.83 -32.08 32.73 -19.13 25.55 34.27 -15.53 22.56 1fdy_c05 source 1fdy N-ACETYLNEURAMINATE LYASE : 6 hits 1fdy_c05 naa= 3 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 C 47 SER A 52 SER~? 1000.00 C 48 THR A 50 THR~? 1000.00 C 165 LYS A 59 LYS~? 1000.00 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 38.79 6.40 16.02 40.97 6.72 17.08 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 42.63 3.53 13.14 43.65 3.28 11.23 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 31.90 13.00 11.85 28.95 14.22 16.49 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 C 47 SER A 90 SER~? 1000.00 C 48 THR A 89 THR.? 1000.00 C 165 LYS A 98 LYS~? 1000.00 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 31.21 -3.52 -5.87 29.84 -3.24 -7.53 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 33.88 9.40 -9.57 30.19 10.21 -6.88 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 C 47 SER B 52 SER~? 1000.00 C 48 THR B 50 THR~? 1000.00 C 165 LYS B 59 LYS~? 1000.00 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 37.53 -22.71 -0.30 38.30 -23.28 -2.54 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 39.90 -26.91 2.51 40.07 -28.04 4.36 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 30.97 -15.57 3.92 34.16 -17.16 -0.27 ULMN 3 1fdy_c06 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 C 47 SER B 90 SER~? 1000.00 C 48 THR B 89 THR.? 1000.00 C 165 LYS B 98 LYS~? 1000.00 coo -15.18 -75.37 -50.42 -16.12 -74.55 -48.34 44.56 -20.57 23.40 44.28 -22.26 25.12 coo -16.57 -77.65 -53.15 -18.61 -78.18 -53.63 46.02 -17.12 22.73 45.78 -15.87 24.48 coo -25.12 -68.79 -47.79 -21.06 -72.76 -50.30 32.73 -19.13 25.55 34.27 -15.53 22.56 1fdy_c06 source 1fdy N-ACETYLNEURAMINATE LYASE : 4 hits 1fdy_c06 naa= 3 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 1 3 # 1 D 47 SER A 52 SER~? 1000.00 D 48 THR A 50 THR~? 1000.00 D 165 LYS A 60 LYS~? 1000.00 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 38.79 6.40 16.02 40.97 6.72 17.08 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 42.63 3.53 13.14 43.65 3.28 11.23 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 2 3 # 2 D 47 SER A 90 SER~? 1000.00 D 48 THR A 89 THR.? 1000.00 D 165 LYS A 8 LYS.? 1000.00 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 31.21 -3.52 -5.87 29.84 -3.24 -7.53 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 3 3 # 3 D 47 SER A 90 SER~? 1000.00 D 48 THR A 89 THR.? 1000.00 D 165 LYS A 98 LYS~? 1000.00 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 31.21 -3.52 -5.87 29.84 -3.24 -7.53 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 33.88 9.40 -9.57 30.19 10.21 -6.88 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 4 3 # 4 D 47 SER B 52 SER~? 1000.00 D 48 THR B 50 THR~? 1000.00 D 165 LYS B 59 LYS~? 1000.00 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 37.53 -22.71 -0.30 38.30 -23.28 -2.54 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 39.90 -26.91 2.51 40.07 -28.04 4.36 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 30.97 -15.57 3.92 34.16 -17.16 -0.27 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 5 3 # 5 D 47 SER B 90 SER~? 1000.00 D 48 THR B 89 THR.? 1000.00 D 165 LYS B 8 LYS.? 1000.00 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 44.56 -20.57 23.40 44.28 -22.26 25.12 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 46.02 -17.12 22.73 45.78 -15.87 24.48 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 41.30 -30.41 16.51 39.51 -34.44 19.49 ULMN 3 1fdy_c07 N-ACETYLNEURAMINATE LYASE user 6 3 # 6 D 47 SER B 90 SER~? 1000.00 D 48 THR B 89 THR.? 1000.00 D 165 LYS B 98 LYS~? 1000.00 coo -21.69 -90.39 -8.89 -21.07 -88.29 -10.03 44.56 -20.57 23.40 44.28 -22.26 25.12 coo -19.38 -93.32 -7.98 -17.24 -93.31 -7.67 46.02 -17.12 22.73 45.78 -15.87 24.48 coo -14.17 -80.73 -6.25 -16.63 -86.38 -7.08 32.73 -19.13 25.55 34.27 -15.53 22.56 1fdy_c07 source 1fdy N-ACETYLNEURAMINATE LYASE : 6 hits 1fdy_c07 naa= 3 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 97 ARG~? 1000.00 A 136 GLU A 33 GLU^? 1000.00 A 246 GLU A 94 GLU~? 1000.00 coo 13.48 30.30 107.06 11.75 30.99 109.44 30.73 3.85 -12.02 31.57 1.08 -11.03 coo 9.46 32.37 115.82 8.50 34.20 115.47 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 11.99 34.33 109.92 10.08 34.19 110.77 33.73 4.64 -5.66 31.71 5.23 -5.97 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG B 97 ARG~? 1000.00 A 136 GLU B 33 GLU^? 1000.00 A 246 GLU B 94 GLU~? 1000.00 coo 13.48 30.30 107.06 11.75 30.99 109.44 37.89 -16.06 27.72 40.60 -17.32 27.02 coo 9.46 32.37 115.82 8.50 34.20 115.47 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 11.99 34.33 109.92 10.08 34.19 110.77 37.91 -18.85 21.91 37.52 -16.89 22.58 1fhl_c00 source 1fhl BETA-1,4-GALACTANASE : 2 hits 1fhl_c00 naa= 3 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 97 ARG~? 1000.00 A 136 GLU A 33 GLU^? 1000.00 A 246 GLU A 94 GLU~? 1000.00 coo 13.94 29.84 106.80 11.67 30.40 108.79 30.73 3.85 -12.02 31.57 1.08 -11.03 coo 9.52 31.97 115.23 8.45 33.74 114.72 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 11.92 33.82 109.35 10.10 33.50 110.39 33.73 4.64 -5.66 31.71 5.23 -5.97 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG B 97 ARG~? 1000.00 A 136 GLU B 33 GLU^? 1000.00 A 246 GLU B 94 GLU~? 1000.00 coo 13.94 29.84 106.80 11.67 30.40 108.79 37.89 -16.06 27.72 40.60 -17.32 27.02 coo 9.52 31.97 115.23 8.45 33.74 114.72 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 11.92 33.82 109.35 10.10 33.50 110.39 37.91 -18.85 21.91 37.52 -16.89 22.58 1fob_c00 source 1fob BETA-1,4-GALACTANASE : 2 hits 1fob_c00 naa= 3 ULMN 3 1fuq_c00 FUMARASE C user 1 3 # 1 A 324 LYS A 86 LYS^? 1000.00 A 331 GLU A 68 GLU~? 1000.00 B 188 HIS A 78 HIS~? 1000.00 coo 130.22 155.23 83.49 125.21 153.71 84.04 29.45 2.33 2.56 27.22 6.18 5.41 coo 120.90 152.23 75.28 120.94 153.09 77.19 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 122.04 152.80 81.06 120.71 154.37 81.46 29.48 -7.00 4.25 30.06 -7.33 2.26 ULMN 3 1fuq_c00 FUMARASE C user 2 3 # 2 A 324 LYS B 59 LYS~? 1000.00 A 331 GLU A 68 GLU~? 1000.00 B 188 HIS A 78 HIS~? 1000.00 coo 130.22 155.23 83.49 125.21 153.71 84.04 30.97 -15.57 3.92 34.16 -17.16 -0.27 coo 120.90 152.23 75.28 120.94 153.09 77.19 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 122.04 152.80 81.06 120.71 154.37 81.46 29.48 -7.00 4.25 30.06 -7.33 2.26 ULMN 3 1fuq_c00 FUMARASE C user 3 3 # 3 A 324 LYS B 60 LYS~? 1000.00 A 331 GLU A 68 GLU~? 1000.00 B 188 HIS A 78 HIS~? 1000.00 coo 130.22 155.23 83.49 125.21 153.71 84.04 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 120.90 152.23 75.28 120.94 153.09 77.19 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 122.04 152.80 81.06 120.71 154.37 81.46 29.48 -7.00 4.25 30.06 -7.33 2.26 1fuq_c00 source 1fuq FUMARASE C : 3 hits 1fuq_c00 naa= 3 ULMN 3 1ga8_c00 GALACTOSYL TRANSFERASE LGTC user 1 3 # 1 A 130 ASP A 79 ASP~? 1000.00 A 153 ASN B 61 ASN.? 1000.00 A 189 GLN A 80 GLN~? 1000.00 coo 27.45 53.97 73.24 26.29 54.34 71.54 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 29.93 52.22 70.56 29.34 51.93 68.54 27.99 -14.15 9.15 27.59 -12.59 7.76 coo 26.19 47.96 71.25 25.92 49.81 70.24 33.67 -9.44 10.69 35.17 -10.85 10.09 1ga8_c00 source 1ga8 GALACTOSYL TRANSFERASE LGTC : 1 hits 1ga8_c00 naa= 3 ULMN 3 1gns_c00 SUBTILISIN BPN' user 1 3 # 1 A 32 ASP B 79 ASP~? 1000.00 A 64 HIS B 78 HIS~? 1000.00 A 155 ASN B 75 ASN.? 1000.00 coo 3.12 38.70 24.20 3.24 38.59 26.33 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 1.90 38.00 29.77 3.91 38.35 29.95 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 9.89 36.55 37.38 9.27 37.99 36.08 57.03 -25.03 13.17 58.00 -25.84 14.88 1gns_c00 source 1gns SUBTILISIN BPN' : 1 hits 1gns_c00 naa= 3 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 A 189 PHE A 10 PHE~? 1000.00 A 298 ASP A 49 ASP.? 1000.00 A 329 LYS A 46 LYS.? 1000.00 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 46.85 -2.71 6.67 46.23 -2.84 9.40 coo 2.59 0.29 25.55 4.65 0.18 25.07 45.31 0.34 15.16 45.91 -1.47 16.07 coo 12.42 6.10 23.27 9.95 1.57 20.16 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 1gtx_c00 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 A 189 PHE B 10 PHE~? 1000.00 A 298 ASP B 49 ASP.? 1000.00 A 329 LYS B 46 LYS.? 1000.00 coo 6.56 -4.17 18.88 9.26 -4.62 19.48 45.29 -31.86 9.15 45.77 -31.04 6.51 coo 2.59 0.29 25.55 4.65 0.18 25.07 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo 12.42 6.10 23.27 9.95 1.57 20.16 47.02 -20.54 2.38 49.97 -14.91 2.65 1gtx_c00 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c00 naa= 3 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 B 189 PHE A 10 PHE~? 1000.00 B 298 ASP A 49 ASP.? 1000.00 B 329 LYS A 46 LYS.? 1000.00 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 46.85 -2.71 6.67 46.23 -2.84 9.40 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 45.31 0.34 15.16 45.91 -1.47 16.07 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 1gtx_c01 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 B 189 PHE B 10 PHE~? 1000.00 B 298 ASP B 49 ASP.? 1000.00 B 329 LYS B 46 LYS.? 1000.00 coo 20.14 -12.51 41.29 18.81 -10.14 40.57 45.29 -31.86 9.15 45.77 -31.04 6.51 coo 25.22 -15.42 34.53 24.48 -13.46 34.89 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo 27.68 -4.10 35.68 24.39 -7.59 39.32 47.02 -20.54 2.38 49.97 -14.91 2.65 1gtx_c01 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c01 naa= 3 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 C 189 PHE A 10 PHE~? 1000.00 C 298 ASP A 49 ASP.? 1000.00 C 329 LYS A 46 LYS.? 1000.00 coo 17.41 60.57 64.39 18.40 58.12 65.34 46.85 -2.71 6.67 46.23 -2.84 9.40 coo 24.10 66.43 63.33 24.18 64.30 63.40 45.31 0.34 15.16 45.91 -1.47 16.07 coo 27.64 56.61 58.17 22.18 57.92 60.36 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 1gtx_c02 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 C 189 PHE B 10 PHE~? 1000.00 C 298 ASP B 49 ASP.? 1000.00 C 329 LYS B 46 LYS.? 1000.00 coo 17.41 60.57 64.39 18.40 58.12 65.34 45.29 -31.86 9.15 45.77 -31.04 6.51 coo 24.10 66.43 63.33 24.18 64.30 63.40 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo 27.64 56.61 58.17 22.18 57.92 60.36 47.02 -20.54 2.38 49.97 -14.91 2.65 1gtx_c02 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c02 naa= 3 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 1 3 # 1 D 189 PHE A 10 PHE~? 1000.00 D 298 ASP A 49 ASP.? 1000.00 D 329 LYS A 46 LYS.? 1000.00 coo 35.44 53.35 83.81 35.65 54.53 81.28 46.85 -2.71 6.67 46.23 -2.84 9.40 coo 29.72 46.46 83.60 30.79 47.36 81.99 45.31 0.34 15.16 45.91 -1.47 16.07 coo 36.89 44.91 74.55 37.33 48.94 79.01 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 1gtx_c03 4-AMINOBUTYRATE AMINOTRANSFERASE user 2 3 # 2 D 189 PHE B 10 PHE~? 1000.00 D 298 ASP B 49 ASP.? 1000.00 D 329 LYS B 46 LYS.? 1000.00 coo 35.44 53.35 83.81 35.65 54.53 81.28 45.29 -31.86 9.15 45.77 -31.04 6.51 coo 29.72 46.46 83.60 30.79 47.36 81.99 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo 36.89 44.91 74.55 37.33 48.94 79.01 47.02 -20.54 2.38 49.97 -14.91 2.65 1gtx_c03 source 1gtx 4-AMINOBUTYRATE AMINOTRANSFERASE : 2 hits 1gtx_c03 naa= 3 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 1 3 # 1 A 50 ASP A 26 ASP~? 1000.00 A 327 GLU B 101 GLU~? 1000.00 A 339 ARG B 97 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 44.41 22.27 3.14 45.59 23.72 2.16 coo 75.11 41.01 160.30 76.65 40.06 161.41 31.45 -15.60 28.20 32.65 -14.70 26.72 coo 82.23 40.35 159.87 85.09 40.67 161.01 37.89 -16.06 27.72 40.60 -17.32 27.02 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 2 3 # 2 A 50 ASP A 29 ASP.? 1000.00 A 327 GLU B 94 GLU~? 1000.00 A 339 ARG B 97 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 33.08 24.05 1.29 32.31 25.48 2.63 coo 75.11 41.01 160.30 76.65 40.06 161.41 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 82.23 40.35 159.87 85.09 40.67 161.01 37.89 -16.06 27.72 40.60 -17.32 27.02 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 3 3 # 3 A 50 ASP A 29 ASP.? 1000.00 A 327 GLU B 101 GLU~? 1000.00 A 339 ARG B 97 ARG~? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 33.08 24.05 1.29 32.31 25.48 2.63 coo 75.11 41.01 160.30 76.65 40.06 161.41 31.45 -15.60 28.20 32.65 -14.70 26.72 coo 82.23 40.35 159.87 85.09 40.67 161.01 37.89 -16.06 27.72 40.60 -17.32 27.02 1hto_c00 source 1hto GLUTAMINE SYNTHETASE : 3 hits 1hto_c00 naa= 3 ULMN 3 1i29_c01 CSDB user 1 3 # 1 A 123 HIS A 78 HIS~? 1000.00 A 200 ASP A 79 ASP~? 1000.00 A 226 LYS A 42 LYS~? 1000.00 coo 23.24 46.58 4.39 24.43 46.59 2.66 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 24.51 43.28 11.18 25.17 44.50 9.58 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 34.47 51.09 7.19 28.58 51.18 7.53 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1i29_c01 CSDB user 2 3 # 2 A 123 HIS B 78 HIS~? 1000.00 A 200 ASP B 79 ASP~? 1000.00 A 226 LYS B 42 LYS~? 1000.00 coo 23.24 46.58 4.39 24.43 46.59 2.66 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 24.51 43.28 11.18 25.17 44.50 9.58 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 34.47 51.09 7.19 28.58 51.18 7.53 47.01 -26.65 9.40 48.95 -31.25 10.40 1i29_c01 source 1i29 CSDB : 2 hits 1i29_c01 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL A 20 VAL~? 1000.00 A 200 ASP A 56 ASP~? 1000.00 A 226 LYS A 46 LYS.? 1000.00 coo 19.13 38.05 1.41 19.72 38.80 -0.53 43.01 13.19 4.46 41.50 11.68 4.01 coo 24.51 43.28 11.18 25.17 44.50 9.58 37.70 11.70 13.69 37.98 13.80 13.68 coo 34.47 51.09 7.19 28.58 51.18 7.53 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 1i29_c03 CSDB user 2 3 # 2 A 128 VAL B 20 VAL~? 1000.00 A 200 ASP B 56 ASP~? 1000.00 A 226 LYS B 46 LYS.? 1000.00 coo 19.13 38.05 1.41 19.72 38.80 -0.53 29.38 -27.08 10.47 31.03 -25.71 10.91 coo 24.51 43.28 11.18 25.17 44.50 9.58 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 34.47 51.09 7.19 28.58 51.18 7.53 47.02 -20.54 2.38 49.97 -14.91 2.65 1i29_c03 source 1i29 CSDB : 2 hits 1i29_c03 naa= 3 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 A 2 GLU A 33 GLU^? 1000.00 A 56 LYS A 2 LYS^? 1000.00 A 258 ARG A 97 ARG~? 1000.00 coo 42.33 1.56 26.99 42.38 2.91 28.66 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 38.45 -0.44 19.89 37.36 0.90 25.90 35.00 17.20 -4.95 29.82 18.43 -6.05 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 30.73 3.85 -12.02 31.57 1.08 -11.03 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 A 2 GLU A 33 GLU^? 1000.00 A 56 LYS A 86 LYS^? 1000.00 A 258 ARG A 97 ARG~? 1000.00 coo 42.33 1.56 26.99 42.38 2.91 28.66 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 38.45 -0.44 19.89 37.36 0.90 25.90 29.45 2.33 2.56 27.22 6.18 5.41 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 30.73 3.85 -12.02 31.57 1.08 -11.03 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 A 2 GLU B 33 GLU^? 1000.00 A 56 LYS B 2 LYS^? 1000.00 A 258 ARG B 97 ARG~? 1000.00 coo 42.33 1.56 26.99 42.38 2.91 28.66 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 38.45 -0.44 19.89 37.36 0.90 25.90 25.35 -19.21 20.13 23.65 -14.85 22.59 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 37.89 -16.06 27.72 40.60 -17.32 27.02 ULMN 3 1k82_c00 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 A 2 GLU B 55 GLU~? 1000.00 A 56 LYS B 46 LYS.? 1000.00 A 258 ARG A 72 ARG~? 1000.00 coo 42.33 1.56 26.99 42.38 2.91 28.66 38.74 -18.72 2.21 39.87 -17.75 0.71 coo 38.45 -0.44 19.89 37.36 0.90 25.90 47.02 -20.54 2.38 49.97 -14.91 2.65 coo 36.54 -1.79 35.54 37.68 -1.44 32.69 33.22 -10.92 -2.70 30.57 -10.95 -4.25 1k82_c00 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 4 hits 1k82_c00 naa= 3 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 B 2 GLU A 33 GLU^? 1000.00 B 56 LYS A 2 LYS^? 1000.00 B 258 ARG A 97 ARG~? 1000.00 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 35.00 17.20 -4.95 29.82 18.43 -6.05 coo 2.64 1.83 34.81 1.56 1.13 32.02 30.73 3.85 -12.02 31.57 1.08 -11.03 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 B 2 GLU A 33 GLU^? 1000.00 B 56 LYS A 86 LYS^? 1000.00 B 258 ARG A 97 ARG~? 1000.00 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 29.45 2.33 2.56 27.22 6.18 5.41 coo 2.64 1.83 34.81 1.56 1.13 32.02 30.73 3.85 -12.02 31.57 1.08 -11.03 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 B 2 GLU B 33 GLU^? 1000.00 B 56 LYS B 2 LYS^? 1000.00 B 258 ARG B 97 ARG~? 1000.00 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 25.35 -19.21 20.13 23.65 -14.85 22.59 coo 2.64 1.83 34.81 1.56 1.13 32.02 37.89 -16.06 27.72 40.60 -17.32 27.02 ULMN 3 1k82_c01 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 B 2 GLU B 55 GLU~? 1000.00 B 56 LYS B 46 LYS.? 1000.00 B 258 ARG A 72 ARG~? 1000.00 coo -2.88 -2.27 26.18 -2.94 -3.40 27.96 38.74 -18.72 2.21 39.87 -17.75 0.71 coo 1.37 -0.44 19.19 2.21 -1.48 25.26 47.02 -20.54 2.38 49.97 -14.91 2.65 coo 2.64 1.83 34.81 1.56 1.13 32.02 33.22 -10.92 -2.70 30.57 -10.95 -4.25 1k82_c01 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 4 hits 1k82_c01 naa= 3 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 C 2 GLU A 33 GLU^? 1000.00 C 56 LYS A 2 LYS^? 1000.00 C 258 ARG A 97 ARG~? 1000.00 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 35.00 17.20 -4.95 29.82 18.43 -6.05 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 30.73 3.85 -12.02 31.57 1.08 -11.03 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 C 2 GLU A 33 GLU^? 1000.00 C 56 LYS A 86 LYS^? 1000.00 C 258 ARG A 97 ARG~? 1000.00 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 29.45 2.33 2.56 27.22 6.18 5.41 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 30.73 3.85 -12.02 31.57 1.08 -11.03 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 C 2 GLU B 33 GLU^? 1000.00 C 56 LYS B 2 LYS^? 1000.00 C 258 ARG B 97 ARG~? 1000.00 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 25.35 -19.21 20.13 23.65 -14.85 22.59 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 37.89 -16.06 27.72 40.60 -17.32 27.02 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 C 2 GLU B 55 GLU~? 1000.00 C 56 LYS B 46 LYS.? 1000.00 C 258 ARG A 72 ARG~? 1000.00 coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 38.74 -18.72 2.21 39.87 -17.75 0.71 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 47.02 -20.54 2.38 49.97 -14.91 2.65 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 33.22 -10.92 -2.70 30.57 -10.95 -4.25 1k82_c02 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 4 hits 1k82_c02 naa= 3 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 D 2 GLU A 33 GLU^? 1000.00 D 56 LYS A 2 LYS^? 1000.00 D 258 ARG A 97 ARG~? 1000.00 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 35.00 17.20 -4.95 29.82 18.43 -6.05 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 30.73 3.85 -12.02 31.57 1.08 -11.03 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 2 3 # 2 D 2 GLU A 33 GLU^? 1000.00 D 56 LYS A 86 LYS^? 1000.00 D 258 ARG A 97 ARG~? 1000.00 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 29.45 2.33 2.56 27.22 6.18 5.41 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 30.73 3.85 -12.02 31.57 1.08 -11.03 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 3 3 # 3 D 2 GLU B 33 GLU^? 1000.00 D 56 LYS B 2 LYS^? 1000.00 D 258 ARG B 97 ARG~? 1000.00 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 25.35 -19.21 20.13 23.65 -14.85 22.59 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 37.89 -16.06 27.72 40.60 -17.32 27.02 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 4 3 # 4 D 2 GLU B 55 GLU~? 1000.00 D 56 LYS B 46 LYS.? 1000.00 D 258 ARG A 72 ARG~? 1000.00 coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 38.74 -18.72 2.21 39.87 -17.75 0.71 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 47.02 -20.54 2.38 49.97 -14.91 2.65 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 33.22 -10.92 -2.70 30.57 -10.95 -4.25 1k82_c03 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 4 hits 1k82_c03 naa= 3 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 1 3 # 1 255 ASP A 56 ASP~? 1000.00 262 LYS A 60 LYS~? 1000.00 336 ARG A 18 ARG~? 1000.00 coo 61.88 50.78 12.96 63.84 50.60 13.71 37.70 11.70 13.69 37.98 13.80 13.68 coo 63.59 44.40 18.32 63.20 49.74 17.95 33.44 15.58 9.51 37.67 16.47 12.82 coo 72.60 57.42 15.86 71.61 56.68 18.70 49.70 13.43 10.16 51.14 10.76 9.79 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 2 3 # 2 255 ASP B 11 ASP~? 1000.00 262 LYS B 8 LYS.? 1000.00 336 ARG B 18 ARG~? 1000.00 coo 61.88 50.78 12.96 63.84 50.60 13.71 42.92 -37.03 9.64 45.02 -37.19 9.59 coo 63.59 44.40 18.32 63.20 49.74 17.95 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 72.60 57.42 15.86 71.61 56.68 18.70 29.83 -33.72 4.49 28.68 -33.26 1.68 ULMN 3 1lam_c00 LEUCINE AMINOPEPTIDASE user 3 3 # 3 255 ASP B 56 ASP~? 1000.00 262 LYS B 60 LYS~? 1000.00 336 ARG B 18 ARG~? 1000.00 coo 61.88 50.78 12.96 63.84 50.60 13.71 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 63.59 44.40 18.32 63.20 49.74 17.95 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 72.60 57.42 15.86 71.61 56.68 18.70 29.83 -33.72 4.49 28.68 -33.26 1.68 1lam_c00 source 1lam LEUCINE AMINOPEPTIDASE : 3 hits 1lam_c00 naa= 3 ULMN 3 1m21_c00 PEPTIDE AMIDASE user 1 3 # 1 A 123 LYS A 42 LYS~? 1000.00 A 202 SER A 70 SER~? 1000.00 A 226 SER A 73 SER~? 1000.00 coo 1.62 6.10 69.30 3.81 1.25 65.91 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 4.43 1.89 61.79 4.31 0.09 63.40 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 8.52 -0.27 63.61 6.46 -1.15 62.94 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1m21_c00 PEPTIDE AMIDASE user 2 3 # 2 A 123 LYS B 42 LYS~? 1000.00 A 202 SER B 70 SER~? 1000.00 A 226 SER B 73 SER~? 1000.00 coo 1.62 6.10 69.30 3.81 1.25 65.91 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 4.43 1.89 61.79 4.31 0.09 63.40 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 8.52 -0.27 63.61 6.46 -1.15 62.94 53.55 -25.74 18.00 51.29 -26.56 18.42 ULMN 3 1m21_c00 PEPTIDE AMIDASE user 3 3 # 3 A 123 LYS B 42 LYS~? 1000.00 A 202 SER B 73 SER~? 1000.00 A 226 SER B 70 SER~? 1000.00 coo 1.62 6.10 69.30 3.81 1.25 65.91 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 4.43 1.89 61.79 4.31 0.09 63.40 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 8.52 -0.27 63.61 6.46 -1.15 62.94 48.76 -24.45 18.03 46.63 -25.35 18.72 1m21_c00 source 1m21 PEPTIDE AMIDASE : 3 hits 1m21_c00 naa= 3 ULMN 3 1m21_c01 PEPTIDE AMIDASE user 1 3 # 1 B 123 LYS A 42 LYS~? 1000.00 B 202 SER A 70 SER~? 1000.00 B 226 SER A 73 SER~? 1000.00 coo 35.67 -0.01 18.11 33.47 4.84 14.73 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 32.81 4.27 10.70 32.87 6.07 12.31 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 28.77 6.36 12.44 30.83 7.25 11.75 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1m21_c01 PEPTIDE AMIDASE user 2 3 # 2 B 123 LYS B 42 LYS~? 1000.00 B 202 SER B 70 SER~? 1000.00 B 226 SER B 73 SER~? 1000.00 coo 35.67 -0.01 18.11 33.47 4.84 14.73 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 32.81 4.27 10.70 32.87 6.07 12.31 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 28.77 6.36 12.44 30.83 7.25 11.75 53.55 -25.74 18.00 51.29 -26.56 18.42 ULMN 3 1m21_c01 PEPTIDE AMIDASE user 3 3 # 3 B 123 LYS B 42 LYS~? 1000.00 B 202 SER B 73 SER~? 1000.00 B 226 SER B 70 SER~? 1000.00 coo 35.67 -0.01 18.11 33.47 4.84 14.73 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 32.81 4.27 10.70 32.87 6.07 12.31 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 28.77 6.36 12.44 30.83 7.25 11.75 48.76 -24.45 18.03 46.63 -25.35 18.72 1m21_c01 source 1m21 PEPTIDE AMIDASE : 3 hits 1m21_c01 naa= 3 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 26 ASP~? 1000.00 A 265 GLU A 33 GLU^? 1000.00 A 369 ASP A 29 ASP.? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 44.41 22.27 3.14 45.59 23.72 2.16 coo 17.36 23.57 72.04 18.68 21.92 71.98 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 12.19 31.08 87.29 11.13 32.66 86.38 33.08 24.05 1.29 32.31 25.48 2.63 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 29 ASP.? 1000.00 A 265 GLU A 33 GLU^? 1000.00 A 369 ASP A 26 ASP~? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 33.08 24.05 1.29 32.31 25.48 2.63 coo 17.36 23.57 72.04 18.68 21.92 71.98 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 12.19 31.08 87.29 11.13 32.66 86.38 44.41 22.27 3.14 45.59 23.72 2.16 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP A 47 ASP.? 1000.00 A 265 GLU B 68 GLU~? 1000.00 A 369 ASP A 49 ASP.? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 17.36 23.57 72.04 18.68 21.92 71.98 49.52 -17.32 19.57 50.21 -16.89 17.61 coo 12.19 31.08 87.29 11.13 32.66 86.38 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 4 3 # 4 A 241 ASP A 49 ASP.? 1000.00 A 265 GLU B 68 GLU~? 1000.00 A 369 ASP A 47 ASP.? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 45.31 0.34 15.16 45.91 -1.47 16.07 coo 17.36 23.57 72.04 18.68 21.92 71.98 49.52 -17.32 19.57 50.21 -16.89 17.61 coo 12.19 31.08 87.29 11.13 32.66 86.38 39.23 -5.09 16.44 39.94 -6.30 14.86 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 5 3 # 5 A 241 ASP B 26 ASP~? 1000.00 A 265 GLU B 33 GLU^? 1000.00 A 369 ASP B 29 ASP.? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 17.36 23.57 72.04 18.68 21.92 71.98 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 12.19 31.08 87.29 11.13 32.66 86.38 18.76 -16.66 13.02 17.62 -16.03 11.36 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 6 3 # 6 A 241 ASP B 29 ASP.? 1000.00 A 265 GLU B 33 GLU^? 1000.00 A 369 ASP B 26 ASP~? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 17.36 23.57 72.04 18.68 21.92 71.98 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 12.19 31.08 87.29 11.13 32.66 86.38 20.05 -27.91 11.23 18.50 -28.91 12.26 1m53_c05 source 1m53 ISOMALTULOSE SYNTHASE : 6 hits 1m53_c05 naa= 3 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 # 1 159 ARG A 72 ARG~? 1000.00 229 SER A 70 SER~? 1000.00 325 GLU A 68 GLU~? 1000.00 coo 2.54 15.84 18.57 3.24 17.85 16.30 33.22 -10.92 -2.70 30.57 -10.95 -4.25 coo 10.17 13.48 15.92 9.61 15.76 15.27 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 5.42 13.04 19.75 5.74 13.81 17.79 31.73 -6.96 -2.64 30.98 -7.61 -0.78 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 2 3 # 2 159 ARG A 72 ARG~? 1000.00 229 SER A 90 SER~? 1000.00 325 GLU A 68 GLU~? 1000.00 coo 2.54 15.84 18.57 3.24 17.85 16.30 33.22 -10.92 -2.70 30.57 -10.95 -4.25 coo 10.17 13.48 15.92 9.61 15.76 15.27 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo 5.42 13.04 19.75 5.74 13.81 17.79 31.73 -6.96 -2.64 30.98 -7.61 -0.78 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 3 3 # 3 159 ARG B 51 ARG~? 1000.00 229 SER A 73 SER~? 1000.00 325 GLU B 55 GLU~? 1000.00 coo 2.54 15.84 18.57 3.24 17.85 16.30 42.92 -20.45 0.43 44.35 -17.75 0.22 coo 10.17 13.48 15.92 9.61 15.76 15.27 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo 5.42 13.04 19.75 5.74 13.81 17.79 38.74 -18.72 2.21 39.87 -17.75 0.71 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 4 3 # 4 159 ARG B 72 ARG~? 1000.00 229 SER B 70 SER~? 1000.00 325 GLU B 68 GLU~? 1000.00 coo 2.54 15.84 18.57 3.24 17.85 16.30 53.69 -19.00 19.46 54.01 -16.13 20.50 coo 10.17 13.48 15.92 9.61 15.76 15.27 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 5.42 13.04 19.75 5.74 13.81 17.79 49.52 -17.32 19.57 50.21 -16.89 17.61 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 5 3 # 5 159 ARG B 72 ARG~? 1000.00 229 SER B 90 SER~? 1000.00 325 GLU B 68 GLU~? 1000.00 coo 2.54 15.84 18.57 3.24 17.85 16.30 53.69 -19.00 19.46 54.01 -16.13 20.50 coo 10.17 13.48 15.92 9.61 15.76 15.27 44.56 -20.57 23.40 44.28 -22.26 25.12 coo 5.42 13.04 19.75 5.74 13.81 17.79 49.52 -17.32 19.57 50.21 -16.89 17.61 1mbb_c00 source 1mbb URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMI: 5 hits 1mbb_c00 naa= 3 ULMN 3 1mdr_c01 MANDELATE RACEMASE (E.C.5.1.2.2) user 1 3 # 1 164 LYS A 8 LYS.? 1000.00 166 LYS A 12 LYS~? 1000.00 324 SER B 77 SER~? 1000.00 coo 25.93 8.11 25.51 26.40 7.80 19.66 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 27.27 1.43 25.09 29.18 5.25 22.89 50.37 3.30 4.84 54.03 3.09 -0.37 coo 46.32 14.55 19.93 45.95 12.72 21.27 53.69 -18.22 10.70 56.03 -18.39 10.07 ULMN 3 1mdr_c01 MANDELATE RACEMASE (E.C.5.1.2.2) user 2 3 # 2 164 LYS A 12 LYS~? 1000.00 166 LYS A 8 LYS.? 1000.00 324 SER B 77 SER~? 1000.00 coo 25.93 8.11 25.51 26.40 7.80 19.66 50.37 3.30 4.84 54.03 3.09 -0.37 coo 27.27 1.43 25.09 29.18 5.25 22.89 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 46.32 14.55 19.93 45.95 12.72 21.27 53.69 -18.22 10.70 56.03 -18.39 10.07 1mdr_c01 source 1mdr MANDELATE RACEMASE (E.C.5.1.2.2) : 2 hits 1mdr_c01 naa= 3 ULMN 3 1mla_c00 MALONYL-COENZYME A ACYL CARRIER PROTuser 1 3 # 1 92 SER A 39 SER~? 1000.00 201 HIS A 37 HIS.? 1000.00 250 GLN A 38 GLN~? 1000.00 coo 38.34 0.72 11.82 37.33 1.15 14.05 44.91 -4.59 1.85 47.19 -3.74 1.94 coo 37.34 -2.58 17.29 36.94 -1.26 15.79 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 35.50 -3.51 11.88 35.27 -1.49 11.17 44.60 -3.31 -3.72 46.52 -2.95 -4.59 ULMN 3 1mla_c00 MALONYL-COENZYME A ACYL CARRIER PROTuser 2 3 # 2 92 SER A 70 SER~? 1000.00 201 HIS A 37 HIS.? 1000.00 250 GLN A 38 GLN~? 1000.00 coo 38.34 0.72 11.82 37.33 1.15 14.05 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 37.34 -2.58 17.29 36.94 -1.26 15.79 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 35.50 -3.51 11.88 35.27 -1.49 11.17 44.60 -3.31 -3.72 46.52 -2.95 -4.59 ULMN 3 1mla_c00 MALONYL-COENZYME A ACYL CARRIER PROTuser 3 3 # 3 92 SER B 39 SER~? 1000.00 201 HIS B 37 HIS.? 1000.00 250 GLN B 38 GLN~? 1000.00 coo 38.34 0.72 11.82 37.33 1.15 14.05 46.85 -30.26 14.14 45.82 -32.43 13.84 coo 37.34 -2.58 17.29 36.94 -1.26 15.79 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 35.50 -3.51 11.88 35.27 -1.49 11.17 45.23 -30.31 19.55 44.55 -32.25 20.14 ULMN 3 1mla_c00 MALONYL-COENZYME A ACYL CARRIER PROTuser 4 3 # 4 92 SER B 70 SER~? 1000.00 201 HIS B 37 HIS.? 1000.00 250 GLN B 38 GLN~? 1000.00 coo 38.34 0.72 11.82 37.33 1.15 14.05 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 37.34 -2.58 17.29 36.94 -1.26 15.79 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 35.50 -3.51 11.88 35.27 -1.49 11.17 45.23 -30.31 19.55 44.55 -32.25 20.14 1mla_c00 source 1mla MALONYL-COENZYME A ACYL CARRIER PROTEIN TRANSA: 4 hits 1mla_c00 naa= 3 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 # 1 A 465 GLY A 91 GLY~? 1000.00 A 501 ASP A 56 ASP~? 1000.00 B 367 TYR B 24 TYR~? 1000.00 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 36.94 0.14 -5.31 36.92 -0.10 -6.12 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 37.70 11.70 13.69 37.98 13.80 13.68 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 24.95 -21.91 8.04 24.30 -19.58 6.61 1mro_c00 source 1mro METHYL-COENZYME M REDUCTASE : 1 hits 1mro_c00 naa= 3 ULMN 3 1mro_c01 METHYL-COENZYME M REDUCTASE user 1 3 # 1 D 465 GLY A 91 GLY~? 1000.00 D 501 ASP A 56 ASP~? 1000.00 E 367 TYR B 24 TYR~? 1000.00 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 36.94 0.14 -5.31 36.92 -0.10 -6.12 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 37.70 11.70 13.69 37.98 13.80 13.68 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 24.95 -21.91 8.04 24.30 -19.58 6.61 1mro_c01 source 1mro METHYL-COENZYME M REDUCTASE : 1 hits 1mro_c01 naa= 3 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 1 3 # 1 A 50 ASP A 26 ASP~? 1000.00 A 55 TYR A 24 TYR~? 1000.00 A 84 LYS A 28 LYS.? 1000.00 coo 11.09 42.89 24.44 11.32 42.06 22.49 44.41 22.27 3.14 45.59 23.72 2.16 coo 4.60 40.33 20.42 7.25 39.50 20.05 38.31 18.23 6.93 36.20 19.30 8.42 coo 9.71 44.83 15.47 10.13 41.43 19.93 37.25 24.93 2.50 34.30 30.45 3.54 ULMN 3 1mrq_c02 ALDO-KETO REDUCTASE FAMILY 1 MEMBER user 2 3 # 2 A 50 ASP B 26 ASP~? 1000.00 A 55 TYR B 24 TYR~? 1000.00 A 84 LYS B 28 LYS.? 1000.00 coo 11.09 42.89 24.44 11.32 42.06 22.49 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 4.60 40.33 20.42 7.25 39.50 20.05 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 9.71 44.83 15.47 10.13 41.43 19.93 18.42 -20.77 11.45 12.91 -21.38 9.53 1mrq_c02 source 1mrq ALDO-KETO REDUCTASE FAMILY 1 MEMBER C1 : 2 hits 1mrq_c02 naa= 3 ULMN 3 1mt5_c00 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 A 142 LYS A 42 LYS~? 1000.00 A 217 SER A 70 SER~? 1000.00 A 241 SER A 73 SER~? 1000.00 coo 12.59 -31.89 29.79 15.18 -27.54 26.08 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 19.52 -27.28 27.04 17.55 -25.93 26.56 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 18.91 -27.35 22.36 18.66 -25.43 23.90 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c00 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 A 142 LYS B 42 LYS~? 1000.00 A 217 SER B 70 SER~? 1000.00 A 241 SER B 73 SER~? 1000.00 coo 12.59 -31.89 29.79 15.18 -27.54 26.08 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 19.52 -27.28 27.04 17.55 -25.93 26.56 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 18.91 -27.35 22.36 18.66 -25.43 23.90 53.55 -25.74 18.00 51.29 -26.56 18.42 1mt5_c00 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 2 hits 1mt5_c00 naa= 3 ULMN 3 1mt5_c01 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 B 142 LYS A 42 LYS~? 1000.00 B 217 SER A 70 SER~? 1000.00 B 241 SER A 73 SER~? 1000.00 coo -7.04 -5.02 -4.87 -7.61 -4.05 1.23 41.51 -4.01 6.86 46.63 -6.91 6.39 coo -9.93 -0.90 2.43 -7.82 -1.91 3.00 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo -11.06 -4.56 5.15 -9.38 -2.84 5.46 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c01 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 B 142 LYS A 42 LYS~? 1000.00 B 217 SER A 73 SER~? 1000.00 B 241 SER A 70 SER~? 1000.00 coo -7.04 -5.02 -4.87 -7.61 -4.05 1.23 41.51 -4.01 6.86 46.63 -6.91 6.39 coo -9.93 -0.90 2.43 -7.82 -1.91 3.00 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo -11.06 -4.56 5.15 -9.38 -2.84 5.46 38.84 -6.45 -1.32 39.90 -4.51 -2.28 ULMN 3 1mt5_c01 FATTY-ACID AMIDE HYDROLASE user 3 3 # 3 B 142 LYS B 42 LYS~? 1000.00 B 217 SER B 70 SER~? 1000.00 B 241 SER B 73 SER~? 1000.00 coo -7.04 -5.02 -4.87 -7.61 -4.05 1.23 47.01 -26.65 9.40 48.95 -31.25 10.40 coo -9.93 -0.90 2.43 -7.82 -1.91 3.00 48.76 -24.45 18.03 46.63 -25.35 18.72 coo -11.06 -4.56 5.15 -9.38 -2.84 5.46 53.55 -25.74 18.00 51.29 -26.56 18.42 ULMN 3 1mt5_c01 FATTY-ACID AMIDE HYDROLASE user 4 3 # 4 B 142 LYS B 42 LYS~? 1000.00 B 217 SER B 73 SER~? 1000.00 B 241 SER B 70 SER~? 1000.00 coo -7.04 -5.02 -4.87 -7.61 -4.05 1.23 47.01 -26.65 9.40 48.95 -31.25 10.40 coo -9.93 -0.90 2.43 -7.82 -1.91 3.00 53.55 -25.74 18.00 51.29 -26.56 18.42 coo -11.06 -4.56 5.15 -9.38 -2.84 5.46 48.76 -24.45 18.03 46.63 -25.35 18.72 1mt5_c01 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 4 hits 1mt5_c01 naa= 3 ULMN 3 1mt5_c02 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 C 142 LYS A 42 LYS~? 1000.00 C 217 SER A 70 SER~? 1000.00 C 241 SER A 73 SER~? 1000.00 coo -12.07 2.83 63.52 -8.95 7.56 61.01 41.51 -4.01 6.86 46.63 -6.91 6.39 coo -11.64 10.12 58.62 -9.34 9.31 58.79 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo -9.31 12.91 61.58 -8.56 11.90 59.50 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c02 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 C 142 LYS B 42 LYS~? 1000.00 C 217 SER B 70 SER~? 1000.00 C 241 SER B 73 SER~? 1000.00 coo -12.07 2.83 63.52 -8.95 7.56 61.01 47.01 -26.65 9.40 48.95 -31.25 10.40 coo -11.64 10.12 58.62 -9.34 9.31 58.79 48.76 -24.45 18.03 46.63 -25.35 18.72 coo -9.31 12.91 61.58 -8.56 11.90 59.50 53.55 -25.74 18.00 51.29 -26.56 18.42 1mt5_c02 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 2 hits 1mt5_c02 naa= 3 ULMN 3 1mt5_c03 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 D 142 LYS A 42 LYS~? 1000.00 D 217 SER A 70 SER~? 1000.00 D 241 SER A 73 SER~? 1000.00 coo 32.93 17.78 71.88 30.89 13.50 67.83 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 34.38 11.17 66.10 32.18 12.14 65.65 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 31.34 7.96 67.74 31.44 9.08 65.62 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c03 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 D 142 LYS A 42 LYS~? 1000.00 D 217 SER A 73 SER~? 1000.00 D 241 SER A 70 SER~? 1000.00 coo 32.93 17.78 71.88 30.89 13.50 67.83 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 34.38 11.17 66.10 32.18 12.14 65.65 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo 31.34 7.96 67.74 31.44 9.08 65.62 38.84 -6.45 -1.32 39.90 -4.51 -2.28 ULMN 3 1mt5_c03 FATTY-ACID AMIDE HYDROLASE user 3 3 # 3 D 142 LYS B 42 LYS~? 1000.00 D 217 SER B 70 SER~? 1000.00 D 241 SER B 73 SER~? 1000.00 coo 32.93 17.78 71.88 30.89 13.50 67.83 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 34.38 11.17 66.10 32.18 12.14 65.65 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 31.34 7.96 67.74 31.44 9.08 65.62 53.55 -25.74 18.00 51.29 -26.56 18.42 ULMN 3 1mt5_c03 FATTY-ACID AMIDE HYDROLASE user 4 3 # 4 D 142 LYS B 42 LYS~? 1000.00 D 217 SER B 73 SER~? 1000.00 D 241 SER B 70 SER~? 1000.00 coo 32.93 17.78 71.88 30.89 13.50 67.83 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 34.38 11.17 66.10 32.18 12.14 65.65 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 31.34 7.96 67.74 31.44 9.08 65.62 48.76 -24.45 18.03 46.63 -25.35 18.72 1mt5_c03 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 4 hits 1mt5_c03 naa= 3 ULMN 3 1mt5_c04 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 E 142 LYS A 42 LYS~? 1000.00 E 217 SER A 70 SER~? 1000.00 E 241 SER A 73 SER~? 1000.00 coo 75.33 -22.06 34.43 71.44 -18.39 37.56 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 67.33 -19.20 36.79 68.69 -17.23 37.19 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 67.84 -18.40 41.49 67.44 -16.90 39.59 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c04 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 E 142 LYS B 42 LYS~? 1000.00 E 217 SER B 70 SER~? 1000.00 E 241 SER B 73 SER~? 1000.00 coo 75.33 -22.06 34.43 71.44 -18.39 37.56 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 67.33 -19.20 36.79 68.69 -17.23 37.19 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 67.84 -18.40 41.49 67.44 -16.90 39.59 53.55 -25.74 18.00 51.29 -26.56 18.42 1mt5_c04 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 2 hits 1mt5_c04 naa= 3 ULMN 3 1mt5_c05 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 F 142 LYS A 42 LYS~? 1000.00 F 217 SER A 70 SER~? 1000.00 F 241 SER A 73 SER~? 1000.00 coo 85.78 13.19 64.96 85.47 13.47 58.63 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 87.43 17.13 57.15 85.84 15.39 56.76 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 89.69 13.60 54.86 87.60 14.67 54.46 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c05 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 F 142 LYS A 42 LYS~? 1000.00 F 217 SER A 73 SER~? 1000.00 F 241 SER A 70 SER~? 1000.00 coo 85.78 13.19 64.96 85.47 13.47 58.63 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 87.43 17.13 57.15 85.84 15.39 56.76 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo 89.69 13.60 54.86 87.60 14.67 54.46 38.84 -6.45 -1.32 39.90 -4.51 -2.28 ULMN 3 1mt5_c05 FATTY-ACID AMIDE HYDROLASE user 3 3 # 3 F 142 LYS B 42 LYS~? 1000.00 F 217 SER B 70 SER~? 1000.00 F 241 SER B 73 SER~? 1000.00 coo 85.78 13.19 64.96 85.47 13.47 58.63 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 87.43 17.13 57.15 85.84 15.39 56.76 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 89.69 13.60 54.86 87.60 14.67 54.46 53.55 -25.74 18.00 51.29 -26.56 18.42 ULMN 3 1mt5_c05 FATTY-ACID AMIDE HYDROLASE user 4 3 # 4 F 142 LYS B 42 LYS~? 1000.00 F 217 SER B 73 SER~? 1000.00 F 241 SER B 70 SER~? 1000.00 coo 85.78 13.19 64.96 85.47 13.47 58.63 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 87.43 17.13 57.15 85.84 15.39 56.76 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 89.69 13.60 54.86 87.60 14.67 54.46 48.76 -24.45 18.03 46.63 -25.35 18.72 1mt5_c05 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 4 hits 1mt5_c05 naa= 3 ULMN 3 1mt5_c06 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 G 142 LYS A 42 LYS~? 1000.00 G 217 SER A 70 SER~? 1000.00 G 241 SER A 73 SER~? 1000.00 coo 89.44 13.59 -3.79 85.15 17.81 -2.15 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 86.84 21.07 -0.09 84.89 19.68 -0.05 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 83.77 22.72 -3.25 83.41 21.94 -0.96 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c06 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 G 142 LYS B 42 LYS~? 1000.00 G 217 SER B 70 SER~? 1000.00 G 241 SER B 73 SER~? 1000.00 coo 89.44 13.59 -3.79 85.15 17.81 -2.15 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 86.84 21.07 -0.09 84.89 19.68 -0.05 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 83.77 22.72 -3.25 83.41 21.94 -0.96 53.55 -25.74 18.00 51.29 -26.56 18.42 1mt5_c06 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 2 hits 1mt5_c06 naa= 3 ULMN 3 1mt5_c07 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 H 142 LYS A 42 LYS~? 1000.00 H 217 SER A 70 SER~? 1000.00 H 241 SER A 73 SER~? 1000.00 coo 42.27 12.37 -13.24 45.60 9.85 -8.67 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 42.97 6.75 -6.56 44.94 8.04 -6.19 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 46.96 4.33 -7.53 46.37 5.62 -5.61 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c07 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 H 142 LYS B 42 LYS~? 1000.00 H 217 SER B 70 SER~? 1000.00 H 241 SER B 73 SER~? 1000.00 coo 42.27 12.37 -13.24 45.60 9.85 -8.67 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 42.97 6.75 -6.56 44.94 8.04 -6.19 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 46.96 4.33 -7.53 46.37 5.62 -5.61 53.55 -25.74 18.00 51.29 -26.56 18.42 1mt5_c07 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 2 hits 1mt5_c07 naa= 3 ULMN 3 1mt5_c08 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 I 142 LYS A 42 LYS~? 1000.00 I 217 SER A 70 SER~? 1000.00 I 241 SER A 73 SER~? 1000.00 coo -5.05 91.11 27.04 -1.24 87.39 30.21 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 2.83 88.63 29.54 1.30 86.82 30.03 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 2.37 88.32 34.25 2.82 86.58 32.61 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c08 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 I 142 LYS B 42 LYS~? 1000.00 I 217 SER B 70 SER~? 1000.00 I 241 SER B 73 SER~? 1000.00 coo -5.05 91.11 27.04 -1.24 87.39 30.21 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 2.83 88.63 29.54 1.30 86.82 30.03 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 2.37 88.32 34.25 2.82 86.58 32.61 53.55 -25.74 18.00 51.29 -26.56 18.42 1mt5_c08 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 2 hits 1mt5_c08 naa= 3 ULMN 3 1mt5_c09 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 J 142 LYS A 42 LYS~? 1000.00 J 217 SER A 70 SER~? 1000.00 J 241 SER A 73 SER~? 1000.00 coo -16.11 59.78 61.53 -15.92 58.68 55.43 41.51 -4.01 6.86 46.63 -6.91 6.39 coo -17.65 54.92 54.17 -15.81 56.46 53.79 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo -19.92 58.10 51.57 -17.75 57.08 51.34 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c09 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 J 142 LYS A 42 LYS~? 1000.00 J 217 SER A 73 SER~? 1000.00 J 241 SER A 70 SER~? 1000.00 coo -16.11 59.78 61.53 -15.92 58.68 55.43 41.51 -4.01 6.86 46.63 -6.91 6.39 coo -17.65 54.92 54.17 -15.81 56.46 53.79 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo -19.92 58.10 51.57 -17.75 57.08 51.34 38.84 -6.45 -1.32 39.90 -4.51 -2.28 ULMN 3 1mt5_c09 FATTY-ACID AMIDE HYDROLASE user 3 3 # 3 J 142 LYS B 42 LYS~? 1000.00 J 217 SER B 70 SER~? 1000.00 J 241 SER B 73 SER~? 1000.00 coo -16.11 59.78 61.53 -15.92 58.68 55.43 47.01 -26.65 9.40 48.95 -31.25 10.40 coo -17.65 54.92 54.17 -15.81 56.46 53.79 48.76 -24.45 18.03 46.63 -25.35 18.72 coo -19.92 58.10 51.57 -17.75 57.08 51.34 53.55 -25.74 18.00 51.29 -26.56 18.42 ULMN 3 1mt5_c09 FATTY-ACID AMIDE HYDROLASE user 4 3 # 4 J 142 LYS B 42 LYS~? 1000.00 J 217 SER B 73 SER~? 1000.00 J 241 SER B 70 SER~? 1000.00 coo -16.11 59.78 61.53 -15.92 58.68 55.43 47.01 -26.65 9.40 48.95 -31.25 10.40 coo -17.65 54.92 54.17 -15.81 56.46 53.79 53.55 -25.74 18.00 51.29 -26.56 18.42 coo -19.92 58.10 51.57 -17.75 57.08 51.34 48.76 -24.45 18.03 46.63 -25.35 18.72 1mt5_c09 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 4 hits 1mt5_c09 naa= 3 ULMN 3 1mt5_c10 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 K 142 LYS A 42 LYS~? 1000.00 K 217 SER A 70 SER~? 1000.00 K 241 SER A 73 SER~? 1000.00 coo -19.03 51.36 -6.94 -15.20 46.99 -4.75 41.51 -4.01 6.86 46.63 -6.91 6.39 coo -16.83 44.30 -2.14 -14.73 45.44 -2.29 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo -13.82 42.19 -5.17 -13.38 43.30 -3.07 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c10 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 K 142 LYS B 42 LYS~? 1000.00 K 217 SER B 70 SER~? 1000.00 K 241 SER B 73 SER~? 1000.00 coo -19.03 51.36 -6.94 -15.20 46.99 -4.75 47.01 -26.65 9.40 48.95 -31.25 10.40 coo -16.83 44.30 -2.14 -14.73 45.44 -2.29 48.76 -24.45 18.03 46.63 -25.35 18.72 coo -13.82 42.19 -5.17 -13.38 43.30 -3.07 53.55 -25.74 18.00 51.29 -26.56 18.42 1mt5_c10 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 2 hits 1mt5_c10 naa= 3 ULMN 3 1mt5_c11 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 L 142 LYS A 42 LYS~? 1000.00 L 217 SER A 70 SER~? 1000.00 L 241 SER A 73 SER~? 1000.00 coo 28.16 48.07 -15.34 25.35 51.49 -11.15 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 28.02 54.76 -9.49 26.01 53.53 -9.27 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 24.20 57.36 -11.16 24.62 56.31 -9.00 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c11 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 L 142 LYS A 42 LYS~? 1000.00 L 217 SER A 73 SER~? 1000.00 L 241 SER A 70 SER~? 1000.00 coo 28.16 48.07 -15.34 25.35 51.49 -11.15 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 28.02 54.76 -9.49 26.01 53.53 -9.27 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo 24.20 57.36 -11.16 24.62 56.31 -9.00 38.84 -6.45 -1.32 39.90 -4.51 -2.28 ULMN 3 1mt5_c11 FATTY-ACID AMIDE HYDROLASE user 3 3 # 3 L 142 LYS B 42 LYS~? 1000.00 L 217 SER B 70 SER~? 1000.00 L 241 SER B 73 SER~? 1000.00 coo 28.16 48.07 -15.34 25.35 51.49 -11.15 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 28.02 54.76 -9.49 26.01 53.53 -9.27 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 24.20 57.36 -11.16 24.62 56.31 -9.00 53.55 -25.74 18.00 51.29 -26.56 18.42 ULMN 3 1mt5_c11 FATTY-ACID AMIDE HYDROLASE user 4 3 # 4 L 142 LYS B 42 LYS~? 1000.00 L 217 SER B 73 SER~? 1000.00 L 241 SER B 70 SER~? 1000.00 coo 28.16 48.07 -15.34 25.35 51.49 -11.15 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 28.02 54.76 -9.49 26.01 53.53 -9.27 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 24.20 57.36 -11.16 24.62 56.31 -9.00 48.76 -24.45 18.03 46.63 -25.35 18.72 1mt5_c11 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 4 hits 1mt5_c11 naa= 3 ULMN 3 1mt5_c12 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 M 142 LYS A 42 LYS~? 1000.00 M 217 SER A 70 SER~? 1000.00 M 241 SER A 73 SER~? 1000.00 coo 57.83 99.61 24.25 54.90 95.14 20.60 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 51.07 94.66 21.52 53.18 93.49 22.20 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 51.67 94.23 16.93 51.60 92.47 18.57 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c12 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 M 142 LYS B 42 LYS~? 1000.00 M 217 SER B 70 SER~? 1000.00 M 241 SER B 73 SER~? 1000.00 coo 57.83 99.61 24.25 54.90 95.14 20.60 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 51.07 94.66 21.52 53.18 93.49 22.20 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 51.67 94.23 16.93 51.60 92.47 18.57 53.55 -25.74 18.00 51.29 -26.56 18.42 1mt5_c12 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 2 hits 1mt5_c12 naa= 3 ULMN 3 1mt5_c13 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 N 142 LYS A 42 LYS~? 1000.00 N 217 SER A 70 SER~? 1000.00 N 241 SER A 73 SER~? 1000.00 coo 79.06 71.19 -8.17 79.37 70.55 -1.89 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 81.67 67.31 -0.58 79.53 68.28 0.00 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 82.47 71.15 2.07 80.82 69.44 2.28 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c13 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 N 142 LYS A 42 LYS~? 1000.00 N 217 SER A 73 SER~? 1000.00 N 241 SER A 70 SER~? 1000.00 coo 79.06 71.19 -8.17 79.37 70.55 -1.89 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 81.67 67.31 -0.58 79.53 68.28 0.00 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo 82.47 71.15 2.07 80.82 69.44 2.28 38.84 -6.45 -1.32 39.90 -4.51 -2.28 ULMN 3 1mt5_c13 FATTY-ACID AMIDE HYDROLASE user 3 3 # 3 N 142 LYS B 42 LYS~? 1000.00 N 217 SER B 70 SER~? 1000.00 N 241 SER B 73 SER~? 1000.00 coo 79.06 71.19 -8.17 79.37 70.55 -1.89 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 81.67 67.31 -0.58 79.53 68.28 0.00 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 82.47 71.15 2.07 80.82 69.44 2.28 53.55 -25.74 18.00 51.29 -26.56 18.42 ULMN 3 1mt5_c13 FATTY-ACID AMIDE HYDROLASE user 4 3 # 4 N 142 LYS B 42 LYS~? 1000.00 N 217 SER B 73 SER~? 1000.00 N 241 SER B 70 SER~? 1000.00 coo 79.06 71.19 -8.17 79.37 70.55 -1.89 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 81.67 67.31 -0.58 79.53 68.28 0.00 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 82.47 71.15 2.07 80.82 69.44 2.28 48.76 -24.45 18.03 46.63 -25.35 18.72 1mt5_c13 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 4 hits 1mt5_c13 naa= 3 ULMN 3 1mt5_c14 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 O 142 LYS A 42 LYS~? 1000.00 O 217 SER A 70 SER~? 1000.00 O 241 SER A 73 SER~? 1000.00 coo 81.67 70.12 58.71 78.82 64.87 57.22 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 81.62 62.23 55.05 79.32 62.93 55.20 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 79.39 59.54 58.42 78.72 60.00 56.11 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c14 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 O 142 LYS B 42 LYS~? 1000.00 O 217 SER B 70 SER~? 1000.00 O 241 SER B 73 SER~? 1000.00 coo 81.67 70.12 58.71 78.82 64.87 57.22 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 81.62 62.23 55.05 79.32 62.93 55.20 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 79.39 59.54 58.42 78.72 60.00 56.11 53.55 -25.74 18.00 51.29 -26.56 18.42 1mt5_c14 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 2 hits 1mt5_c14 naa= 3 ULMN 3 1mt5_c15 FATTY-ACID AMIDE HYDROLASE user 1 3 # 1 P 142 LYS A 42 LYS~? 1000.00 P 217 SER A 70 SER~? 1000.00 P 241 SER A 73 SER~? 1000.00 coo 37.29 55.72 69.54 38.73 59.85 65.07 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 35.55 61.40 62.96 37.72 60.41 62.66 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 38.60 64.77 64.10 38.63 63.28 62.26 39.74 -11.42 -0.85 40.75 -9.32 -1.57 ULMN 3 1mt5_c15 FATTY-ACID AMIDE HYDROLASE user 2 3 # 2 P 142 LYS A 42 LYS~? 1000.00 P 217 SER A 73 SER~? 1000.00 P 241 SER A 70 SER~? 1000.00 coo 37.29 55.72 69.54 38.73 59.85 65.07 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 35.55 61.40 62.96 37.72 60.41 62.66 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo 38.60 64.77 64.10 38.63 63.28 62.26 38.84 -6.45 -1.32 39.90 -4.51 -2.28 ULMN 3 1mt5_c15 FATTY-ACID AMIDE HYDROLASE user 3 3 # 3 P 142 LYS B 42 LYS~? 1000.00 P 217 SER B 70 SER~? 1000.00 P 241 SER B 73 SER~? 1000.00 coo 37.29 55.72 69.54 38.73 59.85 65.07 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 35.55 61.40 62.96 37.72 60.41 62.66 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 38.60 64.77 64.10 38.63 63.28 62.26 53.55 -25.74 18.00 51.29 -26.56 18.42 ULMN 3 1mt5_c15 FATTY-ACID AMIDE HYDROLASE user 4 3 # 4 P 142 LYS B 42 LYS~? 1000.00 P 217 SER B 73 SER~? 1000.00 P 241 SER B 70 SER~? 1000.00 coo 37.29 55.72 69.54 38.73 59.85 65.07 47.01 -26.65 9.40 48.95 -31.25 10.40 coo 35.55 61.40 62.96 37.72 60.41 62.66 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 38.60 64.77 64.10 38.63 63.28 62.26 48.76 -24.45 18.03 46.63 -25.35 18.72 1mt5_c15 source 1mt5 FATTY-ACID AMIDE HYDROLASE : 4 hits 1mt5_c15 naa= 3 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 A 114 HIS A 78 HIS~? 1000.00 A 197 ASP A 79 ASP~? 1000.00 A 223 ALA A 43 ALA~? 1000.00 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 29.48 -7.00 4.25 30.06 -7.33 2.26 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 41.57 -0.50 8.30 42.20 0.73 7.66 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 A 114 HIS B 78 HIS~? 1000.00 A 197 ASP B 79 ASP~? 1000.00 A 223 ALA B 43 ALA~? 1000.00 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 50.43 -14.84 12.90 50.32 -15.37 14.93 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 53.02 -14.22 6.66 54.72 -15.42 7.04 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 43.67 -26.34 7.62 42.33 -26.82 8.16 1n2t_c02 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 2 hits 1n2t_c02 naa= 3 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 B 114 HIS A 78 HIS~? 1000.00 B 197 ASP A 79 ASP~? 1000.00 B 223 ALA A 43 ALA~? 1000.00 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 29.48 -7.00 4.25 30.06 -7.33 2.26 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 41.57 -0.50 8.30 42.20 0.73 7.66 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 B 114 HIS B 78 HIS~? 1000.00 B 197 ASP B 79 ASP~? 1000.00 B 223 ALA B 43 ALA~? 1000.00 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 50.43 -14.84 12.90 50.32 -15.37 14.93 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 53.02 -14.22 6.66 54.72 -15.42 7.04 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 43.67 -26.34 7.62 42.33 -26.82 8.16 1n2t_c03 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 2 hits 1n2t_c03 naa= 3 ULMN 3 1nsf_c00 N-ETHYLMALEIMIDE SENSITIVE FACTOR user 1 3 # 1 549 LYS B 46 LYS.? 1000.00 631 LYS A 12 LYS~? 1000.00 708 LYS B 42 LYS~? 1000.00 coo 8.61 33.06 11.15 10.12 29.19 8.82 47.02 -20.54 2.38 49.97 -14.91 2.65 coo -11.99 27.40 17.14 -13.60 24.52 11.71 50.37 3.30 4.84 54.03 3.09 -0.37 coo 18.16 32.86 9.85 16.06 28.20 13.56 47.01 -26.65 9.40 48.95 -31.25 10.40 1nsf_c00 source 1nsf N-ETHYLMALEIMIDE SENSITIVE FACTOR : 1 hits 1nsf_c00 naa= 3 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 51 ARG~? 1000.00 A 101 ASP A 47 ASP.? 1000.00 A 132 ASP A 49 ASP.? 1000.00 coo 11.61 22.83 17.30 14.06 21.71 15.78 36.08 1.17 15.71 33.32 0.07 16.46 coo 11.37 24.94 11.48 12.48 24.45 13.28 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 16.14 18.17 13.37 15.92 19.81 14.71 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 1nu3_c00 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG B 51 ARG~? 1000.00 A 101 ASP B 47 ASP.? 1000.00 A 132 ASP B 49 ASP.? 1000.00 coo 11.61 22.83 17.30 14.06 21.71 15.78 42.92 -20.45 0.43 44.35 -17.75 0.22 coo 11.37 24.94 11.48 12.48 24.45 13.28 48.90 -24.15 -0.05 49.90 -25.19 1.49 coo 16.14 18.17 13.37 15.92 19.81 14.71 42.86 -29.77 0.45 44.61 -30.51 -0.48 1nu3_c00 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nu3_c00 naa= 3 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 51 ARG~? 1000.00 B 101 ASP A 47 ASP.? 1000.00 B 132 ASP A 49 ASP.? 1000.00 coo 11.61 3.43 18.38 9.11 4.29 16.86 36.08 1.17 15.71 33.32 0.07 16.46 coo 11.74 0.51 12.98 10.75 1.32 14.67 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 6.93 7.52 14.08 7.18 6.08 15.65 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 1nu3_c01 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG B 51 ARG~? 1000.00 B 101 ASP B 47 ASP.? 1000.00 B 132 ASP B 49 ASP.? 1000.00 coo 11.61 3.43 18.38 9.11 4.29 16.86 42.92 -20.45 0.43 44.35 -17.75 0.22 coo 11.74 0.51 12.98 10.75 1.32 14.67 48.90 -24.15 -0.05 49.90 -25.19 1.49 coo 6.93 7.52 14.08 7.18 6.08 15.65 42.86 -29.77 0.45 44.61 -30.51 -0.48 1nu3_c01 source 1nu3 LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nu3_c01 naa= 3 ULMN 3 1nw9_c02 CASPASE 9, APOPTOSIS-RELATED CYSTEINuser 1 3 # 1 B 237 HIS A 37 HIS.? 1000.00 B 238 GLY A 91 GLY~? 1000.00 B 287 CYH A 67 CYH^? 1000.00 coo 51.19 11.65 88.44 53.07 12.52 88.13 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 45.40 11.66 89.13 45.79 11.98 88.49 36.94 0.14 -5.31 36.92 -0.10 -6.12 coo 48.33 16.15 90.44 50.61 16.80 91.98 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1nw9_c02 CASPASE 9, APOPTOSIS-RELATED CYSTEINuser 2 3 # 2 B 237 HIS B 37 HIS.? 1000.00 B 238 GLY B 91 GLY~? 1000.00 B 287 CYH B 67 CYH^? 1000.00 coo 51.19 11.65 88.44 53.07 12.52 88.13 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 45.40 11.66 89.13 45.79 11.98 88.49 41.89 -22.47 21.50 42.09 -22.54 22.29 coo 48.33 16.15 90.44 50.61 16.80 91.98 44.74 -21.15 18.29 45.66 -22.86 20.37 1nw9_c02 source 1nw9 CASPASE 9, APOPTOSIS-RELATED CYSTEINE PROTEASE: 2 hits 1nw9_c02 naa= 3 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 A 99 ARG A 51 ARG~? 1000.00 A 101 ASP A 47 ASP.? 1000.00 A 132 ASP A 49 ASP.? 1000.00 coo 11.50 22.77 17.24 14.00 21.62 15.86 36.08 1.17 15.71 33.32 0.07 16.46 coo 11.19 25.00 11.76 12.16 24.45 13.59 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 16.04 18.11 13.43 15.88 19.70 14.83 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 1nww_c02 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 A 99 ARG B 51 ARG~? 1000.00 A 101 ASP B 47 ASP.? 1000.00 A 132 ASP B 49 ASP.? 1000.00 coo 11.50 22.77 17.24 14.00 21.62 15.86 42.92 -20.45 0.43 44.35 -17.75 0.22 coo 11.19 25.00 11.76 12.16 24.45 13.59 48.90 -24.15 -0.05 49.90 -25.19 1.49 coo 16.04 18.11 13.43 15.88 19.70 14.83 42.86 -29.77 0.45 44.61 -30.51 -0.48 1nww_c02 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nww_c02 naa= 3 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 1 3 # 1 B 99 ARG A 51 ARG~? 1000.00 B 101 ASP A 47 ASP.? 1000.00 B 132 ASP A 49 ASP.? 1000.00 coo 11.48 3.09 18.25 9.01 4.07 16.77 36.08 1.17 15.71 33.32 0.07 16.46 coo 11.83 0.33 13.01 10.88 1.04 14.81 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 6.85 7.33 14.07 7.10 5.88 15.60 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 1nww_c03 LIMONENE-1,2-EPOXIDE HYDROLASE user 2 3 # 2 B 99 ARG B 51 ARG~? 1000.00 B 101 ASP B 47 ASP.? 1000.00 B 132 ASP B 49 ASP.? 1000.00 coo 11.48 3.09 18.25 9.01 4.07 16.77 42.92 -20.45 0.43 44.35 -17.75 0.22 coo 11.83 0.33 13.01 10.88 1.04 14.81 48.90 -24.15 -0.05 49.90 -25.19 1.49 coo 6.85 7.33 14.07 7.10 5.88 15.60 42.86 -29.77 0.45 44.61 -30.51 -0.48 1nww_c03 source 1nww LIMONENE-1,2-EPOXIDE HYDROLASE : 2 hits 1nww_c03 naa= 3 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 # 1 A 62 SER A 48 SER.? 1000.00 A 154 ASP A 56 ASP~? 1000.00 A 261 ARG A 51 ARG~? 1000.00 coo 16.10 74.10 3.11 17.18 73.52 5.20 41.08 -1.55 13.65 41.52 0.08 11.91 coo 16.07 84.71 8.14 15.20 82.81 8.14 37.70 11.70 13.69 37.98 13.80 13.68 coo 10.59 77.85 4.81 13.09 76.36 5.76 36.08 1.17 15.71 33.32 0.07 16.46 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 2 3 # 2 A 62 SER A 73 SER~? 1000.00 A 154 ASP B 56 ASP~? 1000.00 A 261 ARG A 72 ARG~? 1000.00 coo 16.10 74.10 3.11 17.18 73.52 5.20 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo 16.07 84.71 8.14 15.20 82.81 8.14 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 10.59 77.85 4.81 13.09 76.36 5.76 33.22 -10.92 -2.70 30.57 -10.95 -4.25 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 3 3 # 3 A 62 SER B 48 SER.? 1000.00 A 154 ASP B 56 ASP~? 1000.00 A 261 ARG B 51 ARG~? 1000.00 coo 16.10 74.10 3.11 17.18 73.52 5.20 44.98 -25.82 2.30 43.33 -26.34 3.99 coo 16.07 84.71 8.14 15.20 82.81 8.14 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 10.59 77.85 4.81 13.09 76.36 5.76 42.92 -20.45 0.43 44.35 -17.75 0.22 1o98_c00 source 1o98 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT PHOSPHOGLY: 3 hits 1o98_c00 naa= 3 ULMN 3 1ofd_c02 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 1 3 # 1 A 1 CYH A 67 CYH^? 1000.00 A 903 GLU B 68 GLU~? 1000.00 A 972 LYS B 42 LYS~? 1000.00 coo 88.42 112.53 24.94 87.72 110.88 27.11 35.78 -2.24 -1.76 37.21 -3.54 -3.81 coo 61.58 117.15 13.99 62.31 115.51 15.12 49.52 -17.32 19.57 50.21 -16.89 17.61 coo 60.18 107.64 21.53 58.13 110.55 17.14 47.01 -26.65 9.40 48.95 -31.25 10.40 ULMN 3 1ofd_c02 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 2 3 # 2 A 1 CYH A 67 CYH^? 1000.00 A 903 GLU B 94 GLU~? 1000.00 A 972 LYS B 2 LYS^? 1000.00 coo 88.42 112.53 24.94 87.72 110.88 27.11 35.78 -2.24 -1.76 37.21 -3.54 -3.81 coo 61.58 117.15 13.99 62.31 115.51 15.12 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 60.18 107.64 21.53 58.13 110.55 17.14 25.35 -19.21 20.13 23.65 -14.85 22.59 1ofd_c02 source 1ofd FERREDOXIN-DEPENDENT GLUTAMATE SYNTHASE 2 : 2 hits 1ofd_c02 naa= 3 ULMN 3 1ofd_c03 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 1 3 # 1 B 1 CYH A 67 CYH^? 1000.00 B 903 GLU B 68 GLU~? 1000.00 B 972 LYS B 42 LYS~? 1000.00 coo 31.47 38.87 24.90 30.94 36.98 26.93 35.78 -2.24 -1.76 37.21 -3.54 -3.81 coo 4.13 40.53 14.21 5.06 38.89 15.19 49.52 -17.32 19.57 50.21 -16.89 17.61 coo 4.08 30.40 21.12 1.62 33.28 16.83 47.01 -26.65 9.40 48.95 -31.25 10.40 ULMN 3 1ofd_c03 FERREDOXIN-DEPENDENT GLUTAMATE SYNTHuser 2 3 # 2 B 1 CYH A 67 CYH^? 1000.00 B 903 GLU B 94 GLU~? 1000.00 B 972 LYS B 2 LYS^? 1000.00 coo 31.47 38.87 24.90 30.94 36.98 26.93 35.78 -2.24 -1.76 37.21 -3.54 -3.81 coo 4.13 40.53 14.21 5.06 38.89 15.19 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 4.08 30.40 21.12 1.62 33.28 16.83 25.35 -19.21 20.13 23.65 -14.85 22.59 1ofd_c03 source 1ofd FERREDOXIN-DEPENDENT GLUTAMATE SYNTHASE 2 : 2 hits 1ofd_c03 naa= 3 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 A 175 LYS A 98 LYS~? 1000.00 A 208 GLN A 6 GLN^? 1000.00 A 209 LYS A 8 LYS.? 1000.00 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 33.88 9.40 -9.57 30.19 10.21 -6.88 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 43.42 4.45 -4.29 44.63 4.11 -6.01 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 2 3 # 2 A 175 LYS B 59 LYS~? 1000.00 A 208 GLN A 74 GLN~? 1000.00 A 209 LYS A 42 LYS~? 1000.00 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 30.97 -15.57 3.92 34.16 -17.16 -0.27 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 41.83 -8.17 2.52 43.84 -8.77 2.84 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 3 3 # 3 A 175 LYS B 59 LYS~? 1000.00 A 208 GLN A 80 GLN~? 1000.00 A 209 LYS A 46 LYS.? 1000.00 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 30.97 -15.57 3.92 34.16 -17.16 -0.27 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 33.67 -9.44 10.69 35.17 -10.85 10.09 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 4 3 # 4 A 175 LYS B 60 LYS~? 1000.00 A 208 GLN A 80 GLN~? 1000.00 A 209 LYS A 46 LYS.? 1000.00 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 33.67 -9.44 10.69 35.17 -10.85 10.09 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 1ohh_c06 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 5 3 # 5 A 175 LYS B 98 LYS~? 1000.00 A 208 GLN B 6 GLN^? 1000.00 A 209 LYS B 8 LYS.? 1000.00 coo 98.39 14.31 -19.34 101.13 12.36 -14.91 32.73 -19.13 25.55 34.27 -15.53 22.56 coo 107.44 7.66 -20.60 106.37 8.45 -22.25 37.40 -28.66 19.69 37.54 -29.92 21.40 coo 109.03 2.06 -20.49 104.00 -1.36 -18.88 41.30 -30.41 16.51 39.51 -34.44 19.49 1ohh_c06 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 5 hits 1ohh_c06 naa= 3 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 B 175 LYS A 98 LYS~? 1000.00 B 208 GLN A 6 GLN^? 1000.00 B 209 LYS A 8 LYS.? 1000.00 coo 105.03 46.01 19.55 106.59 42.35 15.55 33.88 9.40 -9.57 30.19 10.21 -6.88 coo 113.93 46.99 13.56 113.37 48.52 14.95 43.42 4.45 -4.29 44.63 4.11 -6.01 coo 115.66 49.12 8.60 111.19 49.52 4.73 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 2 3 # 2 B 175 LYS B 59 LYS~? 1000.00 B 208 GLN A 80 GLN~? 1000.00 B 209 LYS A 46 LYS.? 1000.00 coo 105.03 46.01 19.55 106.59 42.35 15.55 30.97 -15.57 3.92 34.16 -17.16 -0.27 coo 113.93 46.99 13.56 113.37 48.52 14.95 33.67 -9.44 10.69 35.17 -10.85 10.09 coo 115.66 49.12 8.60 111.19 49.52 4.73 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 1ohh_c07 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 3 3 # 3 B 175 LYS B 98 LYS~? 1000.00 B 208 GLN B 6 GLN^? 1000.00 B 209 LYS B 8 LYS.? 1000.00 coo 105.03 46.01 19.55 106.59 42.35 15.55 32.73 -19.13 25.55 34.27 -15.53 22.56 coo 113.93 46.99 13.56 113.37 48.52 14.95 37.40 -28.66 19.69 37.54 -29.92 21.40 coo 115.66 49.12 8.60 111.19 49.52 4.73 41.30 -30.41 16.51 39.51 -34.44 19.49 1ohh_c07 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 3 hits 1ohh_c07 naa= 3 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 1 3 # 1 C 175 LYS A 98 LYS~? 1000.00 C 208 GLN A 6 GLN^? 1000.00 C 209 LYS A 8 LYS.? 1000.00 coo 100.54 -2.78 25.52 103.29 2.02 24.05 33.88 9.40 -9.57 30.19 10.21 -6.88 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 43.42 4.45 -4.29 44.63 4.11 -6.01 coo 113.62 1.19 33.65 109.52 3.92 36.47 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 2 3 # 2 C 175 LYS B 59 LYS~? 1000.00 C 208 GLN A 74 GLN~? 1000.00 C 209 LYS A 42 LYS~? 1000.00 coo 100.54 -2.78 25.52 103.29 2.02 24.05 30.97 -15.57 3.92 34.16 -17.16 -0.27 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 41.83 -8.17 2.52 43.84 -8.77 2.84 coo 113.62 1.19 33.65 109.52 3.92 36.47 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1ohh_c08 ATP SYNTHASE ALPHA CHAIN HEART ISOFOuser 3 3 # 3 C 175 LYS B 98 LYS~? 1000.00 C 208 GLN B 6 GLN^? 1000.00 C 209 LYS B 8 LYS.? 1000.00 coo 100.54 -2.78 25.52 103.29 2.02 24.05 32.73 -19.13 25.55 34.27 -15.53 22.56 coo 111.02 -1.31 30.92 109.87 -2.78 29.89 37.40 -28.66 19.69 37.54 -29.92 21.40 coo 113.62 1.19 33.65 109.52 3.92 36.47 41.30 -30.41 16.51 39.51 -34.44 19.49 1ohh_c08 source 1ohh ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, MITOCH: 3 hits 1ohh_c08 naa= 3 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 A 24 ASP A 29 ASP.? 1000.00 A 146 TYR A 24 TYR~? 1000.00 A 177 LYS A 60 LYS~? 1000.00 coo -3.50 124.89 25.05 -2.25 124.77 23.26 33.08 24.05 1.29 32.31 25.48 2.63 coo 1.87 119.38 16.45 1.41 122.11 16.84 38.31 18.23 6.93 36.20 19.30 8.42 coo -2.59 124.07 12.67 -0.91 126.17 18.42 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1ok4_c00 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 A 24 ASP B 29 ASP.? 1000.00 A 146 TYR B 24 TYR~? 1000.00 A 177 LYS B 60 LYS~? 1000.00 coo -3.50 124.89 25.05 -2.25 124.77 23.26 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 1.87 119.38 16.45 1.41 122.11 16.84 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -2.59 124.07 12.67 -0.91 126.17 18.42 28.11 -17.10 5.89 27.12 -20.73 2.18 1ok4_c00 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c00 naa= 3 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 B 24 ASP A 29 ASP.? 1000.00 B 146 TYR A 24 TYR~? 1000.00 B 177 LYS A 60 LYS~? 1000.00 coo -7.43 109.06 51.23 -5.84 110.54 50.86 33.08 24.05 1.29 32.31 25.48 2.63 coo 0.22 114.56 44.62 -0.76 115.18 47.18 38.31 18.23 6.93 36.20 19.30 8.42 coo -4.18 120.17 46.85 -4.02 115.31 51.00 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1ok4_c01 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 B 24 ASP B 29 ASP.? 1000.00 B 146 TYR B 24 TYR~? 1000.00 B 177 LYS B 60 LYS~? 1000.00 coo -7.43 109.06 51.23 -5.84 110.54 50.86 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 0.22 114.56 44.62 -0.76 115.18 47.18 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -4.18 120.17 46.85 -4.02 115.31 51.00 28.11 -17.10 5.89 27.12 -20.73 2.18 1ok4_c01 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c01 naa= 3 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 C 24 ASP A 29 ASP.? 1000.00 C 146 TYR A 24 TYR~? 1000.00 C 177 LYS A 60 LYS~? 1000.00 coo -13.49 79.65 43.90 -12.13 80.29 45.45 33.08 24.05 1.29 32.31 25.48 2.63 coo -5.65 86.78 48.49 -7.16 84.72 49.65 38.31 18.23 6.93 36.20 19.30 8.42 coo -11.22 87.18 53.49 -10.94 81.64 50.31 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1ok4_c02 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 C 24 ASP B 29 ASP.? 1000.00 C 146 TYR B 24 TYR~? 1000.00 C 177 LYS B 60 LYS~? 1000.00 coo -13.49 79.65 43.90 -12.13 80.29 45.45 18.76 -16.66 13.02 17.62 -16.03 11.36 coo -5.65 86.78 48.49 -7.16 84.72 49.65 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -11.22 87.18 53.49 -10.94 81.64 50.31 28.11 -17.10 5.89 27.12 -20.73 2.18 1ok4_c02 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c02 naa= 3 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 D 24 ASP A 29 ASP.? 1000.00 D 146 TYR A 24 TYR~? 1000.00 D 177 LYS A 60 LYS~? 1000.00 coo -13.44 77.36 13.12 -12.53 75.97 14.48 33.08 24.05 1.29 32.31 25.48 2.63 coo -7.85 74.44 22.75 -9.22 72.86 20.89 38.31 18.23 6.93 36.20 19.30 8.42 coo -14.24 70.61 23.48 -12.55 71.73 17.42 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1ok4_c03 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 D 24 ASP B 29 ASP.? 1000.00 D 146 TYR B 24 TYR~? 1000.00 D 177 LYS B 60 LYS~? 1000.00 coo -13.44 77.36 13.12 -12.53 75.97 14.48 18.76 -16.66 13.02 17.62 -16.03 11.36 coo -7.85 74.44 22.75 -9.22 72.86 20.89 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -14.24 70.61 23.48 -12.55 71.73 17.42 28.11 -17.10 5.89 27.12 -20.73 2.18 1ok4_c03 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c03 naa= 3 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 E 24 ASP A 29 ASP.? 1000.00 E 146 TYR A 24 TYR~? 1000.00 E 177 LYS A 60 LYS~? 1000.00 coo -7.12 105.25 1.43 -6.30 103.34 0.77 33.08 24.05 1.29 32.31 25.48 2.63 coo -3.11 94.55 3.01 -3.83 95.92 0.66 38.31 18.23 6.93 36.20 19.30 8.42 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1ok4_c04 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 E 24 ASP B 29 ASP.? 1000.00 E 146 TYR B 24 TYR~? 1000.00 E 177 LYS B 60 LYS~? 1000.00 coo -7.12 105.25 1.43 -6.30 103.34 0.77 18.76 -16.66 13.02 17.62 -16.03 11.36 coo -3.11 94.55 3.01 -3.83 95.92 0.66 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -8.77 93.34 -1.70 -6.28 99.15 -2.21 28.11 -17.10 5.89 27.12 -20.73 2.18 1ok4_c04 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c04 naa= 3 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 F 24 ASP A 29 ASP.? 1000.00 F 146 TYR A 24 TYR~? 1000.00 F 177 LYS A 60 LYS~? 1000.00 coo -44.75 128.15 10.28 -45.68 129.67 11.55 33.08 24.05 1.29 32.31 25.48 2.63 coo -50.43 131.90 19.60 -49.04 133.31 17.60 38.31 18.23 6.93 36.20 19.30 8.42 coo -44.10 135.86 19.99 -45.67 134.21 14.07 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1ok4_c05 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 F 24 ASP B 29 ASP.? 1000.00 F 146 TYR B 24 TYR~? 1000.00 F 177 LYS B 60 LYS~? 1000.00 coo -44.75 128.15 10.28 -45.68 129.67 11.55 18.76 -16.66 13.02 17.62 -16.03 11.36 coo -50.43 131.90 19.60 -49.04 133.31 17.60 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -44.10 135.86 19.99 -45.67 134.21 14.07 28.11 -17.10 5.89 27.12 -20.73 2.18 1ok4_c05 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c05 naa= 3 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 G 24 ASP A 29 ASP.? 1000.00 G 146 TYR A 24 TYR~? 1000.00 G 177 LYS A 60 LYS~? 1000.00 coo -44.97 128.78 41.20 -46.32 128.26 42.83 33.08 24.05 1.29 32.31 25.48 2.63 coo -52.83 122.13 46.42 -51.31 124.30 47.39 38.31 18.23 6.93 36.20 19.30 8.42 coo -47.30 122.24 51.49 -47.46 127.44 47.81 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1ok4_c06 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 G 24 ASP B 29 ASP.? 1000.00 G 146 TYR B 24 TYR~? 1000.00 G 177 LYS B 60 LYS~? 1000.00 coo -44.97 128.78 41.20 -46.32 128.26 42.83 18.76 -16.66 13.02 17.62 -16.03 11.36 coo -52.83 122.13 46.42 -51.31 124.30 47.39 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -47.30 122.24 51.49 -47.46 127.44 47.81 28.11 -17.10 5.89 27.12 -20.73 2.18 1ok4_c06 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c06 naa= 3 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 H 24 ASP A 29 ASP.? 1000.00 H 146 TYR A 24 TYR~? 1000.00 H 177 LYS A 60 LYS~? 1000.00 coo -51.11 100.30 51.41 -52.67 98.82 51.12 33.08 24.05 1.29 32.31 25.48 2.63 coo -58.70 94.17 45.32 -57.76 93.82 47.92 38.31 18.23 6.93 36.20 19.30 8.42 coo -54.32 88.79 48.13 -54.61 94.04 51.74 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1ok4_c07 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 H 24 ASP B 29 ASP.? 1000.00 H 146 TYR B 24 TYR~? 1000.00 H 177 LYS B 60 LYS~? 1000.00 coo -51.11 100.30 51.41 -52.67 98.82 51.12 18.76 -16.66 13.02 17.62 -16.03 11.36 coo -58.70 94.17 45.32 -57.76 93.82 47.92 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -54.32 88.79 48.13 -54.61 94.04 51.74 28.11 -17.10 5.89 27.12 -20.73 2.18 1ok4_c07 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c07 naa= 3 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 I 24 ASP A 29 ASP.? 1000.00 I 146 TYR A 24 TYR~? 1000.00 I 177 LYS A 60 LYS~? 1000.00 coo -54.65 81.97 26.87 -55.88 81.89 25.07 33.08 24.05 1.29 32.31 25.48 2.63 coo -59.92 86.62 17.74 -59.42 83.94 18.40 38.31 18.23 6.93 36.20 19.30 8.42 coo -55.38 81.61 14.50 -57.11 80.05 20.41 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1ok4_c08 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 I 24 ASP B 29 ASP.? 1000.00 I 146 TYR B 24 TYR~? 1000.00 I 177 LYS B 60 LYS~? 1000.00 coo -54.65 81.97 26.87 -55.88 81.89 25.07 18.76 -16.66 13.02 17.62 -16.03 11.36 coo -59.92 86.62 17.74 -59.42 83.94 18.40 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -55.38 81.61 14.50 -57.11 80.05 20.41 28.11 -17.10 5.89 27.12 -20.73 2.18 1ok4_c08 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c08 naa= 3 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 1 3 # 1 J 24 ASP A 29 ASP.? 1000.00 J 146 TYR A 24 TYR~? 1000.00 J 177 LYS A 60 LYS~? 1000.00 coo -50.64 99.08 1.52 -51.52 100.83 0.67 33.08 24.05 1.29 32.31 25.48 2.63 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 38.31 18.23 6.93 36.20 19.30 8.42 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 33.44 15.58 9.51 37.67 16.47 12.82 ULMN 3 1ok4_c09 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASSuser 2 3 # 2 J 24 ASP B 29 ASP.? 1000.00 J 146 TYR B 24 TYR~? 1000.00 J 177 LYS B 60 LYS~? 1000.00 coo -50.64 99.08 1.52 -51.52 100.83 0.67 18.76 -16.66 13.02 17.62 -16.03 11.36 coo -54.74 109.84 1.86 -54.04 108.22 -0.34 24.95 -21.91 8.04 24.30 -19.58 6.61 coo -49.01 110.53 -2.89 -51.59 104.72 -2.78 28.11 -17.10 5.89 27.12 -20.73 2.18 1ok4_c09 source 1ok4 FRUCTOSE-BISPHOSPHATE ALDOLASE CLASS I : 2 hits 1ok4_c09 naa= 3 ULMN 3 1p1x_c00 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 1 3 # 1 A 102 ASP A 79 ASP~? 1000.00 A 167 LYS B 60 LYS~? 1000.00 A 201 LYS B 59 LYS~? 1000.00 coo 26.53 8.31 20.37 28.45 8.41 19.40 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 24.92 6.08 13.38 27.75 4.33 18.83 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 29.08 5.53 11.69 30.46 5.61 17.93 30.97 -15.57 3.92 34.16 -17.16 -0.27 1p1x_c00 source 1p1x DEOXYRIBOSE-PHOSPHATE ALDOLASE : 1 hits 1p1x_c00 naa= 3 ULMN 3 1p1x_c01 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 1 3 # 1 B1102 ASP A 79 ASP~? 1000.00 B1167 LYS B 60 LYS~? 1000.00 B1201 LYS B 59 LYS~? 1000.00 coo 26.10 12.11 49.61 24.19 12.48 50.51 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 27.70 11.69 56.92 24.82 8.55 52.12 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 23.50 11.64 58.67 22.19 10.19 52.59 30.97 -15.57 3.92 34.16 -17.16 -0.27 1p1x_c01 source 1p1x DEOXYRIBOSE-PHOSPHATE ALDOLASE : 1 hits 1p1x_c01 naa= 3 ULMN 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 # 1 A 630 SER A 70 SER~? 1000.00 A 709 ASP A 9 ASP~? 1000.00 A 740 HIS A 37 HIS.? 1000.00 coo -7.09 7.44 6.22 -7.53 5.14 5.59 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo -6.04 -3.54 13.59 -7.99 -3.21 12.73 49.66 0.41 0.84 50.15 0.20 -1.21 coo -8.70 2.86 9.96 -8.03 3.92 8.29 41.42 -0.42 -3.75 42.78 0.47 -5.09 ULMN 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 2 3 # 2 A 630 SER B 70 SER~? 1000.00 A 709 ASP B 9 ASP~? 1000.00 A 740 HIS B 37 HIS.? 1000.00 coo -7.09 7.44 6.22 -7.53 5.14 5.59 48.76 -24.45 18.03 46.63 -25.35 18.72 coo -6.04 -3.54 13.59 -7.99 -3.21 12.73 41.34 -34.74 14.44 41.31 -35.37 16.46 coo -8.70 2.86 9.96 -8.03 3.92 8.29 42.39 -26.87 19.72 41.38 -28.37 20.76 1pfq_c02 source 1pfq DIPEPTIDYL PEPTIDASE IV SOLUBLE FORM : 2 hits 1pfq_c02 naa= 3 ULMN 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 # 1 B 630 SER A 70 SER~? 1000.00 B 709 ASP A 9 ASP~? 1000.00 B 740 HIS A 37 HIS.? 1000.00 coo 4.44 13.29 37.64 6.01 11.66 38.49 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 10.26 2.81 31.69 11.64 4.30 32.43 49.66 0.41 0.84 50.15 0.20 -1.21 coo 8.57 10.09 34.47 7.10 10.73 35.82 41.42 -0.42 -3.75 42.78 0.47 -5.09 ULMN 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 2 3 # 2 B 630 SER B 70 SER~? 1000.00 B 709 ASP B 9 ASP~? 1000.00 B 740 HIS B 37 HIS.? 1000.00 coo 4.44 13.29 37.64 6.01 11.66 38.49 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 10.26 2.81 31.69 11.64 4.30 32.43 41.34 -34.74 14.44 41.31 -35.37 16.46 coo 8.57 10.09 34.47 7.10 10.73 35.82 42.39 -26.87 19.72 41.38 -28.37 20.76 1pfq_c03 source 1pfq DIPEPTIDYL PEPTIDASE IV SOLUBLE FORM : 2 hits 1pfq_c03 naa= 3 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 1 3 # 1 A 248 ASP A 79 ASP~? 1000.00 A 270 LYS B 59 LYS~? 1000.00 A 382 MET B 1 MET.? 1000.00 coo -27.63 121.99 45.48 -26.66 123.86 45.68 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -32.20 115.91 49.56 -31.37 121.03 53.12 30.97 -15.57 3.92 34.16 -17.16 -0.27 coo -23.75 127.89 58.42 -26.02 128.79 55.12 21.57 -19.38 19.89 21.35 -23.48 19.64 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 2 3 # 2 A 248 ASP A 79 ASP~? 1000.00 A 270 LYS B 60 LYS~? 1000.00 A 382 MET B 1 MET.? 1000.00 coo -27.63 121.99 45.48 -26.66 123.86 45.68 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -32.20 115.91 49.56 -31.37 121.03 53.12 28.11 -17.10 5.89 27.12 -20.73 2.18 coo -23.75 127.89 58.42 -26.02 128.79 55.12 21.57 -19.38 19.89 21.35 -23.48 19.64 1pjq_c02 source 1pjq SIROHEME SYNTHASE : 2 hits 1pjq_c02 naa= 3 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 1 3 # 1 B 248 ASP A 79 ASP~? 1000.00 B 270 LYS B 60 LYS~? 1000.00 B 382 MET B 1 MET.? 1000.00 coo -11.82 154.51 43.38 -12.86 152.74 43.79 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -5.09 158.39 43.41 -0.74 158.80 47.15 28.11 -17.10 5.89 27.12 -20.73 2.18 coo -2.79 145.52 50.38 -5.75 148.14 51.66 21.57 -19.38 19.89 21.35 -23.48 19.64 1pjq_c03 source 1pjq SIROHEME SYNTHASE : 1 hits 1pjq_c03 naa= 3 ULMN 3 1pp4_c02 RHAMNOGALACTURONAN ACETYLESTERASE user 1 3 # 1 A 74 ASN A 75 ASN.? 1000.00 A 192 ASP A 79 ASP~? 1000.00 A 195 HIS A 78 HIS~? 1000.00 coo -4.84 51.77 30.37 -3.89 50.12 29.46 38.85 -14.15 4.51 39.52 -15.44 2.97 coo 2.03 47.14 19.75 1.72 46.26 21.64 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 1.41 44.84 24.92 -0.49 45.70 25.19 29.48 -7.00 4.25 30.06 -7.33 2.26 ULMN 3 1pp4_c02 RHAMNOGALACTURONAN ACETYLESTERASE user 2 3 # 2 A 74 ASN B 75 ASN.? 1000.00 A 192 ASP B 79 ASP~? 1000.00 A 195 HIS B 78 HIS~? 1000.00 coo -4.84 51.77 30.37 -3.89 50.12 29.46 57.03 -25.03 13.17 58.00 -25.84 14.88 coo 2.03 47.14 19.75 1.72 46.26 21.64 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 1.41 44.84 24.92 -0.49 45.70 25.19 50.43 -14.84 12.90 50.32 -15.37 14.93 1pp4_c02 source 1pp4 RHAMNOGALACTURONAN ACETYLESTERASE : 2 hits 1pp4_c02 naa= 3 ULMN 3 1pp4_c03 RHAMNOGALACTURONAN ACETYLESTERASE user 1 3 # 1 B 74 ASN A 75 ASN.? 1000.00 B 192 ASP A 79 ASP~? 1000.00 B 195 HIS A 78 HIS~? 1000.00 coo -1.08 51.41 10.34 0.65 52.62 10.17 38.85 -14.15 4.51 39.52 -15.44 2.97 coo 11.36 52.33 5.59 10.18 53.87 6.47 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 7.99 56.74 7.55 6.88 55.39 8.70 29.48 -7.00 4.25 30.06 -7.33 2.26 ULMN 3 1pp4_c03 RHAMNOGALACTURONAN ACETYLESTERASE user 2 3 # 2 B 74 ASN B 75 ASN.? 1000.00 B 192 ASP B 79 ASP~? 1000.00 B 195 HIS B 78 HIS~? 1000.00 coo -1.08 51.41 10.34 0.65 52.62 10.17 57.03 -25.03 13.17 58.00 -25.84 14.88 coo 11.36 52.33 5.59 10.18 53.87 6.47 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 7.99 56.74 7.55 6.88 55.39 8.70 50.43 -14.84 12.90 50.32 -15.37 14.93 1pp4_c03 source 1pp4 RHAMNOGALACTURONAN ACETYLESTERASE : 2 hits 1pp4_c03 naa= 3 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 A 48 LEU A 23 LEU~? 1000.00 A 58 ASP A 26 ASP~? 1000.00 A 120 LYS A 28 LYS.? 1000.00 coo 34.02 69.29 75.26 34.82 67.82 76.74 42.62 16.67 2.14 41.89 16.81 0.11 coo 34.46 72.45 78.57 32.82 72.75 77.28 44.41 22.27 3.14 45.59 23.72 2.16 coo 28.96 77.64 81.19 29.05 74.53 77.51 37.25 24.93 2.50 34.30 30.45 3.54 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 2 3 # 2 A 48 LEU A 45 LEU~? 1000.00 A 58 ASP A 47 ASP.? 1000.00 A 120 LYS B 86 LYS^? 1000.00 coo 34.02 69.29 75.26 34.82 67.82 76.74 38.62 -4.52 10.93 38.78 -6.39 9.86 coo 34.46 72.45 78.57 32.82 72.75 77.28 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 28.96 77.64 81.19 29.05 74.53 77.51 40.69 -14.41 14.48 36.91 -13.49 19.50 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 3 3 # 3 A 48 LEU B 23 LEU~? 1000.00 A 58 ASP B 26 ASP~? 1000.00 A 120 LYS B 28 LYS.? 1000.00 coo 34.02 69.29 75.26 34.82 67.82 76.74 25.73 -26.66 12.65 25.52 -25.98 14.70 coo 34.46 72.45 78.57 32.82 72.75 77.28 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 28.96 77.64 81.19 29.05 74.53 77.51 18.42 -20.77 11.45 12.91 -21.38 9.53 1pym_c00 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 3 hits 1pym_c00 naa= 3 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 B 48 LEU A 23 LEU~? 1000.00 B 58 ASP A 26 ASP~? 1000.00 B 120 LYS A 28 LYS.? 1000.00 coo 54.50 104.32 58.69 55.83 105.69 59.81 42.62 16.67 2.14 41.89 16.81 0.11 coo 57.63 101.19 59.83 56.60 100.89 57.99 44.41 22.27 3.14 45.59 23.72 2.16 coo 61.58 95.88 55.22 58.18 99.30 54.71 37.25 24.93 2.50 34.30 30.45 3.54 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 2 3 # 2 B 48 LEU A 45 LEU~? 1000.00 B 58 ASP A 47 ASP.? 1000.00 B 120 LYS B 86 LYS^? 1000.00 coo 54.50 104.32 58.69 55.83 105.69 59.81 38.62 -4.52 10.93 38.78 -6.39 9.86 coo 57.63 101.19 59.83 56.60 100.89 57.99 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 61.58 95.88 55.22 58.18 99.30 54.71 40.69 -14.41 14.48 36.91 -13.49 19.50 1pym_c01 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 2 hits 1pym_c01 naa= 3 ULMN 3 1qe3_c00 PARA-NITROBENZYL ESTERASE user 1 3 # 1 A 189 SER A 77 SER~? 1000.00 A 310 GLU A 68 GLU~? 1000.00 A 399 HIS A 78 HIS~? 1000.00 coo 2.67 37.96 55.23 1.78 40.01 56.16 32.56 -10.06 6.91 30.65 -10.82 8.21 coo 6.61 38.44 63.61 6.69 38.31 61.50 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 4.95 41.82 59.53 3.85 40.70 58.14 29.48 -7.00 4.25 30.06 -7.33 2.26 ULMN 3 1qe3_c00 PARA-NITROBENZYL ESTERASE user 2 3 # 2 A 189 SER B 77 SER~? 1000.00 A 310 GLU B 68 GLU~? 1000.00 A 399 HIS B 78 HIS~? 1000.00 coo 2.67 37.96 55.23 1.78 40.01 56.16 53.69 -18.22 10.70 56.03 -18.39 10.07 coo 6.61 38.44 63.61 6.69 38.31 61.50 49.52 -17.32 19.57 50.21 -16.89 17.61 coo 4.95 41.82 59.53 3.85 40.70 58.14 50.43 -14.84 12.90 50.32 -15.37 14.93 1qe3_c00 source 1qe3 PARA-NITROBENZYL ESTERASE : 2 hits 1qe3_c00 naa= 3 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 155 HIS A 37 HIS.? 1000.00 A 236 ASP B 79 ASP~? 1000.00 A 261 LYS B 42 LYS~? 1000.00 coo 55.45 46.76 42.08 57.34 46.16 42.75 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 48.87 29.19 44.63 49.10 27.34 43.63 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 47.58 17.35 41.83 51.40 20.85 40.83 47.01 -26.65 9.40 48.95 -31.25 10.40 1qgn_c00 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c00 naa= 3 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 155 HIS A 37 HIS.? 1000.00 D 236 ASP B 79 ASP~? 1000.00 D 261 LYS B 42 LYS~? 1000.00 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 47.01 -26.65 9.40 48.95 -31.25 10.40 1qgn_c03 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c03 naa= 3 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 155 HIS A 37 HIS.? 1000.00 E 236 ASP B 79 ASP~? 1000.00 E 261 LYS B 42 LYS~? 1000.00 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 47.01 -26.65 9.40 48.95 -31.25 10.40 1qgn_c04 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c04 naa= 3 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 155 HIS A 37 HIS.? 1000.00 H 236 ASP B 79 ASP~? 1000.00 H 261 LYS B 42 LYS~? 1000.00 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 47.01 -26.65 9.40 48.95 -31.25 10.40 1qgn_c07 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 1 hits 1qgn_c07 naa= 3 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 24 TYR~? 1000.00 A 236 ASP A 26 ASP~? 1000.00 A 261 LYS A 2 LYS^? 1000.00 coo 55.48 26.51 40.65 55.39 23.99 39.43 38.31 18.23 6.93 36.20 19.30 8.42 coo 48.87 29.19 44.63 49.10 27.34 43.63 44.41 22.27 3.14 45.59 23.72 2.16 coo 47.58 17.35 41.83 51.40 20.85 40.83 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1qgn_c08 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR B 24 TYR~? 1000.00 A 236 ASP B 26 ASP~? 1000.00 A 261 LYS B 2 LYS^? 1000.00 coo 55.48 26.51 40.65 55.39 23.99 39.43 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 48.87 29.19 44.63 49.10 27.34 43.63 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 47.58 17.35 41.83 51.40 20.85 40.83 25.35 -19.21 20.13 23.65 -14.85 22.59 1qgn_c08 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c08 naa= 3 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 24 TYR~? 1000.00 B 236 ASP A 26 ASP~? 1000.00 B 261 LYS A 2 LYS^? 1000.00 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 38.31 18.23 6.93 36.20 19.30 8.42 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 44.41 22.27 3.14 45.59 23.72 2.16 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1qgn_c09 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR B 24 TYR~? 1000.00 B 236 ASP B 26 ASP~? 1000.00 B 261 LYS B 2 LYS^? 1000.00 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 34.76 -4.30 11.09 34.67 -9.53 11.78 25.35 -19.21 20.13 23.65 -14.85 22.59 1qgn_c09 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c09 naa= 3 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 C 163 TYR A 24 TYR~? 1000.00 C 236 ASP A 26 ASP~? 1000.00 C 261 LYS A 2 LYS^? 1000.00 coo 39.51 34.34 13.63 37.63 32.61 14.79 38.31 18.23 6.93 36.20 19.30 8.42 coo 45.78 31.11 9.51 44.25 30.06 10.53 44.41 22.27 3.14 45.59 23.72 2.16 coo 37.54 22.37 12.10 37.83 27.55 13.24 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1qgn_c10 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 C 163 TYR B 24 TYR~? 1000.00 C 236 ASP B 26 ASP~? 1000.00 C 261 LYS B 2 LYS^? 1000.00 coo 39.51 34.34 13.63 37.63 32.61 14.79 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 45.78 31.11 9.51 44.25 30.06 10.53 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 37.54 22.37 12.10 37.83 27.55 13.24 25.35 -19.21 20.13 23.65 -14.85 22.59 1qgn_c10 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c10 naa= 3 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 163 TYR A 24 TYR~? 1000.00 D 236 ASP A 26 ASP~? 1000.00 D 261 LYS A 2 LYS^? 1000.00 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 38.31 18.23 6.93 36.20 19.30 8.42 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 44.41 22.27 3.14 45.59 23.72 2.16 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1qgn_c11 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 D 163 TYR B 24 TYR~? 1000.00 D 236 ASP B 26 ASP~? 1000.00 D 261 LYS B 2 LYS^? 1000.00 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 25.35 -19.21 20.13 23.65 -14.85 22.59 1qgn_c11 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c11 naa= 3 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 24 TYR~? 1000.00 E 236 ASP A 26 ASP~? 1000.00 E 261 LYS A 2 LYS^? 1000.00 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 38.31 18.23 6.93 36.20 19.30 8.42 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 44.41 22.27 3.14 45.59 23.72 2.16 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1qgn_c12 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR B 24 TYR~? 1000.00 E 236 ASP B 26 ASP~? 1000.00 E 261 LYS B 2 LYS^? 1000.00 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 25.35 -19.21 20.13 23.65 -14.85 22.59 1qgn_c12 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c12 naa= 3 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 24 TYR~? 1000.00 F 236 ASP A 26 ASP~? 1000.00 F 261 LYS A 2 LYS^? 1000.00 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 38.31 18.23 6.93 36.20 19.30 8.42 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 44.41 22.27 3.14 45.59 23.72 2.16 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1qgn_c13 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR B 24 TYR~? 1000.00 F 236 ASP B 26 ASP~? 1000.00 F 261 LYS B 2 LYS^? 1000.00 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 26.66 -3.59 -66.44 21.49 -3.17 -65.71 25.35 -19.21 20.13 23.65 -14.85 22.59 1qgn_c13 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c13 naa= 3 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 G 163 TYR A 24 TYR~? 1000.00 G 236 ASP A 26 ASP~? 1000.00 G 261 LYS A 2 LYS^? 1000.00 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 38.31 18.23 6.93 36.20 19.30 8.42 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 44.41 22.27 3.14 45.59 23.72 2.16 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1qgn_c14 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 G 163 TYR B 24 TYR~? 1000.00 G 236 ASP B 26 ASP~? 1000.00 G 261 LYS B 2 LYS^? 1000.00 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 53.04 -8.15 -65.60 58.23 -8.69 -64.55 25.35 -19.21 20.13 23.65 -14.85 22.59 1qgn_c14 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c14 naa= 3 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 163 TYR A 24 TYR~? 1000.00 H 236 ASP A 26 ASP~? 1000.00 H 261 LYS A 2 LYS^? 1000.00 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 38.31 18.23 6.93 36.20 19.30 8.42 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 44.41 22.27 3.14 45.59 23.72 2.16 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 1qgn_c15 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 H 163 TYR B 24 TYR~? 1000.00 H 236 ASP B 26 ASP~? 1000.00 H 261 LYS B 2 LYS^? 1000.00 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 25.35 -19.21 20.13 23.65 -14.85 22.59 1qgn_c15 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c15 naa= 3 ULMN 3 1qho_c05 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 11 ASP~? 1000.00 A 261 ASP A 56 ASP~? 1000.00 A 329 ASP A 49 ASP.? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 52.21 -0.96 5.64 52.68 -0.78 3.58 coo 34.02 79.89 42.60 34.73 78.01 41.86 37.70 11.70 13.69 37.98 13.80 13.68 coo 37.87 70.12 31.80 36.61 69.74 30.15 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 1qho_c05 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 29 ASP.? 1000.00 A 261 ASP A 56 ASP~? 1000.00 A 329 ASP A 26 ASP~? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 33.08 24.05 1.29 32.31 25.48 2.63 coo 34.02 79.89 42.60 34.73 78.01 41.86 37.70 11.70 13.69 37.98 13.80 13.68 coo 37.87 70.12 31.80 36.61 69.74 30.15 44.41 22.27 3.14 45.59 23.72 2.16 ULMN 3 1qho_c05 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP A 49 ASP.? 1000.00 A 261 ASP B 79 ASP~? 1000.00 A 329 ASP A 11 ASP~? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 45.31 0.34 15.16 45.91 -1.47 16.07 coo 34.02 79.89 42.60 34.73 78.01 41.86 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 37.87 70.12 31.80 36.61 69.74 30.15 52.21 -0.96 5.64 52.68 -0.78 3.58 ULMN 3 1qho_c05 ALPHA-AMYLASE user 4 3 # 4 A 228 ASP B 11 ASP~? 1000.00 A 261 ASP B 56 ASP~? 1000.00 A 329 ASP B 49 ASP.? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 42.92 -37.03 9.64 45.02 -37.19 9.59 coo 34.02 79.89 42.60 34.73 78.01 41.86 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 37.87 70.12 31.80 36.61 69.74 30.15 42.86 -29.77 0.45 44.61 -30.51 -0.48 ULMN 3 1qho_c05 ALPHA-AMYLASE user 5 3 # 5 A 228 ASP B 29 ASP.? 1000.00 A 261 ASP B 56 ASP~? 1000.00 A 329 ASP B 26 ASP~? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 18.76 -16.66 13.02 17.62 -16.03 11.36 coo 34.02 79.89 42.60 34.73 78.01 41.86 32.42 -21.29 1.64 30.34 -21.41 1.35 coo 37.87 70.12 31.80 36.61 69.74 30.15 20.05 -27.91 11.23 18.50 -28.91 12.26 1qho_c05 source 1qho ALPHA-AMYLASE : 5 hits 1qho_c05 naa= 3 ULMN 3 1qrz_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 37 HIS.? 1000.00 A 646 ASP A 9 ASP~? 1000.00 A 741 SER A 70 SER~? 1000.00 coo -20.72 2.99 34.37 -21.94 1.82 35.61 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo -18.83 7.68 26.86 -20.89 7.78 26.56 49.66 0.41 0.84 50.15 0.20 -1.21 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 38.84 -6.45 -1.32 39.90 -4.51 -2.28 1qrz_c12 source 1qrz PLASMINOGEN : 1 hits 1qrz_c12 naa= 3 ULMN 3 1qrz_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 37 HIS.? 1000.00 C 646 ASP A 9 ASP~? 1000.00 C 741 SER A 70 SER~? 1000.00 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 49.66 0.41 0.84 50.15 0.20 -1.21 coo 4.71 -4.57 4.71 3.58 -6.49 5.69 38.84 -6.45 -1.32 39.90 -4.51 -2.28 1qrz_c14 source 1qrz PLASMINOGEN : 1 hits 1qrz_c14 naa= 3 ULMN 3 1qtn_c02 ACETYL-ILE-GLU-THR-ASP-ALDEHYDE user 1 3 # 1 A 317 HIS A 37 HIS.? 1000.00 A 318 GLY A 91 GLY~? 1000.00 A 360 CYH A 67 CYH^? 1000.00 coo -8.43 39.80 36.26 -8.18 39.59 38.31 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo -11.14 38.10 31.61 -11.46 38.10 32.37 36.94 0.14 -5.31 36.92 -0.10 -6.12 coo -11.95 34.09 34.07 -11.89 34.73 36.80 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1qtn_c02 ACETYL-ILE-GLU-THR-ASP-ALDEHYDE user 2 3 # 2 A 317 HIS B 37 HIS.? 1000.00 A 318 GLY B 91 GLY~? 1000.00 A 360 CYH B 67 CYH^? 1000.00 coo -8.43 39.80 36.26 -8.18 39.59 38.31 42.39 -26.87 19.72 41.38 -28.37 20.76 coo -11.14 38.10 31.61 -11.46 38.10 32.37 41.89 -22.47 21.50 42.09 -22.54 22.29 coo -11.95 34.09 34.07 -11.89 34.73 36.80 44.74 -21.15 18.29 45.66 -22.86 20.37 1qtn_c02 source 1qtn ACETYL-ILE-GLU-THR-ASP-ALDEHYDE : 2 hits 1qtn_c02 naa= 3 ULMN 3 1qx3_c00 APOPAIN user 1 3 # 1 A 121 HIS A 37 HIS.? 1000.00 A 122 GLY A 91 GLY~? 1000.00 A 163 CYH A 67 CYH^? 1000.00 coo 2.23 29.11 15.20 1.24 27.27 15.13 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 2.54 34.86 14.60 1.83 34.53 14.82 36.94 0.14 -5.31 36.92 -0.10 -6.12 coo -1.20 35.13 11.95 -2.11 32.67 12.98 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1qx3_c00 APOPAIN user 2 3 # 2 A 121 HIS B 37 HIS.? 1000.00 A 122 GLY B 91 GLY~? 1000.00 A 163 CYH B 67 CYH^? 1000.00 coo 2.23 29.11 15.20 1.24 27.27 15.13 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 2.54 34.86 14.60 1.83 34.53 14.82 41.89 -22.47 21.50 42.09 -22.54 22.29 coo -1.20 35.13 11.95 -2.11 32.67 12.98 44.74 -21.15 18.29 45.66 -22.86 20.37 1qx3_c00 source 1qx3 APOPAIN : 2 hits 1qx3_c00 naa= 3 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 1 3 # 1 A 10 ASP A 26 ASP~? 1000.00 A 186 ASN A 22 ASN~? 1000.00 A 260 ALA A 16 ALA~? 1000.00 coo 11.81 33.10 11.71 13.07 31.45 11.40 44.41 22.27 3.14 45.59 23.72 2.16 coo 11.43 26.53 7.41 13.01 27.56 8.43 46.65 17.32 5.68 48.04 16.96 7.27 coo 21.53 26.33 6.96 20.26 25.69 7.52 47.04 8.35 4.48 46.50 7.11 3.78 ULMN 3 1r4f_c00 IAG-NUCLEOSIDE HYDROLASE user 2 3 # 2 A 10 ASP B 26 ASP~? 1000.00 A 186 ASN B 22 ASN~? 1000.00 A 260 ALA B 16 ALA~? 1000.00 coo 11.81 33.10 11.71 13.07 31.45 11.40 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 11.43 26.53 7.41 13.01 27.56 8.43 24.98 -30.44 8.86 25.45 -31.72 7.22 coo 21.53 26.33 6.96 20.26 25.69 7.52 33.92 -31.40 10.52 35.14 -31.01 11.36 1r4f_c00 source 1r4f IAG-NUCLEOSIDE HYDROLASE : 2 hits 1r4f_c00 naa= 3 ULMN 3 1rgq_c01 NS4A PEPTIDE user 1 3 # 1 B 60 HIS A 78 HIS~? 1000.00 B 84 ASP A 79 ASP~? 1000.00 B 140 GLY A 66 GLY^? 1000.00 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 35.16 0.03 1.24 34.60 0.21 0.65 ULMN 3 1rgq_c01 NS4A PEPTIDE user 2 3 # 2 B 60 HIS B 78 HIS~? 1000.00 B 84 ASP B 79 ASP~? 1000.00 B 140 GLY B 66 GLY^? 1000.00 coo 20.71 17.85 -18.47 19.91 19.62 -17.68 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 23.40 21.01 -22.79 22.72 19.65 -21.32 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 11.52 20.17 -13.15 11.93 20.87 -13.16 42.82 -20.03 15.19 42.57 -19.59 15.86 1rgq_c01 source 1rgq NS4A PEPTIDE : 2 hits 1rgq_c01 naa= 3 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 1 3 # 1 32 ASP A 9 ASP~? 1000.00 35 SER A 39 SER~? 1000.00 215 ASP A 11 ASP~? 1000.00 coo 11.85 17.24 72.81 11.09 15.37 72.36 49.66 0.41 0.84 50.15 0.20 -1.21 coo 12.20 12.71 75.45 13.69 13.84 74.03 44.91 -4.59 1.85 47.19 -3.74 1.94 coo 5.22 15.03 71.43 7.19 14.88 70.83 52.21 -0.96 5.64 52.68 -0.78 3.58 ULMN 3 1rne_c04 RENIN (ACTIVATED, GLYCOSYLATED, INHIuser 2 3 # 2 32 ASP B 9 ASP~? 1000.00 35 SER B 39 SER~? 1000.00 215 ASP B 11 ASP~? 1000.00 coo 11.85 17.24 72.81 11.09 15.37 72.36 41.34 -34.74 14.44 41.31 -35.37 16.46 coo 12.20 12.71 75.45 13.69 13.84 74.03 46.85 -30.26 14.14 45.82 -32.43 13.84 coo 5.22 15.03 71.43 7.19 14.88 70.83 42.92 -37.03 9.64 45.02 -37.19 9.59 1rne_c04 source 1rne RENIN (ACTIVATED, GLYCOSYLATED, INHIBITED) (E.: 2 hits 1rne_c04 naa= 3 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 A 137 GLU A 101 GLU~? 1000.00 A 288 HIS A 78 HIS~? 1000.00 A 329 LYS B 59 LYS~? 1000.00 coo 29.27 18.78 14.99 27.16 18.62 14.76 30.15 10.80 -12.01 29.56 9.58 -10.37 coo 49.52 10.06 10.36 50.99 9.65 8.92 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 57.80 12.92 13.83 53.77 8.42 12.15 30.97 -15.57 3.92 34.16 -17.16 -0.27 ULMN 3 1roz_c00 DEOXYHYPUSINE SYNTHASE user 2 3 # 2 A 137 GLU B 94 GLU~? 1000.00 A 288 HIS A 78 HIS~? 1000.00 A 329 LYS A 86 LYS^? 1000.00 coo 29.27 18.78 14.99 27.16 18.62 14.76 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 49.52 10.06 10.36 50.99 9.65 8.92 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 57.80 12.92 13.83 53.77 8.42 12.15 29.45 2.33 2.56 27.22 6.18 5.41 1roz_c00 source 1roz DEOXYHYPUSINE SYNTHASE : 2 hits 1roz_c00 naa= 3 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 1 3 # 1 B 137 GLU A 101 GLU~? 1000.00 B 288 HIS A 78 HIS~? 1000.00 B 329 LYS B 59 LYS~? 1000.00 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 30.15 10.80 -12.01 29.56 9.58 -10.37 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 30.97 -15.57 3.92 34.16 -17.16 -0.27 ULMN 3 1roz_c01 DEOXYHYPUSINE SYNTHASE user 2 3 # 2 B 137 GLU B 94 GLU~? 1000.00 B 288 HIS A 78 HIS~? 1000.00 B 329 LYS A 86 LYS^? 1000.00 coo 51.99 -1.20 48.77 51.89 -0.93 46.67 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 31.44 -9.36 43.35 29.98 -10.83 43.65 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 23.19 -4.89 44.25 27.28 -8.41 40.97 29.45 2.33 2.56 27.22 6.18 5.41 1roz_c01 source 1roz DEOXYHYPUSINE SYNTHASE : 2 hits 1roz_c01 naa= 3 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 # 1 B 57 HIS A 78 HIS~? 1000.00 B 102 ASP A 79 ASP~? 1000.00 B 193 GLY A 66 GLY^? 1000.00 coo -4.60 27.52 42.88 -4.63 27.41 40.76 29.48 -7.00 4.25 30.06 -7.33 2.26 coo -0.27 31.24 43.51 -1.49 29.62 42.98 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -6.81 22.81 34.74 -6.42 23.54 34.62 35.16 0.03 1.24 34.60 0.21 0.65 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 2 3 # 2 B 57 HIS A 78 HIS~? 1000.00 B 102 ASP A 79 ASP~? 1000.00 B 193 GLY A 84 GLY.? 1000.00 coo -4.60 27.52 42.88 -4.63 27.41 40.76 29.48 -7.00 4.25 30.06 -7.33 2.26 coo -0.27 31.24 43.51 -1.49 29.62 42.98 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -6.81 22.81 34.74 -6.42 23.54 34.62 28.24 3.53 8.75 28.74 2.92 8.51 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 3 3 # 3 B 57 HIS B 78 HIS~? 1000.00 B 102 ASP B 79 ASP~? 1000.00 B 193 GLY B 66 GLY^? 1000.00 coo -4.60 27.52 42.88 -4.63 27.41 40.76 50.43 -14.84 12.90 50.32 -15.37 14.93 coo -0.27 31.24 43.51 -1.49 29.62 42.98 53.02 -14.22 6.66 54.72 -15.42 7.04 coo -6.81 22.81 34.74 -6.42 23.54 34.62 42.82 -20.03 15.19 42.57 -19.59 15.86 ULMN 3 1rtf_c06 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 4 3 # 4 B 57 HIS B 78 HIS~? 1000.00 B 102 ASP B 79 ASP~? 1000.00 B 193 GLY B 84 GLY.? 1000.00 coo -4.60 27.52 42.88 -4.63 27.41 40.76 50.43 -14.84 12.90 50.32 -15.37 14.93 coo -0.27 31.24 43.51 -1.49 29.62 42.98 53.02 -14.22 6.66 54.72 -15.42 7.04 coo -6.81 22.81 34.74 -6.42 23.54 34.62 40.56 -13.02 8.08 41.12 -13.48 8.40 1rtf_c06 source 1rtf TWO CHAIN TISSUE PLASMINOGEN ACTIVATOR : 4 hits 1rtf_c06 naa= 3 ULMN 3 1sca_c01 SUBTILISIN CARLSBERG (E.C.3.4.21.62)user 1 3 # 1 32 ASP B 79 ASP~? 1000.00 64 HIS B 78 HIS~? 1000.00 155 ASN B 75 ASN.? 1000.00 coo 80.16 73.25 62.48 80.01 71.25 61.82 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 78.27 67.69 61.83 79.58 67.76 60.19 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 80.34 61.88 52.75 81.25 63.19 54.35 57.03 -25.03 13.17 58.00 -25.84 14.88 1sca_c01 source 1sca SUBTILISIN CARLSBERG (E.C.3.4.21.62) (AQUEOUS : 1 hits 1sca_c01 naa= 3 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 1 3 # 1 A 57 HIS A 78 HIS~? 1000.00 A 102 ASP A 79 ASP~? 1000.00 A 193 GLY A 66 GLY^? 1000.00 coo 15.02 29.17 19.44 15.63 29.96 17.60 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 19.67 30.58 22.61 18.30 29.87 21.17 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 14.52 29.10 10.01 15.08 29.66 10.19 35.16 0.03 1.24 34.60 0.21 0.65 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 2 3 # 2 A 57 HIS B 78 HIS~? 1000.00 A 102 ASP B 79 ASP~? 1000.00 A 193 GLY B 66 GLY^? 1000.00 coo 15.02 29.17 19.44 15.63 29.96 17.60 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 19.67 30.58 22.61 18.30 29.87 21.17 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 14.52 29.10 10.01 15.08 29.66 10.19 42.82 -20.03 15.19 42.57 -19.59 15.86 ULMN 3 1ssx_c02 ALPHA-LYTIC PROTEASE user 3 3 # 3 A 57 HIS B 78 HIS~? 1000.00 A 102 ASP B 79 ASP~? 1000.00 A 193 GLY B 84 GLY.? 1000.00 coo 15.02 29.17 19.44 15.63 29.96 17.60 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 19.67 30.58 22.61 18.30 29.87 21.17 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 14.52 29.10 10.01 15.08 29.66 10.19 40.56 -13.02 8.08 41.12 -13.48 8.40 1ssx_c02 source 1ssx ALPHA-LYTIC PROTEASE : 3 hits 1ssx_c02 naa= 3 ULMN 3 1t0u_c01 URIDINE PHOSPHORYLASE user 1 3 # 1 B 8 HIS A 78 HIS~? 1000.00 B 80 GLU A 68 GLU~? 1000.00 B 223 ARG B 72 ARG~? 1000.00 coo -27.29 12.84 -47.54 -26.57 10.91 -47.95 29.48 -7.00 4.25 30.06 -7.33 2.26 coo -24.01 16.61 -49.84 -25.90 15.74 -49.71 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo -14.82 14.90 -18.49 -14.21 12.08 -19.40 53.69 -19.00 19.46 54.01 -16.13 20.50 1t0u_c01 source 1t0u URIDINE PHOSPHORYLASE : 1 hits 1t0u_c01 naa= 3 ULMN 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 1 3 # 1 A 261 GLY A 93 GLY~? 1000.00 B 17 GLN A 99 GLN~? 1000.00 B 140 GLU A 94 GLU~? 1000.00 coo 61.49 19.86 5.96 61.52 19.46 5.16 35.52 1.04 -10.46 35.76 1.47 -9.76 coo 63.76 11.90 7.93 65.18 13.07 6.77 39.04 10.14 -10.94 40.93 9.43 -11.61 coo 66.44 19.00 7.38 67.69 17.67 8.37 33.73 4.64 -5.66 31.71 5.23 -5.97 ULMN 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 2 3 # 2 A 261 GLY A 102 GLY.? 1000.00 B 17 GLN A 99 GLN~? 1000.00 B 140 GLU A 101 GLU~? 1000.00 coo 61.49 19.86 5.96 61.52 19.46 5.16 34.37 15.37 -12.19 34.43 14.77 -11.69 coo 63.76 11.90 7.93 65.18 13.07 6.77 39.04 10.14 -10.94 40.93 9.43 -11.61 coo 66.44 19.00 7.38 67.69 17.67 8.37 30.15 10.80 -12.01 29.56 9.58 -10.37 ULMN 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 3 3 # 3 A 261 GLY B 93 GLY~? 1000.00 B 17 GLN B 99 GLN~? 1000.00 B 140 GLU B 94 GLU~? 1000.00 coo 61.49 19.86 5.96 61.52 19.46 5.16 40.83 -21.48 26.74 40.43 -21.62 26.00 coo 63.76 11.90 7.93 65.18 13.07 6.77 31.57 -24.25 26.40 31.90 -26.29 26.90 coo 66.44 19.00 7.38 67.69 17.67 8.37 37.91 -18.85 21.91 37.52 -16.89 22.58 ULMN 3 1t4c_c02 FORMYL-COENZYME A TRANSFERASE user 4 3 # 4 A 261 GLY B 102 GLY.? 1000.00 B 17 GLN B 99 GLN~? 1000.00 B 140 GLU B 101 GLU~? 1000.00 coo 61.49 19.86 5.96 61.52 19.46 5.16 26.60 -19.43 27.68 27.22 -19.51 27.25 coo 63.76 11.90 7.93 65.18 13.07 6.77 31.57 -24.25 26.40 31.90 -26.29 26.90 coo 66.44 19.00 7.38 67.69 17.67 8.37 31.45 -15.60 28.20 32.65 -14.70 26.72 1t4c_c02 source 1t4c FORMYL-COENZYME A TRANSFERASE : 4 hits 1t4c_c02 naa= 3 ULMN 3 1t7d_c00 SIGNAL PEPTIDASE I user 1 3 # 1 A 88 SER A 70 SER~? 1000.00 A 90 SER A 39 SER~? 1000.00 A 145 LYS A 8 LYS.? 1000.00 coo -3.31 40.95 15.56 -0.94 40.79 14.97 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 1.47 40.03 18.48 2.45 41.37 16.68 44.91 -4.59 1.85 47.19 -3.74 1.94 coo 7.35 44.71 16.29 4.71 40.98 14.52 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1t7d_c00 SIGNAL PEPTIDASE I user 2 3 # 2 A 88 SER A 73 SER~? 1000.00 A 90 SER A 70 SER~? 1000.00 A 145 LYS A 42 LYS~? 1000.00 coo -3.31 40.95 15.56 -0.94 40.79 14.97 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo 1.47 40.03 18.48 2.45 41.37 16.68 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 7.35 44.71 16.29 4.71 40.98 14.52 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1t7d_c00 SIGNAL PEPTIDASE I user 3 3 # 3 A 88 SER B 70 SER~? 1000.00 A 90 SER B 39 SER~? 1000.00 A 145 LYS B 8 LYS.? 1000.00 coo -3.31 40.95 15.56 -0.94 40.79 14.97 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 1.47 40.03 18.48 2.45 41.37 16.68 46.85 -30.26 14.14 45.82 -32.43 13.84 coo 7.35 44.71 16.29 4.71 40.98 14.52 41.30 -30.41 16.51 39.51 -34.44 19.49 ULMN 3 1t7d_c00 SIGNAL PEPTIDASE I user 4 3 # 4 A 88 SER B 73 SER~? 1000.00 A 90 SER B 70 SER~? 1000.00 A 145 LYS B 8 LYS.? 1000.00 coo -3.31 40.95 15.56 -0.94 40.79 14.97 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 1.47 40.03 18.48 2.45 41.37 16.68 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 7.35 44.71 16.29 4.71 40.98 14.52 41.30 -30.41 16.51 39.51 -34.44 19.49 ULMN 3 1t7d_c00 SIGNAL PEPTIDASE I user 5 3 # 5 A 88 SER B 73 SER~? 1000.00 A 90 SER B 70 SER~? 1000.00 A 145 LYS B 42 LYS~? 1000.00 coo -3.31 40.95 15.56 -0.94 40.79 14.97 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 1.47 40.03 18.48 2.45 41.37 16.68 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 7.35 44.71 16.29 4.71 40.98 14.52 47.01 -26.65 9.40 48.95 -31.25 10.40 1t7d_c00 source 1t7d SIGNAL PEPTIDASE I : 5 hits 1t7d_c00 naa= 3 ULMN 3 1t7d_c01 SIGNAL PEPTIDASE I user 1 3 # 1 B 88 SER A 70 SER~? 1000.00 B 90 SER A 39 SER~? 1000.00 B 145 LYS A 8 LYS.? 1000.00 coo 61.01 10.03 12.97 58.78 10.97 12.69 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 56.85 12.22 16.37 55.62 11.34 14.45 44.91 -4.59 1.85 47.19 -3.74 1.94 coo 49.80 9.51 14.88 53.14 11.99 12.77 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1t7d_c01 SIGNAL PEPTIDASE I user 2 3 # 2 B 88 SER A 73 SER~? 1000.00 B 90 SER A 70 SER~? 1000.00 B 145 LYS A 8 LYS.? 1000.00 coo 61.01 10.03 12.97 58.78 10.97 12.69 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo 56.85 12.22 16.37 55.62 11.34 14.45 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 49.80 9.51 14.88 53.14 11.99 12.77 45.31 0.72 -1.08 48.07 3.21 -5.30 ULMN 3 1t7d_c01 SIGNAL PEPTIDASE I user 3 3 # 3 B 88 SER A 73 SER~? 1000.00 B 90 SER A 70 SER~? 1000.00 B 145 LYS A 42 LYS~? 1000.00 coo 61.01 10.03 12.97 58.78 10.97 12.69 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo 56.85 12.22 16.37 55.62 11.34 14.45 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo 49.80 9.51 14.88 53.14 11.99 12.77 41.51 -4.01 6.86 46.63 -6.91 6.39 ULMN 3 1t7d_c01 SIGNAL PEPTIDASE I user 4 3 # 4 B 88 SER B 70 SER~? 1000.00 B 90 SER B 39 SER~? 1000.00 B 145 LYS B 8 LYS.? 1000.00 coo 61.01 10.03 12.97 58.78 10.97 12.69 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 56.85 12.22 16.37 55.62 11.34 14.45 46.85 -30.26 14.14 45.82 -32.43 13.84 coo 49.80 9.51 14.88 53.14 11.99 12.77 41.30 -30.41 16.51 39.51 -34.44 19.49 ULMN 3 1t7d_c01 SIGNAL PEPTIDASE I user 5 3 # 5 B 88 SER B 73 SER~? 1000.00 B 90 SER B 70 SER~? 1000.00 B 145 LYS B 8 LYS.? 1000.00 coo 61.01 10.03 12.97 58.78 10.97 12.69 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 56.85 12.22 16.37 55.62 11.34 14.45 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 49.80 9.51 14.88 53.14 11.99 12.77 41.30 -30.41 16.51 39.51 -34.44 19.49 ULMN 3 1t7d_c01 SIGNAL PEPTIDASE I user 6 3 # 6 B 88 SER B 73 SER~? 1000.00 B 90 SER B 70 SER~? 1000.00 B 145 LYS B 42 LYS~? 1000.00 coo 61.01 10.03 12.97 58.78 10.97 12.69 53.55 -25.74 18.00 51.29 -26.56 18.42 coo 56.85 12.22 16.37 55.62 11.34 14.45 48.76 -24.45 18.03 46.63 -25.35 18.72 coo 49.80 9.51 14.88 53.14 11.99 12.77 47.01 -26.65 9.40 48.95 -31.25 10.40 1t7d_c01 source 1t7d SIGNAL PEPTIDASE I : 6 hits 1t7d_c01 naa= 3 ULMN 3 1thg_c00 LIPASE (E.C.3.1.1.3) TRIACYLGLYCEROLuser 1 3 # 1 217 SER A 77 SER~? 1000.00 354 GLU A 68 GLU~? 1000.00 463 HIS A 78 HIS~? 1000.00 coo 48.87 13.74 2.81 48.49 11.54 3.93 32.56 -10.06 6.91 30.65 -10.82 8.21 coo 39.95 14.43 3.01 41.55 14.10 1.63 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 43.90 10.50 2.81 45.63 11.48 3.27 29.48 -7.00 4.25 30.06 -7.33 2.26 ULMN 3 1thg_c00 LIPASE (E.C.3.1.1.3) TRIACYLGLYCEROLuser 2 3 # 2 217 SER B 77 SER~? 1000.00 354 GLU B 68 GLU~? 1000.00 463 HIS B 78 HIS~? 1000.00 coo 48.87 13.74 2.81 48.49 11.54 3.93 53.69 -18.22 10.70 56.03 -18.39 10.07 coo 39.95 14.43 3.01 41.55 14.10 1.63 49.52 -17.32 19.57 50.21 -16.89 17.61 coo 43.90 10.50 2.81 45.63 11.48 3.27 50.43 -14.84 12.90 50.32 -15.37 14.93 1thg_c00 source 1thg LIPASE (E.C.3.1.1.3) TRIACYLGLYCEROL HYDROLASE: 2 hits 1thg_c00 naa= 3 ULMN 3 1uaq_c00 CYTOSINE DEAMINASE user 1 3 # 1 A 64 GLU A 68 GLU~? 1000.00 A 89 SER A 70 SER~? 1000.00 A 91 CYH A 67 CYH^? 1000.00 coo -18.27 -3.12 10.92 -16.30 -3.26 10.07 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo -16.83 -3.83 3.62 -17.28 -5.61 2.05 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo -13.84 -8.33 7.58 -13.00 -8.13 10.24 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1uaq_c00 CYTOSINE DEAMINASE user 2 3 # 2 A 64 GLU A 68 GLU~? 1000.00 A 89 SER A 90 SER~? 1000.00 A 91 CYH A 67 CYH^? 1000.00 coo -18.27 -3.12 10.92 -16.30 -3.26 10.07 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo -16.83 -3.83 3.62 -17.28 -5.61 2.05 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo -13.84 -8.33 7.58 -13.00 -8.13 10.24 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1uaq_c00 CYTOSINE DEAMINASE user 3 3 # 3 A 64 GLU A 94 GLU~? 1000.00 A 89 SER A 90 SER~? 1000.00 A 91 CYH A 67 CYH^? 1000.00 coo -18.27 -3.12 10.92 -16.30 -3.26 10.07 33.73 4.64 -5.66 31.71 5.23 -5.97 coo -16.83 -3.83 3.62 -17.28 -5.61 2.05 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo -13.84 -8.33 7.58 -13.00 -8.13 10.24 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1uaq_c00 CYTOSINE DEAMINASE user 4 3 # 4 A 64 GLU B 68 GLU~? 1000.00 A 89 SER B 70 SER~? 1000.00 A 91 CYH B 67 CYH^? 1000.00 coo -18.27 -3.12 10.92 -16.30 -3.26 10.07 49.52 -17.32 19.57 50.21 -16.89 17.61 coo -16.83 -3.83 3.62 -17.28 -5.61 2.05 48.76 -24.45 18.03 46.63 -25.35 18.72 coo -13.84 -8.33 7.58 -13.00 -8.13 10.24 44.74 -21.15 18.29 45.66 -22.86 20.37 ULMN 3 1uaq_c00 CYTOSINE DEAMINASE user 5 3 # 5 A 64 GLU B 68 GLU~? 1000.00 A 89 SER B 90 SER~? 1000.00 A 91 CYH B 67 CYH^? 1000.00 coo -18.27 -3.12 10.92 -16.30 -3.26 10.07 49.52 -17.32 19.57 50.21 -16.89 17.61 coo -16.83 -3.83 3.62 -17.28 -5.61 2.05 44.56 -20.57 23.40 44.28 -22.26 25.12 coo -13.84 -8.33 7.58 -13.00 -8.13 10.24 44.74 -21.15 18.29 45.66 -22.86 20.37 ULMN 3 1uaq_c00 CYTOSINE DEAMINASE user 6 3 # 6 A 64 GLU B 94 GLU~? 1000.00 A 89 SER B 90 SER~? 1000.00 A 91 CYH B 67 CYH^? 1000.00 coo -18.27 -3.12 10.92 -16.30 -3.26 10.07 37.91 -18.85 21.91 37.52 -16.89 22.58 coo -16.83 -3.83 3.62 -17.28 -5.61 2.05 44.56 -20.57 23.40 44.28 -22.26 25.12 coo -13.84 -8.33 7.58 -13.00 -8.13 10.24 44.74 -21.15 18.29 45.66 -22.86 20.37 1uaq_c00 source 1uaq CYTOSINE DEAMINASE : 6 hits 1uaq_c00 naa= 3 ULMN 3 1uaq_c01 CYTOSINE DEAMINASE user 1 3 # 1 B 64 GLU A 68 GLU~? 1000.00 B 89 SER A 70 SER~? 1000.00 B 91 CYH A 67 CYH^? 1000.00 coo -13.67 -17.67 21.70 -15.74 -17.78 22.24 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo -17.71 -23.81 20.93 -18.57 -24.92 18.94 38.84 -6.45 -1.32 39.90 -4.51 -2.28 coo -20.38 -18.31 18.13 -20.06 -15.64 18.96 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1uaq_c01 CYTOSINE DEAMINASE user 2 3 # 2 B 64 GLU A 68 GLU~? 1000.00 B 89 SER A 90 SER~? 1000.00 B 91 CYH A 67 CYH^? 1000.00 coo -13.67 -17.67 21.70 -15.74 -17.78 22.24 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo -17.71 -23.81 20.93 -18.57 -24.92 18.94 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo -20.38 -18.31 18.13 -20.06 -15.64 18.96 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1uaq_c01 CYTOSINE DEAMINASE user 3 3 # 3 B 64 GLU A 94 GLU~? 1000.00 B 89 SER A 90 SER~? 1000.00 B 91 CYH A 67 CYH^? 1000.00 coo -13.67 -17.67 21.70 -15.74 -17.78 22.24 33.73 4.64 -5.66 31.71 5.23 -5.97 coo -17.71 -23.81 20.93 -18.57 -24.92 18.94 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo -20.38 -18.31 18.13 -20.06 -15.64 18.96 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 1uaq_c01 CYTOSINE DEAMINASE user 4 3 # 4 B 64 GLU B 68 GLU~? 1000.00 B 89 SER B 70 SER~? 1000.00 B 91 CYH B 67 CYH^? 1000.00 coo -13.67 -17.67 21.70 -15.74 -17.78 22.24 49.52 -17.32 19.57 50.21 -16.89 17.61 coo -17.71 -23.81 20.93 -18.57 -24.92 18.94 48.76 -24.45 18.03 46.63 -25.35 18.72 coo -20.38 -18.31 18.13 -20.06 -15.64 18.96 44.74 -21.15 18.29 45.66 -22.86 20.37 ULMN 3 1uaq_c01 CYTOSINE DEAMINASE user 5 3 # 5 B 64 GLU B 68 GLU~? 1000.00 B 89 SER B 90 SER~? 1000.00 B 91 CYH B 67 CYH^? 1000.00 coo -13.67 -17.67 21.70 -15.74 -17.78 22.24 49.52 -17.32 19.57 50.21 -16.89 17.61 coo -17.71 -23.81 20.93 -18.57 -24.92 18.94 44.56 -20.57 23.40 44.28 -22.26 25.12 coo -20.38 -18.31 18.13 -20.06 -15.64 18.96 44.74 -21.15 18.29 45.66 -22.86 20.37 ULMN 3 1uaq_c01 CYTOSINE DEAMINASE user 6 3 # 6 B 64 GLU B 94 GLU~? 1000.00 B 89 SER B 90 SER~? 1000.00 B 91 CYH B 67 CYH^? 1000.00 coo -13.67 -17.67 21.70 -15.74 -17.78 22.24 37.91 -18.85 21.91 37.52 -16.89 22.58 coo -17.71 -23.81 20.93 -18.57 -24.92 18.94 44.56 -20.57 23.40 44.28 -22.26 25.12 coo -20.38 -18.31 18.13 -20.06 -15.64 18.96 44.74 -21.15 18.29 45.66 -22.86 20.37 1uaq_c01 source 1uaq CYTOSINE DEAMINASE : 6 hits 1uaq_c01 naa= 3 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 47 ASP.? 1000.00 218 GLU A 101 GLU~? 1000.00 329 ASP A 79 ASP~? 1000.00 coo 49.16 35.16 15.19 51.08 34.43 15.65 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 70.09 11.71 8.46 70.56 12.89 6.77 30.15 10.80 -12.01 29.56 9.58 -10.37 coo 59.16 37.82 13.95 57.63 37.03 15.12 29.04 -9.02 10.71 27.15 -9.65 10.03 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 49 ASP.? 1000.00 218 GLU A 101 GLU~? 1000.00 329 ASP A 11 ASP~? 1000.00 coo 49.16 35.16 15.19 51.08 34.43 15.65 45.31 0.34 15.16 45.91 -1.47 16.07 coo 70.09 11.71 8.46 70.56 12.89 6.77 30.15 10.80 -12.01 29.56 9.58 -10.37 coo 59.16 37.82 13.95 57.63 37.03 15.12 52.21 -0.96 5.64 52.68 -0.78 3.58 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP B 49 ASP.? 1000.00 218 GLU B 101 GLU~? 1000.00 329 ASP B 11 ASP~? 1000.00 coo 49.16 35.16 15.19 51.08 34.43 15.65 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo 70.09 11.71 8.46 70.56 12.89 6.77 31.45 -15.60 28.20 32.65 -14.70 26.72 coo 59.16 37.82 13.95 57.63 37.03 15.12 42.92 -37.03 9.64 45.02 -37.19 9.59 1uok_c04 source 1uok OLIGO-1,6-GLUCOSIDASE : 3 hits 1uok_c04 naa= 3 ULMN 3 2ace_c00 ACETYLCHOLINESTERASE user 1 3 # 1 200 SER A 77 SER~? 1000.00 327 GLU A 68 GLU~? 1000.00 440 HIS A 78 HIS~? 1000.00 coo 6.96 64.04 57.84 6.74 63.69 60.26 32.56 -10.06 6.91 30.65 -10.82 8.21 coo 14.82 64.63 62.37 13.47 65.72 61.17 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 9.52 66.51 63.07 8.75 65.02 61.81 29.48 -7.00 4.25 30.06 -7.33 2.26 ULMN 3 2ace_c00 ACETYLCHOLINESTERASE user 2 3 # 2 200 SER B 77 SER~? 1000.00 327 GLU B 68 GLU~? 1000.00 440 HIS B 78 HIS~? 1000.00 coo 6.96 64.04 57.84 6.74 63.69 60.26 53.69 -18.22 10.70 56.03 -18.39 10.07 coo 14.82 64.63 62.37 13.47 65.72 61.17 49.52 -17.32 19.57 50.21 -16.89 17.61 coo 9.52 66.51 63.07 8.75 65.02 61.81 50.43 -14.84 12.90 50.32 -15.37 14.93 2ace_c00 source 2ace ACETYLCHOLINESTERASE : 2 hits 2ace_c00 naa= 3 ULMN 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 1 3 # 1 A 43 ASP A 79 ASP~? 1000.00 A 48 HIS A 78 HIS~? 1000.00 A 77 LYS B 59 LYS~? 1000.00 coo 13.04 30.41 72.50 12.95 30.65 70.36 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 12.77 23.50 68.33 13.58 25.42 68.49 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 7.53 29.84 65.06 12.29 29.41 67.79 30.97 -15.57 3.92 34.16 -17.16 -0.27 ULMN 3 2acu_c01 ALDOSE REDUCTASE (E.C.1.1.1.21) MUTAuser 2 3 # 2 A 43 ASP A 79 ASP~? 1000.00 A 48 HIS A 78 HIS~? 1000.00 A 77 LYS B 60 LYS~? 1000.00 coo 13.04 30.41 72.50 12.95 30.65 70.36 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 12.77 23.50 68.33 13.58 25.42 68.49 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 7.53 29.84 65.06 12.29 29.41 67.79 28.11 -17.10 5.89 27.12 -20.73 2.18 2acu_c01 source 2acu ALDOSE REDUCTASE (E.C.1.1.1.21) MUTANT WITH TY: 2 hits 2acu_c01 naa= 3 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 37 HIS.? 1000.00 B 50 GLU A 33 GLU^? 1000.00 B 113 GLN A 6 GLN^? 1000.00 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 43.42 4.45 -4.29 44.63 4.11 -6.01 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS A 37 HIS.? 1000.00 B 50 GLU A 68 GLU~? 1000.00 B 113 GLN A 38 GLN~? 1000.00 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 44.60 -3.31 -3.72 46.52 -2.95 -4.59 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 3 3 # 3 B 29 HIS B 37 HIS.? 1000.00 B 50 GLU B 33 GLU^? 1000.00 B 113 GLN B 6 GLN^? 1000.00 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 37.40 -28.66 19.69 37.54 -29.92 21.40 2ag0_c04 source 2ag0 BENZALDEHYDE LYASE : 3 hits 2ag0_c04 naa= 3 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 37 HIS.? 1000.00 B 50 GLU A 33 GLU^? 1000.00 B 113 GLN A 6 GLN^? 1000.00 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 43.42 4.45 -4.29 44.63 4.11 -6.01 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS A 37 HIS.? 1000.00 B 50 GLU A 68 GLU~? 1000.00 B 113 GLN A 38 GLN~? 1000.00 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 44.60 -3.31 -3.72 46.52 -2.95 -4.59 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 3 3 # 3 B 29 HIS B 37 HIS.? 1000.00 B 50 GLU B 33 GLU^? 1000.00 B 113 GLN B 6 GLN^? 1000.00 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 37.40 -28.66 19.69 37.54 -29.92 21.40 2ag0_c08 source 2ag0 BENZALDEHYDE LYASE : 3 hits 2ag0_c08 naa= 3 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 1 3 # 1 A 29 HIS A 37 HIS.? 1000.00 A 50 GLU A 33 GLU^? 1000.00 A 113 GLN A 6 GLN^? 1000.00 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 43.42 4.45 -4.29 44.63 4.11 -6.01 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 2 3 # 2 A 29 HIS A 37 HIS.? 1000.00 A 50 GLU A 68 GLU~? 1000.00 A 113 GLN A 38 GLN~? 1000.00 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 44.60 -3.31 -3.72 46.52 -2.95 -4.59 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 3 3 # 3 A 29 HIS B 37 HIS.? 1000.00 A 50 GLU B 33 GLU^? 1000.00 A 113 GLN B 6 GLN^? 1000.00 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 37.40 -28.66 19.69 37.54 -29.92 21.40 2ag0_c09 source 2ag0 BENZALDEHYDE LYASE : 3 hits 2ag0_c09 naa= 3 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 1 3 # 1 C 29 HIS A 37 HIS.? 1000.00 C 50 GLU A 33 GLU^? 1000.00 C 113 GLN A 6 GLN^? 1000.00 coo 74.92 8.52 28.42 74.88 6.86 29.70 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 65.25 15.95 28.73 65.73 15.63 30.78 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 70.80 6.73 32.72 71.88 8.55 32.53 43.42 4.45 -4.29 44.63 4.11 -6.01 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 2 3 # 2 C 29 HIS A 37 HIS.? 1000.00 C 50 GLU A 68 GLU~? 1000.00 C 113 GLN A 38 GLN~? 1000.00 coo 74.92 8.52 28.42 74.88 6.86 29.70 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 65.25 15.95 28.73 65.73 15.63 30.78 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 70.80 6.73 32.72 71.88 8.55 32.53 44.60 -3.31 -3.72 46.52 -2.95 -4.59 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 3 3 # 3 C 29 HIS B 37 HIS.? 1000.00 C 50 GLU B 33 GLU^? 1000.00 C 113 GLN B 6 GLN^? 1000.00 coo 74.92 8.52 28.42 74.88 6.86 29.70 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 65.25 15.95 28.73 65.73 15.63 30.78 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 70.80 6.73 32.72 71.88 8.55 32.53 37.40 -28.66 19.69 37.54 -29.92 21.40 2ag0_c10 source 2ag0 BENZALDEHYDE LYASE : 3 hits 2ag0_c10 naa= 3 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 1 3 # 1 D 29 HIS A 37 HIS.? 1000.00 D 50 GLU A 33 GLU^? 1000.00 D 113 GLN A 6 GLN^? 1000.00 coo 38.66 11.31 27.15 38.67 12.13 25.22 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 48.72 12.85 33.83 48.36 14.77 32.95 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 42.85 14.77 24.15 41.85 15.11 26.02 43.42 4.45 -4.29 44.63 4.11 -6.01 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 2 3 # 2 D 29 HIS A 37 HIS.? 1000.00 D 50 GLU A 68 GLU~? 1000.00 D 113 GLN A 38 GLN~? 1000.00 coo 38.66 11.31 27.15 38.67 12.13 25.22 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 48.72 12.85 33.83 48.36 14.77 32.95 31.73 -6.96 -2.64 30.98 -7.61 -0.78 coo 42.85 14.77 24.15 41.85 15.11 26.02 44.60 -3.31 -3.72 46.52 -2.95 -4.59 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 3 3 # 3 D 29 HIS B 37 HIS.? 1000.00 D 50 GLU B 33 GLU^? 1000.00 D 113 GLN B 6 GLN^? 1000.00 coo 38.66 11.31 27.15 38.67 12.13 25.22 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 48.72 12.85 33.83 48.36 14.77 32.95 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 42.85 14.77 24.15 41.85 15.11 26.02 37.40 -28.66 19.69 37.54 -29.92 21.40 2ag0_c11 source 2ag0 BENZALDEHYDE LYASE : 3 hits 2ag0_c11 naa= 3 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP A 11 ASP~? 1000.00 231 ASP A 26 ASP~? 1000.00 294 ASP A 49 ASP.? 1000.00 coo 27.89 102.52 14.98 29.35 101.92 13.57 52.21 -0.96 5.64 52.68 -0.78 3.58 coo 14.74 93.05 -1.00 14.30 94.22 0.73 44.41 22.27 3.14 45.59 23.72 2.16 coo 33.16 106.80 7.72 33.34 104.87 6.92 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 # 2 193 ASP B 11 ASP~? 1000.00 231 ASP B 26 ASP~? 1000.00 294 ASP B 49 ASP.? 1000.00 coo 27.89 102.52 14.98 29.35 101.92 13.57 42.92 -37.03 9.64 45.02 -37.19 9.59 coo 14.74 93.05 -1.00 14.30 94.22 0.73 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 33.16 106.80 7.72 33.34 104.87 6.92 42.86 -29.77 0.45 44.61 -30.51 -0.48 2amg_c06 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 2 hits 2amg_c06 naa= 3 ULMN 3 2bhg_c02 FOOT-AND-MOUTH DISEASE VIRUS 3C PROTuser 1 3 # 1 B 46 HIS A 37 HIS.? 1000.00 B 163 ALA A 40 ALA~? 1000.00 B 182 SER A 39 SER~? 1000.00 coo 30.42 1.98 4.36 29.07 0.41 4.68 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo 25.72 -4.33 3.52 26.60 -3.24 4.12 43.87 -1.17 3.12 43.94 0.15 2.33 coo 24.00 -0.17 2.07 24.51 1.00 0.04 44.91 -4.59 1.85 47.19 -3.74 1.94 ULMN 3 2bhg_c02 FOOT-AND-MOUTH DISEASE VIRUS 3C PROTuser 2 3 # 2 B 46 HIS B 37 HIS.? 1000.00 B 163 ALA B 40 ALA~? 1000.00 B 182 SER B 39 SER~? 1000.00 coo 30.42 1.98 4.36 29.07 0.41 4.68 42.39 -26.87 19.72 41.38 -28.37 20.76 coo 25.72 -4.33 3.52 26.60 -3.24 4.12 43.58 -28.94 12.69 42.22 -28.95 13.38 coo 24.00 -0.17 2.07 24.51 1.00 0.04 46.85 -30.26 14.14 45.82 -32.43 13.84 2bhg_c02 source 2bhg FOOT-AND-MOUTH DISEASE VIRUS 3C PROTEASE : 2 hits 2bhg_c02 naa= 3 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 1 3 # 1 C 14 ARG B 18 ARG~? 1000.00 C 161 ASP B 26 ASP~? 1000.00 C 174 TYR B 24 TYR~? 1000.00 coo 2.84 19.43 40.34 1.59 20.35 37.65 29.83 -33.72 4.49 28.68 -33.26 1.68 coo -0.62 11.10 28.05 -0.65 13.15 27.46 20.05 -27.91 11.23 18.50 -28.91 12.26 coo 5.94 13.28 27.17 3.53 13.05 28.58 24.95 -21.91 8.04 24.30 -19.58 6.61 2c7v_c10 source 2c7v PTERIDINE REDUCTASE : 1 hits 2c7v_c10 naa= 3 ULMN 3 2c7v_c11 PTERIDINE REDUCTASE user 1 3 # 1 D 14 ARG B 18 ARG~? 1000.00 D 161 ASP B 26 ASP~? 1000.00 D 174 TYR B 24 TYR~? 1000.00 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 29.83 -33.72 4.49 28.68 -33.26 1.68 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 20.05 -27.91 11.23 18.50 -28.91 12.26 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 24.95 -21.91 8.04 24.30 -19.58 6.61 2c7v_c11 source 2c7v PTERIDINE REDUCTASE : 1 hits 2c7v_c11 naa= 3 ULMN 3 2cpu_c01 ALPHA-AMYLASE user 1 3 # 1 A 197 ASP A 29 ASP.? 1000.00 A 233 GLU A 31 GLU^? 1000.00 A 300 ASN A 61 ASN.? 1000.00 coo 12.51 17.07 49.46 12.44 16.89 47.35 33.08 24.05 1.29 32.31 25.48 2.63 coo 6.52 19.14 48.16 7.77 18.42 46.61 31.17 16.72 -1.44 29.83 16.99 -3.04 coo 9.30 22.40 41.76 10.10 20.96 40.36 30.19 15.67 6.52 28.59 15.39 5.14 2cpu_c01 source 2cpu ALPHA-AMYLASE : 1 hits 2cpu_c01 naa= 3 ULMN 3 2dw7_c32 BLL6730 PROTEIN user 1 3 # 1 A 182 LYS A 12 LYS~? 1000.00 A 184 LYS A 8 LYS.? 1000.00 A 345 ASP A 49 ASP.? 1000.00 coo 5.98 42.76 7.73 10.19 38.62 9.02 50.37 3.30 4.84 54.03 3.09 -0.37 coo 2.77 37.17 4.99 6.33 34.76 8.06 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 0.07 40.30 18.65 -0.21 42.34 18.18 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c32 BLL6730 PROTEIN user 2 3 # 2 A 182 LYS B 12 LYS~? 1000.00 A 184 LYS B 8 LYS.? 1000.00 A 345 ASP B 49 ASP.? 1000.00 coo 5.98 42.76 7.73 10.19 38.62 9.02 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 2.77 37.17 4.99 6.33 34.76 8.06 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 0.07 40.30 18.65 -0.21 42.34 18.18 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c32 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c32 naa= 3 ULMN 3 2dw7_c33 BLL6730 PROTEIN user 1 3 # 1 B 182 LYS A 12 LYS~? 1000.00 B 184 LYS A 8 LYS.? 1000.00 B 345 ASP A 49 ASP.? 1000.00 coo 38.76 2.27 4.00 34.00 5.99 4.37 50.37 3.30 4.84 54.03 3.09 -0.37 coo 40.63 7.13 9.06 35.85 7.36 8.95 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 34.36 -6.33 13.69 36.02 -6.07 12.41 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c33 BLL6730 PROTEIN user 2 3 # 2 B 182 LYS A 46 LYS.? 1000.00 B 184 LYS A 42 LYS~? 1000.00 B 345 ASP A 56 ASP~? 1000.00 coo 38.76 2.27 4.00 34.00 5.99 4.37 35.76 -2.84 14.03 29.74 -4.84 14.37 coo 40.63 7.13 9.06 35.85 7.36 8.95 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 34.36 -6.33 13.69 36.02 -6.07 12.41 37.70 11.70 13.69 37.98 13.80 13.68 ULMN 3 2dw7_c33 BLL6730 PROTEIN user 3 3 # 3 B 182 LYS B 12 LYS~? 1000.00 B 184 LYS B 8 LYS.? 1000.00 B 345 ASP B 49 ASP.? 1000.00 coo 38.76 2.27 4.00 34.00 5.99 4.37 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 40.63 7.13 9.06 35.85 7.36 8.95 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 34.36 -6.33 13.69 36.02 -6.07 12.41 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c33 source 2dw7 BLL6730 PROTEIN : 3 hits 2dw7_c33 naa= 3 ULMN 3 2dw7_c34 BLL6730 PROTEIN user 1 3 # 1 C 182 LYS A 12 LYS~? 1000.00 C 184 LYS A 8 LYS.? 1000.00 C 345 ASP A 49 ASP.? 1000.00 coo -5.66 12.40 71.13 -2.66 9.98 66.50 50.37 3.30 4.84 54.03 3.09 -0.37 coo 0.95 12.72 73.51 1.58 12.72 68.31 45.31 0.72 -1.08 48.07 3.21 -5.30 coo -4.59 24.28 66.67 -6.26 24.34 67.99 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c34 BLL6730 PROTEIN user 2 3 # 2 C 182 LYS B 12 LYS~? 1000.00 C 184 LYS B 8 LYS.? 1000.00 C 345 ASP B 49 ASP.? 1000.00 coo -5.66 12.40 71.13 -2.66 9.98 66.50 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 0.95 12.72 73.51 1.58 12.72 68.31 41.30 -30.41 16.51 39.51 -34.44 19.49 coo -4.59 24.28 66.67 -6.26 24.34 67.99 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c34 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c34 naa= 3 ULMN 3 2dw7_c35 BLL6730 PROTEIN user 1 3 # 1 D 182 LYS A 12 LYS~? 1000.00 D 184 LYS A 8 LYS.? 1000.00 D 345 ASP A 49 ASP.? 1000.00 coo 29.31 -12.29 40.88 26.50 -8.82 44.94 50.37 3.30 4.84 54.03 3.09 -0.37 coo 23.25 -10.73 37.68 24.08 -6.91 41.08 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 35.01 -2.71 35.14 36.51 -4.14 34.87 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c35 BLL6730 PROTEIN user 2 3 # 2 D 182 LYS B 12 LYS~? 1000.00 D 184 LYS B 8 LYS.? 1000.00 D 345 ASP B 49 ASP.? 1000.00 coo 29.31 -12.29 40.88 26.50 -8.82 44.94 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 23.25 -10.73 37.68 24.08 -6.91 41.08 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 35.01 -2.71 35.14 36.51 -4.14 34.87 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c35 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c35 naa= 3 ULMN 3 2dw7_c36 BLL6730 PROTEIN user 1 3 # 1 E 182 LYS A 12 LYS~? 1000.00 E 184 LYS A 8 LYS.? 1000.00 E 345 ASP A 49 ASP.? 1000.00 coo -21.16 62.58 121.86 -16.35 60.33 119.23 50.37 3.30 4.84 54.03 3.09 -0.37 coo -23.22 55.98 120.74 -18.11 55.31 120.43 45.31 0.72 -1.08 48.07 3.21 -5.30 coo -17.15 59.71 133.33 -17.96 61.54 134.01 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c36 BLL6730 PROTEIN user 2 3 # 2 E 182 LYS B 12 LYS~? 1000.00 E 184 LYS B 8 LYS.? 1000.00 E 345 ASP B 49 ASP.? 1000.00 coo -21.16 62.58 121.86 -16.35 60.33 119.23 38.84 -34.95 10.33 37.98 -38.40 15.60 coo -23.22 55.98 120.74 -18.11 55.31 120.43 41.30 -30.41 16.51 39.51 -34.44 19.49 coo -17.15 59.71 133.33 -17.96 61.54 134.01 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c36 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c36 naa= 3 ULMN 3 2dw7_c37 BLL6730 PROTEIN user 1 3 # 1 F 182 LYS B 12 LYS~? 1000.00 F 184 LYS B 8 LYS.? 1000.00 F 345 ASP B 49 ASP.? 1000.00 coo 10.64 34.02 91.30 6.30 35.60 95.11 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 13.75 39.76 94.12 11.42 37.23 97.89 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 16.35 26.90 99.56 16.81 25.90 97.75 42.86 -29.77 0.45 44.61 -30.51 -0.48 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 B 12 LYS~? 1000.00 G 184 LYS B 8 LYS.? 1000.00 G 345 ASP B 49 ASP.? 1000.00 coo 39.68 42.04 76.11 43.42 46.43 74.96 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 36.69 47.69 78.93 39.38 50.40 75.35 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 33.43 44.37 65.47 33.10 42.30 65.37 42.86 -29.77 0.45 44.61 -30.51 -0.48 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 12 LYS~? 1000.00 H 184 LYS A 8 LYS.? 1000.00 H 345 ASP A 49 ASP.? 1000.00 coo 71.58 83.18 80.51 66.88 79.77 79.84 50.37 3.30 4.84 54.03 3.09 -0.37 coo 73.65 78.64 75.66 68.14 79.07 75.04 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 67.43 90.73 71.39 68.27 92.30 72.52 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c39 BLL6730 PROTEIN user 2 3 # 2 H 182 LYS B 12 LYS~? 1000.00 H 184 LYS B 8 LYS.? 1000.00 H 345 ASP B 49 ASP.? 1000.00 coo 71.58 83.18 80.51 66.88 79.77 79.84 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 73.65 78.64 75.66 68.14 79.07 75.04 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 67.43 90.73 71.39 68.27 92.30 72.52 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c39 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c39 naa= 3 ULMN 3 2dw7_c40 BLL6730 PROTEIN user 1 3 # 1 I 182 LYS A 12 LYS~? 1000.00 I 184 LYS A 8 LYS.? 1000.00 I 345 ASP A 49 ASP.? 1000.00 coo 60.20 96.92 42.53 57.60 93.13 38.67 50.37 3.30 4.84 54.03 3.09 -0.37 coo 54.31 95.46 46.01 55.34 91.59 42.65 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 66.35 87.81 48.53 68.10 89.01 48.77 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c40 BLL6730 PROTEIN user 2 3 # 2 I 182 LYS B 12 LYS~? 1000.00 I 184 LYS B 8 LYS.? 1000.00 I 345 ASP B 49 ASP.? 1000.00 coo 60.20 96.92 42.53 57.60 93.13 38.67 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 54.31 95.46 46.01 55.34 91.59 42.65 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 66.35 87.81 48.53 68.10 89.01 48.77 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c40 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c40 naa= 3 ULMN 3 2dw7_c41 BLL6730 PROTEIN user 1 3 # 1 J 182 LYS A 12 LYS~? 1000.00 J 184 LYS A 8 LYS.? 1000.00 J 345 ASP A 49 ASP.? 1000.00 coo 25.22 70.55 14.03 27.64 73.07 18.65 50.37 3.30 4.84 54.03 3.09 -0.37 coo 31.73 69.87 11.50 32.73 70.19 16.40 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 25.87 58.42 18.79 23.95 58.54 17.90 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c41 BLL6730 PROTEIN user 2 3 # 2 J 182 LYS B 12 LYS~? 1000.00 J 184 LYS B 8 LYS.? 1000.00 J 345 ASP B 49 ASP.? 1000.00 coo 25.22 70.55 14.03 27.64 73.07 18.65 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 31.73 69.87 11.50 32.73 70.19 16.40 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 25.87 58.42 18.79 23.95 58.54 17.90 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c41 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c41 naa= 3 ULMN 3 2dw7_c42 BLL6730 PROTEIN user 1 3 # 1 K 182 LYS A 12 LYS~? 1000.00 K 184 LYS A 8 LYS.? 1000.00 K 345 ASP A 49 ASP.? 1000.00 coo 51.91 50.98 -7.18 47.83 49.38 -11.15 50.37 3.30 4.84 54.03 3.09 -0.37 coo 54.95 45.24 -9.88 51.94 46.65 -13.66 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 58.09 58.36 -15.39 58.48 59.93 -14.05 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c42 BLL6730 PROTEIN user 2 3 # 2 K 182 LYS B 12 LYS~? 1000.00 K 184 LYS B 8 LYS.? 1000.00 K 345 ASP B 49 ASP.? 1000.00 coo 51.91 50.98 -7.18 47.83 49.38 -11.15 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 54.95 45.24 -9.88 51.94 46.65 -13.66 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 58.09 58.36 -15.39 58.48 59.93 -14.05 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c42 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c42 naa= 3 ULMN 3 2dw7_c43 BLL6730 PROTEIN user 1 3 # 1 L 182 LYS A 12 LYS~? 1000.00 L 184 LYS A 8 LYS.? 1000.00 L 345 ASP A 49 ASP.? 1000.00 coo 20.72 21.86 -37.85 25.46 24.17 -34.95 50.37 3.30 4.84 54.03 3.09 -0.37 coo 18.47 28.51 -37.00 23.90 28.36 -37.29 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 25.62 23.75 -50.41 24.07 23.21 -49.03 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c43 BLL6730 PROTEIN user 2 3 # 2 L 182 LYS B 12 LYS~? 1000.00 L 184 LYS B 8 LYS.? 1000.00 L 345 ASP B 49 ASP.? 1000.00 coo 20.72 21.86 -37.85 25.46 24.17 -34.95 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 18.47 28.51 -37.00 23.90 28.36 -37.29 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 25.62 23.75 -50.41 24.07 23.21 -49.03 42.86 -29.77 0.45 44.61 -30.51 -0.48 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 12 LYS~? 1000.00 M 184 LYS A 8 LYS.? 1000.00 M 345 ASP A 49 ASP.? 1000.00 coo -16.84 -32.78 53.48 -13.51 -32.22 58.34 50.37 3.30 4.84 54.03 3.09 -0.37 coo -11.12 -36.54 51.97 -12.06 -36.49 56.95 45.31 0.72 -1.08 48.07 3.21 -5.30 coo -23.86 -43.59 58.54 -23.60 -42.14 57.00 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c44 BLL6730 PROTEIN user 2 3 # 2 M 182 LYS B 12 LYS~? 1000.00 M 184 LYS B 8 LYS.? 1000.00 M 345 ASP B 49 ASP.? 1000.00 coo -16.84 -32.78 53.48 -13.51 -32.22 58.34 38.84 -34.95 10.33 37.98 -38.40 15.60 coo -11.12 -36.54 51.97 -12.06 -36.49 56.95 41.30 -30.41 16.51 39.51 -34.44 19.49 coo -23.86 -43.59 58.54 -23.60 -42.14 57.00 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c44 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c44 naa= 3 ULMN 3 2dw7_c46 BLL6730 PROTEIN user 1 3 # 1 O 182 LYS A 12 LYS~? 1000.00 O 184 LYS A 8 LYS.? 1000.00 O 345 ASP A 49 ASP.? 1000.00 coo 54.57 -51.89 -4.22 51.14 -49.62 0.15 50.37 3.30 4.84 54.03 3.09 -0.37 coo 48.40 -53.90 -6.78 48.57 -49.84 -4.13 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 54.15 -41.12 -10.77 56.24 -41.47 -10.94 45.31 0.34 15.16 45.91 -1.47 16.07 ULMN 3 2dw7_c46 BLL6730 PROTEIN user 2 3 # 2 O 182 LYS B 12 LYS~? 1000.00 O 184 LYS B 8 LYS.? 1000.00 O 345 ASP B 49 ASP.? 1000.00 coo 54.57 -51.89 -4.22 51.14 -49.62 0.15 38.84 -34.95 10.33 37.98 -38.40 15.60 coo 48.40 -53.90 -6.78 48.57 -49.84 -4.13 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 54.15 -41.12 -10.77 56.24 -41.47 -10.94 42.86 -29.77 0.45 44.61 -30.51 -0.48 2dw7_c46 source 2dw7 BLL6730 PROTEIN : 2 hits 2dw7_c46 naa= 3 ULMN 3 2esd_c00 1.02.01.0009 user 1 3 # 1 A 154 ASN A 69 ASN~? 1000.00 A 250 ALA A 40 ALA~? 1000.00 A 284 CYH A 67 CYH^? 1000.00 coo -98.31 19.25 26.95 -99.27 21.10 26.57 36.86 -6.86 -5.26 35.56 -6.98 -6.93 coo -102.90 29.72 23.02 -103.69 28.50 23.43 43.87 -1.17 3.12 43.94 0.15 2.33 coo -98.59 26.45 29.50 -99.24 25.73 26.84 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 2esd_c00 1.02.01.0009 user 2 3 # 2 A 154 ASN B 69 ASN~? 1000.00 A 250 ALA B 40 ALA~? 1000.00 A 284 CYH B 67 CYH^? 1000.00 coo -98.31 19.25 26.95 -99.27 21.10 26.57 48.97 -22.65 22.06 48.94 -21.42 23.79 coo -102.90 29.72 23.02 -103.69 28.50 23.43 43.58 -28.94 12.69 42.22 -28.95 13.38 coo -98.59 26.45 29.50 -99.24 25.73 26.84 44.74 -21.15 18.29 45.66 -22.86 20.37 2esd_c00 source 2esd 1.02.01.0009 : 2 hits 2esd_c00 naa= 3 ULMN 3 2esd_c01 1.02.01.0009 user 1 3 # 1 B 154 ASN A 69 ASN~? 1000.00 B 250 ALA A 40 ALA~? 1000.00 B 284 CYH A 67 CYH^? 1000.00 coo -116.62 58.12 2.11 -116.17 56.24 3.01 36.86 -6.86 -5.26 35.56 -6.98 -6.93 coo -114.20 47.61 7.65 -114.88 48.80 8.33 43.87 -1.17 3.12 43.94 0.15 2.33 coo -118.73 50.90 1.30 -116.61 51.76 2.87 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 2esd_c01 1.02.01.0009 user 2 3 # 2 B 154 ASN B 69 ASN~? 1000.00 B 250 ALA B 40 ALA~? 1000.00 B 284 CYH B 67 CYH^? 1000.00 coo -116.62 58.12 2.11 -116.17 56.24 3.01 48.97 -22.65 22.06 48.94 -21.42 23.79 coo -114.20 47.61 7.65 -114.88 48.80 8.33 43.58 -28.94 12.69 42.22 -28.95 13.38 coo -118.73 50.90 1.30 -116.61 51.76 2.87 44.74 -21.15 18.29 45.66 -22.86 20.37 2esd_c01 source 2esd 1.02.01.0009 : 2 hits 2esd_c01 naa= 3 ULMN 3 2esd_c02 1.02.01.0009 user 1 3 # 1 C 154 ASN A 69 ASN~? 1000.00 C 250 ALA A 40 ALA~? 1000.00 C 284 CYH A 67 CYH^? 1000.00 coo -155.36 18.42 28.93 -154.49 20.30 29.39 36.86 -6.86 -5.26 35.56 -6.98 -6.93 coo -150.95 29.02 32.87 -150.10 27.86 32.40 43.87 -1.17 3.12 43.94 0.15 2.33 coo -155.22 25.64 26.33 -154.78 25.20 29.09 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 2esd_c02 1.02.01.0009 user 2 3 # 2 C 154 ASN B 69 ASN~? 1000.00 C 250 ALA B 40 ALA~? 1000.00 C 284 CYH B 67 CYH^? 1000.00 coo -155.36 18.42 28.93 -154.49 20.30 29.39 48.97 -22.65 22.06 48.94 -21.42 23.79 coo -150.95 29.02 32.87 -150.10 27.86 32.40 43.58 -28.94 12.69 42.22 -28.95 13.38 coo -155.22 25.64 26.33 -154.78 25.20 29.09 44.74 -21.15 18.29 45.66 -22.86 20.37 2esd_c02 source 2esd 1.02.01.0009 : 2 hits 2esd_c02 naa= 3 ULMN 3 2esd_c03 1.02.01.0009 user 1 3 # 1 D 154 ASN A 69 ASN~? 1000.00 D 250 ALA A 40 ALA~? 1000.00 D 284 CYH A 67 CYH^? 1000.00 coo -138.05 57.23 54.59 -137.96 55.47 53.43 36.86 -6.86 -5.26 35.56 -6.98 -6.93 coo -139.97 46.71 48.80 -139.25 47.90 48.19 43.87 -1.17 3.12 43.94 0.15 2.33 coo -135.22 50.13 55.22 -137.25 50.94 53.65 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 2esd_c03 1.02.01.0009 user 2 3 # 2 D 154 ASN B 69 ASN~? 1000.00 D 250 ALA B 40 ALA~? 1000.00 D 284 CYH B 67 CYH^? 1000.00 coo -138.05 57.23 54.59 -137.96 55.47 53.43 48.97 -22.65 22.06 48.94 -21.42 23.79 coo -139.97 46.71 48.80 -139.25 47.90 48.19 43.58 -28.94 12.69 42.22 -28.95 13.38 coo -135.22 50.13 55.22 -137.25 50.94 53.65 44.74 -21.15 18.29 45.66 -22.86 20.37 2esd_c03 source 2esd 1.02.01.0009 : 2 hits 2esd_c03 naa= 3 ULMN 3 2f61_c01 ACID BETA-GLUCOSIDASE user 1 3 # 1 B 235 GLU A 33 GLU^? 1000.00 B 340 GLU A 94 GLU~? 1000.00 B 342 CYH A 67 CYH^? 1000.00 coo 41.63 98.81 4.74 43.45 99.80 5.19 33.95 8.51 -1.79 32.88 7.84 -3.49 coo 40.49 105.59 6.14 40.82 103.64 6.89 33.73 4.64 -5.66 31.71 5.23 -5.97 coo 45.58 109.64 7.60 45.90 106.93 8.23 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 2f61_c01 ACID BETA-GLUCOSIDASE user 2 3 # 2 B 235 GLU B 33 GLU^? 1000.00 B 340 GLU B 94 GLU~? 1000.00 B 342 CYH B 67 CYH^? 1000.00 coo 41.63 98.81 4.74 43.45 99.80 5.19 33.92 -18.51 17.58 34.21 -17.51 19.41 coo 40.49 105.59 6.14 40.82 103.64 6.89 37.91 -18.85 21.91 37.52 -16.89 22.58 coo 45.58 109.64 7.60 45.90 106.93 8.23 44.74 -21.15 18.29 45.66 -22.86 20.37 2f61_c01 source 2f61 ACID BETA-GLUCOSIDASE : 2 hits 2f61_c01 naa= 3 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 1 3 # 1 A 150 TYR A 24 TYR~? 1000.00 A 245 ASP A 26 ASP~? 1000.00 A 273 LYS A 2 LYS^? 1000.00 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 38.31 18.23 6.93 36.20 19.30 8.42 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 44.41 22.27 3.14 45.59 23.72 2.16 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 35.00 17.20 -4.95 29.82 18.43 -6.05 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 2 3 # 2 A 150 TYR B 24 TYR~? 1000.00 A 245 ASP B 26 ASP~? 1000.00 A 273 LYS B 2 LYS^? 1000.00 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 20.05 -27.91 11.23 18.50 -28.91 12.26 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 25.35 -19.21 20.13 23.65 -14.85 22.59 ULMN 3 2gsa_c02 GLUTAMATE SEMIALDEHYDE AMINOTRANSFERuser 3 3 # 3 A 150 TYR B 24 TYR~? 1000.00 A 245 ASP B 29 ASP.? 1000.00 A 273 LYS B 2 LYS^? 1000.00 coo 9.74 16.83 -36.21 11.10 17.13 -33.77 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 1.75 12.92 -36.29 2.66 14.31 -34.97 18.76 -16.66 13.02 17.62 -16.03 11.36 coo -0.09 22.51 -29.56 4.47 22.51 -33.59 25.35 -19.21 20.13 23.65 -14.85 22.59 2gsa_c02 source 2gsa GLUTAMATE SEMIALDEHYDE AMINOTRANSFERASE : 3 hits 2gsa_c02 naa= 3 ULMN 3 2hdh_c02 L-3-HYDROXYACYL COA DEHYDROGENASE user 1 3 # 1 B 137 SER A 77 SER~? 1000.00 B 158 HIS A 78 HIS~? 1000.00 B 208 ASN B 61 ASN.? 1000.00 coo 50.29 50.10 71.46 47.85 50.06 71.46 32.56 -10.06 6.91 30.65 -10.82 8.21 coo 48.67 45.40 71.68 47.67 46.90 70.60 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 48.91 49.12 65.17 47.29 49.14 66.54 27.99 -14.15 9.15 27.59 -12.59 7.76 2hdh_c02 source 2hdh L-3-HYDROXYACYL COA DEHYDROGENASE : 1 hits 2hdh_c02 naa= 3 ULMN 3 2jxr_c04 LIGAND CP-081282 user 1 3 # 1 A 32 ASP A 9 ASP~? 1000.00 A 35 SER A 39 SER~? 1000.00 A 215 ASP A 11 ASP~? 1000.00 coo -14.00 61.45 43.99 -14.19 63.14 42.84 49.66 0.41 0.84 50.15 0.20 -1.21 coo -13.21 66.21 45.84 -15.49 65.90 45.84 44.91 -4.59 1.85 47.19 -3.74 1.94 coo -10.72 64.19 37.77 -12.20 64.43 39.15 52.21 -0.96 5.64 52.68 -0.78 3.58 ULMN 3 2jxr_c04 LIGAND CP-081282 user 2 3 # 2 A 32 ASP B 9 ASP~? 1000.00 A 35 SER B 39 SER~? 1000.00 A 215 ASP B 11 ASP~? 1000.00 coo -14.00 61.45 43.99 -14.19 63.14 42.84 41.34 -34.74 14.44 41.31 -35.37 16.46 coo -13.21 66.21 45.84 -15.49 65.90 45.84 46.85 -30.26 14.14 45.82 -32.43 13.84 coo -10.72 64.19 37.77 -12.20 64.43 39.15 42.92 -37.03 9.64 45.02 -37.19 9.59 2jxr_c04 source 2jxr LIGAND CP-081282 : 2 hits 2jxr_c04 naa= 3 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 1 3 # 1 A 57 HIS A 78 HIS~? 1000.00 A 102 ASP A 79 ASP~? 1000.00 A 193 GLY A 66 GLY^? 1000.00 coo 14.96 29.22 19.55 15.62 29.93 17.67 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 19.64 30.69 22.61 18.18 29.94 21.25 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 14.54 28.99 9.76 15.06 29.59 10.02 35.16 0.03 1.24 34.60 0.21 0.65 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 2 3 # 2 A 57 HIS A 78 HIS~? 1000.00 A 102 ASP A 79 ASP~? 1000.00 A 193 GLY A 84 GLY.? 1000.00 coo 14.96 29.22 19.55 15.62 29.93 17.67 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 19.64 30.69 22.61 18.18 29.94 21.25 29.04 -9.02 10.71 27.15 -9.65 10.03 coo 14.54 28.99 9.76 15.06 29.59 10.02 28.24 3.53 8.75 28.74 2.92 8.51 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 3 3 # 3 A 57 HIS B 78 HIS~? 1000.00 A 102 ASP B 79 ASP~? 1000.00 A 193 GLY B 66 GLY^? 1000.00 coo 14.96 29.22 19.55 15.62 29.93 17.67 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 19.64 30.69 22.61 18.18 29.94 21.25 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 14.54 28.99 9.76 15.06 29.59 10.02 42.82 -20.03 15.19 42.57 -19.59 15.86 ULMN 3 2lpr_c02 ALPHA-LYTIC PROTEASE user 4 3 # 4 A 57 HIS B 78 HIS~? 1000.00 A 102 ASP B 79 ASP~? 1000.00 A 193 GLY B 84 GLY.? 1000.00 coo 14.96 29.22 19.55 15.62 29.93 17.67 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 19.64 30.69 22.61 18.18 29.94 21.25 53.02 -14.22 6.66 54.72 -15.42 7.04 coo 14.54 28.99 9.76 15.06 29.59 10.02 40.56 -13.02 8.08 41.12 -13.48 8.40 2lpr_c02 source 2lpr ALPHA-LYTIC PROTEASE : 4 hits 2lpr_c02 naa= 3 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 A 177 PHE A 10 PHE~? 1000.00 A 263 ASP A 49 ASP.? 1000.00 A 292 LYS A 46 LYS.? 1000.00 coo 51.51 50.32 16.39 52.13 49.68 13.75 46.85 -2.71 6.67 46.23 -2.84 9.40 coo 54.43 44.82 23.74 55.21 45.06 21.80 45.31 0.34 15.16 45.91 -1.47 16.07 coo 63.95 45.30 16.71 59.11 49.15 16.05 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 2oat_c03 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 A 177 PHE B 10 PHE~? 1000.00 A 263 ASP B 49 ASP.? 1000.00 A 292 LYS B 46 LYS.? 1000.00 coo 51.51 50.32 16.39 52.13 49.68 13.75 45.29 -31.86 9.15 45.77 -31.04 6.51 coo 54.43 44.82 23.74 55.21 45.06 21.80 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo 63.95 45.30 16.71 59.11 49.15 16.05 47.02 -20.54 2.38 49.97 -14.91 2.65 2oat_c03 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c03 naa= 3 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 B 177 PHE A 10 PHE~? 1000.00 B 263 ASP A 49 ASP.? 1000.00 B 292 LYS A 46 LYS.? 1000.00 coo 49.99 26.05 6.28 51.46 26.87 8.49 46.85 -2.71 6.67 46.23 -2.84 9.40 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 45.31 0.34 15.16 45.91 -1.47 16.07 coo 60.53 31.67 0.97 57.79 27.51 3.63 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 2oat_c04 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 B 177 PHE B 10 PHE~? 1000.00 B 263 ASP B 49 ASP.? 1000.00 B 292 LYS B 46 LYS.? 1000.00 coo 49.99 26.05 6.28 51.46 26.87 8.49 45.29 -31.86 9.15 45.77 -31.04 6.51 coo 49.07 31.32 -1.50 50.64 31.29 -0.07 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo 60.53 31.67 0.97 57.79 27.51 3.63 47.02 -20.54 2.38 49.97 -14.91 2.65 2oat_c04 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c04 naa= 3 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 1 3 # 1 C 177 PHE A 10 PHE~? 1000.00 C 263 ASP A 49 ASP.? 1000.00 C 292 LYS A 46 LYS.? 1000.00 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 46.85 -2.71 6.67 46.23 -2.84 9.40 coo 19.84 12.02 9.33 18.68 11.23 7.75 45.31 0.34 15.16 45.91 -1.47 16.07 coo 12.82 3.49 4.98 17.80 5.59 1.90 35.76 -2.84 14.03 29.74 -4.84 14.37 ULMN 3 2oat_c05 ORNITHINE AMINOTRANSFERASE user 2 3 # 2 C 177 PHE B 10 PHE~? 1000.00 C 263 ASP B 49 ASP.? 1000.00 C 292 LYS B 46 LYS.? 1000.00 coo 21.96 11.84 -0.03 20.04 11.74 -2.01 45.29 -31.86 9.15 45.77 -31.04 6.51 coo 19.84 12.02 9.33 18.68 11.23 7.75 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo 12.82 3.49 4.98 17.80 5.59 1.90 47.02 -20.54 2.38 49.97 -14.91 2.65 2oat_c05 source 2oat ORNITHINE AMINOTRANSFERASE : 2 hits 2oat_c05 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP A 9 ASP~? 1000.00 166 GLY A 93 GLY~? 1000.00 169 GLU A 101 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 49.66 0.41 0.84 50.15 0.20 -1.21 coo -8.58 13.22 3.21 -8.90 13.15 4.05 35.52 1.04 -10.46 35.76 1.47 -9.76 coo -16.67 7.89 2.78 -17.65 6.56 1.49 30.15 10.80 -12.01 29.56 9.58 -10.37 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 # 2 141 ASP A 47 ASP.? 1000.00 166 GLY A 66 GLY^? 1000.00 169 GLU A 33 GLU^? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 39.23 -5.09 16.44 39.94 -6.30 14.86 coo -8.58 13.22 3.21 -8.90 13.15 4.05 35.16 0.03 1.24 34.60 0.21 0.65 coo -16.67 7.89 2.78 -17.65 6.56 1.49 33.95 8.51 -1.79 32.88 7.84 -3.49 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 # 3 141 ASP A 47 ASP.? 1000.00 166 GLY A 66 GLY^? 1000.00 169 GLU A 94 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 39.23 -5.09 16.44 39.94 -6.30 14.86 coo -8.58 13.22 3.21 -8.90 13.15 4.05 35.16 0.03 1.24 34.60 0.21 0.65 coo -16.67 7.89 2.78 -17.65 6.56 1.49 33.73 4.64 -5.66 31.71 5.23 -5.97 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 # 4 141 ASP A 49 ASP.? 1000.00 166 GLY A 66 GLY^? 1000.00 169 GLU A 68 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 45.31 0.34 15.16 45.91 -1.47 16.07 coo -8.58 13.22 3.21 -8.90 13.15 4.05 35.16 0.03 1.24 34.60 0.21 0.65 coo -16.67 7.89 2.78 -17.65 6.56 1.49 31.73 -6.96 -2.64 30.98 -7.61 -0.78 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 5 3 # 5 141 ASP A 49 ASP.? 1000.00 166 GLY A 66 GLY^? 1000.00 169 GLU A 94 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 45.31 0.34 15.16 45.91 -1.47 16.07 coo -8.58 13.22 3.21 -8.90 13.15 4.05 35.16 0.03 1.24 34.60 0.21 0.65 coo -16.67 7.89 2.78 -17.65 6.56 1.49 33.73 4.64 -5.66 31.71 5.23 -5.97 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 6 3 # 6 141 ASP A 56 ASP~? 1000.00 166 GLY A 66 GLY^? 1000.00 169 GLU A 68 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 37.70 11.70 13.69 37.98 13.80 13.68 coo -8.58 13.22 3.21 -8.90 13.15 4.05 35.16 0.03 1.24 34.60 0.21 0.65 coo -16.67 7.89 2.78 -17.65 6.56 1.49 31.73 -6.96 -2.64 30.98 -7.61 -0.78 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 7 3 # 7 141 ASP A 79 ASP~? 1000.00 166 GLY B 66 GLY^? 1000.00 169 GLU B 68 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 29.04 -9.02 10.71 27.15 -9.65 10.03 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.82 -20.03 15.19 42.57 -19.59 15.86 coo -16.67 7.89 2.78 -17.65 6.56 1.49 49.52 -17.32 19.57 50.21 -16.89 17.61 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 8 3 # 8 141 ASP B 9 ASP~? 1000.00 166 GLY B 93 GLY~? 1000.00 169 GLU B 101 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 41.34 -34.74 14.44 41.31 -35.37 16.46 coo -8.58 13.22 3.21 -8.90 13.15 4.05 40.83 -21.48 26.74 40.43 -21.62 26.00 coo -16.67 7.89 2.78 -17.65 6.56 1.49 31.45 -15.60 28.20 32.65 -14.70 26.72 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 9 3 # 9 141 ASP B 11 ASP~? 1000.00 166 GLY B 66 GLY^? 1000.00 169 GLU B 68 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 42.92 -37.03 9.64 45.02 -37.19 9.59 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.82 -20.03 15.19 42.57 -19.59 15.86 coo -16.67 7.89 2.78 -17.65 6.56 1.49 49.52 -17.32 19.57 50.21 -16.89 17.61 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 10 3 # 10 141 ASP B 11 ASP~? 1000.00 166 GLY B 91 GLY~? 1000.00 169 GLU B 68 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 42.92 -37.03 9.64 45.02 -37.19 9.59 coo -8.58 13.22 3.21 -8.90 13.15 4.05 41.89 -22.47 21.50 42.09 -22.54 22.29 coo -16.67 7.89 2.78 -17.65 6.56 1.49 49.52 -17.32 19.57 50.21 -16.89 17.61 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 11 3 # 11 141 ASP B 47 ASP.? 1000.00 166 GLY B 66 GLY^? 1000.00 169 GLU B 33 GLU^? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 48.90 -24.15 -0.05 49.90 -25.19 1.49 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.82 -20.03 15.19 42.57 -19.59 15.86 coo -16.67 7.89 2.78 -17.65 6.56 1.49 33.92 -18.51 17.58 34.21 -17.51 19.41 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 12 3 # 12 141 ASP B 47 ASP.? 1000.00 166 GLY B 66 GLY^? 1000.00 169 GLU B 94 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 48.90 -24.15 -0.05 49.90 -25.19 1.49 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.82 -20.03 15.19 42.57 -19.59 15.86 coo -16.67 7.89 2.78 -17.65 6.56 1.49 37.91 -18.85 21.91 37.52 -16.89 22.58 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 13 3 # 13 141 ASP B 49 ASP.? 1000.00 166 GLY B 66 GLY^? 1000.00 169 GLU B 68 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.82 -20.03 15.19 42.57 -19.59 15.86 coo -16.67 7.89 2.78 -17.65 6.56 1.49 49.52 -17.32 19.57 50.21 -16.89 17.61 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 14 3 # 14 141 ASP B 49 ASP.? 1000.00 166 GLY B 66 GLY^? 1000.00 169 GLU B 94 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.82 -20.03 15.19 42.57 -19.59 15.86 coo -16.67 7.89 2.78 -17.65 6.56 1.49 37.91 -18.85 21.91 37.52 -16.89 22.58 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 15 3 # 15 141 ASP B 56 ASP~? 1000.00 166 GLY B 66 GLY^? 1000.00 169 GLU B 68 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 32.42 -21.29 1.64 30.34 -21.41 1.35 coo -8.58 13.22 3.21 -8.90 13.15 4.05 42.82 -20.03 15.19 42.57 -19.59 15.86 coo -16.67 7.89 2.78 -17.65 6.56 1.49 49.52 -17.32 19.57 50.21 -16.89 17.61 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 15 hits 2tdt_c00 naa= 3 ULMN 3 2tps_c00 THIAMIN PHOSPHATE SYNTHASE user 1 3 # 1 A 59 ARG A 97 ARG~? 1000.00 A 130 SER A 90 SER~? 1000.00 A 159 LYS A 98 LYS~? 1000.00 coo 18.35 45.84 20.99 16.20 47.83 21.89 30.73 3.85 -12.02 31.57 1.08 -11.03 coo 15.14 43.67 10.77 15.61 44.43 13.04 34.68 -2.41 -6.97 36.17 -2.30 -8.89 coo 11.57 48.49 22.18 13.51 49.99 17.21 33.88 9.40 -9.57 30.19 10.21 -6.88 ULMN 3 2tps_c00 THIAMIN PHOSPHATE SYNTHASE user 2 3 # 2 A 59 ARG B 97 ARG~? 1000.00 A 130 SER B 90 SER~? 1000.00 A 159 LYS B 98 LYS~? 1000.00 coo 18.35 45.84 20.99 16.20 47.83 21.89 37.89 -16.06 27.72 40.60 -17.32 27.02 coo 15.14 43.67 10.77 15.61 44.43 13.04 44.56 -20.57 23.40 44.28 -22.26 25.12 coo 11.57 48.49 22.18 13.51 49.99 17.21 32.73 -19.13 25.55 34.27 -15.53 22.56 2tps_c00 source 2tps THIAMIN PHOSPHATE SYNTHASE : 2 hits 2tps_c00 naa= 3 ULMN 3 2tps_c01 THIAMIN PHOSPHATE SYNTHASE user 1 3 # 1 B 59 ARG B 97 ARG~? 1000.00 B 130 SER B 90 SER~? 1000.00 B 159 LYS B 98 LYS~? 1000.00 coo 58.72 31.58 20.45 60.80 29.39 20.94 37.89 -16.06 27.72 40.60 -17.32 27.02 coo 61.66 35.17 10.39 61.29 34.14 12.56 44.56 -20.57 23.40 44.28 -22.26 25.12 coo 65.38 28.77 21.17 63.49 28.03 16.12 32.73 -19.13 25.55 34.27 -15.53 22.56 2tps_c01 source 2tps THIAMIN PHOSPHATE SYNTHASE : 1 hits 2tps_c01 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 22 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 46.65 17.32 5.68 48.04 16.96 7.27 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 25 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 42.82 21.13 8.00 42.20 20.11 9.76 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN A 61 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 30.19 15.67 6.52 28.59 15.39 5.14 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN A 69 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 36.86 -6.86 -5.26 35.56 -6.98 -6.93 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 5 1 # 5 A 461 ASN A 75 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 38.85 -14.15 4.51 39.52 -15.44 2.97 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 6 1 # 6 A 461 ASN B 22 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 24.98 -30.44 8.86 25.45 -31.72 7.22 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 7 1 # 7 A 461 ASN B 25 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 21.64 -26.03 6.51 22.85 -25.33 4.91 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 8 1 # 8 A 461 ASN B 61 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 27.99 -14.15 9.15 27.59 -12.59 7.76 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 9 1 # 9 A 461 ASN B 69 ASN~? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 48.97 -22.65 22.06 48.94 -21.42 23.79 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 10 1 # 10 A 461 ASN B 75 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 57.03 -25.03 13.17 58.00 -25.84 14.88 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 10 hits 1kbk_p00 naa= 1 ULMN 3 1wbf_p00 PROTEIN (AGGLUTININ) user 1 3 # 1 A 44 ASN A 75 ASN.? 1000.00 A 213 PRO B 83 PRO.? 1000.00 A 219 ASN A 69 ASN~? 1000.00 coo -7.34 -5.74 33.55 -6.42 -4.32 34.85 38.85 -14.15 4.51 39.52 -15.44 2.97 coo -10.08 -3.19 35.19 -11.51 -3.72 33.58 43.50 -13.24 3.81 43.92 -14.34 5.70 coo -15.60 -12.66 27.15 -15.94 -14.47 28.23 36.86 -6.86 -5.26 35.56 -6.98 -6.93 1wbf_p00 source 1wbf PROTEIN (AGGLUTININ) : 1 hits 1wbf_p00 naa= 3 ULMN 3 2v3r_p00 EXOGLUCANASE 1 user 1 3 # 1 A 270 ASN B 75 ASN.? 1000.00 A 384 ASN A 75 ASN.? 1000.00 A 385 GLU B 55 GLU~? 1000.00 coo 22.28 63.17 110.61 22.47 65.06 111.53 57.03 -25.03 13.17 58.00 -25.84 14.88 coo 7.06 50.07 96.17 8.50 48.54 96.31 38.85 -14.15 4.51 39.52 -15.44 2.97 coo 11.59 49.83 99.41 10.92 47.97 100.16 38.74 -18.72 2.21 39.87 -17.75 0.71 2v3r_p00 source 2v3r EXOGLUCANASE 1 : 1 hits 2v3r_p00 naa= 3 ULMN 3 1bdv_d00 GENE REGULATION/DNA user 1 3 # 1 A 9 GLN A 38 GLN~? 1000.00 A 11 ASN A 69 ASN~? 1000.00 A 13 ARG A 72 ARG~? 1000.00 coo 33.45 2.10 7.21 34.51 1.09 5.67 44.60 -3.31 -3.72 46.52 -2.95 -4.59 coo 38.37 -1.60 11.46 39.03 -3.43 10.75 36.86 -6.86 -5.26 35.56 -6.98 -6.93 coo 41.73 -6.32 12.94 43.25 -5.49 10.40 33.22 -10.92 -2.70 30.57 -10.95 -4.25 ULMN 3 1bdv_d00 GENE REGULATION/DNA user 2 3 # 2 A 9 GLN B 38 GLN~? 1000.00 A 11 ASN B 69 ASN~? 1000.00 A 13 ARG B 72 ARG~? 1000.00 coo 33.45 2.10 7.21 34.51 1.09 5.67 45.23 -30.31 19.55 44.55 -32.25 20.14 coo 38.37 -1.60 11.46 39.03 -3.43 10.75 48.97 -22.65 22.06 48.94 -21.42 23.79 coo 41.73 -6.32 12.94 43.25 -5.49 10.40 53.69 -19.00 19.46 54.01 -16.13 20.50 1bdv_d00 source 1bdv GENE REGULATION/DNA : 2 hits 1bdv_d00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 24 TYR~? 1000.00 I 306 VAL A 20 VAL~? 1000.00 I 308 VAL A 5 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 38.31 18.23 6.93 36.20 19.30 8.42 coo 23.55 29.53 9.81 23.15 27.39 10.24 43.01 13.19 4.46 41.50 11.68 4.01 coo 16.43 30.18 9.35 15.05 30.67 11.01 40.76 9.70 -2.33 41.54 10.68 -0.55 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 2 3 # 2 I 303 TYR A 24 TYR~? 1000.00 I 306 VAL A 20 VAL~? 1000.00 I 308 VAL A 34 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 38.31 18.23 6.93 36.20 19.30 8.42 coo 23.55 29.53 9.81 23.15 27.39 10.24 43.01 13.19 4.46 41.50 11.68 4.01 coo 16.43 30.18 9.35 15.05 30.67 11.01 37.69 7.97 0.58 39.06 8.39 2.21 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 3 3 # 3 I 303 TYR A 105 TYR^? 1000.00 I 306 VAL A 3 VAL^? 1000.00 I 308 VAL A 34 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 42.88 9.93 -8.73 44.28 7.53 -8.39 coo 23.55 29.53 9.81 23.15 27.39 10.24 37.90 14.85 -4.19 39.70 15.76 -3.32 coo 16.43 30.18 9.35 15.05 30.67 11.01 37.69 7.97 0.58 39.06 8.39 2.21 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 4 3 # 4 I 303 TYR A 105 TYR^? 1000.00 I 306 VAL A 4 VAL^? 1000.00 I 308 VAL A 34 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 42.88 9.93 -8.73 44.28 7.53 -8.39 coo 23.55 29.53 9.81 23.15 27.39 10.24 37.94 11.07 -4.50 37.75 9.65 -6.16 coo 16.43 30.18 9.35 15.05 30.67 11.01 37.69 7.97 0.58 39.06 8.39 2.21 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 5 3 # 5 I 303 TYR A 105 TYR^? 1000.00 I 306 VAL A 4 VAL^? 1000.00 I 308 VAL A 35 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 42.88 9.93 -8.73 44.28 7.53 -8.39 coo 23.55 29.53 9.81 23.15 27.39 10.24 37.94 11.07 -4.50 37.75 9.65 -6.16 coo 16.43 30.18 9.35 15.05 30.67 11.01 37.85 4.60 -1.16 37.05 4.18 -3.15 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 6 3 # 6 I 303 TYR A 105 TYR^? 1000.00 I 306 VAL A 5 VAL^? 1000.00 I 308 VAL A 35 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 42.88 9.93 -8.73 44.28 7.53 -8.39 coo 23.55 29.53 9.81 23.15 27.39 10.24 40.76 9.70 -2.33 41.54 10.68 -0.55 coo 16.43 30.18 9.35 15.05 30.67 11.01 37.85 4.60 -1.16 37.05 4.18 -3.15 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 7 3 # 7 I 303 TYR A 105 TYR^? 1000.00 I 306 VAL A 96 VAL~? 1000.00 I 308 VAL A 92 VAL~? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 42.88 9.93 -8.73 44.28 7.53 -8.39 coo 23.55 29.53 9.81 23.15 27.39 10.24 37.30 5.68 -12.01 37.98 4.40 -13.65 coo 16.43 30.18 9.35 15.05 30.67 11.01 38.79 0.82 -8.54 39.99 -0.95 -8.99 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 8 3 # 8 I 303 TYR B 24 TYR~? 1000.00 I 306 VAL B 20 VAL~? 1000.00 I 308 VAL B 5 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 23.55 29.53 9.81 23.15 27.39 10.24 29.38 -27.08 10.47 31.03 -25.71 10.91 coo 16.43 30.18 9.35 15.05 30.67 11.01 32.59 -25.44 17.60 31.63 -26.10 15.75 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 9 3 # 9 I 303 TYR B 24 TYR~? 1000.00 I 306 VAL B 20 VAL~? 1000.00 I 308 VAL B 34 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 24.95 -21.91 8.04 24.30 -19.58 6.61 coo 23.55 29.53 9.81 23.15 27.39 10.24 29.38 -27.08 10.47 31.03 -25.71 10.91 coo 16.43 30.18 9.35 15.05 30.67 11.01 34.63 -22.37 14.92 34.32 -23.62 13.17 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 10 3 # 10 I 303 TYR B 105 TYR^? 1000.00 I 306 VAL B 3 VAL^? 1000.00 I 308 VAL B 34 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 31.74 -27.89 23.83 34.05 -29.43 23.52 coo 23.55 29.53 9.81 23.15 27.39 10.24 27.45 -22.26 19.28 26.48 -23.95 18.30 coo 16.43 30.18 9.35 15.05 30.67 11.01 34.63 -22.37 14.92 34.32 -23.62 13.17 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 11 3 # 11 I 303 TYR B 105 TYR^? 1000.00 I 306 VAL B 4 VAL^? 1000.00 I 308 VAL B 34 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 31.74 -27.89 23.83 34.05 -29.43 23.52 coo 23.55 29.53 9.81 23.15 27.39 10.24 31.18 -22.68 19.84 32.44 -22.74 21.64 coo 16.43 30.18 9.35 15.05 30.67 11.01 34.63 -22.37 14.92 34.32 -23.62 13.17 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 12 3 # 12 I 303 TYR B 105 TYR^? 1000.00 I 306 VAL B 4 VAL^? 1000.00 I 308 VAL B 35 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 31.74 -27.89 23.83 34.05 -29.43 23.52 coo 23.55 29.53 9.81 23.15 27.39 10.24 31.18 -22.68 19.84 32.44 -22.74 21.64 coo 16.43 30.18 9.35 15.05 30.67 11.01 37.80 -22.83 16.97 38.08 -22.18 19.03 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 13 3 # 13 I 303 TYR B 105 TYR^? 1000.00 I 306 VAL B 5 VAL^? 1000.00 I 308 VAL B 35 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 31.74 -27.89 23.83 34.05 -29.43 23.52 coo 23.55 29.53 9.81 23.15 27.39 10.24 32.59 -25.44 17.60 31.63 -26.10 15.75 coo 16.43 30.18 9.35 15.05 30.67 11.01 37.80 -22.83 16.97 38.08 -22.18 19.03 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 14 3 # 14 I 303 TYR B 105 TYR^? 1000.00 I 306 VAL B 96 VAL~? 1000.00 I 308 VAL B 92 VAL~? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 31.74 -27.89 23.83 34.05 -29.43 23.52 coo 23.55 29.53 9.81 23.15 27.39 10.24 35.92 -22.94 27.80 37.02 -23.99 29.36 coo 16.43 30.18 9.35 15.05 30.67 11.01 40.87 -24.55 24.50 42.53 -25.85 24.99 1cqt_d00 source 1cqt GENE REGULATION/DNA : 14 hits 1cqt_d00 naa= 3 ULMN 3 1hwt_d00 GENE REGULATION/DNA user 1 3 # 1 C 70 ARG A 97 ARG~? 1000.00 C 71 LYS A 98 LYS~? 1000.00 C 72 VAL A 96 VAL~? 1000.00 coo 23.89 33.54 29.21 26.59 34.86 28.68 30.73 3.85 -12.02 31.57 1.08 -11.03 coo 25.82 26.89 29.68 23.33 22.98 25.84 33.88 9.40 -9.57 30.19 10.21 -6.88 coo 28.86 29.08 30.37 28.04 31.02 29.93 37.30 5.68 -12.01 37.98 4.40 -13.65 ULMN 3 1hwt_d00 GENE REGULATION/DNA user 2 3 # 2 C 70 ARG B 97 ARG~? 1000.00 C 71 LYS B 98 LYS~? 1000.00 C 72 VAL B 96 VAL~? 1000.00 coo 23.89 33.54 29.21 26.59 34.86 28.68 37.89 -16.06 27.72 40.60 -17.32 27.02 coo 25.82 26.89 29.68 23.33 22.98 25.84 32.73 -19.13 25.55 34.27 -15.53 22.56 coo 28.86 29.08 30.37 28.04 31.02 29.93 35.92 -22.94 27.80 37.02 -23.99 29.36 1hwt_d00 source 1hwt GENE REGULATION/DNA : 2 hits 1hwt_d00 naa= 3 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 1 3 # 1 A 40 LYS A 60 LYS~? 1000.00 A 41 LYS A 59 LYS~? 1000.00 A 42 ILE A 58 ILE~? 1000.00 coo 36.07 63.73 124.22 32.72 60.75 122.39 33.44 15.58 9.51 37.67 16.47 12.82 coo 38.49 66.12 125.64 35.69 66.71 131.25 31.90 13.00 11.85 28.95 14.22 16.49 coo 41.08 63.27 123.17 40.13 62.43 122.44 32.30 8.99 9.86 31.62 7.72 9.68 ULMN 3 1pyi_d00 PROTEIN (PYRIMIDINE PATHWAY REGULATOuser 2 3 # 2 A 40 LYS B 60 LYS~? 1000.00 A 41 LYS B 59 LYS~? 1000.00 A 42 ILE B 58 ILE~? 1000.00 coo 36.07 63.73 124.22 32.72 60.75 122.39 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 38.49 66.12 125.64 35.69 66.71 131.25 30.97 -15.57 3.92 34.16 -17.16 -0.27 coo 41.08 63.27 123.17 40.13 62.43 122.44 34.71 -16.37 6.29 35.98 -15.78 6.66 1pyi_d00 source 1pyi PROTEIN (PYRIMIDINE PATHWAY REGULATOR 1) : 2 hits 1pyi_d00 naa= 3 ULMN 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 1 3 # 1 A1290 LYS A 60 LYS~? 1000.00 A1294 ASN A 61 ASN.? 1000.00 A1297 GLU A 31 GLU^? 1000.00 coo 39.24 18.84-161.99 36.62 21.47-165.99 33.44 15.58 9.51 37.67 16.47 12.82 coo 33.53 17.37-161.81 34.31 17.81-163.76 30.19 15.67 6.52 28.59 15.39 5.14 coo 29.78 23.31-161.30 31.23 23.66-162.84 31.17 16.72 -1.44 29.83 16.99 -3.04 ULMN 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 2 3 # 2 A1290 LYS B 60 LYS~? 1000.00 A1294 ASN B 61 ASN.? 1000.00 A1297 GLU B 31 GLU^? 1000.00 coo 39.24 18.84-161.99 36.62 21.47-165.99 28.11 -17.10 5.89 27.12 -20.73 2.18 coo 33.53 17.37-161.81 34.31 17.81-163.76 27.99 -14.15 9.15 27.59 -12.59 7.76 coo 29.78 23.31-161.30 31.23 23.66-162.84 27.17 -15.62 16.86 27.14 -13.84 18.01 1xpx_d00 source 1xpx TRANSCRIPTION REGULATION/DNA : 2 hits 1xpx_d00 naa= 3 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 B 34 SER A 73 SER~? 1000.00 B 37 ASN A 75 ASN.? 1000.00 B 45 THR B 50 THR~? 1000.00 coo -19.49 41.97 71.08 -17.37 40.80 71.17 39.74 -11.42 -0.85 40.75 -9.32 -1.57 coo -23.05 39.62 69.74 -22.86 39.59 67.61 38.85 -14.15 4.51 39.52 -15.44 2.97 coo -30.87 34.84 80.57 -28.94 34.51 81.49 39.90 -26.91 2.51 40.07 -28.04 4.36 2z3x_d00 source 2z3x DNA BINDING PROTEIN/DNA : 1 hits 2z3x_d00 naa= 3 ULMN 4 3odc_d00 DNA BINDING PROTEIN/DNA user 1 4 # 1 B 122 ARG A 72 ARG~? 1000.00 B 148 LYS B 86 LYS^? 1000.00 B 151 LEU B 63 LEU^? 1000.00 B 154 ILE B 64 ILE^? 1000.00 coo 13.00 32.05 60.31 16.02 31.73 59.80 33.22 -10.92 -2.70 30.57 -10.95 -4.25 coo 11.05 44.13 44.68 12.77 44.45 49.56 40.69 -14.41 14.48 36.91 -13.49 19.50 coo 11.72 38.91 44.77 13.11 39.67 46.23 33.63 -16.13 14.15 34.97 -14.59 14.85 coo 7.03 36.97 46.99 7.83 37.90 47.52 37.45 -19.09 10.73 36.96 -20.42 10.42 3odc_d00 source 3odc DNA BINDING PROTEIN/DNA : 1 hits 3odc_d00 naa= 4 ULMN 3 3pta_d00 TRANSFERASE/DNA user 1 3 # 1 A 682 SER A 100 SER~? 1000.00 A 683 LYS A 98 LYS~? 1000.00 A 684 GLN A 99 GLN~? 1000.00 coo -8.24 -20.23 36.50 -7.44 -18.27 37.68 34.51 10.65 -14.80 32.89 8.83 -14.70 coo -5.30 -22.52 37.30 -6.47 -26.26 32.30 33.88 9.40 -9.57 30.19 10.21 -6.88 coo -3.80 -18.22 38.13 -1.93 -17.88 37.17 39.04 10.14 -10.94 40.93 9.43 -11.61 ULMN 3 3pta_d00 TRANSFERASE/DNA user 2 3 # 2 A 682 SER B 100 SER~? 1000.00 A 683 LYS B 98 LYS~? 1000.00 A 684 GLN B 99 GLN~? 1000.00 coo -8.24 -20.23 36.50 -7.44 -18.27 37.68 31.09 -20.06 30.62 32.94 -18.49 30.60 coo -5.30 -22.52 37.30 -6.47 -26.26 32.30 32.73 -19.13 25.55 34.27 -15.53 22.56 coo -3.80 -18.22 38.13 -1.93 -17.88 37.17 31.57 -24.25 26.40 31.90 -26.29 26.90 3pta_d00 source 3pta TRANSFERASE/DNA : 2 hits 3pta_d00 naa= 3 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 G 386 ARG A 72 ARG~? 1000.00 G 387 HIS A 78 HIS~? 1000.00 G 390 SER A 77 SER~? 1000.00 coo 93.17 52.97 31.81 95.66 54.71 32.14 33.22 -10.92 -2.70 30.57 -10.95 -4.25 coo 95.60 53.07 40.31 97.10 52.52 41.67 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 93.25 46.91 38.79 94.12 47.43 36.62 32.56 -10.06 6.91 30.65 -10.82 8.21 ULMN 3 3qrf_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 G 386 ARG B 72 ARG~? 1000.00 G 387 HIS B 78 HIS~? 1000.00 G 390 SER B 77 SER~? 1000.00 coo 93.17 52.97 31.81 95.66 54.71 32.14 53.69 -19.00 19.46 54.01 -16.13 20.50 coo 95.60 53.07 40.31 97.10 52.52 41.67 50.43 -14.84 12.90 50.32 -15.37 14.93 coo 93.25 46.91 38.79 94.12 47.43 36.62 53.69 -18.22 10.70 56.03 -18.39 10.07 3qrf_d00 source 3qrf DNA BINDING PROTEIN/DNA : 2 hits 3qrf_d00 naa= 3 ULMN 3 3qsv_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 81 ARG A 97 ARG~? 1000.00 A 83 GLN A 99 GLN~? 1000.00 A 88 LYS A 98 LYS~? 1000.00 coo 19.97 2.61 -45.02 18.79 3.68 -42.41 30.73 3.85 -12.02 31.57 1.08 -11.03 coo 24.10 10.39 -42.90 23.65 10.53 -40.83 39.04 10.14 -10.94 40.93 9.43 -11.61 coo 20.32 8.01 -45.76 23.08 6.63 -41.24 33.88 9.40 -9.57 30.19 10.21 -6.88 ULMN 3 3qsv_d00 TRANSCRIPTION/DNA user 2 3 # 2 A 81 ARG B 97 ARG~? 1000.00 A 83 GLN B 99 GLN~? 1000.00 A 88 LYS B 98 LYS~? 1000.00 coo 19.97 2.61 -45.02 18.79 3.68 -42.41 37.89 -16.06 27.72 40.60 -17.32 27.02 coo 24.10 10.39 -42.90 23.65 10.53 -40.83 31.57 -24.25 26.40 31.90 -26.29 26.90 coo 20.32 8.01 -45.76 23.08 6.63 -41.24 32.73 -19.13 25.55 34.27 -15.53 22.56 3qsv_d00 source 3qsv TRANSCRIPTION/DNA : 2 hits 3qsv_d00 naa= 3 ULMN 3 4hp3_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 C 61 LYS A 86 LYS^? 1000.00 C 90 HIS A 37 HIS.? 1000.00 C 91 GLN A 6 GLN^? 1000.00 coo -19.62 -7.95 11.61 -14.74 -11.23 10.80 29.45 2.33 2.56 27.22 6.18 5.41 coo -14.60 -21.92 8.98 -13.75 -22.48 7.16 41.42 -0.42 -3.75 42.78 0.47 -5.09 coo -19.27 -22.51 13.20 -20.06 -20.67 12.43 43.42 4.45 -4.29 44.63 4.11 -6.01 ULMN 3 4hp3_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 C 61 LYS B 86 LYS^? 1000.00 C 90 HIS B 37 HIS.? 1000.00 C 91 GLN B 6 GLN^? 1000.00 coo -19.62 -7.95 11.61 -14.74 -11.23 10.80 40.69 -14.41 14.48 36.91 -13.49 19.50 coo -14.60 -21.92 8.98 -13.75 -22.48 7.16 42.39 -26.87 19.72 41.38 -28.37 20.76 coo -19.27 -22.51 13.20 -20.06 -20.67 12.43 37.40 -28.66 19.69 37.54 -29.92 21.40 4hp3_d00 source 4hp3 DNA BINDING PROTEIN/DNA : 2 hits 4hp3_d00 naa= 3 ULMN 3 2odj_o00 PORIN D user 1 3 # 1 A 156 HIS A 78 HIS~? 1000.00 A 208 ASP A 47 ASP.? 1000.00 A 296 SER B 48 SER.? 1000.00 coo 12.72 17.48 24.71 12.80 19.37 23.81 29.48 -7.00 4.25 30.06 -7.33 2.26 coo 18.47 29.19 29.68 19.30 29.17 27.75 39.23 -5.09 16.44 39.94 -6.30 14.86 coo 6.89 17.22 46.63 5.08 16.21 47.91 44.98 -25.82 2.30 43.33 -26.34 3.99 2odj_o00 source 2ODJ PORIN D : 1 hits 2odj_o00 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 55 GLU~? 1000.00 A 44 ASP A 49 ASP.? 1000.00 A 50 THR A 50 THR~? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 34.72 5.65 14.40 34.53 4.90 16.37 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 45.31 0.34 15.16 45.91 -1.47 16.07 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 42.63 3.53 13.14 43.65 3.28 11.23 ULMN 3 3hde_o00 LYSOZYME user 2 3 # 2 A 35 GLU B 55 GLU~? 1000.00 A 44 ASP B 49 ASP.? 1000.00 A 50 THR B 50 THR~? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 38.74 -18.72 2.21 39.87 -17.75 0.71 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 42.86 -29.77 0.45 44.61 -30.51 -0.48 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 39.90 -26.91 2.51 40.07 -28.04 4.36 3hde_o00 source 3HDE LYSOZYME : 2 hits 3hde_o00 naa= 3 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 1 3 # 1 H 28 VAL A 35 VAL^? 1000.00 H 117 LYS A 8 LYS.? 1000.00 H 150 CYH A 67 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 37.85 4.60 -1.16 37.05 4.18 -3.15 coo 38.01 32.08 28.20 39.46 29.85 23.57 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 41.19 29.62 18.76 39.21 28.51 20.32 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 2 3 # 2 H 28 VAL A 35 VAL^? 1000.00 H 117 LYS A 86 LYS^? 1000.00 H 150 CYH A 67 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 37.85 4.60 -1.16 37.05 4.18 -3.15 coo 38.01 32.08 28.20 39.46 29.85 23.57 29.45 2.33 2.56 27.22 6.18 5.41 coo 41.19 29.62 18.76 39.21 28.51 20.32 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 3 3 # 3 H 28 VAL A 65 VAL^? 1000.00 H 117 LYS A 8 LYS.? 1000.00 H 150 CYH A 67 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 33.90 3.61 1.17 32.92 4.01 -0.75 coo 38.01 32.08 28.20 39.46 29.85 23.57 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 41.19 29.62 18.76 39.21 28.51 20.32 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 4 3 # 4 H 28 VAL A 65 VAL^? 1000.00 H 117 LYS A 42 LYS~? 1000.00 H 150 CYH A 67 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 33.90 3.61 1.17 32.92 4.01 -0.75 coo 38.01 32.08 28.20 39.46 29.85 23.57 41.51 -4.01 6.86 46.63 -6.91 6.39 coo 41.19 29.62 18.76 39.21 28.51 20.32 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 5 3 # 5 H 28 VAL A 92 VAL~? 1000.00 H 117 LYS A 8 LYS.? 1000.00 H 150 CYH A 67 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 38.79 0.82 -8.54 39.99 -0.95 -8.99 coo 38.01 32.08 28.20 39.46 29.85 23.57 45.31 0.72 -1.08 48.07 3.21 -5.30 coo 41.19 29.62 18.76 39.21 28.51 20.32 35.78 -2.24 -1.76 37.21 -3.54 -3.81 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 6 3 # 6 H 28 VAL B 35 VAL^? 1000.00 H 117 LYS B 8 LYS.? 1000.00 H 150 CYH B 67 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 37.80 -22.83 16.97 38.08 -22.18 19.03 coo 38.01 32.08 28.20 39.46 29.85 23.57 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 41.19 29.62 18.76 39.21 28.51 20.32 44.74 -21.15 18.29 45.66 -22.86 20.37 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 7 3 # 7 H 28 VAL B 35 VAL^? 1000.00 H 117 LYS B 86 LYS^? 1000.00 H 150 CYH B 67 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 37.80 -22.83 16.97 38.08 -22.18 19.03 coo 38.01 32.08 28.20 39.46 29.85 23.57 40.69 -14.41 14.48 36.91 -13.49 19.50 coo 41.19 29.62 18.76 39.21 28.51 20.32 44.74 -21.15 18.29 45.66 -22.86 20.37 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 8 3 # 8 H 28 VAL B 65 VAL^? 1000.00 H 117 LYS B 8 LYS.? 1000.00 H 150 CYH B 67 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 39.20 -18.88 15.11 38.50 -18.26 17.08 coo 38.01 32.08 28.20 39.46 29.85 23.57 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 41.19 29.62 18.76 39.21 28.51 20.32 44.74 -21.15 18.29 45.66 -22.86 20.37 ULMN 3 3uao_o07 PUTATIVE ISOCHORISMATASE user 9 3 # 9 H 28 VAL B 92 VAL~? 1000.00 H 117 LYS B 8 LYS.? 1000.00 H 150 CYH B 67 CYH^? 1000.00 coo 45.82 27.58 23.40 45.30 28.87 21.66 40.87 -24.55 24.50 42.53 -25.85 24.99 coo 38.01 32.08 28.20 39.46 29.85 23.57 41.30 -30.41 16.51 39.51 -34.44 19.49 coo 41.19 29.62 18.76 39.21 28.51 20.32 44.74 -21.15 18.29 45.66 -22.86 20.37 3uao_o07 source 3UAO PUTATIVE ISOCHORISMATASE : 9 hits 3uao_o07 naa= 3