*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 4 1djo_c00 GLUTAMINASE-ASPARAGINASE user 1 4 # 1 A1020 THR B 88 THR^? 1000.00 A1034 TYR A 34 TYR^? 1000.00 A1100 THR B 51 THR^? 1000.00 B3294 GLU A 84 GLU^? 1000.00 coo 40.94 131.25 89.60 39.24 130.12 90.27 -48.13 -9.38 1.15 -48.23 -7.80 -0.36 coo 35.38 132.08 89.27 36.78 129.74 88.76 -49.95 -10.14 -3.28 -50.35 -7.75 -4.70 coo 43.56 124.16 89.51 42.17 124.73 91.05 -54.17 -14.69 4.70 -54.04 -16.81 5.16 coo 33.89 125.64 85.55 35.54 126.95 85.33 -58.33 -5.80 -2.09 -59.99 -6.03 -0.78 1djo_c00 source 1djo GLUTAMINASE-ASPARAGINASE : 1 hits 1djo_c00 naa= 4 ULMN 4 1dl2_c00 CLASS I ALPHA-1,2-MANNOSIDASE user 1 4 # 1 A 132 GLU B 39 GLU^? 1000.00 A 136 ARG B 42 ARG^? 1000.00 A 275 ASP B 35 ASP^? 1000.00 A 435 GLU B 80 GLU^? 1000.00 coo -6.23 53.40 -2.33 -7.38 55.09 -1.77 -47.18 4.86 26.07 -48.34 6.33 25.07 coo -4.99 57.22 1.82 -7.93 56.43 2.21 -53.81 2.37 28.63 -55.98 2.33 30.80 coo -12.63 61.87 -10.13 -11.95 60.35 -8.79 -49.40 0.45 15.21 -49.07 2.29 16.26 coo -13.69 65.25 -3.58 -13.46 63.85 -2.01 -57.00 -2.99 18.11 -58.91 -3.70 18.69 1dl2_c00 source 1dl2 CLASS I ALPHA-1,2-MANNOSIDASE : 1 hits 1dl2_c00 naa= 4 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 # 1 A 49 GLU A 39 GLU^? 1000.00 A 60 ASP B 20 ASP^? 1000.00 A 175 TYR A 44 TYR^? 1000.00 coo 46.10 28.27 19.27 45.48 26.99 20.84 -47.18 -26.06 4.85 -48.32 -25.05 6.33 coo 56.42 28.06 12.93 55.01 27.92 14.50 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 45.02 22.04 15.38 46.16 24.00 13.76 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 1a50_c03 source 1a50 TRYPTOPHAN SYNTHASE : 1 hits 1a50_c03 naa= 3 ULMN 3 1amy_c05 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP B 20 ASP^? 1000.00 204 GLU B 22 GLU^? 1000.00 289 ASP A 35 ASP^? 1000.00 coo -0.62 65.95 29.97 0.31 67.47 31.05 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 4.34 62.44 32.05 4.22 64.48 32.53 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 9.42 68.07 30.27 7.35 68.27 30.10 -49.43 -15.23 0.44 -49.11 -16.26 2.29 1amy_c05 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 1 hits 1amy_c05 naa= 3 ULMN 3 1asy_c00 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 B 325 ARG B 91 ARG^? 1000.00 B 342 ASP B 20 ASP^? 1000.00 B 531 ARG A 46 ARG^? 1000.00 coo 68.60 41.07 -12.62 69.17 40.45 -9.67 -47.06 -5.45 4.73 -47.67 -2.44 4.89 coo 73.51 47.41 -3.97 72.62 46.48 -5.62 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 59.93 41.82 -5.59 61.38 39.13 -5.79 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 1asy_c00 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 1 hits 1asy_c00 naa= 3 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 1 3 # 1 A 325 ARG A 42 ARG^? 1000.00 A 342 ASP A 35 ASP^? 1000.00 A 531 ARG A 65 ARG^? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 2 3 # 2 A 325 ARG A 46 ARG^? 1000.00 A 342 ASP B 20 ASP^? 1000.00 A 531 ARG B 91 ARG^? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -47.06 -5.45 4.73 -47.67 -2.44 4.89 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 3 3 # 3 A 325 ARG B 42 ARG^? 1000.00 A 342 ASP B 35 ASP^? 1000.00 A 531 ARG B 65 ARG^? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -49.40 0.45 15.21 -49.07 2.29 16.26 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -52.72 -10.65 26.03 -52.74 -13.16 27.81 ULMN 3 1asy_c01 TRANSFER RIBONUCLEIC ACID (TRNAASP) user 4 3 # 4 A 325 ARG B 91 ARG^? 1000.00 A 342 ASP B 20 ASP^? 1000.00 A 531 ARG A 46 ARG^? 1000.00 coo 73.40 61.96 -24.99 72.46 63.92 -22.84 -47.06 -5.45 4.73 -47.67 -2.44 4.89 coo 66.77 64.93 -14.03 68.02 64.49 -15.66 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 80.46 68.51 -18.35 79.98 68.55 -21.36 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 1asy_c01 source 1asy TRANSFER RIBONUCLEIC ACID (TRNAASP) : 4 hits 1asy_c01 naa= 3 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 A 137 ARG A 46 ARG^? 1000.00 A 141 THR A 48 THR^? 1000.00 A 235 ASP B 20 ASP^? 1000.00 coo 6.21 93.81 36.58 4.58 96.33 37.17 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 6.80 92.87 28.33 4.91 92.74 27.40 -52.48 -10.49 -8.44 -52.10 -8.36 -8.18 coo 12.98 90.36 47.57 11.26 89.62 46.62 -46.34 -16.80 11.39 -48.03 -17.24 10.19 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 A 137 ARG A 46 ARG^? 1000.00 A 141 THR B 50 THR^? 1000.00 A 235 ASP A 58 ASP^? 1000.00 coo 6.21 93.81 36.58 4.58 96.33 37.17 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 6.80 92.87 28.33 4.91 92.74 27.40 -50.87 -13.60 6.25 -49.43 -15.06 6.90 coo 12.98 90.36 47.57 11.26 89.62 46.62 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 A 137 ARG A 46 ARG^? 1000.00 A 141 THR B 88 THR^? 1000.00 A 235 ASP A 58 ASP^? 1000.00 coo 6.21 93.81 36.58 4.58 96.33 37.17 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 6.80 92.87 28.33 4.91 92.74 27.40 -48.13 -9.38 1.15 -48.23 -7.80 -0.36 coo 12.98 90.36 47.57 11.26 89.62 46.62 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 1bd3_c00 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 3 hits 1bd3_c00 naa= 3 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 D 137 ARG A 46 ARG^? 1000.00 D 141 THR A 48 THR^? 1000.00 D 235 ASP B 20 ASP^? 1000.00 coo -8.33 92.80 100.06 -7.71 95.33 98.44 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo -9.24 93.49 108.77 -7.37 94.21 109.61 -52.48 -10.49 -8.44 -52.10 -8.36 -8.18 coo -14.64 87.74 89.51 -12.89 87.43 90.65 -46.34 -16.80 11.39 -48.03 -17.24 10.19 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 D 137 ARG A 46 ARG^? 1000.00 D 141 THR B 50 THR^? 1000.00 D 235 ASP A 58 ASP^? 1000.00 coo -8.33 92.80 100.06 -7.71 95.33 98.44 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo -9.24 93.49 108.77 -7.37 94.21 109.61 -50.87 -13.60 6.25 -49.43 -15.06 6.90 coo -14.64 87.74 89.51 -12.89 87.43 90.65 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 D 137 ARG A 46 ARG^? 1000.00 D 141 THR B 88 THR^? 1000.00 D 235 ASP A 58 ASP^? 1000.00 coo -8.33 92.80 100.06 -7.71 95.33 98.44 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo -9.24 93.49 108.77 -7.37 94.21 109.61 -48.13 -9.38 1.15 -48.23 -7.80 -0.36 coo -14.64 87.74 89.51 -12.89 87.43 90.65 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 1bd3_c01 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 3 hits 1bd3_c01 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG A 46 ARG^? 1000.00 C 141 THR A 48 THR^? 1000.00 C 235 ASP B 20 ASP^? 1000.00 coo -5.79 67.26 36.83 -4.57 64.58 37.74 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo -6.81 68.31 28.28 -4.82 68.47 27.57 -52.48 -10.49 -8.44 -52.10 -8.36 -8.18 coo -13.01 70.96 47.58 -11.44 71.65 46.34 -46.34 -16.80 11.39 -48.03 -17.24 10.19 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 C 137 ARG A 46 ARG^? 1000.00 C 141 THR B 50 THR^? 1000.00 C 235 ASP A 58 ASP^? 1000.00 coo -5.79 67.26 36.83 -4.57 64.58 37.74 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo -6.81 68.31 28.28 -4.82 68.47 27.57 -50.87 -13.60 6.25 -49.43 -15.06 6.90 coo -13.01 70.96 47.58 -11.44 71.65 46.34 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 C 137 ARG A 46 ARG^? 1000.00 C 141 THR B 88 THR^? 1000.00 C 235 ASP A 58 ASP^? 1000.00 coo -5.79 67.26 36.83 -4.57 64.58 37.74 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo -6.81 68.31 28.28 -4.82 68.47 27.57 -48.13 -9.38 1.15 -48.23 -7.80 -0.36 coo -13.01 70.96 47.58 -11.44 71.65 46.34 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 3 hits 1bd3_c02 naa= 3 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 B 137 ARG A 46 ARG^? 1000.00 B 141 THR A 48 THR^? 1000.00 B 235 ASP B 20 ASP^? 1000.00 coo 8.13 67.41 100.27 7.18 68.35 97.45 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 8.28 67.78 108.81 6.22 67.65 109.43 -52.48 -10.49 -8.44 -52.10 -8.36 -8.18 coo 14.55 73.52 89.47 12.81 73.95 90.56 -46.34 -16.80 11.39 -48.03 -17.24 10.19 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 B 137 ARG A 46 ARG^? 1000.00 B 141 THR B 50 THR^? 1000.00 B 235 ASP A 58 ASP^? 1000.00 coo 8.13 67.41 100.27 7.18 68.35 97.45 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 8.28 67.78 108.81 6.22 67.65 109.43 -50.87 -13.60 6.25 -49.43 -15.06 6.90 coo 14.55 73.52 89.47 12.81 73.95 90.56 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 B 137 ARG A 46 ARG^? 1000.00 B 141 THR B 88 THR^? 1000.00 B 235 ASP A 58 ASP^? 1000.00 coo 8.13 67.41 100.27 7.18 68.35 97.45 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 8.28 67.78 108.81 6.22 67.65 109.43 -48.13 -9.38 1.15 -48.23 -7.80 -0.36 coo 14.55 73.52 89.47 12.81 73.95 90.56 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 1bd3_c03 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 3 hits 1bd3_c03 naa= 3 ULMN 3 1bf2_c00 ISOAMYLASE user 1 3 # 1 375 ASP B 20 ASP^? 1000.00 435 GLU B 22 GLU^? 1000.00 510 ASP A 35 ASP^? 1000.00 coo 88.62 69.90 41.16 89.05 70.67 43.04 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 89.52 76.11 40.17 89.01 75.16 41.97 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 84.89 77.60 46.67 85.63 75.79 46.03 -49.43 -15.23 0.44 -49.11 -16.26 2.29 1bf2_c00 source 1bf2 ISOAMYLASE : 1 hits 1bf2_c00 naa= 3 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 1 3 # 1 A 461 GLU A 76 GLU^? 1000.00 A 503 TYR A 44 TYR^? 1000.00 A 537 GLU A 78 GLU^? 1000.00 coo 24.06 146.21 11.09 22.89 146.18 9.36 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 coo 15.91 140.69 8.32 15.71 143.39 9.13 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 16.65 144.44 13.24 18.34 145.22 12.33 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 ULMN 3 1bgl_c08 BETA-GALACTOSIDASE user 2 3 # 2 A 461 GLU B 76 GLU^? 1000.00 A 503 TYR B 44 TYR^? 1000.00 A 537 GLU B 78 GLU^? 1000.00 coo 24.06 146.21 11.09 22.89 146.18 9.36 -55.55 -3.12 28.55 -56.84 -1.45 28.53 coo 15.91 140.69 8.32 15.71 143.39 9.13 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 16.65 144.44 13.24 18.34 145.22 12.33 -56.54 -2.96 22.09 -57.18 -0.96 21.78 1bgl_c08 source 1bgl BETA-GALACTOSIDASE : 2 hits 1bgl_c08 naa= 3 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 1 3 # 1 A 451 GLU A 76 GLU^? 1000.00 A 504 TYR A 44 TYR^? 1000.00 A 540 GLU A 78 GLU^? 1000.00 coo 81.34 87.29 87.22 82.36 86.09 88.61 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 coo 80.85 81.34 94.77 81.70 80.16 92.41 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 79.94 80.46 88.84 81.11 81.36 87.27 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 ULMN 3 1bhg_c02 BETA-GLUCURONIDASE user 2 3 # 2 A 451 GLU B 76 GLU^? 1000.00 A 504 TYR B 44 TYR^? 1000.00 A 540 GLU B 78 GLU^? 1000.00 coo 81.34 87.29 87.22 82.36 86.09 88.61 -55.55 -3.12 28.55 -56.84 -1.45 28.53 coo 80.85 81.34 94.77 81.70 80.16 92.41 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 79.94 80.46 88.84 81.11 81.36 87.27 -56.54 -2.96 22.09 -57.18 -0.96 21.78 1bhg_c02 source 1bhg BETA-GLUCURONIDASE : 2 hits 1bhg_c02 naa= 3 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 1 3 # 1 B 451 GLU A 39 GLU^? 1000.00 B 504 TYR A 44 TYR^? 1000.00 B 540 GLU B 22 GLU^? 1000.00 coo 86.52 35.28 112.74 87.08 36.38 110.99 -47.18 -26.06 4.85 -48.32 -25.05 6.33 coo 84.93 40.21 105.31 85.72 41.45 107.72 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 83.38 41.19 112.55 85.47 40.59 112.72 -50.12 -20.97 7.83 -51.66 -20.31 6.53 ULMN 3 1bhg_c03 BETA-GLUCURONIDASE user 2 3 # 2 B 451 GLU B 22 GLU^? 1000.00 B 504 TYR A 44 TYR^? 1000.00 B 540 GLU A 39 GLU^? 1000.00 coo 86.52 35.28 112.74 87.08 36.38 110.99 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 84.93 40.21 105.31 85.72 41.45 107.72 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 83.38 41.19 112.55 85.47 40.59 112.72 -47.18 -26.06 4.85 -48.32 -25.05 6.33 1bhg_c03 source 1bhg BETA-GLUCURONIDASE : 2 hits 1bhg_c03 naa= 3 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 1 3 # 1 A 382 ARG A 65 ARG^? 1000.00 A 451 GLU A 75 GLU^? 1000.00 A 540 GLU A 76 GLU^? 1000.00 coo 79.04 80.20 80.81 79.58 81.40 83.63 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo 81.34 87.29 87.22 82.36 86.09 88.61 -51.22 -35.35 -3.84 -51.67 -37.29 -4.69 coo 79.94 80.46 88.84 81.11 81.36 87.27 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 2 3 # 2 A 382 ARG A 65 ARG^? 1000.00 A 451 GLU A 76 GLU^? 1000.00 A 540 GLU A 78 GLU^? 1000.00 coo 79.04 80.20 80.81 79.58 81.40 83.63 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo 81.34 87.29 87.22 82.36 86.09 88.61 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 coo 79.94 80.46 88.84 81.11 81.36 87.27 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 3 3 # 3 A 382 ARG A 65 ARG^? 1000.00 A 451 GLU A 78 GLU^? 1000.00 A 540 GLU A 76 GLU^? 1000.00 coo 79.04 80.20 80.81 79.58 81.40 83.63 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo 81.34 87.29 87.22 82.36 86.09 88.61 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 coo 79.94 80.46 88.84 81.11 81.36 87.27 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 4 3 # 4 A 382 ARG B 65 ARG^? 1000.00 A 451 GLU B 75 GLU^? 1000.00 A 540 GLU B 76 GLU^? 1000.00 coo 79.04 80.20 80.81 79.58 81.40 83.63 -52.72 -10.65 26.03 -52.74 -13.16 27.81 coo 81.34 87.29 87.22 82.36 86.09 88.61 -51.48 -4.50 35.42 -52.39 -3.63 37.12 coo 79.94 80.46 88.84 81.11 81.36 87.27 -55.55 -3.12 28.55 -56.84 -1.45 28.53 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 5 3 # 5 A 382 ARG B 65 ARG^? 1000.00 A 451 GLU B 76 GLU^? 1000.00 A 540 GLU B 78 GLU^? 1000.00 coo 79.04 80.20 80.81 79.58 81.40 83.63 -52.72 -10.65 26.03 -52.74 -13.16 27.81 coo 81.34 87.29 87.22 82.36 86.09 88.61 -55.55 -3.12 28.55 -56.84 -1.45 28.53 coo 79.94 80.46 88.84 81.11 81.36 87.27 -56.54 -2.96 22.09 -57.18 -0.96 21.78 ULMN 3 1bhg_c04 BETA-GLUCURONIDASE user 6 3 # 6 A 382 ARG B 65 ARG^? 1000.00 A 451 GLU B 78 GLU^? 1000.00 A 540 GLU B 76 GLU^? 1000.00 coo 79.04 80.20 80.81 79.58 81.40 83.63 -52.72 -10.65 26.03 -52.74 -13.16 27.81 coo 81.34 87.29 87.22 82.36 86.09 88.61 -56.54 -2.96 22.09 -57.18 -0.96 21.78 coo 79.94 80.46 88.84 81.11 81.36 87.27 -55.55 -3.12 28.55 -56.84 -1.45 28.53 1bhg_c04 source 1bhg BETA-GLUCURONIDASE : 6 hits 1bhg_c04 naa= 3 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 1 3 # 1 B 382 ARG A 65 ARG^? 1000.00 B 451 GLU A 78 GLU^? 1000.00 B 540 GLU A 76 GLU^? 1000.00 coo 82.21 41.07 119.14 83.95 40.66 116.59 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo 86.52 35.28 112.74 87.08 36.38 110.99 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 coo 83.38 41.19 112.55 85.47 40.59 112.72 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 2 3 # 2 B 382 ARG B 42 ARG^? 1000.00 B 451 GLU B 75 GLU^? 1000.00 B 540 GLU B 76 GLU^? 1000.00 coo 82.21 41.07 119.14 83.95 40.66 116.59 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 86.52 35.28 112.74 87.08 36.38 110.99 -51.48 -4.50 35.42 -52.39 -3.63 37.12 coo 83.38 41.19 112.55 85.47 40.59 112.72 -55.55 -3.12 28.55 -56.84 -1.45 28.53 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 3 3 # 3 B 382 ARG B 42 ARG^? 1000.00 B 451 GLU B 78 GLU^? 1000.00 B 540 GLU B 76 GLU^? 1000.00 coo 82.21 41.07 119.14 83.95 40.66 116.59 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 86.52 35.28 112.74 87.08 36.38 110.99 -56.54 -2.96 22.09 -57.18 -0.96 21.78 coo 83.38 41.19 112.55 85.47 40.59 112.72 -55.55 -3.12 28.55 -56.84 -1.45 28.53 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 4 3 # 4 B 382 ARG B 65 ARG^? 1000.00 B 451 GLU B 75 GLU^? 1000.00 B 540 GLU B 76 GLU^? 1000.00 coo 82.21 41.07 119.14 83.95 40.66 116.59 -52.72 -10.65 26.03 -52.74 -13.16 27.81 coo 86.52 35.28 112.74 87.08 36.38 110.99 -51.48 -4.50 35.42 -52.39 -3.63 37.12 coo 83.38 41.19 112.55 85.47 40.59 112.72 -55.55 -3.12 28.55 -56.84 -1.45 28.53 ULMN 3 1bhg_c05 BETA-GLUCURONIDASE user 5 3 # 5 B 382 ARG B 65 ARG^? 1000.00 B 451 GLU B 78 GLU^? 1000.00 B 540 GLU B 76 GLU^? 1000.00 coo 82.21 41.07 119.14 83.95 40.66 116.59 -52.72 -10.65 26.03 -52.74 -13.16 27.81 coo 86.52 35.28 112.74 87.08 36.38 110.99 -56.54 -2.96 22.09 -57.18 -0.96 21.78 coo 83.38 41.19 112.55 85.47 40.59 112.72 -55.55 -3.12 28.55 -56.84 -1.45 28.53 1bhg_c05 source 1bhg BETA-GLUCURONIDASE : 5 hits 1bhg_c05 naa= 3 ULMN 3 1bqc_c01 BETA-MANNANASE user 1 3 # 1 A 50 ARG A 42 ARG^? 1000.00 A 128 GLU A 75 GLU^? 1000.00 A 225 GLU A 76 GLU^? 1000.00 coo 38.56 19.11 14.83 37.12 21.00 16.76 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 36.48 24.43 22.02 36.86 26.34 21.13 -51.22 -35.35 -3.84 -51.67 -37.29 -4.69 coo 40.16 23.71 17.01 38.52 24.96 17.40 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 ULMN 3 1bqc_c01 BETA-MANNANASE user 2 3 # 2 A 50 ARG A 42 ARG^? 1000.00 A 128 GLU A 78 GLU^? 1000.00 A 225 GLU A 76 GLU^? 1000.00 coo 38.56 19.11 14.83 37.12 21.00 16.76 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 36.48 24.43 22.02 36.86 26.34 21.13 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 coo 40.16 23.71 17.01 38.52 24.96 17.40 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 ULMN 3 1bqc_c01 BETA-MANNANASE user 3 3 # 3 A 50 ARG B 42 ARG^? 1000.00 A 128 GLU B 75 GLU^? 1000.00 A 225 GLU B 76 GLU^? 1000.00 coo 38.56 19.11 14.83 37.12 21.00 16.76 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 36.48 24.43 22.02 36.86 26.34 21.13 -51.48 -4.50 35.42 -52.39 -3.63 37.12 coo 40.16 23.71 17.01 38.52 24.96 17.40 -55.55 -3.12 28.55 -56.84 -1.45 28.53 ULMN 3 1bqc_c01 BETA-MANNANASE user 4 3 # 4 A 50 ARG B 42 ARG^? 1000.00 A 128 GLU B 78 GLU^? 1000.00 A 225 GLU B 76 GLU^? 1000.00 coo 38.56 19.11 14.83 37.12 21.00 16.76 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 36.48 24.43 22.02 36.86 26.34 21.13 -56.54 -2.96 22.09 -57.18 -0.96 21.78 coo 40.16 23.71 17.01 38.52 24.96 17.40 -55.55 -3.12 28.55 -56.84 -1.45 28.53 1bqc_c01 source 1bqc BETA-MANNANASE : 4 hits 1bqc_c01 naa= 3 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 10 GLN~? 1000.00 A 91 LEU A 14 LEU~? 1000.00 A 133 GLU A 8 GLU~? 1000.00 coo 43.58 43.67 66.73 42.32 42.78 68.15 -38.03 -27.28 -6.34 -38.61 -29.32 -6.12 coo 38.58 45.09 70.44 38.28 45.21 72.59 -41.39 -23.74 -9.94 -41.14 -25.88 -10.14 coo 44.05 36.87 70.65 43.15 38.64 69.97 -40.65 -21.45 0.99 -42.76 -21.54 0.85 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 10 GLN~? 1000.00 A 91 LEU A 71 LEU^? 1000.00 A 133 GLU A 8 GLU~? 1000.00 coo 43.58 43.67 66.73 42.32 42.78 68.15 -38.03 -27.28 -6.34 -38.61 -29.32 -6.12 coo 38.58 45.09 70.44 38.28 45.21 72.59 -43.81 -28.88 -5.73 -42.87 -26.98 -5.32 coo 44.05 36.87 70.65 43.15 38.64 69.97 -40.65 -21.45 0.99 -42.76 -21.54 0.85 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 3 3 # 3 A 50 GLN B 10 GLN^? 1000.00 A 91 LEU B 14 LEU^? 1000.00 A 133 GLU B 8 GLU^? 1000.00 coo 43.58 43.67 66.73 42.32 42.78 68.15 -37.99 -6.36 27.30 -38.60 -6.20 29.34 coo 38.58 45.09 70.44 38.28 45.21 72.59 -41.40 -9.93 23.72 -41.15 -10.09 25.86 coo 44.05 36.87 70.65 43.15 38.64 69.97 -40.69 0.80 21.29 -42.80 1.05 21.24 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 4 3 # 4 A 50 GLN B 10 GLN^? 1000.00 A 91 LEU B 71 LEU^? 1000.00 A 133 GLU B 8 GLU^? 1000.00 coo 43.58 43.67 66.73 42.32 42.78 68.15 -37.99 -6.36 27.30 -38.60 -6.20 29.34 coo 38.58 45.09 70.44 38.28 45.21 72.59 -43.83 -5.74 28.89 -42.97 -5.30 26.95 coo 44.05 36.87 70.65 43.15 38.64 69.97 -40.69 0.80 21.29 -42.80 1.05 21.24 1bs4_c00 source 1bs4 PEPTIDE DEFORMYLASE : 4 hits 1bs4_c00 naa= 3 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 # 1 B 550 GLN A 10 GLN~? 1000.00 B 591 LEU A 14 LEU~? 1000.00 B 633 GLU A 8 GLU~? 1000.00 coo 88.06 44.34 57.19 89.06 45.53 55.74 -38.03 -27.28 -6.34 -38.61 -29.32 -6.12 coo 86.70 48.66 52.61 87.15 48.69 50.51 -41.39 -23.74 -9.94 -41.14 -25.88 -10.14 coo 95.42 44.52 54.43 93.46 45.31 54.70 -40.65 -21.45 0.99 -42.76 -21.54 0.85 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 2 3 # 2 B 550 GLN A 10 GLN~? 1000.00 B 591 LEU A 71 LEU^? 1000.00 B 633 GLU A 8 GLU~? 1000.00 coo 88.06 44.34 57.19 89.06 45.53 55.74 -38.03 -27.28 -6.34 -38.61 -29.32 -6.12 coo 86.70 48.66 52.61 87.15 48.69 50.51 -43.81 -28.88 -5.73 -42.87 -26.98 -5.32 coo 95.42 44.52 54.43 93.46 45.31 54.70 -40.65 -21.45 0.99 -42.76 -21.54 0.85 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 3 3 # 3 B 550 GLN B 10 GLN^? 1000.00 B 591 LEU B 14 LEU^? 1000.00 B 633 GLU B 8 GLU^? 1000.00 coo 88.06 44.34 57.19 89.06 45.53 55.74 -37.99 -6.36 27.30 -38.60 -6.20 29.34 coo 86.70 48.66 52.61 87.15 48.69 50.51 -41.40 -9.93 23.72 -41.15 -10.09 25.86 coo 95.42 44.52 54.43 93.46 45.31 54.70 -40.69 0.80 21.29 -42.80 1.05 21.24 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 4 3 # 4 B 550 GLN B 10 GLN^? 1000.00 B 591 LEU B 71 LEU^? 1000.00 B 633 GLU B 8 GLU^? 1000.00 coo 88.06 44.34 57.19 89.06 45.53 55.74 -37.99 -6.36 27.30 -38.60 -6.20 29.34 coo 86.70 48.66 52.61 87.15 48.69 50.51 -43.83 -5.74 28.89 -42.97 -5.30 26.95 coo 95.42 44.52 54.43 93.46 45.31 54.70 -40.69 0.80 21.29 -42.80 1.05 21.24 1bs4_c01 source 1bs4 PEPTIDE DEFORMYLASE : 4 hits 1bs4_c01 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 10 GLN~? 1000.00 C1091 LEU A 14 LEU~? 1000.00 C1133 GLU A 8 GLU~? 1000.00 coo 68.29 34.44 43.03 66.67 34.74 44.37 -38.03 -27.28 -6.34 -38.61 -29.32 -6.12 coo 65.83 38.95 47.05 65.46 38.90 49.20 -41.39 -23.74 -9.94 -41.14 -25.88 -10.14 coo 63.14 29.39 46.25 63.84 31.31 45.74 -40.65 -21.45 0.99 -42.76 -21.54 0.85 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 # 2 C1050 GLN A 10 GLN~? 1000.00 C1091 LEU A 71 LEU^? 1000.00 C1133 GLU A 8 GLU~? 1000.00 coo 68.29 34.44 43.03 66.67 34.74 44.37 -38.03 -27.28 -6.34 -38.61 -29.32 -6.12 coo 65.83 38.95 47.05 65.46 38.90 49.20 -43.81 -28.88 -5.73 -42.87 -26.98 -5.32 coo 63.14 29.39 46.25 63.84 31.31 45.74 -40.65 -21.45 0.99 -42.76 -21.54 0.85 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 3 3 # 3 C1050 GLN B 10 GLN^? 1000.00 C1091 LEU B 14 LEU^? 1000.00 C1133 GLU B 8 GLU^? 1000.00 coo 68.29 34.44 43.03 66.67 34.74 44.37 -37.99 -6.36 27.30 -38.60 -6.20 29.34 coo 65.83 38.95 47.05 65.46 38.90 49.20 -41.40 -9.93 23.72 -41.15 -10.09 25.86 coo 63.14 29.39 46.25 63.84 31.31 45.74 -40.69 0.80 21.29 -42.80 1.05 21.24 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 4 3 # 4 C1050 GLN B 10 GLN^? 1000.00 C1091 LEU B 71 LEU^? 1000.00 C1133 GLU B 8 GLU^? 1000.00 coo 68.29 34.44 43.03 66.67 34.74 44.37 -37.99 -6.36 27.30 -38.60 -6.20 29.34 coo 65.83 38.95 47.05 65.46 38.90 49.20 -43.83 -5.74 28.89 -42.97 -5.30 26.95 coo 63.14 29.39 46.25 63.84 31.31 45.74 -40.69 0.80 21.29 -42.80 1.05 21.24 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 4 hits 1bs4_c02 naa= 3 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 10 GLN~? 1000.00 A 91 LEU A 14 LEU~? 1000.00 A 133 GLU A 8 GLU~? 1000.00 coo 38.23 53.34 67.59 38.84 53.87 69.56 -38.03 -27.28 -6.34 -38.61 -29.32 -6.12 coo 35.40 53.22 73.30 35.37 54.87 74.74 -41.39 -23.74 -9.94 -41.14 -25.88 -10.14 coo 45.08 56.04 70.60 43.15 55.19 70.77 -40.65 -21.45 0.99 -42.76 -21.54 0.85 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN A 10 GLN~? 1000.00 A 91 LEU A 71 LEU^? 1000.00 A 133 GLU A 8 GLU~? 1000.00 coo 38.23 53.34 67.59 38.84 53.87 69.56 -38.03 -27.28 -6.34 -38.61 -29.32 -6.12 coo 35.40 53.22 73.30 35.37 54.87 74.74 -43.81 -28.88 -5.73 -42.87 -26.98 -5.32 coo 45.08 56.04 70.60 43.15 55.19 70.77 -40.65 -21.45 0.99 -42.76 -21.54 0.85 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 3 3 # 3 A 50 GLN B 10 GLN^? 1000.00 A 91 LEU B 14 LEU^? 1000.00 A 133 GLU B 8 GLU^? 1000.00 coo 38.23 53.34 67.59 38.84 53.87 69.56 -37.99 -6.36 27.30 -38.60 -6.20 29.34 coo 35.40 53.22 73.30 35.37 54.87 74.74 -41.40 -9.93 23.72 -41.15 -10.09 25.86 coo 45.08 56.04 70.60 43.15 55.19 70.77 -40.69 0.80 21.29 -42.80 1.05 21.24 ULMN 3 1bsj_c00 PEPTIDE DEFORMYLASE user 4 3 # 4 A 50 GLN B 10 GLN^? 1000.00 A 91 LEU B 71 LEU^? 1000.00 A 133 GLU B 8 GLU^? 1000.00 coo 38.23 53.34 67.59 38.84 53.87 69.56 -37.99 -6.36 27.30 -38.60 -6.20 29.34 coo 35.40 53.22 73.30 35.37 54.87 74.74 -43.83 -5.74 28.89 -42.97 -5.30 26.95 coo 45.08 56.04 70.60 43.15 55.19 70.77 -40.69 0.80 21.29 -42.80 1.05 21.24 1bsj_c00 source 1bsj PEPTIDE DEFORMYLASE : 4 hits 1bsj_c00 naa= 3 ULMN 3 1bvz_c08 ALPHA-AMYLASE II user 1 3 # 1 A 325 ASP B 20 ASP^? 1000.00 A 354 GLU B 22 GLU^? 1000.00 A 421 ASP A 35 ASP^? 1000.00 coo 31.05 49.37 64.51 31.97 51.11 63.85 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 29.07 50.42 58.36 29.02 52.18 59.49 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 30.82 59.76 58.47 31.12 59.02 60.40 -49.43 -15.23 0.44 -49.11 -16.26 2.29 1bvz_c08 source 1bvz ALPHA-AMYLASE II : 1 hits 1bvz_c08 naa= 3 ULMN 3 1bvz_c09 ALPHA-AMYLASE II user 1 3 # 1 B 325 ASP B 20 ASP^? 1000.00 B 354 GLU B 22 GLU^? 1000.00 B 421 ASP A 35 ASP^? 1000.00 coo 25.90 8.19 53.87 25.36 6.97 52.29 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 27.87 10.66 47.95 27.82 8.60 48.27 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 26.02 1.87 43.38 25.90 1.97 45.49 -49.43 -15.23 0.44 -49.11 -16.26 2.29 1bvz_c09 source 1bvz ALPHA-AMYLASE II : 1 hits 1bvz_c09 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 20 ASP^? 1000.00 264 GLU A 78 GLU^? 1000.00 328 ASP A 58 ASP^? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 -46.33 -11.43 -16.79 -47.95 -10.15 -17.25 coo 59.69 92.71 39.85 58.53 92.03 41.47 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 coo 45.39 90.72 40.63 45.07 89.14 41.90 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP B 20 ASP^? 1000.00 264 GLU A 76 GLU^? 1000.00 328 ASP A 35 ASP^? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 59.69 92.71 39.85 58.53 92.03 41.47 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 coo 45.39 90.72 40.63 45.07 89.14 41.90 -49.43 -15.23 0.44 -49.11 -16.26 2.29 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 3 3 # 3 229 ASP B 20 ASP^? 1000.00 264 GLU B 78 GLU^? 1000.00 328 ASP B 58 ASP^? 1000.00 coo 45.62 80.42 43.69 45.65 82.01 45.07 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 59.69 92.71 39.85 58.53 92.03 41.47 -56.54 -2.96 22.09 -57.18 -0.96 21.78 coo 45.39 90.72 40.63 45.07 89.14 41.90 -57.19 -14.71 16.52 -55.58 -13.45 15.88 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 3 hits 1cdg_c00 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 44 TYR^? 1000.00 A 173 ASP A 35 ASP^? 1000.00 C 48 ARG A 42 ARG^? 1000.00 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 24.35 4.55 25.11 25.94 3.23 25.53 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 -54.32 -29.07 0.18 -55.53 -31.83 0.78 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 101 TYR B 44 TYR^? 1000.00 A 173 ASP B 35 ASP^? 1000.00 C 48 ARG B 42 ARG^? 1000.00 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 24.35 4.55 25.11 25.94 3.23 25.53 -49.40 0.45 15.21 -49.07 2.29 16.26 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 -53.81 2.37 28.63 -55.98 2.33 30.80 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1cs1_c00 naa= 3 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 48 ARG A 42 ARG^? 1000.00 C 101 TYR A 44 TYR^? 1000.00 C 173 ASP A 35 ASP^? 1000.00 coo 32.27 5.62 48.15 31.93 6.48 51.06 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 29.64 3.64 57.39 31.22 5.14 55.65 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 -49.43 -15.23 0.44 -49.11 -16.26 2.29 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 48 ARG B 42 ARG^? 1000.00 C 101 TYR B 44 TYR^? 1000.00 C 173 ASP B 35 ASP^? 1000.00 coo 32.27 5.62 48.15 31.93 6.48 51.06 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 29.64 3.64 57.39 31.22 5.14 55.65 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 -49.40 0.45 15.21 -49.07 2.29 16.26 1cs1_c01 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1cs1_c01 naa= 3 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 48 ARG A 42 ARG^? 1000.00 D 101 TYR A 44 TYR^? 1000.00 D 173 ASP A 35 ASP^? 1000.00 coo 69.08 8.58 32.60 69.70 10.81 30.58 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 71.77 11.86 24.26 70.23 12.22 26.56 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 71.60 6.14 19.25 70.26 6.87 20.69 -49.43 -15.23 0.44 -49.11 -16.26 2.29 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 48 ARG B 42 ARG^? 1000.00 D 101 TYR B 44 TYR^? 1000.00 D 173 ASP B 35 ASP^? 1000.00 coo 69.08 8.58 32.60 69.70 10.81 30.58 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 71.77 11.86 24.26 70.23 12.22 26.56 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 71.60 6.14 19.25 70.26 6.87 20.69 -49.40 0.45 15.21 -49.07 2.29 16.26 1cs1_c02 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1cs1_c02 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 44 TYR^? 1000.00 B 173 ASP A 35 ASP^? 1000.00 D 48 ARG A 42 ARG^? 1000.00 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 -54.32 -29.07 0.18 -55.53 -31.83 0.78 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 101 TYR B 44 TYR^? 1000.00 B 173 ASP B 35 ASP^? 1000.00 D 48 ARG B 42 ARG^? 1000.00 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 -49.40 0.45 15.21 -49.07 2.29 16.26 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 -53.81 2.37 28.63 -55.98 2.33 30.80 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1cs1_c03 naa= 3 ULMN 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 1 3 # 1 A 1 ALA A 96 ALA^? 1000.00 A 74 ASN A 29 ASN.? 1000.00 A 75 GLY A 31 GLY.? 1000.00 coo -1.80 62.71 122.76 -1.88 63.70 123.92 -36.47 -6.45 -12.75 -37.89 -6.51 -12.23 coo 1.20 66.40 122.20 2.03 64.53 121.46 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 coo 4.68 65.84 125.52 4.11 65.60 126.05 -43.94 -8.70 -7.62 -44.35 -9.04 -8.23 ULMN 3 1ct9_c04 ASPARAGINE SYNTHETASE B user 2 3 # 2 A 1 ALA B 96 ALA^? 1000.00 A 74 ASN B 29 ASN^? 1000.00 A 75 GLY B 31 GLY^? 1000.00 coo -1.80 62.71 122.76 -1.88 63.70 123.92 -36.53 -12.78 6.48 -37.94 -12.23 6.51 coo 1.20 66.40 122.20 2.03 64.53 121.46 -38.46 -11.22 10.44 -36.76 -10.52 11.49 coo 4.68 65.84 125.52 4.11 65.60 126.05 -43.92 -7.60 8.70 -44.33 -8.22 9.03 1ct9_c04 source 1ct9 ASPARAGINE SYNTHETASE B : 2 hits 1ct9_c04 naa= 3 ULMN 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 1 3 # 1 B 1 ALA A 96 ALA^? 1000.00 B 74 ASN A 29 ASN.? 1000.00 B 75 GLY A 31 GLY.? 1000.00 coo 39.21 14.97 27.55 40.19 16.01 27.08 -36.47 -6.45 -12.75 -37.89 -6.51 -12.23 coo 43.06 12.94 25.74 42.26 11.81 27.44 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 coo 46.38 13.54 29.18 46.14 14.29 29.26 -43.94 -8.70 -7.62 -44.35 -9.04 -8.23 ULMN 3 1ct9_c05 ASPARAGINE SYNTHETASE B user 2 3 # 2 B 1 ALA B 96 ALA^? 1000.00 B 74 ASN B 29 ASN^? 1000.00 B 75 GLY B 31 GLY^? 1000.00 coo 39.21 14.97 27.55 40.19 16.01 27.08 -36.53 -12.78 6.48 -37.94 -12.23 6.51 coo 43.06 12.94 25.74 42.26 11.81 27.44 -38.46 -11.22 10.44 -36.76 -10.52 11.49 coo 46.38 13.54 29.18 46.14 14.29 29.26 -43.92 -7.60 8.70 -44.33 -8.22 9.03 1ct9_c05 source 1ct9 ASPARAGINE SYNTHETASE B : 2 hits 1ct9_c05 naa= 3 ULMN 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 1 3 # 1 C 1 ALA A 96 ALA^? 1000.00 C 74 ASN A 29 ASN.? 1000.00 C 75 GLY A 31 GLY.? 1000.00 coo 16.14 15.08 36.63 15.28 14.65 37.81 -36.47 -6.45 -12.75 -37.89 -6.51 -12.23 coo 11.60 16.13 36.70 12.80 17.74 35.96 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 coo 10.99 19.23 40.32 11.50 18.77 40.74 -43.94 -8.70 -7.62 -44.35 -9.04 -8.23 ULMN 3 1ct9_c06 ASPARAGINE SYNTHETASE B user 2 3 # 2 C 1 ALA B 96 ALA^? 1000.00 C 74 ASN B 29 ASN^? 1000.00 C 75 GLY B 31 GLY^? 1000.00 coo 16.14 15.08 36.63 15.28 14.65 37.81 -36.53 -12.78 6.48 -37.94 -12.23 6.51 coo 11.60 16.13 36.70 12.80 17.74 35.96 -38.46 -11.22 10.44 -36.76 -10.52 11.49 coo 10.99 19.23 40.32 11.50 18.77 40.74 -43.92 -7.60 8.70 -44.33 -8.22 9.03 1ct9_c06 source 1ct9 ASPARAGINE SYNTHETASE B : 2 hits 1ct9_c06 naa= 3 ULMN 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 1 3 # 1 D 1 ALA A 96 ALA^? 1000.00 D 74 ASN A 29 ASN.? 1000.00 D 75 GLY A 31 GLY.? 1000.00 coo -13.31 41.90 116.45 -13.05 40.39 116.25 -36.47 -6.45 -12.75 -37.89 -6.51 -12.23 coo -16.85 39.36 115.26 -17.55 40.58 116.90 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 coo -17.65 36.37 119.00 -16.85 36.22 119.00 -43.94 -8.70 -7.62 -44.35 -9.04 -8.23 ULMN 3 1ct9_c07 ASPARAGINE SYNTHETASE B user 2 3 # 2 D 1 ALA B 96 ALA^? 1000.00 D 74 ASN B 29 ASN^? 1000.00 D 75 GLY B 31 GLY^? 1000.00 coo -13.31 41.90 116.45 -13.05 40.39 116.25 -36.53 -12.78 6.48 -37.94 -12.23 6.51 coo -16.85 39.36 115.26 -17.55 40.58 116.90 -38.46 -11.22 10.44 -36.76 -10.52 11.49 coo -17.65 36.37 119.00 -16.85 36.22 119.00 -43.92 -7.60 8.70 -44.33 -8.22 9.03 1ct9_c07 source 1ct9 ASPARAGINE SYNTHETASE B : 2 hits 1ct9_c07 naa= 3 ULMN 3 1cwy_c00 AMYLOMALTASE user 1 3 # 1 A 293 ASP B 20 ASP^? 1000.00 A 340 GLU B 22 GLU^? 1000.00 A 395 ASP A 35 ASP^? 1000.00 coo -48.00 -26.48 6.86 -46.51 -25.94 5.49 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo -43.58 -29.03 7.13 -42.45 -27.34 7.75 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo -42.28 -26.47 -1.32 -44.06 -25.60 -0.58 -49.43 -15.23 0.44 -49.11 -16.26 2.29 1cwy_c00 source 1cwy AMYLOMALTASE : 1 hits 1cwy_c00 naa= 3 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 42 ARG^? 1000.00 A 136 GLU A 75 GLU^? 1000.00 A 246 GLU A 76 GLU^? 1000.00 coo 13.48 30.30 107.06 11.75 30.99 109.44 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 9.46 32.37 115.82 8.50 34.20 115.47 -51.22 -35.35 -3.84 -51.67 -37.29 -4.69 coo 11.99 34.33 109.92 10.08 34.19 110.77 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG A 42 ARG^? 1000.00 A 136 GLU A 78 GLU^? 1000.00 A 246 GLU A 76 GLU^? 1000.00 coo 13.48 30.30 107.06 11.75 30.99 109.44 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 9.46 32.37 115.82 8.50 34.20 115.47 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 coo 11.99 34.33 109.92 10.08 34.19 110.77 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 3 3 # 3 A 45 ARG B 42 ARG^? 1000.00 A 136 GLU B 75 GLU^? 1000.00 A 246 GLU B 76 GLU^? 1000.00 coo 13.48 30.30 107.06 11.75 30.99 109.44 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 9.46 32.37 115.82 8.50 34.20 115.47 -51.48 -4.50 35.42 -52.39 -3.63 37.12 coo 11.99 34.33 109.92 10.08 34.19 110.77 -55.55 -3.12 28.55 -56.84 -1.45 28.53 ULMN 3 1fhl_c00 BETA-1,4-GALACTANASE user 4 3 # 4 A 45 ARG B 42 ARG^? 1000.00 A 136 GLU B 78 GLU^? 1000.00 A 246 GLU B 76 GLU^? 1000.00 coo 13.48 30.30 107.06 11.75 30.99 109.44 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 9.46 32.37 115.82 8.50 34.20 115.47 -56.54 -2.96 22.09 -57.18 -0.96 21.78 coo 11.99 34.33 109.92 10.08 34.19 110.77 -55.55 -3.12 28.55 -56.84 -1.45 28.53 1fhl_c00 source 1fhl BETA-1,4-GALACTANASE : 4 hits 1fhl_c00 naa= 3 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 1 3 # 1 A 45 ARG A 42 ARG^? 1000.00 A 136 GLU A 75 GLU^? 1000.00 A 246 GLU A 76 GLU^? 1000.00 coo 13.94 29.84 106.80 11.67 30.40 108.79 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 9.52 31.97 115.23 8.45 33.74 114.72 -51.22 -35.35 -3.84 -51.67 -37.29 -4.69 coo 11.92 33.82 109.35 10.10 33.50 110.39 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 2 3 # 2 A 45 ARG A 42 ARG^? 1000.00 A 136 GLU A 78 GLU^? 1000.00 A 246 GLU A 76 GLU^? 1000.00 coo 13.94 29.84 106.80 11.67 30.40 108.79 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 9.52 31.97 115.23 8.45 33.74 114.72 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 coo 11.92 33.82 109.35 10.10 33.50 110.39 -55.46 -28.55 -3.07 -57.01 -28.69 -1.65 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 3 3 # 3 A 45 ARG B 42 ARG^? 1000.00 A 136 GLU B 75 GLU^? 1000.00 A 246 GLU B 76 GLU^? 1000.00 coo 13.94 29.84 106.80 11.67 30.40 108.79 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 9.52 31.97 115.23 8.45 33.74 114.72 -51.48 -4.50 35.42 -52.39 -3.63 37.12 coo 11.92 33.82 109.35 10.10 33.50 110.39 -55.55 -3.12 28.55 -56.84 -1.45 28.53 ULMN 3 1fob_c00 BETA-1,4-GALACTANASE user 4 3 # 4 A 45 ARG B 42 ARG^? 1000.00 A 136 GLU B 78 GLU^? 1000.00 A 246 GLU B 76 GLU^? 1000.00 coo 13.94 29.84 106.80 11.67 30.40 108.79 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 9.52 31.97 115.23 8.45 33.74 114.72 -56.54 -2.96 22.09 -57.18 -0.96 21.78 coo 11.92 33.82 109.35 10.10 33.50 110.39 -55.55 -3.12 28.55 -56.84 -1.45 28.53 1fob_c00 source 1fob BETA-1,4-GALACTANASE : 4 hits 1fob_c00 naa= 3 ULMN 3 1fr8_c00 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 A 317 GLU B 22 GLU^? 1000.00 A 319 ASP A 35 ASP^? 1000.00 A 359 ARG A 46 ARG^? 1000.00 coo 14.41 12.40 16.42 12.92 13.74 15.71 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 12.25 13.04 23.85 11.56 15.02 23.93 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 10.89 14.95 28.28 12.39 12.53 29.31 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 1fr8_c00 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 1 hits 1fr8_c00 naa= 3 ULMN 3 1fr8_c01 BETA 1,4 GALACTOSYLTRANSFERASE user 1 3 # 1 B 317 GLU B 22 GLU^? 1000.00 B 319 ASP A 35 ASP^? 1000.00 B 359 ARG A 46 ARG^? 1000.00 coo 10.77 13.13 40.94 11.03 14.73 39.51 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 3.77 12.64 38.21 3.35 14.53 37.39 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo -1.16 15.32 35.60 -3.32 13.56 36.98 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 1fr8_c01 source 1fr8 BETA 1,4 GALACTOSYLTRANSFERASE : 1 hits 1fr8_c01 naa= 3 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 1 3 # 1 A 50 ASP A 20 ASP^? 1000.00 A 327 GLU B 76 GLU^? 1000.00 A 339 ARG B 42 ARG^? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 -46.33 -11.43 -16.79 -47.95 -10.15 -17.25 coo 75.11 41.01 160.30 76.65 40.06 161.41 -55.55 -3.12 28.55 -56.84 -1.45 28.53 coo 82.23 40.35 159.87 85.09 40.67 161.01 -53.81 2.37 28.63 -55.98 2.33 30.80 ULMN 3 1hto_c00 GLUTAMINE SYNTHETASE user 2 3 # 2 A 50 ASP A 58 ASP^? 1000.00 A 327 GLU B 39 GLU^? 1000.00 A 339 ARG B 42 ARG^? 1000.00 coo 85.81 57.99 116.01 86.03 55.86 115.89 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 coo 75.11 41.01 160.30 76.65 40.06 161.41 -47.18 4.86 26.07 -48.34 6.33 25.07 coo 82.23 40.35 159.87 85.09 40.67 161.01 -53.81 2.37 28.63 -55.98 2.33 30.80 1hto_c00 source 1hto GLUTAMINE SYNTHETASE : 2 hits 1hto_c00 naa= 3 ULMN 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 1 3 # 1 A 267 GLU A 78 GLU^? 1000.00 A 369 ARG A 46 ARG^? 1000.00 A 372 TYR A 44 TYR^? 1000.00 coo 16.47 7.99 31.03 17.36 6.90 32.63 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 coo 18.73 -1.52 28.96 15.88 -0.55 29.44 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 16.01 4.58 27.39 13.82 5.38 28.94 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 ULMN 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 2 3 # 2 A 267 GLU A 80 GLU^? 1000.00 A 369 ARG A 42 ARG^? 1000.00 A 372 TYR A 44 TYR^? 1000.00 coo 16.47 7.99 31.03 17.36 6.90 32.63 -57.02 -18.07 -2.99 -58.93 -18.63 -3.73 coo 18.73 -1.52 28.96 15.88 -0.55 29.44 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 16.01 4.58 27.39 13.82 5.38 28.94 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 ULMN 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 3 3 # 3 A 267 GLU B 78 GLU^? 1000.00 A 369 ARG B 42 ARG^? 1000.00 A 372 TYR B 44 TYR^? 1000.00 coo 16.47 7.99 31.03 17.36 6.90 32.63 -56.54 -2.96 22.09 -57.18 -0.96 21.78 coo 18.73 -1.52 28.96 15.88 -0.55 29.44 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 16.01 4.58 27.39 13.82 5.38 28.94 -52.56 -0.11 20.46 -53.72 0.19 17.92 ULMN 3 1i1e_c00 BOTULINUM NEUROTOXIN TYPE B user 4 3 # 4 A 267 GLU B 78 GLU^? 1000.00 A 369 ARG B 46 ARG^? 1000.00 A 372 TYR B 44 TYR^? 1000.00 coo 16.47 7.99 31.03 17.36 6.90 32.63 -56.54 -2.96 22.09 -57.18 -0.96 21.78 coo 18.73 -1.52 28.96 15.88 -0.55 29.44 -54.06 -0.84 13.27 -52.10 1.52 13.37 coo 16.01 4.58 27.39 13.82 5.38 28.94 -52.56 -0.11 20.46 -53.72 0.19 17.92 1i1e_c00 source 1i1e BOTULINUM NEUROTOXIN TYPE B : 4 hits 1i1e_c00 naa= 3 ULMN 3 1i29_c03 CSDB user 1 3 # 1 A 128 VAL A 38 VAL^? 1000.00 A 200 ASP B 20 ASP^? 1000.00 A 226 LYS B 95 LYS^? 1000.00 coo 19.13 38.05 1.41 19.72 38.80 -0.53 -46.09 -25.10 0.48 -44.88 -25.49 -1.27 coo 24.51 43.28 11.18 25.17 44.50 9.58 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 34.47 51.09 7.19 28.58 51.18 7.53 -33.38 -10.82 7.30 -33.07 -12.53 13.40 ULMN 3 1i29_c03 CSDB user 2 3 # 2 A 128 VAL A 64 VAL^? 1000.00 A 200 ASP A 20 ASP^? 1000.00 A 226 LYS A 95 LYS^? 1000.00 coo 19.13 38.05 1.41 19.72 38.80 -0.53 -48.63 -20.44 -11.76 -48.60 -18.76 -10.34 coo 24.51 43.28 11.18 25.17 44.50 9.58 -46.33 -11.43 -16.79 -47.95 -10.15 -17.25 coo 34.47 51.09 7.19 28.58 51.18 7.53 -33.35 -7.32 -10.76 -32.76 -13.46 -12.27 ULMN 3 1i29_c03 CSDB user 3 3 # 3 A 128 VAL B 64 VAL^? 1000.00 A 200 ASP B 20 ASP^? 1000.00 A 226 LYS B 95 LYS^? 1000.00 coo 19.13 38.05 1.41 19.72 38.80 -0.53 -48.61 -11.76 20.43 -48.59 -10.33 18.76 coo 24.51 43.28 11.18 25.17 44.50 9.58 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 34.47 51.09 7.19 28.58 51.18 7.53 -33.38 -10.82 7.30 -33.07 -12.53 13.40 1i29_c03 source 1i29 CSDB : 3 hits 1i29_c03 naa= 3 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 1 3 # 1 54 ASP A 20 ASP^? 1000.00 158 THR A 50 THR^? 1000.00 317 ASP A 58 ASP^? 1000.00 coo -2.63 8.40 35.07 -3.66 9.81 36.17 -46.33 -11.43 -16.79 -47.95 -10.15 -17.25 coo -5.30 12.75 41.86 -4.34 13.05 39.99 -50.87 -6.22 -13.60 -49.45 -6.86 -15.08 coo -12.63 17.64 33.66 -10.65 17.90 34.40 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 2 3 # 2 54 ASP A 58 ASP^? 1000.00 158 THR A 48 THR^? 1000.00 317 ASP A 20 ASP^? 1000.00 coo -2.63 8.40 35.07 -3.66 9.81 36.17 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 coo -5.30 12.75 41.86 -4.34 13.05 39.99 -52.48 -10.49 -8.44 -52.10 -8.36 -8.18 coo -12.63 17.64 33.66 -10.65 17.90 34.40 -46.33 -11.43 -16.79 -47.95 -10.15 -17.25 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 3 3 # 3 54 ASP B 20 ASP^? 1000.00 158 THR B 50 THR^? 1000.00 317 ASP B 58 ASP^? 1000.00 coo -2.63 8.40 35.07 -3.66 9.81 36.17 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo -5.30 12.75 41.86 -4.34 13.05 39.99 -50.87 -13.60 6.25 -49.43 -15.06 6.90 coo -12.63 17.64 33.66 -10.65 17.90 34.40 -57.19 -14.71 16.52 -55.58 -13.45 15.88 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 4 3 # 4 54 ASP B 58 ASP^? 1000.00 158 THR B 48 THR^? 1000.00 317 ASP B 20 ASP^? 1000.00 coo -2.63 8.40 35.07 -3.66 9.81 36.17 -57.19 -14.71 16.52 -55.58 -13.45 15.88 coo -5.30 12.75 41.86 -4.34 13.05 39.99 -52.47 -8.44 10.51 -52.10 -8.16 8.38 coo -12.63 17.64 33.66 -10.65 17.90 34.40 -46.34 -16.80 11.39 -48.03 -17.24 10.19 1inp_c02 source 1inp INOSITOL POLYPHOSPHATE 1-PHOSPHATASE (1-PTASE): 4 hits 1inp_c02 naa= 3 ULMN 3 1m53_c03 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP B 20 ASP^? 1000.00 A 295 GLU B 22 GLU^? 1000.00 A 369 ASP A 35 ASP^? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 16.11 33.72 80.99 14.10 33.54 81.63 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 12.19 31.08 87.29 11.13 32.66 86.38 -49.43 -15.23 0.44 -49.11 -16.26 2.29 1m53_c03 source 1m53 ISOMALTULOSE SYNTHASE : 1 hits 1m53_c03 naa= 3 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 35 ASP^? 1000.00 A 265 GLU B 84 GLU^? 1000.00 A 369 ASP B 20 ASP^? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 17.36 23.57 72.04 18.68 21.92 71.98 -58.36 -2.12 5.81 -60.03 -0.84 6.05 coo 12.19 31.08 87.29 11.13 32.66 86.38 -46.34 -16.80 11.39 -48.03 -17.24 10.19 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 35 ASP^? 1000.00 A 265 GLU B 94 GLU^? 1000.00 A 369 ASP B 20 ASP^? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 17.36 23.57 72.04 18.68 21.92 71.98 -32.15 -7.39 3.51 -33.16 -7.14 1.67 coo 12.19 31.08 87.29 11.13 32.66 86.38 -46.34 -16.80 11.39 -48.03 -17.24 10.19 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP B 20 ASP^? 1000.00 A 265 GLU B 94 GLU^? 1000.00 A 369 ASP A 35 ASP^? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 17.36 23.57 72.04 18.68 21.92 71.98 -32.15 -7.39 3.51 -33.16 -7.14 1.67 coo 12.19 31.08 87.29 11.13 32.66 86.38 -49.43 -15.23 0.44 -49.11 -16.26 2.29 1m53_c05 source 1m53 ISOMALTULOSE SYNTHASE : 3 hits 1m53_c05 naa= 3 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 35 ASP^? 1000.00 A 279 GLU A 62 GLU^? 1000.00 A 369 ASP B 20 ASP^? 1000.00 coo 11.74 38.14 80.19 10.63 36.40 80.65 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 16.54 46.37 63.94 14.77 45.79 62.95 -53.80 -22.83 -16.54 -54.72 -24.31 -15.35 coo 12.19 31.08 87.29 11.13 32.66 86.38 -46.34 -16.80 11.39 -48.03 -17.24 10.19 1m53_c06 source 1m53 ISOMALTULOSE SYNTHASE : 1 hits 1m53_c06 naa= 3 ULMN 3 1mro_c00 METHYL-COENZYME M REDUCTASE user 1 3 # 1 A 465 GLY B 24 GLY^? 1000.00 A 501 ASP B 35 ASP^? 1000.00 B 367 TYR A 19 TYR^? 1000.00 coo 4.40 25.46 -23.33 5.00 25.87 -23.68 -41.94 -20.50 9.78 -42.09 -19.72 9.58 coo 13.82 6.17 -29.83 11.78 5.87 -29.33 -49.40 0.45 15.21 -49.07 2.29 16.26 coo 27.05 35.80 -12.24 28.72 34.05 -10.85 -41.17 -15.27 -18.35 -38.46 -15.21 -17.66 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 B 24 GLY^? 1000.00 D 501 ASP B 35 ASP^? 1000.00 E 367 TYR A 19 TYR^? 1000.00 coo 21.60 60.44 -42.77 21.61 59.72 -42.40 -41.94 -20.50 9.78 -42.09 -19.72 9.58 coo 42.23 65.30 -35.49 41.21 67.05 -36.13 -49.40 0.45 15.21 -49.07 2.29 16.26 coo 28.27 36.08 -52.91 30.75 35.88 -54.18 -41.17 -15.27 -18.35 -38.46 -15.21 -17.66 1mro_c01 source 1mro METHYL-COENZYME M REDUCTASE : 1 hits 1mro_c01 naa= 3 ULMN 3 1oqz_c00 GLUTARYL ACYLASE user 1 3 # 1 A 170 SER A 93 SER^? 1000.00 A 239 VAL A 28 VAL.? 1000.00 A 413 ASN A 29 ASN.? 1000.00 coo 80.14 40.76 52.28 77.73 40.59 51.94 -37.64 -6.34 -7.71 -36.86 -8.13 -9.13 coo 75.67 35.37 52.30 76.00 35.96 50.23 -41.76 -13.23 -9.04 -40.69 -14.83 -7.99 coo 81.75 35.21 52.13 80.92 37.12 51.69 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 ULMN 3 1oqz_c00 GLUTARYL ACYLASE user 2 3 # 2 A 170 SER B 93 SER^? 1000.00 A 239 VAL B 28 VAL^? 1000.00 A 413 ASN B 29 ASN^? 1000.00 coo 80.14 40.76 52.28 77.73 40.59 51.94 -37.64 -7.71 6.34 -36.84 -9.11 8.12 coo 75.67 35.37 52.30 76.00 35.96 50.23 -41.78 -9.03 13.24 -40.69 -8.00 14.84 coo 81.75 35.21 52.13 80.92 37.12 51.69 -38.46 -11.22 10.44 -36.76 -10.52 11.49 1oqz_c00 source 1oqz GLUTARYL ACYLASE : 2 hits 1oqz_c00 naa= 3 ULMN 3 1oqz_c01 GLUTARYL ACYLASE user 1 3 # 1 B 170 SER A 93 SER^? 1000.00 B 239 VAL A 28 VAL.? 1000.00 B 413 ASN A 29 ASN.? 1000.00 coo 25.22 6.41 2.90 27.67 6.33 3.11 -37.64 -6.34 -7.71 -36.86 -8.13 -9.13 coo 29.71 1.00 2.66 29.43 1.57 4.74 -41.76 -13.23 -9.04 -40.69 -14.83 -7.99 coo 23.72 0.88 2.95 24.56 2.79 3.34 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 ULMN 3 1oqz_c01 GLUTARYL ACYLASE user 2 3 # 2 B 170 SER B 93 SER^? 1000.00 B 239 VAL B 28 VAL^? 1000.00 B 413 ASN B 29 ASN^? 1000.00 coo 25.22 6.41 2.90 27.67 6.33 3.11 -37.64 -7.71 6.34 -36.84 -9.11 8.12 coo 29.71 1.00 2.66 29.43 1.57 4.74 -41.78 -9.03 13.24 -40.69 -8.00 14.84 coo 23.72 0.88 2.95 24.56 2.79 3.34 -38.46 -11.22 10.44 -36.76 -10.52 11.49 1oqz_c01 source 1oqz GLUTARYL ACYLASE : 2 hits 1oqz_c01 naa= 3 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 A 70 ALA A 11 ALA~? 1000.00 A 126 LEU A 15 LEU~? 1000.00 A 158 GLU A 16 GLU~? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -41.28 -23.34 -5.44 -42.23 -23.14 -4.26 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -42.89 -18.77 -8.93 -44.64 -19.68 -8.04 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -37.95 -16.73 -9.43 -36.24 -17.13 -8.24 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA A 67 ALA^? 1000.00 A 126 LEU A 15 LEU~? 1000.00 A 158 GLU A 16 GLU~? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -45.63 -24.57 -12.05 -45.12 -23.13 -12.00 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -42.89 -18.77 -8.93 -44.64 -19.68 -8.04 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -37.95 -16.73 -9.43 -36.24 -17.13 -8.24 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 A 70 ALA B 11 ALA^? 1000.00 A 126 LEU B 15 LEU^? 1000.00 A 158 GLU B 16 GLU^? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -41.28 -5.44 23.36 -42.23 -4.26 23.17 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -42.95 -9.00 18.74 -44.76 -8.04 19.45 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -37.94 -9.44 16.81 -36.14 -8.36 17.15 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 A 70 ALA B 67 ALA^? 1000.00 A 126 LEU B 15 LEU^? 1000.00 A 158 GLU B 16 GLU^? 1000.00 coo -2.29 37.66 144.73 -1.46 37.12 145.87 -45.61 -12.06 24.58 -45.10 -12.03 23.14 coo -4.62 32.83 147.14 -5.50 32.85 149.12 -42.95 -9.00 18.74 -44.76 -8.04 19.45 coo -0.83 29.57 149.77 -0.39 31.47 148.95 -37.94 -9.44 16.81 -36.14 -8.36 17.15 1pjh_c00 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 4 hits 1pjh_c00 naa= 3 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 B 70 ALA A 11 ALA~? 1000.00 B 126 LEU A 15 LEU~? 1000.00 B 158 GLU A 16 GLU~? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -41.28 -23.34 -5.44 -42.23 -23.14 -4.26 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -42.89 -18.77 -8.93 -44.64 -19.68 -8.04 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -37.95 -16.73 -9.43 -36.24 -17.13 -8.24 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA A 67 ALA^? 1000.00 B 126 LEU A 15 LEU~? 1000.00 B 158 GLU A 16 GLU~? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -45.63 -24.57 -12.05 -45.12 -23.13 -12.00 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -42.89 -18.77 -8.93 -44.64 -19.68 -8.04 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -37.95 -16.73 -9.43 -36.24 -17.13 -8.24 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 B 70 ALA B 11 ALA^? 1000.00 B 126 LEU B 15 LEU^? 1000.00 B 158 GLU B 16 GLU^? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -41.28 -5.44 23.36 -42.23 -4.26 23.17 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -42.95 -9.00 18.74 -44.76 -8.04 19.45 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -37.94 -9.44 16.81 -36.14 -8.36 17.15 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 B 70 ALA B 67 ALA^? 1000.00 B 126 LEU B 15 LEU^? 1000.00 B 158 GLU B 16 GLU^? 1000.00 coo -39.79 4.61 147.27 -39.61 5.56 148.47 -45.61 -12.06 24.58 -45.10 -12.03 23.14 coo -34.22 5.06 149.25 -33.65 4.24 151.15 -42.95 -9.00 18.74 -44.76 -8.04 19.45 coo -33.03 9.93 151.71 -34.98 9.38 151.11 -37.94 -9.44 16.81 -36.14 -8.36 17.15 1pjh_c01 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 4 hits 1pjh_c01 naa= 3 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 C 70 ALA A 11 ALA~? 1000.00 C 126 LEU A 15 LEU~? 1000.00 C 158 GLU A 16 GLU~? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -41.28 -23.34 -5.44 -42.23 -23.14 -4.26 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -42.89 -18.77 -8.93 -44.64 -19.68 -8.04 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -37.95 -16.73 -9.43 -36.24 -17.13 -8.24 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA A 67 ALA^? 1000.00 C 126 LEU A 15 LEU~? 1000.00 C 158 GLU A 16 GLU~? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -45.63 -24.57 -12.05 -45.12 -23.13 -12.00 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -42.89 -18.77 -8.93 -44.64 -19.68 -8.04 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -37.95 -16.73 -9.43 -36.24 -17.13 -8.24 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 3 3 # 3 C 70 ALA B 11 ALA^? 1000.00 C 126 LEU B 14 LEU^? 1000.00 C 158 GLU B 16 GLU^? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -41.28 -5.44 23.36 -42.23 -4.26 23.17 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -41.40 -9.93 23.72 -41.15 -10.09 25.86 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -37.94 -9.44 16.81 -36.14 -8.36 17.15 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 4 3 # 4 C 70 ALA B 11 ALA^? 1000.00 C 126 LEU B 15 LEU^? 1000.00 C 158 GLU B 16 GLU^? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -41.28 -5.44 23.36 -42.23 -4.26 23.17 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -42.95 -9.00 18.74 -44.76 -8.04 19.45 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -37.94 -9.44 16.81 -36.14 -8.36 17.15 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 5 3 # 5 C 70 ALA B 67 ALA^? 1000.00 C 126 LEU B 14 LEU^? 1000.00 C 158 GLU B 16 GLU^? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -45.61 -12.06 24.58 -45.10 -12.03 23.14 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -41.40 -9.93 23.72 -41.15 -10.09 25.86 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -37.94 -9.44 16.81 -36.14 -8.36 17.15 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 6 3 # 6 C 70 ALA B 67 ALA^? 1000.00 C 126 LEU B 15 LEU^? 1000.00 C 158 GLU B 16 GLU^? 1000.00 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 -45.61 -12.06 24.58 -45.10 -12.03 23.14 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 -42.95 -9.00 18.74 -44.76 -8.04 19.45 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 -37.94 -9.44 16.81 -36.14 -8.36 17.15 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 6 hits 1pjh_c02 naa= 3 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 # 1 B 1 SER A 93 SER^? 1000.00 B 69 ALA A 96 ALA^? 1000.00 B 241 ASN A 29 ASN.? 1000.00 coo 13.24 41.94 33.13 13.08 39.54 33.17 -37.64 -6.34 -7.71 -36.86 -8.13 -9.13 coo 9.15 37.89 36.69 10.55 37.76 37.22 -36.47 -6.45 -12.75 -37.89 -6.51 -12.23 coo 10.91 43.03 38.47 11.81 41.82 36.93 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 2 3 # 2 B 1 SER B 93 SER^? 1000.00 B 69 ALA B 96 ALA^? 1000.00 B 241 ASN B 29 ASN^? 1000.00 coo 13.24 41.94 33.13 13.08 39.54 33.17 -37.64 -7.71 6.34 -36.84 -9.11 8.12 coo 9.15 37.89 36.69 10.55 37.76 37.22 -36.53 -12.78 6.48 -37.94 -12.23 6.51 coo 10.91 43.03 38.47 11.81 41.82 36.93 -38.46 -11.22 10.44 -36.76 -10.52 11.49 1pnl_c00 source 1pnl PENICILLIN AMIDOHYDROLASE : 2 hits 1pnl_c00 naa= 3 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 1 3 # 1 A 67 ASP A 26 ASP^? 1000.00 A 68 ALA A 17 ALA.? 1000.00 A 72 LEU A 15 LEU~? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -40.43 -14.45 -14.00 -39.23 -13.59 -12.50 coo 48.88 4.35 16.59 48.73 5.09 15.20 -39.76 -19.33 -14.70 -39.35 -20.80 -14.82 coo 53.89 6.25 15.09 52.88 7.92 14.14 -42.89 -18.77 -8.93 -44.64 -19.68 -8.04 ULMN 3 1q6l_c05 3-KETO-L-GULONATE 6-PHOSPHATE DECARBuser 2 3 # 2 A 67 ASP B 26 ASP^? 1000.00 A 68 ALA B 17 ALA^? 1000.00 A 72 LEU B 15 LEU^? 1000.00 coo 46.76 7.59 18.65 45.27 6.01 18.52 -40.43 -13.98 14.44 -39.18 -12.51 13.58 coo 48.88 4.35 16.59 48.73 5.09 15.20 -39.77 -14.73 19.31 -39.37 -14.85 20.79 coo 53.89 6.25 15.09 52.88 7.92 14.14 -42.95 -9.00 18.74 -44.76 -8.04 19.45 1q6l_c05 source 1q6l 3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE : 2 hits 1q6l_c05 naa= 3 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 155 HIS A 57 HIS^? 1000.00 A 236 ASP A 26 ASP^? 1000.00 A 261 LYS A 95 LYS^? 1000.00 coo 55.45 46.76 42.08 57.34 46.16 42.75 -59.56 -18.13 -21.34 -60.89 -19.30 -22.47 coo 48.87 29.19 44.63 49.10 27.34 43.63 -40.43 -14.45 -14.00 -39.23 -13.59 -12.50 coo 47.58 17.35 41.83 51.40 20.85 40.83 -33.35 -7.32 -10.76 -32.76 -13.46 -12.27 ULMN 3 1qgn_c00 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 155 HIS B 57 HIS^? 1000.00 A 236 ASP B 26 ASP^? 1000.00 A 261 LYS B 95 LYS^? 1000.00 coo 55.45 46.76 42.08 57.34 46.16 42.75 -59.63 -21.34 18.09 -61.00 -22.53 19.14 coo 48.87 29.19 44.63 49.10 27.34 43.63 -40.43 -13.98 14.44 -39.18 -12.51 13.58 coo 47.58 17.35 41.83 51.40 20.85 40.83 -33.38 -10.82 7.30 -33.07 -12.53 13.40 1qgn_c00 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c00 naa= 3 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 D 155 HIS A 57 HIS^? 1000.00 D 236 ASP A 26 ASP^? 1000.00 D 261 LYS A 95 LYS^? 1000.00 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 -59.56 -18.13 -21.34 -60.89 -19.30 -22.47 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -40.43 -14.45 -14.00 -39.23 -13.59 -12.50 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 -33.35 -7.32 -10.76 -32.76 -13.46 -12.27 ULMN 3 1qgn_c03 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 D 155 HIS B 57 HIS^? 1000.00 D 236 ASP B 26 ASP^? 1000.00 D 261 LYS B 95 LYS^? 1000.00 coo 21.65 -31.73 40.91 19.91 -31.10 41.91 -59.63 -21.34 18.09 -61.00 -22.53 19.14 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 -40.43 -13.98 14.44 -39.18 -12.51 13.58 coo 29.23 -2.19 42.26 25.35 -5.68 41.50 -33.38 -10.82 7.30 -33.07 -12.53 13.40 1qgn_c03 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c03 naa= 3 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 155 HIS A 57 HIS^? 1000.00 E 236 ASP A 26 ASP^? 1000.00 E 261 LYS A 95 LYS^? 1000.00 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 -59.56 -18.13 -21.34 -60.89 -19.30 -22.47 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -40.43 -14.45 -14.00 -39.23 -13.59 -12.50 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 -33.35 -7.32 -10.76 -32.76 -13.46 -12.27 ULMN 3 1qgn_c04 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 155 HIS B 57 HIS^? 1000.00 E 236 ASP B 26 ASP^? 1000.00 E 261 LYS B 95 LYS^? 1000.00 coo 76.61 -27.00 -35.69 75.87 -28.77 -34.87 -59.63 -21.34 18.09 -61.00 -22.53 19.14 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -40.43 -13.98 14.44 -39.18 -12.51 13.58 coo 47.72 -17.32 -35.69 50.97 -21.34 -36.71 -33.38 -10.82 7.30 -33.07 -12.53 13.40 1qgn_c04 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c04 naa= 3 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 H 155 HIS A 57 HIS^? 1000.00 H 236 ASP A 26 ASP^? 1000.00 H 261 LYS A 95 LYS^? 1000.00 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 -59.56 -18.13 -21.34 -60.89 -19.30 -22.47 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -40.43 -14.45 -14.00 -39.23 -13.59 -12.50 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 -33.35 -7.32 -10.76 -32.76 -13.46 -12.27 ULMN 3 1qgn_c07 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 H 155 HIS B 57 HIS^? 1000.00 H 236 ASP B 26 ASP^? 1000.00 H 261 LYS B 95 LYS^? 1000.00 coo 0.50 11.68 -36.58 0.99 13.43 -35.52 -59.63 -21.34 18.09 -61.00 -22.53 19.14 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -40.43 -13.98 14.44 -39.18 -12.51 13.58 coo 29.54 2.32 -35.34 26.33 6.41 -36.17 -33.38 -10.82 7.30 -33.07 -12.53 13.40 1qgn_c07 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c07 naa= 3 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 44 TYR^? 1000.00 B 236 ASP A 35 ASP^? 1000.00 D 110 ARG A 42 ARG^? 1000.00 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 -54.32 -29.07 0.18 -55.53 -31.83 0.78 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR B 44 TYR^? 1000.00 B 236 ASP B 35 ASP^? 1000.00 D 110 ARG B 42 ARG^? 1000.00 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 -49.40 0.45 15.21 -49.07 2.29 16.26 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 -53.81 2.37 28.63 -55.98 2.33 30.80 1qgn_c19 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c19 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG A 42 ARG^? 1000.00 H 163 TYR A 44 TYR^? 1000.00 H 236 ASP A 35 ASP^? 1000.00 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 -54.32 -29.07 0.18 -55.53 -31.83 0.78 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -49.43 -15.23 0.44 -49.11 -16.26 2.29 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 110 ARG B 42 ARG^? 1000.00 H 163 TYR B 44 TYR^? 1000.00 H 236 ASP B 35 ASP^? 1000.00 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 -53.81 2.37 28.63 -55.98 2.33 30.80 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 -49.40 0.45 15.21 -49.07 2.29 16.26 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c21 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 44 TYR^? 1000.00 E 236 ASP A 35 ASP^? 1000.00 G 110 ARG A 42 ARG^? 1000.00 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 -54.32 -29.07 0.18 -55.53 -31.83 0.78 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR B 44 TYR^? 1000.00 E 236 ASP B 35 ASP^? 1000.00 G 110 ARG B 42 ARG^? 1000.00 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 -49.40 0.45 15.21 -49.07 2.29 16.26 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 -53.81 2.37 28.63 -55.98 2.33 30.80 1qgn_c22 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 2 hits 1qgn_c22 naa= 3 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 1 3 # 1 A 49 ASP A 20 ASP^? 1000.00 A 147 THR A 50 THR^? 1000.00 A 294 ASP A 58 ASP^? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 -46.33 -11.43 -16.79 -47.95 -10.15 -17.25 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 -50.87 -6.22 -13.60 -49.45 -6.86 -15.08 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 ULMN 3 1qgx_c02 3',5'-ADENOSINE BISPHOSPHATASE user 2 3 # 2 A 49 ASP B 20 ASP^? 1000.00 A 147 THR B 50 THR^? 1000.00 A 294 ASP B 58 ASP^? 1000.00 coo 1.13 15.67 -24.51 2.35 14.34 -25.71 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 6.09 11.55 -27.32 4.75 13.20 -27.33 -50.87 -13.60 6.25 -49.43 -15.06 6.90 coo 14.48 16.57 -21.30 13.03 16.83 -22.81 -57.19 -14.71 16.52 -55.58 -13.45 15.88 1qgx_c02 source 1qgx 3',5'-ADENOSINE BISPHOSPHATASE : 2 hits 1qgx_c02 naa= 3 ULMN 3 1qho_c04 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP B 20 ASP^? 1000.00 A 256 GLU B 22 GLU^? 1000.00 A 329 ASP A 35 ASP^? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 30.54 71.65 32.58 31.73 72.26 30.92 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 37.87 70.12 31.80 36.61 69.74 30.15 -49.43 -15.23 0.44 -49.11 -16.26 2.29 1qho_c04 source 1qho ALPHA-AMYLASE : 1 hits 1qho_c04 naa= 3 ULMN 3 1qho_c05 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 20 ASP^? 1000.00 A 261 ASP A 35 ASP^? 1000.00 A 329 ASP A 58 ASP^? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 -46.33 -11.43 -16.79 -47.95 -10.15 -17.25 coo 34.02 79.89 42.60 34.73 78.01 41.86 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 37.87 70.12 31.80 36.61 69.74 30.15 -57.20 -16.52 -14.70 -55.60 -15.92 -13.43 ULMN 3 1qho_c05 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP B 20 ASP^? 1000.00 A 261 ASP B 35 ASP^? 1000.00 A 329 ASP B 58 ASP^? 1000.00 coo 28.46 69.88 26.74 30.40 70.70 26.53 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 34.02 79.89 42.60 34.73 78.01 41.86 -49.40 0.45 15.21 -49.07 2.29 16.26 coo 37.87 70.12 31.80 36.61 69.74 30.15 -57.19 -14.71 16.52 -55.58 -13.45 15.88 1qho_c05 source 1qho ALPHA-AMYLASE : 2 hits 1qho_c05 naa= 3 ULMN 3 1uok_c03 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP B 20 ASP^? 1000.00 255 GLU B 22 GLU^? 1000.00 329 ASP A 35 ASP^? 1000.00 coo 49.16 35.16 15.19 51.08 34.43 15.65 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 52.57 37.12 10.17 53.37 35.95 11.75 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 59.16 37.82 13.95 57.63 37.03 15.12 -49.43 -15.23 0.44 -49.11 -16.26 2.29 1uok_c03 source 1uok OLIGO-1,6-GLUCOSIDASE : 1 hits 1uok_c03 naa= 3 ULMN 3 1v0e_c00 ENDO-ALPHA-SIALIDASE user 1 3 # 1 A 581 GLU A 62 GLU^? 1000.00 A 596 ARG A 65 ARG^? 1000.00 A 647 ARG A 70 ARG^? 1000.00 coo 69.13 32.20 28.58 68.39 32.96 30.44 -53.80 -22.83 -16.54 -54.72 -24.31 -15.35 coo 70.89 37.31 29.70 69.54 36.29 32.39 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo 66.09 40.54 34.70 66.92 37.69 35.49 -44.42 -29.60 -13.59 -47.25 -28.83 -14.52 1v0e_c00 source 1v0e ENDO-ALPHA-SIALIDASE : 1 hits 1v0e_c00 naa= 3 ULMN 3 1v0e_c01 ENDO-ALPHA-SIALIDASE user 1 3 # 1 B 581 GLU A 62 GLU^? 1000.00 B 596 ARG A 65 ARG^? 1000.00 B 647 ARG A 70 ARG^? 1000.00 coo 38.22 57.83 70.36 36.82 56.74 69.18 -53.80 -22.83 -16.54 -54.72 -24.31 -15.35 coo 34.24 60.89 68.08 33.31 57.93 67.63 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo 31.43 57.38 61.97 31.90 55.58 64.41 -44.42 -29.60 -13.59 -47.25 -28.83 -14.52 1v0e_c01 source 1v0e ENDO-ALPHA-SIALIDASE : 1 hits 1v0e_c01 naa= 3 ULMN 3 1v0e_c02 ENDO-ALPHA-SIALIDASE user 1 3 # 1 C 581 GLU A 62 GLU^? 1000.00 C 596 ARG A 65 ARG^? 1000.00 C 647 ARG A 70 ARG^? 1000.00 coo 11.31 31.26 27.00 13.31 30.71 26.58 -53.80 -22.83 -16.54 -54.72 -24.31 -15.35 coo 13.44 32.78 22.07 15.56 30.91 23.37 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo 21.00 33.35 22.82 19.83 30.82 24.09 -44.42 -29.60 -13.59 -47.25 -28.83 -14.52 1v0e_c02 source 1v0e ENDO-ALPHA-SIALIDASE : 1 hits 1v0e_c02 naa= 3 ULMN 3 1v0e_c03 ENDO-ALPHA-SIALIDASE user 1 3 # 1 D 581 GLU A 62 GLU^? 1000.00 D 596 ARG A 65 ARG^? 1000.00 D 647 ARG A 70 ARG^? 1000.00 coo -44.60 -18.05 21.23 -43.91 -19.28 22.81 -53.80 -22.83 -16.54 -54.72 -24.31 -15.35 coo -46.27 -23.29 20.77 -45.12 -23.03 23.65 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo -41.59 -27.81 24.72 -42.43 -25.21 26.20 -44.42 -29.60 -13.59 -47.25 -28.83 -14.52 1v0e_c03 source 1v0e ENDO-ALPHA-SIALIDASE : 1 hits 1v0e_c03 naa= 3 ULMN 3 1v0e_c04 ENDO-ALPHA-SIALIDASE user 1 3 # 1 E 581 GLU A 62 GLU^? 1000.00 E 596 ARG A 65 ARG^? 1000.00 E 647 ARG A 70 ARG^? 1000.00 coo 13.14 -15.80 20.26 11.08 -15.36 20.42 -53.80 -22.83 -16.54 -54.72 -24.31 -15.35 coo 10.98 -16.04 15.26 8.84 -14.68 17.08 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo 3.51 -16.91 15.71 4.51 -14.91 17.79 -44.42 -29.60 -13.59 -47.25 -28.83 -14.52 1v0e_c04 source 1v0e ENDO-ALPHA-SIALIDASE : 1 hits 1v0e_c04 naa= 3 ULMN 3 1v0e_c05 ENDO-ALPHA-SIALIDASE user 1 3 # 1 F 581 GLU A 62 GLU^? 1000.00 F 596 ARG A 65 ARG^? 1000.00 F 647 ARG A 70 ARG^? 1000.00 coo -13.62 -54.34 53.96 -12.26 -52.95 53.12 -53.80 -22.83 -16.54 -54.72 -24.31 -15.35 coo -9.88 -56.64 50.98 -8.81 -53.71 51.30 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo -6.86 -51.53 46.20 -7.51 -50.44 49.00 -44.42 -29.60 -13.59 -47.25 -28.83 -14.52 1v0e_c05 source 1v0e ENDO-ALPHA-SIALIDASE : 1 hits 1v0e_c05 naa= 3 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 B 124 ALA A 43 ALA^? 1000.00 B 126 ARG A 65 ARG^? 1000.00 B 138 GLU A 39 GLU^? 1000.00 coo 2.11 4.00 19.31 3.14 4.86 19.99 -49.67 -25.57 -1.91 -48.91 -25.80 -3.20 coo 2.45 5.53 11.28 3.59 7.56 13.29 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo 6.10 2.00 25.24 6.12 1.84 23.13 -47.18 -26.06 4.85 -48.32 -25.05 6.33 ULMN 3 1xs1_c07 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 B 124 ALA B 43 ALA^? 1000.00 B 126 ARG B 65 ARG^? 1000.00 B 138 GLU B 39 GLU^? 1000.00 coo 2.11 4.00 19.31 3.14 4.86 19.99 -49.63 -1.90 25.54 -48.87 -3.19 25.75 coo 2.45 5.53 11.28 3.59 7.56 13.29 -52.72 -10.65 26.03 -52.74 -13.16 27.81 coo 6.10 2.00 25.24 6.12 1.84 23.13 -47.18 4.86 26.07 -48.34 6.33 25.07 1xs1_c07 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 2 hits 1xs1_c07 naa= 3 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 C 124 ALA A 43 ALA^? 1000.00 C 126 ARG A 65 ARG^? 1000.00 C 138 GLU A 39 GLU^? 1000.00 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -49.67 -25.57 -1.91 -48.91 -25.80 -3.20 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -47.18 -26.06 4.85 -48.32 -25.05 6.33 ULMN 3 1xs1_c08 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 C 124 ALA B 43 ALA^? 1000.00 C 126 ARG B 65 ARG^? 1000.00 C 138 GLU B 39 GLU^? 1000.00 coo -4.54 -7.50 19.94 -4.33 -8.73 20.82 -49.63 -1.90 25.54 -48.87 -3.19 25.75 coo -3.14 -9.40 12.05 -1.75 -11.23 14.08 -52.72 -10.65 26.03 -52.74 -13.16 27.81 coo -8.56 -9.50 25.72 -8.77 -9.47 23.62 -47.18 4.86 26.07 -48.34 6.33 25.07 1xs1_c08 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 2 hits 1xs1_c08 naa= 3 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 D 124 ALA A 43 ALA^? 1000.00 D 126 ARG A 65 ARG^? 1000.00 D 138 GLU A 39 GLU^? 1000.00 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -49.67 -25.57 -1.91 -48.91 -25.80 -3.20 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo 6.23 0.50 57.10 5.93 0.72 59.19 -47.18 -26.06 4.85 -48.32 -25.05 6.33 ULMN 3 1xs1_c09 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 D 124 ALA B 43 ALA^? 1000.00 D 126 ARG B 65 ARG^? 1000.00 D 138 GLU B 39 GLU^? 1000.00 coo 2.08 -1.49 62.94 3.12 -2.39 62.28 -49.63 -1.90 25.54 -48.87 -3.19 25.75 coo 2.52 -3.11 70.84 3.63 -5.24 68.92 -52.72 -10.65 26.03 -52.74 -13.16 27.81 coo 6.23 0.50 57.10 5.93 0.72 59.19 -47.18 4.86 26.07 -48.34 6.33 25.07 1xs1_c09 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 2 hits 1xs1_c09 naa= 3 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 E 124 ALA A 43 ALA^? 1000.00 E 126 ARG A 65 ARG^? 1000.00 E 138 GLU A 39 GLU^? 1000.00 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -49.67 -25.57 -1.91 -48.91 -25.80 -3.20 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -47.18 -26.06 4.85 -48.32 -25.05 6.33 ULMN 3 1xs1_c10 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 E 124 ALA B 43 ALA^? 1000.00 E 126 ARG B 65 ARG^? 1000.00 E 138 GLU B 39 GLU^? 1000.00 coo -4.56 10.03 62.36 -4.38 11.31 61.55 -49.63 -1.90 25.54 -48.87 -3.19 25.75 coo -3.02 12.00 70.07 -1.94 13.84 67.82 -52.72 -10.65 26.03 -52.74 -13.16 27.81 coo -8.67 12.22 56.54 -8.68 12.09 58.65 -47.18 4.86 26.07 -48.34 6.33 25.07 1xs1_c10 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 2 hits 1xs1_c10 naa= 3 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 1 3 # 1 F 124 ALA A 43 ALA^? 1000.00 F 126 ARG A 65 ARG^? 1000.00 F 138 GLU A 39 GLU^? 1000.00 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -49.67 -25.57 -1.91 -48.91 -25.80 -3.20 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -47.18 -26.06 4.85 -48.32 -25.05 6.33 ULMN 3 1xs1_c11 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASEuser 2 3 # 2 F 124 ALA B 43 ALA^? 1000.00 F 126 ARG B 65 ARG^? 1000.00 F 138 GLU B 39 GLU^? 1000.00 coo -11.15 -1.53 62.85 -12.44 -2.03 62.23 -49.63 -1.90 25.54 -48.87 -3.19 25.75 coo -13.16 -0.52 70.77 -15.41 -0.40 68.66 -52.72 -10.65 26.03 -52.74 -13.16 27.81 coo -11.26 -6.31 57.37 -11.02 -6.31 59.47 -47.18 4.86 26.07 -48.34 6.33 25.07 1xs1_c11 source 1xs1 DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE : 2 hits 1xs1_c11 naa= 3 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 1 3 # 1 B 137 GLY B 53 GLY^? 1000.00 B 175 ARG A 46 ARG^? 1000.00 B 242 TYR A 44 TYR^? 1000.00 coo 99.45 58.28 3.33 99.57 58.61 4.10 -60.45 -13.86 6.74 -59.78 -13.57 7.07 coo 106.37 63.53 0.89 108.02 63.40 -1.62 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 100.93 69.04 4.38 99.52 68.48 2.09 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 1xva_c03 source 1xva GLYCINE N-METHYLTRANSFERASE : 1 hits 1xva_c03 naa= 3 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 # 1 142 TRP B 87 TRP^? 1000.00 223 ASP A 35 ASP^? 1000.00 258 ALA B 96 ALA^? 1000.00 coo 128.40 33.01 26.67 128.12 36.28 28.81 -47.77 -8.79 6.03 -46.96 -12.21 4.25 coo 127.91 41.73 23.55 129.18 40.35 24.44 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 141.00 37.49 25.74 139.80 37.53 24.78 -36.53 -12.78 6.48 -37.94 -12.23 6.51 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 1 hits 2aat_c01 naa= 3 ULMN 3 2amg_c02 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP B 20 ASP^? 1000.00 219 GLU B 22 GLU^? 1000.00 294 ASP A 35 ASP^? 1000.00 coo 27.89 102.52 14.98 29.35 101.92 13.57 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo 25.84 105.87 9.06 27.86 105.55 8.74 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 33.16 106.80 7.72 33.34 104.87 6.92 -49.43 -15.23 0.44 -49.11 -16.26 2.29 2amg_c02 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 1 hits 2amg_c02 naa= 3 ULMN 3 2dbt_c00 CHITINASE C user 1 3 # 1 A 147 GLU A 8 GLU~? 1000.00 A 156 GLU B 22 GLU^? 1000.00 A 194 ASN B 29 ASN^? 1000.00 coo 74.14 15.91 8.55 72.08 15.36 8.63 -40.65 -21.45 0.99 -42.76 -21.54 0.85 coo 67.47 20.07 1.34 65.99 20.06 2.88 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 67.44 25.26 13.91 67.54 23.65 15.28 -38.46 -11.22 10.44 -36.76 -10.52 11.49 2dbt_c00 source 2dbt CHITINASE C : 1 hits 2dbt_c00 naa= 3 ULMN 3 2dbt_c02 CHITINASE C user 1 3 # 1 C 147 GLU A 8 GLU~? 1000.00 C 156 GLU B 22 GLU^? 1000.00 C 194 ASN B 29 ASN^? 1000.00 coo 41.23 29.31 13.28 43.03 29.85 12.29 -40.65 -21.45 0.99 -42.76 -21.54 0.85 coo 44.75 23.09 5.51 46.77 22.91 6.12 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo 49.75 21.00 18.12 50.45 23.02 18.26 -38.46 -11.22 10.44 -36.76 -10.52 11.49 2dbt_c02 source 2dbt CHITINASE C : 1 hits 2dbt_c02 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP A 35 ASP^? 1000.00 166 GLY B 61 GLY^? 1000.00 169 GLU B 78 GLU^? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo -8.58 13.22 3.21 -8.90 13.15 4.05 -52.93 -12.72 17.90 -52.73 -13.47 18.27 coo -16.67 7.89 2.78 -17.65 6.56 1.49 -56.54 -2.96 22.09 -57.18 -0.96 21.78 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 # 2 141 ASP B 58 ASP^? 1000.00 166 GLY B 24 GLY^? 1000.00 169 GLU A 8 GLU~? 1000.00 coo 8.28 6.87 1.62 10.08 5.77 1.34 -57.19 -14.71 16.52 -55.58 -13.45 15.88 coo -8.58 13.22 3.21 -8.90 13.15 4.05 -41.94 -20.50 9.78 -42.09 -19.72 9.58 coo -16.67 7.89 2.78 -17.65 6.56 1.49 -40.65 -21.45 0.99 -42.76 -21.54 0.85 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 2 hits 2tdt_c00 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 29 ASN.? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN B 29 ASN^? 1000.00 coo 5.80 63.03 55.85 5.52 65.03 56.45 -38.46 -11.22 10.44 -36.76 -10.52 11.49 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 2 hits 1kbk_p00 naa= 1 ULMN 4 2cl8_p00 DECTIN-1 user 1 4 # 1 A 145 ARG A 91 ARG^? 1000.00 A 148 SER A 93 SER^? 1000.00 A 152 ALA A 96 ALA^? 1000.00 A 194 GLU A 16 GLU~? 1000.00 coo -29.52 -1.51 -10.80 -29.25 -1.07 -13.87 -47.08 -4.77 -5.45 -47.68 -4.88 -2.42 coo -35.30 0.90 -4.91 -36.19 -1.20 -5.57 -37.64 -6.34 -7.71 -36.86 -8.13 -9.13 coo -37.81 4.22 -2.30 -36.99 5.43 -2.37 -36.47 -6.45 -12.75 -37.89 -6.51 -12.23 coo -43.25 5.44 -9.45 -44.36 4.89 -7.68 -37.95 -16.73 -9.43 -36.24 -17.13 -8.24 ULMN 4 2cl8_p00 DECTIN-1 user 2 4 # 2 A 145 ARG B 91 ARG^? 1000.00 A 148 SER B 93 SER^? 1000.00 A 152 ALA B 96 ALA^? 1000.00 A 194 GLU B 16 GLU^? 1000.00 coo -29.52 -1.51 -10.80 -29.25 -1.07 -13.87 -47.06 -5.45 4.73 -47.67 -2.44 4.89 coo -35.30 0.90 -4.91 -36.19 -1.20 -5.57 -37.64 -7.71 6.34 -36.84 -9.11 8.12 coo -37.81 4.22 -2.30 -36.99 5.43 -2.37 -36.53 -12.78 6.48 -37.94 -12.23 6.51 coo -43.25 5.44 -9.45 -44.36 4.89 -7.68 -37.94 -9.44 16.81 -36.14 -8.36 17.15 2cl8_p00 source 2cl8 DECTIN-1 : 2 hits 2cl8_p00 naa= 4 ULMN 3 1b01_d00 GENE REGULATION/DNA user 1 3 # 1 B 4 ARG A 46 ARG^? 1000.00 B 6 THR A 48 THR^? 1000.00 B 8 THR A 50 THR^? 1000.00 coo 40.52 16.08 100.90 37.97 16.41 102.60 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 36.11 13.64 95.03 34.54 14.86 95.91 -52.48 -10.49 -8.44 -52.10 -8.36 -8.18 coo 32.72 8.05 92.39 31.25 9.11 91.35 -50.87 -6.22 -13.60 -49.45 -6.86 -15.08 ULMN 3 1b01_d00 GENE REGULATION/DNA user 2 3 # 2 B 4 ARG A 46 ARG^? 1000.00 B 6 THR B 50 THR^? 1000.00 B 8 THR B 48 THR^? 1000.00 coo 40.52 16.08 100.90 37.97 16.41 102.60 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 36.11 13.64 95.03 34.54 14.86 95.91 -50.87 -13.60 6.25 -49.43 -15.06 6.90 coo 32.72 8.05 92.39 31.25 9.11 91.35 -52.47 -8.44 10.51 -52.10 -8.16 8.38 ULMN 3 1b01_d00 GENE REGULATION/DNA user 3 3 # 3 B 4 ARG A 46 ARG^? 1000.00 B 6 THR B 51 THR^? 1000.00 B 8 THR B 48 THR^? 1000.00 coo 40.52 16.08 100.90 37.97 16.41 102.60 -54.07 -13.27 -0.86 -52.09 -13.37 1.49 coo 36.11 13.64 95.03 34.54 14.86 95.91 -54.17 -14.69 4.70 -54.04 -16.81 5.16 coo 32.72 8.05 92.39 31.25 9.11 91.35 -52.47 -8.44 10.51 -52.10 -8.16 8.38 ULMN 3 1b01_d00 GENE REGULATION/DNA user 4 3 # 4 B 4 ARG A 91 ARG^? 1000.00 B 6 THR B 88 THR^? 1000.00 B 8 THR B 50 THR^? 1000.00 coo 40.52 16.08 100.90 37.97 16.41 102.60 -47.08 -4.77 -5.45 -47.68 -4.88 -2.42 coo 36.11 13.64 95.03 34.54 14.86 95.91 -48.13 -9.38 1.15 -48.23 -7.80 -0.36 coo 32.72 8.05 92.39 31.25 9.11 91.35 -50.87 -13.60 6.25 -49.43 -15.06 6.90 ULMN 3 1b01_d00 GENE REGULATION/DNA user 5 3 # 5 B 4 ARG A 91 ARG^? 1000.00 B 6 THR B 88 THR^? 1000.00 B 8 THR B 51 THR^? 1000.00 coo 40.52 16.08 100.90 37.97 16.41 102.60 -47.08 -4.77 -5.45 -47.68 -4.88 -2.42 coo 36.11 13.64 95.03 34.54 14.86 95.91 -48.13 -9.38 1.15 -48.23 -7.80 -0.36 coo 32.72 8.05 92.39 31.25 9.11 91.35 -54.17 -14.69 4.70 -54.04 -16.81 5.16 ULMN 3 1b01_d00 GENE REGULATION/DNA user 6 3 # 6 B 4 ARG B 46 ARG^? 1000.00 B 6 THR B 48 THR^? 1000.00 B 8 THR B 50 THR^? 1000.00 coo 40.52 16.08 100.90 37.97 16.41 102.60 -54.06 -0.84 13.27 -52.10 1.52 13.37 coo 36.11 13.64 95.03 34.54 14.86 95.91 -52.47 -8.44 10.51 -52.10 -8.16 8.38 coo 32.72 8.05 92.39 31.25 9.11 91.35 -50.87 -13.60 6.25 -49.43 -15.06 6.90 1b01_d00 source 1b01 GENE REGULATION/DNA : 6 hits 1b01_d00 naa= 3 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 1 3 # 1 I 303 TYR A 19 TYR^? 1000.00 I 306 VAL A 18 VAL.? 1000.00 I 308 VAL A 28 VAL.? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -41.17 -15.27 -18.35 -38.46 -15.21 -17.66 coo 23.55 29.53 9.81 23.15 27.39 10.24 -43.43 -18.33 -15.09 -45.23 -19.03 -14.08 coo 16.43 30.18 9.35 15.05 30.67 11.01 -41.76 -13.23 -9.04 -40.69 -14.83 -7.99 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 2 3 # 2 I 303 TYR A 19 TYR^? 1000.00 I 306 VAL A 18 VAL.? 1000.00 I 308 VAL A 64 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -41.17 -15.27 -18.35 -38.46 -15.21 -17.66 coo 23.55 29.53 9.81 23.15 27.39 10.24 -43.43 -18.33 -15.09 -45.23 -19.03 -14.08 coo 16.43 30.18 9.35 15.05 30.67 11.01 -48.63 -20.44 -11.76 -48.60 -18.76 -10.34 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 3 3 # 3 I 303 TYR A 19 TYR^? 1000.00 I 306 VAL A 27 VAL.? 1000.00 I 308 VAL A 64 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -41.17 -15.27 -18.35 -38.46 -15.21 -17.66 coo 23.55 29.53 9.81 23.15 27.39 10.24 -44.26 -13.24 -11.92 -45.43 -15.07 -12.03 coo 16.43 30.18 9.35 15.05 30.67 11.01 -48.63 -20.44 -11.76 -48.60 -18.76 -10.34 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 4 3 # 4 I 303 TYR A 34 TYR^? 1000.00 I 306 VAL A 45 VAL^? 1000.00 I 308 VAL A 37 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -49.95 -10.14 -3.28 -50.35 -7.75 -4.70 coo 23.55 29.53 9.81 23.15 27.39 10.24 -50.49 -19.01 -3.49 -49.82 -18.94 -5.59 coo 16.43 30.18 9.35 15.05 30.67 11.01 -47.22 -21.59 1.39 -48.30 -21.29 3.27 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 5 3 # 5 I 303 TYR A 34 TYR^? 1000.00 I 306 VAL A 81 VAL^? 1000.00 I 308 VAL A 79 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -49.95 -10.14 -3.28 -50.35 -7.75 -4.70 coo 23.55 29.53 9.81 23.15 27.39 10.24 -56.13 -14.07 -7.47 -55.94 -14.10 -9.63 coo 16.43 30.18 9.35 15.05 30.67 11.01 -54.25 -20.17 -6.49 -53.06 -20.06 -8.32 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 6 3 # 6 I 303 TYR A 44 TYR^? 1000.00 I 306 VAL A 38 VAL^? 1000.00 I 308 VAL A 74 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 23.55 29.53 9.81 23.15 27.39 10.24 -46.09 -25.10 0.48 -44.88 -25.49 -1.27 coo 16.43 30.18 9.35 15.05 30.67 11.01 -48.29 -31.45 -3.89 -47.74 -29.33 -3.97 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 7 3 # 7 I 303 TYR A 44 TYR^? 1000.00 I 306 VAL A 77 VAL^? 1000.00 I 308 VAL A 74 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 23.55 29.53 9.81 23.15 27.39 10.24 -52.69 -26.27 -5.47 -50.94 -25.85 -6.71 coo 16.43 30.18 9.35 15.05 30.67 11.01 -48.29 -31.45 -3.89 -47.74 -29.33 -3.97 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 8 3 # 8 I 303 TYR A 44 TYR^? 1000.00 I 306 VAL A 79 VAL^? 1000.00 I 308 VAL A 64 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 23.55 29.53 9.81 23.15 27.39 10.24 -54.25 -20.17 -6.49 -53.06 -20.06 -8.32 coo 16.43 30.18 9.35 15.05 30.67 11.01 -48.63 -20.44 -11.76 -48.60 -18.76 -10.34 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 9 3 # 9 I 303 TYR A 44 TYR^? 1000.00 I 306 VAL A 79 VAL^? 1000.00 I 308 VAL A 81 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -52.55 -20.48 -0.10 -53.71 -17.94 0.19 coo 23.55 29.53 9.81 23.15 27.39 10.24 -54.25 -20.17 -6.49 -53.06 -20.06 -8.32 coo 16.43 30.18 9.35 15.05 30.67 11.01 -56.13 -14.07 -7.47 -55.94 -14.10 -9.63 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 10 3 # 10 I 303 TYR B 19 TYR^? 1000.00 I 306 VAL B 18 VAL^? 1000.00 I 308 VAL B 28 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -41.13 -18.28 15.27 -38.42 -17.55 15.36 coo 23.55 29.53 9.81 23.15 27.39 10.24 -43.43 -15.11 18.30 -45.21 -14.10 19.08 coo 16.43 30.18 9.35 15.05 30.67 11.01 -41.78 -9.03 13.24 -40.69 -8.00 14.84 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 11 3 # 11 I 303 TYR B 19 TYR^? 1000.00 I 306 VAL B 18 VAL^? 1000.00 I 308 VAL B 64 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -41.13 -18.28 15.27 -38.42 -17.55 15.36 coo 23.55 29.53 9.81 23.15 27.39 10.24 -43.43 -15.11 18.30 -45.21 -14.10 19.08 coo 16.43 30.18 9.35 15.05 30.67 11.01 -48.61 -11.76 20.43 -48.59 -10.33 18.76 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 12 3 # 12 I 303 TYR B 19 TYR^? 1000.00 I 306 VAL B 27 VAL^? 1000.00 I 308 VAL B 64 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -41.13 -18.28 15.27 -38.42 -17.55 15.36 coo 23.55 29.53 9.81 23.15 27.39 10.24 -44.28 -11.90 13.25 -45.42 -12.04 15.11 coo 16.43 30.18 9.35 15.05 30.67 11.01 -48.61 -11.76 20.43 -48.59 -10.33 18.76 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 13 3 # 13 I 303 TYR B 34 TYR^? 1000.00 I 306 VAL B 45 VAL^? 1000.00 I 308 VAL B 37 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -49.93 -3.30 10.13 -50.31 -4.70 7.73 coo 23.55 29.53 9.81 23.15 27.39 10.24 -50.49 -3.47 18.99 -49.82 -5.56 18.93 coo 16.43 30.18 9.35 15.05 30.67 11.01 -47.22 1.40 21.61 -48.29 3.29 21.35 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 14 3 # 14 I 303 TYR B 34 TYR^? 1000.00 I 306 VAL B 81 VAL^? 1000.00 I 308 VAL B 79 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -49.93 -3.30 10.13 -50.31 -4.70 7.73 coo 23.55 29.53 9.81 23.15 27.39 10.24 -56.14 -7.47 14.08 -55.94 -9.63 14.10 coo 16.43 30.18 9.35 15.05 30.67 11.01 -54.26 -6.51 20.18 -53.07 -8.35 20.07 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 15 3 # 15 I 303 TYR B 44 TYR^? 1000.00 I 306 VAL B 38 VAL^? 1000.00 I 308 VAL B 74 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 23.55 29.53 9.81 23.15 27.39 10.24 -46.10 0.45 25.11 -44.94 -1.34 25.53 coo 16.43 30.18 9.35 15.05 30.67 11.01 -48.26 -3.91 31.43 -47.71 -3.97 29.31 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 16 3 # 16 I 303 TYR B 44 TYR^? 1000.00 I 306 VAL B 77 VAL^? 1000.00 I 308 VAL B 74 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 23.55 29.53 9.81 23.15 27.39 10.24 -52.67 -5.49 26.25 -50.93 -6.74 25.85 coo 16.43 30.18 9.35 15.05 30.67 11.01 -48.26 -3.91 31.43 -47.71 -3.97 29.31 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 17 3 # 17 I 303 TYR B 44 TYR^? 1000.00 I 306 VAL B 79 VAL^? 1000.00 I 308 VAL B 64 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 23.55 29.53 9.81 23.15 27.39 10.24 -54.26 -6.51 20.18 -53.07 -8.35 20.07 coo 16.43 30.18 9.35 15.05 30.67 11.01 -48.61 -11.76 20.43 -48.59 -10.33 18.76 ULMN 3 1cqt_d00 GENE REGULATION/DNA user 18 3 # 18 I 303 TYR B 44 TYR^? 1000.00 I 306 VAL B 79 VAL^? 1000.00 I 308 VAL B 81 VAL^? 1000.00 coo 26.18 35.24 6.87 24.33 35.18 8.97 -52.56 -0.11 20.46 -53.72 0.19 17.92 coo 23.55 29.53 9.81 23.15 27.39 10.24 -54.26 -6.51 20.18 -53.07 -8.35 20.07 coo 16.43 30.18 9.35 15.05 30.67 11.01 -56.14 -7.47 14.08 -55.94 -9.63 14.10 1cqt_d00 source 1cqt GENE REGULATION/DNA : 18 hits 1cqt_d00 naa= 3 ULMN 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 1 3 # 1 A1290 LYS A 95 LYS^? 1000.00 A1294 ASN A 29 ASN.? 1000.00 A1297 GLU A 16 GLU~? 1000.00 coo 39.24 18.84-161.99 36.62 21.47-165.99 -33.35 -7.32 -10.76 -32.76 -13.46 -12.27 coo 33.53 17.37-161.81 34.31 17.81-163.76 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 coo 29.78 23.31-161.30 31.23 23.66-162.84 -37.95 -16.73 -9.43 -36.24 -17.13 -8.24 ULMN 3 1xpx_d00 TRANSCRIPTION REGULATION/DNA user 2 3 # 2 A1290 LYS B 95 LYS^? 1000.00 A1294 ASN B 29 ASN^? 1000.00 A1297 GLU B 16 GLU^? 1000.00 coo 39.24 18.84-161.99 36.62 21.47-165.99 -33.38 -10.82 7.30 -33.07 -12.53 13.40 coo 33.53 17.37-161.81 34.31 17.81-163.76 -38.46 -11.22 10.44 -36.76 -10.52 11.49 coo 29.78 23.31-161.30 31.23 23.66-162.84 -37.94 -9.44 16.81 -36.14 -8.36 17.15 1xpx_d00 source 1xpx TRANSCRIPTION REGULATION/DNA : 2 hits 1xpx_d00 naa= 3 ULMN 3 2bsq_d00 TRANSCRIPTION user 1 3 # 1 E 3 SER A 59 SER^? 1000.00 E 5 VAL A 64 VAL^? 1000.00 E 7 ARG A 65 ARG^? 1000.00 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 -53.89 -17.84 -18.14 -54.50 -17.67 -20.48 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 -48.63 -20.44 -11.76 -48.60 -18.76 -10.34 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 -52.71 -26.07 -10.64 -52.73 -27.84 -13.14 ULMN 3 2bsq_d00 TRANSCRIPTION user 2 3 # 2 E 3 SER A 69 SER^? 1000.00 E 5 VAL A 77 VAL^? 1000.00 E 7 ARG A 42 ARG^? 1000.00 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 -47.91 -28.72 -9.32 -48.58 -28.92 -11.65 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 -52.69 -26.27 -5.47 -50.94 -25.85 -6.71 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 -54.32 -29.07 0.18 -55.53 -31.83 0.78 ULMN 3 2bsq_d00 TRANSCRIPTION user 3 3 # 3 E 3 SER B 59 SER^? 1000.00 E 5 VAL B 64 VAL^? 1000.00 E 7 ARG B 65 ARG^? 1000.00 coo -3.82 -25.91 35.53 -5.28 -27.06 37.10 -53.94 -18.09 17.98 -53.28 -19.77 16.38 coo -8.42 -21.09 33.22 -10.34 -21.69 33.92 -48.61 -11.76 20.43 -48.59 -10.33 18.76 coo -12.01 -17.19 33.96 -11.18 -17.21 36.88 -52.72 -10.65 26.03 -52.74 -13.16 27.81 2bsq_d00 source 2bsq TRANSCRIPTION : 3 hits 2bsq_d00 naa= 3 ULMN 3 2hos_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 5 ARG A 91 ARG^? 1000.00 A 50 LYS A 95 LYS^? 1000.00 A 51 ASN A 29 ASN.? 1000.00 coo 28.68 23.77 42.74 27.76 26.72 42.93 -47.08 -4.77 -5.45 -47.68 -4.88 -2.42 coo 14.40 30.33 40.28 14.25 28.31 45.36 -33.35 -7.32 -10.76 -32.76 -13.46 -12.27 coo 19.09 30.55 41.51 19.09 28.89 42.82 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 ULMN 3 2hos_d00 TRANSCRIPTION/DNA user 2 3 # 2 A 5 ARG B 91 ARG^? 1000.00 A 50 LYS B 95 LYS^? 1000.00 A 51 ASN B 29 ASN^? 1000.00 coo 28.68 23.77 42.74 27.76 26.72 42.93 -47.06 -5.45 4.73 -47.67 -2.44 4.89 coo 14.40 30.33 40.28 14.25 28.31 45.36 -33.38 -10.82 7.30 -33.07 -12.53 13.40 coo 19.09 30.55 41.51 19.09 28.89 42.82 -38.46 -11.22 10.44 -36.76 -10.52 11.49 2hos_d00 source 2hos TRANSCRIPTION/DNA : 2 hits 2hos_d00 naa= 3 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 B 34 SER A 93 SER^? 1000.00 B 37 ASN A 29 ASN.? 1000.00 B 45 THR A 48 THR^? 1000.00 coo -19.49 41.97 71.08 -17.37 40.80 71.17 -37.64 -6.34 -7.71 -36.86 -8.13 -9.13 coo -23.05 39.62 69.74 -22.86 39.59 67.61 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 coo -30.87 34.84 80.57 -28.94 34.51 81.49 -52.48 -10.49 -8.44 -52.10 -8.36 -8.18 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 B 34 SER A 93 SER^? 1000.00 B 37 ASN A 29 ASN.? 1000.00 B 45 THR A 50 THR^? 1000.00 coo -19.49 41.97 71.08 -17.37 40.80 71.17 -37.64 -6.34 -7.71 -36.86 -8.13 -9.13 coo -23.05 39.62 69.74 -22.86 39.59 67.61 -38.44 -10.42 -11.21 -36.74 -11.46 -10.50 coo -30.87 34.84 80.57 -28.94 34.51 81.49 -50.87 -6.22 -13.60 -49.45 -6.86 -15.08 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 B 34 SER B 93 SER^? 1000.00 B 37 ASN B 29 ASN^? 1000.00 B 45 THR B 48 THR^? 1000.00 coo -19.49 41.97 71.08 -17.37 40.80 71.17 -37.64 -7.71 6.34 -36.84 -9.11 8.12 coo -23.05 39.62 69.74 -22.86 39.59 67.61 -38.46 -11.22 10.44 -36.76 -10.52 11.49 coo -30.87 34.84 80.57 -28.94 34.51 81.49 -52.47 -8.44 10.51 -52.10 -8.16 8.38 ULMN 3 2z3x_d00 DNA BINDING PROTEIN/DNA user 4 3 # 4 B 34 SER B 93 SER^? 1000.00 B 37 ASN B 29 ASN^? 1000.00 B 45 THR B 50 THR^? 1000.00 coo -19.49 41.97 71.08 -17.37 40.80 71.17 -37.64 -7.71 6.34 -36.84 -9.11 8.12 coo -23.05 39.62 69.74 -22.86 39.59 67.61 -38.46 -11.22 10.44 -36.76 -10.52 11.49 coo -30.87 34.84 80.57 -28.94 34.51 81.49 -50.87 -13.60 6.25 -49.43 -15.06 6.90 2z3x_d00 source 2z3x DNA BINDING PROTEIN/DNA : 4 hits 2z3x_d00 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 78 GLU^? 1000.00 A 44 ASP A 35 ASP^? 1000.00 A 50 THR B 51 THR^? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 -54.17 -14.69 4.70 -54.04 -16.81 5.16 ULMN 3 3hde_o00 LYSOZYME user 2 3 # 2 A 35 GLU A 80 GLU^? 1000.00 A 44 ASP A 35 ASP^? 1000.00 A 50 THR B 50 THR^? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -57.02 -18.07 -2.99 -58.93 -18.63 -3.73 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 -50.87 -13.60 6.25 -49.43 -15.06 6.90 ULMN 3 3hde_o00 LYSOZYME user 3 3 # 3 A 35 GLU A 80 GLU^? 1000.00 A 44 ASP A 35 ASP^? 1000.00 A 50 THR B 51 THR^? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -57.02 -18.07 -2.99 -58.93 -18.63 -3.73 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 -54.17 -14.69 4.70 -54.04 -16.81 5.16 ULMN 3 3hde_o00 LYSOZYME user 4 3 # 4 A 35 GLU B 22 GLU^? 1000.00 A 44 ASP A 35 ASP^? 1000.00 A 50 THR B 51 THR^? 1000.00 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 -50.12 -20.97 7.83 -51.66 -20.31 6.53 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 -54.17 -14.69 4.70 -54.04 -16.81 5.16 3hde_o00 source 3HDE LYSOZYME : 4 hits 3hde_o00 naa= 3 ULMN 3 3hde_o01 LYSOZYME user 1 3 # 1 B 35 GLU A 39 GLU^? 1000.00 B 44 ASP A 35 ASP^? 1000.00 B 50 THR B 50 THR^? 1000.00 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -47.18 -26.06 4.85 -48.32 -25.05 6.33 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 -50.87 -13.60 6.25 -49.43 -15.06 6.90 ULMN 3 3hde_o01 LYSOZYME user 2 3 # 2 B 35 GLU A 39 GLU^? 1000.00 B 44 ASP B 20 ASP^? 1000.00 B 50 THR B 50 THR^? 1000.00 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -47.18 -26.06 4.85 -48.32 -25.05 6.33 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -46.34 -16.80 11.39 -48.03 -17.24 10.19 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 -50.87 -13.60 6.25 -49.43 -15.06 6.90 ULMN 3 3hde_o01 LYSOZYME user 3 3 # 3 B 35 GLU A 78 GLU^? 1000.00 B 44 ASP A 35 ASP^? 1000.00 B 50 THR B 51 THR^? 1000.00 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 -54.17 -14.69 4.70 -54.04 -16.81 5.16 ULMN 3 3hde_o01 LYSOZYME user 4 3 # 4 B 35 GLU A 84 GLU^? 1000.00 B 44 ASP A 35 ASP^? 1000.00 B 50 THR B 51 THR^? 1000.00 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -58.33 -5.80 -2.09 -59.99 -6.03 -0.78 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 -54.17 -14.69 4.70 -54.04 -16.81 5.16 ULMN 3 3hde_o01 LYSOZYME user 5 3 # 5 B 35 GLU A 84 GLU^? 1000.00 B 44 ASP A 35 ASP^? 1000.00 B 50 THR B 88 THR^? 1000.00 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 -58.33 -5.80 -2.09 -59.99 -6.03 -0.78 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 -48.13 -9.38 1.15 -48.23 -7.80 -0.36 3hde_o01 source 3HDE LYSOZYME : 5 hits 3hde_o01 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU A 78 GLU^? 1000.00 C 44 ASP A 35 ASP^? 1000.00 C 50 THR B 51 THR^? 1000.00 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 -56.56 -22.11 -2.96 -57.24 -21.81 -0.97 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 25.48 4.87 1.60 23.90 4.95 0.15 -54.17 -14.69 4.70 -54.04 -16.81 5.16 ULMN 3 3hde_o02 LYSOZYME user 2 3 # 2 C 35 GLU A 84 GLU^? 1000.00 C 44 ASP A 35 ASP^? 1000.00 C 50 THR B 51 THR^? 1000.00 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 -58.33 -5.80 -2.09 -59.99 -6.03 -0.78 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 25.48 4.87 1.60 23.90 4.95 0.15 -54.17 -14.69 4.70 -54.04 -16.81 5.16 ULMN 3 3hde_o02 LYSOZYME user 3 3 # 3 C 35 GLU A 84 GLU^? 1000.00 C 44 ASP A 35 ASP^? 1000.00 C 50 THR B 88 THR^? 1000.00 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 -58.33 -5.80 -2.09 -59.99 -6.03 -0.78 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 -49.43 -15.23 0.44 -49.11 -16.26 2.29 coo 25.48 4.87 1.60 23.90 4.95 0.15 -48.13 -9.38 1.15 -48.23 -7.80 -0.36 3hde_o02 source 3HDE LYSOZYME : 3 hits 3hde_o02 naa= 3