*********** PTASSAMj00 ******** FILEIN user.vek ../../CSA/PIK_SPRITE/ ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 47 ASP^? 15.55 CL CL B 123 A 86 HIS A 48 HIS.? 12.89 CL CL B 123 A 250 ALA B 116 ALA.? 9.15 CL CL B 123 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 43.31 28.55 -18.97 43.37 26.94 -17.63 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 38.93 23.71 -15.82 39.49 24.61 -14.68 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP B 47 ASP^? 15.68 CL CL A 123 A 86 HIS B 48 HIS.? 12.72 CL CL A 123 A 250 ALA A 116 ALA.? 8.95 CL CL A 123 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 36.24 17.92 20.25 35.18 16.23 20.89 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 39.28 14.76 21.81 39.53 14.41 19.75 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 43.77 13.30 16.69 43.18 14.66 16.33 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o00 naa= 3 ULMN 4 1e6e_c00 ADRENODOXIN user 1 4 # 1 A 55 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 159 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 376 ILE B 66 ILE.? 8.09 O3 GOL B 126 A 377 THR B 70 THR~? 8.99 CL CL B 124 coo 17.95 58.52 112.81 17.29 59.41 111.03 47.38 26.60 7.09 47.11 24.76 8.07 coo 11.32 57.46 110.35 12.85 58.48 111.39 49.74 30.72 10.50 50.57 30.42 12.42 coo 15.00 65.23 121.40 15.42 63.95 122.00 36.31 24.80 8.82 35.17 25.03 7.95 coo 15.65 69.77 121.40 17.38 70.64 120.41 36.66 20.03 6.23 35.79 20.25 8.21 ULMN 4 1e6e_c00 ADRENODOXIN user 2 4 # 2 A 55 HIS A 103 HIS~? 11.95 CL CL B 124 A 159 ASP A 104 ASP~? 7.36 CL CL B 124 A 376 ILE B 52 ILE^? 11.72 C3 GOL B 126 A 377 THR B 46 THR^? 9.21 O2 GOL B 125 coo 17.95 58.52 112.81 17.29 59.41 111.03 24.53 20.38 13.18 24.12 18.57 14.18 coo 11.32 57.46 110.35 12.85 58.48 111.39 26.83 19.68 8.21 24.75 19.17 8.13 coo 15.00 65.23 121.40 15.42 63.95 122.00 35.96 21.58 16.53 35.63 20.22 16.09 coo 15.65 69.77 121.40 17.38 70.64 120.41 37.69 22.33 20.76 39.06 23.33 22.13 ULMN 4 1e6e_c00 ADRENODOXIN user 3 4 # 3 A 55 HIS B 85 HIS^? -3.53 O6 UNL A 200s A 159 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 376 ILE A 66 ILE^? 8.33 O1 UNL A 200 A 377 THR A 70 THR~? 11.53 O1 UNL A 200 coo 17.95 58.52 112.81 17.29 59.41 111.03 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 11.32 57.46 110.35 12.85 58.48 111.39 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 15.00 65.23 121.40 15.42 63.95 122.00 46.08 28.80 -2.42 47.23 28.47 -1.60 coo 15.65 69.77 121.40 17.38 70.64 120.41 45.96 23.42 -3.30 46.76 24.92 -4.64 ULMN 4 1e6e_c00 ADRENODOXIN user 4 4 # 4 A 55 HIS B 103 HIS~? 20.60 O1 UNL A 200 A 159 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 376 ILE A 52 ILE^? 11.79 O1 UNL A 200 A 377 THR A 46 THR^? 11.88 CL CL B 123 coo 17.95 58.52 112.81 17.29 59.41 111.03 57.94 28.30 -8.81 58.37 27.44 -10.67 coo 11.32 57.46 110.35 12.85 58.48 111.39 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 15.00 65.23 121.40 15.42 63.95 122.00 46.46 30.97 -10.58 46.75 29.64 -11.04 coo 15.65 69.77 121.40 17.38 70.64 120.41 44.43 34.05 -13.46 43.00 35.60 -13.85 1e6e_c00 source 1e6e ADRENODOXIN : 4 hits 1e6e_c00 naa= 4 ULMN 4 1e6e_c01 ADRENODOXIN user 1 4 # 1 C 55 HIS A 85 HIS^? 3.67 O3 GOL A 201s C 159 ASP A 84 ASP.? -3.46 O1 GOL A 201s C 376 ILE B 66 ILE.? 8.09 O3 GOL B 126 C 377 THR B 70 THR~? 8.99 CL CL B 124 coo -29.07 40.56 142.27 -27.79 41.91 141.29 47.38 26.60 7.09 47.11 24.76 8.07 coo -23.44 38.39 138.46 -25.44 39.03 138.64 49.74 30.72 10.50 50.57 30.42 12.42 coo -37.08 37.01 134.95 -37.09 36.11 136.10 36.31 24.80 8.82 35.17 25.03 7.95 coo -39.65 39.67 132.35 -40.33 41.62 133.03 36.66 20.03 6.23 35.79 20.25 8.21 ULMN 4 1e6e_c01 ADRENODOXIN user 2 4 # 2 C 55 HIS A 103 HIS~? 11.95 CL CL B 124 C 159 ASP A 104 ASP~? 7.36 CL CL B 124 C 376 ILE B 52 ILE^? 11.72 C3 GOL B 126 C 377 THR B 46 THR^? 9.21 O2 GOL B 125 coo -29.07 40.56 142.27 -27.79 41.91 141.29 24.53 20.38 13.18 24.12 18.57 14.18 coo -23.44 38.39 138.46 -25.44 39.03 138.64 26.83 19.68 8.21 24.75 19.17 8.13 coo -37.08 37.01 134.95 -37.09 36.11 136.10 35.96 21.58 16.53 35.63 20.22 16.09 coo -39.65 39.67 132.35 -40.33 41.62 133.03 37.69 22.33 20.76 39.06 23.33 22.13 ULMN 4 1e6e_c01 ADRENODOXIN user 3 4 # 3 C 55 HIS B 85 HIS^? -3.53 O6 UNL A 200s C 159 ASP B 84 ASP.? -3.52 O9 UNL A 200s C 376 ILE A 66 ILE^? 8.33 O1 UNL A 200 C 377 THR A 70 THR~? 11.53 O1 UNL A 200 coo -29.07 40.56 142.27 -27.79 41.91 141.29 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -23.44 38.39 138.46 -25.44 39.03 138.64 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -37.08 37.01 134.95 -37.09 36.11 136.10 46.08 28.80 -2.42 47.23 28.47 -1.60 coo -39.65 39.67 132.35 -40.33 41.62 133.03 45.96 23.42 -3.30 46.76 24.92 -4.64 ULMN 4 1e6e_c01 ADRENODOXIN user 4 4 # 4 C 55 HIS B 103 HIS~? 20.60 O1 UNL A 200 C 159 ASP B 104 ASP~? 19.83 C2 GOL A 201 C 376 ILE A 52 ILE^? 11.79 O1 UNL A 200 C 377 THR A 46 THR^? 11.88 CL CL B 123 coo -29.07 40.56 142.27 -27.79 41.91 141.29 57.94 28.30 -8.81 58.37 27.44 -10.67 coo -23.44 38.39 138.46 -25.44 39.03 138.64 55.81 24.74 -5.14 57.90 24.34 -5.34 coo -37.08 37.01 134.95 -37.09 36.11 136.10 46.46 30.97 -10.58 46.75 29.64 -11.04 coo -39.65 39.67 132.35 -40.33 41.62 133.03 44.43 34.05 -13.46 43.00 35.60 -13.85 1e6e_c01 source 1e6e ADRENODOXIN : 4 hits 1e6e_c01 naa= 4 ULMN 4 1eag_c06 PEPTIDE INHIBITOR user 1 4 # 1 A 32 ASP A 15 ASP~? 26.19 O1 GOL B 126 A 33 THR A 13 THR~? 22.54 O1 GOL B 126 A 218 ASP A 16 ASP~? 19.78 O1 GOL B 126 A 221 THR A 18 THR~? 24.66 O1 UNL A 200 coo 47.22 22.34 8.57 45.16 22.02 9.13 60.61 47.40 3.28 62.48 48.35 3.41 coo 47.36 17.58 7.81 48.27 16.18 9.23 55.62 50.17 4.36 56.58 48.88 5.81 coo 44.05 16.99 12.67 44.05 18.89 11.74 55.39 45.97 3.05 55.87 45.57 5.11 coo 44.42 20.57 16.06 42.37 19.87 16.06 59.01 46.38 -2.71 61.05 47.10 -2.52 ULMN 4 1eag_c06 PEPTIDE INHIBITOR user 2 4 # 2 A 32 ASP A 16 ASP~? 19.78 O1 GOL B 126 A 33 THR A 13 THR~? 22.54 O1 GOL B 126 A 218 ASP A 15 ASP~? 26.19 O1 GOL B 126 A 221 THR A 18 THR~? 24.66 O1 UNL A 200 coo 47.22 22.34 8.57 45.16 22.02 9.13 55.39 45.97 3.05 55.87 45.57 5.11 coo 47.36 17.58 7.81 48.27 16.18 9.23 55.62 50.17 4.36 56.58 48.88 5.81 coo 44.05 16.99 12.67 44.05 18.89 11.74 60.61 47.40 3.28 62.48 48.35 3.41 coo 44.42 20.57 16.06 42.37 19.87 16.06 59.01 46.38 -2.71 61.05 47.10 -2.52 ULMN 4 1eag_c06 PEPTIDE INHIBITOR user 3 4 # 3 A 32 ASP B 15 ASP~? 25.69 O9 UNL A 200 A 33 THR B 13 THR~? 22.22 O9 UNL A 200 A 218 ASP B 16 ASP~? 19.71 O9 UNL A 200 A 221 THR B 18 THR~? 24.71 O3 GOL B 126 coo 47.22 22.34 8.57 45.16 22.02 9.13 21.08 42.76 15.13 19.15 43.54 15.67 coo 47.36 17.58 7.81 48.27 16.18 9.23 26.14 45.78 16.10 25.30 45.56 14.11 coo 44.05 16.99 12.67 44.05 18.89 11.74 26.40 41.60 14.58 25.93 42.50 12.70 coo 44.42 20.57 16.06 42.37 19.87 16.06 22.78 38.34 19.37 20.77 39.03 19.72 ULMN 4 1eag_c06 PEPTIDE INHIBITOR user 4 4 # 4 A 32 ASP B 16 ASP~? 19.71 O9 UNL A 200 A 33 THR B 13 THR~? 22.22 O9 UNL A 200 A 218 ASP B 15 ASP~? 25.69 O9 UNL A 200 A 221 THR B 18 THR~? 24.71 O3 GOL B 126 coo 47.22 22.34 8.57 45.16 22.02 9.13 26.40 41.60 14.58 25.93 42.50 12.70 coo 47.36 17.58 7.81 48.27 16.18 9.23 26.14 45.78 16.10 25.30 45.56 14.11 coo 44.05 16.99 12.67 44.05 18.89 11.74 21.08 42.76 15.13 19.15 43.54 15.67 coo 44.42 20.57 16.06 42.37 19.87 16.06 22.78 38.34 19.37 20.77 39.03 19.72 1eag_c06 source 1eag PEPTIDE INHIBITOR : 4 hits 1eag_c06 naa= 4 ULMN 4 1ecl_c00 MOLECULE: ESCHERICHIA COLI TOPOISOMEuser 1 4 # 1 9 GLU A 99 GLU~? 18.98 CL CL B 124 111 ASP A 98 ASP~? 12.55 CL CL B 124 319 TYR B 83 TYR.? 10.34 O6 UNL A 200 365 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 40.90 33.12 50.07 39.32 31.72 50.03 22.47 28.68 12.84 21.91 29.15 14.84 coo 38.20 29.86 46.47 38.01 31.94 46.26 23.35 28.15 6.47 22.62 26.21 5.89 coo 35.52 29.82 41.60 37.98 29.12 42.65 27.45 31.12 3.14 25.07 31.24 4.61 coo 32.44 22.36 39.83 33.57 21.39 41.30 35.07 28.78 -0.10 35.41 27.96 -2.01 1ecl_c00 source 1ecl MOLECULE: ESCHERICHIA COLI TOPOISOMERASE I : 1 hits 1ecl_c00 naa= 4 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 1 3 # 1 A 46 ASP A 79 ASP~? 6.09 O1 GOL A 201 A 100 ARG A 122 ARG.? -4.14 CL CL A 123s A 116 GLN A 121 GLN.? 8.90 O3 GOL A 201 coo 32.24 20.09 5.34 30.38 19.04 5.27 53.25 22.44 8.57 51.13 22.57 8.85 coo 26.40 25.34 6.28 26.15 22.33 7.25 51.28 18.48 12.98 52.83 19.03 15.57 coo 26.74 21.94 13.78 27.57 20.97 12.08 44.39 18.21 9.15 43.36 18.66 7.34 ULMN 3 12as_c00 ASPARAGINE SYNTHETASE user 2 3 # 2 A 46 ASP A 104 ASP~? 7.36 CL CL B 124 A 100 ARG B 73 ARG~? -5.03 CL CL B 124s A 116 GLN A 112 GLN~? 9.93 CL CL B 124 coo 32.24 20.09 5.34 30.38 19.04 5.27 26.83 19.68 8.21 24.75 19.17 8.13 coo 26.40 25.34 6.28 26.15 22.33 7.25 32.94 15.87 2.60 33.21 12.81 2.35 coo 26.74 21.94 13.78 27.57 20.97 12.08 36.85 13.76 9.11 37.16 11.85 8.18 12as_c00 source 12as ASPARAGINE SYNTHETASE : 2 hits 12as_c00 naa= 3 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 1 3 # 1 B 46 ASP A 104 ASP~? 7.36 CL CL B 124 B 100 ARG B 73 ARG~? -5.03 CL CL B 124s B 116 GLN A 112 GLN~? 9.93 CL CL B 124 coo 32.18 48.37 12.48 33.96 49.46 12.97 26.83 19.68 8.21 24.75 19.17 8.13 coo 39.04 43.25 11.37 38.30 45.35 13.56 32.94 15.87 2.60 33.21 12.81 2.35 coo 37.43 42.63 19.41 36.76 44.08 17.97 36.85 13.76 9.11 37.16 11.85 8.18 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 2 3 # 2 B 46 ASP A 111 ASP~? 10.94 CL CL B 124 B 100 ARG B 73 ARG~? -5.03 CL CL B 124s B 116 GLN B 69 GLN~? 10.95 CL CL B 124 coo 32.18 48.37 12.48 33.96 49.46 12.97 33.22 12.10 12.41 33.55 10.10 11.76 coo 39.04 43.25 11.37 38.30 45.35 13.56 32.94 15.87 2.60 33.21 12.81 2.35 coo 37.43 42.63 19.41 36.76 44.08 17.97 39.63 16.15 5.65 39.69 14.61 7.13 ULMN 3 12as_c01 ASPARAGINE SYNTHETASE user 3 3 # 3 B 46 ASP B 104 ASP~? 19.83 C2 GOL A 201 B 100 ARG A 73 ARG~? 17.00 O3 GOL A 201 B 116 GLN B 112 GLN~? 17.09 O4 UNL A 200 coo 32.18 48.37 12.48 33.96 49.46 12.97 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 39.04 43.25 11.37 38.30 45.35 13.56 49.22 17.19 -2.93 46.61 15.60 -2.23 coo 37.43 42.63 19.41 36.76 44.08 17.97 45.90 20.40 -9.43 45.66 18.29 -9.74 12as_c01 source 12as ASPARAGINE SYNTHETASE : 3 hits 12as_c01 naa= 3 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 140 TYR A 108 TYR~? 6.12 CL CL B 124 B 190 LYS A 113 LYS~? 7.84 CL CL A 123 B 222 ASP B 47 ASP^? 15.68 CL CL A 123 coo 7.17 16.59 41.26 8.01 19.20 40.73 33.34 16.08 7.97 35.36 15.08 6.29 coo 13.38 20.00 35.06 11.43 22.49 39.53 39.46 14.20 14.59 41.86 19.61 14.55 coo 9.76 26.58 38.10 11.63 25.78 38.76 36.24 17.92 20.25 35.18 16.23 20.89 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 140 TYR A 108 TYR~? 6.12 CL CL B 124 B 190 LYS A 114 LYS.? 14.28 CL CL B 124 B 222 ASP B 47 ASP^? 15.68 CL CL A 123 coo 7.17 16.59 41.26 8.01 19.20 40.73 33.34 16.08 7.97 35.36 15.08 6.29 coo 13.38 20.00 35.06 11.43 22.49 39.53 38.24 11.42 16.94 34.01 7.82 14.29 coo 9.76 26.58 38.10 11.63 25.78 38.76 36.24 17.92 20.25 35.18 16.23 20.89 ULMN 3 1a05_c00 3-ISOPROPYLMALATE DEHYDROGENASE user 3 3 # 3 A 140 TYR B 108 TYR~? 16.24 O4 UNL A 200 B 190 LYS B 113 LYS~? 7.99 CL CL B 123 B 222 ASP A 47 ASP^? 15.55 CL CL B 123 coo 7.17 16.59 41.26 8.01 19.20 40.73 49.35 21.55 -7.05 47.36 19.71 -6.34 coo 13.38 20.00 35.06 11.43 22.49 39.53 43.28 23.93 -13.69 40.73 27.69 -10.11 coo 9.76 26.58 38.10 11.63 25.78 38.76 46.06 30.34 -15.72 47.22 29.37 -17.24 1a05_c00 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 3 hits 1a05_c00 naa= 3 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 1 3 # 1 A 190 LYS A 113 LYS~? 7.84 CL CL A 123 A 222 ASP B 47 ASP^? 15.68 CL CL A 123 B 140 TYR A 108 TYR~? 6.12 CL CL B 124 coo -4.61 20.12 30.34 -2.74 22.65 25.95 39.46 14.20 14.59 41.86 19.61 14.55 coo -1.04 26.60 27.37 -2.94 25.93 26.69 36.24 17.92 20.25 35.18 16.23 20.89 coo 1.51 16.60 24.17 0.82 19.23 24.79 33.34 16.08 7.97 35.36 15.08 6.29 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 2 3 # 2 A 190 LYS A 114 LYS.? 14.28 CL CL B 124 A 222 ASP B 47 ASP^? 15.68 CL CL A 123 B 140 TYR A 108 TYR~? 6.12 CL CL B 124 coo -4.61 20.12 30.34 -2.74 22.65 25.95 38.24 11.42 16.94 34.01 7.82 14.29 coo -1.04 26.60 27.37 -2.94 25.93 26.69 36.24 17.92 20.25 35.18 16.23 20.89 coo 1.51 16.60 24.17 0.82 19.23 24.79 33.34 16.08 7.97 35.36 15.08 6.29 ULMN 3 1a05_c01 3-ISOPROPYLMALATE DEHYDROGENASE user 3 3 # 3 A 190 LYS B 113 LYS~? 7.99 CL CL B 123 A 222 ASP A 47 ASP^? 15.55 CL CL B 123 B 140 TYR B 108 TYR~? 16.24 O4 UNL A 200 coo -4.61 20.12 30.34 -2.74 22.65 25.95 43.28 23.93 -13.69 40.73 27.69 -10.11 coo -1.04 26.60 27.37 -2.94 25.93 26.69 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 1.51 16.60 24.17 0.82 19.23 24.79 49.35 21.55 -7.05 47.36 19.71 -6.34 1a05_c01 source 1a05 3-ISOPROPYLMALATE DEHYDROGENASE : 3 hits 1a05_c01 naa= 3 ULMN 3 1a0j_c02 TRYPSIN user 1 3 # 1 C 57 HIS B 85 HIS^? -3.53 O6 UNL A 200s C 102 ASP B 84 ASP.? -3.52 O9 UNL A 200s C 195 SER B 86 SER^? -3.07 O1 UNL A 200s coo 34.37 41.18 73.21 34.04 43.09 73.87 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 34.89 38.34 78.12 35.11 39.59 76.42 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 36.16 46.87 75.66 34.01 46.43 74.59 38.80 31.67 1.48 40.20 33.63 1.48 1a0j_c02 source 1a0j TRYPSIN : 1 hits 1a0j_c02 naa= 3 ULMN 3 1a41_c01 TOPOISOMERASE I user 1 3 # 1 223 ARG B 122 ARG.? 4.15 CL CL B 123s 265 HIS B 85 HIS^? -3.53 O6 UNL A 200s 274 TYR B 108 TYR~? 16.24 O4 UNL A 200 coo -15.18 55.46 8.55 -14.82 52.98 10.38 31.77 26.02 -8.78 30.06 27.01 -11.17 coo -14.48 45.59 11.18 -14.02 47.49 10.42 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 0.94 52.26 9.16 1.95 54.78 9.91 49.35 21.55 -7.05 47.36 19.71 -6.34 1a41_c01 source 1a41 TOPOISOMERASE I : 1 hits 1a41_c01 naa= 3 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 1 3 # 1 A 49 GLU A 21 GLU~? 22.63 O1 UNL A 200 A 60 ASP A 15 ASP~? 26.19 O1 GOL B 126 A 175 TYR A 8 TYR~? 17.73 O1 UNL A 200 coo 46.10 28.27 19.27 45.48 26.99 20.84 55.82 46.81 -6.36 56.64 48.78 -6.25 coo 56.42 28.06 12.93 55.01 27.92 14.50 60.61 47.40 3.28 62.48 48.35 3.41 coo 45.02 22.04 15.38 46.16 24.00 13.76 50.16 48.46 -5.63 50.76 46.54 -7.56 ULMN 3 1a50_c03 TRYPTOPHAN SYNTHASE user 2 3 # 2 A 49 GLU B 21 GLU~? 22.82 C3 GOL B 126 A 60 ASP B 15 ASP~? 25.69 O9 UNL A 200 A 175 TYR B 8 TYR~? 16.62 O1 GOL B 125 coo 46.10 28.27 19.27 45.48 26.99 20.84 25.81 36.56 22.58 24.87 38.21 23.53 coo 56.42 28.06 12.93 55.01 27.92 14.50 21.08 42.76 15.13 19.15 43.54 15.67 coo 45.02 22.04 15.38 46.16 24.00 13.76 31.46 38.27 23.11 30.63 35.63 23.45 1a50_c03 source 1a50 TRYPTOPHAN SYNTHASE : 2 hits 1a50_c03 naa= 3 ULMN 3 1aa6_c01 FORMATE DEHYDROGENASE H user 1 3 # 1 44 LYS A 39 LYS^? 9.22 O10 UNL A 200 141 HIS A 61 HIS^? 9.47 O2 GOL B 126 333 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 69.56 26.03 31.04 72.53 30.39 31.84 38.86 41.59 -9.23 36.85 38.97 -13.00 coo 85.95 39.62 33.57 84.70 40.34 35.09 49.34 38.44 7.48 47.30 38.27 7.99 coo 87.31 36.08 32.89 89.57 36.58 34.95 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1aa6_c01 FORMATE DEHYDROGENASE H user 2 3 # 2 44 LYS B 39 LYS^? -2.66 O2 GOL B 125s 141 HIS B 61 HIS^? 10.01 O3 UNL A 200 333 ARG A 90 ARG^? -3.37 O3 UNL A 200s coo 69.56 26.03 31.04 72.53 30.39 31.84 43.23 31.03 22.06 45.10 26.50 23.58 coo 85.95 39.62 33.57 84.70 40.34 35.09 32.69 38.40 6.72 34.73 38.60 6.25 coo 87.31 36.08 32.89 89.57 36.58 34.95 34.56 36.69 3.31 35.72 36.40 0.46 1aa6_c01 source 1aa6 FORMATE DEHYDROGENASE H : 2 hits 1aa6_c01 naa= 3 ULMN 3 1aam_c01 ASPARTATE AMINOTRANSFERASE user 1 3 # 1 142 TRP A 120 TRP.? -3.57 C3 GOL A 201s 223 ASP A 84 ASP.? -3.46 O1 GOL A 201s 258 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo 127.19 33.46 26.14 126.78 36.79 28.15 47.59 24.24 15.32 44.33 26.38 14.78 coo 126.95 41.66 23.38 128.48 40.72 24.51 49.74 30.72 10.50 50.57 30.42 12.42 coo 138.83 37.95 25.17 133.50 36.37 26.52 43.23 31.03 22.06 45.10 26.50 23.58 ULMN 3 1aam_c01 ASPARTATE AMINOTRANSFERASE user 2 3 # 2 142 TRP B 120 TRP.? -4.12 O5 UNL A 200s 223 ASP B 84 ASP.? -3.52 O9 UNL A 200s 258 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 127.19 33.46 26.14 126.78 36.79 28.15 34.73 31.77 -8.13 37.90 33.34 -6.41 coo 126.95 41.66 23.38 128.48 40.72 24.51 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 138.83 37.95 25.17 133.50 36.37 26.52 38.86 41.59 -9.23 36.85 38.97 -13.00 1aam_c01 source 1aam ASPARTATE AMINOTRANSFERASE : 2 hits 1aam_c01 naa= 3 ULMN 3 1ab4_c00 GYRASE A user 1 3 # 1 32 ARG B 122 ARG.? 4.15 CL CL B 123s 78 HIS B 85 HIS^? -3.53 O6 UNL A 200s 122 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 48.32 72.26 30.89 48.69 69.28 31.53 31.77 26.02 -8.78 30.06 27.01 -11.17 coo 53.63 68.24 34.99 53.08 69.10 33.16 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 75.01 61.87 32.93 75.34 59.26 31.96 54.83 30.60 5.85 57.08 31.79 4.69 1ab4_c00 source 1ab4 GYRASE A : 1 hits 1ab4_c00 naa= 3 ULMN 3 1aj8_c00 CITRATE SYNTHASE user 1 3 # 1 A 223 HIS A 61 HIS^? 9.47 O2 GOL B 126 A 262 HIS B 94 HIS.? 18.31 O1 GOL B 126 A 312 ASP A 16 ASP~? 19.78 O1 GOL B 126 coo 29.33 36.13 69.70 30.07 34.20 70.11 49.34 38.44 7.48 47.30 38.27 7.99 coo 38.54 36.60 66.38 37.88 34.77 67.15 58.52 42.74 10.71 57.93 44.74 10.95 coo 30.62 37.23 61.07 30.08 35.73 62.49 55.39 45.97 3.05 55.87 45.57 5.11 ULMN 3 1aj8_c00 CITRATE SYNTHASE user 2 3 # 2 A 223 HIS A 94 HIS.? 16.90 O9 UNL A 200 A 262 HIS B 61 HIS^? 10.01 O3 UNL A 200 A 312 ASP B 16 ASP~? 19.71 O9 UNL A 200 coo 29.33 36.13 69.70 30.07 34.20 70.11 23.42 43.43 6.45 23.95 45.16 7.52 coo 38.54 36.60 66.38 37.88 34.77 67.15 32.69 38.40 6.72 34.73 38.60 6.25 coo 30.62 37.23 61.07 30.08 35.73 62.49 26.40 41.60 14.58 25.93 42.50 12.70 ULMN 3 1aj8_c00 CITRATE SYNTHASE user 3 3 # 3 A 223 HIS B 61 HIS^? 10.01 O3 UNL A 200 A 262 HIS A 94 HIS.? 16.90 O9 UNL A 200 A 312 ASP B 16 ASP~? 19.71 O9 UNL A 200 coo 29.33 36.13 69.70 30.07 34.20 70.11 32.69 38.40 6.72 34.73 38.60 6.25 coo 38.54 36.60 66.38 37.88 34.77 67.15 23.42 43.43 6.45 23.95 45.16 7.52 coo 30.62 37.23 61.07 30.08 35.73 62.49 26.40 41.60 14.58 25.93 42.50 12.70 ULMN 3 1aj8_c00 CITRATE SYNTHASE user 4 3 # 4 A 223 HIS B 94 HIS.? 18.31 O1 GOL B 126 A 262 HIS A 61 HIS^? 9.47 O2 GOL B 126 A 312 ASP A 16 ASP~? 19.78 O1 GOL B 126 coo 29.33 36.13 69.70 30.07 34.20 70.11 58.52 42.74 10.71 57.93 44.74 10.95 coo 38.54 36.60 66.38 37.88 34.77 67.15 49.34 38.44 7.48 47.30 38.27 7.99 coo 30.62 37.23 61.07 30.08 35.73 62.49 55.39 45.97 3.05 55.87 45.57 5.11 1aj8_c00 source 1aj8 CITRATE SYNTHASE : 4 hits 1aj8_c00 naa= 3 ULMN 3 1aj8_c01 CITRATE SYNTHASE user 1 3 # 1 B 223 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 262 HIS B 94 HIS.? 18.31 O1 GOL B 126 B 312 ASP A 16 ASP~? 19.78 O1 GOL B 126 coo 23.86 29.50 91.20 24.12 31.58 91.00 49.34 38.44 7.48 47.30 38.27 7.99 coo 29.35 31.42 99.15 28.72 33.09 98.04 58.52 42.74 10.71 57.93 44.74 10.95 coo 20.42 28.25 99.26 20.25 29.62 97.63 55.39 45.97 3.05 55.87 45.57 5.11 ULMN 3 1aj8_c01 CITRATE SYNTHASE user 2 3 # 2 B 223 HIS A 94 HIS.? 16.90 O9 UNL A 200 B 262 HIS B 61 HIS^? 10.01 O3 UNL A 200 B 312 ASP B 16 ASP~? 19.71 O9 UNL A 200 coo 23.86 29.50 91.20 24.12 31.58 91.00 23.42 43.43 6.45 23.95 45.16 7.52 coo 29.35 31.42 99.15 28.72 33.09 98.04 32.69 38.40 6.72 34.73 38.60 6.25 coo 20.42 28.25 99.26 20.25 29.62 97.63 26.40 41.60 14.58 25.93 42.50 12.70 ULMN 3 1aj8_c01 CITRATE SYNTHASE user 3 3 # 3 B 223 HIS B 61 HIS^? 10.01 O3 UNL A 200 B 262 HIS A 94 HIS.? 16.90 O9 UNL A 200 B 312 ASP B 16 ASP~? 19.71 O9 UNL A 200 coo 23.86 29.50 91.20 24.12 31.58 91.00 32.69 38.40 6.72 34.73 38.60 6.25 coo 29.35 31.42 99.15 28.72 33.09 98.04 23.42 43.43 6.45 23.95 45.16 7.52 coo 20.42 28.25 99.26 20.25 29.62 97.63 26.40 41.60 14.58 25.93 42.50 12.70 ULMN 3 1aj8_c01 CITRATE SYNTHASE user 4 3 # 4 B 223 HIS B 94 HIS.? 18.31 O1 GOL B 126 B 262 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 312 ASP A 16 ASP~? 19.78 O1 GOL B 126 coo 23.86 29.50 91.20 24.12 31.58 91.00 58.52 42.74 10.71 57.93 44.74 10.95 coo 29.35 31.42 99.15 28.72 33.09 98.04 49.34 38.44 7.48 47.30 38.27 7.99 coo 20.42 28.25 99.26 20.25 29.62 97.63 55.39 45.97 3.05 55.87 45.57 5.11 1aj8_c01 source 1aj8 CITRATE SYNTHASE : 4 hits 1aj8_c01 naa= 3 ULMN 3 1al6_c00 CITRATE SYNTHASE user 1 3 # 1 274 HIS A 61 HIS^? 9.47 O2 GOL B 126 320 HIS B 94 HIS.? 18.31 O1 GOL B 126 375 ASP A 16 ASP~? 19.78 O1 GOL B 126 coo 11.08 -2.90 2.00 11.09 -3.48 -0.01 49.34 38.44 7.48 47.30 38.27 7.99 coo 17.22 -10.90 1.81 16.10 -10.23 0.18 58.52 42.74 10.71 57.93 44.74 10.95 coo 20.14 -1.52 3.09 18.48 -1.53 1.77 55.39 45.97 3.05 55.87 45.57 5.11 ULMN 3 1al6_c00 CITRATE SYNTHASE user 2 3 # 2 274 HIS A 94 HIS.? 16.90 O9 UNL A 200 320 HIS B 61 HIS^? 10.01 O3 UNL A 200 375 ASP B 16 ASP~? 19.71 O9 UNL A 200 coo 11.08 -2.90 2.00 11.09 -3.48 -0.01 23.42 43.43 6.45 23.95 45.16 7.52 coo 17.22 -10.90 1.81 16.10 -10.23 0.18 32.69 38.40 6.72 34.73 38.60 6.25 coo 20.14 -1.52 3.09 18.48 -1.53 1.77 26.40 41.60 14.58 25.93 42.50 12.70 ULMN 3 1al6_c00 CITRATE SYNTHASE user 3 3 # 3 274 HIS B 61 HIS^? 10.01 O3 UNL A 200 320 HIS A 94 HIS.? 16.90 O9 UNL A 200 375 ASP B 16 ASP~? 19.71 O9 UNL A 200 coo 11.08 -2.90 2.00 11.09 -3.48 -0.01 32.69 38.40 6.72 34.73 38.60 6.25 coo 17.22 -10.90 1.81 16.10 -10.23 0.18 23.42 43.43 6.45 23.95 45.16 7.52 coo 20.14 -1.52 3.09 18.48 -1.53 1.77 26.40 41.60 14.58 25.93 42.50 12.70 ULMN 3 1al6_c00 CITRATE SYNTHASE user 4 3 # 4 274 HIS B 94 HIS.? 18.31 O1 GOL B 126 320 HIS A 61 HIS^? 9.47 O2 GOL B 126 375 ASP A 16 ASP~? 19.78 O1 GOL B 126 coo 11.08 -2.90 2.00 11.09 -3.48 -0.01 58.52 42.74 10.71 57.93 44.74 10.95 coo 17.22 -10.90 1.81 16.10 -10.23 0.18 49.34 38.44 7.48 47.30 38.27 7.99 coo 20.14 -1.52 3.09 18.48 -1.53 1.77 55.39 45.97 3.05 55.87 45.57 5.11 1al6_c00 source 1al6 CITRATE SYNTHASE : 4 hits 1al6_c00 naa= 3 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 79 ASP~? 6.09 O1 GOL A 201 214 ASP B 16 ASP~? 19.71 O9 UNL A 200 289 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -0.62 65.95 29.97 0.31 67.47 31.05 53.25 22.44 8.57 51.13 22.57 8.85 coo 26.86 59.76 46.36 25.42 58.23 45.92 26.40 41.60 14.58 25.93 42.50 12.70 coo 9.42 68.07 30.27 7.35 68.27 30.10 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 111 ASP~? 10.94 CL CL B 124 214 ASP B 15 ASP~? 25.69 O9 UNL A 200 289 ASP A 104 ASP~? 7.36 CL CL B 124 coo -0.62 65.95 29.97 0.31 67.47 31.05 33.22 12.10 12.41 33.55 10.10 11.76 coo 26.86 59.76 46.36 25.42 58.23 45.92 21.08 42.76 15.13 19.15 43.54 15.67 coo 9.42 68.07 30.27 7.35 68.27 30.10 26.83 19.68 8.21 24.75 19.17 8.13 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP A 115 ASP.? 16.41 CL CL A 123 214 ASP B 84 ASP.? -3.52 O9 UNL A 200s 289 ASP A 111 ASP~? 10.94 CL CL B 124 coo -0.62 65.95 29.97 0.31 67.47 31.05 42.06 8.77 16.59 40.52 7.32 16.97 coo 26.86 59.76 46.36 25.42 58.23 45.92 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 9.42 68.07 30.27 7.35 68.27 30.10 33.22 12.10 12.41 33.55 10.10 11.76 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP A 115 ASP.? 16.41 CL CL A 123 214 ASP B 84 ASP.? -3.52 O9 UNL A 200s 289 ASP B 47 ASP^? 15.68 CL CL A 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 42.06 8.77 16.59 40.52 7.32 16.97 coo 26.86 59.76 46.36 25.42 58.23 45.92 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 9.42 68.07 30.27 7.35 68.27 30.10 36.24 17.92 20.25 35.18 16.23 20.89 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 5 3 # 5 179 ASP B 79 ASP~? 3.97 O7 UNL A 200 214 ASP A 16 ASP~? 19.78 O1 GOL B 126 289 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -0.62 65.95 29.97 0.31 67.47 31.05 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 26.86 59.76 46.36 25.42 58.23 45.92 55.39 45.97 3.05 55.87 45.57 5.11 coo 9.42 68.07 30.27 7.35 68.27 30.10 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 6 3 # 6 179 ASP B 79 ASP~? 3.97 O7 UNL A 200 214 ASP B 98 ASP~? 15.88 O1 GOL A 201 289 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -0.62 65.95 29.97 0.31 67.47 31.05 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 26.86 59.76 46.36 25.42 58.23 45.92 59.21 30.58 1.37 59.85 28.74 0.55 coo 9.42 68.07 30.27 7.35 68.27 30.10 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 7 3 # 7 179 ASP B 98 ASP~? 15.88 O1 GOL A 201 214 ASP B 79 ASP~? 3.97 O7 UNL A 200 289 ASP B 104 ASP~? 19.83 C2 GOL A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 59.21 30.58 1.37 59.85 28.74 0.55 coo 26.86 59.76 46.36 25.42 58.23 45.92 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 9.42 68.07 30.27 7.35 68.27 30.10 55.81 24.74 -5.14 57.90 24.34 -5.34 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 8 3 # 8 179 ASP B 111 ASP~? 19.61 CL CL B 123 214 ASP A 15 ASP~? 26.19 O1 GOL B 126 289 ASP B 104 ASP~? 19.83 C2 GOL A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 49.48 21.08 -13.06 49.20 19.08 -13.70 coo 26.86 59.76 46.36 25.42 58.23 45.92 60.61 47.40 3.28 62.48 48.35 3.41 coo 9.42 68.07 30.27 7.35 68.27 30.10 55.81 24.74 -5.14 57.90 24.34 -5.34 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 9 3 # 9 179 ASP B 115 ASP.? 16.66 CL CL B 123 214 ASP A 84 ASP.? -3.46 O1 GOL A 201s 289 ASP A 47 ASP^? 15.55 CL CL B 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 40.90 20.11 -18.41 42.52 19.20 -19.45 coo 26.86 59.76 46.36 25.42 58.23 45.92 49.74 30.72 10.50 50.57 30.42 12.42 coo 9.42 68.07 30.27 7.35 68.27 30.10 46.06 30.34 -15.72 47.22 29.37 -17.24 ULMN 3 1amy_c01 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 10 3 # 10 179 ASP B 115 ASP.? 16.66 CL CL B 123 214 ASP A 84 ASP.? -3.46 O1 GOL A 201s 289 ASP B 111 ASP~? 19.61 CL CL B 123 coo -0.62 65.95 29.97 0.31 67.47 31.05 40.90 20.11 -18.41 42.52 19.20 -19.45 coo 26.86 59.76 46.36 25.42 58.23 45.92 49.74 30.72 10.50 50.57 30.42 12.42 coo 9.42 68.07 30.27 7.35 68.27 30.10 49.48 21.08 -13.06 49.20 19.08 -13.70 1amy_c01 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 10 hits 1amy_c01 naa= 3 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 1 3 # 1 179 ASP A 84 ASP.? -3.46 O1 GOL A 201s 227 GLU B 99 GLU~? 20.37 O1 UNL A 200 289 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 49.74 30.72 10.50 50.57 30.42 12.42 coo 3.96 55.76 41.24 4.83 57.69 41.17 59.74 34.86 -3.51 60.17 36.42 -4.90 coo 9.42 68.07 30.27 7.35 68.27 30.10 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 2 3 # 2 179 ASP A 104 ASP~? 7.36 CL CL B 124 227 GLU B 67 GLU~? 5.53 O3 GOL A 201 289 ASP A 98 ASP~? 12.55 CL CL B 124 coo -0.62 65.95 29.97 0.31 67.47 31.05 26.83 19.68 8.21 24.75 19.17 8.13 coo 3.96 55.76 41.24 4.83 57.69 41.17 40.62 21.48 11.23 42.64 22.01 11.70 coo 9.42 68.07 30.27 7.35 68.27 30.10 23.35 28.15 6.47 22.62 26.21 5.89 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 3 3 # 3 179 ASP B 84 ASP.? -3.52 O9 UNL A 200s 227 GLU A 99 GLU~? 18.98 CL CL B 124 289 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo -0.62 65.95 29.97 0.31 67.47 31.05 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 3.96 55.76 41.24 4.83 57.69 41.17 22.47 28.68 12.84 21.91 29.15 14.84 coo 9.42 68.07 30.27 7.35 68.27 30.10 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1amy_c06 ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE user 4 3 # 4 179 ASP B 104 ASP~? 19.83 C2 GOL A 201 227 GLU A 67 GLU~? 5.52 O4 UNL A 200 289 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo -0.62 65.95 29.97 0.31 67.47 31.05 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 3.96 55.76 41.24 4.83 57.69 41.17 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 9.42 68.07 30.27 7.35 68.27 30.10 59.21 30.58 1.37 59.85 28.74 0.55 1amy_c06 source 1amy ALPHA-1,4 GLYCAN-4-GLUCANOHYDROLASE (ALPHA-AMY: 4 hits 1amy_c06 naa= 3 ULMN 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 1 3 # 1 A 194 SER A 86 SER^? -2.62 O3 GOL B 126s A 292 ASP A 115 ASP.? 16.41 CL CL A 123 A 322 HIS B 61 HIS^? 10.01 O3 UNL A 200 coo 36.34 32.23 39.60 36.43 34.62 39.93 43.49 29.72 7.55 42.01 31.25 8.69 coo 19.73 19.18 41.39 21.50 18.65 40.34 42.06 8.77 16.59 40.52 7.32 16.97 coo 41.69 45.14 46.60 41.78 47.19 46.18 32.69 38.40 6.72 34.73 38.60 6.25 ULMN 3 1aql_c02 BILE-SALT ACTIVATED LIPASE user 2 3 # 2 A 194 SER B 86 SER^? -3.07 O1 UNL A 200s A 292 ASP B 115 ASP.? 16.66 CL CL B 123 A 322 HIS A 61 HIS^? 9.47 O2 GOL B 126 coo 36.34 32.23 39.60 36.43 34.62 39.93 38.80 31.67 1.48 40.20 33.63 1.48 coo 19.73 19.18 41.39 21.50 18.65 40.34 40.90 20.11 -18.41 42.52 19.20 -19.45 coo 41.69 45.14 46.60 41.78 47.19 46.18 49.34 38.44 7.48 47.30 38.27 7.99 1aql_c02 source 1aql BILE-SALT ACTIVATED LIPASE : 2 hits 1aql_c02 naa= 3 ULMN 3 1aql_c03 BILE-SALT ACTIVATED LIPASE user 1 3 # 1 B 194 SER B 86 SER^? -3.07 O1 UNL A 200s B 292 ASP B 115 ASP.? 16.66 CL CL B 123 B 322 HIS A 61 HIS^? 9.47 O2 GOL B 126 coo 35.42 71.28 22.94 36.24 69.06 22.37 38.80 31.67 1.48 40.20 33.63 1.48 coo 24.74 78.07 5.59 24.32 79.03 7.46 40.90 20.11 -18.41 42.52 19.20 -19.45 coo 48.81 64.16 26.34 49.30 62.16 26.73 49.34 38.44 7.48 47.30 38.27 7.99 1aql_c03 source 1aql BILE-SALT ACTIVATED LIPASE : 1 hits 1aql_c03 naa= 3 ULMN 3 1ay4_c02 AROMATIC AMINO ACID AMINOTRANSFERASEuser 1 3 # 1 A 140 TRP A 120 TRP.? -3.57 C3 GOL A 201s A 222 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 258 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo 89.83 15.40 0.01 90.61 18.86 1.71 47.59 24.24 15.32 44.33 26.38 14.78 coo 82.92 20.43 2.47 84.82 20.45 1.55 49.74 30.72 10.50 50.57 30.42 12.42 coo 89.09 24.00 -8.81 89.39 20.33 -4.16 43.23 31.03 22.06 45.10 26.50 23.58 ULMN 3 1ay4_c02 AROMATIC AMINO ACID AMINOTRANSFERASEuser 2 3 # 2 A 140 TRP B 120 TRP.? -4.12 O5 UNL A 200s A 222 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 258 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 89.83 15.40 0.01 90.61 18.86 1.71 34.73 31.77 -8.13 37.90 33.34 -6.41 coo 82.92 20.43 2.47 84.82 20.45 1.55 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 89.09 24.00 -8.81 89.39 20.33 -4.16 38.86 41.59 -9.23 36.85 38.97 -13.00 1ay4_c02 source 1ay4 AROMATIC AMINO ACID AMINOTRANSFERASE : 2 hits 1ay4_c02 naa= 3 ULMN 3 1ay4_c03 AROMATIC AMINO ACID AMINOTRANSFERASEuser 1 3 # 1 B 140 TRP A 120 TRP.? -3.57 C3 GOL A 201s B 222 ASP A 84 ASP.? -3.46 O1 GOL A 201s B 258 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo 103.45 44.39 16.20 102.66 41.02 14.32 47.59 24.24 15.32 44.33 26.38 14.78 coo 110.10 38.66 15.58 108.40 39.41 14.53 49.74 30.72 10.50 50.57 30.42 12.42 coo 107.51 45.54 4.76 105.41 44.51 10.25 43.23 31.03 22.06 45.10 26.50 23.58 ULMN 3 1ay4_c03 AROMATIC AMINO ACID AMINOTRANSFERASEuser 2 3 # 2 B 140 TRP B 120 TRP.? -4.12 O5 UNL A 200s B 222 ASP B 84 ASP.? -3.52 O9 UNL A 200s B 258 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 103.45 44.39 16.20 102.66 41.02 14.32 34.73 31.77 -8.13 37.90 33.34 -6.41 coo 110.10 38.66 15.58 108.40 39.41 14.53 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 107.51 45.54 4.76 105.41 44.51 10.25 38.86 41.59 -9.23 36.85 38.97 -13.00 1ay4_c03 source 1ay4 AROMATIC AMINO ACID AMINOTRANSFERASE : 2 hits 1ay4_c03 naa= 3 ULMN 3 1b6g_c00 HALOALKANE DEHALOGENASE user 1 3 # 1 124 ASP A 79 ASP~? 6.09 O1 GOL A 201 260 ASP A 84 ASP.? -3.46 O1 GOL A 201s 289 HIS A 85 HIS^? 3.67 O3 GOL A 201s coo 30.43 27.27 28.31 29.04 28.69 29.00 53.25 22.44 8.57 51.13 22.57 8.85 coo 34.79 33.03 22.11 33.47 32.83 23.76 49.74 30.72 10.50 50.57 30.42 12.42 coo 30.83 30.57 23.91 30.62 30.06 25.92 47.38 26.60 7.09 47.11 24.76 8.07 ULMN 3 1b6g_c00 HALOALKANE DEHALOGENASE user 2 3 # 2 124 ASP B 79 ASP~? 3.97 O7 UNL A 200 260 ASP B 84 ASP.? -3.52 O9 UNL A 200s 289 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 30.43 27.27 28.31 29.04 28.69 29.00 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 34.79 33.03 22.11 33.47 32.83 23.76 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 30.83 30.57 23.91 30.62 30.06 25.92 35.07 28.78 -0.10 35.41 27.96 -2.01 1b6g_c00 source 1b6g HALOALKANE DEHALOGENASE : 2 hits 1b6g_c00 naa= 3 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 1 3 # 1 A 88 PHE A 31 PHE~? 18.57 O1 UNL A 200 A 159 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 188 LYS B 113 LYS~? 7.99 CL CL B 123 coo 13.91 34.58 14.67 12.95 36.00 12.47 54.25 30.54 -13.29 55.26 28.76 -11.37 coo 20.97 28.40 16.26 20.19 30.15 15.34 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 22.55 41.65 15.60 18.92 37.20 14.63 43.28 23.93 -13.69 40.73 27.69 -10.11 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 2 3 # 2 A 88 PHE A 45 PHE^? 13.75 O1 UNL A 200 A 159 ASP A 47 ASP^? 15.55 CL CL B 123 A 188 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 13.91 34.58 14.67 12.95 36.00 12.47 49.20 35.83 -10.55 51.58 37.30 -10.35 coo 20.97 28.40 16.26 20.19 30.15 15.34 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 22.55 41.65 15.60 18.92 37.20 14.63 38.86 41.59 -9.23 36.85 38.97 -13.00 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 3 3 # 3 A 88 PHE A 51 PHE^? 5.85 O1 UNL A 200 A 159 ASP A 47 ASP^? 15.55 CL CL B 123 A 188 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 13.91 34.58 14.67 12.95 36.00 12.47 41.46 32.01 -8.11 42.68 32.74 -5.72 coo 20.97 28.40 16.26 20.19 30.15 15.34 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 22.55 41.65 15.60 18.92 37.20 14.63 38.86 41.59 -9.23 36.85 38.97 -13.00 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 4 3 # 4 A 88 PHE B 31 PHE~? 13.92 CL CL B 124 A 159 ASP A 104 ASP~? 7.36 CL CL B 124 A 188 LYS A 113 LYS~? 7.84 CL CL A 123 coo 13.91 34.58 14.67 12.95 36.00 12.47 28.10 19.46 18.19 27.25 19.09 15.56 coo 20.97 28.40 16.26 20.19 30.15 15.34 26.83 19.68 8.21 24.75 19.17 8.13 coo 22.55 41.65 15.60 18.92 37.20 14.63 39.46 14.20 14.59 41.86 19.61 14.55 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 5 3 # 5 A 88 PHE B 45 PHE^? 13.55 C3 GOL B 126 A 159 ASP B 47 ASP^? 15.68 CL CL A 123 A 188 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo 13.91 34.58 14.67 12.95 36.00 12.47 32.99 25.50 19.27 30.62 26.78 19.90 coo 20.97 28.40 16.26 20.19 30.15 15.34 36.24 17.92 20.25 35.18 16.23 20.89 coo 22.55 41.65 15.60 18.92 37.20 14.63 43.23 31.03 22.06 45.10 26.50 23.58 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 6 3 # 6 A 88 PHE B 51 PHE^? 5.59 C3 GOL B 126 A 159 ASP B 47 ASP^? 15.68 CL CL A 123 A 188 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo 13.91 34.58 14.67 12.95 36.00 12.47 40.88 24.13 15.35 39.58 26.06 13.87 coo 20.97 28.40 16.26 20.19 30.15 15.34 36.24 17.92 20.25 35.18 16.23 20.89 coo 22.55 41.65 15.60 18.92 37.20 14.63 43.23 31.03 22.06 45.10 26.50 23.58 ULMN 3 1b9h_c02 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHAuser 7 3 # 7 A 88 PHE B 119 PHE.? -6.42 CL CL B 123s A 159 ASP A 47 ASP^? 15.55 CL CL B 123 A 188 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 13.91 34.58 14.67 12.95 36.00 12.47 37.18 32.81 -11.88 39.08 34.64 -11.03 coo 20.97 28.40 16.26 20.19 30.15 15.34 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 22.55 41.65 15.60 18.92 37.20 14.63 38.86 41.59 -9.23 36.85 38.97 -13.00 1b9h_c02 source 1b9h 3-AMINO-5-HYDROXYBENZOIC ACID SYNTHASE : 7 hits 1b9h_c02 naa= 3 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 A 137 ARG A 73 ARG~? 17.00 O3 GOL A 201 A 141 THR B 109 THR~? 11.58 O1 UNL A 200 A 235 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 6.21 93.81 36.58 4.58 96.33 37.17 49.22 17.19 -2.93 46.61 15.60 -2.23 coo 6.80 92.87 28.33 4.91 92.74 27.40 47.32 25.04 -9.31 46.41 26.51 -8.00 coo 12.98 90.36 47.57 11.26 89.62 46.62 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 A 137 ARG A 122 ARG.? -4.14 CL CL A 123s A 141 THR A 117 THR.? 9.36 CL CL A 123 A 235 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 6.21 93.81 36.58 4.58 96.33 37.17 51.28 18.48 12.98 52.83 19.03 15.57 coo 6.80 92.87 28.33 4.91 92.74 27.40 47.06 13.65 18.60 48.13 11.99 17.78 coo 12.98 90.36 47.57 11.26 89.62 46.62 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 A 137 ARG B 19 ARG~? 17.69 O8 UNL A 200 A 141 THR B 18 THR~? 24.71 O3 GOL B 126 A 235 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 6.21 93.81 36.58 4.58 96.33 37.17 24.49 36.14 12.47 22.88 36.56 9.90 coo 6.80 92.87 28.33 4.91 92.74 27.40 22.78 38.34 19.37 20.77 39.03 19.72 coo 12.98 90.36 47.57 11.26 89.62 46.62 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 A 137 ARG B 73 ARG~? -5.03 CL CL B 124s A 141 THR A 109 THR~? 11.26 CL CL B 124 A 235 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 6.21 93.81 36.58 4.58 96.33 37.17 32.94 15.87 2.60 33.21 12.81 2.35 coo 6.80 92.87 28.33 4.91 92.74 27.40 35.30 17.54 11.93 36.10 19.55 11.83 coo 12.98 90.36 47.57 11.26 89.62 46.62 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1bd3_c00 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 A 137 ARG B 122 ARG.? 4.15 CL CL B 123s A 141 THR B 117 THR.? 9.48 CL CL B 123 A 235 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 6.21 93.81 36.58 4.58 96.33 37.17 31.77 26.02 -8.78 30.06 27.01 -11.17 coo 6.80 92.87 28.33 4.91 92.74 27.40 35.62 25.18 -17.07 34.59 23.37 -17.57 coo 12.98 90.36 47.57 11.26 89.62 46.62 32.50 34.12 -0.35 31.64 35.02 -2.06 1bd3_c00 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 5 hits 1bd3_c00 naa= 3 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 D 137 ARG A 73 ARG~? 17.00 O3 GOL A 201 D 141 THR B 109 THR~? 11.58 O1 UNL A 200 D 235 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo -8.33 92.80 100.06 -7.71 95.33 98.44 49.22 17.19 -2.93 46.61 15.60 -2.23 coo -9.24 93.49 108.77 -7.37 94.21 109.61 47.32 25.04 -9.31 46.41 26.51 -8.00 coo -14.64 87.74 89.51 -12.89 87.43 90.65 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 D 137 ARG A 122 ARG.? -4.14 CL CL A 123s D 141 THR A 117 THR.? 9.36 CL CL A 123 D 235 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -8.33 92.80 100.06 -7.71 95.33 98.44 51.28 18.48 12.98 52.83 19.03 15.57 coo -9.24 93.49 108.77 -7.37 94.21 109.61 47.06 13.65 18.60 48.13 11.99 17.78 coo -14.64 87.74 89.51 -12.89 87.43 90.65 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 D 137 ARG B 19 ARG~? 17.69 O8 UNL A 200 D 141 THR B 13 THR~? 22.22 O9 UNL A 200 D 235 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -8.33 92.80 100.06 -7.71 95.33 98.44 24.49 36.14 12.47 22.88 36.56 9.90 coo -9.24 93.49 108.77 -7.37 94.21 109.61 26.14 45.78 16.10 25.30 45.56 14.11 coo -14.64 87.74 89.51 -12.89 87.43 90.65 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 D 137 ARG B 19 ARG~? 17.69 O8 UNL A 200 D 141 THR B 18 THR~? 24.71 O3 GOL B 126 D 235 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -8.33 92.80 100.06 -7.71 95.33 98.44 24.49 36.14 12.47 22.88 36.56 9.90 coo -9.24 93.49 108.77 -7.37 94.21 109.61 22.78 38.34 19.37 20.77 39.03 19.72 coo -14.64 87.74 89.51 -12.89 87.43 90.65 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 D 137 ARG B 73 ARG~? -5.03 CL CL B 124s D 141 THR A 109 THR~? 11.26 CL CL B 124 D 235 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo -8.33 92.80 100.06 -7.71 95.33 98.44 32.94 15.87 2.60 33.21 12.81 2.35 coo -9.24 93.49 108.77 -7.37 94.21 109.61 35.30 17.54 11.93 36.10 19.55 11.83 coo -14.64 87.74 89.51 -12.89 87.43 90.65 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1bd3_c01 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 D 137 ARG B 122 ARG.? 4.15 CL CL B 123s D 141 THR B 117 THR.? 9.48 CL CL B 123 D 235 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -8.33 92.80 100.06 -7.71 95.33 98.44 31.77 26.02 -8.78 30.06 27.01 -11.17 coo -9.24 93.49 108.77 -7.37 94.21 109.61 35.62 25.18 -17.07 34.59 23.37 -17.57 coo -14.64 87.74 89.51 -12.89 87.43 90.65 32.50 34.12 -0.35 31.64 35.02 -2.06 1bd3_c01 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 6 hits 1bd3_c01 naa= 3 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 C 137 ARG A 19 ARG~? 17.61 O2 GOL A 201 C 141 THR A 13 THR~? 22.54 O1 GOL B 126 C 235 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -5.79 67.26 36.83 -4.57 64.58 37.74 57.40 40.38 1.34 58.96 39.38 3.77 coo -6.81 68.31 28.28 -4.82 68.47 27.57 55.62 50.17 4.36 56.58 48.88 5.81 coo -13.01 70.96 47.58 -11.44 71.65 46.34 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 C 137 ARG A 73 ARG~? 17.00 O3 GOL A 201 C 141 THR B 109 THR~? 11.58 O1 UNL A 200 C 235 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo -5.79 67.26 36.83 -4.57 64.58 37.74 49.22 17.19 -2.93 46.61 15.60 -2.23 coo -6.81 68.31 28.28 -4.82 68.47 27.57 47.32 25.04 -9.31 46.41 26.51 -8.00 coo -13.01 70.96 47.58 -11.44 71.65 46.34 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 C 137 ARG A 122 ARG.? -4.14 CL CL A 123s C 141 THR A 117 THR.? 9.36 CL CL A 123 C 235 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -5.79 67.26 36.83 -4.57 64.58 37.74 51.28 18.48 12.98 52.83 19.03 15.57 coo -6.81 68.31 28.28 -4.82 68.47 27.57 47.06 13.65 18.60 48.13 11.99 17.78 coo -13.01 70.96 47.58 -11.44 71.65 46.34 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 C 137 ARG B 19 ARG~? 17.69 O8 UNL A 200 C 141 THR B 13 THR~? 22.22 O9 UNL A 200 C 235 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -5.79 67.26 36.83 -4.57 64.58 37.74 24.49 36.14 12.47 22.88 36.56 9.90 coo -6.81 68.31 28.28 -4.82 68.47 27.57 26.14 45.78 16.10 25.30 45.56 14.11 coo -13.01 70.96 47.58 -11.44 71.65 46.34 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 5 3 # 5 C 137 ARG B 19 ARG~? 17.69 O8 UNL A 200 C 141 THR B 18 THR~? 24.71 O3 GOL B 126 C 235 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -5.79 67.26 36.83 -4.57 64.58 37.74 24.49 36.14 12.47 22.88 36.56 9.90 coo -6.81 68.31 28.28 -4.82 68.47 27.57 22.78 38.34 19.37 20.77 39.03 19.72 coo -13.01 70.96 47.58 -11.44 71.65 46.34 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 6 3 # 6 C 137 ARG B 73 ARG~? -5.03 CL CL B 124s C 141 THR A 109 THR~? 11.26 CL CL B 124 C 235 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo -5.79 67.26 36.83 -4.57 64.58 37.74 32.94 15.87 2.60 33.21 12.81 2.35 coo -6.81 68.31 28.28 -4.82 68.47 27.57 35.30 17.54 11.93 36.10 19.55 11.83 coo -13.01 70.96 47.58 -11.44 71.65 46.34 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1bd3_c02 URACIL PHOSPHORIBOSYLTRANSFERASE user 7 3 # 7 C 137 ARG B 122 ARG.? 4.15 CL CL B 123s C 141 THR B 117 THR.? 9.48 CL CL B 123 C 235 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -5.79 67.26 36.83 -4.57 64.58 37.74 31.77 26.02 -8.78 30.06 27.01 -11.17 coo -6.81 68.31 28.28 -4.82 68.47 27.57 35.62 25.18 -17.07 34.59 23.37 -17.57 coo -13.01 70.96 47.58 -11.44 71.65 46.34 32.50 34.12 -0.35 31.64 35.02 -2.06 1bd3_c02 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 7 hits 1bd3_c02 naa= 3 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 1 3 # 1 B 137 ARG A 19 ARG~? 17.61 O2 GOL A 201 B 141 THR A 13 THR~? 22.54 O1 GOL B 126 B 235 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 8.13 67.41 100.27 7.18 68.35 97.45 57.40 40.38 1.34 58.96 39.38 3.77 coo 8.28 67.78 108.81 6.22 67.65 109.43 55.62 50.17 4.36 56.58 48.88 5.81 coo 14.55 73.52 89.47 12.81 73.95 90.56 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 2 3 # 2 B 137 ARG A 19 ARG~? 17.61 O2 GOL A 201 B 141 THR A 18 THR~? 24.66 O1 UNL A 200 B 235 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 8.13 67.41 100.27 7.18 68.35 97.45 57.40 40.38 1.34 58.96 39.38 3.77 coo 8.28 67.78 108.81 6.22 67.65 109.43 59.01 46.38 -2.71 61.05 47.10 -2.52 coo 14.55 73.52 89.47 12.81 73.95 90.56 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 3 3 # 3 B 137 ARG B 19 ARG~? 17.69 O8 UNL A 200 B 141 THR B 13 THR~? 22.22 O9 UNL A 200 B 235 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 8.13 67.41 100.27 7.18 68.35 97.45 24.49 36.14 12.47 22.88 36.56 9.90 coo 8.28 67.78 108.81 6.22 67.65 109.43 26.14 45.78 16.10 25.30 45.56 14.11 coo 14.55 73.52 89.47 12.81 73.95 90.56 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1bd3_c03 URACIL PHOSPHORIBOSYLTRANSFERASE user 4 3 # 4 B 137 ARG B 19 ARG~? 17.69 O8 UNL A 200 B 141 THR B 18 THR~? 24.71 O3 GOL B 126 B 235 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 8.13 67.41 100.27 7.18 68.35 97.45 24.49 36.14 12.47 22.88 36.56 9.90 coo 8.28 67.78 108.81 6.22 67.65 109.43 22.78 38.34 19.37 20.77 39.03 19.72 coo 14.55 73.52 89.47 12.81 73.95 90.56 32.50 34.12 -0.35 31.64 35.02 -2.06 1bd3_c03 source 1bd3 URACIL PHOSPHORIBOSYLTRANSFERASE : 4 hits 1bd3_c03 naa= 3 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 1 3 # 1 14 ASP A 104 ASP~? 7.36 CL CL B 124 16 HIS A 103 HIS~? 11.95 CL CL B 124 67 GLY B 49 GLY.? 10.28 CL CL A 123 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 26.83 19.68 8.21 24.75 19.17 8.13 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 24.53 20.38 13.18 24.12 18.57 14.18 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 41.90 19.29 23.14 41.52 18.99 22.53 ULMN 3 1be1_c02 GLUTAMATE MUTASE user 2 3 # 2 14 ASP B 104 ASP~? 19.83 C2 GOL A 201 16 HIS B 103 HIS~? 20.60 O1 UNL A 200 67 GLY A 49 GLY.? 9.77 CL CL B 123 coo -11.04 -6.46 -7.27 -10.57 -4.40 -7.48 55.81 24.74 -5.14 57.90 24.34 -5.34 coo -6.73 -11.42 -7.86 -5.41 -11.61 -6.26 57.94 28.30 -8.81 58.37 27.44 -10.67 coo 10.06 -0.59 -9.79 9.66 -0.34 -9.05 39.92 32.51 -17.24 40.42 31.99 -16.89 1be1_c02 source 1be1 GLUTAMATE MUTASE : 2 hits 1be1_c02 naa= 3 ULMN 3 1bjo_c00 PHOSPHOSERINE AMINOTRANSFERASE user 1 3 # 1 A 102 TRP A 120 TRP.? -3.57 C3 GOL A 201s A 174 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 198 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo 21.59 67.76 35.19 19.10 64.95 36.34 47.59 24.24 15.32 44.33 26.38 14.78 coo 19.39 73.14 39.98 19.70 71.07 40.14 49.74 30.72 10.50 50.57 30.42 12.42 coo 27.94 65.10 43.55 24.20 64.94 40.01 43.23 31.03 22.06 45.10 26.50 23.58 ULMN 3 1bjo_c00 PHOSPHOSERINE AMINOTRANSFERASE user 2 3 # 2 A 102 TRP B 120 TRP.? -4.12 O5 UNL A 200s A 174 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 198 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 21.59 67.76 35.19 19.10 64.95 36.34 34.73 31.77 -8.13 37.90 33.34 -6.41 coo 19.39 73.14 39.98 19.70 71.07 40.14 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 27.94 65.10 43.55 24.20 64.94 40.01 38.86 41.59 -9.23 36.85 38.97 -13.00 1bjo_c00 source 1bjo PHOSPHOSERINE AMINOTRANSFERASE : 2 hits 1bjo_c00 naa= 3 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 # 1 A 82 HIS A 48 HIS.? 12.89 CL CL B 123 A 168 ARG B 122 ARG.? 4.15 CL CL B 123s A 187 LYS B 113 LYS~? 7.99 CL CL B 123 coo 62.47 12.00 59.65 61.76 10.14 60.31 43.31 28.55 -18.97 43.37 26.94 -17.63 coo 55.10 8.37 73.00 55.48 9.59 70.20 31.77 26.02 -8.78 30.06 27.01 -11.17 coo 66.76 10.09 66.23 61.80 8.06 65.82 43.28 23.93 -13.69 40.73 27.69 -10.11 ULMN 3 1brw_c00 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 2 3 # 2 A 82 HIS B 48 HIS.? 12.72 CL CL A 123 A 168 ARG A 122 ARG.? -4.14 CL CL A 123s A 187 LYS A 113 LYS~? 7.84 CL CL A 123 coo 62.47 12.00 59.65 61.76 10.14 60.31 39.28 14.76 21.81 39.53 14.41 19.75 coo 55.10 8.37 73.00 55.48 9.59 70.20 51.28 18.48 12.98 52.83 19.03 15.57 coo 66.76 10.09 66.23 61.80 8.06 65.82 39.46 14.20 14.59 41.86 19.61 14.55 1brw_c00 source 1brw PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE : 2 hits 1brw_c00 naa= 3 ULMN 3 1brw_c01 PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE user 1 3 # 1 B1082 HIS B 48 HIS.? 12.72 CL CL A 123 B1168 ARG A 122 ARG.? -4.14 CL CL A 123s B1187 LYS A 113 LYS~? 7.84 CL CL A 123 coo 35.03 5.72 103.61 36.82 5.00 102.79 39.28 14.76 21.81 39.53 14.41 19.75 coo 41.91 5.48 91.85 40.59 6.81 94.28 51.28 18.48 12.98 52.83 19.03 15.57 coo 32.93 -0.12 99.60 37.71 2.39 99.23 39.46 14.20 14.59 41.86 19.61 14.55 1brw_c01 source 1brw PYRIMIDINE NUCLEOSIDE PHOSPHORYLASE : 1 hits 1brw_c01 naa= 3 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 1 3 # 1 A 50 GLN A 100 GLN~? 11.54 CL CL B 124 A 91 LEU A 101 LEU~? 9.84 CL CL B 124 A 133 GLU A 99 GLU~? 18.98 CL CL B 124 coo 43.58 43.67 66.73 42.32 42.78 68.15 21.51 21.50 8.41 21.20 20.36 10.22 coo 38.58 45.09 70.44 38.28 45.21 72.59 25.92 25.11 6.50 27.55 25.17 5.00 coo 44.05 36.87 70.65 43.15 38.64 69.97 22.47 28.68 12.84 21.91 29.15 14.84 ULMN 3 1bs4_c00 PEPTIDE DEFORMYLASE user 2 3 # 2 A 50 GLN B 100 GLN~? 22.34 O1 GOL A 201 A 91 LEU B 101 LEU~? 13.87 C2 GOL A 201 A 133 GLU B 99 GLU~? 20.37 O1 UNL A 200 coo 43.58 43.67 66.73 42.32 42.78 68.15 61.02 26.44 -4.25 61.35 26.63 -6.38 coo 38.58 45.09 70.44 38.28 45.21 72.59 56.45 28.08 -0.50 54.90 27.09 0.75 coo 44.05 36.87 70.65 43.15 38.64 69.97 59.74 34.86 -3.51 60.17 36.42 -4.90 1bs4_c00 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c00 naa= 3 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 1 3 # 1 B 550 GLN A 100 GLN~? 11.54 CL CL B 124 B 591 LEU A 101 LEU~? 9.84 CL CL B 124 B 633 GLU A 99 GLU~? 18.98 CL CL B 124 coo 88.06 44.34 57.19 89.06 45.53 55.74 21.51 21.50 8.41 21.20 20.36 10.22 coo 86.70 48.66 52.61 87.15 48.69 50.51 25.92 25.11 6.50 27.55 25.17 5.00 coo 95.42 44.52 54.43 93.46 45.31 54.70 22.47 28.68 12.84 21.91 29.15 14.84 ULMN 3 1bs4_c01 PEPTIDE DEFORMYLASE user 2 3 # 2 B 550 GLN B 100 GLN~? 22.34 O1 GOL A 201 B 591 LEU B 101 LEU~? 13.87 C2 GOL A 201 B 633 GLU B 99 GLU~? 20.37 O1 UNL A 200 coo 88.06 44.34 57.19 89.06 45.53 55.74 61.02 26.44 -4.25 61.35 26.63 -6.38 coo 86.70 48.66 52.61 87.15 48.69 50.51 56.45 28.08 -0.50 54.90 27.09 0.75 coo 95.42 44.52 54.43 93.46 45.31 54.70 59.74 34.86 -3.51 60.17 36.42 -4.90 1bs4_c01 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c01 naa= 3 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 1 3 # 1 C1050 GLN A 100 GLN~? 11.54 CL CL B 124 C1091 LEU A 101 LEU~? 9.84 CL CL B 124 C1133 GLU A 99 GLU~? 18.98 CL CL B 124 coo 68.29 34.44 43.03 66.67 34.74 44.37 21.51 21.50 8.41 21.20 20.36 10.22 coo 65.83 38.95 47.05 65.46 38.90 49.20 25.92 25.11 6.50 27.55 25.17 5.00 coo 63.14 29.39 46.25 63.84 31.31 45.74 22.47 28.68 12.84 21.91 29.15 14.84 ULMN 3 1bs4_c02 PEPTIDE DEFORMYLASE user 2 3 # 2 C1050 GLN B 100 GLN~? 22.34 O1 GOL A 201 C1091 LEU B 101 LEU~? 13.87 C2 GOL A 201 C1133 GLU B 99 GLU~? 20.37 O1 UNL A 200 coo 68.29 34.44 43.03 66.67 34.74 44.37 61.02 26.44 -4.25 61.35 26.63 -6.38 coo 65.83 38.95 47.05 65.46 38.90 49.20 56.45 28.08 -0.50 54.90 27.09 0.75 coo 63.14 29.39 46.25 63.84 31.31 45.74 59.74 34.86 -3.51 60.17 36.42 -4.90 1bs4_c02 source 1bs4 PEPTIDE DEFORMYLASE : 2 hits 1bs4_c02 naa= 3 ULMN 3 1bwp_c01 PLATELET-ACTIVATING FACTOR ACETYLHYDuser 1 3 # 1 104 ASN A 26 ASN~? 22.72 O1 UNL A 200 192 ASP B 104 ASP~? 19.83 C2 GOL A 201 195 HIS B 103 HIS~? 20.60 O1 UNL A 200 coo 48.26 -8.64 25.32 50.17 -7.72 25.52 59.79 36.87 -9.12 61.45 38.07 -8.53 coo 56.18 0.19 32.76 56.16 -1.23 31.19 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 56.71 -3.36 28.21 54.80 -3.08 27.37 57.94 28.30 -8.81 58.37 27.44 -10.67 ULMN 3 1bwp_c01 PLATELET-ACTIVATING FACTOR ACETYLHYDuser 2 3 # 2 104 ASN B 26 ASN~? 21.41 CL CL B 124 192 ASP A 104 ASP~? 7.36 CL CL B 124 195 HIS A 103 HIS~? 11.95 CL CL B 124 coo 48.26 -8.64 25.32 50.17 -7.72 25.52 22.33 26.94 18.41 20.59 28.17 18.67 coo 56.18 0.19 32.76 56.16 -1.23 31.19 26.83 19.68 8.21 24.75 19.17 8.13 coo 56.71 -3.36 28.21 54.80 -3.08 27.37 24.53 20.38 13.18 24.12 18.57 14.18 1bwp_c01 source 1bwp PLATELET-ACTIVATING FACTOR ACETYLHYDROLASE : 2 hits 1bwp_c01 naa= 3 ULMN 3 1c54_c00 RIBONUCLEASE SA user 1 3 # 1 A 54 GLU A 67 GLU~? 5.52 O4 UNL A 200 A 65 ARG B 122 ARG.? 4.15 CL CL B 123s A 85 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo -3.75 5.08 -16.45 -4.49 7.03 -16.67 41.87 27.48 -6.41 39.78 28.14 -6.44 coo -11.31 0.89 -21.51 -13.74 2.37 -20.15 31.77 26.02 -8.78 30.06 27.01 -11.17 coo -11.98 -0.40 -12.41 -12.65 1.37 -13.15 35.07 28.78 -0.10 35.41 27.96 -2.01 ULMN 3 1c54_c00 RIBONUCLEASE SA user 2 3 # 2 A 54 GLU B 67 GLU~? 5.53 O3 GOL A 201 A 65 ARG A 122 ARG.? -4.14 CL CL A 123s A 85 HIS A 85 HIS^? 3.67 O3 GOL A 201s coo -3.75 5.08 -16.45 -4.49 7.03 -16.67 40.62 21.48 11.23 42.64 22.01 11.70 coo -11.31 0.89 -21.51 -13.74 2.37 -20.15 51.28 18.48 12.98 52.83 19.03 15.57 coo -11.98 -0.40 -12.41 -12.65 1.37 -13.15 47.38 26.60 7.09 47.11 24.76 8.07 1c54_c00 source 1c54 RIBONUCLEASE SA : 2 hits 1c54_c00 naa= 3 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 1 3 # 1 A 14 ASP A 79 ASP~? 6.09 O1 GOL A 201 A 16 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 67 GLY A 82 GLY~? 7.92 O1 GOL A 201 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 53.25 22.44 8.57 51.13 22.57 8.85 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 47.38 26.60 7.09 47.11 24.76 8.07 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 56.82 27.71 9.09 56.39 27.85 8.44 ULMN 3 1cb7_c06 GLUTAMATE MUTASE user 2 3 # 2 A 14 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 16 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 67 GLY A 82 GLY~? 7.92 O1 GOL A 201 coo 11.02 -13.08 77.25 10.70 -11.13 76.52 49.74 30.72 10.50 50.57 30.42 12.42 coo 7.44 -8.54 76.22 7.57 -7.67 78.12 47.38 26.60 7.09 47.11 24.76 8.07 coo 18.64 -11.26 77.99 18.99 -11.13 78.72 56.82 27.71 9.09 56.39 27.85 8.44 1cb7_c06 source 1cb7 GLUTAMATE MUTASE : 2 hits 1cb7_c06 naa= 3 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 1 3 # 1 C 14 ASP A 79 ASP~? 6.09 O1 GOL A 201 C 16 HIS A 85 HIS^? 3.67 O3 GOL A 201s C 67 GLY A 82 GLY~? 7.92 O1 GOL A 201 coo 10.04 44.27 88.44 9.47 42.32 89.03 53.25 22.44 8.57 51.13 22.57 8.85 coo 6.38 39.80 88.71 6.88 38.89 86.87 47.38 26.60 7.09 47.11 24.76 8.07 coo 17.63 42.50 89.25 18.11 42.29 88.64 56.82 27.71 9.09 56.39 27.85 8.44 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 2 3 # 2 C 14 ASP A 84 ASP.? -3.46 O1 GOL A 201s C 16 HIS A 85 HIS^? 3.67 O3 GOL A 201s C 67 GLY A 82 GLY~? 7.92 O1 GOL A 201 coo 10.04 44.27 88.44 9.47 42.32 89.03 49.74 30.72 10.50 50.57 30.42 12.42 coo 6.38 39.80 88.71 6.88 38.89 86.87 47.38 26.60 7.09 47.11 24.76 8.07 coo 17.63 42.50 89.25 18.11 42.29 88.64 56.82 27.71 9.09 56.39 27.85 8.44 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 3 3 # 3 C 14 ASP B 79 ASP~? 3.97 O7 UNL A 200 C 16 HIS B 85 HIS^? -3.53 O6 UNL A 200s C 67 GLY B 82 GLY~? 8.35 O7 UNL A 200 coo 10.04 44.27 88.44 9.47 42.32 89.03 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 6.38 39.80 88.71 6.88 38.89 86.87 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 17.63 42.50 89.25 18.11 42.29 88.64 25.71 30.64 -1.30 26.07 30.37 -0.67 ULMN 3 1cb7_c07 GLUTAMATE MUTASE user 4 3 # 4 C 14 ASP B 84 ASP.? -3.52 O9 UNL A 200s C 16 HIS B 85 HIS^? -3.53 O6 UNL A 200s C 67 GLY B 82 GLY~? 8.35 O7 UNL A 200 coo 10.04 44.27 88.44 9.47 42.32 89.03 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 6.38 39.80 88.71 6.88 38.89 86.87 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 17.63 42.50 89.25 18.11 42.29 88.64 25.71 30.64 -1.30 26.07 30.37 -0.67 1cb7_c07 source 1cb7 GLUTAMATE MUTASE : 4 hits 1cb7_c07 naa= 3 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 1 3 # 1 229 ASP A 98 ASP~? 12.55 CL CL B 124 264 GLU B 67 GLU~? 5.53 O3 GOL A 201 328 ASP A 104 ASP~? 7.36 CL CL B 124 coo 45.62 80.42 43.69 45.65 82.01 45.07 23.35 28.15 6.47 22.62 26.21 5.89 coo 59.69 92.71 39.85 58.53 92.03 41.47 40.62 21.48 11.23 42.64 22.01 11.70 coo 45.39 90.72 40.63 45.07 89.14 41.90 26.83 19.68 8.21 24.75 19.17 8.13 ULMN 3 1cdg_c00 CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.user 2 3 # 2 229 ASP B 98 ASP~? 15.88 O1 GOL A 201 264 GLU A 67 GLU~? 5.52 O4 UNL A 200 328 ASP B 104 ASP~? 19.83 C2 GOL A 201 coo 45.62 80.42 43.69 45.65 82.01 45.07 59.21 30.58 1.37 59.85 28.74 0.55 coo 59.69 92.71 39.85 58.53 92.03 41.47 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 45.39 90.72 40.63 45.07 89.14 41.90 55.81 24.74 -5.14 57.90 24.34 -5.34 1cdg_c00 source 1cdg CYCLODEXTRIN GLYCOSYLTRANSFERASE (E.C.2.4.1.19: 2 hits 1cdg_c00 naa= 3 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 A 173 ASP A 79 ASP~? 6.09 O1 GOL A 201 C 48 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 54.83 30.60 5.85 57.08 31.79 4.69 coo 24.35 4.55 25.11 25.94 3.23 25.53 53.25 22.44 8.57 51.13 22.57 8.85 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 A 173 ASP A 84 ASP.? -3.46 O1 GOL A 201s C 48 ARG A 19 ARG~? 17.61 O2 GOL A 201 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 54.83 30.60 5.85 57.08 31.79 4.69 coo 24.35 4.55 25.11 25.94 3.23 25.53 49.74 30.72 10.50 50.57 30.42 12.42 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 57.40 40.38 1.34 58.96 39.38 3.77 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 A 173 ASP B 98 ASP~? 15.88 O1 GOL A 201 C 48 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 54.83 30.60 5.85 57.08 31.79 4.69 coo 24.35 4.55 25.11 25.94 3.23 25.53 59.21 30.58 1.37 59.85 28.74 0.55 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 A 173 ASP A 98 ASP~? 12.55 CL CL B 124 C 48 ARG A 90 ARG^? -3.37 O3 UNL A 200s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 27.45 31.12 3.14 25.07 31.24 4.61 coo 24.35 4.55 25.11 25.94 3.23 25.53 23.35 28.15 6.47 22.62 26.21 5.89 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 34.56 36.69 3.31 35.72 36.40 0.46 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 A 173 ASP B 79 ASP~? 3.97 O7 UNL A 200 C 48 ARG A 90 ARG^? -3.37 O3 UNL A 200s coo 25.00 -3.03 25.68 27.14 -4.51 26.75 27.45 31.12 3.14 25.07 31.24 4.61 coo 24.35 4.55 25.11 25.94 3.23 25.53 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 34.56 36.69 3.31 35.72 36.40 0.46 ULMN 3 1cs1_c00 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 A 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 A 173 ASP B 84 ASP.? -3.52 O9 UNL A 200s C 48 ARG B 19 ARG~? 17.69 O8 UNL A 200 coo 25.00 -3.03 25.68 27.14 -4.51 26.75 27.45 31.12 3.14 25.07 31.24 4.61 coo 24.35 4.55 25.11 25.94 3.23 25.53 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 29.84 -5.31 33.83 28.87 -5.97 30.97 24.49 36.14 12.47 22.88 36.56 9.90 1cs1_c00 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1cs1_c00 naa= 3 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 48 ARG A 19 ARG~? 17.61 O2 GOL A 201 C 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 C 173 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 32.27 5.62 48.15 31.93 6.48 51.06 57.40 40.38 1.34 58.96 39.38 3.77 coo 29.64 3.64 57.39 31.22 5.14 55.65 54.83 30.60 5.85 57.08 31.79 4.69 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 48 ARG A 90 ARG^? -3.37 O3 UNL A 200s C 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 C 173 ASP A 98 ASP~? 12.55 CL CL B 124 coo 32.27 5.62 48.15 31.93 6.48 51.06 34.56 36.69 3.31 35.72 36.40 0.46 coo 29.64 3.64 57.39 31.22 5.14 55.65 27.45 31.12 3.14 25.07 31.24 4.61 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 23.35 28.15 6.47 22.62 26.21 5.89 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 48 ARG A 90 ARG^? -3.37 O3 UNL A 200s C 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 C 173 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 32.27 5.62 48.15 31.93 6.48 51.06 34.56 36.69 3.31 35.72 36.40 0.46 coo 29.64 3.64 57.39 31.22 5.14 55.65 27.45 31.12 3.14 25.07 31.24 4.61 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 48 ARG B 19 ARG~? 17.69 O8 UNL A 200 C 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 C 173 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 32.27 5.62 48.15 31.93 6.48 51.06 24.49 36.14 12.47 22.88 36.56 9.90 coo 29.64 3.64 57.39 31.22 5.14 55.65 27.45 31.12 3.14 25.07 31.24 4.61 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 48 ARG B 90 ARG^? -2.91 O2 GOL B 126s C 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 C 173 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 32.27 5.62 48.15 31.93 6.48 51.06 47.88 34.42 9.42 45.31 33.29 10.75 coo 29.64 3.64 57.39 31.22 5.14 55.65 54.83 30.60 5.85 57.08 31.79 4.69 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1cs1_c01 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 A 48 ARG B 90 ARG^? -2.91 O2 GOL B 126s C 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 C 173 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 32.27 5.62 48.15 31.93 6.48 51.06 47.88 34.42 9.42 45.31 33.29 10.75 coo 29.64 3.64 57.39 31.22 5.14 55.65 54.83 30.60 5.85 57.08 31.79 4.69 coo 28.89 -3.78 58.23 30.38 -2.57 57.33 59.21 30.58 1.37 59.85 28.74 0.55 1cs1_c01 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1cs1_c01 naa= 3 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 48 ARG A 19 ARG~? 17.61 O2 GOL A 201 D 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 D 173 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 69.08 8.58 32.60 69.70 10.81 30.58 57.40 40.38 1.34 58.96 39.38 3.77 coo 71.77 11.86 24.26 70.23 12.22 26.56 54.83 30.60 5.85 57.08 31.79 4.69 coo 71.60 6.14 19.25 70.26 6.87 20.69 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 48 ARG A 90 ARG^? -3.37 O3 UNL A 200s D 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 D 173 ASP A 98 ASP~? 12.55 CL CL B 124 coo 69.08 8.58 32.60 69.70 10.81 30.58 34.56 36.69 3.31 35.72 36.40 0.46 coo 71.77 11.86 24.26 70.23 12.22 26.56 27.45 31.12 3.14 25.07 31.24 4.61 coo 71.60 6.14 19.25 70.26 6.87 20.69 23.35 28.15 6.47 22.62 26.21 5.89 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 48 ARG A 90 ARG^? -3.37 O3 UNL A 200s D 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 D 173 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 69.08 8.58 32.60 69.70 10.81 30.58 34.56 36.69 3.31 35.72 36.40 0.46 coo 71.77 11.86 24.26 70.23 12.22 26.56 27.45 31.12 3.14 25.07 31.24 4.61 coo 71.60 6.14 19.25 70.26 6.87 20.69 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 48 ARG B 19 ARG~? 17.69 O8 UNL A 200 D 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 D 173 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 69.08 8.58 32.60 69.70 10.81 30.58 24.49 36.14 12.47 22.88 36.56 9.90 coo 71.77 11.86 24.26 70.23 12.22 26.56 27.45 31.12 3.14 25.07 31.24 4.61 coo 71.60 6.14 19.25 70.26 6.87 20.69 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 48 ARG B 90 ARG^? -2.91 O2 GOL B 126s D 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 D 173 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 69.08 8.58 32.60 69.70 10.81 30.58 47.88 34.42 9.42 45.31 33.29 10.75 coo 71.77 11.86 24.26 70.23 12.22 26.56 54.83 30.60 5.85 57.08 31.79 4.69 coo 71.60 6.14 19.25 70.26 6.87 20.69 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1cs1_c02 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 B 48 ARG B 90 ARG^? -2.91 O2 GOL B 126s D 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 D 173 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 69.08 8.58 32.60 69.70 10.81 30.58 47.88 34.42 9.42 45.31 33.29 10.75 coo 71.77 11.86 24.26 70.23 12.22 26.56 54.83 30.60 5.85 57.08 31.79 4.69 coo 71.60 6.14 19.25 70.26 6.87 20.69 59.21 30.58 1.37 59.85 28.74 0.55 1cs1_c02 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1cs1_c02 naa= 3 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 B 173 ASP A 79 ASP~? 6.09 O1 GOL A 201 D 48 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 54.83 30.60 5.85 57.08 31.79 4.69 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 53.25 22.44 8.57 51.13 22.57 8.85 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 B 173 ASP A 84 ASP.? -3.46 O1 GOL A 201s D 48 ARG A 19 ARG~? 17.61 O2 GOL A 201 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 54.83 30.60 5.85 57.08 31.79 4.69 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 49.74 30.72 10.50 50.57 30.42 12.42 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 57.40 40.38 1.34 58.96 39.38 3.77 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 101 TYR A 83 TYR.? 10.52 O1 GOL A 201 B 173 ASP B 98 ASP~? 15.88 O1 GOL A 201 D 48 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 54.83 30.60 5.85 57.08 31.79 4.69 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 59.21 30.58 1.37 59.85 28.74 0.55 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 B 173 ASP A 98 ASP~? 12.55 CL CL B 124 D 48 ARG A 90 ARG^? -3.37 O3 UNL A 200s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 27.45 31.12 3.14 25.07 31.24 4.61 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 23.35 28.15 6.47 22.62 26.21 5.89 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 34.56 36.69 3.31 35.72 36.40 0.46 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 B 173 ASP B 79 ASP~? 3.97 O7 UNL A 200 D 48 ARG A 90 ARG^? -3.37 O3 UNL A 200s coo 74.59 -12.57 45.75 72.37 -12.96 44.12 27.45 31.12 3.14 25.07 31.24 4.61 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 34.56 36.69 3.31 35.72 36.40 0.46 ULMN 3 1cs1_c03 CYSTATHIONINE GAMMA-SYNTHASE user 6 3 # 6 B 101 TYR B 83 TYR.? 10.34 O6 UNL A 200 B 173 ASP B 84 ASP.? -3.52 O9 UNL A 200s D 48 ARG B 19 ARG~? 17.69 O8 UNL A 200 coo 74.59 -12.57 45.75 72.37 -12.96 44.12 27.45 31.12 3.14 25.07 31.24 4.61 coo 76.00 -6.96 50.63 74.29 -7.61 49.57 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 69.39 -8.90 38.17 70.70 -11.19 39.77 24.49 36.14 12.47 22.88 36.56 9.90 1cs1_c03 source 1cs1 CYSTATHIONINE GAMMA-SYNTHASE : 6 hits 1cs1_c03 naa= 3 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 1 3 # 1 A 37 ASP A 79 ASP~? 6.09 O1 GOL A 201 A 56 ILE B 89 ILE^? 9.19 O2 GOL A 201 A 82 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 53.25 22.44 8.57 51.13 22.57 8.85 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 49.77 30.80 3.05 50.65 29.74 2.65 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 2 3 # 2 A 37 ASP A 104 ASP~? 7.36 CL CL B 124 A 56 ILE A 89 ILE^? 8.76 O6 UNL A 200 A 82 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 26.83 19.68 8.21 24.75 19.17 8.13 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 32.54 29.68 5.55 31.72 28.57 5.29 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 27.45 31.12 3.14 25.07 31.24 4.61 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 3 3 # 3 A 37 ASP A 104 ASP~? 7.36 CL CL B 124 A 56 ILE B 78 ILE~? 7.33 O6 UNL A 200 A 82 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 26.83 19.68 8.21 24.75 19.17 8.13 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 30.66 26.01 1.23 31.74 26.31 2.04 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 27.45 31.12 3.14 25.07 31.24 4.61 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 4 3 # 4 A 37 ASP B 79 ASP~? 3.97 O7 UNL A 200 A 56 ILE A 89 ILE^? 8.76 O6 UNL A 200 A 82 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 32.54 29.68 5.55 31.72 28.57 5.29 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 27.45 31.12 3.14 25.07 31.24 4.61 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 5 3 # 5 A 37 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 56 ILE A 78 ILE~? 8.37 C2 GOL A 201 A 82 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 51.89 25.33 4.26 50.78 26.08 3.81 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1d6o_c00 FK506-BINDING PROTEIN user 6 3 # 6 A 37 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 56 ILE B 89 ILE^? 9.19 O2 GOL A 201 A 82 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 57.53 -0.59 -5.76 57.73 0.50 -3.97 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 60.23 -10.38 -0.25 59.76 -9.69 -1.44 49.77 30.80 3.05 50.65 29.74 2.65 coo 54.60 -10.25 -2.46 55.96 -7.94 -1.62 54.83 30.60 5.85 57.08 31.79 4.69 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 79 ASP~? 6.09 O1 GOL A 201 B 56 ILE B 89 ILE^? 9.19 O2 GOL A 201 B 82 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 53.25 22.44 8.57 51.13 22.57 8.85 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 49.77 30.80 3.05 50.65 29.74 2.65 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 2 3 # 2 B 37 ASP B 79 ASP~? 3.97 O7 UNL A 200 B 56 ILE A 89 ILE^? 8.76 O6 UNL A 200 B 82 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 32.54 29.68 5.55 31.72 28.57 5.29 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 27.45 31.12 3.14 25.07 31.24 4.61 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 3 3 # 3 B 37 ASP B 104 ASP~? 19.83 C2 GOL A 201 B 56 ILE A 78 ILE~? 8.37 C2 GOL A 201 B 82 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 51.89 25.33 4.26 50.78 26.08 3.81 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1d6o_c01 FK506-BINDING PROTEIN user 4 3 # 4 B 37 ASP B 104 ASP~? 19.83 C2 GOL A 201 B 56 ILE B 89 ILE^? 9.19 O2 GOL A 201 B 82 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 60.36 -17.02 -33.28 60.59 -15.91 -31.49 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 63.12 -26.85 -28.11 62.65 -26.16 -29.29 49.77 30.80 3.05 50.65 29.74 2.65 coo 57.53 -26.71 -30.24 58.93 -24.39 -29.50 54.83 30.60 5.85 57.08 31.79 4.69 1d6o_c01 source 1d6o FK506-BINDING PROTEIN : 4 hits 1d6o_c01 naa= 3 ULMN 3 1ddj_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 646 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 47.38 26.60 7.09 47.11 24.76 8.07 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 49.74 30.72 10.50 50.57 30.42 12.42 coo 11.37 50.89 2.29 11.05 51.63 2.25 37.19 29.24 15.05 36.55 29.11 14.54 ULMN 3 1ddj_c12 PLASMINOGEN user 2 3 # 2 A 603 HIS B 85 HIS^? -3.53 O6 UNL A 200s A 646 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo 17.92 60.45 -3.51 16.63 61.88 -2.68 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 18.60 56.26 -8.31 18.53 57.26 -6.47 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 11.37 50.89 2.29 11.05 51.63 2.25 45.00 36.12 -4.79 45.64 35.72 -4.41 1ddj_c12 source 1ddj PLASMINOGEN : 2 hits 1ddj_c12 naa= 3 ULMN 3 1ddj_c13 PLASMINOGEN user 1 3 # 1 B 603 HIS A 85 HIS^? 3.67 O3 GOL A 201s B 646 ASP A 84 ASP.? -3.46 O1 GOL A 201s B 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 47.38 26.60 7.09 47.11 24.76 8.07 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 49.74 30.72 10.50 50.57 30.42 12.42 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 37.19 29.24 15.05 36.55 29.11 14.54 ULMN 3 1ddj_c13 PLASMINOGEN user 2 3 # 2 B 603 HIS B 85 HIS^? -3.53 O6 UNL A 200s B 646 ASP B 84 ASP.? -3.52 O9 UNL A 200s B 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo -28.76 37.11 -20.75 -29.48 38.32 -19.19 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -23.42 34.83 -23.78 -25.09 36.03 -23.31 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -24.60 49.24 -23.60 -24.80 48.99 -22.86 45.00 36.12 -4.79 45.64 35.72 -4.41 1ddj_c13 source 1ddj PLASMINOGEN : 2 hits 1ddj_c13 naa= 3 ULMN 3 1ddj_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 85 HIS^? 3.67 O3 GOL A 201s C 646 ASP A 84 ASP.? -3.46 O1 GOL A 201s C 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo 15.33 59.81 59.60 13.98 60.99 60.69 47.38 26.60 7.09 47.11 24.76 8.07 coo 16.06 55.72 54.73 15.97 56.49 56.70 49.74 30.72 10.50 50.57 30.42 12.42 coo 9.38 49.29 65.28 9.01 50.03 65.31 37.19 29.24 15.05 36.55 29.11 14.54 ULMN 3 1ddj_c14 PLASMINOGEN user 2 3 # 2 C 603 HIS B 85 HIS^? -3.53 O6 UNL A 200s C 646 ASP B 84 ASP.? -3.52 O9 UNL A 200s C 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo 15.33 59.81 59.60 13.98 60.99 60.69 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 16.06 55.72 54.73 15.97 56.49 56.70 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 9.38 49.29 65.28 9.01 50.03 65.31 45.00 36.12 -4.79 45.64 35.72 -4.41 1ddj_c14 source 1ddj PLASMINOGEN : 2 hits 1ddj_c14 naa= 3 ULMN 3 1ddj_c15 PLASMINOGEN user 1 3 # 1 D 603 HIS A 85 HIS^? 3.67 O3 GOL A 201s D 646 ASP A 84 ASP.? -3.46 O1 GOL A 201s D 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo -30.51 33.83 43.05 -30.50 33.12 45.03 47.38 26.60 7.09 47.11 24.76 8.07 coo -25.73 33.05 39.28 -27.50 34.05 39.88 49.74 30.72 10.50 50.57 30.42 12.42 coo -27.66 47.32 40.66 -27.81 47.01 41.41 37.19 29.24 15.05 36.55 29.11 14.54 ULMN 3 1ddj_c15 PLASMINOGEN user 2 3 # 2 D 603 HIS A 103 HIS~? 11.95 CL CL B 124 D 646 ASP A 104 ASP~? 7.36 CL CL B 124 D 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo -30.51 33.83 43.05 -30.50 33.12 45.03 24.53 20.38 13.18 24.12 18.57 14.18 coo -25.73 33.05 39.28 -27.50 34.05 39.88 26.83 19.68 8.21 24.75 19.17 8.13 coo -27.66 47.32 40.66 -27.81 47.01 41.41 37.19 29.24 15.05 36.55 29.11 14.54 ULMN 3 1ddj_c15 PLASMINOGEN user 3 3 # 3 D 603 HIS B 85 HIS^? -3.53 O6 UNL A 200s D 646 ASP B 84 ASP.? -3.52 O9 UNL A 200s D 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo -30.51 33.83 43.05 -30.50 33.12 45.03 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -25.73 33.05 39.28 -27.50 34.05 39.88 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -27.66 47.32 40.66 -27.81 47.01 41.41 45.00 36.12 -4.79 45.64 35.72 -4.41 ULMN 3 1ddj_c15 PLASMINOGEN user 4 3 # 4 D 603 HIS B 103 HIS~? 20.60 O1 UNL A 200 D 646 ASP B 104 ASP~? 19.83 C2 GOL A 201 D 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo -30.51 33.83 43.05 -30.50 33.12 45.03 57.94 28.30 -8.81 58.37 27.44 -10.67 coo -25.73 33.05 39.28 -27.50 34.05 39.88 55.81 24.74 -5.14 57.90 24.34 -5.34 coo -27.66 47.32 40.66 -27.81 47.01 41.41 45.00 36.12 -4.79 45.64 35.72 -4.41 1ddj_c15 source 1ddj PLASMINOGEN : 4 hits 1ddj_c15 naa= 3 ULMN 3 1de6_c00 L-RHAMNOSE ISOMERASE user 1 3 # 1 A 236 LYS A 114 LYS.? 14.28 CL CL B 124 A 270 HIS B 48 HIS.? 12.72 CL CL A 123 A 302 ASP B 47 ASP^? 15.68 CL CL A 123 coo 31.95 29.75 57.34 28.52 26.19 61.27 38.24 11.42 16.94 34.01 7.82 14.29 coo 33.21 25.89 58.06 33.02 25.68 60.13 39.28 14.76 21.81 39.53 14.41 19.75 coo 28.85 22.90 58.20 30.22 22.78 59.84 36.24 17.92 20.25 35.18 16.23 20.89 1de6_c00 source 1de6 L-RHAMNOSE ISOMERASE : 1 hits 1de6_c00 naa= 3 ULMN 3 1de6_c01 L-RHAMNOSE ISOMERASE user 1 3 # 1 B 236 LYS A 114 LYS.? 14.28 CL CL B 124 B 270 HIS B 48 HIS.? 12.72 CL CL A 123 B 302 ASP B 47 ASP^? 15.68 CL CL A 123 coo 38.57 31.68 38.20 37.57 30.37 32.27 38.24 11.42 16.94 34.01 7.82 14.29 coo 35.21 33.33 36.56 35.91 33.91 34.66 39.28 14.76 21.81 39.53 14.41 19.75 coo 33.27 29.36 33.58 33.68 31.25 32.69 36.24 17.92 20.25 35.18 16.23 20.89 1de6_c01 source 1de6 L-RHAMNOSE ISOMERASE : 1 hits 1de6_c01 naa= 3 ULMN 3 1de6_c02 L-RHAMNOSE ISOMERASE user 1 3 # 1 C 236 LYS A 114 LYS.? 14.28 CL CL B 124 C 270 HIS B 48 HIS.? 12.72 CL CL A 123 C 302 ASP B 47 ASP^? 15.68 CL CL A 123 coo 14.14 13.22 49.33 13.72 16.13 54.74 38.24 11.42 16.94 34.01 7.82 14.29 coo 12.62 17.05 49.17 11.38 17.06 50.85 39.28 14.76 21.81 39.53 14.41 19.75 coo 15.59 19.87 52.59 13.47 19.78 52.76 36.24 17.92 20.25 35.18 16.23 20.89 1de6_c02 source 1de6 L-RHAMNOSE ISOMERASE : 1 hits 1de6_c02 naa= 3 ULMN 3 1de6_c03 L-RHAMNOSE ISOMERASE user 1 3 # 1 D 236 LYS A 114 LYS.? 14.28 CL CL B 124 D 270 HIS B 48 HIS.? 12.72 CL CL A 123 D 302 ASP B 47 ASP^? 15.68 CL CL A 123 coo 22.81 12.92 30.93 27.72 14.83 27.49 38.24 11.42 16.94 34.01 7.82 14.29 coo 26.34 11.31 32.03 27.15 10.82 30.17 39.28 14.76 21.81 39.53 14.41 19.75 coo 29.89 15.23 31.62 30.32 13.38 30.56 36.24 17.92 20.25 35.18 16.23 20.89 1de6_c03 source 1de6 L-RHAMNOSE ISOMERASE : 1 hits 1de6_c03 naa= 3 ULMN 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 57 GLU A 67 GLU~? 5.52 O4 UNL A 200 A 226 THR A 109 THR~? 11.26 CL CL B 124 A 229 LYS A 113 LYS~? 7.84 CL CL A 123 coo 9.66 102.78 70.07 9.79 101.18 71.42 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 7.24 97.46 49.60 8.11 95.69 48.80 35.30 17.54 11.93 36.10 19.55 11.83 coo 10.53 97.56 43.71 9.33 93.71 47.17 39.46 14.20 14.59 41.86 19.61 14.55 ULMN 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 A 57 GLU A 67 GLU~? 5.52 O4 UNL A 200 A 226 THR A 109 THR~? 11.26 CL CL B 124 A 229 LYS A 114 LYS.? 14.28 CL CL B 124 coo 9.66 102.78 70.07 9.79 101.18 71.42 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 7.24 97.46 49.60 8.11 95.69 48.80 35.30 17.54 11.93 36.10 19.55 11.83 coo 10.53 97.56 43.71 9.33 93.71 47.17 38.24 11.42 16.94 34.01 7.82 14.29 ULMN 3 1dfo_c04 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 A 57 GLU B 67 GLU~? 5.53 O3 GOL A 201 A 226 THR B 109 THR~? 11.58 O1 UNL A 200 A 229 LYS B 113 LYS~? 7.99 CL CL B 123 coo 9.66 102.78 70.07 9.79 101.18 71.42 40.62 21.48 11.23 42.64 22.01 11.70 coo 7.24 97.46 49.60 8.11 95.69 48.80 47.32 25.04 -9.31 46.41 26.51 -8.00 coo 10.53 97.56 43.71 9.33 93.71 47.17 43.28 23.93 -13.69 40.73 27.69 -10.11 1dfo_c04 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 3 hits 1dfo_c04 naa= 3 ULMN 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 57 GLU A 67 GLU~? 5.52 O4 UNL A 200 B 226 THR A 109 THR~? 11.26 CL CL B 124 B 229 LYS A 113 LYS~? 7.84 CL CL A 123 coo 15.90 87.61 49.61 13.92 86.96 49.36 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 20.74 95.78 68.68 19.29 96.84 69.83 35.30 17.54 11.93 36.10 19.55 11.83 coo 22.32 101.61 71.64 17.89 98.63 71.55 39.46 14.20 14.59 41.86 19.61 14.55 ULMN 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 B 57 GLU A 67 GLU~? 5.52 O4 UNL A 200 B 226 THR A 109 THR~? 11.26 CL CL B 124 B 229 LYS A 114 LYS.? 14.28 CL CL B 124 coo 15.90 87.61 49.61 13.92 86.96 49.36 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 20.74 95.78 68.68 19.29 96.84 69.83 35.30 17.54 11.93 36.10 19.55 11.83 coo 22.32 101.61 71.64 17.89 98.63 71.55 38.24 11.42 16.94 34.01 7.82 14.29 ULMN 3 1dfo_c05 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 B 57 GLU B 67 GLU~? 5.53 O3 GOL A 201 B 226 THR B 109 THR~? 11.58 O1 UNL A 200 B 229 LYS B 113 LYS~? 7.99 CL CL B 123 coo 15.90 87.61 49.61 13.92 86.96 49.36 40.62 21.48 11.23 42.64 22.01 11.70 coo 20.74 95.78 68.68 19.29 96.84 69.83 47.32 25.04 -9.31 46.41 26.51 -8.00 coo 22.32 101.61 71.64 17.89 98.63 71.55 43.28 23.93 -13.69 40.73 27.69 -10.11 1dfo_c05 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 3 hits 1dfo_c05 naa= 3 ULMN 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 57 GLU A 67 GLU~? 5.52 O4 UNL A 200 C 226 THR A 109 THR~? 11.26 CL CL B 124 C 229 LYS A 113 LYS~? 7.84 CL CL A 123 coo 5.43 40.40 61.63 4.27 41.99 60.90 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 22.16 45.88 73.63 23.23 47.70 73.25 35.30 17.54 11.93 36.10 19.55 11.83 coo 28.90 45.91 73.55 25.22 49.72 72.97 39.46 14.20 14.59 41.86 19.61 14.55 ULMN 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 C 57 GLU A 67 GLU~? 5.52 O4 UNL A 200 C 226 THR A 109 THR~? 11.26 CL CL B 124 C 229 LYS A 114 LYS.? 14.28 CL CL B 124 coo 5.43 40.40 61.63 4.27 41.99 60.90 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 22.16 45.88 73.63 23.23 47.70 73.25 35.30 17.54 11.93 36.10 19.55 11.83 coo 28.90 45.91 73.55 25.22 49.72 72.97 38.24 11.42 16.94 34.01 7.82 14.29 ULMN 3 1dfo_c06 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 C 57 GLU B 67 GLU~? 5.53 O3 GOL A 201 C 226 THR B 109 THR~? 11.58 O1 UNL A 200 C 229 LYS B 113 LYS~? 7.99 CL CL B 123 coo 5.43 40.40 61.63 4.27 41.99 60.90 40.62 21.48 11.23 42.64 22.01 11.70 coo 22.16 45.88 73.63 23.23 47.70 73.25 47.32 25.04 -9.31 46.41 26.51 -8.00 coo 28.90 45.91 73.55 25.22 49.72 72.97 43.28 23.93 -13.69 40.73 27.69 -10.11 1dfo_c06 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 3 hits 1dfo_c06 naa= 3 ULMN 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 57 GLU A 67 GLU~? 5.52 O4 UNL A 200 D 226 THR A 109 THR~? 11.26 CL CL B 124 D 229 LYS A 113 LYS~? 7.84 CL CL A 123 coo 26.07 55.89 66.14 25.33 56.50 68.01 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 11.79 47.62 52.67 10.10 46.51 53.39 35.30 17.54 11.93 36.10 19.55 11.83 coo 10.05 41.79 49.80 7.94 44.71 53.76 39.46 14.20 14.59 41.86 19.61 14.55 ULMN 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 D 57 GLU A 67 GLU~? 5.52 O4 UNL A 200 D 226 THR A 109 THR~? 11.26 CL CL B 124 D 229 LYS A 114 LYS.? 14.28 CL CL B 124 coo 26.07 55.89 66.14 25.33 56.50 68.01 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 11.79 47.62 52.67 10.10 46.51 53.39 35.30 17.54 11.93 36.10 19.55 11.83 coo 10.05 41.79 49.80 7.94 44.71 53.76 38.24 11.42 16.94 34.01 7.82 14.29 ULMN 3 1dfo_c07 SERINE HYDROXYMETHYLTRANSFERASE user 3 3 # 3 D 57 GLU B 67 GLU~? 5.53 O3 GOL A 201 D 226 THR B 109 THR~? 11.58 O1 UNL A 200 D 229 LYS B 113 LYS~? 7.99 CL CL B 123 coo 26.07 55.89 66.14 25.33 56.50 68.01 40.62 21.48 11.23 42.64 22.01 11.70 coo 11.79 47.62 52.67 10.10 46.51 53.39 47.32 25.04 -9.31 46.41 26.51 -8.00 coo 10.05 41.79 49.80 7.94 44.71 53.76 43.28 23.93 -13.69 40.73 27.69 -10.11 1dfo_c07 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 3 hits 1dfo_c07 naa= 3 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 A 123 HIS A 94 HIS.? 16.90 O9 UNL A 200 A 200 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 229 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 1.13 77.49 40.64 0.62 75.57 39.98 23.42 43.43 6.45 23.95 45.16 7.52 coo 0.84 91.24 49.01 2.91 91.61 49.23 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 10.53 97.56 43.71 9.33 93.71 47.17 38.86 41.59 -9.23 36.85 38.97 -13.00 ULMN 3 1dfo_c12 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 A 123 HIS B 94 HIS.? 18.31 O1 GOL B 126 A 200 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 229 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo 1.13 77.49 40.64 0.62 75.57 39.98 58.52 42.74 10.71 57.93 44.74 10.95 coo 0.84 91.24 49.01 2.91 91.61 49.23 49.74 30.72 10.50 50.57 30.42 12.42 coo 10.53 97.56 43.71 9.33 93.71 47.17 43.23 31.03 22.06 45.10 26.50 23.58 1dfo_c12 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 2 hits 1dfo_c12 naa= 3 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 B 123 HIS A 94 HIS.? 16.90 O9 UNL A 200 B 200 ASP B 84 ASP.? -3.52 O9 UNL A 200s B 229 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 9.24 94.26 88.22 8.02 94.07 89.92 23.42 43.43 6.45 23.95 45.16 7.52 coo 17.54 90.31 75.01 17.17 92.01 73.80 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 22.32 101.61 71.64 17.89 98.63 71.55 38.86 41.59 -9.23 36.85 38.97 -13.00 ULMN 3 1dfo_c13 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 B 123 HIS B 94 HIS.? 18.31 O1 GOL B 126 B 200 ASP A 84 ASP.? -3.46 O1 GOL A 201s B 229 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo 9.24 94.26 88.22 8.02 94.07 89.92 58.52 42.74 10.71 57.93 44.74 10.95 coo 17.54 90.31 75.01 17.17 92.01 73.80 49.74 30.72 10.50 50.57 30.42 12.42 coo 22.32 101.61 71.64 17.89 98.63 71.55 43.23 31.03 22.06 45.10 26.50 23.58 1dfo_c13 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 2 hits 1dfo_c13 naa= 3 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 C 123 HIS A 94 HIS.? 16.90 O9 UNL A 200 C 200 ASP B 84 ASP.? -3.52 O9 UNL A 200s C 229 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 26.77 65.84 83.49 27.06 67.76 84.27 23.42 43.43 6.45 23.95 45.16 7.52 coo 19.52 52.01 79.59 20.28 51.65 77.65 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 28.90 45.91 73.55 25.22 49.72 72.97 38.86 41.59 -9.23 36.85 38.97 -13.00 ULMN 3 1dfo_c14 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 C 123 HIS B 94 HIS.? 18.31 O1 GOL B 126 C 200 ASP A 84 ASP.? -3.46 O1 GOL A 201s C 229 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo 26.77 65.84 83.49 27.06 67.76 84.27 58.52 42.74 10.71 57.93 44.74 10.95 coo 19.52 52.01 79.59 20.28 51.65 77.65 49.74 30.72 10.50 50.57 30.42 12.42 coo 28.90 45.91 73.55 25.22 49.72 72.97 43.23 31.03 22.06 45.10 26.50 23.58 1dfo_c14 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 2 hits 1dfo_c14 naa= 3 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 1 3 # 1 D 123 HIS A 94 HIS.? 16.90 O9 UNL A 200 D 200 ASP B 84 ASP.? -3.52 O9 UNL A 200s D 229 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo -10.90 48.74 53.41 -12.98 48.90 53.67 23.42 43.43 6.45 23.95 45.16 7.52 coo 4.60 52.95 52.50 5.57 51.29 53.40 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 10.05 41.79 49.80 7.94 44.71 53.76 38.86 41.59 -9.23 36.85 38.97 -13.00 ULMN 3 1dfo_c15 SERINE HYDROXYMETHYLTRANSFERASE user 2 3 # 2 D 123 HIS B 94 HIS.? 18.31 O1 GOL B 126 D 200 ASP A 84 ASP.? -3.46 O1 GOL A 201s D 229 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo -10.90 48.74 53.41 -12.98 48.90 53.67 58.52 42.74 10.71 57.93 44.74 10.95 coo 4.60 52.95 52.50 5.57 51.29 53.40 49.74 30.72 10.50 50.57 30.42 12.42 coo 10.05 41.79 49.80 7.94 44.71 53.76 43.23 31.03 22.06 45.10 26.50 23.58 1dfo_c15 source 1dfo SERINE HYDROXYMETHYLTRANSFERASE : 2 hits 1dfo_c15 naa= 3 ULMN 3 1dhp_c02 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 A 44 THR A 70 THR~? 11.53 O1 UNL A 200 A 45 THR A 72 THR~? 12.50 O3 GOL A 201 A 161 LYS B 113 LYS~? 7.99 CL CL B 123 coo 26.16 88.25 79.16 25.22 89.47 80.71 45.96 23.42 -3.30 46.76 24.92 -4.64 coo 27.73 89.90 76.08 29.24 91.46 75.95 44.96 20.42 1.10 43.33 19.07 0.95 coo 33.83 91.15 88.62 31.07 91.06 83.02 43.28 23.93 -13.69 40.73 27.69 -10.11 ULMN 3 1dhp_c02 DIHYDRODIPICOLINATE SYNTHASE user 2 3 # 2 A 44 THR B 70 THR~? 8.99 CL CL B 124 A 45 THR B 72 THR~? 11.14 CL CL B 124 A 161 LYS A 113 LYS~? 7.84 CL CL A 123 coo 26.16 88.25 79.16 25.22 89.47 80.71 36.66 20.03 6.23 35.79 20.25 8.21 coo 27.73 89.90 76.08 29.24 91.46 75.95 37.75 20.46 0.91 39.51 19.47 0.17 coo 33.83 91.15 88.62 31.07 91.06 83.02 39.46 14.20 14.59 41.86 19.61 14.55 1dhp_c02 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 2 hits 1dhp_c02 naa= 3 ULMN 3 1dhp_c03 DIHYDRODIPICOLINATE SYNTHASE user 1 3 # 1 B 44 THR A 70 THR~? 11.53 O1 UNL A 200 B 45 THR A 72 THR~? 12.50 O3 GOL A 201 B 161 LYS B 113 LYS~? 7.99 CL CL B 123 coo 7.39 128.28 94.56 8.34 126.36 94.79 45.96 23.42 -3.30 46.76 24.92 -4.64 coo 5.75 129.25 91.25 4.29 128.16 90.07 44.96 20.42 1.10 43.33 19.07 0.95 coo -0.17 119.75 99.65 2.51 123.83 95.70 43.28 23.93 -13.69 40.73 27.69 -10.11 ULMN 3 1dhp_c03 DIHYDRODIPICOLINATE SYNTHASE user 2 3 # 2 B 44 THR B 70 THR~? 8.99 CL CL B 124 B 45 THR B 72 THR~? 11.14 CL CL B 124 B 161 LYS A 113 LYS~? 7.84 CL CL A 123 coo 7.39 128.28 94.56 8.34 126.36 94.79 36.66 20.03 6.23 35.79 20.25 8.21 coo 5.75 129.25 91.25 4.29 128.16 90.07 37.75 20.46 0.91 39.51 19.47 0.17 coo -0.17 119.75 99.65 2.51 123.83 95.70 39.46 14.20 14.59 41.86 19.61 14.55 1dhp_c03 source 1dhp DIHYDRODIPICOLINATE SYNTHASE : 2 hits 1dhp_c03 naa= 3 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 1 3 # 1 A 48 ALA A 116 ALA.? 8.95 CL CL A 123 A 52 HIS B 48 HIS.? 12.72 CL CL A 123 A 191 TRP A 120 TRP.? -3.57 C3 GOL A 201s coo 0.32 19.13 2.10 -0.45 20.12 1.22 43.77 13.30 16.69 43.18 14.66 16.33 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 39.28 14.76 21.81 39.53 14.41 19.75 coo -12.27 21.19 4.26 -8.94 21.66 2.22 47.59 24.24 15.32 44.33 26.38 14.78 ULMN 3 1dj1_c00 CYTOCHROME C PEROXIDASE user 2 3 # 2 A 48 ALA B 116 ALA.? 9.15 CL CL B 123 A 52 HIS A 48 HIS.? 12.89 CL CL B 123 A 191 TRP B 120 TRP.? -4.12 O5 UNL A 200s coo 0.32 19.13 2.10 -0.45 20.12 1.22 38.93 23.71 -15.82 39.49 24.61 -14.68 coo 0.08 14.87 -2.02 -1.94 15.16 -2.48 43.31 28.55 -18.97 43.37 26.94 -17.63 coo -12.27 21.19 4.26 -8.94 21.66 2.22 34.73 31.77 -8.13 37.90 33.34 -6.41 1dj1_c00 source 1dj1 CYTOCHROME C PEROXIDASE : 2 hits 1dj1_c00 naa= 3 ULMN 3 1do8_c01 MALIC ENZYME user 1 3 # 1 B 112 TYR A 108 TYR~? 6.12 CL CL B 124 B 183 LYS A 113 LYS~? 7.84 CL CL A 123 B 278 ASP B 47 ASP^? 15.68 CL CL A 123 coo 58.62 15.99 58.34 60.98 14.60 58.93 33.34 16.08 7.97 35.36 15.08 6.29 coo 60.11 10.60 53.63 62.59 10.74 58.67 39.46 14.20 14.59 41.86 19.61 14.55 coo 66.50 7.32 58.45 66.26 9.42 58.23 36.24 17.92 20.25 35.18 16.23 20.89 1do8_c01 source 1do8 MALIC ENZYME : 1 hits 1do8_c01 naa= 3 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 1 3 # 1 A 16 TYR A 83 TYR.? 10.52 O1 GOL A 201 A 40 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 103 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 54.83 30.60 5.85 57.08 31.79 4.69 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 59.21 30.58 1.37 59.85 28.74 0.55 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 2 3 # 2 A 16 TYR A 108 TYR~? 6.12 CL CL B 124 A 40 ASP B 47 ASP^? 15.68 CL CL A 123 A 103 ASP A 111 ASP~? 10.94 CL CL B 124 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 33.34 16.08 7.97 35.36 15.08 6.29 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 36.24 17.92 20.25 35.18 16.23 20.89 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 33.22 12.10 12.41 33.55 10.10 11.76 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 3 3 # 3 A 16 TYR B 83 TYR.? 10.34 O6 UNL A 200 A 40 ASP A 104 ASP~? 7.36 CL CL B 124 A 103 ASP A 98 ASP~? 12.55 CL CL B 124 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 27.45 31.12 3.14 25.07 31.24 4.61 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 26.83 19.68 8.21 24.75 19.17 8.13 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 23.35 28.15 6.47 22.62 26.21 5.89 ULMN 3 1e3v_c02 STEROID DELTA-ISOMERASE user 4 3 # 4 A 16 TYR B 108 TYR~? 16.24 O4 UNL A 200 A 40 ASP A 47 ASP^? 15.55 CL CL B 123 A 103 ASP B 111 ASP~? 19.61 CL CL B 123 coo 3.86 -20.80 85.74 4.58 -18.11 85.73 49.35 21.55 -7.05 47.36 19.71 -6.34 coo 8.98 -11.19 82.60 6.87 -11.00 82.49 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 5.15 -17.92 79.35 5.03 -16.26 80.65 49.48 21.08 -13.06 49.20 19.08 -13.70 1e3v_c02 source 1e3v STEROID DELTA-ISOMERASE : 4 hits 1e3v_c02 naa= 3 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 1 3 # 1 B 16 TYR A 83 TYR.? 10.52 O1 GOL A 201 B 40 ASP B 104 ASP~? 19.83 C2 GOL A 201 B 103 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 54.83 30.60 5.85 57.08 31.79 4.69 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 59.21 30.58 1.37 59.85 28.74 0.55 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 2 3 # 2 B 16 TYR A 108 TYR~? 6.12 CL CL B 124 B 40 ASP B 47 ASP^? 15.68 CL CL A 123 B 103 ASP A 111 ASP~? 10.94 CL CL B 124 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 33.34 16.08 7.97 35.36 15.08 6.29 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 36.24 17.92 20.25 35.18 16.23 20.89 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 33.22 12.10 12.41 33.55 10.10 11.76 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 3 3 # 3 B 16 TYR B 83 TYR.? 10.34 O6 UNL A 200 B 40 ASP A 104 ASP~? 7.36 CL CL B 124 B 103 ASP A 98 ASP~? 12.55 CL CL B 124 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 27.45 31.12 3.14 25.07 31.24 4.61 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 26.83 19.68 8.21 24.75 19.17 8.13 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 23.35 28.15 6.47 22.62 26.21 5.89 ULMN 3 1e3v_c03 STEROID DELTA-ISOMERASE user 4 3 # 4 B 16 TYR B 108 TYR~? 16.24 O4 UNL A 200 B 40 ASP A 47 ASP^? 15.55 CL CL B 123 B 103 ASP B 111 ASP~? 19.61 CL CL B 123 coo 4.95 -16.38 58.56 5.78 -19.05 58.68 49.35 21.55 -7.05 47.36 19.71 -6.34 coo 9.81 -26.10 62.11 7.73 -26.45 62.06 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 5.71 -19.27 64.99 5.64 -20.90 63.63 49.48 21.08 -13.06 49.20 19.08 -13.70 1e3v_c03 source 1e3v STEROID DELTA-ISOMERASE : 4 hits 1e3v_c03 naa= 3 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 1 3 # 1 150 ASP A 84 ASP.? -3.46 O1 GOL A 201s 153 ARG B 90 ARG^? -2.91 O2 GOL B 126s 177 HIS A 85 HIS^? 3.67 O3 GOL A 201s coo 6.83 2.75 19.17 7.40 0.75 19.11 49.74 30.72 10.50 50.57 30.42 12.42 coo 1.78 0.50 17.43 2.55 -2.31 16.44 47.88 34.42 9.42 45.31 33.29 10.75 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 47.38 26.60 7.09 47.11 24.76 8.07 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 2 3 # 2 150 ASP B 79 ASP~? 3.97 O7 UNL A 200 153 ARG B 122 ARG.? 4.15 CL CL B 123s 177 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 6.83 2.75 19.17 7.40 0.75 19.11 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 1.78 0.50 17.43 2.55 -2.31 16.44 31.77 26.02 -8.78 30.06 27.01 -11.17 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 35.07 28.78 -0.10 35.41 27.96 -2.01 ULMN 3 1emd_c01 MALATE DEHYDROGENASE (E.C.1.1.1.37) user 3 3 # 3 150 ASP B 84 ASP.? -3.52 O9 UNL A 200s 153 ARG A 90 ARG^? -3.37 O3 UNL A 200s 177 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 6.83 2.75 19.17 7.40 0.75 19.11 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 1.78 0.50 17.43 2.55 -2.31 16.44 34.56 36.69 3.31 35.72 36.40 0.46 coo 9.81 -2.34 18.22 7.84 -2.69 17.56 35.07 28.78 -0.10 35.41 27.96 -2.01 1emd_c01 source 1emd MALATE DEHYDROGENASE (E.C.1.1.1.37) : 3 hits 1emd_c01 naa= 3 ULMN 3 1euu_c00 SIALIDASE user 1 3 # 1 92 ASP A 16 ASP~? 19.78 O1 GOL B 126 260 GLU A 21 GLU~? 22.63 O1 UNL A 200 370 TYR A 8 TYR~? 17.73 O1 UNL A 200 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 55.39 45.97 3.05 55.87 45.57 5.11 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 55.82 46.81 -6.36 56.64 48.78 -6.25 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 50.16 48.46 -5.63 50.76 46.54 -7.56 ULMN 3 1euu_c00 SIALIDASE user 2 3 # 2 92 ASP B 16 ASP~? 19.71 O9 UNL A 200 260 GLU B 21 GLU~? 22.82 C3 GOL B 126 370 TYR B 8 TYR~? 16.62 O1 GOL B 125 coo 8.60 -17.93 28.38 7.67 -19.04 26.88 26.40 41.60 14.58 25.93 42.50 12.70 coo 0.12 -12.06 25.14 1.33 -13.03 23.72 25.81 36.56 22.58 24.87 38.21 23.53 coo 4.66 -12.77 19.52 3.70 -14.16 21.71 31.46 38.27 23.11 30.63 35.63 23.45 1euu_c00 source 1euu SIALIDASE : 2 hits 1euu_c00 naa= 3 ULMN 3 1ez2_c00 PHOSPHOTRIESTERASE user 1 3 # 1 A 233 ASP A 79 ASP~? 6.09 O1 GOL A 201 A 254 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 301 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 54.85 -0.50 33.94 53.35 -1.92 34.23 53.25 22.44 8.57 51.13 22.57 8.85 coo 49.60 -2.04 34.84 49.44 -3.48 33.35 47.38 26.60 7.09 47.11 24.76 8.07 coo 45.28 -3.05 33.32 45.60 -4.40 31.72 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1ez2_c00 PHOSPHOTRIESTERASE user 2 3 # 2 A 233 ASP B 79 ASP~? 3.97 O7 UNL A 200 A 254 HIS B 85 HIS^? -3.53 O6 UNL A 200s A 301 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 54.85 -0.50 33.94 53.35 -1.92 34.23 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 49.60 -2.04 34.84 49.44 -3.48 33.35 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 45.28 -3.05 33.32 45.60 -4.40 31.72 32.50 34.12 -0.35 31.64 35.02 -2.06 1ez2_c00 source 1ez2 PHOSPHOTRIESTERASE : 2 hits 1ez2_c00 naa= 3 ULMN 3 1ez2_c01 PHOSPHOTRIESTERASE user 1 3 # 1 B 233 ASP A 79 ASP~? 6.09 O1 GOL A 201 B 254 HIS A 85 HIS^? 3.67 O3 GOL A 201s B 301 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 56.25 -34.15 2.23 54.65 -32.85 1.82 53.25 22.44 8.57 51.13 22.57 8.85 coo 50.90 -32.78 1.00 50.77 -31.41 2.56 47.38 26.60 7.09 47.11 24.76 8.07 coo 46.50 -31.79 2.21 46.79 -30.43 3.83 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1ez2_c01 PHOSPHOTRIESTERASE user 2 3 # 2 B 233 ASP B 79 ASP~? 3.97 O7 UNL A 200 B 254 HIS B 85 HIS^? -3.53 O6 UNL A 200s B 301 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 56.25 -34.15 2.23 54.65 -32.85 1.82 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 50.90 -32.78 1.00 50.77 -31.41 2.56 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 46.50 -31.79 2.21 46.79 -30.43 3.83 32.50 34.12 -0.35 31.64 35.02 -2.06 1ez2_c01 source 1ez2 PHOSPHOTRIESTERASE : 2 hits 1ez2_c01 naa= 3 ULMN 3 1fgj_c01 HYDROXYLAMINE OXIDOREDUCTASE user 1 3 # 1 B 267 ASP A 84 ASP.? -3.46 O1 GOL A 201s B 268 HIS A 85 HIS^? 3.67 O3 GOL A 201s B 334 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 34.92 32.34 -16.78 33.96 30.63 -15.98 49.74 30.72 10.50 50.57 30.42 12.42 coo 34.35 32.52 -12.02 33.62 30.54 -12.18 47.38 26.60 7.09 47.11 24.76 8.07 coo 31.28 36.97 -17.45 31.29 34.40 -16.38 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1fgj_c01 HYDROXYLAMINE OXIDOREDUCTASE user 2 3 # 2 B 267 ASP B 84 ASP.? -3.52 O9 UNL A 200s B 268 HIS B 85 HIS^? -3.53 O6 UNL A 200s B 334 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 34.92 32.34 -16.78 33.96 30.63 -15.98 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 34.35 32.52 -12.02 33.62 30.54 -12.18 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 31.28 36.97 -17.45 31.29 34.40 -16.38 27.45 31.12 3.14 25.07 31.24 4.61 1fgj_c01 source 1fgj HYDROXYLAMINE OXIDOREDUCTASE : 2 hits 1fgj_c01 naa= 3 ULMN 3 1geq_c02 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 A 36 GLU A 21 GLU~? 22.63 O1 UNL A 200 A 47 ASP A 15 ASP~? 26.19 O1 GOL B 126 A 161 TYR A 8 TYR~? 17.73 O1 UNL A 200 coo 37.12 18.35 73.76 37.09 16.69 72.44 55.82 46.81 -6.36 56.64 48.78 -6.25 coo 29.81 8.06 73.13 30.21 10.11 72.95 60.61 47.40 3.28 62.48 48.35 3.41 coo 37.29 15.56 67.90 37.37 13.79 70.08 50.16 48.46 -5.63 50.76 46.54 -7.56 1geq_c02 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 1 hits 1geq_c02 naa= 3 ULMN 3 1geq_c03 TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT user 1 3 # 1 B 36 GLU A 21 GLU~? 22.63 O1 UNL A 200 B 47 ASP A 15 ASP~? 26.19 O1 GOL B 126 B 161 TYR A 8 TYR~? 17.73 O1 UNL A 200 coo 53.87 35.49 53.22 55.44 35.72 54.61 55.82 46.81 -6.36 56.64 48.78 -6.25 coo 63.47 43.65 53.95 61.45 43.07 54.06 60.61 47.40 3.28 62.48 48.35 3.41 coo 56.38 35.81 59.19 58.25 35.77 57.10 50.16 48.46 -5.63 50.76 46.54 -7.56 1geq_c03 source 1geq TRYPTOPHAN SYNTHASE ALPHA-SUBUNIT : 1 hits 1geq_c03 naa= 3 ULMN 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 1 3 # 1 13 ASP A 79 ASP~? 6.09 O1 GOL A 201 41 HIS A 85 HIS^? 3.67 O3 GOL A 201s 224 GLN A 121 GLN.? 8.90 O3 GOL A 201 coo -3.80 50.71 49.48 -5.59 51.85 49.27 53.25 22.44 8.57 51.13 22.57 8.85 coo -6.45 47.32 41.99 -8.32 46.87 42.83 47.38 26.60 7.09 47.11 24.76 8.07 coo -12.35 49.13 49.89 -13.38 48.89 48.03 44.39 18.21 9.15 43.36 18.66 7.34 ULMN 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 2 3 # 2 13 ASP B 79 ASP~? 3.97 O7 UNL A 200 41 HIS B 85 HIS^? -3.53 O6 UNL A 200s 224 GLN B 77 GLN~? 4.54 CL CL B 124 coo -3.80 50.71 49.48 -5.59 51.85 49.27 29.26 26.18 -3.96 31.36 26.46 -4.14 coo -6.45 47.32 41.99 -8.32 46.87 42.83 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -12.35 49.13 49.89 -13.38 48.89 48.03 27.28 19.96 1.12 28.54 18.65 -0.07 ULMN 3 1gim_c00 ADENYLOSUCCINATE SYNTHETASE user 3 3 # 3 13 ASP B 79 ASP~? 3.97 O7 UNL A 200 41 HIS B 85 HIS^? -3.53 O6 UNL A 200s 224 GLN B 121 GLN.? 9.04 O4 UNL A 200 coo -3.80 50.71 49.48 -5.59 51.85 49.27 29.26 26.18 -3.96 31.36 26.46 -4.14 coo -6.45 47.32 41.99 -8.32 46.87 42.83 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -12.35 49.13 49.89 -13.38 48.89 48.03 38.36 23.42 -6.80 39.29 22.72 -5.01 1gim_c00 source 1gim ADENYLOSUCCINATE SYNTHETASE : 3 hits 1gim_c00 naa= 3 ULMN 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 1 3 # 1 B 106 ASN A 26 ASN~? 22.72 O1 UNL A 200 B 108 HIS B 103 HIS~? 20.60 O1 UNL A 200 B 144 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 36.64 101.02 13.15 38.55 101.84 12.78 59.79 36.87 -9.12 61.45 38.07 -8.53 coo 41.00 107.18 12.86 42.70 107.82 11.96 57.94 28.30 -8.81 58.37 27.44 -10.67 coo 31.60 110.69 6.14 29.69 109.74 5.94 59.21 30.58 1.37 59.85 28.74 0.55 ULMN 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 2 3 # 2 B 106 ASN A 56 ASN^? 8.14 O1 UNL A 200 B 108 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 144 ASP A 16 ASP~? 19.78 O1 GOL B 126 coo 36.64 101.02 13.15 38.55 101.84 12.78 44.33 40.68 0.78 42.68 41.57 -0.30 coo 41.00 107.18 12.86 42.70 107.82 11.96 49.34 38.44 7.48 47.30 38.27 7.99 coo 31.60 110.69 6.14 29.69 109.74 5.94 55.39 45.97 3.05 55.87 45.57 5.11 ULMN 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 3 3 # 3 B 106 ASN B 26 ASN~? 21.41 CL CL B 124 B 108 HIS A 103 HIS~? 11.95 CL CL B 124 B 144 ASP A 98 ASP~? 12.55 CL CL B 124 coo 36.64 101.02 13.15 38.55 101.84 12.78 22.33 26.94 18.41 20.59 28.17 18.67 coo 41.00 107.18 12.86 42.70 107.82 11.96 24.53 20.38 13.18 24.12 18.57 14.18 coo 31.60 110.69 6.14 29.69 109.74 5.94 23.35 28.15 6.47 22.62 26.21 5.89 ULMN 3 1grc_c03 GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMuser 4 3 # 4 B 106 ASN B 56 ASN^? 7.10 O2 GOL B 126 B 108 HIS B 61 HIS^? 10.01 O3 UNL A 200 B 144 ASP B 16 ASP~? 19.71 O9 UNL A 200 coo 36.64 101.02 13.15 38.55 101.84 12.78 37.58 36.28 13.48 39.18 36.45 14.91 coo 41.00 107.18 12.86 42.70 107.82 11.96 32.69 38.40 6.72 34.73 38.60 6.25 coo 31.60 110.69 6.14 29.69 109.74 5.94 26.40 41.60 14.58 25.93 42.50 12.70 1grc_c03 source 1grc GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMYLASE (E.C: 4 hits 1grc_c03 naa= 3 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 1 3 # 1 A 271 GLN A 87 GLN^? 4.75 O3 GOL A 201 A 296 GLU B 67 GLU~? 5.53 O3 GOL A 201 A 383 TYR A 108 TYR~? 6.12 CL CL B 124 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 41.69 26.32 5.03 43.09 26.04 6.63 coo 40.93 4.45 2.36 38.91 3.75 2.26 40.62 21.48 11.23 42.64 22.01 11.70 coo 30.54 7.22 6.23 31.38 5.79 3.97 33.34 16.08 7.97 35.36 15.08 6.29 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 2 3 # 2 A 271 GLN A 100 GLN~? 11.54 CL CL B 124 A 296 GLU A 99 GLU~? 18.98 CL CL B 124 A 383 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 21.51 21.50 8.41 21.20 20.36 10.22 coo 40.93 4.45 2.36 38.91 3.75 2.26 22.47 28.68 12.84 21.91 29.15 14.84 coo 30.54 7.22 6.23 31.38 5.79 3.97 27.45 31.12 3.14 25.07 31.24 4.61 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 3 3 # 3 A 271 GLN A 121 GLN.? 8.90 O3 GOL A 201 A 296 GLU B 67 GLU~? 5.53 O3 GOL A 201 A 383 TYR A 108 TYR~? 6.12 CL CL B 124 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 44.39 18.21 9.15 43.36 18.66 7.34 coo 40.93 4.45 2.36 38.91 3.75 2.26 40.62 21.48 11.23 42.64 22.01 11.70 coo 30.54 7.22 6.23 31.38 5.79 3.97 33.34 16.08 7.97 35.36 15.08 6.29 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 4 3 # 4 A 271 GLN B 87 GLN^? 5.19 O4 UNL A 200 A 296 GLU A 67 GLU~? 5.52 O4 UNL A 200 A 383 TYR B 108 TYR~? 16.24 O4 UNL A 200 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 40.79 27.52 1.41 39.40 28.24 -0.01 coo 40.93 4.45 2.36 38.91 3.75 2.26 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 30.54 7.22 6.23 31.38 5.79 3.97 49.35 21.55 -7.05 47.36 19.71 -6.34 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 5 3 # 5 A 271 GLN B 100 GLN~? 22.34 O1 GOL A 201 A 296 GLU B 99 GLU~? 20.37 O1 UNL A 200 A 383 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 61.02 26.44 -4.25 61.35 26.63 -6.38 coo 40.93 4.45 2.36 38.91 3.75 2.26 59.74 34.86 -3.51 60.17 36.42 -4.90 coo 30.54 7.22 6.23 31.38 5.79 3.97 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1h19_c00 LEUKOTRIENE A-4 HYDROLASE user 6 3 # 6 A 271 GLN B 121 GLN.? 9.04 O4 UNL A 200 A 296 GLU A 67 GLU~? 5.52 O4 UNL A 200 A 383 TYR B 108 TYR~? 16.24 O4 UNL A 200 coo 38.07 -1.37 3.28 36.21 -0.34 2.92 38.36 23.42 -6.80 39.29 22.72 -5.01 coo 40.93 4.45 2.36 38.91 3.75 2.26 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 30.54 7.22 6.23 31.38 5.79 3.97 49.35 21.55 -7.05 47.36 19.71 -6.34 1h19_c00 source 1h19 LEUKOTRIENE A-4 HYDROLASE : 6 hits 1h19_c00 naa= 3 ULMN 3 1ig8_c00 HEXOKINASE PII user 1 3 # 1 A 158 SER A 86 SER^? -2.62 O3 GOL B 126s A 173 ARG A 90 ARG^? -3.37 O3 UNL A 200s A 211 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 22.72 76.24 0.23 24.60 76.86 -1.25 43.49 29.72 7.55 42.01 31.25 8.69 coo 18.77 77.82 11.69 20.55 80.22 10.73 34.56 36.69 3.31 35.72 36.40 0.46 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1ig8_c00 HEXOKINASE PII user 2 3 # 2 A 158 SER B 86 SER^? -3.07 O1 UNL A 200s A 173 ARG B 90 ARG^? -2.91 O2 GOL B 126s A 211 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 22.72 76.24 0.23 24.60 76.86 -1.25 38.80 31.67 1.48 40.20 33.63 1.48 coo 18.77 77.82 11.69 20.55 80.22 10.73 47.88 34.42 9.42 45.31 33.29 10.75 coo 26.87 77.59 -3.91 27.39 79.28 -2.83 32.50 34.12 -0.35 31.64 35.02 -2.06 1ig8_c00 source 1ig8 HEXOKINASE PII : 2 hits 1ig8_c00 naa= 3 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 1 3 # 1 54 ASP A 47 ASP^? 15.55 CL CL B 123 158 THR B 109 THR~? 11.58 O1 UNL A 200 317 ASP B 115 ASP.? 16.66 CL CL B 123 coo -2.63 8.40 35.07 -3.66 9.81 36.17 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -5.30 12.75 41.86 -4.34 13.05 39.99 47.32 25.04 -9.31 46.41 26.51 -8.00 coo -12.63 17.64 33.66 -10.65 17.90 34.40 40.90 20.11 -18.41 42.52 19.20 -19.45 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 2 3 # 2 54 ASP B 104 ASP~? 19.83 C2 GOL A 201 158 THR A 70 THR~? 11.53 O1 UNL A 200 317 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo -2.63 8.40 35.07 -3.66 9.81 36.17 55.81 24.74 -5.14 57.90 24.34 -5.34 coo -5.30 12.75 41.86 -4.34 13.05 39.99 45.96 23.42 -3.30 46.76 24.92 -4.64 coo -12.63 17.64 33.66 -10.65 17.90 34.40 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 3 3 # 3 54 ASP B 115 ASP.? 16.66 CL CL B 123 158 THR B 117 THR.? 9.48 CL CL B 123 317 ASP A 47 ASP^? 15.55 CL CL B 123 coo -2.63 8.40 35.07 -3.66 9.81 36.17 40.90 20.11 -18.41 42.52 19.20 -19.45 coo -5.30 12.75 41.86 -4.34 13.05 39.99 35.62 25.18 -17.07 34.59 23.37 -17.57 coo -12.63 17.64 33.66 -10.65 17.90 34.40 46.06 30.34 -15.72 47.22 29.37 -17.24 ULMN 3 1inp_c02 INOSITOL POLYPHOSPHATE 1-PHOSPHATASEuser 4 3 # 4 54 ASP B 115 ASP.? 16.66 CL CL B 123 158 THR B 118 THR.? 4.28 CL CL B 123 317 ASP A 47 ASP^? 15.55 CL CL B 123 coo -2.63 8.40 35.07 -3.66 9.81 36.17 40.90 20.11 -18.41 42.52 19.20 -19.45 coo -5.30 12.75 41.86 -4.34 13.05 39.99 34.84 27.54 -14.16 33.86 26.13 -12.78 coo -12.63 17.64 33.66 -10.65 17.90 34.40 46.06 30.34 -15.72 47.22 29.37 -17.24 1inp_c02 source 1inp INOSITOL POLYPHOSPHATE 1-PHOSPHATASE (1-PTASE): 4 hits 1inp_c02 naa= 3 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 1 3 # 1 A 55 ASP A 15 ASP~? 26.19 O1 GOL B 126 A 58 ASP A 16 ASP~? 19.78 O1 GOL B 126 A 424 GLU A 21 GLU~? 22.63 O1 UNL A 200 coo 58.42 47.76 20.67 58.01 49.10 19.12 60.61 47.40 3.28 62.48 48.35 3.41 coo 58.59 41.80 18.81 58.94 43.89 18.94 55.39 45.97 3.05 55.87 45.57 5.11 coo 52.85 46.34 13.34 54.09 44.97 14.42 55.82 46.81 -6.36 56.64 48.78 -6.25 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 2 3 # 2 A 55 ASP A 16 ASP~? 19.78 O1 GOL B 126 A 58 ASP A 15 ASP~? 26.19 O1 GOL B 126 A 424 GLU A 21 GLU~? 22.63 O1 UNL A 200 coo 58.42 47.76 20.67 58.01 49.10 19.12 55.39 45.97 3.05 55.87 45.57 5.11 coo 58.59 41.80 18.81 58.94 43.89 18.94 60.61 47.40 3.28 62.48 48.35 3.41 coo 52.85 46.34 13.34 54.09 44.97 14.42 55.82 46.81 -6.36 56.64 48.78 -6.25 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 3 3 # 3 A 55 ASP B 15 ASP~? 25.69 O9 UNL A 200 A 58 ASP B 16 ASP~? 19.71 O9 UNL A 200 A 424 GLU B 21 GLU~? 22.82 C3 GOL B 126 coo 58.42 47.76 20.67 58.01 49.10 19.12 21.08 42.76 15.13 19.15 43.54 15.67 coo 58.59 41.80 18.81 58.94 43.89 18.94 26.40 41.60 14.58 25.93 42.50 12.70 coo 52.85 46.34 13.34 54.09 44.97 14.42 25.81 36.56 22.58 24.87 38.21 23.53 ULMN 3 1js4_c00 ENDO-EXOCELLULASE E4 user 4 3 # 4 A 55 ASP B 16 ASP~? 19.71 O9 UNL A 200 A 58 ASP B 15 ASP~? 25.69 O9 UNL A 200 A 424 GLU B 21 GLU~? 22.82 C3 GOL B 126 coo 58.42 47.76 20.67 58.01 49.10 19.12 26.40 41.60 14.58 25.93 42.50 12.70 coo 58.59 41.80 18.81 58.94 43.89 18.94 21.08 42.76 15.13 19.15 43.54 15.67 coo 52.85 46.34 13.34 54.09 44.97 14.42 25.81 36.56 22.58 24.87 38.21 23.53 1js4_c00 source 1js4 ENDO-EXOCELLULASE E4 : 4 hits 1js4_c00 naa= 3 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 1 3 # 1 B 55 ASP A 15 ASP~? 26.19 O1 GOL B 126 B 58 ASP A 16 ASP~? 19.78 O1 GOL B 126 B 424 GLU A 21 GLU~? 22.63 O1 UNL A 200 coo 112.10 61.46 19.99 111.82 60.65 18.07 60.61 47.40 3.28 62.48 48.35 3.41 coo 117.85 63.62 21.08 115.96 63.25 20.18 55.39 45.97 3.05 55.87 45.57 5.11 coo 118.47 57.23 15.57 119.32 58.77 16.73 55.82 46.81 -6.36 56.64 48.78 -6.25 ULMN 3 1js4_c01 ENDO-EXOCELLULASE E4 user 2 3 # 2 B 55 ASP B 15 ASP~? 25.69 O9 UNL A 200 B 58 ASP B 16 ASP~? 19.71 O9 UNL A 200 B 424 GLU B 21 GLU~? 22.82 C3 GOL B 126 coo 112.10 61.46 19.99 111.82 60.65 18.07 21.08 42.76 15.13 19.15 43.54 15.67 coo 117.85 63.62 21.08 115.96 63.25 20.18 26.40 41.60 14.58 25.93 42.50 12.70 coo 118.47 57.23 15.57 119.32 58.77 16.73 25.81 36.56 22.58 24.87 38.21 23.53 1js4_c01 source 1js4 ENDO-EXOCELLULASE E4 : 2 hits 1js4_c01 naa= 3 ULMN 3 1k82_c02 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 C 2 GLU B 67 GLU~? 5.53 O3 GOL A 201 C 56 LYS A 113 LYS~? 7.84 CL CL A 123 C 258 ARG B 73 ARG~? -5.03 CL CL B 124s coo 43.38 -1.09 -22.48 43.25 -2.24 -24.24 40.62 21.48 11.23 42.64 22.01 11.70 coo 39.00 0.70 -15.53 38.30 -0.73 -21.58 39.46 14.20 14.59 41.86 19.61 14.55 coo 37.62 2.54 -31.11 38.78 1.93 -28.33 32.94 15.87 2.60 33.21 12.81 2.35 1k82_c02 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 1 hits 1k82_c02 naa= 3 ULMN 3 1k82_c03 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE user 1 3 # 1 D 2 GLU B 67 GLU~? 5.53 O3 GOL A 201 D 56 LYS A 113 LYS~? 7.84 CL CL A 123 D 258 ARG B 73 ARG~? -5.03 CL CL B 124s coo -2.14 0.68 -23.29 -2.02 1.93 -25.00 40.62 21.48 11.23 42.64 22.01 11.70 coo 2.02 -1.43 -16.27 3.11 0.23 -22.16 39.46 14.20 14.59 41.86 19.61 14.55 coo 4.06 -2.42 -31.79 2.79 -2.18 -28.99 32.94 15.87 2.60 33.21 12.81 2.35 1k82_c03 source 1k82 FORMAMIDOPYRIMIDINE-DNA GLYCOSYLASE : 1 hits 1k82_c03 naa= 3 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 1 3 # 1 166 ASP A 84 ASP.? -3.46 O1 GOL A 201s 169 ARG B 90 ARG^? -2.91 O2 GOL B 126s 193 HIS A 85 HIS^? 3.67 O3 GOL A 201s coo 20.88 15.91 3.60 20.25 17.72 4.50 49.74 30.72 10.50 50.57 30.42 12.42 coo 17.70 17.91 -0.80 15.74 19.74 0.84 47.88 34.42 9.42 45.31 33.29 10.75 coo 18.81 19.85 7.63 17.55 19.89 5.97 47.38 26.60 7.09 47.11 24.76 8.07 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 2 3 # 2 166 ASP B 79 ASP~? 3.97 O7 UNL A 200 169 ARG B 122 ARG.? 4.15 CL CL B 123s 193 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 20.88 15.91 3.60 20.25 17.72 4.50 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 17.70 17.91 -0.80 15.74 19.74 0.84 31.77 26.02 -8.78 30.06 27.01 -11.17 coo 18.81 19.85 7.63 17.55 19.89 5.97 35.07 28.78 -0.10 35.41 27.96 -2.01 ULMN 3 1ldm_c01 M4 LACTATE DEHYDROGENASE user 3 3 # 3 166 ASP B 84 ASP.? -3.52 O9 UNL A 200s 169 ARG A 90 ARG^? -3.37 O3 UNL A 200s 193 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 20.88 15.91 3.60 20.25 17.72 4.50 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 17.70 17.91 -0.80 15.74 19.74 0.84 34.56 36.69 3.31 35.72 36.40 0.46 coo 18.81 19.85 7.63 17.55 19.89 5.97 35.07 28.78 -0.10 35.41 27.96 -2.01 1ldm_c01 source 1ldm M4 LACTATE DEHYDROGENASE : 3 hits 1ldm_c01 naa= 3 ULMN 3 1lij_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 81 ALA~? 11.29 O1 GOL A 201 A 317 GLY A 82 GLY~? 7.92 O1 GOL A 201 A 318 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 58.12 26.30 5.80 57.53 26.81 4.51 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 56.82 27.71 9.09 56.39 27.85 8.44 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1lij_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA B 81 ALA~? 10.96 O6 UNL A 200 A 317 GLY B 82 GLY~? 8.35 O7 UNL A 200 A 318 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 144.15 17.54 -4.21 144.96 16.79 -5.26 24.43 27.45 0.43 25.05 27.08 1.79 coo 145.79 20.97 -4.38 145.13 20.72 -3.93 25.71 30.64 -1.30 26.07 30.37 -0.67 coo 141.70 22.54 -2.23 141.09 23.62 -3.92 29.26 26.18 -3.96 31.36 26.46 -4.14 1lij_c01 source 1lij ADENOSINE KINASE : 2 hits 1lij_c01 naa= 3 ULMN 3 1lio_c01 ADENOSINE KINASE user 1 3 # 1 A 316 ALA A 81 ALA~? 11.29 O1 GOL A 201 A 317 GLY A 82 GLY~? 7.92 O1 GOL A 201 A 318 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 27.04 23.54 41.85 25.72 24.19 42.18 58.12 26.30 5.80 57.53 26.81 4.51 coo 27.87 23.16 38.17 28.43 22.97 38.87 56.82 27.71 9.09 56.39 27.85 8.44 coo 32.11 22.71 40.58 33.42 24.22 39.78 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1lio_c01 ADENOSINE KINASE user 2 3 # 2 A 316 ALA B 81 ALA~? 10.96 O6 UNL A 200 A 317 GLY B 82 GLY~? 8.35 O7 UNL A 200 A 318 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 27.04 23.54 41.85 25.72 24.19 42.18 24.43 27.45 0.43 25.05 27.08 1.79 coo 27.87 23.16 38.17 28.43 22.97 38.87 25.71 30.64 -1.30 26.07 30.37 -0.67 coo 32.11 22.71 40.58 33.42 24.22 39.78 29.26 26.18 -3.96 31.36 26.46 -4.14 1lio_c01 source 1lio ADENOSINE KINASE : 2 hits 1lio_c01 naa= 3 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 47 ASP^? 15.55 CL CL B 123 A 265 GLU B 99 GLU~? 20.37 O1 UNL A 200 A 369 ASP B 111 ASP~? 19.61 CL CL B 123 coo 11.74 38.14 80.19 10.63 36.40 80.65 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 17.36 23.57 72.04 18.68 21.92 71.98 59.74 34.86 -3.51 60.17 36.42 -4.90 coo 12.19 31.08 87.29 11.13 32.66 86.38 49.48 21.08 -13.06 49.20 19.08 -13.70 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 79 ASP~? 6.09 O1 GOL A 201 A 265 GLU A 67 GLU~? 5.52 O4 UNL A 200 A 369 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 11.74 38.14 80.19 10.63 36.40 80.65 53.25 22.44 8.57 51.13 22.57 8.85 coo 17.36 23.57 72.04 18.68 21.92 71.98 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 12.19 31.08 87.29 11.13 32.66 86.38 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP A 79 ASP~? 6.09 O1 GOL A 201 A 265 GLU B 99 GLU~? 20.37 O1 UNL A 200 A 369 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 11.74 38.14 80.19 10.63 36.40 80.65 53.25 22.44 8.57 51.13 22.57 8.85 coo 17.36 23.57 72.04 18.68 21.92 71.98 59.74 34.86 -3.51 60.17 36.42 -4.90 coo 12.19 31.08 87.29 11.13 32.66 86.38 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 4 3 # 4 A 241 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 265 GLU A 67 GLU~? 5.52 O4 UNL A 200 A 369 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 49.74 30.72 10.50 50.57 30.42 12.42 coo 17.36 23.57 72.04 18.68 21.92 71.98 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 12.19 31.08 87.29 11.13 32.66 86.38 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 5 3 # 5 A 241 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 265 GLU B 99 GLU~? 20.37 O1 UNL A 200 A 369 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 11.74 38.14 80.19 10.63 36.40 80.65 49.74 30.72 10.50 50.57 30.42 12.42 coo 17.36 23.57 72.04 18.68 21.92 71.98 59.74 34.86 -3.51 60.17 36.42 -4.90 coo 12.19 31.08 87.29 11.13 32.66 86.38 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 6 3 # 6 A 241 ASP A 111 ASP~? 10.94 CL CL B 124 A 265 GLU B 37 GLU^? 6.72 O2 GOL B 125 A 369 ASP A 115 ASP.? 16.41 CL CL A 123 coo 11.74 38.14 80.19 10.63 36.40 80.65 33.22 12.10 12.41 33.55 10.10 11.76 coo 17.36 23.57 72.04 18.68 21.92 71.98 39.03 25.88 24.92 40.77 24.72 25.06 coo 12.19 31.08 87.29 11.13 32.66 86.38 42.06 8.77 16.59 40.52 7.32 16.97 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 7 3 # 7 A 241 ASP A 115 ASP.? 16.41 CL CL A 123 A 265 GLU B 37 GLU^? 6.72 O2 GOL B 125 A 369 ASP A 111 ASP~? 10.94 CL CL B 124 coo 11.74 38.14 80.19 10.63 36.40 80.65 42.06 8.77 16.59 40.52 7.32 16.97 coo 17.36 23.57 72.04 18.68 21.92 71.98 39.03 25.88 24.92 40.77 24.72 25.06 coo 12.19 31.08 87.29 11.13 32.66 86.38 33.22 12.10 12.41 33.55 10.10 11.76 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 8 3 # 8 A 241 ASP B 47 ASP^? 15.68 CL CL A 123 A 265 GLU A 99 GLU~? 18.98 CL CL B 124 A 369 ASP A 111 ASP~? 10.94 CL CL B 124 coo 11.74 38.14 80.19 10.63 36.40 80.65 36.24 17.92 20.25 35.18 16.23 20.89 coo 17.36 23.57 72.04 18.68 21.92 71.98 22.47 28.68 12.84 21.91 29.15 14.84 coo 12.19 31.08 87.29 11.13 32.66 86.38 33.22 12.10 12.41 33.55 10.10 11.76 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 9 3 # 9 A 241 ASP B 79 ASP~? 3.97 O7 UNL A 200 A 265 GLU A 99 GLU~? 18.98 CL CL B 124 A 369 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 11.74 38.14 80.19 10.63 36.40 80.65 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 17.36 23.57 72.04 18.68 21.92 71.98 22.47 28.68 12.84 21.91 29.15 14.84 coo 12.19 31.08 87.29 11.13 32.66 86.38 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 10 3 # 10 A 241 ASP B 79 ASP~? 3.97 O7 UNL A 200 A 265 GLU B 67 GLU~? 5.53 O3 GOL A 201 A 369 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 11.74 38.14 80.19 10.63 36.40 80.65 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 17.36 23.57 72.04 18.68 21.92 71.98 40.62 21.48 11.23 42.64 22.01 11.70 coo 12.19 31.08 87.29 11.13 32.66 86.38 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 11 3 # 11 A 241 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 265 GLU A 99 GLU~? 18.98 CL CL B 124 A 369 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 11.74 38.14 80.19 10.63 36.40 80.65 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 17.36 23.57 72.04 18.68 21.92 71.98 22.47 28.68 12.84 21.91 29.15 14.84 coo 12.19 31.08 87.29 11.13 32.66 86.38 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 12 3 # 12 A 241 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 265 GLU B 67 GLU~? 5.53 O3 GOL A 201 A 369 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 11.74 38.14 80.19 10.63 36.40 80.65 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 17.36 23.57 72.04 18.68 21.92 71.98 40.62 21.48 11.23 42.64 22.01 11.70 coo 12.19 31.08 87.29 11.13 32.66 86.38 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1m53_c05 ISOMALTULOSE SYNTHASE user 13 3 # 13 A 241 ASP B 111 ASP~? 19.61 CL CL B 123 A 265 GLU A 37 GLU^? 12.49 O10 UNL A 200 A 369 ASP B 115 ASP.? 16.66 CL CL B 123 coo 11.74 38.14 80.19 10.63 36.40 80.65 49.48 21.08 -13.06 49.20 19.08 -13.70 coo 17.36 23.57 72.04 18.68 21.92 71.98 42.91 39.28 -14.45 41.15 38.40 -15.23 coo 12.19 31.08 87.29 11.13 32.66 86.38 40.90 20.11 -18.41 42.52 19.20 -19.45 1m53_c05 source 1m53 ISOMALTULOSE SYNTHASE : 13 hits 1m53_c05 naa= 3 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 1 3 # 1 A 241 ASP A 47 ASP^? 15.55 CL CL B 123 A 279 GLU B 99 GLU~? 20.37 O1 UNL A 200 A 369 ASP B 115 ASP.? 16.66 CL CL B 123 coo 11.74 38.14 80.19 10.63 36.40 80.65 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 16.54 46.37 63.94 14.77 45.79 62.95 59.74 34.86 -3.51 60.17 36.42 -4.90 coo 12.19 31.08 87.29 11.13 32.66 86.38 40.90 20.11 -18.41 42.52 19.20 -19.45 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 2 3 # 2 A 241 ASP A 111 ASP~? 10.94 CL CL B 124 A 279 GLU A 99 GLU~? 18.98 CL CL B 124 A 369 ASP A 115 ASP.? 16.41 CL CL A 123 coo 11.74 38.14 80.19 10.63 36.40 80.65 33.22 12.10 12.41 33.55 10.10 11.76 coo 16.54 46.37 63.94 14.77 45.79 62.95 22.47 28.68 12.84 21.91 29.15 14.84 coo 12.19 31.08 87.29 11.13 32.66 86.38 42.06 8.77 16.59 40.52 7.32 16.97 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 3 3 # 3 A 241 ASP B 47 ASP^? 15.68 CL CL A 123 A 279 GLU A 99 GLU~? 18.98 CL CL B 124 A 369 ASP A 115 ASP.? 16.41 CL CL A 123 coo 11.74 38.14 80.19 10.63 36.40 80.65 36.24 17.92 20.25 35.18 16.23 20.89 coo 16.54 46.37 63.94 14.77 45.79 62.95 22.47 28.68 12.84 21.91 29.15 14.84 coo 12.19 31.08 87.29 11.13 32.66 86.38 42.06 8.77 16.59 40.52 7.32 16.97 ULMN 3 1m53_c06 ISOMALTULOSE SYNTHASE user 4 3 # 4 A 241 ASP B 111 ASP~? 19.61 CL CL B 123 A 279 GLU B 99 GLU~? 20.37 O1 UNL A 200 A 369 ASP B 115 ASP.? 16.66 CL CL B 123 coo 11.74 38.14 80.19 10.63 36.40 80.65 49.48 21.08 -13.06 49.20 19.08 -13.70 coo 16.54 46.37 63.94 14.77 45.79 62.95 59.74 34.86 -3.51 60.17 36.42 -4.90 coo 12.19 31.08 87.29 11.13 32.66 86.38 40.90 20.11 -18.41 42.52 19.20 -19.45 1m53_c06 source 1m53 ISOMALTULOSE SYNTHASE : 4 hits 1m53_c06 naa= 3 ULMN 3 1mbb_c00 URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYuser 1 3 # 1 159 ARG B 10 ARG.? 11.05 O1 GOL B 125 229 SER B 3 SER~? 12.12 O1 GOL B 125 325 GLU B 6 GLU~? 12.54 O1 GOL B 125 coo 2.54 15.84 18.57 3.24 17.85 16.30 38.06 41.77 18.55 40.34 40.33 20.11 coo 10.17 13.48 15.92 9.61 15.76 15.27 40.00 38.05 26.27 38.94 39.87 27.47 coo 5.42 13.04 19.75 5.74 13.81 17.79 39.33 43.17 24.20 41.41 43.06 24.69 1mbb_c00 source 1mbb URIDINE DIPHOSPHO-N-ACETYLENOLPYRUVYLGLUCOSAMI: 1 hits 1mbb_c00 naa= 3 ULMN 3 1mla_c00 MALONYL-COENZYME A ACYL CARRIER PROTuser 1 3 # 1 92 SER A 86 SER^? -2.62 O3 GOL B 126s 201 HIS A 85 HIS^? 3.67 O3 GOL A 201s 250 GLN A 87 GLN^? 4.75 O3 GOL A 201 coo 38.34 0.72 11.82 37.33 1.15 14.05 43.49 29.72 7.55 42.01 31.25 8.69 coo 37.34 -2.58 17.29 36.94 -1.26 15.79 47.38 26.60 7.09 47.11 24.76 8.07 coo 35.50 -3.51 11.88 35.27 -1.49 11.17 41.69 26.32 5.03 43.09 26.04 6.63 ULMN 3 1mla_c00 MALONYL-COENZYME A ACYL CARRIER PROTuser 2 3 # 2 92 SER B 86 SER^? -3.07 O1 UNL A 200s 201 HIS B 85 HIS^? -3.53 O6 UNL A 200s 250 GLN B 87 GLN^? 5.19 O4 UNL A 200 coo 38.34 0.72 11.82 37.33 1.15 14.05 38.80 31.67 1.48 40.20 33.63 1.48 coo 37.34 -2.58 17.29 36.94 -1.26 15.79 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 35.50 -3.51 11.88 35.27 -1.49 11.17 40.79 27.52 1.41 39.40 28.24 -0.01 1mla_c00 source 1mla MALONYL-COENZYME A ACYL CARRIER PROTEIN TRANSA: 2 hits 1mla_c00 naa= 3 ULMN 3 1mpy_c00 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 A 199 HIS A 94 HIS.? 16.90 O9 UNL A 200 A 246 HIS B 61 HIS^? 10.01 O3 UNL A 200 A 255 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 93.73 21.39 -6.05 92.24 22.72 -5.44 23.42 43.43 6.45 23.95 45.16 7.52 coo 85.83 25.80 -8.70 86.18 27.15 -7.14 32.69 38.40 6.72 34.73 38.60 6.25 coo 84.84 30.41 -2.58 86.81 29.07 -4.09 27.45 31.12 3.14 25.07 31.24 4.61 1mpy_c00 source 1mpy CATECHOL 2,3-DIOXYGENASE : 1 hits 1mpy_c00 naa= 3 ULMN 3 1mpy_c01 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 B 199 HIS A 94 HIS.? 16.90 O9 UNL A 200 B 246 HIS B 61 HIS^? 10.01 O3 UNL A 200 B 255 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 53.99 30.51 -6.27 55.94 30.59 -7.04 23.42 43.43 6.45 23.95 45.16 7.52 coo 63.25 31.40 -4.63 63.50 32.04 -6.62 32.69 38.40 6.72 34.73 38.60 6.25 coo 65.74 33.16 -11.89 63.54 33.33 -10.19 27.45 31.12 3.14 25.07 31.24 4.61 ULMN 3 1mpy_c01 CATECHOL 2,3-DIOXYGENASE user 2 3 # 2 B 199 HIS B 94 HIS.? 18.31 O1 GOL B 126 B 246 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 255 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 53.99 30.51 -6.27 55.94 30.59 -7.04 58.52 42.74 10.71 57.93 44.74 10.95 coo 63.25 31.40 -4.63 63.50 32.04 -6.62 49.34 38.44 7.48 47.30 38.27 7.99 coo 65.74 33.16 -11.89 63.54 33.33 -10.19 54.83 30.60 5.85 57.08 31.79 4.69 1mpy_c01 source 1mpy CATECHOL 2,3-DIOXYGENASE : 2 hits 1mpy_c01 naa= 3 ULMN 3 1mpy_c02 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 C 199 HIS A 94 HIS.? 16.90 O9 UNL A 200 C 246 HIS B 61 HIS^? 10.01 O3 UNL A 200 C 255 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 88.23 -2.44 -2.31 86.28 -2.49 -3.06 23.42 43.43 6.45 23.95 45.16 7.52 coo 79.18 -3.01 0.51 78.86 -4.28 -1.13 32.69 38.40 6.72 34.73 38.60 6.25 coo 76.37 -6.84 -5.95 78.54 -6.39 -4.23 27.45 31.12 3.14 25.07 31.24 4.61 ULMN 3 1mpy_c02 CATECHOL 2,3-DIOXYGENASE user 2 3 # 2 C 199 HIS B 94 HIS.? 18.31 O1 GOL B 126 C 246 HIS A 61 HIS^? 9.47 O2 GOL B 126 C 255 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 88.23 -2.44 -2.31 86.28 -2.49 -3.06 58.52 42.74 10.71 57.93 44.74 10.95 coo 79.18 -3.01 0.51 78.86 -4.28 -1.13 49.34 38.44 7.48 47.30 38.27 7.99 coo 76.37 -6.84 -5.95 78.54 -6.39 -4.23 54.83 30.60 5.85 57.08 31.79 4.69 1mpy_c02 source 1mpy CATECHOL 2,3-DIOXYGENASE : 2 hits 1mpy_c02 naa= 3 ULMN 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 1 3 # 1 D 199 HIS A 94 HIS.? 16.90 O9 UNL A 200 D 246 HIS B 61 HIS^? 10.01 O3 UNL A 200 D 255 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 48.45 6.59 -2.19 50.13 5.63 -1.41 23.42 43.43 6.45 23.95 45.16 7.52 coo 56.33 1.43 -3.93 56.30 0.87 -1.91 32.69 38.40 6.72 34.73 38.60 6.25 coo 57.78 -0.98 3.43 55.81 -0.18 1.59 27.45 31.12 3.14 25.07 31.24 4.61 ULMN 3 1mpy_c03 CATECHOL 2,3-DIOXYGENASE user 2 3 # 2 D 199 HIS B 94 HIS.? 18.31 O1 GOL B 126 D 246 HIS A 61 HIS^? 9.47 O2 GOL B 126 D 255 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 48.45 6.59 -2.19 50.13 5.63 -1.41 58.52 42.74 10.71 57.93 44.74 10.95 coo 56.33 1.43 -3.93 56.30 0.87 -1.91 49.34 38.44 7.48 47.30 38.27 7.99 coo 57.78 -0.98 3.43 55.81 -0.18 1.59 54.83 30.60 5.85 57.08 31.79 4.69 1mpy_c03 source 1mpy CATECHOL 2,3-DIOXYGENASE : 2 hits 1mpy_c03 naa= 3 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 A 114 HIS A 48 HIS.? 12.89 CL CL B 123 A 197 ASP B 115 ASP.? 16.66 CL CL B 123 A 223 ALA B 107 ALA~? 18.72 O1 UNL A 200 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 43.31 28.55 -18.97 43.37 26.94 -17.63 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 40.90 20.11 -18.41 42.52 19.20 -19.45 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 52.64 25.48 -10.62 54.03 24.92 -10.48 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 A 114 HIS A 61 HIS^? 9.47 O2 GOL B 126 A 197 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 223 ALA A 65 ALA^? -3.44 O1 UNL A 200s coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 49.34 38.44 7.48 47.30 38.27 7.99 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 49.74 30.72 10.50 50.57 30.42 12.42 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 44.85 33.10 -1.28 43.67 34.00 -1.64 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 # 3 A 114 HIS A 94 HIS.? 16.90 O9 UNL A 200 A 197 ASP B 16 ASP~? 19.71 O9 UNL A 200 A 223 ALA B 63 ALA^? 8.12 O3 GOL B 126 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 23.42 43.43 6.45 23.95 45.16 7.52 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 26.40 41.60 14.58 25.93 42.50 12.70 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 34.41 34.45 9.56 35.85 35.01 9.44 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 4 3 # 4 A 114 HIS B 48 HIS.? 12.72 CL CL A 123 A 197 ASP A 115 ASP.? 16.41 CL CL A 123 A 223 ALA A 107 ALA~? 9.29 CL CL B 124 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 39.28 14.76 21.81 39.53 14.41 19.75 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 42.06 8.77 16.59 40.52 7.32 16.97 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 29.93 17.06 13.11 28.49 16.67 12.69 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 5 3 # 5 A 114 HIS B 61 HIS^? 10.01 O3 UNL A 200 A 197 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 223 ALA B 65 ALA^? -3.35 O3 GOL B 126s coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 32.69 38.40 6.72 34.73 38.60 6.25 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 37.43 29.00 10.49 38.53 29.52 11.40 ULMN 3 1n2t_c02 L-CYSTEINE-CYSTINE LYASE C-DES user 6 3 # 6 A 114 HIS B 94 HIS.? 18.31 O1 GOL B 126 A 197 ASP A 16 ASP~? 19.78 O1 GOL B 126 A 223 ALA A 63 ALA^? 8.44 O1 UNL A 200 coo -61.68 -8.94 -28.01 -61.87 -7.73 -26.31 58.52 42.74 10.71 57.93 44.74 10.95 coo -57.09 -14.53 -30.28 -57.60 -13.32 -28.61 55.39 45.97 3.05 55.87 45.57 5.11 coo -56.49 -13.76 -16.93 -57.17 -13.93 -18.30 47.70 37.03 2.81 46.25 37.43 3.18 1n2t_c02 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 6 hits 1n2t_c02 naa= 3 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 1 3 # 1 B 114 HIS A 48 HIS.? 12.89 CL CL B 123 B 197 ASP B 115 ASP.? 16.66 CL CL B 123 B 223 ALA B 107 ALA~? 18.72 O1 UNL A 200 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 43.31 28.55 -18.97 43.37 26.94 -17.63 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 40.90 20.11 -18.41 42.52 19.20 -19.45 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 52.64 25.48 -10.62 54.03 24.92 -10.48 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 2 3 # 2 B 114 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 197 ASP A 84 ASP.? -3.46 O1 GOL A 201s B 223 ALA A 65 ALA^? -3.44 O1 UNL A 200s coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 49.34 38.44 7.48 47.30 38.27 7.99 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 49.74 30.72 10.50 50.57 30.42 12.42 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 44.85 33.10 -1.28 43.67 34.00 -1.64 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 3 3 # 3 B 114 HIS A 94 HIS.? 16.90 O9 UNL A 200 B 197 ASP B 16 ASP~? 19.71 O9 UNL A 200 B 223 ALA B 63 ALA^? 8.12 O3 GOL B 126 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 23.42 43.43 6.45 23.95 45.16 7.52 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 26.40 41.60 14.58 25.93 42.50 12.70 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 34.41 34.45 9.56 35.85 35.01 9.44 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 4 3 # 4 B 114 HIS B 48 HIS.? 12.72 CL CL A 123 B 197 ASP A 115 ASP.? 16.41 CL CL A 123 B 223 ALA A 107 ALA~? 9.29 CL CL B 124 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 39.28 14.76 21.81 39.53 14.41 19.75 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 42.06 8.77 16.59 40.52 7.32 16.97 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 29.93 17.06 13.11 28.49 16.67 12.69 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 5 3 # 5 B 114 HIS B 61 HIS^? 10.01 O3 UNL A 200 B 197 ASP B 84 ASP.? -3.52 O9 UNL A 200s B 223 ALA B 65 ALA^? -3.35 O3 GOL B 126s coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 32.69 38.40 6.72 34.73 38.60 6.25 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 37.43 29.00 10.49 38.53 29.52 11.40 ULMN 3 1n2t_c03 L-CYSTEINE-CYSTINE LYASE C-DES user 6 3 # 6 B 114 HIS B 94 HIS.? 18.31 O1 GOL B 126 B 197 ASP A 16 ASP~? 19.78 O1 GOL B 126 B 223 ALA A 63 ALA^? 8.44 O1 UNL A 200 coo -32.24 6.73 -26.90 -32.01 5.24 -25.44 58.52 42.74 10.71 57.93 44.74 10.95 coo -36.83 12.62 -28.19 -36.31 11.10 -26.78 55.39 45.97 3.05 55.87 45.57 5.11 coo -37.23 9.70 -15.15 -36.60 10.10 -16.48 47.70 37.03 2.81 46.25 37.43 3.18 1n2t_c03 source 1n2t L-CYSTEINE-CYSTINE LYASE C-DES : 6 hits 1n2t_c03 naa= 3 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 1 3 # 1 A 62 SER A 22 SER~? 23.06 O1 UNL A 200 A 154 ASP A 15 ASP~? 26.19 O1 GOL B 126 A 261 ARG A 19 ARG~? 17.61 O2 GOL A 201 coo 16.10 74.10 3.11 17.18 73.52 5.20 59.17 41.83 -6.71 61.08 42.87 -5.70 coo 16.07 84.71 8.14 15.20 82.81 8.14 60.61 47.40 3.28 62.48 48.35 3.41 coo 10.59 77.85 4.81 13.09 76.36 5.76 57.40 40.38 1.34 58.96 39.38 3.77 ULMN 3 1o98_c00 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT user 2 3 # 2 A 62 SER B 22 SER~? 23.16 O3 GOL B 126 A 154 ASP B 15 ASP~? 25.69 O9 UNL A 200 A 261 ARG B 19 ARG~? 17.69 O8 UNL A 200 coo 16.10 74.10 3.11 17.18 73.52 5.20 22.70 32.34 19.73 20.75 33.76 19.49 coo 16.07 84.71 8.14 15.20 82.81 8.14 21.08 42.76 15.13 19.15 43.54 15.67 coo 10.59 77.85 4.81 13.09 76.36 5.76 24.49 36.14 12.47 22.88 36.56 9.90 1o98_c00 source 1o98 2,3-BISPHOSPHOGLYCERATE-INDEPENDENT PHOSPHOGLY: 2 hits 1o98_c00 naa= 3 ULMN 3 1oyg_c00 LEVANSUCRASE user 1 3 # 1 A 86 ASP A 104 ASP~? 7.36 CL CL B 124 A 247 ASP A 98 ASP~? 12.55 CL CL B 124 A 342 GLU A 99 GLU~? 18.98 CL CL B 124 coo 44.36 35.68 9.71 43.29 36.20 11.51 26.83 19.68 8.21 24.75 19.17 8.13 coo 41.40 28.81 12.91 40.82 30.90 12.97 23.35 28.15 6.47 22.62 26.21 5.89 coo 40.37 33.11 18.06 39.99 34.93 17.06 22.47 28.68 12.84 21.91 29.15 14.84 ULMN 3 1oyg_c00 LEVANSUCRASE user 2 3 # 2 A 86 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 247 ASP B 98 ASP~? 15.88 O1 GOL A 201 A 342 GLU B 99 GLU~? 20.37 O1 UNL A 200 coo 44.36 35.68 9.71 43.29 36.20 11.51 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 41.40 28.81 12.91 40.82 30.90 12.97 59.21 30.58 1.37 59.85 28.74 0.55 coo 40.37 33.11 18.06 39.99 34.93 17.06 59.74 34.86 -3.51 60.17 36.42 -4.90 1oyg_c00 source 1oyg LEVANSUCRASE : 2 hits 1oyg_c00 naa= 3 ULMN 3 1p1x_c00 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 1 3 # 1 A 102 ASP B 47 ASP^? 15.68 CL CL A 123 A 167 LYS A 113 LYS~? 7.84 CL CL A 123 A 201 LYS A 114 LYS.? 14.28 CL CL B 124 coo 26.53 8.31 20.37 28.45 8.41 19.40 36.24 17.92 20.25 35.18 16.23 20.89 coo 24.92 6.08 13.38 27.75 4.33 18.83 39.46 14.20 14.59 41.86 19.61 14.55 coo 29.08 5.53 11.69 30.46 5.61 17.93 38.24 11.42 16.94 34.01 7.82 14.29 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 B 47 ASP^? 15.68 CL CL A 123 B1167 LYS A 113 LYS~? 7.84 CL CL A 123 B1201 LYS A 114 LYS.? 14.28 CL CL B 124 coo 26.10 12.11 49.61 24.19 12.48 50.51 36.24 17.92 20.25 35.18 16.23 20.89 coo 27.70 11.69 56.92 24.82 8.55 52.12 39.46 14.20 14.59 41.86 19.61 14.55 coo 23.50 11.64 58.67 22.19 10.19 52.59 38.24 11.42 16.94 34.01 7.82 14.29 ULMN 3 1p1x_c01 DEOXYRIBOSE-PHOSPHATE ALDOLASE user 2 3 # 2 B1102 ASP B 47 ASP^? 15.68 CL CL A 123 B1167 LYS A 114 LYS.? 14.28 CL CL B 124 B1201 LYS A 113 LYS~? 7.84 CL CL A 123 coo 26.10 12.11 49.61 24.19 12.48 50.51 36.24 17.92 20.25 35.18 16.23 20.89 coo 27.70 11.69 56.92 24.82 8.55 52.12 38.24 11.42 16.94 34.01 7.82 14.29 coo 23.50 11.64 58.67 22.19 10.19 52.59 39.46 14.20 14.59 41.86 19.61 14.55 1p1x_c01 source 1p1x DEOXYRIBOSE-PHOSPHATE ALDOLASE : 2 hits 1p1x_c01 naa= 3 ULMN 3 1p7m_c00 DNA-3-METHYLADENINE GLYCOSYLASE I user 1 3 # 1 A 16 TYR B 8 TYR~? 16.62 O1 GOL B 125 A 38 GLU B 6 GLU~? 12.54 O1 GOL B 125 A 46 TRP B 7 TRP~? 11.66 O2 GOL B 126 coo 141.05 24.62 -1.85 142.62 22.60 -2.97 31.46 38.27 23.11 30.63 35.63 23.45 coo 142.20 14.40 -6.46 142.04 16.49 -6.62 39.33 43.17 24.20 41.41 43.06 24.69 coo 137.32 22.45 -5.52 140.17 20.39 -3.63 37.31 37.65 18.91 33.65 36.20 18.53 1p7m_c00 source 1p7m DNA-3-METHYLADENINE GLYCOSYLASE I : 1 hits 1p7m_c00 naa= 3 ULMN 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 # 1 A 630 SER A 58 SER.? 11.73 O2 GOL B 126 A 709 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 740 HIS A 61 HIS^? 9.47 O2 GOL B 126 coo -7.09 7.44 6.22 -7.53 5.14 5.59 47.20 43.37 6.46 47.90 41.49 7.82 coo -6.04 -3.54 13.59 -7.99 -3.21 12.73 49.74 30.72 10.50 50.57 30.42 12.42 coo -8.70 2.86 9.96 -8.03 3.92 8.29 49.34 38.44 7.48 47.30 38.27 7.99 ULMN 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 2 3 # 2 A 630 SER A 86 SER^? -2.62 O3 GOL B 126s A 709 ASP A 79 ASP~? 6.09 O1 GOL A 201 A 740 HIS A 85 HIS^? 3.67 O3 GOL A 201s coo -7.09 7.44 6.22 -7.53 5.14 5.59 43.49 29.72 7.55 42.01 31.25 8.69 coo -6.04 -3.54 13.59 -7.99 -3.21 12.73 53.25 22.44 8.57 51.13 22.57 8.85 coo -8.70 2.86 9.96 -8.03 3.92 8.29 47.38 26.60 7.09 47.11 24.76 8.07 ULMN 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 3 3 # 3 A 630 SER B 58 SER.? 12.59 O3 UNL A 200 A 709 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 740 HIS B 61 HIS^? 10.01 O3 UNL A 200 coo -7.09 7.44 6.22 -7.53 5.14 5.59 34.66 41.80 10.52 34.18 41.01 8.30 coo -6.04 -3.54 13.59 -7.99 -3.21 12.73 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -8.70 2.86 9.96 -8.03 3.92 8.29 32.69 38.40 6.72 34.73 38.60 6.25 ULMN 3 1pfq_c02 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 4 3 # 4 A 630 SER B 86 SER^? -3.07 O1 UNL A 200s A 709 ASP B 79 ASP~? 3.97 O7 UNL A 200 A 740 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo -7.09 7.44 6.22 -7.53 5.14 5.59 38.80 31.67 1.48 40.20 33.63 1.48 coo -6.04 -3.54 13.59 -7.99 -3.21 12.73 29.26 26.18 -3.96 31.36 26.46 -4.14 coo -8.70 2.86 9.96 -8.03 3.92 8.29 35.07 28.78 -0.10 35.41 27.96 -2.01 1pfq_c02 source 1pfq DIPEPTIDYL PEPTIDASE IV SOLUBLE FORM : 4 hits 1pfq_c02 naa= 3 ULMN 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 1 3 # 1 B 630 SER A 58 SER.? 11.73 O2 GOL B 126 B 709 ASP A 84 ASP.? -3.46 O1 GOL A 201s B 740 HIS A 61 HIS^? 9.47 O2 GOL B 126 coo 4.44 13.29 37.64 6.01 11.66 38.49 47.20 43.37 6.46 47.90 41.49 7.82 coo 10.26 2.81 31.69 11.64 4.30 32.43 49.74 30.72 10.50 50.57 30.42 12.42 coo 8.57 10.09 34.47 7.10 10.73 35.82 49.34 38.44 7.48 47.30 38.27 7.99 ULMN 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 2 3 # 2 B 630 SER A 86 SER^? -2.62 O3 GOL B 126s B 709 ASP A 79 ASP~? 6.09 O1 GOL A 201 B 740 HIS A 85 HIS^? 3.67 O3 GOL A 201s coo 4.44 13.29 37.64 6.01 11.66 38.49 43.49 29.72 7.55 42.01 31.25 8.69 coo 10.26 2.81 31.69 11.64 4.30 32.43 53.25 22.44 8.57 51.13 22.57 8.85 coo 8.57 10.09 34.47 7.10 10.73 35.82 47.38 26.60 7.09 47.11 24.76 8.07 ULMN 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 3 3 # 3 B 630 SER B 58 SER.? 12.59 O3 UNL A 200 B 709 ASP B 84 ASP.? -3.52 O9 UNL A 200s B 740 HIS B 61 HIS^? 10.01 O3 UNL A 200 coo 4.44 13.29 37.64 6.01 11.66 38.49 34.66 41.80 10.52 34.18 41.01 8.30 coo 10.26 2.81 31.69 11.64 4.30 32.43 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 8.57 10.09 34.47 7.10 10.73 35.82 32.69 38.40 6.72 34.73 38.60 6.25 ULMN 3 1pfq_c03 DIPEPTIDYL PEPTIDASE IV SOLUBLE FORMuser 4 3 # 4 B 630 SER B 86 SER^? -3.07 O1 UNL A 200s B 709 ASP B 79 ASP~? 3.97 O7 UNL A 200 B 740 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 4.44 13.29 37.64 6.01 11.66 38.49 38.80 31.67 1.48 40.20 33.63 1.48 coo 10.26 2.81 31.69 11.64 4.30 32.43 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 8.57 10.09 34.47 7.10 10.73 35.82 35.07 28.78 -0.10 35.41 27.96 -2.01 1pfq_c03 source 1pfq DIPEPTIDYL PEPTIDASE IV SOLUBLE FORM : 4 hits 1pfq_c03 naa= 3 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 A 70 ALA A 25 ALA~? 21.90 O1 UNL A 200 A 126 LEU A 23 LEU~? 16.15 O1 UNL A 200 A 158 GLU B 99 GLU~? 20.37 O1 UNL A 200 coo -2.29 37.66 144.73 -1.46 37.12 145.87 57.35 40.51 -11.23 58.41 41.55 -11.10 coo -4.62 32.83 147.14 -5.50 32.85 149.12 56.03 38.69 -4.81 55.29 36.78 -4.10 coo -0.83 29.57 149.77 -0.39 31.47 148.95 59.74 34.86 -3.51 60.17 36.42 -4.90 ULMN 3 1pjh_c00 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 A 70 ALA B 25 ALA~? 22.05 C3 GOL B 126 A 126 LEU B 23 LEU~? 16.10 O3 GOL B 126 A 158 GLU A 99 GLU~? 18.98 CL CL B 124 coo -2.29 37.66 144.73 -1.46 37.12 145.87 24.55 28.48 22.44 23.39 29.41 22.96 coo -4.62 32.83 147.14 -5.50 32.85 149.12 25.99 31.08 16.32 26.95 29.92 14.78 coo -0.83 29.57 149.77 -0.39 31.47 148.95 22.47 28.68 12.84 21.91 29.15 14.84 1pjh_c00 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 2 hits 1pjh_c00 naa= 3 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 B 70 ALA A 25 ALA~? 21.90 O1 UNL A 200 B 126 LEU A 23 LEU~? 16.15 O1 UNL A 200 B 158 GLU B 99 GLU~? 20.37 O1 UNL A 200 coo -39.79 4.61 147.27 -39.61 5.56 148.47 57.35 40.51 -11.23 58.41 41.55 -11.10 coo -34.22 5.06 149.25 -33.65 4.24 151.15 56.03 38.69 -4.81 55.29 36.78 -4.10 coo -33.03 9.93 151.71 -34.98 9.38 151.11 59.74 34.86 -3.51 60.17 36.42 -4.90 ULMN 3 1pjh_c01 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 B 70 ALA B 25 ALA~? 22.05 C3 GOL B 126 B 126 LEU B 23 LEU~? 16.10 O3 GOL B 126 B 158 GLU A 99 GLU~? 18.98 CL CL B 124 coo -39.79 4.61 147.27 -39.61 5.56 148.47 24.55 28.48 22.44 23.39 29.41 22.96 coo -34.22 5.06 149.25 -33.65 4.24 151.15 25.99 31.08 16.32 26.95 29.92 14.78 coo -33.03 9.93 151.71 -34.98 9.38 151.11 22.47 28.68 12.84 21.91 29.15 14.84 1pjh_c01 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 2 hits 1pjh_c01 naa= 3 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 1 3 # 1 C 70 ALA A 25 ALA~? 21.90 O1 UNL A 200 C 126 LEU A 23 LEU~? 16.15 O1 UNL A 200 C 158 GLU B 99 GLU~? 20.37 O1 UNL A 200 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 57.35 40.51 -11.23 58.41 41.55 -11.10 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 56.03 38.69 -4.81 55.29 36.78 -4.10 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 59.74 34.86 -3.51 60.17 36.42 -4.90 ULMN 3 1pjh_c02 ENOYL-COA ISOMERASE; ECI1P user 2 3 # 2 C 70 ALA B 25 ALA~? 22.05 C3 GOL B 126 C 126 LEU B 23 LEU~? 16.10 O3 GOL B 126 C 158 GLU A 99 GLU~? 18.98 CL CL B 124 coo 7.77 -11.41 146.15 6.88 -11.77 147.32 24.55 28.48 22.44 23.39 29.41 22.96 coo 4.88 -6.81 148.13 5.33 -5.89 150.06 25.99 31.08 16.32 26.95 29.92 14.78 coo 0.03 -8.25 150.96 1.55 -9.64 150.41 22.47 28.68 12.84 21.91 29.15 14.84 1pjh_c02 source 1pjh ENOYL-COA ISOMERASE; ECI1P : 2 hits 1pjh_c02 naa= 3 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 1 3 # 1 A 248 ASP A 111 ASP~? 10.94 CL CL B 124 A 270 LYS A 113 LYS~? 7.84 CL CL A 123 A 382 MET B 27 MET?? 15.07 CL CL B 124 coo -27.63 121.99 45.48 -26.66 123.86 45.68 33.22 12.10 12.41 33.55 10.10 11.76 coo -32.20 115.91 49.56 -31.37 121.03 53.12 39.46 14.20 14.59 41.86 19.61 14.55 coo -23.75 127.89 58.42 -26.02 128.79 55.12 26.14 24.63 18.73 26.23 24.60 15.40 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 2 3 # 2 A 248 ASP A 111 ASP~? 10.94 CL CL B 124 A 270 LYS A 114 LYS.? 14.28 CL CL B 124 A 382 MET B 27 MET?? 15.07 CL CL B 124 coo -27.63 121.99 45.48 -26.66 123.86 45.68 33.22 12.10 12.41 33.55 10.10 11.76 coo -32.20 115.91 49.56 -31.37 121.03 53.12 38.24 11.42 16.94 34.01 7.82 14.29 coo -23.75 127.89 58.42 -26.02 128.79 55.12 26.14 24.63 18.73 26.23 24.60 15.40 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 3 3 # 3 A 248 ASP A 111 ASP~? 10.94 CL CL B 124 A 270 LYS A 114 LYS.? 14.28 CL CL B 124 A 382 MET B 71 MET?? 7.76 O4 UNL A 200 coo -27.63 121.99 45.48 -26.66 123.86 45.68 33.22 12.10 12.41 33.55 10.10 11.76 coo -32.20 115.91 49.56 -31.37 121.03 53.12 38.24 11.42 16.94 34.01 7.82 14.29 coo -23.75 127.89 58.42 -26.02 128.79 55.12 36.83 22.92 3.70 36.15 25.98 2.64 ULMN 3 1pjq_c02 SIROHEME SYNTHASE user 4 3 # 4 A 248 ASP B 111 ASP~? 19.61 CL CL B 123 A 270 LYS B 113 LYS~? 7.99 CL CL B 123 A 382 MET A 27 MET?? 17.15 O1 UNL A 200 coo -27.63 121.99 45.48 -26.66 123.86 45.68 49.48 21.08 -13.06 49.20 19.08 -13.70 coo -32.20 115.91 49.56 -31.37 121.03 53.12 43.28 23.93 -13.69 40.73 27.69 -10.11 coo -23.75 127.89 58.42 -26.02 128.79 55.12 55.97 35.14 -10.65 56.07 32.96 -8.08 1pjq_c02 source 1pjq SIROHEME SYNTHASE : 4 hits 1pjq_c02 naa= 3 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 1 3 # 1 B 248 ASP A 111 ASP~? 10.94 CL CL B 124 B 270 LYS A 113 LYS~? 7.84 CL CL A 123 B 382 MET B 71 MET?? 7.76 O4 UNL A 200 coo -11.82 154.51 43.38 -12.86 152.74 43.79 33.22 12.10 12.41 33.55 10.10 11.76 coo -5.09 158.39 43.41 -0.74 158.80 47.15 39.46 14.20 14.59 41.86 19.61 14.55 coo -2.79 145.52 50.38 -5.75 148.14 51.66 36.83 22.92 3.70 36.15 25.98 2.64 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 2 3 # 2 B 248 ASP A 111 ASP~? 10.94 CL CL B 124 B 270 LYS A 114 LYS.? 14.28 CL CL B 124 B 382 MET B 53 MET?? 10.70 O3 GOL B 126 coo -11.82 154.51 43.38 -12.86 152.74 43.79 33.22 12.10 12.41 33.55 10.10 11.76 coo -5.09 158.39 43.41 -0.74 158.80 47.15 38.24 11.42 16.94 34.01 7.82 14.29 coo -2.79 145.52 50.38 -5.75 148.14 51.66 36.07 25.62 14.63 32.02 26.36 13.51 ULMN 3 1pjq_c03 SIROHEME SYNTHASE user 3 3 # 3 B 248 ASP B 111 ASP~? 19.61 CL CL B 123 B 270 LYS B 113 LYS~? 7.99 CL CL B 123 B 382 MET A 71 MET?? 7.55 O3 GOL A 201 coo -11.82 154.51 43.38 -12.86 152.74 43.79 49.48 21.08 -13.06 49.20 19.08 -13.70 coo -5.09 158.39 43.41 -0.74 158.80 47.15 43.28 23.93 -13.69 40.73 27.69 -10.11 coo -2.79 145.52 50.38 -5.75 148.14 51.66 45.77 24.12 0.45 46.33 25.95 3.19 1pjq_c03 source 1pjq SIROHEME SYNTHASE : 3 hits 1pjq_c03 naa= 3 ULMN 3 1pmi_c00 PHOSPHOMANNOSE ISOMERASE user 1 3 # 1 111 GLN B 9 GLN~? 20.49 O1 GOL B 125 294 GLU B 21 GLU~? 22.82 C3 GOL B 126 304 ARG B 10 ARG.? 11.05 O1 GOL B 125 coo 15.89 18.45 46.53 15.82 16.91 48.02 33.55 44.67 24.26 31.56 45.42 24.57 coo 22.84 13.44 52.91 20.84 13.18 52.38 25.81 36.56 22.58 24.87 38.21 23.53 coo 8.71 17.11 46.51 7.23 17.64 49.20 38.06 41.77 18.55 40.34 40.33 20.11 1pmi_c00 source 1pmi PHOSPHOMANNOSE ISOMERASE : 1 hits 1pmi_c00 naa= 3 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 1 3 # 1 B 1 SER A 22 SER~? 23.06 O1 UNL A 200 B 69 ALA A 25 ALA~? 21.90 O1 UNL A 200 B 241 ASN A 26 ASN~? 22.72 O1 UNL A 200 coo 13.24 41.94 33.13 13.08 39.54 33.17 59.17 41.83 -6.71 61.08 42.87 -5.70 coo 9.15 37.89 36.69 10.55 37.76 37.22 57.35 40.51 -11.23 58.41 41.55 -11.10 coo 10.91 43.03 38.47 11.81 41.82 36.93 59.79 36.87 -9.12 61.45 38.07 -8.53 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 2 3 # 2 B 1 SER A 58 SER.? 11.73 O2 GOL B 126 B 69 ALA A 63 ALA^? 8.44 O1 UNL A 200 B 241 ASN A 56 ASN^? 8.14 O1 UNL A 200 coo 13.24 41.94 33.13 13.08 39.54 33.17 47.20 43.37 6.46 47.90 41.49 7.82 coo 9.15 37.89 36.69 10.55 37.76 37.22 47.70 37.03 2.81 46.25 37.43 3.18 coo 10.91 43.03 38.47 11.81 41.82 36.93 44.33 40.68 0.78 42.68 41.57 -0.30 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 3 3 # 3 B 1 SER B 22 SER~? 23.16 O3 GOL B 126 B 69 ALA B 25 ALA~? 22.05 C3 GOL B 126 B 241 ASN B 26 ASN~? 21.41 CL CL B 124 coo 13.24 41.94 33.13 13.08 39.54 33.17 22.70 32.34 19.73 20.75 33.76 19.49 coo 9.15 37.89 36.69 10.55 37.76 37.22 24.55 28.48 22.44 23.39 29.41 22.96 coo 10.91 43.03 38.47 11.81 41.82 36.93 22.33 26.94 18.41 20.59 28.17 18.67 ULMN 3 1pnl_c00 PENICILLIN AMIDOHYDROLASE user 4 3 # 4 B 1 SER B 58 SER.? 12.59 O3 UNL A 200 B 69 ALA B 63 ALA^? 8.12 O3 GOL B 126 B 241 ASN B 56 ASN^? 7.10 O2 GOL B 126 coo 13.24 41.94 33.13 13.08 39.54 33.17 34.66 41.80 10.52 34.18 41.01 8.30 coo 9.15 37.89 36.69 10.55 37.76 37.22 34.41 34.45 9.56 35.85 35.01 9.44 coo 10.91 43.03 38.47 11.81 41.82 36.93 37.58 36.28 13.48 39.18 36.45 14.91 1pnl_c00 source 1pnl PENICILLIN AMIDOHYDROLASE : 4 hits 1pnl_c00 naa= 3 ULMN 3 1pyl_c00 RIBONUCLEASE user 1 3 # 1 A 56 GLU A 67 GLU~? 5.52 O4 UNL A 200 A 67 ARG B 122 ARG.? 4.15 CL CL B 123s A 86 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 18.15 3.28 18.56 20.10 2.92 19.20 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 21.52 6.83 26.64 21.22 5.53 23.85 31.77 26.02 -8.78 30.06 27.01 -11.17 coo 22.36 -1.88 25.52 23.57 -0.73 24.25 35.07 28.78 -0.10 35.41 27.96 -2.01 ULMN 3 1pyl_c00 RIBONUCLEASE user 2 3 # 2 A 56 GLU B 67 GLU~? 5.53 O3 GOL A 201 A 67 ARG A 122 ARG.? -4.14 CL CL A 123s A 86 HIS A 85 HIS^? 3.67 O3 GOL A 201s coo 18.15 3.28 18.56 20.10 2.92 19.20 40.62 21.48 11.23 42.64 22.01 11.70 coo 21.52 6.83 26.64 21.22 5.53 23.85 51.28 18.48 12.98 52.83 19.03 15.57 coo 22.36 -1.88 25.52 23.57 -0.73 24.25 47.38 26.60 7.09 47.11 24.76 8.07 1pyl_c00 source 1pyl RIBONUCLEASE : 2 hits 1pyl_c00 naa= 3 ULMN 3 1pyl_c01 RIBONUCLEASE user 1 3 # 1 B 56 GLU A 67 GLU~? 5.52 O4 UNL A 200 B 67 ARG B 122 ARG.? 4.15 CL CL B 123s B 86 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 33.14 -5.53 11.32 32.45 -5.14 9.39 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 31.86 -4.62 2.25 31.08 -4.78 5.21 31.77 26.02 -8.78 30.06 27.01 -11.17 coo 25.42 -9.42 7.20 25.63 -7.36 7.52 35.07 28.78 -0.10 35.41 27.96 -2.01 1pyl_c01 source 1pyl RIBONUCLEASE : 1 hits 1pyl_c01 naa= 3 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 1 3 # 1 A 48 LEU A 34 LEU.? 15.81 O1 UNL A 200 A 58 ASP A 47 ASP^? 15.55 CL CL B 123 A 120 LYS B 113 LYS~? 7.99 CL CL B 123 coo 34.02 69.29 75.26 34.82 67.82 76.74 50.10 34.25 -14.66 50.05 32.66 -13.21 coo 34.46 72.45 78.57 32.82 72.75 77.28 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 28.96 77.64 81.19 29.05 74.53 77.51 43.28 23.93 -13.69 40.73 27.69 -10.11 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 2 3 # 2 A 48 LEU B 34 LEU.? 15.63 C3 GOL B 126 A 58 ASP B 47 ASP^? 15.68 CL CL A 123 A 120 LYS A 113 LYS~? 7.84 CL CL A 123 coo 34.02 69.29 75.26 34.82 67.82 76.74 32.08 21.78 21.63 32.21 21.31 19.54 coo 34.46 72.45 78.57 32.82 72.75 77.28 36.24 17.92 20.25 35.18 16.23 20.89 coo 28.96 77.64 81.19 29.05 74.53 77.51 39.46 14.20 14.59 41.86 19.61 14.55 ULMN 3 1pym_c00 PHOSPHOENOLPYRUVATE MUTASE user 3 3 # 3 A 48 LEU B 34 LEU.? 15.63 C3 GOL B 126 A 58 ASP B 47 ASP^? 15.68 CL CL A 123 A 120 LYS A 114 LYS.? 14.28 CL CL B 124 coo 34.02 69.29 75.26 34.82 67.82 76.74 32.08 21.78 21.63 32.21 21.31 19.54 coo 34.46 72.45 78.57 32.82 72.75 77.28 36.24 17.92 20.25 35.18 16.23 20.89 coo 28.96 77.64 81.19 29.05 74.53 77.51 38.24 11.42 16.94 34.01 7.82 14.29 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 34 LEU.? 15.81 O1 UNL A 200 B 58 ASP A 47 ASP^? 15.55 CL CL B 123 B 120 LYS B 113 LYS~? 7.99 CL CL B 123 coo 54.50 104.32 58.69 55.83 105.69 59.81 50.10 34.25 -14.66 50.05 32.66 -13.21 coo 57.63 101.19 59.83 56.60 100.89 57.99 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 61.58 95.88 55.22 58.18 99.30 54.71 43.28 23.93 -13.69 40.73 27.69 -10.11 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 2 3 # 2 B 48 LEU B 34 LEU.? 15.63 C3 GOL B 126 B 58 ASP B 47 ASP^? 15.68 CL CL A 123 B 120 LYS A 113 LYS~? 7.84 CL CL A 123 coo 54.50 104.32 58.69 55.83 105.69 59.81 32.08 21.78 21.63 32.21 21.31 19.54 coo 57.63 101.19 59.83 56.60 100.89 57.99 36.24 17.92 20.25 35.18 16.23 20.89 coo 61.58 95.88 55.22 58.18 99.30 54.71 39.46 14.20 14.59 41.86 19.61 14.55 ULMN 3 1pym_c01 PHOSPHOENOLPYRUVATE MUTASE user 3 3 # 3 B 48 LEU B 34 LEU.? 15.63 C3 GOL B 126 B 58 ASP B 47 ASP^? 15.68 CL CL A 123 B 120 LYS A 114 LYS.? 14.28 CL CL B 124 coo 54.50 104.32 58.69 55.83 105.69 59.81 32.08 21.78 21.63 32.21 21.31 19.54 coo 57.63 101.19 59.83 56.60 100.89 57.99 36.24 17.92 20.25 35.18 16.23 20.89 coo 61.58 95.88 55.22 58.18 99.30 54.71 38.24 11.42 16.94 34.01 7.82 14.29 1pym_c01 source 1pym PHOSPHOENOLPYRUVATE MUTASE : 3 hits 1pym_c01 naa= 3 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 110 ARG A 19 ARG~? 17.61 O2 GOL A 201 C 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 C 236 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 39.01 29.77 22.02 37.48 31.30 19.84 57.40 40.38 1.34 58.96 39.38 3.77 coo 39.51 34.34 13.63 37.63 32.61 14.79 54.83 30.60 5.85 57.08 31.79 4.69 coo 45.78 31.11 9.51 44.25 30.06 10.53 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 110 ARG A 90 ARG^? -3.37 O3 UNL A 200s C 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 C 236 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 39.01 29.77 22.02 37.48 31.30 19.84 34.56 36.69 3.31 35.72 36.40 0.46 coo 39.51 34.34 13.63 37.63 32.61 14.79 27.45 31.12 3.14 25.07 31.24 4.61 coo 45.78 31.11 9.51 44.25 30.06 10.53 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 110 ARG B 19 ARG~? 17.69 O8 UNL A 200 C 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 C 236 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 39.01 29.77 22.02 37.48 31.30 19.84 24.49 36.14 12.47 22.88 36.56 9.90 coo 39.51 34.34 13.63 37.63 32.61 14.79 27.45 31.12 3.14 25.07 31.24 4.61 coo 45.78 31.11 9.51 44.25 30.06 10.53 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s C 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 C 236 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 39.01 29.77 22.02 37.48 31.30 19.84 47.88 34.42 9.42 45.31 33.29 10.75 coo 39.51 34.34 13.63 37.63 32.61 14.79 54.83 30.60 5.85 57.08 31.79 4.69 coo 45.78 31.11 9.51 44.25 30.06 10.53 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1qgn_c16 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s C 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 C 236 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 39.01 29.77 22.02 37.48 31.30 19.84 47.88 34.42 9.42 45.31 33.29 10.75 coo 39.51 34.34 13.63 37.63 32.61 14.79 54.83 30.60 5.85 57.08 31.79 4.69 coo 45.78 31.11 9.51 44.25 30.06 10.53 59.21 30.58 1.37 59.85 28.74 0.55 1qgn_c16 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c16 naa= 3 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 110 ARG A 19 ARG~? 17.61 O2 GOL A 201 D 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 D 236 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 23.05 -7.35 32.81 21.30 -7.38 35.33 57.40 40.38 1.34 58.96 39.38 3.77 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 54.83 30.60 5.85 57.08 31.79 4.69 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 110 ARG A 90 ARG^? -3.37 O3 UNL A 200s D 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 D 236 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 34.56 36.69 3.31 35.72 36.40 0.46 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 27.45 31.12 3.14 25.07 31.24 4.61 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 110 ARG B 19 ARG~? 17.69 O8 UNL A 200 D 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 D 236 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 23.05 -7.35 32.81 21.30 -7.38 35.33 24.49 36.14 12.47 22.88 36.56 9.90 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 27.45 31.12 3.14 25.07 31.24 4.61 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s D 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 D 236 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 47.88 34.42 9.42 45.31 33.29 10.75 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 54.83 30.60 5.85 57.08 31.79 4.69 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1qgn_c17 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s D 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 D 236 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 23.05 -7.35 32.81 21.30 -7.38 35.33 47.88 34.42 9.42 45.31 33.29 10.75 coo 21.28 -11.43 41.42 21.14 -8.83 40.39 54.83 30.60 5.85 57.08 31.79 4.69 coo 28.41 -14.31 44.14 27.98 -12.36 43.41 59.21 30.58 1.37 59.85 28.74 0.55 1qgn_c17 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c17 naa= 3 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 A 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 A 236 ASP A 79 ASP~? 6.09 O1 GOL A 201 C 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 55.48 26.51 40.65 55.39 23.99 39.43 54.83 30.60 5.85 57.08 31.79 4.69 coo 48.87 29.19 44.63 49.10 27.34 43.63 53.25 22.44 8.57 51.13 22.57 8.85 coo 52.39 23.42 32.10 54.51 23.27 34.29 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 A 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 A 236 ASP A 84 ASP.? -3.46 O1 GOL A 201s C 110 ARG A 19 ARG~? 17.61 O2 GOL A 201 coo 55.48 26.51 40.65 55.39 23.99 39.43 54.83 30.60 5.85 57.08 31.79 4.69 coo 48.87 29.19 44.63 49.10 27.34 43.63 49.74 30.72 10.50 50.57 30.42 12.42 coo 52.39 23.42 32.10 54.51 23.27 34.29 57.40 40.38 1.34 58.96 39.38 3.77 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 A 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 A 236 ASP B 98 ASP~? 15.88 O1 GOL A 201 C 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 55.48 26.51 40.65 55.39 23.99 39.43 54.83 30.60 5.85 57.08 31.79 4.69 coo 48.87 29.19 44.63 49.10 27.34 43.63 59.21 30.58 1.37 59.85 28.74 0.55 coo 52.39 23.42 32.10 54.51 23.27 34.29 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 A 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 A 236 ASP B 79 ASP~? 3.97 O7 UNL A 200 C 110 ARG A 90 ARG^? -3.37 O3 UNL A 200s coo 55.48 26.51 40.65 55.39 23.99 39.43 27.45 31.12 3.14 25.07 31.24 4.61 coo 48.87 29.19 44.63 49.10 27.34 43.63 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 52.39 23.42 32.10 54.51 23.27 34.29 34.56 36.69 3.31 35.72 36.40 0.46 ULMN 3 1qgn_c18 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 A 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 A 236 ASP B 84 ASP.? -3.52 O9 UNL A 200s C 110 ARG B 19 ARG~? 17.69 O8 UNL A 200 coo 55.48 26.51 40.65 55.39 23.99 39.43 27.45 31.12 3.14 25.07 31.24 4.61 coo 48.87 29.19 44.63 49.10 27.34 43.63 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 52.39 23.42 32.10 54.51 23.27 34.29 24.49 36.14 12.47 22.88 36.56 9.90 1qgn_c18 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c18 naa= 3 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 B 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 B 236 ASP A 79 ASP~? 6.09 O1 GOL A 201 D 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 32.99 -16.32 11.66 35.01 -14.70 12.72 54.83 30.60 5.85 57.08 31.79 4.69 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 53.25 22.44 8.57 51.13 22.57 8.85 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 B 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 B 236 ASP A 84 ASP.? -3.46 O1 GOL A 201s D 110 ARG A 19 ARG~? 17.61 O2 GOL A 201 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 54.83 30.60 5.85 57.08 31.79 4.69 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 49.74 30.72 10.50 50.57 30.42 12.42 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 57.40 40.38 1.34 58.96 39.38 3.77 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 B 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 B 236 ASP B 98 ASP~? 15.88 O1 GOL A 201 D 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 32.99 -16.32 11.66 35.01 -14.70 12.72 54.83 30.60 5.85 57.08 31.79 4.69 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 59.21 30.58 1.37 59.85 28.74 0.55 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 B 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 B 236 ASP B 79 ASP~? 3.97 O7 UNL A 200 D 110 ARG A 90 ARG^? -3.37 O3 UNL A 200s coo 32.99 -16.32 11.66 35.01 -14.70 12.72 27.45 31.12 3.14 25.07 31.24 4.61 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 34.56 36.69 3.31 35.72 36.40 0.46 ULMN 3 1qgn_c19 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 B 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 B 236 ASP B 84 ASP.? -3.52 O9 UNL A 200s D 110 ARG B 19 ARG~? 17.69 O8 UNL A 200 coo 32.99 -16.32 11.66 35.01 -14.70 12.72 27.45 31.12 3.14 25.07 31.24 4.61 coo 26.18 -12.82 8.91 27.87 -11.87 9.77 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 34.79 -12.60 20.34 35.97 -13.92 17.84 24.49 36.14 12.47 22.88 36.56 9.90 1qgn_c19 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c19 naa= 3 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 110 ARG A 19 ARG~? 17.61 O2 GOL A 201 G 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 G 236 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 57.40 40.38 1.34 58.96 39.38 3.77 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 54.83 30.60 5.85 57.08 31.79 4.69 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 110 ARG A 90 ARG^? -3.37 O3 UNL A 200s G 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 G 236 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 34.56 36.69 3.31 35.72 36.40 0.46 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 27.45 31.12 3.14 25.07 31.24 4.61 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 E 110 ARG B 19 ARG~? 17.69 O8 UNL A 200 G 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 G 236 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 24.49 36.14 12.47 22.88 36.56 9.90 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 27.45 31.12 3.14 25.07 31.24 4.61 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 E 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s G 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 G 236 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 47.88 34.42 9.42 45.31 33.29 10.75 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 54.83 30.60 5.85 57.08 31.79 4.69 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1qgn_c20 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 E 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s G 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 G 236 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 60.40 -9.85 -55.76 62.00 -8.48 -58.01 47.88 34.42 9.42 45.31 33.29 10.75 coo 64.84 -10.79 -64.16 63.27 -8.78 -63.00 54.83 30.60 5.85 57.08 31.79 4.69 coo 61.22 -16.97 -68.13 60.30 -15.38 -67.08 59.21 30.58 1.37 59.85 28.74 0.55 1qgn_c20 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c20 naa= 3 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 110 ARG A 19 ARG~? 17.61 O2 GOL A 201 H 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 H 236 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 24.62 8.71 -44.89 24.77 10.53 -42.42 57.40 40.38 1.34 58.96 39.38 3.77 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 54.83 30.60 5.85 57.08 31.79 4.69 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 110 ARG A 90 ARG^? -3.37 O3 UNL A 200s H 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 H 236 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 34.56 36.69 3.31 35.72 36.40 0.46 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 27.45 31.12 3.14 25.07 31.24 4.61 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 F 110 ARG B 19 ARG~? 17.69 O8 UNL A 200 H 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 H 236 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 24.62 8.71 -44.89 24.77 10.53 -42.42 24.49 36.14 12.47 22.88 36.56 9.90 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 27.45 31.12 3.14 25.07 31.24 4.61 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 F 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s H 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 H 236 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 47.88 34.42 9.42 45.31 33.29 10.75 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 54.83 30.60 5.85 57.08 31.79 4.69 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1qgn_c21 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 F 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s H 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 H 236 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 24.62 8.71 -44.89 24.77 10.53 -42.42 47.88 34.42 9.42 45.31 33.29 10.75 coo 20.90 10.83 -36.23 23.51 10.75 -37.23 54.83 30.60 5.85 57.08 31.79 4.69 coo 17.57 3.99 -33.38 19.51 4.24 -34.16 59.21 30.58 1.37 59.85 28.74 0.55 1qgn_c21 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c21 naa= 3 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 E 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 E 236 ASP A 79 ASP~? 6.09 O1 GOL A 201 G 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 54.83 30.60 5.85 57.08 31.79 4.69 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 53.25 22.44 8.57 51.13 22.57 8.85 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 E 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 E 236 ASP A 84 ASP.? -3.46 O1 GOL A 201s G 110 ARG A 19 ARG~? 17.61 O2 GOL A 201 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 54.83 30.60 5.85 57.08 31.79 4.69 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 49.74 30.72 10.50 50.57 30.42 12.42 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 57.40 40.38 1.34 58.96 39.38 3.77 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 E 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 E 236 ASP B 98 ASP~? 15.88 O1 GOL A 201 G 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 54.83 30.60 5.85 57.08 31.79 4.69 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 59.21 30.58 1.37 59.85 28.74 0.55 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 E 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 E 236 ASP B 79 ASP~? 3.97 O7 UNL A 200 G 110 ARG A 90 ARG^? -3.37 O3 UNL A 200s coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 27.45 31.12 3.14 25.07 31.24 4.61 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 34.56 36.69 3.31 35.72 36.40 0.46 ULMN 3 1qgn_c22 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 E 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 E 236 ASP B 84 ASP.? -3.52 O9 UNL A 200s G 110 ARG B 19 ARG~? 17.69 O8 UNL A 200 coo 56.39 -25.68 -36.91 53.88 -25.46 -38.13 27.45 31.12 3.14 25.07 31.24 4.61 coo 59.54 -19.27 -32.99 57.70 -19.44 -33.97 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 53.35 -22.70 -45.35 52.95 -24.81 -43.16 24.49 36.14 12.47 22.88 36.56 9.90 1qgn_c22 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c22 naa= 3 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 1 3 # 1 F 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 F 236 ASP A 79 ASP~? 6.09 O1 GOL A 201 H 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 54.83 30.60 5.85 57.08 31.79 4.69 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 53.25 22.44 8.57 51.13 22.57 8.85 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 2 3 # 2 F 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 F 236 ASP A 84 ASP.? -3.46 O1 GOL A 201s H 110 ARG A 19 ARG~? 17.61 O2 GOL A 201 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 54.83 30.60 5.85 57.08 31.79 4.69 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 49.74 30.72 10.50 50.57 30.42 12.42 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 57.40 40.38 1.34 58.96 39.38 3.77 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 3 3 # 3 F 163 TYR A 83 TYR.? 10.52 O1 GOL A 201 F 236 ASP B 98 ASP~? 15.88 O1 GOL A 201 H 110 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 54.83 30.60 5.85 57.08 31.79 4.69 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 59.21 30.58 1.37 59.85 28.74 0.55 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 4 3 # 4 F 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 F 236 ASP B 79 ASP~? 3.97 O7 UNL A 200 H 110 ARG A 90 ARG^? -3.37 O3 UNL A 200s coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 27.45 31.12 3.14 25.07 31.24 4.61 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 34.56 36.69 3.31 35.72 36.40 0.46 ULMN 3 1qgn_c23 CYSTATHIONINE GAMMA-SYNTHASE user 5 3 # 5 F 163 TYR B 83 TYR.? 10.34 O6 UNL A 200 F 236 ASP B 84 ASP.? -3.52 O9 UNL A 200s H 110 ARG B 19 ARG~? 17.69 O8 UNL A 200 coo 14.88 -1.19 -65.80 16.37 -3.30 -64.72 27.45 31.12 3.14 25.07 31.24 4.61 coo 18.75 5.49 -68.65 19.58 3.75 -67.80 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 18.56 -3.01 -57.11 17.14 -4.14 -59.58 24.49 36.14 12.47 22.88 36.56 9.90 1qgn_c23 source 1qgn CYSTATHIONINE GAMMA-SYNTHASE : 5 hits 1qgn_c23 naa= 3 ULMN 3 1qho_c05 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 261 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 329 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 49.74 30.72 10.50 50.57 30.42 12.42 coo 34.02 79.89 42.60 34.73 78.01 41.86 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 37.87 70.12 31.80 36.61 69.74 30.15 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1qho_c05 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 98 ASP~? 12.55 CL CL B 124 A 261 ASP B 47 ASP^? 15.68 CL CL A 123 A 329 ASP A 104 ASP~? 7.36 CL CL B 124 coo 28.46 69.88 26.74 30.40 70.70 26.53 23.35 28.15 6.47 22.62 26.21 5.89 coo 34.02 79.89 42.60 34.73 78.01 41.86 36.24 17.92 20.25 35.18 16.23 20.89 coo 37.87 70.12 31.80 36.61 69.74 30.15 26.83 19.68 8.21 24.75 19.17 8.13 ULMN 3 1qho_c05 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP A 115 ASP.? 16.41 CL CL A 123 A 261 ASP A 104 ASP~? 7.36 CL CL B 124 A 329 ASP B 47 ASP^? 15.68 CL CL A 123 coo 28.46 69.88 26.74 30.40 70.70 26.53 42.06 8.77 16.59 40.52 7.32 16.97 coo 34.02 79.89 42.60 34.73 78.01 41.86 26.83 19.68 8.21 24.75 19.17 8.13 coo 37.87 70.12 31.80 36.61 69.74 30.15 36.24 17.92 20.25 35.18 16.23 20.89 ULMN 3 1qho_c05 ALPHA-AMYLASE user 4 3 # 4 A 228 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 261 ASP A 104 ASP~? 7.36 CL CL B 124 A 329 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 28.46 69.88 26.74 30.40 70.70 26.53 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 34.02 79.89 42.60 34.73 78.01 41.86 26.83 19.68 8.21 24.75 19.17 8.13 coo 37.87 70.12 31.80 36.61 69.74 30.15 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1qho_c05 ALPHA-AMYLASE user 5 3 # 5 A 228 ASP B 98 ASP~? 15.88 O1 GOL A 201 A 261 ASP A 47 ASP^? 15.55 CL CL B 123 A 329 ASP B 104 ASP~? 19.83 C2 GOL A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 59.21 30.58 1.37 59.85 28.74 0.55 coo 34.02 79.89 42.60 34.73 78.01 41.86 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 37.87 70.12 31.80 36.61 69.74 30.15 55.81 24.74 -5.14 57.90 24.34 -5.34 ULMN 3 1qho_c05 ALPHA-AMYLASE user 6 3 # 6 A 228 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 261 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 329 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 34.02 79.89 42.60 34.73 78.01 41.86 49.74 30.72 10.50 50.57 30.42 12.42 coo 37.87 70.12 31.80 36.61 69.74 30.15 59.21 30.58 1.37 59.85 28.74 0.55 ULMN 3 1qho_c05 ALPHA-AMYLASE user 7 3 # 7 A 228 ASP B 115 ASP.? 16.66 CL CL B 123 A 261 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 329 ASP A 47 ASP^? 15.55 CL CL B 123 coo 28.46 69.88 26.74 30.40 70.70 26.53 40.90 20.11 -18.41 42.52 19.20 -19.45 coo 34.02 79.89 42.60 34.73 78.01 41.86 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 37.87 70.12 31.80 36.61 69.74 30.15 46.06 30.34 -15.72 47.22 29.37 -17.24 1qho_c05 source 1qho ALPHA-AMYLASE : 7 hits 1qho_c05 naa= 3 ULMN 3 1qho_c07 ALPHA-AMYLASE user 1 3 # 1 A 228 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 260 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 329 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 49.74 30.72 10.50 50.57 30.42 12.42 coo 30.73 81.29 37.61 31.23 82.07 35.69 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 37.87 70.12 31.80 36.61 69.74 30.15 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1qho_c07 ALPHA-AMYLASE user 2 3 # 2 A 228 ASP A 104 ASP~? 7.36 CL CL B 124 A 260 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 329 ASP A 98 ASP~? 12.55 CL CL B 124 coo 28.46 69.88 26.74 30.40 70.70 26.53 26.83 19.68 8.21 24.75 19.17 8.13 coo 30.73 81.29 37.61 31.23 82.07 35.69 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 37.87 70.12 31.80 36.61 69.74 30.15 23.35 28.15 6.47 22.62 26.21 5.89 ULMN 3 1qho_c07 ALPHA-AMYLASE user 3 3 # 3 A 228 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 260 ASP A 104 ASP~? 7.36 CL CL B 124 A 329 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 28.46 69.88 26.74 30.40 70.70 26.53 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 30.73 81.29 37.61 31.23 82.07 35.69 26.83 19.68 8.21 24.75 19.17 8.13 coo 37.87 70.12 31.80 36.61 69.74 30.15 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1qho_c07 ALPHA-AMYLASE user 4 3 # 4 A 228 ASP B 104 ASP~? 19.83 C2 GOL A 201 A 260 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 329 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 28.46 69.88 26.74 30.40 70.70 26.53 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 30.73 81.29 37.61 31.23 82.07 35.69 49.74 30.72 10.50 50.57 30.42 12.42 coo 37.87 70.12 31.80 36.61 69.74 30.15 59.21 30.58 1.37 59.85 28.74 0.55 1qho_c07 source 1qho ALPHA-AMYLASE : 4 hits 1qho_c07 naa= 3 ULMN 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 A 51 ALA A 63 ALA^? 8.44 O1 UNL A 200 A 148 HIS A 61 HIS^? 9.47 O2 GOL B 126 A 163 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 1.42 19.18 21.84 1.11 19.57 23.28 47.70 37.03 2.81 46.25 37.43 3.18 coo 0.71 19.67 27.92 2.43 19.16 26.83 49.34 38.44 7.48 47.30 38.27 7.99 coo 7.15 16.22 27.50 6.15 18.00 27.94 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qol_c00 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 A 51 ALA B 63 ALA^? 8.12 O3 GOL B 126 A 148 HIS B 61 HIS^? 10.01 O3 UNL A 200 A 163 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 1.42 19.18 21.84 1.11 19.57 23.28 34.41 34.45 9.56 35.85 35.01 9.44 coo 0.71 19.67 27.92 2.43 19.16 26.83 32.69 38.40 6.72 34.73 38.60 6.25 coo 7.15 16.22 27.50 6.15 18.00 27.94 32.50 34.12 -0.35 31.64 35.02 -2.06 1qol_c00 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c00 naa= 3 ULMN 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 B 51 ALA A 63 ALA^? 8.44 O1 UNL A 200 B 148 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 163 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -33.97 19.78 54.18 -33.40 20.11 52.82 47.70 37.03 2.81 46.25 37.43 3.18 coo -33.17 20.01 48.16 -34.95 19.37 49.06 49.34 38.44 7.48 47.30 38.27 7.99 coo -39.82 16.62 48.85 -38.59 18.24 48.48 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qol_c01 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 B 51 ALA B 63 ALA^? 8.12 O3 GOL B 126 B 148 HIS B 61 HIS^? 10.01 O3 UNL A 200 B 163 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -33.97 19.78 54.18 -33.40 20.11 52.82 34.41 34.45 9.56 35.85 35.01 9.44 coo -33.17 20.01 48.16 -34.95 19.37 49.06 32.69 38.40 6.72 34.73 38.60 6.25 coo -39.82 16.62 48.85 -38.59 18.24 48.48 32.50 34.12 -0.35 31.64 35.02 -2.06 1qol_c01 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c01 naa= 3 ULMN 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 C 51 ALA A 63 ALA^? 8.44 O1 UNL A 200 C 148 HIS A 61 HIS^? 9.47 O2 GOL B 126 C 163 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -26.36 -19.12 21.15 -25.71 -19.49 22.47 47.70 37.03 2.81 46.25 37.43 3.18 coo -25.01 -20.21 26.78 -26.91 -20.55 25.93 49.34 38.44 7.48 47.30 38.27 7.99 coo -32.17 -20.34 27.36 -30.15 -20.93 27.54 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qol_c02 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 C 51 ALA B 63 ALA^? 8.12 O3 GOL B 126 C 148 HIS B 61 HIS^? 10.01 O3 UNL A 200 C 163 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -26.36 -19.12 21.15 -25.71 -19.49 22.47 34.41 34.45 9.56 35.85 35.01 9.44 coo -25.01 -20.21 26.78 -26.91 -20.55 25.93 32.69 38.40 6.72 34.73 38.60 6.25 coo -32.17 -20.34 27.36 -30.15 -20.93 27.54 32.50 34.12 -0.35 31.64 35.02 -2.06 1qol_c02 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c02 naa= 3 ULMN 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 D 51 ALA A 63 ALA^? 8.44 O1 UNL A 200 D 148 HIS A 61 HIS^? 9.47 O2 GOL B 126 D 163 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -6.15 -19.18 55.49 -6.70 -19.60 54.15 47.70 37.03 2.81 46.25 37.43 3.18 coo -7.62 -20.32 49.70 -5.89 -20.86 50.74 49.34 38.44 7.48 47.30 38.27 7.99 coo -0.41 -20.05 49.27 -2.21 -21.16 49.24 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qol_c03 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 D 51 ALA B 63 ALA^? 8.12 O3 GOL B 126 D 148 HIS B 61 HIS^? 10.01 O3 UNL A 200 D 163 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -6.15 -19.18 55.49 -6.70 -19.60 54.15 34.41 34.45 9.56 35.85 35.01 9.44 coo -7.62 -20.32 49.70 -5.89 -20.86 50.74 32.69 38.40 6.72 34.73 38.60 6.25 coo -0.41 -20.05 49.27 -2.21 -21.16 49.24 32.50 34.12 -0.35 31.64 35.02 -2.06 1qol_c03 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c03 naa= 3 ULMN 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 E 51 ALA A 63 ALA^? 8.44 O1 UNL A 200 E 148 HIS A 61 HIS^? 9.47 O2 GOL B 126 E 163 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 5.48 -16.06 -47.92 6.03 -15.45 -46.65 47.70 37.03 2.81 46.25 37.43 3.18 coo 5.81 -16.05 -42.05 5.54 -17.84 -43.11 49.34 38.44 7.48 47.30 38.27 7.99 coo 2.75 -22.21 -43.08 4.67 -21.31 -42.96 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 E 51 ALA A 107 ALA~? 9.29 CL CL B 124 E 148 HIS A 103 HIS~? 11.95 CL CL B 124 E 163 ASP A 104 ASP~? 7.36 CL CL B 124 coo 5.48 -16.06 -47.92 6.03 -15.45 -46.65 29.93 17.06 13.11 28.49 16.67 12.69 coo 5.81 -16.05 -42.05 5.54 -17.84 -43.11 24.53 20.38 13.18 24.12 18.57 14.18 coo 2.75 -22.21 -43.08 4.67 -21.31 -42.96 26.83 19.68 8.21 24.75 19.17 8.13 ULMN 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 # 3 E 51 ALA B 63 ALA^? 8.12 O3 GOL B 126 E 148 HIS B 61 HIS^? 10.01 O3 UNL A 200 E 163 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 5.48 -16.06 -47.92 6.03 -15.45 -46.65 34.41 34.45 9.56 35.85 35.01 9.44 coo 5.81 -16.05 -42.05 5.54 -17.84 -43.11 32.69 38.40 6.72 34.73 38.60 6.25 coo 2.75 -22.21 -43.08 4.67 -21.31 -42.96 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1qol_c04 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 # 4 E 51 ALA B 107 ALA~? 18.72 O1 UNL A 200 E 148 HIS B 103 HIS~? 20.60 O1 UNL A 200 E 163 ASP B 104 ASP~? 19.83 C2 GOL A 201 coo 5.48 -16.06 -47.92 6.03 -15.45 -46.65 52.64 25.48 -10.62 54.03 24.92 -10.48 coo 5.81 -16.05 -42.05 5.54 -17.84 -43.11 57.94 28.30 -8.81 58.37 27.44 -10.67 coo 2.75 -22.21 -43.08 4.67 -21.31 -42.96 55.81 24.74 -5.14 57.90 24.34 -5.34 1qol_c04 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 4 hits 1qol_c04 naa= 3 ULMN 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 F 51 ALA A 63 ALA^? 8.44 O1 UNL A 200 F 148 HIS A 61 HIS^? 9.47 O2 GOL B 126 F 163 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 5.33 15.59 -14.28 5.80 15.15 -15.64 47.70 37.03 2.81 46.25 37.43 3.18 coo 5.79 15.50 -20.13 5.50 17.28 -19.05 49.34 38.44 7.48 47.30 38.27 7.99 coo 2.42 22.00 -18.97 4.23 20.92 -19.18 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qol_c05 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 F 51 ALA B 63 ALA^? 8.12 O3 GOL B 126 F 148 HIS B 61 HIS^? 10.01 O3 UNL A 200 F 163 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 5.33 15.59 -14.28 5.80 15.15 -15.64 34.41 34.45 9.56 35.85 35.01 9.44 coo 5.79 15.50 -20.13 5.50 17.28 -19.05 32.69 38.40 6.72 34.73 38.60 6.25 coo 2.42 22.00 -18.97 4.23 20.92 -19.18 32.50 34.12 -0.35 31.64 35.02 -2.06 1qol_c05 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c05 naa= 3 ULMN 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 G 51 ALA A 63 ALA^? 8.44 O1 UNL A 200 G 148 HIS A 61 HIS^? 9.47 O2 GOL B 126 G 163 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -33.28 -11.88 -14.46 -33.66 -11.38 -15.87 47.70 37.03 2.81 46.25 37.43 3.18 coo -34.88 -9.77 -20.15 -35.41 -11.60 -19.26 49.34 38.44 7.48 47.30 38.27 7.99 coo -34.41 -16.73 -21.11 -35.66 -15.03 -20.96 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 G 51 ALA A 107 ALA~? 9.29 CL CL B 124 G 148 HIS A 103 HIS~? 11.95 CL CL B 124 G 163 ASP A 104 ASP~? 7.36 CL CL B 124 coo -33.28 -11.88 -14.46 -33.66 -11.38 -15.87 29.93 17.06 13.11 28.49 16.67 12.69 coo -34.88 -9.77 -20.15 -35.41 -11.60 -19.26 24.53 20.38 13.18 24.12 18.57 14.18 coo -34.41 -16.73 -21.11 -35.66 -15.03 -20.96 26.83 19.68 8.21 24.75 19.17 8.13 ULMN 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 3 3 # 3 G 51 ALA B 63 ALA^? 8.12 O3 GOL B 126 G 148 HIS B 61 HIS^? 10.01 O3 UNL A 200 G 163 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -33.28 -11.88 -14.46 -33.66 -11.38 -15.87 34.41 34.45 9.56 35.85 35.01 9.44 coo -34.88 -9.77 -20.15 -35.41 -11.60 -19.26 32.69 38.40 6.72 34.73 38.60 6.25 coo -34.41 -16.73 -21.11 -35.66 -15.03 -20.96 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1qol_c06 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 4 3 # 4 G 51 ALA B 107 ALA~? 18.72 O1 UNL A 200 G 148 HIS B 103 HIS~? 20.60 O1 UNL A 200 G 163 ASP B 104 ASP~? 19.83 C2 GOL A 201 coo -33.28 -11.88 -14.46 -33.66 -11.38 -15.87 52.64 25.48 -10.62 54.03 24.92 -10.48 coo -34.88 -9.77 -20.15 -35.41 -11.60 -19.26 57.94 28.30 -8.81 58.37 27.44 -10.67 coo -34.41 -16.73 -21.11 -35.66 -15.03 -20.96 55.81 24.74 -5.14 57.90 24.34 -5.34 1qol_c06 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 4 hits 1qol_c06 naa= 3 ULMN 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 1 3 # 1 H 51 ALA A 63 ALA^? 8.44 O1 UNL A 200 H 148 HIS A 61 HIS^? 9.47 O2 GOL B 126 H 163 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -33.97 9.40 -47.46 -34.31 8.55 -46.23 47.70 37.03 2.81 46.25 37.43 3.18 coo -35.28 7.86 -41.76 -36.20 9.51 -42.67 49.34 38.44 7.48 47.30 38.27 7.99 coo -35.25 15.19 -41.05 -35.81 13.11 -41.05 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1qol_c07 PROTEASE (NONSTRUCTURAL PROTEIN P20Auser 2 3 # 2 H 51 ALA B 63 ALA^? 8.12 O3 GOL B 126 H 148 HIS B 61 HIS^? 10.01 O3 UNL A 200 H 163 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -33.97 9.40 -47.46 -34.31 8.55 -46.23 34.41 34.45 9.56 35.85 35.01 9.44 coo -35.28 7.86 -41.76 -36.20 9.51 -42.67 32.69 38.40 6.72 34.73 38.60 6.25 coo -35.25 15.19 -41.05 -35.81 13.11 -41.05 32.50 34.12 -0.35 31.64 35.02 -2.06 1qol_c07 source 1qol PROTEASE (NONSTRUCTURAL PROTEIN P20A) : 2 hits 1qol_c07 naa= 3 ULMN 3 1qrz_c12 PLASMINOGEN user 1 3 # 1 A 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 A 646 ASP A 16 ASP~? 19.78 O1 GOL B 126 A 741 SER A 58 SER.? 11.73 O2 GOL B 126 coo -20.72 2.99 34.37 -21.94 1.82 35.61 49.34 38.44 7.48 47.30 38.27 7.99 coo -18.83 7.68 26.86 -20.89 7.78 26.56 55.39 45.97 3.05 55.87 45.57 5.11 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 47.20 43.37 6.46 47.90 41.49 7.82 ULMN 3 1qrz_c12 PLASMINOGEN user 2 3 # 2 A 603 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 646 ASP A 79 ASP~? 6.09 O1 GOL A 201 A 741 SER A 86 SER^? -2.62 O3 GOL B 126s coo -20.72 2.99 34.37 -21.94 1.82 35.61 47.38 26.60 7.09 47.11 24.76 8.07 coo -18.83 7.68 26.86 -20.89 7.78 26.56 53.25 22.44 8.57 51.13 22.57 8.85 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 43.49 29.72 7.55 42.01 31.25 8.69 ULMN 3 1qrz_c12 PLASMINOGEN user 3 3 # 3 A 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 A 646 ASP B 16 ASP~? 19.71 O9 UNL A 200 A 741 SER B 58 SER.? 12.59 O3 UNL A 200 coo -20.72 2.99 34.37 -21.94 1.82 35.61 32.69 38.40 6.72 34.73 38.60 6.25 coo -18.83 7.68 26.86 -20.89 7.78 26.56 26.40 41.60 14.58 25.93 42.50 12.70 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 34.66 41.80 10.52 34.18 41.01 8.30 ULMN 3 1qrz_c12 PLASMINOGEN user 4 3 # 4 A 603 HIS B 85 HIS^? -3.53 O6 UNL A 200s A 646 ASP B 79 ASP~? 3.97 O7 UNL A 200 A 741 SER B 86 SER^? -3.07 O1 UNL A 200s coo -20.72 2.99 34.37 -21.94 1.82 35.61 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -18.83 7.68 26.86 -20.89 7.78 26.56 29.26 26.18 -3.96 31.36 26.46 -4.14 coo -16.10 -1.48 32.49 -17.38 0.37 33.40 38.80 31.67 1.48 40.20 33.63 1.48 1qrz_c12 source 1qrz PLASMINOGEN : 4 hits 1qrz_c12 naa= 3 ULMN 3 1qrz_c13 PLASMINOGEN user 1 3 # 1 B 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 646 ASP A 16 ASP~? 19.78 O1 GOL B 126 B 741 SER A 58 SER.? 11.73 O2 GOL B 126 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 49.34 38.44 7.48 47.30 38.27 7.99 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 55.39 45.97 3.05 55.87 45.57 5.11 coo -43.75 -1.60 -6.12 -44.85 0.33 -5.15 47.20 43.37 6.46 47.90 41.49 7.82 ULMN 3 1qrz_c13 PLASMINOGEN user 2 3 # 2 B 603 HIS A 85 HIS^? 3.67 O3 GOL A 201s B 646 ASP A 79 ASP~? 6.09 O1 GOL A 201 B 741 SER A 86 SER^? -2.62 O3 GOL B 126s coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 47.38 26.60 7.09 47.11 24.76 8.07 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 53.25 22.44 8.57 51.13 22.57 8.85 coo -43.75 -1.60 -6.12 -44.85 0.33 -5.15 43.49 29.72 7.55 42.01 31.25 8.69 ULMN 3 1qrz_c13 PLASMINOGEN user 3 3 # 3 B 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 B 646 ASP B 16 ASP~? 19.71 O9 UNL A 200 B 741 SER B 58 SER.? 12.59 O3 UNL A 200 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 32.69 38.40 6.72 34.73 38.60 6.25 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 26.40 41.60 14.58 25.93 42.50 12.70 coo -43.75 -1.60 -6.12 -44.85 0.33 -5.15 34.66 41.80 10.52 34.18 41.01 8.30 1qrz_c13 source 1qrz PLASMINOGEN : 3 hits 1qrz_c13 naa= 3 ULMN 3 1qrz_c14 PLASMINOGEN user 1 3 # 1 C 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 C 646 ASP A 16 ASP~? 19.78 O1 GOL B 126 C 741 SER A 58 SER.? 11.73 O2 GOL B 126 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 49.34 38.44 7.48 47.30 38.27 7.99 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 55.39 45.97 3.05 55.87 45.57 5.11 coo 4.71 -4.57 4.71 3.58 -6.49 5.69 47.20 43.37 6.46 47.90 41.49 7.82 ULMN 3 1qrz_c14 PLASMINOGEN user 2 3 # 2 C 603 HIS A 85 HIS^? 3.67 O3 GOL A 201s C 646 ASP A 79 ASP~? 6.09 O1 GOL A 201 C 741 SER A 86 SER^? -2.62 O3 GOL B 126s coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 47.38 26.60 7.09 47.11 24.76 8.07 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 53.25 22.44 8.57 51.13 22.57 8.85 coo 4.71 -4.57 4.71 3.58 -6.49 5.69 43.49 29.72 7.55 42.01 31.25 8.69 ULMN 3 1qrz_c14 PLASMINOGEN user 3 3 # 3 C 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 C 646 ASP B 16 ASP~? 19.71 O9 UNL A 200 C 741 SER B 58 SER.? 12.59 O3 UNL A 200 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 32.69 38.40 6.72 34.73 38.60 6.25 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 26.40 41.60 14.58 25.93 42.50 12.70 coo 4.71 -4.57 4.71 3.58 -6.49 5.69 34.66 41.80 10.52 34.18 41.01 8.30 ULMN 3 1qrz_c14 PLASMINOGEN user 4 3 # 4 C 603 HIS B 85 HIS^? -3.53 O6 UNL A 200s C 646 ASP B 79 ASP~? 3.97 O7 UNL A 200 C 741 SER B 86 SER^? -3.07 O1 UNL A 200s coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 4.71 -4.57 4.71 3.58 -6.49 5.69 38.80 31.67 1.48 40.20 33.63 1.48 1qrz_c14 source 1qrz PLASMINOGEN : 4 hits 1qrz_c14 naa= 3 ULMN 3 1qrz_c15 PLASMINOGEN user 1 3 # 1 D 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 D 646 ASP A 16 ASP~? 19.78 O1 GOL B 126 D 741 SER A 58 SER.? 11.73 O2 GOL B 126 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 49.34 38.44 7.48 47.30 38.27 7.99 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 55.39 45.97 3.05 55.87 45.57 5.11 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 47.20 43.37 6.46 47.90 41.49 7.82 ULMN 3 1qrz_c15 PLASMINOGEN user 2 3 # 2 D 603 HIS A 85 HIS^? 3.67 O3 GOL A 201s D 646 ASP A 79 ASP~? 6.09 O1 GOL A 201 D 741 SER A 86 SER^? -2.62 O3 GOL B 126s coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 47.38 26.60 7.09 47.11 24.76 8.07 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 53.25 22.44 8.57 51.13 22.57 8.85 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 43.49 29.72 7.55 42.01 31.25 8.69 ULMN 3 1qrz_c15 PLASMINOGEN user 3 3 # 3 D 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 D 646 ASP B 16 ASP~? 19.71 O9 UNL A 200 D 741 SER B 58 SER.? 12.59 O3 UNL A 200 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 32.69 38.40 6.72 34.73 38.60 6.25 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 26.40 41.60 14.58 25.93 42.50 12.70 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 34.66 41.80 10.52 34.18 41.01 8.30 ULMN 3 1qrz_c15 PLASMINOGEN user 4 3 # 4 D 603 HIS B 85 HIS^? -3.53 O6 UNL A 200s D 646 ASP B 79 ASP~? 3.97 O7 UNL A 200 D 741 SER B 86 SER^? -3.07 O1 UNL A 200s coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 29.26 26.18 -3.96 31.36 26.46 -4.14 coo -49.16 -4.56 43.16 -50.44 -6.45 43.96 38.80 31.67 1.48 40.20 33.63 1.48 1qrz_c15 source 1qrz PLASMINOGEN : 4 hits 1qrz_c15 naa= 3 ULMN 3 1qrz_c20 PLASMINOGEN user 1 3 # 1 A 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 A 646 ASP A 16 ASP~? 19.78 O1 GOL B 126 A 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo -20.72 2.99 34.37 -21.94 1.82 35.61 49.34 38.44 7.48 47.30 38.27 7.99 coo -18.83 7.68 26.86 -20.89 7.78 26.56 55.39 45.97 3.05 55.87 45.57 5.11 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 45.00 36.12 -4.79 45.64 35.72 -4.41 ULMN 3 1qrz_c20 PLASMINOGEN user 2 3 # 2 A 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 A 646 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo -20.72 2.99 34.37 -21.94 1.82 35.61 49.34 38.44 7.48 47.30 38.27 7.99 coo -18.83 7.68 26.86 -20.89 7.78 26.56 49.74 30.72 10.50 50.57 30.42 12.42 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 45.00 36.12 -4.79 45.64 35.72 -4.41 ULMN 3 1qrz_c20 PLASMINOGEN user 3 3 # 3 A 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 A 646 ASP B 16 ASP~? 19.71 O9 UNL A 200 A 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo -20.72 2.99 34.37 -21.94 1.82 35.61 32.69 38.40 6.72 34.73 38.60 6.25 coo -18.83 7.68 26.86 -20.89 7.78 26.56 26.40 41.60 14.58 25.93 42.50 12.70 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 37.19 29.24 15.05 36.55 29.11 14.54 ULMN 3 1qrz_c20 PLASMINOGEN user 4 3 # 4 A 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 A 646 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo -20.72 2.99 34.37 -21.94 1.82 35.61 32.69 38.40 6.72 34.73 38.60 6.25 coo -18.83 7.68 26.86 -20.89 7.78 26.56 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -13.44 -7.35 30.08 -14.24 -7.41 30.34 37.19 29.24 15.05 36.55 29.11 14.54 1qrz_c20 source 1qrz PLASMINOGEN : 4 hits 1qrz_c20 naa= 3 ULMN 3 1qrz_c21 PLASMINOGEN user 1 3 # 1 B 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 646 ASP A 16 ASP~? 19.78 O1 GOL B 126 B 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 49.34 38.44 7.48 47.30 38.27 7.99 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 55.39 45.97 3.05 55.87 45.57 5.11 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 45.00 36.12 -4.79 45.64 35.72 -4.41 ULMN 3 1qrz_c21 PLASMINOGEN user 2 3 # 2 B 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 646 ASP A 84 ASP.? -3.46 O1 GOL A 201s B 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 49.34 38.44 7.48 47.30 38.27 7.99 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 49.74 30.72 10.50 50.57 30.42 12.42 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 45.00 36.12 -4.79 45.64 35.72 -4.41 ULMN 3 1qrz_c21 PLASMINOGEN user 3 3 # 3 B 603 HIS A 103 HIS~? 11.95 CL CL B 124 B 646 ASP A 98 ASP~? 12.55 CL CL B 124 B 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 24.53 20.38 13.18 24.12 18.57 14.18 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 23.35 28.15 6.47 22.62 26.21 5.89 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 37.19 29.24 15.05 36.55 29.11 14.54 ULMN 3 1qrz_c21 PLASMINOGEN user 4 3 # 4 B 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 B 646 ASP B 16 ASP~? 19.71 O9 UNL A 200 B 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 32.69 38.40 6.72 34.73 38.60 6.25 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 26.40 41.60 14.58 25.93 42.50 12.70 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 37.19 29.24 15.05 36.55 29.11 14.54 ULMN 3 1qrz_c21 PLASMINOGEN user 5 3 # 5 B 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 B 646 ASP B 84 ASP.? -3.52 O9 UNL A 200s B 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo -48.36 3.10 -3.91 -49.78 2.04 -2.80 32.69 38.40 6.72 34.73 38.60 6.25 coo -46.10 7.71 -10.96 -48.16 8.01 -11.35 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -41.48 -7.57 -8.71 -42.26 -7.67 -8.41 37.19 29.24 15.05 36.55 29.11 14.54 1qrz_c21 source 1qrz PLASMINOGEN : 5 hits 1qrz_c21 naa= 3 ULMN 3 1qrz_c22 PLASMINOGEN user 1 3 # 1 C 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 C 646 ASP A 16 ASP~? 19.78 O1 GOL B 126 C 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 49.34 38.44 7.48 47.30 38.27 7.99 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 55.39 45.97 3.05 55.87 45.57 5.11 coo 7.82 1.25 3.03 7.30 1.31 3.65 45.00 36.12 -4.79 45.64 35.72 -4.41 ULMN 3 1qrz_c22 PLASMINOGEN user 2 3 # 2 C 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 C 646 ASP A 84 ASP.? -3.46 O1 GOL A 201s C 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 49.34 38.44 7.48 47.30 38.27 7.99 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 49.74 30.72 10.50 50.57 30.42 12.42 coo 7.82 1.25 3.03 7.30 1.31 3.65 45.00 36.12 -4.79 45.64 35.72 -4.41 ULMN 3 1qrz_c22 PLASMINOGEN user 3 3 # 3 C 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 C 646 ASP B 16 ASP~? 19.71 O9 UNL A 200 C 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 32.69 38.40 6.72 34.73 38.60 6.25 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 26.40 41.60 14.58 25.93 42.50 12.70 coo 7.82 1.25 3.03 7.30 1.31 3.65 37.19 29.24 15.05 36.55 29.11 14.54 ULMN 3 1qrz_c22 PLASMINOGEN user 4 3 # 4 C 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 C 646 ASP B 84 ASP.? -3.52 O9 UNL A 200s C 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo 1.49 -9.23 8.48 -0.19 -8.40 9.43 32.69 38.40 6.72 34.73 38.60 6.25 coo 9.05 -13.82 8.74 8.78 -14.02 10.85 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 7.82 1.25 3.03 7.30 1.31 3.65 37.19 29.24 15.05 36.55 29.11 14.54 1qrz_c22 source 1qrz PLASMINOGEN : 4 hits 1qrz_c22 naa= 3 ULMN 3 1qrz_c23 PLASMINOGEN user 1 3 # 1 D 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 D 646 ASP A 16 ASP~? 19.78 O1 GOL B 126 D 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 49.34 38.44 7.48 47.30 38.27 7.99 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 55.39 45.97 3.05 55.87 45.57 5.11 coo -45.82 1.31 41.67 -46.38 1.39 42.31 45.00 36.12 -4.79 45.64 35.72 -4.41 ULMN 3 1qrz_c23 PLASMINOGEN user 2 3 # 2 D 603 HIS A 61 HIS^? 9.47 O2 GOL B 126 D 646 ASP A 84 ASP.? -3.46 O1 GOL A 201s D 739 GLY A 54 GLY^? 6.16 O1 UNL A 200 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 49.34 38.44 7.48 47.30 38.27 7.99 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 49.74 30.72 10.50 50.57 30.42 12.42 coo -45.82 1.31 41.67 -46.38 1.39 42.31 45.00 36.12 -4.79 45.64 35.72 -4.41 ULMN 3 1qrz_c23 PLASMINOGEN user 3 3 # 3 D 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 D 646 ASP B 16 ASP~? 19.71 O9 UNL A 200 D 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 32.69 38.40 6.72 34.73 38.60 6.25 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 26.40 41.60 14.58 25.93 42.50 12.70 coo -45.82 1.31 41.67 -46.38 1.39 42.31 37.19 29.24 15.05 36.55 29.11 14.54 ULMN 3 1qrz_c23 PLASMINOGEN user 4 3 # 4 D 603 HIS B 61 HIS^? 10.01 O3 UNL A 200 D 646 ASP B 84 ASP.? -3.52 O9 UNL A 200s D 739 GLY B 54 GLY^? 6.15 C3 GOL B 126 coo -52.57 -8.94 46.70 -54.06 -7.64 47.39 32.69 38.40 6.72 34.73 38.60 6.25 coo -45.30 -14.04 46.94 -45.65 -14.15 49.00 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -45.82 1.31 41.67 -46.38 1.39 42.31 37.19 29.24 15.05 36.55 29.11 14.54 1qrz_c23 source 1qrz PLASMINOGEN : 4 hits 1qrz_c23 naa= 3 ULMN 3 1qz9_c02 KYNURENINASE user 1 3 # 1 A 129 PHE A 45 PHE^? 13.75 O1 UNL A 200 A 201 ASP A 47 ASP^? 15.55 CL CL B 123 A 227 LYS A 39 LYS^? 9.22 O10 UNL A 200 coo 23.39 49.81 32.16 21.33 51.68 32.26 49.20 35.83 -10.55 51.58 37.30 -10.35 coo 25.52 45.12 37.98 23.98 46.65 37.85 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 12.68 46.83 36.69 18.26 48.67 34.51 38.86 41.59 -9.23 36.85 38.97 -13.00 ULMN 3 1qz9_c02 KYNURENINASE user 2 3 # 2 A 129 PHE B 45 PHE^? 13.55 C3 GOL B 126 A 201 ASP B 47 ASP^? 15.68 CL CL A 123 A 227 LYS B 39 LYS^? -2.66 O2 GOL B 125s coo 23.39 49.81 32.16 21.33 51.68 32.26 32.99 25.50 19.27 30.62 26.78 19.90 coo 25.52 45.12 37.98 23.98 46.65 37.85 36.24 17.92 20.25 35.18 16.23 20.89 coo 12.68 46.83 36.69 18.26 48.67 34.51 43.23 31.03 22.06 45.10 26.50 23.58 1qz9_c02 source 1qz9 KYNURENINASE : 2 hits 1qz9_c02 naa= 3 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 1 3 # 1 A 608 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 610 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 661 HIS A 61 HIS^? 9.47 O2 GOL B 126 coo 75.99 81.56 1.86 73.91 81.34 2.28 49.74 30.72 10.50 50.57 30.42 12.42 coo 71.04 78.84 0.46 71.54 76.90 1.02 47.38 26.60 7.09 47.11 24.76 8.07 coo 75.40 81.38 12.06 74.88 79.42 12.63 49.34 38.44 7.48 47.30 38.27 7.99 ULMN 3 1req_c10 METHYLMALONYL-COA MUTASE user 2 3 # 2 A 608 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 610 HIS B 85 HIS^? -3.53 O6 UNL A 200s A 661 HIS B 61 HIS^? 10.01 O3 UNL A 200 coo 75.99 81.56 1.86 73.91 81.34 2.28 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 71.04 78.84 0.46 71.54 76.90 1.02 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 75.40 81.38 12.06 74.88 79.42 12.63 32.69 38.40 6.72 34.73 38.60 6.25 1req_c10 source 1req METHYLMALONYL-COA MUTASE : 2 hits 1req_c10 naa= 3 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 1 3 # 1 C 608 ASP A 84 ASP.? -3.46 O1 GOL A 201s C 610 HIS A 85 HIS^? 3.67 O3 GOL A 201s C 661 HIS A 61 HIS^? 9.47 O2 GOL B 126 coo -17.65 80.52 58.00 -16.23 80.79 56.41 49.74 30.72 10.50 50.57 30.42 12.42 coo -16.56 83.18 53.03 -16.33 85.18 53.60 47.38 26.60 7.09 47.11 24.76 8.07 coo -8.38 80.78 62.24 -7.53 82.67 62.02 49.34 38.44 7.48 47.30 38.27 7.99 ULMN 3 1req_c11 METHYLMALONYL-COA MUTASE user 2 3 # 2 C 608 ASP B 84 ASP.? -3.52 O9 UNL A 200s C 610 HIS B 85 HIS^? -3.53 O6 UNL A 200s C 661 HIS B 61 HIS^? 10.01 O3 UNL A 200 coo -17.65 80.52 58.00 -16.23 80.79 56.41 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -16.56 83.18 53.03 -16.33 85.18 53.60 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -8.38 80.78 62.24 -7.53 82.67 62.02 32.69 38.40 6.72 34.73 38.60 6.25 1req_c11 source 1req METHYLMALONYL-COA MUTASE : 2 hits 1req_c11 naa= 3 ULMN 3 1rtf_c03 TWO CHAIN TISSUE PLASMINOGEN ACTIVATuser 1 3 # 1 B 57 HIS B 85 HIS^? -3.53 O6 UNL A 200s B 102 ASP B 84 ASP.? -3.52 O9 UNL A 200s B 195 SER B 86 SER^? -3.07 O1 UNL A 200s coo -4.60 27.52 42.88 -4.63 27.41 40.76 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -0.27 31.24 43.51 -1.49 29.62 42.98 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -2.83 25.96 36.71 -4.77 27.03 37.63 38.80 31.67 1.48 40.20 33.63 1.48 1rtf_c03 source 1rtf TWO CHAIN TISSUE PLASMINOGEN ACTIVATOR : 1 hits 1rtf_c03 naa= 3 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 1 3 # 1 A 104 ILE A 78 ILE~? 8.37 C2 GOL A 201 A 106 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 142 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -15.54 60.72 29.56 -16.71 61.53 30.10 51.89 25.33 4.26 50.78 26.08 3.81 coo -17.00 64.03 23.46 -18.21 65.65 22.90 47.38 26.60 7.09 47.11 24.76 8.07 coo -17.05 67.91 26.85 -18.66 66.47 26.76 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 2 3 # 2 A 104 ILE A 88 ILE^? 6.32 O3 GOL B 126 A 106 HIS B 85 HIS^? -3.53 O6 UNL A 200s A 142 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -15.54 60.72 29.56 -16.71 61.53 30.10 37.54 31.90 6.97 37.72 32.87 6.83 coo -17.00 64.03 23.46 -18.21 65.65 22.90 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -17.05 67.91 26.85 -18.66 66.47 26.76 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 3 3 # 3 A 104 ILE A 89 ILE^? 8.76 O6 UNL A 200 A 106 HIS B 85 HIS^? -3.53 O6 UNL A 200s A 142 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -15.54 60.72 29.56 -16.71 61.53 30.10 32.54 29.68 5.55 31.72 28.57 5.29 coo -17.00 64.03 23.46 -18.21 65.65 22.90 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -17.05 67.91 26.85 -18.66 66.47 26.76 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 4 3 # 4 A 104 ILE A 102 ILE~? 13.85 CL CL B 124 A 106 HIS A 103 HIS~? 11.95 CL CL B 124 A 142 ASP A 104 ASP~? 7.36 CL CL B 124 coo -15.54 60.72 29.56 -16.71 61.53 30.10 27.49 26.37 11.41 27.87 27.68 11.81 coo -17.00 64.03 23.46 -18.21 65.65 22.90 24.53 20.38 13.18 24.12 18.57 14.18 coo -17.05 67.91 26.85 -18.66 66.47 26.76 26.83 19.68 8.21 24.75 19.17 8.13 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 5 3 # 5 A 104 ILE A 106 ILE~? 12.84 CL CL B 124 A 106 HIS A 103 HIS~? 11.95 CL CL B 124 A 142 ASP A 104 ASP~? 7.36 CL CL B 124 coo -15.54 60.72 29.56 -16.71 61.53 30.10 30.45 21.25 14.38 30.21 22.01 15.55 coo -17.00 64.03 23.46 -18.21 65.65 22.90 24.53 20.38 13.18 24.12 18.57 14.18 coo -17.05 67.91 26.85 -18.66 66.47 26.76 26.83 19.68 8.21 24.75 19.17 8.13 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 6 3 # 6 A 104 ILE B 78 ILE~? 7.33 O6 UNL A 200 A 106 HIS B 85 HIS^? -3.53 O6 UNL A 200s A 142 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo -15.54 60.72 29.56 -16.71 61.53 30.10 30.66 26.01 1.23 31.74 26.31 2.04 coo -17.00 64.03 23.46 -18.21 65.65 22.90 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -17.05 67.91 26.85 -18.66 66.47 26.76 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 7 3 # 7 A 104 ILE B 88 ILE^? 6.84 O1 UNL A 200 A 106 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 142 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -15.54 60.72 29.56 -16.71 61.53 30.10 44.71 33.22 3.30 44.53 33.78 4.00 coo -17.00 64.03 23.46 -18.21 65.65 22.90 47.38 26.60 7.09 47.11 24.76 8.07 coo -17.05 67.91 26.85 -18.66 66.47 26.76 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 8 3 # 8 A 104 ILE B 89 ILE^? 9.19 O2 GOL A 201 A 106 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 142 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo -15.54 60.72 29.56 -16.71 61.53 30.10 49.77 30.80 3.05 50.65 29.74 2.65 coo -17.00 64.03 23.46 -18.21 65.65 22.90 47.38 26.60 7.09 47.11 24.76 8.07 coo -17.05 67.91 26.85 -18.66 66.47 26.76 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 9 3 # 9 A 104 ILE B 102 ILE~? 14.64 O1 UNL A 200 A 106 HIS B 103 HIS~? 20.60 O1 UNL A 200 A 142 ASP B 104 ASP~? 19.83 C2 GOL A 201 coo -15.54 60.72 29.56 -16.71 61.53 30.10 54.86 32.00 -3.81 54.47 33.27 -3.43 coo -17.00 64.03 23.46 -18.21 65.65 22.90 57.94 28.30 -8.81 58.37 27.44 -10.67 coo -17.05 67.91 26.85 -18.66 66.47 26.76 55.81 24.74 -5.14 57.90 24.34 -5.34 ULMN 3 1s3i_c00 10-FORMYLTETRAHYDROFOLATE DEHYDROGENuser 10 3 # 10 A 104 ILE B 106 ILE~? 14.55 O1 UNL A 200 A 106 HIS B 103 HIS~? 20.60 O1 UNL A 200 A 142 ASP B 104 ASP~? 19.83 C2 GOL A 201 coo -15.54 60.72 29.56 -16.71 61.53 30.10 51.93 29.56 -9.09 52.01 30.92 -9.62 coo -17.00 64.03 23.46 -18.21 65.65 22.90 57.94 28.30 -8.81 58.37 27.44 -10.67 coo -17.05 67.91 26.85 -18.66 66.47 26.76 55.81 24.74 -5.14 57.90 24.34 -5.34 1s3i_c00 source 1s3i 10-FORMYLTETRAHYDROFOLATE DEHYDROGENASE : 10 hits 1s3i_c00 naa= 3 ULMN 3 1sll_c00 SIALIDASE L user 1 3 # 1 318 ASP A 16 ASP~? 19.78 O1 GOL B 126 595 GLU A 21 GLU~? 22.63 O1 UNL A 200 713 TYR A 8 TYR~? 17.73 O1 UNL A 200 coo 5.64 2.82 38.49 4.59 4.19 37.25 55.39 45.97 3.05 55.87 45.57 5.11 coo 4.35 13.73 37.63 3.39 12.18 36.55 55.82 46.81 -6.36 56.64 48.78 -6.25 coo 3.76 10.25 31.38 3.16 9.87 34.10 50.16 48.46 -5.63 50.76 46.54 -7.56 ULMN 3 1sll_c00 SIALIDASE L user 2 3 # 2 318 ASP B 16 ASP~? 19.71 O9 UNL A 200 595 GLU B 21 GLU~? 22.82 C3 GOL B 126 713 TYR B 8 TYR~? 16.62 O1 GOL B 125 coo 5.64 2.82 38.49 4.59 4.19 37.25 26.40 41.60 14.58 25.93 42.50 12.70 coo 4.35 13.73 37.63 3.39 12.18 36.55 25.81 36.56 22.58 24.87 38.21 23.53 coo 3.76 10.25 31.38 3.16 9.87 34.10 31.46 38.27 23.11 30.63 35.63 23.45 1sll_c00 source 1sll SIALIDASE L : 2 hits 1sll_c00 naa= 3 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 1 3 # 1 E 166 ASP A 47 ASP^? 15.55 CL CL B 123 E 168 LYS B 113 LYS~? 7.99 CL CL B 123 E 201 THR B 109 THR~? 11.58 O1 UNL A 200 coo 5.36 16.20 22.10 3.88 17.00 23.31 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 5.06 22.32 18.11 1.02 22.08 22.74 43.28 23.93 -13.69 40.73 27.69 -10.11 coo -1.79 18.29 19.05 -1.19 20.28 19.71 47.32 25.04 -9.31 46.41 26.51 -8.00 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 2 3 # 2 E 166 ASP A 115 ASP.? 16.41 CL CL A 123 E 168 LYS A 113 LYS~? 7.84 CL CL A 123 E 201 THR A 117 THR.? 9.36 CL CL A 123 coo 5.36 16.20 22.10 3.88 17.00 23.31 42.06 8.77 16.59 40.52 7.32 16.97 coo 5.06 22.32 18.11 1.02 22.08 22.74 39.46 14.20 14.59 41.86 19.61 14.55 coo -1.79 18.29 19.05 -1.19 20.28 19.71 47.06 13.65 18.60 48.13 11.99 17.78 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 3 3 # 3 E 166 ASP B 47 ASP^? 15.68 CL CL A 123 E 168 LYS A 114 LYS.? 14.28 CL CL B 124 E 201 THR A 109 THR~? 11.26 CL CL B 124 coo 5.36 16.20 22.10 3.88 17.00 23.31 36.24 17.92 20.25 35.18 16.23 20.89 coo 5.06 22.32 18.11 1.02 22.08 22.74 38.24 11.42 16.94 34.01 7.82 14.29 coo -1.79 18.29 19.05 -1.19 20.28 19.71 35.30 17.54 11.93 36.10 19.55 11.83 ULMN 3 1stc_c02 CAMP-DEPENDENT PROTEIN KINASE user 4 3 # 4 E 166 ASP B 115 ASP.? 16.66 CL CL B 123 E 168 LYS B 113 LYS~? 7.99 CL CL B 123 E 201 THR B 117 THR.? 9.48 CL CL B 123 coo 5.36 16.20 22.10 3.88 17.00 23.31 40.90 20.11 -18.41 42.52 19.20 -19.45 coo 5.06 22.32 18.11 1.02 22.08 22.74 43.28 23.93 -13.69 40.73 27.69 -10.11 coo -1.79 18.29 19.05 -1.19 20.28 19.71 35.62 25.18 -17.07 34.59 23.37 -17.57 1stc_c02 source 1stc CAMP-DEPENDENT PROTEIN KINASE : 4 hits 1stc_c02 naa= 3 ULMN 3 1ti6_c06 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 A 144 HIS A 61 HIS^? 9.47 O2 GOL B 126 A 174 ASP A 16 ASP~? 19.78 O1 GOL B 126 A 404 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 18.51 -77.38 -39.07 19.76 -78.71 -38.04 49.34 38.44 7.48 47.30 38.27 7.99 coo 27.58 -77.64 -39.00 25.78 -78.57 -39.64 55.39 45.97 3.05 55.87 45.57 5.11 coo 14.43 -85.16 -40.78 16.47 -83.93 -39.31 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1ti6_c06 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 A 144 HIS B 61 HIS^? 10.01 O3 UNL A 200 A 174 ASP B 16 ASP~? 19.71 O9 UNL A 200 A 404 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 18.51 -77.38 -39.07 19.76 -78.71 -38.04 32.69 38.40 6.72 34.73 38.60 6.25 coo 27.58 -77.64 -39.00 25.78 -78.57 -39.64 26.40 41.60 14.58 25.93 42.50 12.70 coo 14.43 -85.16 -40.78 16.47 -83.93 -39.31 27.45 31.12 3.14 25.07 31.24 4.61 1ti6_c06 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 2 hits 1ti6_c06 naa= 3 ULMN 3 1ti6_c07 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 C 144 HIS A 61 HIS^? 9.47 O2 GOL B 126 C 174 ASP A 16 ASP~? 19.78 O1 GOL B 126 C 404 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo -15.55 89.08 -13.38 -16.05 90.98 -14.11 49.34 38.44 7.48 47.30 38.27 7.99 coo -23.98 91.31 -16.16 -21.94 90.86 -16.65 55.39 45.97 3.05 55.87 45.57 5.11 coo -8.89 91.06 -18.89 -11.23 91.99 -17.67 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1ti6_c07 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 C 144 HIS B 61 HIS^? 10.01 O3 UNL A 200 C 174 ASP B 16 ASP~? 19.71 O9 UNL A 200 C 404 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo -15.55 89.08 -13.38 -16.05 90.98 -14.11 32.69 38.40 6.72 34.73 38.60 6.25 coo -23.98 91.31 -16.16 -21.94 90.86 -16.65 26.40 41.60 14.58 25.93 42.50 12.70 coo -8.89 91.06 -18.89 -11.23 91.99 -17.67 27.45 31.12 3.14 25.07 31.24 4.61 1ti6_c07 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 2 hits 1ti6_c07 naa= 3 ULMN 3 1ti6_c08 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 E 144 HIS A 61 HIS^? 9.47 O2 GOL B 126 E 174 ASP A 16 ASP~? 19.78 O1 GOL B 126 E 404 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo -7.53-107.59 75.19 -8.14-106.04 76.47 49.34 38.44 7.48 47.30 38.27 7.99 coo -3.55-105.39 83.13 -5.21-106.24 82.09 55.39 45.97 3.05 55.87 45.57 5.11 coo -16.31-108.78 75.35 -14.20-107.14 76.16 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1ti6_c08 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 E 144 HIS B 61 HIS^? 10.01 O3 UNL A 200 E 174 ASP B 16 ASP~? 19.71 O9 UNL A 200 E 404 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo -7.53-107.59 75.19 -8.14-106.04 76.47 32.69 38.40 6.72 34.73 38.60 6.25 coo -3.55-105.39 83.13 -5.21-106.24 82.09 26.40 41.60 14.58 25.93 42.50 12.70 coo -16.31-108.78 75.35 -14.20-107.14 76.16 27.45 31.12 3.14 25.07 31.24 4.61 1ti6_c08 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 2 hits 1ti6_c08 naa= 3 ULMN 3 1ti6_c09 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 G 144 HIS A 61 HIS^? 9.47 O2 GOL B 126 G 174 ASP A 16 ASP~? 19.78 O1 GOL B 126 G 404 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 60.48-101.16 45.95 60.56-101.20 43.85 49.34 38.44 7.48 47.30 38.27 7.99 coo 58.10-108.15 40.62 59.57-106.86 41.51 55.39 45.97 3.05 55.87 45.57 5.11 coo 68.57 -97.60 44.49 66.22 -98.53 43.28 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1ti6_c09 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 G 144 HIS B 61 HIS^? 10.01 O3 UNL A 200 G 174 ASP B 16 ASP~? 19.71 O9 UNL A 200 G 404 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 60.48-101.16 45.95 60.56-101.20 43.85 32.69 38.40 6.72 34.73 38.60 6.25 coo 58.10-108.15 40.62 59.57-106.86 41.51 26.40 41.60 14.58 25.93 42.50 12.70 coo 68.57 -97.60 44.49 66.22 -98.53 43.28 27.45 31.12 3.14 25.07 31.24 4.61 1ti6_c09 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 2 hits 1ti6_c09 naa= 3 ULMN 3 1ti6_c10 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 I 144 HIS A 61 HIS^? 9.47 O2 GOL B 126 I 174 ASP A 16 ASP~? 19.78 O1 GOL B 126 I 404 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo -12.68 -17.50 91.59 -12.79 -19.47 92.31 49.34 38.44 7.48 47.30 38.27 7.99 coo -20.27 -21.99 93.95 -18.47 -20.99 94.50 55.39 45.97 3.05 55.87 45.57 5.11 coo -5.95 -17.59 97.43 -7.86 -19.17 96.13 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1ti6_c10 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 I 144 HIS B 61 HIS^? 10.01 O3 UNL A 200 I 174 ASP B 16 ASP~? 19.71 O9 UNL A 200 I 404 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo -12.68 -17.50 91.59 -12.79 -19.47 92.31 32.69 38.40 6.72 34.73 38.60 6.25 coo -20.27 -21.99 93.95 -18.47 -20.99 94.50 26.40 41.60 14.58 25.93 42.50 12.70 coo -5.95 -17.59 97.43 -7.86 -19.17 96.13 27.45 31.12 3.14 25.07 31.24 4.61 1ti6_c10 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 2 hits 1ti6_c10 naa= 3 ULMN 3 1ti6_c11 PYROGALLOL HYDROXYTRANSFERASE SMALL user 1 3 # 1 K 144 HIS A 61 HIS^? 9.47 O2 GOL B 126 K 174 ASP A 16 ASP~? 19.78 O1 GOL B 126 K 404 TYR A 83 TYR.? 10.52 O1 GOL A 201 coo 100.18 26.45 -1.32 99.24 26.12 0.53 49.34 38.44 7.48 47.30 38.27 7.99 coo 102.36 30.86 6.31 102.45 29.08 5.12 55.39 45.97 3.05 55.87 45.57 5.11 coo 99.93 17.48 -0.85 99.14 19.86 0.39 54.83 30.60 5.85 57.08 31.79 4.69 ULMN 3 1ti6_c11 PYROGALLOL HYDROXYTRANSFERASE SMALL user 2 3 # 2 K 144 HIS B 61 HIS^? 10.01 O3 UNL A 200 K 174 ASP B 16 ASP~? 19.71 O9 UNL A 200 K 404 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 100.18 26.45 -1.32 99.24 26.12 0.53 32.69 38.40 6.72 34.73 38.60 6.25 coo 102.36 30.86 6.31 102.45 29.08 5.12 26.40 41.60 14.58 25.93 42.50 12.70 coo 99.93 17.48 -0.85 99.14 19.86 0.39 27.45 31.12 3.14 25.07 31.24 4.61 1ti6_c11 source 1ti6 PYROGALLOL HYDROXYTRANSFERASE SMALL SUBUNIT : 2 hits 1ti6_c11 naa= 3 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 1 3 # 1 A 250 ALA A 81 ALA~? 11.29 O1 GOL A 201 A 251 GLY A 82 GLY~? 7.92 O1 GOL A 201 A 252 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 58.12 26.30 5.80 57.53 26.81 4.51 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 56.82 27.71 9.09 56.39 27.85 8.44 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1tz3_c02 PUTATIVE SUGAR KINASE user 2 3 # 2 A 250 ALA B 81 ALA~? 10.96 O6 UNL A 200 A 251 GLY B 82 GLY~? 8.35 O7 UNL A 200 A 252 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 27.46 -16.39 -4.13 28.50 -15.30 -4.20 24.43 27.45 0.43 25.05 27.08 1.79 coo 24.64 -14.61 -2.31 24.63 -15.34 -2.63 25.71 30.64 -1.30 26.07 30.37 -0.67 coo 21.52 -17.78 -4.15 20.67 -16.16 -5.23 29.26 26.18 -3.96 31.36 26.46 -4.14 1tz3_c02 source 1tz3 PUTATIVE SUGAR KINASE : 2 hits 1tz3_c02 naa= 3 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 1 3 # 1 B 250 ALA A 81 ALA~? 11.29 O1 GOL A 201 B 251 GLY A 82 GLY~? 7.92 O1 GOL A 201 B 252 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 58.12 26.30 5.80 57.53 26.81 4.51 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 56.82 27.71 9.09 56.39 27.85 8.44 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1tz3_c03 PUTATIVE SUGAR KINASE user 2 3 # 2 B 250 ALA B 81 ALA~? 10.96 O6 UNL A 200 B 251 GLY B 82 GLY~? 8.35 O7 UNL A 200 B 252 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 16.60 -23.26 -48.35 15.78 -24.48 -48.70 24.43 27.45 0.43 25.05 27.08 1.79 coo 14.17 -20.48 -49.26 14.89 -20.41 -48.91 25.71 30.64 -1.30 26.07 30.37 -0.67 coo 16.67 -17.59 -46.30 15.00 -17.34 -45.02 29.26 26.18 -3.96 31.36 26.46 -4.14 1tz3_c03 source 1tz3 PUTATIVE SUGAR KINASE : 2 hits 1tz3_c03 naa= 3 ULMN 3 1uk7_c00 3.07.01.0009 user 1 3 # 1 A 103 ALA A 116 ALA.? 8.95 CL CL A 123 A 224 ASP B 47 ASP^? 15.68 CL CL A 123 A 252 HIS B 48 HIS.? 12.72 CL CL A 123 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 43.77 13.30 16.69 43.18 14.66 16.33 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 36.24 17.92 20.25 35.18 16.23 20.89 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 39.28 14.76 21.81 39.53 14.41 19.75 ULMN 3 1uk7_c00 3.07.01.0009 user 2 3 # 2 A 103 ALA B 116 ALA.? 9.15 CL CL B 123 A 224 ASP A 47 ASP^? 15.55 CL CL B 123 A 252 HIS A 48 HIS.? 12.89 CL CL B 123 coo 10.74 41.88 -3.62 10.55 41.61 -5.11 38.93 23.71 -15.82 39.49 24.61 -14.68 coo 7.52 49.49 -8.72 7.95 47.43 -8.44 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 9.83 44.81 -9.44 9.32 43.66 -7.77 43.31 28.55 -18.97 43.37 26.94 -17.63 1uk7_c00 source 1uk7 3.07.01.0009 : 2 hits 1uk7_c00 naa= 3 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 79 ASP~? 6.09 O1 GOL A 201 218 GLU A 37 GLU^? 12.49 O10 UNL A 200 329 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 49.16 35.16 15.19 51.08 34.43 15.65 53.25 22.44 8.57 51.13 22.57 8.85 coo 70.09 11.71 8.46 70.56 12.89 6.77 42.91 39.28 -14.45 41.15 38.40 -15.23 coo 59.16 37.82 13.95 57.63 37.03 15.12 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 79 ASP~? 6.09 O1 GOL A 201 218 GLU A 99 GLU~? 18.98 CL CL B 124 329 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 49.16 35.16 15.19 51.08 34.43 15.65 53.25 22.44 8.57 51.13 22.57 8.85 coo 70.09 11.71 8.46 70.56 12.89 6.77 22.47 28.68 12.84 21.91 29.15 14.84 coo 59.16 37.82 13.95 57.63 37.03 15.12 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP A 79 ASP~? 6.09 O1 GOL A 201 218 GLU B 21 GLU~? 22.82 C3 GOL B 126 329 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 49.16 35.16 15.19 51.08 34.43 15.65 53.25 22.44 8.57 51.13 22.57 8.85 coo 70.09 11.71 8.46 70.56 12.89 6.77 25.81 36.56 22.58 24.87 38.21 23.53 coo 59.16 37.82 13.95 57.63 37.03 15.12 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP A 98 ASP~? 12.55 CL CL B 124 218 GLU A 6 GLU~? 17.70 O10 UNL A 200 329 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 49.16 35.16 15.19 51.08 34.43 15.65 23.35 28.15 6.47 22.62 26.21 5.89 coo 70.09 11.71 8.46 70.56 12.89 6.77 42.72 53.59 -4.75 40.65 53.84 -4.60 coo 59.16 37.82 13.95 57.63 37.03 15.12 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 5 3 # 5 199 ASP A 104 ASP~? 7.36 CL CL B 124 218 GLU A 37 GLU^? 12.49 O10 UNL A 200 329 ASP A 98 ASP~? 12.55 CL CL B 124 coo 49.16 35.16 15.19 51.08 34.43 15.65 26.83 19.68 8.21 24.75 19.17 8.13 coo 70.09 11.71 8.46 70.56 12.89 6.77 42.91 39.28 -14.45 41.15 38.40 -15.23 coo 59.16 37.82 13.95 57.63 37.03 15.12 23.35 28.15 6.47 22.62 26.21 5.89 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 6 3 # 6 199 ASP A 104 ASP~? 7.36 CL CL B 124 218 GLU B 6 GLU~? 12.54 O1 GOL B 125 329 ASP A 98 ASP~? 12.55 CL CL B 124 coo 49.16 35.16 15.19 51.08 34.43 15.65 26.83 19.68 8.21 24.75 19.17 8.13 coo 70.09 11.71 8.46 70.56 12.89 6.77 39.33 43.17 24.20 41.41 43.06 24.69 coo 59.16 37.82 13.95 57.63 37.03 15.12 23.35 28.15 6.47 22.62 26.21 5.89 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 7 3 # 7 199 ASP A 115 ASP.? 16.41 CL CL A 123 218 GLU B 21 GLU~? 22.82 C3 GOL B 126 329 ASP A 111 ASP~? 10.94 CL CL B 124 coo 49.16 35.16 15.19 51.08 34.43 15.65 42.06 8.77 16.59 40.52 7.32 16.97 coo 70.09 11.71 8.46 70.56 12.89 6.77 25.81 36.56 22.58 24.87 38.21 23.53 coo 59.16 37.82 13.95 57.63 37.03 15.12 33.22 12.10 12.41 33.55 10.10 11.76 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 8 3 # 8 199 ASP B 79 ASP~? 3.97 O7 UNL A 200 218 GLU A 21 GLU~? 22.63 O1 UNL A 200 329 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 49.16 35.16 15.19 51.08 34.43 15.65 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 70.09 11.71 8.46 70.56 12.89 6.77 55.82 46.81 -6.36 56.64 48.78 -6.25 coo 59.16 37.82 13.95 57.63 37.03 15.12 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 9 3 # 9 199 ASP B 79 ASP~? 3.97 O7 UNL A 200 218 GLU B 37 GLU^? 6.72 O2 GOL B 125 329 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 49.16 35.16 15.19 51.08 34.43 15.65 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 70.09 11.71 8.46 70.56 12.89 6.77 39.03 25.88 24.92 40.77 24.72 25.06 coo 59.16 37.82 13.95 57.63 37.03 15.12 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 10 3 # 10 199 ASP B 79 ASP~? 3.97 O7 UNL A 200 218 GLU B 99 GLU~? 20.37 O1 UNL A 200 329 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 49.16 35.16 15.19 51.08 34.43 15.65 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 70.09 11.71 8.46 70.56 12.89 6.77 59.74 34.86 -3.51 60.17 36.42 -4.90 coo 59.16 37.82 13.95 57.63 37.03 15.12 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 11 3 # 11 199 ASP B 98 ASP~? 15.88 O1 GOL A 201 218 GLU B 6 GLU~? 12.54 O1 GOL B 125 329 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 59.21 30.58 1.37 59.85 28.74 0.55 coo 70.09 11.71 8.46 70.56 12.89 6.77 39.33 43.17 24.20 41.41 43.06 24.69 coo 59.16 37.82 13.95 57.63 37.03 15.12 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 12 3 # 12 199 ASP B 104 ASP~? 19.83 C2 GOL A 201 218 GLU A 6 GLU~? 17.70 O10 UNL A 200 329 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 55.81 24.74 -5.14 57.90 24.34 -5.34 coo 70.09 11.71 8.46 70.56 12.89 6.77 42.72 53.59 -4.75 40.65 53.84 -4.60 coo 59.16 37.82 13.95 57.63 37.03 15.12 59.21 30.58 1.37 59.85 28.74 0.55 ULMN 3 1uok_c04 OLIGO-1,6-GLUCOSIDASE user 13 3 # 13 199 ASP B 115 ASP.? 16.66 CL CL B 123 218 GLU A 21 GLU~? 22.63 O1 UNL A 200 329 ASP B 111 ASP~? 19.61 CL CL B 123 coo 49.16 35.16 15.19 51.08 34.43 15.65 40.90 20.11 -18.41 42.52 19.20 -19.45 coo 70.09 11.71 8.46 70.56 12.89 6.77 55.82 46.81 -6.36 56.64 48.78 -6.25 coo 59.16 37.82 13.95 57.63 37.03 15.12 49.48 21.08 -13.06 49.20 19.08 -13.70 1uok_c04 source 1uok OLIGO-1,6-GLUCOSIDASE : 13 hits 1uok_c04 naa= 3 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 1 3 # 1 199 ASP A 79 ASP~? 6.09 O1 GOL A 201 242 GLU B 37 GLU^? 6.72 O2 GOL B 125 329 ASP B 98 ASP~? 15.88 O1 GOL A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 53.25 22.44 8.57 51.13 22.57 8.85 coo 30.42 34.74 5.00 29.09 35.09 3.38 39.03 25.88 24.92 40.77 24.72 25.06 coo 59.16 37.82 13.95 57.63 37.03 15.12 59.21 30.58 1.37 59.85 28.74 0.55 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 2 3 # 2 199 ASP A 84 ASP.? -3.46 O1 GOL A 201s 242 GLU B 6 GLU~? 12.54 O1 GOL B 125 329 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 49.16 35.16 15.19 51.08 34.43 15.65 49.74 30.72 10.50 50.57 30.42 12.42 coo 30.42 34.74 5.00 29.09 35.09 3.38 39.33 43.17 24.20 41.41 43.06 24.69 coo 59.16 37.82 13.95 57.63 37.03 15.12 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 3 3 # 3 199 ASP B 79 ASP~? 3.97 O7 UNL A 200 242 GLU A 37 GLU^? 12.49 O10 UNL A 200 329 ASP A 98 ASP~? 12.55 CL CL B 124 coo 49.16 35.16 15.19 51.08 34.43 15.65 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 30.42 34.74 5.00 29.09 35.09 3.38 42.91 39.28 -14.45 41.15 38.40 -15.23 coo 59.16 37.82 13.95 57.63 37.03 15.12 23.35 28.15 6.47 22.62 26.21 5.89 ULMN 3 1uok_c05 OLIGO-1,6-GLUCOSIDASE user 4 3 # 4 199 ASP B 84 ASP.? -3.52 O9 UNL A 200s 242 GLU A 6 GLU~? 17.70 O10 UNL A 200 329 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 49.16 35.16 15.19 51.08 34.43 15.65 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 30.42 34.74 5.00 29.09 35.09 3.38 42.72 53.59 -4.75 40.65 53.84 -4.60 coo 59.16 37.82 13.95 57.63 37.03 15.12 29.26 26.18 -3.96 31.36 26.46 -4.14 1uok_c05 source 1uok OLIGO-1,6-GLUCOSIDASE : 4 hits 1uok_c05 naa= 3 ULMN 3 1vq1_c00 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 1 3 # 1 A 100 PHE B 55 PHE^? 10.40 O3 GOL B 126 A 197 ASN B 56 ASN^? 7.10 O2 GOL B 126 A 198 PRO B 57 PRO^? 12.24 O2 GOL B 126 coo 5.24 -2.19 28.74 3.83 -0.30 30.29 33.44 31.32 15.89 32.17 28.85 15.98 coo 6.86 -1.03 36.13 5.08 -0.39 35.24 37.58 36.28 13.48 39.18 36.45 14.91 coo 3.80 -4.83 39.13 4.75 -4.51 37.10 34.56 40.10 15.36 34.48 38.74 13.59 1vq1_c00 source 1vq1 N5-GLUTAMINE METHYLTRANSFERASE, HEMK : 1 hits 1vq1_c00 naa= 3 ULMN 3 1vq1_c01 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 1 3 # 1 B 100 PHE A 55 PHE^? 10.34 O1 UNL A 200 B 197 ASN A 56 ASN^? 8.14 O1 UNL A 200 B 198 PRO A 57 PRO^? 12.75 O1 UNL A 200 coo 15.92 -14.38 -0.49 15.85 -16.40 -2.42 48.64 38.35 -4.19 49.98 36.56 -5.84 coo 21.71 -15.65 -5.30 19.75 -16.44 -5.47 44.33 40.68 0.78 42.68 41.57 -0.30 coo 21.24 -11.77 -9.43 20.56 -12.14 -7.31 47.39 44.96 1.47 47.42 42.81 2.16 ULMN 3 1vq1_c01 N5-GLUTAMINE METHYLTRANSFERASE, HEMKuser 2 3 # 2 B 100 PHE B 55 PHE^? 10.40 O3 GOL B 126 B 197 ASN B 56 ASN^? 7.10 O2 GOL B 126 B 198 PRO B 57 PRO^? 12.24 O2 GOL B 126 coo 15.92 -14.38 -0.49 15.85 -16.40 -2.42 33.44 31.32 15.89 32.17 28.85 15.98 coo 21.71 -15.65 -5.30 19.75 -16.44 -5.47 37.58 36.28 13.48 39.18 36.45 14.91 coo 21.24 -11.77 -9.43 20.56 -12.14 -7.31 34.56 40.10 15.36 34.48 38.74 13.59 1vq1_c01 source 1vq1 N5-GLUTAMINE METHYLTRANSFERASE, HEMK : 2 hits 1vq1_c01 naa= 3 ULMN 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 1 3 # 1 A 105 ALA A 116 ALA.? 8.95 CL CL A 123 A 244 ASP B 47 ASP^? 15.68 CL CL A 123 A 271 HIS B 48 HIS.? 12.72 CL CL A 123 coo 15.05 3.71 6.93 14.58 4.88 7.78 43.77 13.30 16.69 43.18 14.66 16.33 coo 9.85 8.15 0.76 10.61 7.04 2.39 36.24 17.92 20.25 35.18 16.23 20.89 coo 10.61 7.65 6.01 12.39 6.55 6.23 39.28 14.76 21.81 39.53 14.41 19.75 ULMN 3 1xqw_c00 PROLINE IMINOPEPTIDASE user 2 3 # 2 A 105 ALA B 116 ALA.? 9.15 CL CL B 123 A 244 ASP A 47 ASP^? 15.55 CL CL B 123 A 271 HIS A 48 HIS.? 12.89 CL CL B 123 coo 15.05 3.71 6.93 14.58 4.88 7.78 38.93 23.71 -15.82 39.49 24.61 -14.68 coo 9.85 8.15 0.76 10.61 7.04 2.39 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 10.61 7.65 6.01 12.39 6.55 6.23 43.31 28.55 -18.97 43.37 26.94 -17.63 1xqw_c00 source 1xqw PROLINE IMINOPEPTIDASE : 2 hits 1xqw_c00 naa= 3 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 1 3 # 1 B 137 GLY A 2 GLY.? 13.94 O10 UNL A 200 B 175 ARG A 10 ARG.? 13.47 O10 UNL A 200 B 242 TYR A 8 TYR~? 17.73 O1 UNL A 200 coo 99.45 58.28 3.33 99.57 58.61 4.10 38.70 50.40 -5.40 38.34 50.14 -6.11 coo 106.37 63.53 0.89 108.02 63.40 -1.62 43.37 48.97 1.15 41.93 48.51 -1.56 coo 100.93 69.04 4.38 99.52 68.48 2.09 50.16 48.46 -5.63 50.76 46.54 -7.56 ULMN 3 1xva_c03 GLYCINE N-METHYLTRANSFERASE user 2 3 # 2 B 137 GLY B 2 GLY.? 8.93 O1 GOL B 125 B 175 ARG B 10 ARG.? 11.05 O1 GOL B 125 B 242 TYR B 8 TYR~? 16.62 O1 GOL B 125 coo 99.45 58.28 3.33 99.57 58.61 4.10 43.18 39.77 25.06 43.33 38.96 25.22 coo 106.37 63.53 0.89 108.02 63.40 -1.62 38.06 41.77 18.55 40.34 40.33 20.11 coo 100.93 69.04 4.38 99.52 68.48 2.09 31.46 38.27 23.11 30.63 35.63 23.45 1xva_c03 source 1xva GLYCINE N-METHYLTRANSFERASE : 2 hits 1xva_c03 naa= 3 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 1 3 # 1 A 369 ASP A 47 ASP^? 15.55 CL CL B 123 A 371 LYS B 113 LYS~? 7.99 CL CL B 123 A 407 THR A 50 THR^? 9.21 CL CL B 123 coo -5.17 31.09 15.73 -7.07 31.12 16.73 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -4.43 30.92 22.89 -6.61 31.91 19.71 43.28 23.93 -13.69 40.73 27.69 -10.11 coo -8.38 36.02 19.06 -8.83 34.10 19.89 40.57 30.50 -14.04 41.23 28.58 -14.86 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 2 3 # 2 A 369 ASP A 47 ASP^? 15.55 CL CL B 123 A 371 LYS B 113 LYS~? 7.99 CL CL B 123 A 407 THR B 109 THR~? 11.58 O1 UNL A 200 coo -5.17 31.09 15.73 -7.07 31.12 16.73 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -4.43 30.92 22.89 -6.61 31.91 19.71 43.28 23.93 -13.69 40.73 27.69 -10.11 coo -8.38 36.02 19.06 -8.83 34.10 19.89 47.32 25.04 -9.31 46.41 26.51 -8.00 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 3 3 # 3 A 369 ASP A 111 ASP~? 10.94 CL CL B 124 A 371 LYS A 113 LYS~? 7.84 CL CL A 123 A 407 THR A 109 THR~? 11.26 CL CL B 124 coo -5.17 31.09 15.73 -7.07 31.12 16.73 33.22 12.10 12.41 33.55 10.10 11.76 coo -4.43 30.92 22.89 -6.61 31.91 19.71 39.46 14.20 14.59 41.86 19.61 14.55 coo -8.38 36.02 19.06 -8.83 34.10 19.89 35.30 17.54 11.93 36.10 19.55 11.83 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 4 3 # 4 A 369 ASP A 111 ASP~? 10.94 CL CL B 124 A 371 LYS A 114 LYS.? 14.28 CL CL B 124 A 407 THR A 109 THR~? 11.26 CL CL B 124 coo -5.17 31.09 15.73 -7.07 31.12 16.73 33.22 12.10 12.41 33.55 10.10 11.76 coo -4.43 30.92 22.89 -6.61 31.91 19.71 38.24 11.42 16.94 34.01 7.82 14.29 coo -8.38 36.02 19.06 -8.83 34.10 19.89 35.30 17.54 11.93 36.10 19.55 11.83 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 5 3 # 5 A 369 ASP A 115 ASP.? 16.41 CL CL A 123 A 371 LYS A 113 LYS~? 7.84 CL CL A 123 A 407 THR A 117 THR.? 9.36 CL CL A 123 coo -5.17 31.09 15.73 -7.07 31.12 16.73 42.06 8.77 16.59 40.52 7.32 16.97 coo -4.43 30.92 22.89 -6.61 31.91 19.71 39.46 14.20 14.59 41.86 19.61 14.55 coo -8.38 36.02 19.06 -8.83 34.10 19.89 47.06 13.65 18.60 48.13 11.99 17.78 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 6 3 # 6 A 369 ASP B 47 ASP^? 15.68 CL CL A 123 A 371 LYS A 113 LYS~? 7.84 CL CL A 123 A 407 THR A 109 THR~? 11.26 CL CL B 124 coo -5.17 31.09 15.73 -7.07 31.12 16.73 36.24 17.92 20.25 35.18 16.23 20.89 coo -4.43 30.92 22.89 -6.61 31.91 19.71 39.46 14.20 14.59 41.86 19.61 14.55 coo -8.38 36.02 19.06 -8.83 34.10 19.89 35.30 17.54 11.93 36.10 19.55 11.83 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 7 3 # 7 A 369 ASP B 47 ASP^? 15.68 CL CL A 123 A 371 LYS A 113 LYS~? 7.84 CL CL A 123 A 407 THR B 50 THR^? 8.67 CL CL A 123 coo -5.17 31.09 15.73 -7.07 31.12 16.73 36.24 17.92 20.25 35.18 16.23 20.89 coo -4.43 30.92 22.89 -6.61 31.91 19.71 39.46 14.20 14.59 41.86 19.61 14.55 coo -8.38 36.02 19.06 -8.83 34.10 19.89 41.85 19.42 19.33 41.41 17.97 17.75 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 8 3 # 8 A 369 ASP B 47 ASP^? 15.68 CL CL A 123 A 371 LYS A 114 LYS.? 14.28 CL CL B 124 A 407 THR A 109 THR~? 11.26 CL CL B 124 coo -5.17 31.09 15.73 -7.07 31.12 16.73 36.24 17.92 20.25 35.18 16.23 20.89 coo -4.43 30.92 22.89 -6.61 31.91 19.71 38.24 11.42 16.94 34.01 7.82 14.29 coo -8.38 36.02 19.06 -8.83 34.10 19.89 35.30 17.54 11.93 36.10 19.55 11.83 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 9 3 # 9 A 369 ASP B 47 ASP^? 15.68 CL CL A 123 A 371 LYS A 114 LYS.? 14.28 CL CL B 124 A 407 THR B 50 THR^? 8.67 CL CL A 123 coo -5.17 31.09 15.73 -7.07 31.12 16.73 36.24 17.92 20.25 35.18 16.23 20.89 coo -4.43 30.92 22.89 -6.61 31.91 19.71 38.24 11.42 16.94 34.01 7.82 14.29 coo -8.38 36.02 19.06 -8.83 34.10 19.89 41.85 19.42 19.33 41.41 17.97 17.75 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 10 3 # 10 A 369 ASP B 111 ASP~? 19.61 CL CL B 123 A 371 LYS B 113 LYS~? 7.99 CL CL B 123 A 407 THR B 109 THR~? 11.58 O1 UNL A 200 coo -5.17 31.09 15.73 -7.07 31.12 16.73 49.48 21.08 -13.06 49.20 19.08 -13.70 coo -4.43 30.92 22.89 -6.61 31.91 19.71 43.28 23.93 -13.69 40.73 27.69 -10.11 coo -8.38 36.02 19.06 -8.83 34.10 19.89 47.32 25.04 -9.31 46.41 26.51 -8.00 ULMN 3 1zrz_c02 PROTEIN KINASE C, IOTA user 11 3 # 11 A 369 ASP B 115 ASP.? 16.66 CL CL B 123 A 371 LYS B 113 LYS~? 7.99 CL CL B 123 A 407 THR B 117 THR.? 9.48 CL CL B 123 coo -5.17 31.09 15.73 -7.07 31.12 16.73 40.90 20.11 -18.41 42.52 19.20 -19.45 coo -4.43 30.92 22.89 -6.61 31.91 19.71 43.28 23.93 -13.69 40.73 27.69 -10.11 coo -8.38 36.02 19.06 -8.83 34.10 19.89 35.62 25.18 -17.07 34.59 23.37 -17.57 1zrz_c02 source 1zrz PROTEIN KINASE C, IOTA : 11 hits 1zrz_c02 naa= 3 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 1 3 # 1 142 TRP A 40 TRP.? 3.98 O9 UNL A 200 223 ASP B 84 ASP.? -3.52 O9 UNL A 200s 258 ALA A 65 ALA^? -3.44 O1 UNL A 200s coo 128.40 33.01 26.67 128.12 36.28 28.81 33.99 40.17 -6.70 35.44 37.26 -8.87 coo 127.91 41.73 23.55 129.18 40.35 24.44 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 141.00 37.49 25.74 139.80 37.53 24.78 44.85 33.10 -1.28 43.67 34.00 -1.64 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 2 3 # 2 142 TRP A 120 TRP.? -3.57 C3 GOL A 201s 223 ASP A 79 ASP~? 6.09 O1 GOL A 201 258 ALA A 116 ALA.? 8.95 CL CL A 123 coo 128.40 33.01 26.67 128.12 36.28 28.81 47.59 24.24 15.32 44.33 26.38 14.78 coo 127.91 41.73 23.55 129.18 40.35 24.44 53.25 22.44 8.57 51.13 22.57 8.85 coo 141.00 37.49 25.74 139.80 37.53 24.78 43.77 13.30 16.69 43.18 14.66 16.33 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 3 3 # 3 142 TRP A 120 TRP.? -3.57 C3 GOL A 201s 223 ASP A 84 ASP.? -3.46 O1 GOL A 201s 258 ALA B 65 ALA^? -3.35 O3 GOL B 126s coo 128.40 33.01 26.67 128.12 36.28 28.81 47.59 24.24 15.32 44.33 26.38 14.78 coo 127.91 41.73 23.55 129.18 40.35 24.44 49.74 30.72 10.50 50.57 30.42 12.42 coo 141.00 37.49 25.74 139.80 37.53 24.78 37.43 29.00 10.49 38.53 29.52 11.40 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 4 3 # 4 142 TRP B 40 TRP.? -3.95 C3 GOL B 125s 223 ASP A 84 ASP.? -3.46 O1 GOL A 201s 258 ALA B 65 ALA^? -3.35 O3 GOL B 126s coo 128.40 33.01 26.67 128.12 36.28 28.81 48.14 31.65 19.34 46.98 27.90 19.24 coo 127.91 41.73 23.55 129.18 40.35 24.44 49.74 30.72 10.50 50.57 30.42 12.42 coo 141.00 37.49 25.74 139.80 37.53 24.78 37.43 29.00 10.49 38.53 29.52 11.40 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 5 3 # 5 142 TRP B 120 TRP.? -4.12 O5 UNL A 200s 223 ASP B 79 ASP~? 3.97 O7 UNL A 200 258 ALA B 116 ALA.? 9.15 CL CL B 123 coo 128.40 33.01 26.67 128.12 36.28 28.81 34.73 31.77 -8.13 37.90 33.34 -6.41 coo 127.91 41.73 23.55 129.18 40.35 24.44 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 141.00 37.49 25.74 139.80 37.53 24.78 38.93 23.71 -15.82 39.49 24.61 -14.68 ULMN 3 2aat_c01 ASPARTATE AMINOTRANSFERASE (E.C.2.6.user 6 3 # 6 142 TRP B 120 TRP.? -4.12 O5 UNL A 200s 223 ASP B 84 ASP.? -3.52 O9 UNL A 200s 258 ALA A 65 ALA^? -3.44 O1 UNL A 200s coo 128.40 33.01 26.67 128.12 36.28 28.81 34.73 31.77 -8.13 37.90 33.34 -6.41 coo 127.91 41.73 23.55 129.18 40.35 24.44 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 141.00 37.49 25.74 139.80 37.53 24.78 44.85 33.10 -1.28 43.67 34.00 -1.64 2aat_c01 source 2aat ASPARTATE AMINOTRANSFERASE (E.C.2.6.1.1) MUTAN: 6 hits 2aat_c01 naa= 3 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 48 HIS.? 12.89 CL CL B 123 B 50 GLU A 37 GLU^? 12.49 O10 UNL A 200 B 113 GLN A 33 GLN.? 20.24 CL CL B 123 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 43.31 28.55 -18.97 43.37 26.94 -17.63 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 42.91 39.28 -14.45 41.15 38.40 -15.23 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 50.37 30.63 -18.14 52.11 29.49 -17.66 ULMN 3 2ag0_c04 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS B 48 HIS.? 12.72 CL CL A 123 B 50 GLU B 37 GLU^? 6.72 O2 GOL B 125 B 113 GLN B 33 GLN.? 17.55 CL CL B 124 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 39.28 14.76 21.81 39.53 14.41 19.75 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 39.03 25.88 24.92 40.77 24.72 25.06 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 31.92 16.61 22.07 30.15 15.99 21.01 2ag0_c04 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c04 naa= 3 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 1 3 # 1 B 29 HIS A 48 HIS.? 12.89 CL CL B 123 B 50 GLU A 37 GLU^? 12.49 O10 UNL A 200 B 113 GLN A 33 GLN.? 20.24 CL CL B 123 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 43.31 28.55 -18.97 43.37 26.94 -17.63 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 42.91 39.28 -14.45 41.15 38.40 -15.23 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 50.37 30.63 -18.14 52.11 29.49 -17.66 ULMN 3 2ag0_c08 BENZALDEHYDE LYASE user 2 3 # 2 B 29 HIS B 48 HIS.? 12.72 CL CL A 123 B 50 GLU B 37 GLU^? 6.72 O2 GOL B 125 B 113 GLN B 33 GLN.? 17.55 CL CL B 124 coo 37.74 -17.01 11.59 38.11 -17.83 13.49 39.28 14.76 21.81 39.53 14.41 19.75 coo 46.64 -18.37 3.41 46.45 -20.27 4.34 39.03 25.88 24.92 40.77 24.72 25.06 coo 42.38 -20.40 13.90 41.08 -20.72 12.22 31.92 16.61 22.07 30.15 15.99 21.01 2ag0_c08 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c08 naa= 3 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 1 3 # 1 A 29 HIS A 48 HIS.? 12.89 CL CL B 123 A 50 GLU A 37 GLU^? 12.49 O10 UNL A 200 A 113 GLN A 33 GLN.? 20.24 CL CL B 123 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 43.31 28.55 -18.97 43.37 26.94 -17.63 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 42.91 39.28 -14.45 41.15 38.40 -15.23 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 50.37 30.63 -18.14 52.11 29.49 -17.66 ULMN 3 2ag0_c09 BENZALDEHYDE LYASE user 2 3 # 2 A 29 HIS B 48 HIS.? 12.72 CL CL A 123 A 50 GLU B 37 GLU^? 6.72 O2 GOL B 125 A 113 GLN B 33 GLN.? 17.55 CL CL B 124 coo 73.37 -13.43 4.64 73.06 -11.77 3.39 39.28 14.76 21.81 39.53 14.41 19.75 coo 63.97 -21.08 5.81 64.12 -20.78 3.71 39.03 25.88 24.92 40.77 24.72 25.06 coo 68.60 -11.76 1.04 69.76 -13.55 1.03 31.92 16.61 22.07 30.15 15.99 21.01 2ag0_c09 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c09 naa= 3 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 1 3 # 1 C 29 HIS A 48 HIS.? 12.89 CL CL B 123 C 50 GLU A 37 GLU^? 12.49 O10 UNL A 200 C 113 GLN A 33 GLN.? 20.24 CL CL B 123 coo 74.92 8.52 28.42 74.88 6.86 29.70 43.31 28.55 -18.97 43.37 26.94 -17.63 coo 65.25 15.95 28.73 65.73 15.63 30.78 42.91 39.28 -14.45 41.15 38.40 -15.23 coo 70.80 6.73 32.72 71.88 8.55 32.53 50.37 30.63 -18.14 52.11 29.49 -17.66 ULMN 3 2ag0_c10 BENZALDEHYDE LYASE user 2 3 # 2 C 29 HIS B 48 HIS.? 12.72 CL CL A 123 C 50 GLU B 37 GLU^? 6.72 O2 GOL B 125 C 113 GLN B 33 GLN.? 17.55 CL CL B 124 coo 74.92 8.52 28.42 74.88 6.86 29.70 39.28 14.76 21.81 39.53 14.41 19.75 coo 65.25 15.95 28.73 65.73 15.63 30.78 39.03 25.88 24.92 40.77 24.72 25.06 coo 70.80 6.73 32.72 71.88 8.55 32.53 31.92 16.61 22.07 30.15 15.99 21.01 2ag0_c10 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c10 naa= 3 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 1 3 # 1 D 29 HIS A 48 HIS.? 12.89 CL CL B 123 D 50 GLU A 37 GLU^? 12.49 O10 UNL A 200 D 113 GLN A 33 GLN.? 20.24 CL CL B 123 coo 38.66 11.31 27.15 38.67 12.13 25.22 43.31 28.55 -18.97 43.37 26.94 -17.63 coo 48.72 12.85 33.83 48.36 14.77 32.95 42.91 39.28 -14.45 41.15 38.40 -15.23 coo 42.85 14.77 24.15 41.85 15.11 26.02 50.37 30.63 -18.14 52.11 29.49 -17.66 ULMN 3 2ag0_c11 BENZALDEHYDE LYASE user 2 3 # 2 D 29 HIS B 48 HIS.? 12.72 CL CL A 123 D 50 GLU B 37 GLU^? 6.72 O2 GOL B 125 D 113 GLN B 33 GLN.? 17.55 CL CL B 124 coo 38.66 11.31 27.15 38.67 12.13 25.22 39.28 14.76 21.81 39.53 14.41 19.75 coo 48.72 12.85 33.83 48.36 14.77 32.95 39.03 25.88 24.92 40.77 24.72 25.06 coo 42.85 14.77 24.15 41.85 15.11 26.02 31.92 16.61 22.07 30.15 15.99 21.01 2ag0_c11 source 2ag0 BENZALDEHYDE LYASE : 2 hits 2ag0_c11 naa= 3 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 1 3 # 1 193 ASP A 47 ASP^? 15.55 CL CL B 123 231 ASP B 79 ASP~? 3.97 O7 UNL A 200 294 ASP B 111 ASP~? 19.61 CL CL B 123 coo 27.89 102.52 14.98 29.35 101.92 13.57 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 14.74 93.05 -1.00 14.30 94.22 0.73 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 33.16 106.80 7.72 33.34 104.87 6.92 49.48 21.08 -13.06 49.20 19.08 -13.70 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 2 3 # 2 193 ASP A 47 ASP^? 15.55 CL CL B 123 231 ASP B 84 ASP.? -3.52 O9 UNL A 200s 294 ASP B 111 ASP~? 19.61 CL CL B 123 coo 27.89 102.52 14.98 29.35 101.92 13.57 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 14.74 93.05 -1.00 14.30 94.22 0.73 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 33.16 106.80 7.72 33.34 104.87 6.92 49.48 21.08 -13.06 49.20 19.08 -13.70 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 3 3 # 3 193 ASP A 47 ASP^? 15.55 CL CL B 123 231 ASP B 84 ASP.? -3.52 O9 UNL A 200s 294 ASP B 115 ASP.? 16.66 CL CL B 123 coo 27.89 102.52 14.98 29.35 101.92 13.57 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 14.74 93.05 -1.00 14.30 94.22 0.73 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 33.16 106.80 7.72 33.34 104.87 6.92 40.90 20.11 -18.41 42.52 19.20 -19.45 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 4 3 # 4 193 ASP A 79 ASP~? 6.09 O1 GOL A 201 231 ASP A 111 ASP~? 10.94 CL CL B 124 294 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 27.89 102.52 14.98 29.35 101.92 13.57 53.25 22.44 8.57 51.13 22.57 8.85 coo 14.74 93.05 -1.00 14.30 94.22 0.73 33.22 12.10 12.41 33.55 10.10 11.76 coo 33.16 106.80 7.72 33.34 104.87 6.92 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 5 3 # 5 193 ASP A 79 ASP~? 6.09 O1 GOL A 201 231 ASP B 111 ASP~? 19.61 CL CL B 123 294 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 27.89 102.52 14.98 29.35 101.92 13.57 53.25 22.44 8.57 51.13 22.57 8.85 coo 14.74 93.05 -1.00 14.30 94.22 0.73 49.48 21.08 -13.06 49.20 19.08 -13.70 coo 33.16 106.80 7.72 33.34 104.87 6.92 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 6 3 # 6 193 ASP A 84 ASP.? -3.46 O1 GOL A 201s 231 ASP A 15 ASP~? 26.19 O1 GOL B 126 294 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 27.89 102.52 14.98 29.35 101.92 13.57 49.74 30.72 10.50 50.57 30.42 12.42 coo 14.74 93.05 -1.00 14.30 94.22 0.73 60.61 47.40 3.28 62.48 48.35 3.41 coo 33.16 106.80 7.72 33.34 104.87 6.92 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 7 3 # 7 193 ASP A 111 ASP~? 10.94 CL CL B 124 231 ASP A 79 ASP~? 6.09 O1 GOL A 201 294 ASP A 104 ASP~? 7.36 CL CL B 124 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.22 12.10 12.41 33.55 10.10 11.76 coo 14.74 93.05 -1.00 14.30 94.22 0.73 53.25 22.44 8.57 51.13 22.57 8.85 coo 33.16 106.80 7.72 33.34 104.87 6.92 26.83 19.68 8.21 24.75 19.17 8.13 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 8 3 # 8 193 ASP A 111 ASP~? 10.94 CL CL B 124 231 ASP B 79 ASP~? 3.97 O7 UNL A 200 294 ASP B 47 ASP^? 15.68 CL CL A 123 coo 27.89 102.52 14.98 29.35 101.92 13.57 33.22 12.10 12.41 33.55 10.10 11.76 coo 14.74 93.05 -1.00 14.30 94.22 0.73 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 33.16 106.80 7.72 33.34 104.87 6.92 36.24 17.92 20.25 35.18 16.23 20.89 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 9 3 # 9 193 ASP A 115 ASP.? 16.41 CL CL A 123 231 ASP A 84 ASP.? -3.46 O1 GOL A 201s 294 ASP A 111 ASP~? 10.94 CL CL B 124 coo 27.89 102.52 14.98 29.35 101.92 13.57 42.06 8.77 16.59 40.52 7.32 16.97 coo 14.74 93.05 -1.00 14.30 94.22 0.73 49.74 30.72 10.50 50.57 30.42 12.42 coo 33.16 106.80 7.72 33.34 104.87 6.92 33.22 12.10 12.41 33.55 10.10 11.76 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 10 3 # 10 193 ASP B 47 ASP^? 15.68 CL CL A 123 231 ASP A 79 ASP~? 6.09 O1 GOL A 201 294 ASP A 111 ASP~? 10.94 CL CL B 124 coo 27.89 102.52 14.98 29.35 101.92 13.57 36.24 17.92 20.25 35.18 16.23 20.89 coo 14.74 93.05 -1.00 14.30 94.22 0.73 53.25 22.44 8.57 51.13 22.57 8.85 coo 33.16 106.80 7.72 33.34 104.87 6.92 33.22 12.10 12.41 33.55 10.10 11.76 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 11 3 # 11 193 ASP B 47 ASP^? 15.68 CL CL A 123 231 ASP A 84 ASP.? -3.46 O1 GOL A 201s 294 ASP A 111 ASP~? 10.94 CL CL B 124 coo 27.89 102.52 14.98 29.35 101.92 13.57 36.24 17.92 20.25 35.18 16.23 20.89 coo 14.74 93.05 -1.00 14.30 94.22 0.73 49.74 30.72 10.50 50.57 30.42 12.42 coo 33.16 106.80 7.72 33.34 104.87 6.92 33.22 12.10 12.41 33.55 10.10 11.76 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 12 3 # 12 193 ASP B 47 ASP^? 15.68 CL CL A 123 231 ASP A 84 ASP.? -3.46 O1 GOL A 201s 294 ASP A 115 ASP.? 16.41 CL CL A 123 coo 27.89 102.52 14.98 29.35 101.92 13.57 36.24 17.92 20.25 35.18 16.23 20.89 coo 14.74 93.05 -1.00 14.30 94.22 0.73 49.74 30.72 10.50 50.57 30.42 12.42 coo 33.16 106.80 7.72 33.34 104.87 6.92 42.06 8.77 16.59 40.52 7.32 16.97 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 13 3 # 13 193 ASP B 79 ASP~? 3.97 O7 UNL A 200 231 ASP A 111 ASP~? 10.94 CL CL B 124 294 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 27.89 102.52 14.98 29.35 101.92 13.57 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 14.74 93.05 -1.00 14.30 94.22 0.73 33.22 12.10 12.41 33.55 10.10 11.76 coo 33.16 106.80 7.72 33.34 104.87 6.92 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 14 3 # 14 193 ASP B 79 ASP~? 3.97 O7 UNL A 200 231 ASP B 111 ASP~? 19.61 CL CL B 123 294 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 27.89 102.52 14.98 29.35 101.92 13.57 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 14.74 93.05 -1.00 14.30 94.22 0.73 49.48 21.08 -13.06 49.20 19.08 -13.70 coo 33.16 106.80 7.72 33.34 104.87 6.92 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 15 3 # 15 193 ASP B 84 ASP.? -3.52 O9 UNL A 200s 231 ASP B 15 ASP~? 25.69 O9 UNL A 200 294 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 27.89 102.52 14.98 29.35 101.92 13.57 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 14.74 93.05 -1.00 14.30 94.22 0.73 21.08 42.76 15.13 19.15 43.54 15.67 coo 33.16 106.80 7.72 33.34 104.87 6.92 29.26 26.18 -3.96 31.36 26.46 -4.14 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 16 3 # 16 193 ASP B 111 ASP~? 19.61 CL CL B 123 231 ASP A 79 ASP~? 6.09 O1 GOL A 201 294 ASP A 47 ASP^? 15.55 CL CL B 123 coo 27.89 102.52 14.98 29.35 101.92 13.57 49.48 21.08 -13.06 49.20 19.08 -13.70 coo 14.74 93.05 -1.00 14.30 94.22 0.73 53.25 22.44 8.57 51.13 22.57 8.85 coo 33.16 106.80 7.72 33.34 104.87 6.92 46.06 30.34 -15.72 47.22 29.37 -17.24 ULMN 3 2amg_c06 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLAuser 17 3 # 17 193 ASP B 115 ASP.? 16.66 CL CL B 123 231 ASP B 84 ASP.? -3.52 O9 UNL A 200s 294 ASP B 111 ASP~? 19.61 CL CL B 123 coo 27.89 102.52 14.98 29.35 101.92 13.57 40.90 20.11 -18.41 42.52 19.20 -19.45 coo 14.74 93.05 -1.00 14.30 94.22 0.73 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 33.16 106.80 7.72 33.34 104.87 6.92 49.48 21.08 -13.06 49.20 19.08 -13.70 2amg_c06 source 2amg 1,4-ALPHA-D-GLUCAN MALTOTETRAHYDROLASE : 17 hits 2amg_c06 naa= 3 ULMN 3 2c7v_c08 PTERIDINE REDUCTASE user 1 3 # 1 A 14 ARG B 73 ARG~? -5.03 CL CL B 124s A 161 ASP A 98 ASP~? 12.55 CL CL B 124 A 174 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 14.43 -13.26 8.40 11.75 -14.25 9.60 32.94 15.87 2.60 33.21 12.81 2.35 coo 3.82 -4.94 15.61 3.37 -6.97 16.02 23.35 28.15 6.47 22.62 26.21 5.89 coo 8.61 -7.11 20.41 7.51 -6.92 17.85 27.45 31.12 3.14 25.07 31.24 4.61 2c7v_c08 source 2c7v PTERIDINE REDUCTASE : 1 hits 2c7v_c08 naa= 3 ULMN 3 2c7v_c09 PTERIDINE REDUCTASE user 1 3 # 1 B 14 ARG B 73 ARG~? -5.03 CL CL B 124s B 161 ASP A 98 ASP~? 12.55 CL CL B 124 B 174 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo -18.34 17.48 -4.91 -16.98 18.69 -2.39 32.94 15.87 2.60 33.21 12.81 2.35 coo -14.86 10.19 8.14 -14.82 12.31 8.42 23.35 28.15 6.47 22.62 26.21 5.89 coo -21.46 12.70 8.53 -19.04 12.30 7.24 27.45 31.12 3.14 25.07 31.24 4.61 2c7v_c09 source 2c7v PTERIDINE REDUCTASE : 1 hits 2c7v_c09 naa= 3 ULMN 3 2c7v_c10 PTERIDINE REDUCTASE user 1 3 # 1 C 14 ARG B 73 ARG~? -5.03 CL CL B 124s C 161 ASP A 98 ASP~? 12.55 CL CL B 124 C 174 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo 2.84 19.43 40.34 1.59 20.35 37.65 32.94 15.87 2.60 33.21 12.81 2.35 coo -0.62 11.10 28.05 -0.65 13.15 27.46 23.35 28.15 6.47 22.62 26.21 5.89 coo 5.94 13.28 27.17 3.53 13.05 28.58 27.45 31.12 3.14 25.07 31.24 4.61 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 73 ARG~? -5.03 CL CL B 124s D 161 ASP A 98 ASP~? 12.55 CL CL B 124 D 174 TYR B 83 TYR.? 10.34 O6 UNL A 200 coo -30.56 -11.62 29.88 -27.98 -12.86 28.66 32.94 15.87 2.60 33.21 12.81 2.35 coo -19.83 -4.38 21.99 -19.35 -6.45 21.76 23.35 28.15 6.47 22.62 26.21 5.89 coo -24.51 -6.92 17.31 -23.48 -6.50 19.84 27.45 31.12 3.14 25.07 31.24 4.61 2c7v_c11 source 2c7v PTERIDINE REDUCTASE : 1 hits 2c7v_c11 naa= 3 ULMN 3 2hdh_c02 L-3-HYDROXYACYL COA DEHYDROGENASE user 1 3 # 1 B 137 SER A 58 SER.? 11.73 O2 GOL B 126 B 158 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 208 ASN A 56 ASN^? 8.14 O1 UNL A 200 coo 50.29 50.10 71.46 47.85 50.06 71.46 47.20 43.37 6.46 47.90 41.49 7.82 coo 48.67 45.40 71.68 47.67 46.90 70.60 49.34 38.44 7.48 47.30 38.27 7.99 coo 48.91 49.12 65.17 47.29 49.14 66.54 44.33 40.68 0.78 42.68 41.57 -0.30 ULMN 3 2hdh_c02 L-3-HYDROXYACYL COA DEHYDROGENASE user 2 3 # 2 B 137 SER B 58 SER.? 12.59 O3 UNL A 200 B 158 HIS B 61 HIS^? 10.01 O3 UNL A 200 B 208 ASN B 56 ASN^? 7.10 O2 GOL B 126 coo 50.29 50.10 71.46 47.85 50.06 71.46 34.66 41.80 10.52 34.18 41.01 8.30 coo 48.67 45.40 71.68 47.67 46.90 70.60 32.69 38.40 6.72 34.73 38.60 6.25 coo 48.91 49.12 65.17 47.29 49.14 66.54 37.58 36.28 13.48 39.18 36.45 14.91 2hdh_c02 source 2hdh L-3-HYDROXYACYL COA DEHYDROGENASE : 2 hits 2hdh_c02 naa= 3 ULMN 3 2phk_c02 MC-PEPTIDE user 1 3 # 1 A 149 ASP A 47 ASP^? 15.55 CL CL B 123 A 151 LYS A 35 LYS^? 15.84 CL CL B 123 A 186 THR A 50 THR^? 9.21 CL CL B 123 coo 41.42 17.90 44.98 43.39 18.36 45.61 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 45.75 16.58 39.61 47.43 18.26 45.54 47.30 37.41 -16.11 42.27 39.41 -19.45 coo 45.88 23.02 44.72 46.99 21.16 44.68 40.57 30.50 -14.04 41.23 28.58 -14.86 ULMN 3 2phk_c02 MC-PEPTIDE user 2 3 # 2 A 149 ASP A 47 ASP^? 15.55 CL CL B 123 A 151 LYS B 113 LYS~? 7.99 CL CL B 123 A 186 THR A 50 THR^? 9.21 CL CL B 123 coo 41.42 17.90 44.98 43.39 18.36 45.61 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 45.75 16.58 39.61 47.43 18.26 45.54 43.28 23.93 -13.69 40.73 27.69 -10.11 coo 45.88 23.02 44.72 46.99 21.16 44.68 40.57 30.50 -14.04 41.23 28.58 -14.86 ULMN 3 2phk_c02 MC-PEPTIDE user 3 3 # 3 A 149 ASP A 111 ASP~? 10.94 CL CL B 124 A 151 LYS A 114 LYS.? 14.28 CL CL B 124 A 186 THR A 109 THR~? 11.26 CL CL B 124 coo 41.42 17.90 44.98 43.39 18.36 45.61 33.22 12.10 12.41 33.55 10.10 11.76 coo 45.75 16.58 39.61 47.43 18.26 45.54 38.24 11.42 16.94 34.01 7.82 14.29 coo 45.88 23.02 44.72 46.99 21.16 44.68 35.30 17.54 11.93 36.10 19.55 11.83 ULMN 3 2phk_c02 MC-PEPTIDE user 4 3 # 4 A 149 ASP A 115 ASP.? 16.41 CL CL A 123 A 151 LYS A 113 LYS~? 7.84 CL CL A 123 A 186 THR A 117 THR.? 9.36 CL CL A 123 coo 41.42 17.90 44.98 43.39 18.36 45.61 42.06 8.77 16.59 40.52 7.32 16.97 coo 45.75 16.58 39.61 47.43 18.26 45.54 39.46 14.20 14.59 41.86 19.61 14.55 coo 45.88 23.02 44.72 46.99 21.16 44.68 47.06 13.65 18.60 48.13 11.99 17.78 ULMN 3 2phk_c02 MC-PEPTIDE user 5 3 # 5 A 149 ASP B 47 ASP^? 15.68 CL CL A 123 A 151 LYS A 113 LYS~? 7.84 CL CL A 123 A 186 THR B 50 THR^? 8.67 CL CL A 123 coo 41.42 17.90 44.98 43.39 18.36 45.61 36.24 17.92 20.25 35.18 16.23 20.89 coo 45.75 16.58 39.61 47.43 18.26 45.54 39.46 14.20 14.59 41.86 19.61 14.55 coo 45.88 23.02 44.72 46.99 21.16 44.68 41.85 19.42 19.33 41.41 17.97 17.75 ULMN 3 2phk_c02 MC-PEPTIDE user 6 3 # 6 A 149 ASP B 47 ASP^? 15.68 CL CL A 123 A 151 LYS A 114 LYS.? 14.28 CL CL B 124 A 186 THR A 109 THR~? 11.26 CL CL B 124 coo 41.42 17.90 44.98 43.39 18.36 45.61 36.24 17.92 20.25 35.18 16.23 20.89 coo 45.75 16.58 39.61 47.43 18.26 45.54 38.24 11.42 16.94 34.01 7.82 14.29 coo 45.88 23.02 44.72 46.99 21.16 44.68 35.30 17.54 11.93 36.10 19.55 11.83 ULMN 3 2phk_c02 MC-PEPTIDE user 7 3 # 7 A 149 ASP B 47 ASP^? 15.68 CL CL A 123 A 151 LYS A 114 LYS.? 14.28 CL CL B 124 A 186 THR B 50 THR^? 8.67 CL CL A 123 coo 41.42 17.90 44.98 43.39 18.36 45.61 36.24 17.92 20.25 35.18 16.23 20.89 coo 45.75 16.58 39.61 47.43 18.26 45.54 38.24 11.42 16.94 34.01 7.82 14.29 coo 45.88 23.02 44.72 46.99 21.16 44.68 41.85 19.42 19.33 41.41 17.97 17.75 ULMN 3 2phk_c02 MC-PEPTIDE user 8 3 # 8 A 149 ASP B 115 ASP.? 16.66 CL CL B 123 A 151 LYS B 113 LYS~? 7.99 CL CL B 123 A 186 THR B 117 THR.? 9.48 CL CL B 123 coo 41.42 17.90 44.98 43.39 18.36 45.61 40.90 20.11 -18.41 42.52 19.20 -19.45 coo 45.75 16.58 39.61 47.43 18.26 45.54 43.28 23.93 -13.69 40.73 27.69 -10.11 coo 45.88 23.02 44.72 46.99 21.16 44.68 35.62 25.18 -17.07 34.59 23.37 -17.57 2phk_c02 source 2phk MC-PEPTIDE : 8 hits 2phk_c02 naa= 3 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 1 3 # 1 141 ASP A 16 ASP~? 19.78 O1 GOL B 126 166 GLY A 54 GLY^? 6.16 O1 UNL A 200 169 GLU A 67 GLU~? 5.52 O4 UNL A 200 coo 8.28 6.87 1.62 10.08 5.77 1.34 55.39 45.97 3.05 55.87 45.57 5.11 coo -8.58 13.22 3.21 -8.90 13.15 4.05 45.00 36.12 -4.79 45.64 35.72 -4.41 coo -16.67 7.89 2.78 -17.65 6.56 1.49 41.87 27.48 -6.41 39.78 28.14 -6.44 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 2 3 # 2 141 ASP A 98 ASP~? 12.55 CL CL B 124 166 GLY B 54 GLY^? 6.15 C3 GOL B 126 169 GLU B 37 GLU^? 6.72 O2 GOL B 125 coo 8.28 6.87 1.62 10.08 5.77 1.34 23.35 28.15 6.47 22.62 26.21 5.89 coo -8.58 13.22 3.21 -8.90 13.15 4.05 37.19 29.24 15.05 36.55 29.11 14.54 coo -16.67 7.89 2.78 -17.65 6.56 1.49 39.03 25.88 24.92 40.77 24.72 25.06 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 3 3 # 3 141 ASP B 16 ASP~? 19.71 O9 UNL A 200 166 GLY B 54 GLY^? 6.15 C3 GOL B 126 169 GLU B 67 GLU~? 5.53 O3 GOL A 201 coo 8.28 6.87 1.62 10.08 5.77 1.34 26.40 41.60 14.58 25.93 42.50 12.70 coo -8.58 13.22 3.21 -8.90 13.15 4.05 37.19 29.24 15.05 36.55 29.11 14.54 coo -16.67 7.89 2.78 -17.65 6.56 1.49 40.62 21.48 11.23 42.64 22.01 11.70 ULMN 3 2tdt_c00 TETRAHYDRODIPICOLINATE N-SUCCINYLTRAuser 4 3 # 4 141 ASP B 98 ASP~? 15.88 O1 GOL A 201 166 GLY A 54 GLY^? 6.16 O1 UNL A 200 169 GLU A 37 GLU^? 12.49 O10 UNL A 200 coo 8.28 6.87 1.62 10.08 5.77 1.34 59.21 30.58 1.37 59.85 28.74 0.55 coo -8.58 13.22 3.21 -8.90 13.15 4.05 45.00 36.12 -4.79 45.64 35.72 -4.41 coo -16.67 7.89 2.78 -17.65 6.56 1.49 42.91 39.28 -14.45 41.15 38.40 -15.23 2tdt_c00 source 2tdt TETRAHYDRODIPICOLINATE N-SUCCINYLTRANSFERASE : 4 hits 2tdt_c00 naa= 3 ULMN 3 2xis_c00 XYLOSE ISOMERASE (E.C.5.3.1.5) COMPLuser 1 3 # 1 183 LYS A 114 LYS.? 14.28 CL CL B 124 220 HIS B 48 HIS.? 12.72 CL CL A 123 255 ASP B 47 ASP^? 15.68 CL CL A 123 coo 11.94 40.77 50.56 7.67 36.15 49.76 38.24 11.42 16.94 34.01 7.82 14.29 coo 10.50 40.09 46.76 10.54 37.99 46.56 39.28 14.76 21.81 39.53 14.41 19.75 coo 4.47 38.05 47.65 5.63 36.87 46.50 36.24 17.92 20.25 35.18 16.23 20.89 2xis_c00 source 2xis XYLOSE ISOMERASE (E.C.5.3.1.5) COMPLEX WITH XY: 1 hits 2xis_c00 naa= 3 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 1 3 # 1 18 ARG A 90 ARG^? -3.37 O3 UNL A 200s 195 HIS B 85 HIS^? -3.53 O6 UNL A 200s 199 ASP B 84 ASP.? -3.52 O9 UNL A 200s coo 21.96 2.03 15.24 19.33 1.86 13.55 34.56 36.69 3.31 35.72 36.40 0.46 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 32.50 34.12 -0.35 31.64 35.02 -2.06 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 2 3 # 2 18 ARG A 122 ARG.? -4.14 CL CL A 123s 195 HIS A 85 HIS^? 3.67 O3 GOL A 201s 199 ASP A 79 ASP~? 6.09 O1 GOL A 201 coo 21.96 2.03 15.24 19.33 1.86 13.55 51.28 18.48 12.98 52.83 19.03 15.57 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 47.38 26.60 7.09 47.11 24.76 8.07 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 53.25 22.44 8.57 51.13 22.57 8.85 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 3 3 # 3 18 ARG B 90 ARG^? -2.91 O2 GOL B 126s 195 HIS A 85 HIS^? 3.67 O3 GOL A 201s 199 ASP A 84 ASP.? -3.46 O1 GOL A 201s coo 21.96 2.03 15.24 19.33 1.86 13.55 47.88 34.42 9.42 45.31 33.29 10.75 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 47.38 26.60 7.09 47.11 24.76 8.07 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 49.74 30.72 10.50 50.57 30.42 12.42 ULMN 3 3cla_c00 TYPE III CHLORAMPHENICOL ACETYLTRANSuser 4 3 # 4 18 ARG B 122 ARG.? 4.15 CL CL B 123s 195 HIS B 85 HIS^? -3.53 O6 UNL A 200s 199 ASP B 79 ASP~? 3.97 O7 UNL A 200 coo 21.96 2.03 15.24 19.33 1.86 13.55 31.77 26.02 -8.78 30.06 27.01 -11.17 coo 13.48 -0.87 14.56 14.47 -2.14 15.92 35.07 28.78 -0.10 35.41 27.96 -2.01 coo 17.92 -0.05 18.55 18.90 -0.38 16.73 29.26 26.18 -3.96 31.36 26.46 -4.14 3cla_c00 source 3cla TYPE III CHLORAMPHENICOL ACETYLTRANSFERASE ( C: 4 hits 3cla_c00 naa= 3 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 # 1 A 158 ASP A 84 ASP.? -3.46 O1 GOL A 201s A 161 ARG B 90 ARG^? -2.91 O2 GOL B 126s A 186 HIS A 85 HIS^? 3.67 O3 GOL A 201s coo 18.62 26.83 58.17 18.48 28.64 57.08 49.74 30.72 10.50 50.57 30.42 12.42 coo 23.76 27.69 57.88 24.05 29.81 55.69 47.88 34.42 9.42 45.31 33.29 10.75 coo 16.67 31.22 54.64 18.74 31.15 54.14 47.38 26.60 7.09 47.11 24.76 8.07 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 2 3 # 2 A 158 ASP B 79 ASP~? 3.97 O7 UNL A 200 A 161 ARG B 122 ARG.? 4.15 CL CL B 123s A 186 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 18.62 26.83 58.17 18.48 28.64 57.08 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 23.76 27.69 57.88 24.05 29.81 55.69 31.77 26.02 -8.78 30.06 27.01 -11.17 coo 16.67 31.22 54.64 18.74 31.15 54.14 35.07 28.78 -0.10 35.41 27.96 -2.01 ULMN 3 4mdh_c02 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 3 3 # 3 A 158 ASP B 84 ASP.? -3.52 O9 UNL A 200s A 161 ARG A 90 ARG^? -3.37 O3 UNL A 200s A 186 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 18.62 26.83 58.17 18.48 28.64 57.08 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 23.76 27.69 57.88 24.05 29.81 55.69 34.56 36.69 3.31 35.72 36.40 0.46 coo 16.67 31.22 54.64 18.74 31.15 54.14 35.07 28.78 -0.10 35.41 27.96 -2.01 4mdh_c02 source 4mdh CYTOPLASMIC MALATE DEHYDROGENASE (E.C.1.1.1.37: 3 hits 4mdh_c02 naa= 3 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 1 3 # 1 B 158 ASP A 79 ASP~? 6.09 O1 GOL A 201 B 161 ARG A 122 ARG.? -4.14 CL CL A 123s B 186 HIS A 85 HIS^? 3.67 O3 GOL A 201s coo 44.53 16.44 28.54 44.89 18.45 28.77 53.25 22.44 8.57 51.13 22.57 8.85 coo 39.64 19.27 28.15 40.19 21.74 29.94 51.28 18.48 12.98 52.83 19.03 15.57 coo 48.32 20.00 31.44 46.45 20.91 31.50 47.38 26.60 7.09 47.11 24.76 8.07 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 2 3 # 2 B 158 ASP A 84 ASP.? -3.46 O1 GOL A 201s B 161 ARG B 90 ARG^? -2.91 O2 GOL B 126s B 186 HIS A 85 HIS^? 3.67 O3 GOL A 201s coo 44.53 16.44 28.54 44.89 18.45 28.77 49.74 30.72 10.50 50.57 30.42 12.42 coo 39.64 19.27 28.15 40.19 21.74 29.94 47.88 34.42 9.42 45.31 33.29 10.75 coo 48.32 20.00 31.44 46.45 20.91 31.50 47.38 26.60 7.09 47.11 24.76 8.07 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 3 3 # 3 B 158 ASP B 79 ASP~? 3.97 O7 UNL A 200 B 161 ARG B 122 ARG.? 4.15 CL CL B 123s B 186 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 44.53 16.44 28.54 44.89 18.45 28.77 29.26 26.18 -3.96 31.36 26.46 -4.14 coo 39.64 19.27 28.15 40.19 21.74 29.94 31.77 26.02 -8.78 30.06 27.01 -11.17 coo 48.32 20.00 31.44 46.45 20.91 31.50 35.07 28.78 -0.10 35.41 27.96 -2.01 ULMN 3 4mdh_c03 CYTOPLASMIC MALATE DEHYDROGENASE (E.user 4 3 # 4 B 158 ASP B 84 ASP.? -3.52 O9 UNL A 200s B 161 ARG A 90 ARG^? -3.37 O3 UNL A 200s B 186 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo 44.53 16.44 28.54 44.89 18.45 28.77 32.50 34.12 -0.35 31.64 35.02 -2.06 coo 39.64 19.27 28.15 40.19 21.74 29.94 34.56 36.69 3.31 35.72 36.40 0.46 coo 48.32 20.00 31.44 46.45 20.91 31.50 35.07 28.78 -0.10 35.41 27.96 -2.01 4mdh_c03 source 4mdh CYTOPLASMIC MALATE DEHYDROGENASE (E.C.1.1.1.37: 4 hits 4mdh_c03 naa= 3 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 1 1 # 1 A 461 ASN A 26 ASN~? 22.72 O1 UNL A 200 coo 5.80 63.03 55.85 5.52 65.03 56.45 59.79 36.87 -9.12 61.45 38.07 -8.53 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 2 1 # 2 A 461 ASN A 41 ASN.? 10.82 O10 UNL A 200 coo 5.80 63.03 55.85 5.52 65.03 56.45 38.23 45.23 -3.76 39.03 47.09 -3.08 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 3 1 # 3 A 461 ASN A 56 ASN^? 8.14 O1 UNL A 200 coo 5.80 63.03 55.85 5.52 65.03 56.45 44.33 40.68 0.78 42.68 41.57 -0.30 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 4 1 # 4 A 461 ASN B 26 ASN~? 21.41 CL CL B 124 coo 5.80 63.03 55.85 5.52 65.03 56.45 22.33 26.94 18.41 20.59 28.17 18.67 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 5 1 # 5 A 461 ASN B 41 ASN.? 8.50 O1 GOL B 125 coo 5.80 63.03 55.85 5.52 65.03 56.45 43.73 37.27 19.82 43.17 39.18 20.62 ULMN 1 1kbk_p00 ALPHA-AMYLASE, PANCREATIC user 6 1 # 6 A 461 ASN B 56 ASN^? 7.10 O2 GOL B 126 coo 5.80 63.03 55.85 5.52 65.03 56.45 37.58 36.28 13.48 39.18 36.45 14.91 1kbk_p00 source 1kbk ALPHA-AMYLASE, PANCREATIC : 6 hits 1kbk_p00 naa= 1 ULMN 4 2cl8_p00 DECTIN-1 user 1 4 # 1 A 145 ARG A 90 ARG^? -3.37 O3 UNL A 200s A 148 SER B 86 SER^? -3.07 O1 UNL A 200s A 152 ALA A 65 ALA^? -3.44 O1 UNL A 200s A 194 GLU A 67 GLU~? 5.52 O4 UNL A 200 coo -29.52 -1.51 -10.80 -29.25 -1.07 -13.87 34.56 36.69 3.31 35.72 36.40 0.46 coo -35.30 0.90 -4.91 -36.19 -1.20 -5.57 38.80 31.67 1.48 40.20 33.63 1.48 coo -37.81 4.22 -2.30 -36.99 5.43 -2.37 44.85 33.10 -1.28 43.67 34.00 -1.64 coo -43.25 5.44 -9.45 -44.36 4.89 -7.68 41.87 27.48 -6.41 39.78 28.14 -6.44 ULMN 4 2cl8_p00 DECTIN-1 user 2 4 # 2 A 145 ARG B 90 ARG^? -2.91 O2 GOL B 126s A 148 SER A 86 SER^? -2.62 O3 GOL B 126s A 152 ALA B 65 ALA^? -3.35 O3 GOL B 126s A 194 GLU B 67 GLU~? 5.53 O3 GOL A 201 coo -29.52 -1.51 -10.80 -29.25 -1.07 -13.87 47.88 34.42 9.42 45.31 33.29 10.75 coo -35.30 0.90 -4.91 -36.19 -1.20 -5.57 43.49 29.72 7.55 42.01 31.25 8.69 coo -37.81 4.22 -2.30 -36.99 5.43 -2.37 37.43 29.00 10.49 38.53 29.52 11.40 coo -43.25 5.44 -9.45 -44.36 4.89 -7.68 40.62 21.48 11.23 42.64 22.01 11.70 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 73 ARG~? 17.00 O3 GOL A 201 B 6 THR A 72 THR~? 12.50 O3 GOL A 201 B 8 THR B 72 THR~? 11.14 CL CL B 124 coo 40.52 16.08 100.90 37.97 16.41 102.60 49.22 17.19 -2.93 46.61 15.60 -2.23 coo 36.11 13.64 95.03 34.54 14.86 95.91 44.96 20.42 1.10 43.33 19.07 0.95 coo 32.72 8.05 92.39 31.25 9.11 91.35 37.75 20.46 0.91 39.51 19.47 0.17 ULMN 3 1b01_d00 GENE REGULATION/DNA user 2 3 # 2 B 4 ARG B 73 ARG~? -5.03 CL CL B 124s B 6 THR B 72 THR~? 11.14 CL CL B 124 B 8 THR A 72 THR~? 12.50 O3 GOL A 201 coo 40.52 16.08 100.90 37.97 16.41 102.60 32.94 15.87 2.60 33.21 12.81 2.35 coo 36.11 13.64 95.03 34.54 14.86 95.91 37.75 20.46 0.91 39.51 19.47 0.17 coo 32.72 8.05 92.39 31.25 9.11 91.35 44.96 20.42 1.10 43.33 19.07 0.95 1b01_d00 source 1b01 GENE REGULATION/DNA : 2 hits 1b01_d00 naa= 3 ULMN 3 1emh_d00 HYDROLASE/DNA user 1 3 # 1 A 271 PRO A 14 PRO~? 25.50 O1 UNL A 200 A 272 LEU A 17 LEU~? 21.23 O1 UNL A 200 A 276 ARG A 19 ARG~? 17.61 O2 GOL A 201 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 58.19 53.02 2.37 57.46 50.95 1.96 coo 10.97 0.43 16.73 11.31 2.11 18.06 55.41 48.81 -1.56 54.43 49.62 -3.30 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 57.40 40.38 1.34 58.96 39.38 3.77 ULMN 3 1emh_d00 HYDROLASE/DNA user 2 3 # 2 A 271 PRO A 57 PRO^? 12.75 O1 UNL A 200 A 272 LEU A 62 LEU^? 12.80 O1 UNL A 200 A 276 ARG B 90 ARG^? -2.91 O2 GOL B 126s coo 16.45 -2.42 17.59 14.58 -2.74 16.47 47.39 44.96 1.47 47.42 42.81 2.16 coo 10.97 0.43 16.73 11.31 2.11 18.06 51.66 39.37 2.05 51.26 39.61 -0.10 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 47.88 34.42 9.42 45.31 33.29 10.75 ULMN 3 1emh_d00 HYDROLASE/DNA user 3 3 # 3 A 271 PRO B 14 PRO~? 25.39 O2 GOL B 126 A 272 LEU B 17 LEU~? 21.14 O2 GOL B 126 A 276 ARG B 19 ARG~? 17.69 O8 UNL A 200 coo 16.45 -2.42 17.59 14.58 -2.74 16.47 23.25 46.77 19.29 24.15 44.96 18.38 coo 10.97 0.43 16.73 11.31 2.11 18.06 26.24 41.18 19.94 27.31 40.90 21.82 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 24.49 36.14 12.47 22.88 36.56 9.90 ULMN 3 1emh_d00 HYDROLASE/DNA user 4 3 # 4 A 271 PRO B 57 PRO^? 12.24 O2 GOL B 126 A 272 LEU B 62 LEU^? 12.72 O3 GOL B 126 A 276 ARG A 90 ARG^? -3.37 O3 UNL A 200s coo 16.45 -2.42 17.59 14.58 -2.74 16.47 34.56 40.10 15.36 34.48 38.74 13.59 coo 10.97 0.43 16.73 11.31 2.11 18.06 30.30 35.72 11.44 30.62 34.64 13.31 coo 5.13 -4.12 13.47 2.16 -3.72 14.17 34.56 36.69 3.31 35.72 36.40 0.46 1emh_d00 source 1emh HYDROLASE/DNA : 4 hits 1emh_d00 naa= 3 ULMN 4 1z1c_d00 VIRUS/DNA user 1 4 # 1 A 52 HIS A 85 HIS^? 3.67 O3 GOL A 201s A 53 TYR A 83 TYR.? 10.52 O1 GOL A 201 A 54 ARG B 90 ARG^? -2.91 O2 GOL B 126s A 55 PHE B 91 PHE^? 12.14 O2 GOL A 201 coo -51.92 14.77 71.82 -52.52 16.69 71.24 47.38 26.60 7.09 47.11 24.76 8.07 coo -53.17 8.84 75.64 -53.81 9.66 78.23 54.83 30.60 5.85 57.08 31.79 4.69 coo -46.84 9.39 68.38 -45.10 9.66 65.86 47.88 34.42 9.42 45.31 33.29 10.75 coo -51.87 3.84 71.46 -53.47 4.35 73.68 53.74 34.37 2.85 53.64 32.00 1.42 ULMN 4 1z1c_d00 VIRUS/DNA user 2 4 # 2 A 52 HIS B 85 HIS^? -3.53 O6 UNL A 200s A 53 TYR B 83 TYR.? 10.34 O6 UNL A 200 A 54 ARG A 90 ARG^? -3.37 O3 UNL A 200s A 55 PHE A 91 PHE^? 11.91 O6 UNL A 200 coo -51.92 14.77 71.82 -52.52 16.69 71.24 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -53.17 8.84 75.64 -53.81 9.66 78.23 27.45 31.12 3.14 25.07 31.24 4.61 coo -46.84 9.39 68.38 -45.10 9.66 65.86 34.56 36.69 3.31 35.72 36.40 0.46 coo -51.87 3.84 71.46 -53.47 4.35 73.68 28.47 32.27 7.84 28.60 29.55 7.47 1z1c_d00 source 1z1c VIRUS/DNA : 2 hits 1z1c_d00 naa= 4 ULMN 3 2hos_d00 TRANSCRIPTION/DNA user 1 3 # 1 A 5 ARG A 90 ARG^? -3.37 O3 UNL A 200s A 50 LYS A 39 LYS^? 9.22 O10 UNL A 200 A 51 ASN A 41 ASN.? 10.82 O10 UNL A 200 coo 28.68 23.77 42.74 27.76 26.72 42.93 34.56 36.69 3.31 35.72 36.40 0.46 coo 14.40 30.33 40.28 14.25 28.31 45.36 38.86 41.59 -9.23 36.85 38.97 -13.00 coo 19.09 30.55 41.51 19.09 28.89 42.82 38.23 45.23 -3.76 39.03 47.09 -3.08 2hos_d00 source 2hos TRANSCRIPTION/DNA : 1 hits 2hos_d00 naa= 3 ULMN 3 4hp3_d00 DNA BINDING PROTEIN/DNA user 1 3 # 1 C 61 LYS A 35 LYS^? 15.84 CL CL B 123 C 90 HIS B 103 HIS~? 20.60 O1 UNL A 200 C 91 GLN A 30 GLN~? 21.45 O1 UNL A 200 coo -19.62 -7.95 11.61 -14.74 -11.23 10.80 47.30 37.41 -16.11 42.27 39.41 -19.45 coo -14.60 -21.92 8.98 -13.75 -22.48 7.16 57.94 28.30 -8.81 58.37 27.44 -10.67 coo -19.27 -22.51 13.20 -20.06 -20.67 12.43 59.73 32.31 -12.09 59.90 32.34 -9.98 ULMN 3 4hp3_d00 DNA BINDING PROTEIN/DNA user 2 3 # 2 C 61 LYS A 113 LYS~? 7.84 CL CL A 123 C 90 HIS A 85 HIS^? 3.67 O3 GOL A 201s C 91 GLN A 87 GLN^? 4.75 O3 GOL A 201 coo -19.62 -7.95 11.61 -14.74 -11.23 10.80 39.46 14.20 14.59 41.86 19.61 14.55 coo -14.60 -21.92 8.98 -13.75 -22.48 7.16 47.38 26.60 7.09 47.11 24.76 8.07 coo -19.27 -22.51 13.20 -20.06 -20.67 12.43 41.69 26.32 5.03 43.09 26.04 6.63 ULMN 3 4hp3_d00 DNA BINDING PROTEIN/DNA user 3 3 # 3 C 61 LYS B 113 LYS~? 7.99 CL CL B 123 C 90 HIS B 85 HIS^? -3.53 O6 UNL A 200s C 91 GLN B 87 GLN^? 5.19 O4 UNL A 200 coo -19.62 -7.95 11.61 -14.74 -11.23 10.80 43.28 23.93 -13.69 40.73 27.69 -10.11 coo -14.60 -21.92 8.98 -13.75 -22.48 7.16 35.07 28.78 -0.10 35.41 27.96 -2.01 coo -19.27 -22.51 13.20 -20.06 -20.67 12.43 40.79 27.52 1.41 39.40 28.24 -0.01 4hp3_d00 source 4hp3 DNA BINDING PROTEIN/DNA : 3 hits 4hp3_d00 naa= 3 ULMN 3 2odj_o00 PORIN D user 1 3 # 1 A 156 HIS A 61 HIS^? 9.47 O2 GOL B 126 A 208 ASP A 15 ASP~? 26.19 O1 GOL B 126 A 296 SER A 3 SER~? 17.75 O10 UNL A 200 coo 12.72 17.48 24.71 12.80 19.37 23.81 49.34 38.44 7.48 47.30 38.27 7.99 coo 18.47 29.19 29.68 19.30 29.17 27.75 60.61 47.40 3.28 62.48 48.35 3.41 coo 6.89 17.22 46.63 5.08 16.21 47.91 41.53 50.51 -7.94 42.84 52.62 -7.99 ULMN 3 2odj_o00 PORIN D user 2 3 # 2 A 156 HIS A 103 HIS~? 11.95 CL CL B 124 A 208 ASP A 111 ASP~? 10.94 CL CL B 124 A 296 SER B 86 SER^? -3.07 O1 UNL A 200s coo 12.72 17.48 24.71 12.80 19.37 23.81 24.53 20.38 13.18 24.12 18.57 14.18 coo 18.47 29.19 29.68 19.30 29.17 27.75 33.22 12.10 12.41 33.55 10.10 11.76 coo 6.89 17.22 46.63 5.08 16.21 47.91 38.80 31.67 1.48 40.20 33.63 1.48 ULMN 3 2odj_o00 PORIN D user 3 3 # 3 A 156 HIS A 103 HIS~? 11.95 CL CL B 124 A 208 ASP B 47 ASP^? 15.68 CL CL A 123 A 296 SER B 86 SER^? -3.07 O1 UNL A 200s coo 12.72 17.48 24.71 12.80 19.37 23.81 24.53 20.38 13.18 24.12 18.57 14.18 coo 18.47 29.19 29.68 19.30 29.17 27.75 36.24 17.92 20.25 35.18 16.23 20.89 coo 6.89 17.22 46.63 5.08 16.21 47.91 38.80 31.67 1.48 40.20 33.63 1.48 ULMN 3 2odj_o00 PORIN D user 4 3 # 4 A 156 HIS B 61 HIS^? 10.01 O3 UNL A 200 A 208 ASP B 15 ASP~? 25.69 O9 UNL A 200 A 296 SER B 3 SER~? 12.12 O1 GOL B 125 coo 12.72 17.48 24.71 12.80 19.37 23.81 32.69 38.40 6.72 34.73 38.60 6.25 coo 18.47 29.19 29.68 19.30 29.17 27.75 21.08 42.76 15.13 19.15 43.54 15.67 coo 6.89 17.22 46.63 5.08 16.21 47.91 40.00 38.05 26.27 38.94 39.87 27.47 ULMN 3 2odj_o00 PORIN D user 5 3 # 5 A 156 HIS B 103 HIS~? 20.60 O1 UNL A 200 A 208 ASP A 47 ASP^? 15.55 CL CL B 123 A 296 SER A 58 SER.? 11.73 O2 GOL B 126 coo 12.72 17.48 24.71 12.80 19.37 23.81 57.94 28.30 -8.81 58.37 27.44 -10.67 coo 18.47 29.19 29.68 19.30 29.17 27.75 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 6.89 17.22 46.63 5.08 16.21 47.91 47.20 43.37 6.46 47.90 41.49 7.82 ULMN 3 2odj_o00 PORIN D user 6 3 # 6 A 156 HIS B 103 HIS~? 20.60 O1 UNL A 200 A 208 ASP A 47 ASP^? 15.55 CL CL B 123 A 296 SER A 86 SER^? -2.62 O3 GOL B 126s coo 12.72 17.48 24.71 12.80 19.37 23.81 57.94 28.30 -8.81 58.37 27.44 -10.67 coo 18.47 29.19 29.68 19.30 29.17 27.75 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 6.89 17.22 46.63 5.08 16.21 47.91 43.49 29.72 7.55 42.01 31.25 8.69 2odj_o00 source 2ODJ PORIN D : 6 hits 2odj_o00 naa= 3 ULMN 3 2odj_o01 PORIN D user 1 3 # 1 B 156 HIS A 61 HIS^? 9.47 O2 GOL B 126 B 208 ASP A 15 ASP~? 26.19 O1 GOL B 126 B 296 SER A 3 SER~? 17.75 O10 UNL A 200 coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 49.34 38.44 7.48 47.30 38.27 7.99 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 60.61 47.40 3.28 62.48 48.35 3.41 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 41.53 50.51 -7.94 42.84 52.62 -7.99 ULMN 3 2odj_o01 PORIN D user 2 3 # 2 B 156 HIS A 103 HIS~? 11.95 CL CL B 124 B 208 ASP A 111 ASP~? 10.94 CL CL B 124 B 296 SER B 86 SER^? -3.07 O1 UNL A 200s coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 24.53 20.38 13.18 24.12 18.57 14.18 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 33.22 12.10 12.41 33.55 10.10 11.76 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 38.80 31.67 1.48 40.20 33.63 1.48 ULMN 3 2odj_o01 PORIN D user 3 3 # 3 B 156 HIS A 103 HIS~? 11.95 CL CL B 124 B 208 ASP B 47 ASP^? 15.68 CL CL A 123 B 296 SER B 86 SER^? -3.07 O1 UNL A 200s coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 24.53 20.38 13.18 24.12 18.57 14.18 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 36.24 17.92 20.25 35.18 16.23 20.89 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 38.80 31.67 1.48 40.20 33.63 1.48 ULMN 3 2odj_o01 PORIN D user 4 3 # 4 B 156 HIS B 103 HIS~? 20.60 O1 UNL A 200 B 208 ASP A 47 ASP^? 15.55 CL CL B 123 B 296 SER A 86 SER^? -2.62 O3 GOL B 126s coo -2.35 -7.60 76.02 -1.45 -9.49 76.24 57.94 28.30 -8.81 58.37 27.44 -10.67 coo -7.90 -19.74 71.88 -5.88 -19.94 71.25 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -24.72 -6.64 81.21 -24.66 -4.26 81.67 43.49 29.72 7.55 42.01 31.25 8.69 2odj_o01 source 2ODJ PORIN D : 4 hits 2odj_o01 naa= 3 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 1 3 # 1 A 130 SER A 22 SER~? 23.06 O1 UNL A 200 A 166 PHE A 45 PHE^? 13.75 O1 UNL A 200 A 182 PHE A 31 PHE~? 18.57 O1 UNL A 200 coo -46.28 37.24 81.97 -44.96 39.32 82.40 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -36.62 39.62 84.60 -38.76 41.24 85.25 49.20 35.83 -10.55 51.58 37.30 -10.35 coo -36.55 45.66 79.22 -38.34 43.94 80.53 54.25 30.54 -13.29 55.26 28.76 -11.37 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 2 3 # 2 A 130 SER A 22 SER~? 23.06 O1 UNL A 200 A 166 PHE A 45 PHE^? 13.75 O1 UNL A 200 A 182 PHE A 55 PHE^? 10.34 O1 UNL A 200 coo -46.28 37.24 81.97 -44.96 39.32 82.40 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -36.62 39.62 84.60 -38.76 41.24 85.25 49.20 35.83 -10.55 51.58 37.30 -10.35 coo -36.55 45.66 79.22 -38.34 43.94 80.53 48.64 38.35 -4.19 49.98 36.56 -5.84 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 3 3 # 3 A 130 SER A 22 SER~? 23.06 O1 UNL A 200 A 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 A 182 PHE A 45 PHE^? 13.75 O1 UNL A 200 coo -46.28 37.24 81.97 -44.96 39.32 82.40 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -36.62 39.62 84.60 -38.76 41.24 85.25 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -36.55 45.66 79.22 -38.34 43.94 80.53 49.20 35.83 -10.55 51.58 37.30 -10.35 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 4 3 # 4 A 130 SER A 22 SER~? 23.06 O1 UNL A 200 A 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 A 182 PHE B 91 PHE^? 12.14 O2 GOL A 201 coo -46.28 37.24 81.97 -44.96 39.32 82.40 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -36.62 39.62 84.60 -38.76 41.24 85.25 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -36.55 45.66 79.22 -38.34 43.94 80.53 53.74 34.37 2.85 53.64 32.00 1.42 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 5 3 # 5 A 130 SER A 58 SER.? 11.73 O2 GOL B 126 A 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 A 182 PHE B 91 PHE^? 12.14 O2 GOL A 201 coo -46.28 37.24 81.97 -44.96 39.32 82.40 47.20 43.37 6.46 47.90 41.49 7.82 coo -36.62 39.62 84.60 -38.76 41.24 85.25 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -36.55 45.66 79.22 -38.34 43.94 80.53 53.74 34.37 2.85 53.64 32.00 1.42 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 6 3 # 6 A 130 SER A 58 SER.? 11.73 O2 GOL B 126 A 166 PHE B 91 PHE^? 12.14 O2 GOL A 201 A 182 PHE A 55 PHE^? 10.34 O1 UNL A 200 coo -46.28 37.24 81.97 -44.96 39.32 82.40 47.20 43.37 6.46 47.90 41.49 7.82 coo -36.62 39.62 84.60 -38.76 41.24 85.25 53.74 34.37 2.85 53.64 32.00 1.42 coo -36.55 45.66 79.22 -38.34 43.94 80.53 48.64 38.35 -4.19 49.98 36.56 -5.84 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 7 3 # 7 A 130 SER B 22 SER~? 23.16 O3 GOL B 126 A 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 A 182 PHE A 91 PHE^? 11.91 O6 UNL A 200 coo -46.28 37.24 81.97 -44.96 39.32 82.40 22.70 32.34 19.73 20.75 33.76 19.49 coo -36.62 39.62 84.60 -38.76 41.24 85.25 33.44 31.32 15.89 32.17 28.85 15.98 coo -36.55 45.66 79.22 -38.34 43.94 80.53 28.47 32.27 7.84 28.60 29.55 7.47 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 8 3 # 8 A 130 SER B 22 SER~? 23.16 O3 GOL B 126 A 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 A 182 PHE B 45 PHE^? 13.55 C3 GOL B 126 coo -46.28 37.24 81.97 -44.96 39.32 82.40 22.70 32.34 19.73 20.75 33.76 19.49 coo -36.62 39.62 84.60 -38.76 41.24 85.25 33.44 31.32 15.89 32.17 28.85 15.98 coo -36.55 45.66 79.22 -38.34 43.94 80.53 32.99 25.50 19.27 30.62 26.78 19.90 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 9 3 # 9 A 130 SER B 58 SER.? 12.59 O3 UNL A 200 A 166 PHE A 91 PHE^? 11.91 O6 UNL A 200 A 182 PHE B 55 PHE^? 10.40 O3 GOL B 126 coo -46.28 37.24 81.97 -44.96 39.32 82.40 34.66 41.80 10.52 34.18 41.01 8.30 coo -36.62 39.62 84.60 -38.76 41.24 85.25 28.47 32.27 7.84 28.60 29.55 7.47 coo -36.55 45.66 79.22 -38.34 43.94 80.53 33.44 31.32 15.89 32.17 28.85 15.98 ULMN 3 2r11_o00 CARBOXYLESTERASE NP user 10 3 # 10 A 130 SER B 58 SER.? 12.59 O3 UNL A 200 A 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 A 182 PHE A 91 PHE^? 11.91 O6 UNL A 200 coo -46.28 37.24 81.97 -44.96 39.32 82.40 34.66 41.80 10.52 34.18 41.01 8.30 coo -36.62 39.62 84.60 -38.76 41.24 85.25 33.44 31.32 15.89 32.17 28.85 15.98 coo -36.55 45.66 79.22 -38.34 43.94 80.53 28.47 32.27 7.84 28.60 29.55 7.47 2r11_o00 source 2R11 CARBOXYLESTERASE NP : 10 hits 2r11_o00 naa= 3 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 1 3 # 1 B 130 SER A 22 SER~? 23.06 O1 UNL A 200 B 166 PHE A 45 PHE^? 13.75 O1 UNL A 200 B 182 PHE A 31 PHE~? 18.57 O1 UNL A 200 coo -19.94 46.29 97.83 -22.38 46.56 97.60 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -29.59 43.40 95.66 -28.22 45.54 94.50 49.20 35.83 -10.55 51.58 37.30 -10.35 coo -32.72 50.15 98.46 -30.32 48.85 97.77 54.25 30.54 -13.29 55.26 28.76 -11.37 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 2 3 # 2 B 130 SER A 22 SER~? 23.06 O1 UNL A 200 B 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 B 182 PHE A 45 PHE^? 13.75 O1 UNL A 200 coo -19.94 46.29 97.83 -22.38 46.56 97.60 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -29.59 43.40 95.66 -28.22 45.54 94.50 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -32.72 50.15 98.46 -30.32 48.85 97.77 49.20 35.83 -10.55 51.58 37.30 -10.35 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 3 3 # 3 B 130 SER A 22 SER~? 23.06 O1 UNL A 200 B 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 B 182 PHE B 91 PHE^? 12.14 O2 GOL A 201 coo -19.94 46.29 97.83 -22.38 46.56 97.60 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -29.59 43.40 95.66 -28.22 45.54 94.50 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -32.72 50.15 98.46 -30.32 48.85 97.77 53.74 34.37 2.85 53.64 32.00 1.42 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 4 3 # 4 B 130 SER A 58 SER.? 11.73 O2 GOL B 126 B 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 B 182 PHE A 24 PHE~? 14.46 O1 UNL A 200 coo -19.94 46.29 97.83 -22.38 46.56 97.60 47.20 43.37 6.46 47.90 41.49 7.82 coo -29.59 43.40 95.66 -28.22 45.54 94.50 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -32.72 50.15 98.46 -30.32 48.85 97.77 52.56 41.17 -7.79 50.42 41.37 -5.99 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 5 3 # 5 B 130 SER A 58 SER.? 11.73 O2 GOL B 126 B 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 B 182 PHE B 91 PHE^? 12.14 O2 GOL A 201 coo -19.94 46.29 97.83 -22.38 46.56 97.60 47.20 43.37 6.46 47.90 41.49 7.82 coo -29.59 43.40 95.66 -28.22 45.54 94.50 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -32.72 50.15 98.46 -30.32 48.85 97.77 53.74 34.37 2.85 53.64 32.00 1.42 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 6 3 # 6 B 130 SER A 58 SER.? 11.73 O2 GOL B 126 B 166 PHE B 91 PHE^? 12.14 O2 GOL A 201 B 182 PHE A 55 PHE^? 10.34 O1 UNL A 200 coo -19.94 46.29 97.83 -22.38 46.56 97.60 47.20 43.37 6.46 47.90 41.49 7.82 coo -29.59 43.40 95.66 -28.22 45.54 94.50 53.74 34.37 2.85 53.64 32.00 1.42 coo -32.72 50.15 98.46 -30.32 48.85 97.77 48.64 38.35 -4.19 49.98 36.56 -5.84 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 7 3 # 7 B 130 SER B 22 SER~? 23.16 O3 GOL B 126 B 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 B 182 PHE A 91 PHE^? 11.91 O6 UNL A 200 coo -19.94 46.29 97.83 -22.38 46.56 97.60 22.70 32.34 19.73 20.75 33.76 19.49 coo -29.59 43.40 95.66 -28.22 45.54 94.50 33.44 31.32 15.89 32.17 28.85 15.98 coo -32.72 50.15 98.46 -30.32 48.85 97.77 28.47 32.27 7.84 28.60 29.55 7.47 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 8 3 # 8 B 130 SER B 22 SER~? 23.16 O3 GOL B 126 B 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 B 182 PHE B 45 PHE^? 13.55 C3 GOL B 126 coo -19.94 46.29 97.83 -22.38 46.56 97.60 22.70 32.34 19.73 20.75 33.76 19.49 coo -29.59 43.40 95.66 -28.22 45.54 94.50 33.44 31.32 15.89 32.17 28.85 15.98 coo -32.72 50.15 98.46 -30.32 48.85 97.77 32.99 25.50 19.27 30.62 26.78 19.90 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 9 3 # 9 B 130 SER B 58 SER.? 12.59 O3 UNL A 200 B 166 PHE A 91 PHE^? 11.91 O6 UNL A 200 B 182 PHE B 55 PHE^? 10.40 O3 GOL B 126 coo -19.94 46.29 97.83 -22.38 46.56 97.60 34.66 41.80 10.52 34.18 41.01 8.30 coo -29.59 43.40 95.66 -28.22 45.54 94.50 28.47 32.27 7.84 28.60 29.55 7.47 coo -32.72 50.15 98.46 -30.32 48.85 97.77 33.44 31.32 15.89 32.17 28.85 15.98 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 10 3 # 10 B 130 SER B 58 SER.? 12.59 O3 UNL A 200 B 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 B 182 PHE A 91 PHE^? 11.91 O6 UNL A 200 coo -19.94 46.29 97.83 -22.38 46.56 97.60 34.66 41.80 10.52 34.18 41.01 8.30 coo -29.59 43.40 95.66 -28.22 45.54 94.50 33.44 31.32 15.89 32.17 28.85 15.98 coo -32.72 50.15 98.46 -30.32 48.85 97.77 28.47 32.27 7.84 28.60 29.55 7.47 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 11 3 # 11 B 130 SER B 58 SER.? 12.59 O3 UNL A 200 B 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 B 182 PHE B 24 PHE~? 14.50 C3 GOL B 126 coo -19.94 46.29 97.83 -22.38 46.56 97.60 34.66 41.80 10.52 34.18 41.01 8.30 coo -29.59 43.40 95.66 -28.22 45.54 94.50 33.44 31.32 15.89 32.17 28.85 15.98 coo -32.72 50.15 98.46 -30.32 48.85 97.77 29.40 31.22 20.36 31.60 32.46 19.14 ULMN 3 2r11_o01 CARBOXYLESTERASE NP user 12 3 # 12 B 130 SER B 86 SER^? -3.07 O1 UNL A 200s B 166 PHE A 91 PHE^? 11.91 O6 UNL A 200 B 182 PHE B 55 PHE^? 10.40 O3 GOL B 126 coo -19.94 46.29 97.83 -22.38 46.56 97.60 38.80 31.67 1.48 40.20 33.63 1.48 coo -29.59 43.40 95.66 -28.22 45.54 94.50 28.47 32.27 7.84 28.60 29.55 7.47 coo -32.72 50.15 98.46 -30.32 48.85 97.77 33.44 31.32 15.89 32.17 28.85 15.98 2r11_o01 source 2R11 CARBOXYLESTERASE NP : 12 hits 2r11_o01 naa= 3 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 1 3 # 1 C 130 SER A 22 SER~? 23.06 O1 UNL A 200 C 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 C 182 PHE A 45 PHE^? 13.75 O1 UNL A 200 coo -2.19 64.27 51.12 -3.34 62.10 50.60 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -11.14 61.91 46.89 -9.88 60.30 48.76 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -7.71 55.92 42.70 -7.18 57.60 44.85 49.20 35.83 -10.55 51.58 37.30 -10.35 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 2 3 # 2 C 130 SER A 22 SER~? 23.06 O1 UNL A 200 C 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 C 182 PHE B 91 PHE^? 12.14 O2 GOL A 201 coo -2.19 64.27 51.12 -3.34 62.10 50.60 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -11.14 61.91 46.89 -9.88 60.30 48.76 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -7.71 55.92 42.70 -7.18 57.60 44.85 53.74 34.37 2.85 53.64 32.00 1.42 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 3 3 # 3 C 130 SER A 58 SER.? 11.73 O2 GOL B 126 C 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 C 182 PHE B 91 PHE^? 12.14 O2 GOL A 201 coo -2.19 64.27 51.12 -3.34 62.10 50.60 47.20 43.37 6.46 47.90 41.49 7.82 coo -11.14 61.91 46.89 -9.88 60.30 48.76 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -7.71 55.92 42.70 -7.18 57.60 44.85 53.74 34.37 2.85 53.64 32.00 1.42 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 4 3 # 4 C 130 SER A 58 SER.? 11.73 O2 GOL B 126 C 166 PHE B 91 PHE^? 12.14 O2 GOL A 201 C 182 PHE A 55 PHE^? 10.34 O1 UNL A 200 coo -2.19 64.27 51.12 -3.34 62.10 50.60 47.20 43.37 6.46 47.90 41.49 7.82 coo -11.14 61.91 46.89 -9.88 60.30 48.76 53.74 34.37 2.85 53.64 32.00 1.42 coo -7.71 55.92 42.70 -7.18 57.60 44.85 48.64 38.35 -4.19 49.98 36.56 -5.84 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 5 3 # 5 C 130 SER B 22 SER~? 23.16 O3 GOL B 126 C 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 C 182 PHE A 91 PHE^? 11.91 O6 UNL A 200 coo -2.19 64.27 51.12 -3.34 62.10 50.60 22.70 32.34 19.73 20.75 33.76 19.49 coo -11.14 61.91 46.89 -9.88 60.30 48.76 33.44 31.32 15.89 32.17 28.85 15.98 coo -7.71 55.92 42.70 -7.18 57.60 44.85 28.47 32.27 7.84 28.60 29.55 7.47 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 6 3 # 6 C 130 SER B 22 SER~? 23.16 O3 GOL B 126 C 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 C 182 PHE B 45 PHE^? 13.55 C3 GOL B 126 coo -2.19 64.27 51.12 -3.34 62.10 50.60 22.70 32.34 19.73 20.75 33.76 19.49 coo -11.14 61.91 46.89 -9.88 60.30 48.76 33.44 31.32 15.89 32.17 28.85 15.98 coo -7.71 55.92 42.70 -7.18 57.60 44.85 32.99 25.50 19.27 30.62 26.78 19.90 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 7 3 # 7 C 130 SER B 58 SER.? 12.59 O3 UNL A 200 C 166 PHE A 91 PHE^? 11.91 O6 UNL A 200 C 182 PHE B 55 PHE^? 10.40 O3 GOL B 126 coo -2.19 64.27 51.12 -3.34 62.10 50.60 34.66 41.80 10.52 34.18 41.01 8.30 coo -11.14 61.91 46.89 -9.88 60.30 48.76 28.47 32.27 7.84 28.60 29.55 7.47 coo -7.71 55.92 42.70 -7.18 57.60 44.85 33.44 31.32 15.89 32.17 28.85 15.98 ULMN 3 2r11_o02 CARBOXYLESTERASE NP user 8 3 # 8 C 130 SER B 58 SER.? 12.59 O3 UNL A 200 C 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 C 182 PHE A 91 PHE^? 11.91 O6 UNL A 200 coo -2.19 64.27 51.12 -3.34 62.10 50.60 34.66 41.80 10.52 34.18 41.01 8.30 coo -11.14 61.91 46.89 -9.88 60.30 48.76 33.44 31.32 15.89 32.17 28.85 15.98 coo -7.71 55.92 42.70 -7.18 57.60 44.85 28.47 32.27 7.84 28.60 29.55 7.47 2r11_o02 source 2R11 CARBOXYLESTERASE NP : 8 hits 2r11_o02 naa= 3 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 1 3 # 1 D 130 SER A 22 SER~? 23.06 O1 UNL A 200 D 166 PHE A 45 PHE^? 13.75 O1 UNL A 200 D 182 PHE A 31 PHE~? 18.57 O1 UNL A 200 coo -32.42 55.27 46.18 -30.51 54.94 47.67 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -23.62 58.20 50.84 -23.76 56.14 48.96 49.20 35.83 -10.55 51.58 37.30 -10.35 coo -23.08 51.44 54.96 -24.43 52.71 52.88 54.25 30.54 -13.29 55.26 28.76 -11.37 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 2 3 # 2 D 130 SER A 22 SER~? 23.06 O1 UNL A 200 D 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 D 182 PHE A 45 PHE^? 13.75 O1 UNL A 200 coo -32.42 55.27 46.18 -30.51 54.94 47.67 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -23.62 58.20 50.84 -23.76 56.14 48.96 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -23.08 51.44 54.96 -24.43 52.71 52.88 49.20 35.83 -10.55 51.58 37.30 -10.35 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 3 3 # 3 D 130 SER A 22 SER~? 23.06 O1 UNL A 200 D 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 D 182 PHE B 91 PHE^? 12.14 O2 GOL A 201 coo -32.42 55.27 46.18 -30.51 54.94 47.67 59.17 41.83 -6.71 61.08 42.87 -5.70 coo -23.62 58.20 50.84 -23.76 56.14 48.96 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -23.08 51.44 54.96 -24.43 52.71 52.88 53.74 34.37 2.85 53.64 32.00 1.42 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 4 3 # 4 D 130 SER A 58 SER.? 11.73 O2 GOL B 126 D 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 D 182 PHE A 24 PHE~? 14.46 O1 UNL A 200 coo -32.42 55.27 46.18 -30.51 54.94 47.67 47.20 43.37 6.46 47.90 41.49 7.82 coo -23.62 58.20 50.84 -23.76 56.14 48.96 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -23.08 51.44 54.96 -24.43 52.71 52.88 52.56 41.17 -7.79 50.42 41.37 -5.99 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 5 3 # 5 D 130 SER A 58 SER.? 11.73 O2 GOL B 126 D 166 PHE A 55 PHE^? 10.34 O1 UNL A 200 D 182 PHE B 91 PHE^? 12.14 O2 GOL A 201 coo -32.42 55.27 46.18 -30.51 54.94 47.67 47.20 43.37 6.46 47.90 41.49 7.82 coo -23.62 58.20 50.84 -23.76 56.14 48.96 48.64 38.35 -4.19 49.98 36.56 -5.84 coo -23.08 51.44 54.96 -24.43 52.71 52.88 53.74 34.37 2.85 53.64 32.00 1.42 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 6 3 # 6 D 130 SER A 58 SER.? 11.73 O2 GOL B 126 D 166 PHE B 91 PHE^? 12.14 O2 GOL A 201 D 182 PHE A 55 PHE^? 10.34 O1 UNL A 200 coo -32.42 55.27 46.18 -30.51 54.94 47.67 47.20 43.37 6.46 47.90 41.49 7.82 coo -23.62 58.20 50.84 -23.76 56.14 48.96 53.74 34.37 2.85 53.64 32.00 1.42 coo -23.08 51.44 54.96 -24.43 52.71 52.88 48.64 38.35 -4.19 49.98 36.56 -5.84 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 7 3 # 7 D 130 SER B 22 SER~? 23.16 O3 GOL B 126 D 166 PHE B 45 PHE^? 13.55 C3 GOL B 126 D 182 PHE B 31 PHE~? 13.92 CL CL B 124 coo -32.42 55.27 46.18 -30.51 54.94 47.67 22.70 32.34 19.73 20.75 33.76 19.49 coo -23.62 58.20 50.84 -23.76 56.14 48.96 32.99 25.50 19.27 30.62 26.78 19.90 coo -23.08 51.44 54.96 -24.43 52.71 52.88 28.10 19.46 18.19 27.25 19.09 15.56 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 8 3 # 8 D 130 SER B 22 SER~? 23.16 O3 GOL B 126 D 166 PHE B 45 PHE^? 13.55 C3 GOL B 126 D 182 PHE B 55 PHE^? 10.40 O3 GOL B 126 coo -32.42 55.27 46.18 -30.51 54.94 47.67 22.70 32.34 19.73 20.75 33.76 19.49 coo -23.62 58.20 50.84 -23.76 56.14 48.96 32.99 25.50 19.27 30.62 26.78 19.90 coo -23.08 51.44 54.96 -24.43 52.71 52.88 33.44 31.32 15.89 32.17 28.85 15.98 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 9 3 # 9 D 130 SER B 22 SER~? 23.16 O3 GOL B 126 D 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 D 182 PHE A 91 PHE^? 11.91 O6 UNL A 200 coo -32.42 55.27 46.18 -30.51 54.94 47.67 22.70 32.34 19.73 20.75 33.76 19.49 coo -23.62 58.20 50.84 -23.76 56.14 48.96 33.44 31.32 15.89 32.17 28.85 15.98 coo -23.08 51.44 54.96 -24.43 52.71 52.88 28.47 32.27 7.84 28.60 29.55 7.47 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 10 3 # 10 D 130 SER B 22 SER~? 23.16 O3 GOL B 126 D 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 D 182 PHE B 45 PHE^? 13.55 C3 GOL B 126 coo -32.42 55.27 46.18 -30.51 54.94 47.67 22.70 32.34 19.73 20.75 33.76 19.49 coo -23.62 58.20 50.84 -23.76 56.14 48.96 33.44 31.32 15.89 32.17 28.85 15.98 coo -23.08 51.44 54.96 -24.43 52.71 52.88 32.99 25.50 19.27 30.62 26.78 19.90 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 11 3 # 11 D 130 SER B 58 SER.? 12.59 O3 UNL A 200 D 166 PHE A 91 PHE^? 11.91 O6 UNL A 200 D 182 PHE B 55 PHE^? 10.40 O3 GOL B 126 coo -32.42 55.27 46.18 -30.51 54.94 47.67 34.66 41.80 10.52 34.18 41.01 8.30 coo -23.62 58.20 50.84 -23.76 56.14 48.96 28.47 32.27 7.84 28.60 29.55 7.47 coo -23.08 51.44 54.96 -24.43 52.71 52.88 33.44 31.32 15.89 32.17 28.85 15.98 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 12 3 # 12 D 130 SER B 58 SER.? 12.59 O3 UNL A 200 D 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 D 182 PHE A 91 PHE^? 11.91 O6 UNL A 200 coo -32.42 55.27 46.18 -30.51 54.94 47.67 34.66 41.80 10.52 34.18 41.01 8.30 coo -23.62 58.20 50.84 -23.76 56.14 48.96 33.44 31.32 15.89 32.17 28.85 15.98 coo -23.08 51.44 54.96 -24.43 52.71 52.88 28.47 32.27 7.84 28.60 29.55 7.47 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 13 3 # 13 D 130 SER B 58 SER.? 12.59 O3 UNL A 200 D 166 PHE B 55 PHE^? 10.40 O3 GOL B 126 D 182 PHE B 24 PHE~? 14.50 C3 GOL B 126 coo -32.42 55.27 46.18 -30.51 54.94 47.67 34.66 41.80 10.52 34.18 41.01 8.30 coo -23.62 58.20 50.84 -23.76 56.14 48.96 33.44 31.32 15.89 32.17 28.85 15.98 coo -23.08 51.44 54.96 -24.43 52.71 52.88 29.40 31.22 20.36 31.60 32.46 19.14 ULMN 3 2r11_o03 CARBOXYLESTERASE NP user 14 3 # 14 D 130 SER B 86 SER^? -3.07 O1 UNL A 200s D 166 PHE A 91 PHE^? 11.91 O6 UNL A 200 D 182 PHE B 55 PHE^? 10.40 O3 GOL B 126 coo -32.42 55.27 46.18 -30.51 54.94 47.67 38.80 31.67 1.48 40.20 33.63 1.48 coo -23.62 58.20 50.84 -23.76 56.14 48.96 28.47 32.27 7.84 28.60 29.55 7.47 coo -23.08 51.44 54.96 -24.43 52.71 52.88 33.44 31.32 15.89 32.17 28.85 15.98 2r11_o03 source 2R11 CARBOXYLESTERASE NP : 14 hits 2r11_o03 naa= 3 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 A 49 ASP A 47 ASP^? 15.55 CL CL B 123 A 86 HIS A 48 HIS.? 12.89 CL CL B 123 A 250 ALA B 116 ALA.? 9.15 CL CL B 123 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 43.31 28.55 -18.97 43.37 26.94 -17.63 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 38.93 23.71 -15.82 39.49 24.61 -14.68 ULMN 3 2wwt_o00 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 A 49 ASP B 47 ASP^? 15.68 CL CL A 123 A 86 HIS B 48 HIS.? 12.72 CL CL A 123 A 250 ALA A 116 ALA.? 8.95 CL CL A 123 coo 18.89 -28.09 25.11 19.05 -26.61 23.60 36.24 17.92 20.25 35.18 16.23 20.89 coo 21.50 -24.76 21.11 19.82 -23.58 21.50 39.28 14.76 21.81 39.53 14.41 19.75 coo 16.40 -19.57 19.82 17.00 -20.87 19.22 43.77 13.30 16.69 43.18 14.66 16.33 2wwt_o00 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o00 naa= 3 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 B 49 ASP A 47 ASP^? 15.55 CL CL B 123 B 86 HIS A 48 HIS.? 12.89 CL CL B 123 B 250 ALA B 116 ALA.? 9.15 CL CL B 123 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 43.31 28.55 -18.97 43.37 26.94 -17.63 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 38.93 23.71 -15.82 39.49 24.61 -14.68 ULMN 3 2wwt_o01 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 B 49 ASP B 47 ASP^? 15.68 CL CL A 123 B 86 HIS B 48 HIS.? 12.72 CL CL A 123 B 250 ALA A 116 ALA.? 8.95 CL CL A 123 coo -25.60 -8.15 41.87 -24.93 -7.05 43.55 36.24 17.92 20.25 35.18 16.23 20.89 coo -24.87 -3.97 45.59 -22.79 -4.09 45.73 39.28 14.76 21.81 39.53 14.41 19.75 coo -17.45 -4.02 46.78 -18.80 -4.41 47.26 43.77 13.30 16.69 43.18 14.66 16.33 2wwt_o01 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o01 naa= 3 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 C 49 ASP A 47 ASP^? 15.55 CL CL B 123 C 86 HIS A 48 HIS.? 12.89 CL CL B 123 C 250 ALA B 116 ALA.? 9.15 CL CL B 123 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 43.31 28.55 -18.97 43.37 26.94 -17.63 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 38.93 23.71 -15.82 39.49 24.61 -14.68 ULMN 3 2wwt_o02 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 C 49 ASP B 47 ASP^? 15.68 CL CL A 123 C 86 HIS B 48 HIS.? 12.72 CL CL A 123 C 250 ALA A 116 ALA.? 8.95 CL CL A 123 coo 52.29 -8.84 6.54 53.45 -9.52 8.16 36.24 17.92 20.25 35.18 16.23 20.89 coo 56.78 -9.42 10.42 56.27 -11.41 10.02 39.28 14.76 21.81 39.53 14.41 19.75 coo 56.74 -16.59 11.78 56.33 -15.18 12.23 43.77 13.30 16.69 43.18 14.66 16.33 2wwt_o02 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o02 naa= 3 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 D 49 ASP A 47 ASP^? 15.55 CL CL B 123 D 86 HIS A 48 HIS.? 12.89 CL CL B 123 D 250 ALA B 116 ALA.? 9.15 CL CL B 123 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 43.31 28.55 -18.97 43.37 26.94 -17.63 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 38.93 23.71 -15.82 39.49 24.61 -14.68 ULMN 3 2wwt_o03 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 D 49 ASP B 47 ASP^? 15.68 CL CL A 123 D 86 HIS B 48 HIS.? 12.72 CL CL A 123 D 250 ALA A 116 ALA.? 8.95 CL CL A 123 coo 33.58 -54.23 -8.77 34.81 -54.76 -10.41 36.24 17.92 20.25 35.18 16.23 20.89 coo 36.78 -56.86 -12.59 37.95 -55.16 -12.26 39.28 14.76 21.81 39.53 14.41 19.75 coo 41.85 -51.50 -13.98 40.55 -52.02 -14.52 43.77 13.30 16.69 43.18 14.66 16.33 2wwt_o03 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o03 naa= 3 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 E 49 ASP A 47 ASP^? 15.55 CL CL B 123 E 86 HIS A 48 HIS.? 12.89 CL CL B 123 E 250 ALA B 116 ALA.? 9.15 CL CL B 123 coo -36.18 24.97 18.78 -36.93 26.11 17.11 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -36.85 29.32 15.06 -38.90 29.14 15.48 43.31 28.55 -18.97 43.37 26.94 -17.63 coo -44.49 29.68 13.98 -43.47 28.67 13.52 38.93 23.71 -15.82 39.49 24.61 -14.68 ULMN 3 2wwt_o04 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 E 49 ASP B 47 ASP^? 15.68 CL CL A 123 E 86 HIS B 48 HIS.? 12.72 CL CL A 123 E 250 ALA A 116 ALA.? 8.95 CL CL A 123 coo -36.18 24.97 18.78 -36.93 26.11 17.11 36.24 17.92 20.25 35.18 16.23 20.89 coo -36.85 29.32 15.06 -38.90 29.14 15.48 39.28 14.76 21.81 39.53 14.41 19.75 coo -44.49 29.68 13.98 -43.47 28.67 13.52 43.77 13.30 16.69 43.18 14.66 16.33 2wwt_o04 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o04 naa= 3 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 1 3 # 1 F 49 ASP A 47 ASP^? 15.55 CL CL B 123 F 86 HIS A 48 HIS.? 12.89 CL CL B 123 F 250 ALA B 116 ALA.? 9.15 CL CL B 123 coo -82.12 8.55 35.60 -81.93 9.84 37.19 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -84.21 11.81 39.90 -82.43 12.70 39.26 43.31 28.55 -18.97 43.37 26.94 -17.63 coo -78.49 17.13 41.31 -79.25 15.85 41.61 38.93 23.71 -15.82 39.49 24.61 -14.68 ULMN 3 2wwt_o05 INTRACELLULAR SUBTILISIN PROTEASE user 2 3 # 2 F 49 ASP B 47 ASP^? 15.68 CL CL A 123 F 86 HIS B 48 HIS.? 12.72 CL CL A 123 F 250 ALA A 116 ALA.? 8.95 CL CL A 123 coo -82.12 8.55 35.60 -81.93 9.84 37.19 36.24 17.92 20.25 35.18 16.23 20.89 coo -84.21 11.81 39.90 -82.43 12.70 39.26 39.28 14.76 21.81 39.53 14.41 19.75 coo -78.49 17.13 41.31 -79.25 15.85 41.61 43.77 13.30 16.69 43.18 14.66 16.33 2wwt_o05 source 2WWT INTRACELLULAR SUBTILISIN PROTEASE : 2 hits 2wwt_o05 naa= 3 ULMN 3 3hde_o00 LYSOZYME user 1 3 # 1 A 35 GLU A 21 GLU~? 22.63 O1 UNL A 200 A 44 ASP A 15 ASP~? 26.19 O1 GOL B 126 A 50 THR A 13 THR~? 22.54 O1 GOL B 126 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 55.82 46.81 -6.36 56.64 48.78 -6.25 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 60.61 47.40 3.28 62.48 48.35 3.41 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 55.62 50.17 4.36 56.58 48.88 5.81 ULMN 3 3hde_o00 LYSOZYME user 2 3 # 2 A 35 GLU A 21 GLU~? 22.63 O1 UNL A 200 A 44 ASP A 16 ASP~? 19.78 O1 GOL B 126 A 50 THR A 13 THR~? 22.54 O1 GOL B 126 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 55.82 46.81 -6.36 56.64 48.78 -6.25 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 55.39 45.97 3.05 55.87 45.57 5.11 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 55.62 50.17 4.36 56.58 48.88 5.81 ULMN 3 3hde_o00 LYSOZYME user 3 3 # 3 A 35 GLU A 37 GLU^? 12.49 O10 UNL A 200 A 44 ASP A 47 ASP^? 15.55 CL CL B 123 A 50 THR A 50 THR^? 9.21 CL CL B 123 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 42.91 39.28 -14.45 41.15 38.40 -15.23 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 40.57 30.50 -14.04 41.23 28.58 -14.86 ULMN 3 3hde_o00 LYSOZYME user 4 3 # 4 A 35 GLU A 67 GLU~? 5.52 O4 UNL A 200 A 44 ASP A 47 ASP^? 15.55 CL CL B 123 A 50 THR A 46 THR^? 11.88 CL CL B 123 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 41.87 27.48 -6.41 39.78 28.14 -6.44 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 44.43 34.05 -13.46 43.00 35.60 -13.85 ULMN 3 3hde_o00 LYSOZYME user 5 3 # 5 A 35 GLU A 67 GLU~? 5.52 O4 UNL A 200 A 44 ASP A 47 ASP^? 15.55 CL CL B 123 A 50 THR A 50 THR^? 9.21 CL CL B 123 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 41.87 27.48 -6.41 39.78 28.14 -6.44 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 40.57 30.50 -14.04 41.23 28.58 -14.86 ULMN 3 3hde_o00 LYSOZYME user 6 3 # 6 A 35 GLU B 21 GLU~? 22.82 C3 GOL B 126 A 44 ASP B 15 ASP~? 25.69 O9 UNL A 200 A 50 THR B 13 THR~? 22.22 O9 UNL A 200 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 25.81 36.56 22.58 24.87 38.21 23.53 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 21.08 42.76 15.13 19.15 43.54 15.67 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 26.14 45.78 16.10 25.30 45.56 14.11 ULMN 3 3hde_o00 LYSOZYME user 7 3 # 7 A 35 GLU B 21 GLU~? 22.82 C3 GOL B 126 A 44 ASP B 16 ASP~? 19.71 O9 UNL A 200 A 50 THR B 13 THR~? 22.22 O9 UNL A 200 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 25.81 36.56 22.58 24.87 38.21 23.53 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 26.40 41.60 14.58 25.93 42.50 12.70 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 26.14 45.78 16.10 25.30 45.56 14.11 ULMN 3 3hde_o00 LYSOZYME user 8 3 # 8 A 35 GLU B 37 GLU^? 6.72 O2 GOL B 125 A 44 ASP B 47 ASP^? 15.68 CL CL A 123 A 50 THR B 50 THR^? 8.67 CL CL A 123 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 39.03 25.88 24.92 40.77 24.72 25.06 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 36.24 17.92 20.25 35.18 16.23 20.89 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 41.85 19.42 19.33 41.41 17.97 17.75 ULMN 3 3hde_o00 LYSOZYME user 9 3 # 9 A 35 GLU B 67 GLU~? 5.53 O3 GOL A 201 A 44 ASP B 47 ASP^? 15.68 CL CL A 123 A 50 THR B 46 THR^? 9.21 O2 GOL B 125 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 40.62 21.48 11.23 42.64 22.01 11.70 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 36.24 17.92 20.25 35.18 16.23 20.89 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 37.69 22.33 20.76 39.06 23.33 22.13 ULMN 3 3hde_o00 LYSOZYME user 10 3 # 10 A 35 GLU B 67 GLU~? 5.53 O3 GOL A 201 A 44 ASP B 47 ASP^? 15.68 CL CL A 123 A 50 THR B 50 THR^? 8.67 CL CL A 123 coo 3.19 -22.62 -21.80 4.26 -21.93 -23.46 40.62 21.48 11.23 42.64 22.01 11.70 coo -3.28 -18.53 -28.91 -2.33 -19.01 -30.75 36.24 17.92 20.25 35.18 16.23 20.89 coo -4.91 -24.14 -27.53 -3.37 -22.71 -27.06 41.85 19.42 19.33 41.41 17.97 17.75 3hde_o00 source 3HDE LYSOZYME : 10 hits 3hde_o00 naa= 3 ULMN 3 3hde_o01 LYSOZYME user 1 3 # 1 B 35 GLU A 21 GLU~? 22.63 O1 UNL A 200 B 44 ASP A 15 ASP~? 26.19 O1 GOL B 126 B 50 THR A 13 THR~? 22.54 O1 GOL B 126 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 55.82 46.81 -6.36 56.64 48.78 -6.25 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 60.61 47.40 3.28 62.48 48.35 3.41 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 55.62 50.17 4.36 56.58 48.88 5.81 ULMN 3 3hde_o01 LYSOZYME user 2 3 # 2 B 35 GLU A 67 GLU~? 5.52 O4 UNL A 200 B 44 ASP A 47 ASP^? 15.55 CL CL B 123 B 50 THR A 46 THR^? 11.88 CL CL B 123 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 41.87 27.48 -6.41 39.78 28.14 -6.44 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 46.06 30.34 -15.72 47.22 29.37 -17.24 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 44.43 34.05 -13.46 43.00 35.60 -13.85 ULMN 3 3hde_o01 LYSOZYME user 3 3 # 3 B 35 GLU A 99 GLU~? 18.98 CL CL B 124 B 44 ASP B 16 ASP~? 19.71 O9 UNL A 200 B 50 THR B 18 THR~? 24.71 O3 GOL B 126 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 22.47 28.68 12.84 21.91 29.15 14.84 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 26.40 41.60 14.58 25.93 42.50 12.70 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 22.78 38.34 19.37 20.77 39.03 19.72 ULMN 3 3hde_o01 LYSOZYME user 4 3 # 4 B 35 GLU B 21 GLU~? 22.82 C3 GOL B 126 B 44 ASP B 15 ASP~? 25.69 O9 UNL A 200 B 50 THR B 13 THR~? 22.22 O9 UNL A 200 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 25.81 36.56 22.58 24.87 38.21 23.53 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 21.08 42.76 15.13 19.15 43.54 15.67 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 26.14 45.78 16.10 25.30 45.56 14.11 ULMN 3 3hde_o01 LYSOZYME user 5 3 # 5 B 35 GLU B 67 GLU~? 5.53 O3 GOL A 201 B 44 ASP B 47 ASP^? 15.68 CL CL A 123 B 50 THR B 46 THR^? 9.21 O2 GOL B 125 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 40.62 21.48 11.23 42.64 22.01 11.70 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 36.24 17.92 20.25 35.18 16.23 20.89 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 37.69 22.33 20.76 39.06 23.33 22.13 ULMN 3 3hde_o01 LYSOZYME user 6 3 # 6 B 35 GLU B 99 GLU~? 20.37 O1 UNL A 200 B 44 ASP A 16 ASP~? 19.78 O1 GOL B 126 B 50 THR A 18 THR~? 24.66 O1 UNL A 200 coo -10.34 -10.51 -29.93 -8.23 -10.47 -29.91 59.74 34.86 -3.51 60.17 36.42 -4.90 coo -0.99 -14.50 -23.89 0.18 -12.74 -23.86 55.39 45.97 3.05 55.87 45.57 5.11 coo -5.24 -12.06 -20.18 -4.96 -12.24 -22.31 59.01 46.38 -2.71 61.05 47.10 -2.52 3hde_o01 source 3HDE LYSOZYME : 6 hits 3hde_o01 naa= 3 ULMN 3 3hde_o02 LYSOZYME user 1 3 # 1 C 35 GLU A 21 GLU~? 22.63 O1 UNL A 200 C 44 ASP A 15 ASP~? 26.19 O1 GOL B 126 C 50 THR A 13 THR~? 22.54 O1 GOL B 126 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 55.82 46.81 -6.36 56.64 48.78 -6.25 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 60.61 47.40 3.28 62.48 48.35 3.41 coo 25.48 4.87 1.60 23.90 4.95 0.15 55.62 50.17 4.36 56.58 48.88 5.81 ULMN 3 3hde_o02 LYSOZYME user 2 3 # 2 C 35 GLU A 67 GLU~? 5.52 O4 UNL A 200 C 44 ASP A 47 ASP^? 15.55 CL CL B 123 C 50 THR A 46 THR^? 11.88 CL CL B 123 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 46.06 30.34 -15.72 47.22 29.37 -17.24 coo 25.48 4.87 1.60 23.90 4.95 0.15 44.43 34.05 -13.46 43.00 35.60 -13.85 ULMN 3 3hde_o02 LYSOZYME user 3 3 # 3 C 35 GLU A 67 GLU~? 5.52 O4 UNL A 200 C 44 ASP B 115 ASP.? 16.66 CL CL B 123 C 50 THR B 117 THR.? 9.48 CL CL B 123 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 41.87 27.48 -6.41 39.78 28.14 -6.44 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 40.90 20.11 -18.41 42.52 19.20 -19.45 coo 25.48 4.87 1.60 23.90 4.95 0.15 35.62 25.18 -17.07 34.59 23.37 -17.57 ULMN 3 3hde_o02 LYSOZYME user 4 3 # 4 C 35 GLU A 99 GLU~? 18.98 CL CL B 124 C 44 ASP B 16 ASP~? 19.71 O9 UNL A 200 C 50 THR B 18 THR~? 24.71 O3 GOL B 126 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 22.47 28.68 12.84 21.91 29.15 14.84 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 26.40 41.60 14.58 25.93 42.50 12.70 coo 25.48 4.87 1.60 23.90 4.95 0.15 22.78 38.34 19.37 20.77 39.03 19.72 ULMN 3 3hde_o02 LYSOZYME user 5 3 # 5 C 35 GLU B 21 GLU~? 22.82 C3 GOL B 126 C 44 ASP B 15 ASP~? 25.69 O9 UNL A 200 C 50 THR B 13 THR~? 22.22 O9 UNL A 200 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 25.81 36.56 22.58 24.87 38.21 23.53 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 21.08 42.76 15.13 19.15 43.54 15.67 coo 25.48 4.87 1.60 23.90 4.95 0.15 26.14 45.78 16.10 25.30 45.56 14.11 ULMN 3 3hde_o02 LYSOZYME user 6 3 # 6 C 35 GLU B 67 GLU~? 5.53 O3 GOL A 201 C 44 ASP A 115 ASP.? 16.41 CL CL A 123 C 50 THR A 117 THR.? 9.36 CL CL A 123 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 40.62 21.48 11.23 42.64 22.01 11.70 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 42.06 8.77 16.59 40.52 7.32 16.97 coo 25.48 4.87 1.60 23.90 4.95 0.15 47.06 13.65 18.60 48.13 11.99 17.78 ULMN 3 3hde_o02 LYSOZYME user 7 3 # 7 C 35 GLU B 67 GLU~? 5.53 O3 GOL A 201 C 44 ASP B 47 ASP^? 15.68 CL CL A 123 C 50 THR B 46 THR^? 9.21 O2 GOL B 125 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 40.62 21.48 11.23 42.64 22.01 11.70 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 36.24 17.92 20.25 35.18 16.23 20.89 coo 25.48 4.87 1.60 23.90 4.95 0.15 37.69 22.33 20.76 39.06 23.33 22.13 ULMN 3 3hde_o02 LYSOZYME user 8 3 # 8 C 35 GLU B 99 GLU~? 20.37 O1 UNL A 200 C 44 ASP A 16 ASP~? 19.78 O1 GOL B 126 C 50 THR A 18 THR~? 24.66 O1 UNL A 200 coo 15.89 -0.52 0.58 15.91 1.38 -0.35 59.74 34.86 -3.51 60.17 36.42 -4.90 coo 24.21 6.79 -4.52 23.75 8.67 -3.70 55.39 45.97 3.05 55.87 45.57 5.11 coo 25.48 4.87 1.60 23.90 4.95 0.15 59.01 46.38 -2.71 61.05 47.10 -2.52 3hde_o02 source 3HDE LYSOZYME : 8 hits 3hde_o02 naa= 3 ULMN 3 3o4g_o02 ACYLAMINO-ACID-RELEASING ENZYME user 1 3 # 1 C 445 SER B 86 SER^? -3.07 O1 UNL A 200s C 524 ASP B 84 ASP.? -3.52 O9 UNL A 200s C 556 HIS B 85 HIS^? -3.53 O6 UNL A 200s coo -35.83 1.21 57.61 -37.94 0.15 57.18 38.80 31.67 1.48 40.20 33.63 1.48 coo -39.65 7.59 52.45 -39.69 5.70 53.46 32.50 34.12 -0.35 31.64 35.02 -2.06 coo -39.51 2.45 52.87 -38.69 1.68 54.64 35.07 28.78 -0.10 35.41 27.96 -2.01 3o4g_o02 source 3O4G ACYLAMINO-ACID-RELEASING ENZYME : 1 hits 3o4g_o02 naa= 3