==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-DEC-08 2ZW6 . COMPND 2 MOLECULE: BLEOMYCIN ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES VERTICILLUS; . AUTHOR K.ODA,Y.MATOBA,M.SUGIYAMA . 591 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26995.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 393 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 138 23.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 54 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 110 18.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 2 2 2 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 2 1 4 6 4 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 5 A P 0 0 100 0, 0.0 2,-0.3 0, 0.0 62,-0.1 0.000 360.0 360.0 360.0-118.1 -6.7 61.6 15.0 2 6 A R + 0 0 221 60,-0.2 0, 0.0 1,-0.2 0, 0.0 -0.686 360.0 9.0 90.9-131.7 -8.2 63.2 12.0 3 7 A A + 0 0 79 -2,-0.3 2,-0.6 1,-0.2 -1,-0.2 0.952 46.5 176.3 -50.4-103.8 -10.9 65.9 11.8 4 8 A H + 0 0 43 -3,-0.1 2,-0.3 61,-0.1 -1,-0.2 -0.957 6.2 169.6 127.6-100.8 -12.1 67.6 15.0 5 9 A T + 0 0 123 -2,-0.6 -2,-0.0 1,-0.3 -1,-0.0 -0.269 36.7 124.1 84.5 -35.0 -14.6 70.1 13.8 6 10 A A - 0 0 31 -2,-0.3 2,-0.5 10,-0.1 -1,-0.3 -0.205 45.8-160.3 -61.2 137.0 -15.8 70.8 17.3 7 11 A H - 0 0 85 9,-0.1 2,-0.7 -3,-0.1 9,-0.2 -0.977 12.2-144.2-118.6 116.7 -15.7 74.3 18.8 8 12 A L E -A 15 0A 18 7,-1.3 7,-2.8 -2,-0.5 2,-0.5 -0.732 18.1-170.1 -87.7 117.2 -15.8 74.5 22.7 9 13 A R E +A 14 0A 189 -2,-0.7 5,-0.2 5,-0.2 2,-0.2 -0.927 9.7 170.7-111.9 125.7 -17.8 77.5 23.9 10 14 A T - 0 0 37 3,-1.9 3,-0.3 -2,-0.5 98,-0.1 -0.565 51.1 -69.9-119.9-174.6 -17.9 78.6 27.5 11 15 A A S S- 0 0 95 1,-0.2 -2,-0.0 -2,-0.2 3,-0.0 0.855 127.2 -0.7 -44.1 -52.7 -19.1 81.4 29.7 12 16 A R S S+ 0 0 96 92,-0.1 2,-0.3 59,-0.0 -1,-0.2 0.138 123.3 72.4-129.2 19.7 -16.6 84.0 28.4 13 17 A L - 0 0 8 -3,-0.3 -3,-1.9 58,-0.2 2,-0.4 -0.888 52.9-153.4-137.9 166.2 -14.6 82.0 25.9 14 18 A E E -AB 9 70A 69 56,-1.7 56,-3.5 -2,-0.3 2,-0.6 -0.997 13.5-155.2-135.8 131.8 -14.5 80.3 22.6 15 19 A L E -AB 8 69A 0 -7,-2.8 -7,-1.3 -2,-0.4 54,-0.2 -0.949 14.7-172.8-111.5 112.4 -12.2 77.4 21.9 16 20 A T E - B 0 68A 16 52,-2.4 52,-2.9 -2,-0.6 -9,-0.1 -0.894 39.3 -94.1-109.4 134.5 -11.4 77.0 18.2 17 21 A P E - B 0 67A 32 0, 0.0 50,-0.3 0, 0.0 64,-0.1 -0.208 58.1-101.4 -45.7 117.6 -9.5 74.0 16.8 18 22 A L - 0 0 23 48,-1.5 48,-0.1 62,-0.1 61,-0.0 -0.088 34.5-165.8 -47.5 137.0 -5.9 75.2 16.9 19 23 A D >> - 0 0 79 1,-0.2 4,-2.6 -3,-0.1 5,-0.5 -0.883 7.3-157.5-128.5 94.7 -4.4 76.4 13.5 20 24 A P H >5S+ 0 0 20 0, 0.0 4,-3.2 0, 0.0 -1,-0.2 0.881 89.5 39.9 -35.2 -82.9 -0.6 76.7 13.8 21 25 A A H >5S+ 0 0 60 1,-0.2 4,-0.5 2,-0.2 31,-0.1 0.853 120.3 47.8 -36.4 -54.2 0.1 79.1 11.0 22 26 A A H 45S+ 0 0 57 1,-0.2 3,-0.4 2,-0.1 4,-0.2 0.956 125.2 23.3 -54.7 -63.6 -3.0 81.2 11.9 23 27 A D H >X5S+ 0 0 15 -4,-2.6 3,-2.4 1,-0.2 4,-1.5 0.791 92.6 96.3 -78.3 -34.5 -2.6 81.6 15.6 24 28 A A H 3XX S+ 0 0 2 -4,-1.5 4,-2.1 1,-0.3 3,-1.7 0.686 92.4 76.3 -57.8 -18.6 0.3 81.9 21.0 28 32 A H H 3X S+ 0 0 39 -4,-2.0 4,-2.0 -5,-0.4 -1,-0.3 0.756 79.7 71.5 -66.5 -19.5 4.0 82.9 20.7 29 33 A H H <4 S+ 0 0 70 -3,-2.6 68,-0.3 -4,-0.2 -1,-0.3 0.803 111.2 30.9 -63.7 -26.1 3.2 85.3 23.6 30 34 A A H X4 S+ 0 0 1 -3,-1.7 3,-2.2 -4,-0.3 -2,-0.2 0.909 123.6 42.0 -93.3 -65.1 3.0 82.1 25.7 31 35 A Y H 3< S+ 0 0 4 -4,-2.1 14,-2.2 1,-0.3 -3,-0.2 0.689 116.0 51.6 -57.9 -22.1 5.4 79.7 24.1 32 36 A G T 3< S+ 0 0 25 -4,-2.0 2,-0.6 -5,-0.3 -1,-0.3 0.505 87.4 103.4 -93.4 -4.3 8.0 82.4 23.6 33 37 A D <> - 0 0 32 -3,-2.2 4,-2.0 1,-0.2 5,-0.1 -0.694 56.8-160.6 -84.5 114.8 7.8 83.5 27.2 34 38 A E T 4 S+ 0 0 149 -2,-0.6 4,-0.3 2,-0.2 -1,-0.2 0.940 95.3 46.4 -56.0 -49.7 10.7 82.3 29.3 35 39 A E T >4 S+ 0 0 92 1,-0.2 3,-2.1 2,-0.2 4,-0.3 0.981 113.9 46.3 -56.3 -61.4 8.7 82.8 32.5 36 40 A V T 34 S+ 0 0 7 1,-0.3 3,-0.4 -7,-0.2 -1,-0.2 0.750 115.8 48.2 -54.8 -25.7 5.6 81.1 31.2 37 41 A M T >< S+ 0 0 5 -4,-2.0 3,-0.9 1,-0.2 -1,-0.3 0.310 77.1 100.3-101.4 10.1 7.7 78.2 29.8 38 42 A R T < S+ 0 0 141 -3,-2.1 -1,-0.2 -4,-0.3 -2,-0.1 0.728 91.2 42.6 -65.9 -20.2 9.8 77.5 33.0 39 43 A W T 3 S+ 0 0 73 -3,-0.4 91,-0.3 -4,-0.3 -1,-0.2 0.478 96.9 106.4-102.8 -4.7 7.5 74.6 33.7 40 44 A W S < S- 0 0 34 -3,-0.9 4,-0.1 2,-0.2 -3,-0.1 -0.235 80.7-112.5 -76.5 163.9 7.3 73.3 30.2 41 45 A T S S+ 0 0 73 2,-0.1 116,-0.2 -2,-0.0 -1,-0.1 0.453 99.3 22.7 -74.0 -3.3 8.8 70.2 28.6 42 46 A R S S- 0 0 47 -5,-0.2 -2,-0.2 113,-0.1 3,-0.1 -0.976 94.2 -83.8-156.2 160.7 11.2 72.3 26.4 43 47 A P - 0 0 61 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.019 60.4 -76.7 -61.8 174.4 12.6 75.8 26.3 44 48 A A - 0 0 24 -12,-0.1 2,-0.3 1,-0.1 -12,-0.3 -0.386 53.0 -99.6 -72.6 154.5 10.8 78.8 25.0 45 49 A C - 0 0 5 -14,-2.2 -1,-0.1 1,-0.1 6,-0.1 -0.571 21.8-137.0 -76.3 133.2 10.5 79.3 21.2 46 50 A A S S- 0 0 79 -2,-0.3 -1,-0.1 1,-0.1 -14,-0.1 0.842 80.6 -13.9 -59.0 -35.1 13.0 81.7 19.8 47 51 A D S > S- 0 0 69 1,-0.1 4,-1.8 -16,-0.0 3,-0.4 -0.950 79.9 -84.8-158.3 173.3 10.4 83.3 17.6 48 52 A P H > S+ 0 0 53 0, 0.0 4,-4.2 0, 0.0 5,-0.3 0.875 122.7 61.5 -54.8 -39.6 6.8 82.7 16.2 49 53 A A H > S+ 0 0 68 1,-0.3 4,-2.7 2,-0.2 5,-0.1 0.937 107.3 44.6 -51.9 -49.1 8.3 80.6 13.4 50 54 A E H > S+ 0 0 43 -3,-0.4 4,-3.0 1,-0.2 -1,-0.3 0.838 113.9 51.0 -63.5 -34.0 9.6 78.2 16.0 51 55 A T H X S+ 0 0 0 -4,-1.8 4,-3.5 2,-0.2 5,-0.2 0.925 109.6 48.4 -69.8 -44.4 6.2 78.5 17.8 52 56 A E H X S+ 0 0 76 -4,-4.2 4,-2.2 2,-0.2 -2,-0.2 0.930 113.5 49.3 -59.8 -44.4 4.3 77.7 14.5 53 57 A R H X S+ 0 0 132 -4,-2.7 4,-2.8 -5,-0.3 3,-0.5 0.984 114.3 43.2 -56.6 -61.5 6.7 74.8 14.0 54 58 A Y H X S+ 0 0 34 -4,-3.0 4,-3.0 1,-0.3 5,-0.3 0.932 112.7 52.7 -50.1 -54.3 6.2 73.5 17.6 55 59 A L H X S+ 0 0 0 -4,-3.5 4,-2.5 1,-0.2 -1,-0.3 0.863 111.3 49.0 -50.2 -39.1 2.4 74.0 17.4 56 60 A T H X S+ 0 0 59 -4,-2.2 4,-3.4 -3,-0.5 5,-0.3 0.942 109.3 48.7 -68.8 -50.7 2.4 72.0 14.2 57 61 A S H X S+ 0 0 52 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.923 116.1 45.9 -55.9 -41.8 4.4 69.1 15.5 58 62 A C H < S+ 0 0 31 -4,-3.0 26,-0.3 -5,-0.2 -2,-0.2 0.914 113.4 48.9 -66.5 -42.0 2.1 69.1 18.5 59 63 A A H < S+ 0 0 39 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.892 112.0 48.5 -63.9 -42.0 -1.0 69.4 16.3 60 64 A A H < S+ 0 0 77 -4,-3.4 -1,-0.2 -5,-0.1 -2,-0.2 0.856 85.2 119.2 -66.9 -36.8 0.3 66.6 14.0 61 65 A A S >< S- 0 0 24 -4,-2.0 3,-1.2 -5,-0.3 24,-0.2 0.100 84.6 -86.2 -31.0 139.0 0.9 64.4 17.0 62 66 A P T 3 S- 0 0 83 0, 0.0 -60,-0.2 0, 0.0 22,-0.1 0.685 111.1 -2.9 -15.7-101.0 -1.2 61.1 17.0 63 67 A G T 3 S+ 0 0 36 -62,-0.1 -2,-0.1 20,-0.1 19,-0.1 0.253 88.6 157.9 -91.1 15.6 -4.5 61.9 18.5 64 68 A A < - 0 0 11 -3,-1.2 2,-0.3 -6,-0.2 19,-0.2 -0.047 17.2-177.1 -42.2 129.2 -3.7 65.5 19.5 65 69 A R E + C 0 82A 73 17,-3.1 17,-2.3 2,-0.0 2,-0.3 -0.766 14.6 167.6-134.5 85.8 -6.9 67.6 19.9 66 70 A L E - C 0 81A 13 -2,-0.3 -48,-1.5 15,-0.3 2,-0.3 -0.699 16.1-167.4-105.5 156.7 -6.0 71.2 20.6 67 71 A W E -BC 17 80A 0 13,-1.4 13,-2.0 -50,-0.3 2,-0.4 -0.912 19.3-128.4-133.5 159.8 -8.0 74.4 20.7 68 72 A T E -BC 16 79A 0 -52,-2.9 -52,-2.4 -2,-0.3 2,-0.6 -0.908 27.9-123.0-110.2 140.3 -7.0 78.1 20.9 69 73 A I E -BC 15 78A 0 9,-3.1 2,-0.5 -2,-0.4 9,-0.5 -0.753 25.8-167.6 -89.4 119.4 -8.6 80.2 23.5 70 74 A R E -B 14 0A 67 -56,-3.5 -56,-1.7 -2,-0.6 6,-0.2 -0.928 5.7-154.4-111.5 126.0 -10.5 83.2 22.3 71 75 A A > - 0 0 7 4,-3.4 3,-1.8 -2,-0.5 -58,-0.2 -0.571 28.7-113.7 -91.2 158.5 -11.7 85.9 24.7 72 76 A P T 3 S+ 0 0 106 0, 0.0 -1,-0.1 0, 0.0 -59,-0.1 0.812 117.0 59.4 -61.9 -31.0 -14.7 88.1 23.9 73 77 A D T 3 S- 0 0 111 1,-0.1 -3,-0.0 2,-0.1 0, 0.0 0.410 126.1-102.6 -78.1 3.0 -12.4 91.2 23.6 74 78 A G S < S+ 0 0 56 -3,-1.8 2,-0.1 1,-0.3 -1,-0.1 0.456 77.0 139.5 90.8 1.9 -10.6 89.4 20.8 75 79 A T - 0 0 52 -5,-0.1 -4,-3.4 1,-0.0 -1,-0.3 -0.469 49.3-141.5 -80.3 153.1 -7.6 88.3 22.9 76 80 A V - 0 0 5 -6,-0.2 -6,-0.2 1,-0.2 20,-0.1 -0.872 17.6-176.2-115.2 90.6 -6.0 84.9 22.6 77 81 A P - 0 0 0 0, 0.0 19,-2.2 0, 0.0 2,-0.3 0.828 55.1 -81.6 -54.1 -39.7 -5.1 84.0 26.3 78 82 A G E -CD 69 95A 1 -9,-0.5 -9,-3.1 17,-0.2 2,-0.3 -0.970 53.2 -62.3 166.5-151.3 -3.5 80.8 25.2 79 83 A M E +CD 68 94A 2 15,-1.8 15,-2.2 -2,-0.3 2,-0.3 -0.803 32.7 179.2-127.4 168.7 -4.2 77.2 24.2 80 84 A A E +CD 67 93A 0 -13,-2.0 -13,-1.4 -2,-0.3 13,-0.2 -0.874 23.0 108.7-169.4 133.8 -5.7 74.1 25.7 81 85 A G E -CD 66 92A 0 11,-2.2 11,-1.4 -2,-0.3 2,-0.5 -0.845 59.8 -54.5-170.8-150.7 -6.5 70.6 24.6 82 86 A L E -C 65 0A 18 -17,-2.3 -17,-3.1 -2,-0.2 9,-0.2 -0.978 47.3-131.8-121.8 117.7 -5.8 66.9 24.6 83 87 A L - 0 0 74 -2,-0.5 7,-0.5 -19,-0.2 2,-0.3 -0.310 17.7-140.3 -68.1 151.5 -2.2 65.7 23.8 84 88 A G S S+ 0 0 18 -26,-0.3 -23,-0.1 1,-0.2 3,-0.1 -0.840 72.7 52.1-112.7 150.6 -1.7 62.9 21.3 85 89 A G S S+ 0 0 59 -2,-0.3 -1,-0.2 1,-0.2 2,-0.1 0.621 83.5 106.4 102.7 17.1 0.8 60.0 21.6 86 90 A T - 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