==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 30-OCT-07 2ZBZ . COMPND 2 MOLECULE: CYTOCHROME P450-SU1; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES GRISEOLUS; . AUTHOR H.SUGIMOTO,R.SHINKYO,K.HAYASHI,S.YONEDA,M.YAMADA,M.KAMAKURA, . 404 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17750.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 269 66.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 25 6.2 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 0 0.0 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 . 18 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 154 38.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.7 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 2 0 1 1 1 2 0 1 2 0 0 0 0 0 1 0 0 0 0 0 2 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 0 1 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 0 0 PARALLEL BRIDGES PER LADDER . 1 3 2 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 0 1 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 4 A T 0 0 179 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 167.8 -9.3 -26.9 32.2 2 5 A A + 0 0 73 1,-0.1 4,-0.1 4,-0.0 0, 0.0 -0.528 360.0 171.2 -69.2 115.3 -5.7 -27.2 30.8 3 6 A T + 0 0 129 -2,-0.5 -1,-0.1 2,-0.1 3,-0.1 0.235 52.3 74.6-111.0 10.7 -4.0 -30.1 32.6 4 7 A T S S- 0 0 95 1,-0.1 -2,-0.0 2,-0.0 0, 0.0 -0.774 95.1 -65.6-123.8 164.1 -0.8 -30.3 30.5 5 8 A P - 0 0 120 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.126 38.9-148.8 -51.0 145.5 2.5 -28.3 30.1 6 9 A Q + 0 0 142 -4,-0.1 -4,-0.0 -3,-0.1 -2,-0.0 0.358 45.9 133.7-108.5 2.7 1.9 -24.8 28.7 7 10 A T - 0 0 142 2,-0.0 2,-0.3 1,-0.0 0, 0.0 -0.225 35.1-166.9 -52.9 138.9 5.2 -24.2 26.7 8 11 A T - 0 0 85 1,-0.1 -2,-0.1 0, 0.0 -1,-0.0 -0.909 30.5-150.1-128.0 157.2 4.6 -22.7 23.3 9 12 A D S S+ 0 0 107 -2,-0.3 30,-0.4 1,-0.2 -1,-0.1 0.312 98.2 55.4-104.8 4.6 6.7 -22.2 20.2 10 13 A A S S- 0 0 1 28,-0.1 30,-0.3 30,-0.0 -1,-0.2 -0.627 84.6-161.1-132.2 73.9 4.7 -19.1 19.2 11 14 A P - 0 0 36 0, 0.0 30,-2.7 0, 0.0 2,-0.1 -0.055 31.0 -86.7 -59.4 155.4 4.8 -16.8 22.3 12 15 A A B -a 41 0A 76 28,-0.2 30,-0.2 31,-0.0 31,-0.0 -0.381 56.3-125.9 -60.4 136.3 2.4 -14.0 22.9 13 16 A F S S+ 0 0 7 28,-2.1 30,-0.3 -3,-0.1 2,-0.2 -0.995 73.6 33.1-145.8 137.8 3.5 -10.8 21.1 14 17 A P S S- 0 0 22 0, 0.0 2,-0.3 0, 0.0 377,-0.1 0.509 72.1-164.6 -76.7 178.8 4.0 -7.9 21.9 15 18 A S - 0 0 35 -2,-0.2 2,-0.3 375,-0.2 -2,-0.0 -0.888 18.8-109.8-124.9 160.3 5.4 -7.9 25.4 16 19 A N - 0 0 101 -2,-0.3 9,-0.2 373,-0.1 2,-0.2 -0.680 25.2-119.7 -93.5 142.5 5.8 -5.1 28.0 17 20 A R - 0 0 19 371,-0.5 370,-0.2 -2,-0.3 6,-0.1 -0.562 20.4-175.3 -72.5 141.1 9.0 -3.6 29.2 18 21 A S S S+ 0 0 99 1,-0.3 -1,-0.1 -2,-0.2 5,-0.1 0.581 81.5 44.5-104.8 -25.7 9.8 -3.8 32.9 19 22 A C S > S- 0 0 33 3,-0.4 3,-1.4 1,-0.1 -1,-0.3 -0.985 83.7-134.5-118.2 133.4 12.9 -1.7 32.5 20 23 A P T 3 S+ 0 0 5 0, 0.0 -1,-0.1 0, 0.0 236,-0.1 0.785 104.0 31.4 -54.7 -33.7 12.7 1.5 30.4 21 24 A Y T 3 S+ 0 0 32 2,-0.1 2,-0.3 234,-0.1 265,-0.1 0.038 108.3 76.8-120.0 23.6 16.0 0.7 28.6 22 25 A Q S < S- 0 0 59 -3,-1.4 -3,-0.4 263,-0.1 -4,-0.2 -0.966 83.0-101.0-132.7 149.4 16.1 -3.1 28.5 23 26 A L - 0 0 11 -2,-0.3 -5,-0.1 1,-0.1 -2,-0.1 -0.360 44.1-100.6 -62.3 144.0 14.2 -5.6 26.3 24 27 A P >> - 0 0 5 0, 0.0 4,-2.1 0, 0.0 3,-1.0 -0.372 40.4-108.0 -54.2 148.5 11.2 -7.4 27.8 25 28 A D H 3> S+ 0 0 124 1,-0.3 4,-1.9 -9,-0.2 5,-0.1 0.875 121.7 53.0 -50.2 -43.7 12.3 -10.9 28.9 26 29 A G H 3> S+ 0 0 21 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.799 107.8 50.8 -61.9 -32.2 10.4 -12.5 26.0 27 30 A Y H <> S+ 0 0 1 -3,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.857 107.6 52.0 -74.8 -38.9 12.2 -10.2 23.5 28 31 A A H X S+ 0 0 23 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.874 107.6 54.8 -61.5 -38.0 15.6 -11.1 25.0 29 32 A Q H X S+ 0 0 126 -4,-1.9 4,-1.0 -5,-0.2 -2,-0.2 0.935 109.6 45.2 -59.0 -49.0 14.5 -14.8 24.5 30 33 A L H < S+ 0 0 9 -4,-1.7 3,-0.2 1,-0.2 -2,-0.2 0.854 110.3 55.0 -63.1 -37.7 13.7 -14.1 20.8 31 34 A R H < S+ 0 0 35 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.861 109.9 46.4 -62.6 -38.8 17.0 -12.2 20.4 32 35 A D H < S+ 0 0 110 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.655 91.5 98.7 -79.6 -19.6 19.0 -15.2 21.7 33 36 A T S < S- 0 0 50 -4,-1.0 19,-0.1 -3,-0.2 -3,-0.0 -0.559 81.9-112.2 -75.2 129.5 17.1 -17.7 19.5 34 37 A P S S+ 0 0 114 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.234 76.1 45.6 -59.9 149.0 19.0 -18.7 16.3 35 38 A G S S- 0 0 30 1,-0.1 17,-0.1 3,-0.0 268,-0.1 0.085 86.0 -94.8 98.0 151.7 17.7 -17.6 12.9 36 39 A P S S+ 0 0 2 0, 0.0 16,-2.4 0, 0.0 17,-0.5 0.698 101.2 50.9 -70.8 -23.1 16.3 -14.4 11.5 37 40 A L E - B 0 51A 4 14,-0.2 2,-0.3 265,-0.2 14,-0.2 -0.856 55.4-177.1-124.6 151.1 12.6 -15.3 12.2 38 41 A H E - B 0 50A 40 12,-1.8 12,-2.6 -2,-0.3 2,-0.2 -0.989 27.8-118.0-145.2 140.9 10.4 -16.5 15.0 39 42 A R E + B 0 49A 114 -30,-0.4 2,-0.3 -2,-0.3 10,-0.2 -0.477 35.5 176.7 -70.0 142.0 6.7 -17.4 15.2 40 43 A V E - B 0 48A 0 8,-2.4 8,-2.0 -30,-0.3 2,-0.5 -0.940 27.9-125.5-138.7 163.1 4.5 -15.4 17.6 41 44 A T E -aB 12 47A 38 -30,-2.7 -28,-2.1 -2,-0.3 6,-0.2 -0.964 26.0-145.3-112.4 121.8 0.9 -15.3 18.5 42 45 A L > - 0 0 7 4,-2.9 3,-2.4 -2,-0.5 36,-0.1 -0.283 34.8 -91.6 -79.4 170.3 -0.9 -11.9 18.1 43 46 A Y T 3 S+ 0 0 101 -30,-0.3 35,-0.1 1,-0.3 -1,-0.1 0.738 125.3 52.9 -54.6 -29.4 -3.7 -10.6 20.4 44 47 A D T 3 S- 0 0 70 33,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.357 120.4-103.7 -91.9 3.2 -6.4 -12.1 18.2 45 48 A G S < S+ 0 0 53 -3,-2.4 -2,-0.1 1,-0.3 2,-0.1 0.229 79.5 130.5 94.7 -13.2 -4.9 -15.6 18.1 46 49 A R - 0 0 87 -5,-0.1 -4,-2.9 1,-0.1 -1,-0.3 -0.428 55.5-124.3 -72.5 146.7 -3.5 -15.4 14.6 47 50 A Q E +B 41 0A 106 -6,-0.2 265,-0.5 -2,-0.1 2,-0.3 -0.710 34.1 167.8 -94.0 144.9 0.2 -16.4 14.1 48 51 A A E -B 40 0A 5 -8,-2.0 -8,-2.4 -2,-0.3 2,-0.3 -0.904 31.6-107.5-142.0 170.3 2.8 -14.1 12.5 49 52 A W E -Bc 39 313A 10 263,-2.5 265,-2.5 -2,-0.3 2,-0.4 -0.803 21.9-156.9 -98.7 145.7 6.5 -13.9 12.1 50 53 A V E -Bc 38 314A 0 -12,-2.6 -12,-1.8 -2,-0.3 2,-0.5 -0.954 15.1-134.5-113.9 145.3 8.9 -11.5 13.9 51 54 A V E +Bc 37 315A 0 263,-2.3 265,-1.4 -2,-0.4 269,-0.3 -0.887 26.7 174.2 -98.6 126.2 12.3 -10.5 12.5 52 55 A T + 0 0 2 -16,-2.4 2,-0.3 -2,-0.5 -15,-0.1 0.251 48.6 72.8-122.2 6.3 14.9 -10.8 15.3 53 56 A K S > S- 0 0 39 -17,-0.5 4,-1.7 1,-0.1 267,-0.2 -0.946 72.4-126.9-130.2 152.8 18.3 -10.1 13.7 54 57 A H H > S+ 0 0 6 -2,-0.3 4,-1.8 266,-0.3 5,-0.1 0.930 103.6 38.2 -66.9 -56.1 19.9 -6.9 12.3 55 58 A E H > S+ 0 0 123 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.922 116.4 52.5 -66.0 -43.9 20.9 -7.8 8.8 56 59 A A H > S+ 0 0 7 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.850 106.9 54.9 -57.2 -37.4 17.8 -9.9 8.1 57 60 A A H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.925 109.1 46.4 -61.6 -46.9 15.7 -6.9 9.3 58 61 A R H X S+ 0 0 69 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.916 113.1 49.9 -59.5 -47.6 17.4 -4.6 6.7 59 62 A K H X S+ 0 0 146 -4,-2.6 4,-0.5 2,-0.2 3,-0.3 0.942 114.7 42.8 -57.0 -50.3 16.9 -7.3 3.9 60 63 A L H >< S+ 0 0 3 -4,-2.6 3,-0.9 1,-0.2 6,-0.2 0.886 110.6 54.5 -69.9 -38.1 13.2 -7.8 4.7 61 64 A L H 3< S+ 0 0 17 -4,-2.6 288,-0.3 1,-0.2 289,-0.2 0.777 111.7 47.7 -63.4 -25.8 12.5 -4.0 5.1 62 65 A G H 3< S+ 0 0 45 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.548 88.8 106.0 -87.3 -9.2 14.1 -3.6 1.6 63 66 A D X< - 0 0 19 -3,-0.9 3,-2.0 -4,-0.5 -3,-0.0 -0.606 59.8-154.6 -81.0 117.8 12.0 -6.5 0.1 64 67 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.638 90.9 72.3 -66.6 -10.8 9.2 -5.3 -2.2 65 68 A R T 3 S+ 0 0 98 1,-0.1 232,-2.6 231,-0.1 2,-0.7 0.529 82.9 78.1 -78.3 -8.8 7.3 -8.5 -1.4 66 69 A L E < S-D 296 0A 10 -3,-2.0 230,-0.2 230,-0.2 2,-0.2 -0.891 77.6-156.8-103.7 104.1 6.6 -7.2 2.1 67 70 A S E -D 295 0A 5 228,-3.1 228,-2.1 -2,-0.7 29,-0.1 -0.485 22.8-151.8 -84.9 146.3 3.7 -4.8 1.8 68 71 A S + 0 0 2 226,-0.2 2,-1.0 -2,-0.2 -1,-0.1 0.147 50.3 138.5 -96.9 16.7 2.9 -1.9 4.2 69 72 A N > - 0 0 51 226,-0.2 3,-1.1 1,-0.2 6,-0.1 -0.503 29.2-178.3 -69.8 98.0 -0.8 -2.2 3.2 70 73 A R T 3 S+ 0 0 50 -2,-1.0 -1,-0.2 24,-0.5 16,-0.1 0.581 77.5 64.8 -77.8 -9.6 -2.6 -1.8 6.5 71 74 A T T 3 S+ 0 0 71 23,-0.3 -1,-0.2 14,-0.1 2,-0.2 0.561 77.7 107.6 -86.3 -12.3 -6.0 -2.3 4.9 72 75 A D S X S- 0 0 47 -3,-1.1 3,-1.7 1,-0.1 14,-0.0 -0.487 76.0-131.5 -65.6 134.3 -5.1 -5.9 3.9 73 76 A D T 3 S+ 0 0 111 1,-0.3 -1,-0.1 -2,-0.2 -3,-0.0 0.809 105.5 55.0 -55.7 -33.1 -6.9 -8.4 6.1 74 77 A N T 3 S+ 0 0 71 2,-0.1 -1,-0.3 237,-0.1 222,-0.1 0.399 74.9 126.9 -87.6 1.6 -3.7 -10.3 6.8 75 78 A F S < S- 0 0 12 -3,-1.7 2,-2.3 -6,-0.1 220,-0.1 -0.385 72.2-112.9 -60.1 133.7 -1.8 -7.2 8.2 76 79 A P - 0 0 5 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.406 37.8-170.8 -76.4 72.2 -0.4 -8.1 11.6 77 80 A A - 0 0 4 -2,-2.3 -33,-0.3 1,-0.1 -34,-0.2 -0.405 7.9-162.2 -58.0 133.8 -2.5 -5.8 13.8 78 81 A T + 0 0 15 1,-0.1 -35,-0.3 313,-0.1 -1,-0.1 0.575 65.5 16.5-102.2 -14.0 -1.0 -5.9 17.4 79 82 A S S > S- 0 0 18 -37,-0.1 3,-0.9 1,-0.1 4,-0.3 -0.969 78.5-105.6-151.3 161.8 -4.0 -4.5 19.4 80 83 A P G > S+ 0 0 54 0, 0.0 3,-1.3 0, 0.0 102,-0.2 0.824 116.9 63.1 -56.6 -33.3 -7.7 -3.8 19.1 81 84 A A G > S+ 0 0 8 100,-0.3 3,-1.8 1,-0.2 4,-0.1 0.808 85.3 73.3 -62.4 -32.6 -7.0 -0.1 18.7 82 85 A F G X> S+ 0 0 40 -3,-0.9 3,-2.0 1,-0.3 4,-0.7 0.704 76.2 80.7 -57.2 -21.5 -5.0 -0.7 15.5 83 86 A E G <4 S+ 0 0 51 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.1 0.522 78.4 69.9 -66.5 -4.5 -8.3 -1.3 13.7 84 87 A A G <4 S+ 0 0 7 -3,-1.8 3,-0.5 1,-0.2 4,-0.3 0.516 89.8 60.7 -89.4 -9.3 -8.8 2.5 13.4 85 88 A V T X4 S+ 0 0 47 -3,-2.0 3,-0.7 1,-0.2 2,-0.5 0.849 100.3 54.7 -79.6 -39.5 -6.0 2.8 10.9 86 89 A R T 3< S+ 0 0 90 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.1 -0.157 98.9 66.4 -86.8 40.9 -7.8 0.5 8.5 87 90 A E T 3 S+ 0 0 134 -2,-0.5 -1,-0.2 -3,-0.5 -2,-0.1 0.545 97.4 44.5-131.1 -27.4 -10.9 2.7 8.5 88 91 A S S < S- 0 0 24 -3,-0.7 -1,-0.2 -4,-0.3 3,-0.1 -0.747 103.8 -72.0-113.7 165.2 -9.8 6.0 6.9 89 92 A P - 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