==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 05-DEC-11 4AAN . COMPND 2 MOLECULE: CYTOCHROME C551 PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACTER SULFURREDUCENS; . AUTHOR J.SEIDEL . 322 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14407.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 203 63.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 4.7 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 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 . 16 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 16.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 27.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 2 0 2 0 1 0 2 0 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 24 A D > 0 0 121 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 146.5 -11.2 -7.6 1.1 2 25 A V H > + 0 0 23 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.859 360.0 57.6 -64.2 -34.9 -10.7 -10.3 -1.6 3 26 A M H > S+ 0 0 21 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.945 109.3 45.3 -59.5 -48.6 -9.0 -7.8 -4.0 4 27 A K H > S+ 0 0 53 2,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.907 112.3 51.3 -64.2 -38.8 -6.3 -7.1 -1.3 5 28 A R H >< S+ 0 0 110 -4,-2.2 3,-0.7 1,-0.2 4,-0.4 0.951 111.5 47.8 -60.7 -44.5 -5.9 -10.8 -0.5 6 29 A A H >X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.3 3,-1.6 0.889 105.5 58.2 -62.6 -41.6 -5.4 -11.5 -4.3 7 30 A Q H 3< S+ 0 0 89 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.797 104.8 52.5 -63.4 -21.3 -2.9 -8.7 -4.6 8 31 A G T << S+ 0 0 69 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.509 119.3 33.1 -85.7 -10.2 -0.8 -10.4 -1.9 9 32 A L T <4 S+ 0 0 76 -3,-1.6 193,-3.0 -4,-0.4 2,-0.3 0.664 117.4 38.8-117.8 -25.8 -0.8 -13.8 -3.8 10 33 A F B < -a 202 0A 4 -4,-2.6 193,-0.3 191,-0.2 -1,-0.2 -0.816 57.5-157.4-128.6 162.2 -0.8 -13.1 -7.5 11 34 A K - 0 0 118 191,-1.0 194,-0.1 -2,-0.3 2,-0.1 -0.987 26.3-108.2-137.5 149.4 0.7 -10.6 -9.9 12 35 A P - 0 0 39 0, 0.0 191,-0.1 0, 0.0 192,-0.1 -0.426 40.4 -99.1 -73.3 153.9 -0.3 -9.4 -13.4 13 36 A I - 0 0 2 151,-0.2 153,-0.4 -2,-0.1 154,-0.1 -0.593 42.6-120.9 -68.5 125.1 1.6 -10.4 -16.5 14 37 A P - 0 0 55 0, 0.0 -1,-0.1 0, 0.0 149,-0.0 -0.278 10.6-130.2 -63.4 150.8 4.0 -7.5 -17.5 15 38 A A S S+ 0 0 86 2,-0.1 148,-0.1 149,-0.1 -2,-0.0 0.858 89.1 72.1 -69.8 -35.3 3.6 -6.1 -20.9 16 39 A K S S- 0 0 124 1,-0.1 145,-0.0 0, 0.0 0, 0.0 -0.653 93.6-109.4 -85.7 135.7 7.2 -6.4 -21.8 17 40 A P - 0 0 37 0, 0.0 144,-0.2 0, 0.0 2,-0.1 -0.269 42.2-105.7 -56.2 142.0 8.8 -9.8 -22.4 18 41 A P - 0 0 29 0, 0.0 2,-0.3 0, 0.0 142,-0.0 -0.418 32.9-108.2 -70.6 151.1 11.1 -10.9 -19.6 19 42 A V - 0 0 119 -2,-0.1 2,-0.6 5,-0.0 138,-0.0 -0.557 23.3-142.8 -79.1 132.5 14.9 -10.8 -20.1 20 43 A M B > -B 23 0B 31 3,-0.5 3,-1.8 -2,-0.3 2,-0.2 -0.876 23.3-121.6 -95.8 121.1 16.7 -14.2 -20.4 21 44 A K T 3 S+ 0 0 97 -2,-0.6 -1,-0.0 1,-0.3 0, 0.0 -0.438 96.0 6.9 -62.5 128.9 20.1 -14.1 -18.7 22 45 A D T 3 S+ 0 0 90 -2,-0.2 -1,-0.3 1,-0.1 0, 0.0 0.740 118.5 82.1 66.3 24.9 22.8 -14.9 -21.1 23 46 A N B < -B 20 0B 2 -3,-1.8 -3,-0.5 133,-0.0 2,-0.1 -0.528 68.3-162.0-151.8 76.1 20.4 -14.9 -24.0 24 47 A P - 0 0 84 0, 0.0 2,-1.4 0, 0.0 133,-0.1 -0.367 17.0-130.7 -64.2 140.1 19.8 -11.3 -25.2 25 48 A A + 0 0 60 -2,-0.1 129,-0.0 4,-0.1 113,-0.0 -0.441 34.1 171.4 -92.8 70.0 16.7 -10.7 -27.3 26 49 A S > - 0 0 43 -2,-1.4 4,-2.6 112,-0.2 5,-0.3 -0.295 48.4-108.3 -68.8 161.1 17.9 -8.7 -30.3 27 50 A P H > S+ 0 0 116 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.908 120.8 51.0 -54.8 -38.8 15.3 -8.1 -33.1 28 51 A S H > S+ 0 0 26 2,-0.2 4,-2.4 1,-0.2 110,-0.2 0.874 109.7 47.5 -68.0 -40.6 17.3 -10.5 -35.2 29 52 A R H > S+ 0 0 26 2,-0.2 4,-2.3 108,-0.2 129,-0.2 0.904 114.0 47.0 -71.0 -38.0 17.4 -13.3 -32.6 30 53 A V H X S+ 0 0 32 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.939 112.6 50.0 -67.0 -42.3 13.6 -13.0 -31.9 31 54 A E H X S+ 0 0 73 -4,-2.6 4,-2.6 -5,-0.3 -2,-0.2 0.927 110.7 50.5 -60.6 -45.0 12.8 -13.0 -35.6 32 55 A L H X S+ 0 0 2 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.929 108.8 51.6 -57.8 -46.5 14.9 -16.1 -36.1 33 56 A G H X S+ 0 0 0 -4,-2.3 4,-2.2 121,-0.3 -2,-0.2 0.891 108.6 50.5 -60.4 -36.6 13.1 -17.8 -33.2 34 57 A R H X S+ 0 0 56 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.931 110.2 51.0 -66.9 -40.3 9.7 -17.0 -34.7 35 58 A M H >X S+ 0 0 18 -4,-2.6 3,-0.6 1,-0.2 4,-0.5 0.951 112.9 44.9 -53.0 -52.8 10.9 -18.4 -38.0 36 59 A L H >< S+ 0 0 0 -4,-2.7 3,-0.9 1,-0.2 14,-0.4 0.843 105.6 59.8 -66.3 -38.1 12.1 -21.6 -36.4 37 60 A F H 3< S+ 0 0 1 -4,-2.2 14,-1.4 1,-0.2 13,-0.8 0.820 115.1 36.5 -59.1 -32.7 9.0 -22.1 -34.2 38 61 A F H << S+ 0 0 9 -4,-1.4 -1,-0.2 -3,-0.6 -2,-0.2 0.384 92.9 104.5 -98.1 -2.5 6.9 -22.2 -37.4 39 62 A D X< - 0 0 1 -3,-0.9 3,-1.8 -4,-0.5 11,-0.2 -0.737 51.5-164.5 -89.3 110.6 9.4 -24.1 -39.6 40 63 A P G > S+ 0 0 39 0, 0.0 3,-1.9 0, 0.0 8,-0.7 0.595 79.8 83.1 -69.8 -9.2 8.4 -27.8 -40.1 41 64 A R G 3 S+ 0 0 26 1,-0.3 8,-0.1 5,-0.2 83,-0.1 0.543 71.6 78.0 -70.2 -3.4 11.9 -28.5 -41.4 42 65 A L G < S+ 0 0 1 -3,-1.8 2,-0.3 6,-0.2 -1,-0.3 0.564 89.9 71.4 -68.0 -16.3 12.9 -28.7 -37.7 43 66 A S S X S- 0 0 0 -3,-1.9 3,-1.2 5,-0.3 72,-0.2 -0.765 91.2-121.4 -98.8 157.4 11.2 -32.2 -37.9 44 67 A A T 3 S+ 0 0 14 70,-2.3 277,-2.6 -2,-0.3 71,-0.1 0.894 115.5 47.7 -58.5 -38.6 12.6 -35.3 -39.8 45 68 A S T 3 S- 0 0 21 69,-0.4 -1,-0.3 275,-0.2 -4,-0.1 0.564 102.4-130.9 -80.0 -11.8 9.4 -35.4 -41.9 46 69 A H S < S+ 0 0 30 -3,-1.2 -5,-0.2 -6,-0.5 -2,-0.1 0.593 90.3 88.9 63.8 21.0 9.5 -31.7 -42.8 47 70 A L + 0 0 140 -7,-0.2 2,-0.5 67,-0.1 -6,-0.1 0.560 68.1 70.3-120.4 -18.3 5.8 -31.6 -41.7 48 71 A I + 0 0 21 -8,-0.7 -5,-0.3 66,-0.1 2,-0.2 -0.927 52.5 172.1-112.7 126.0 5.8 -30.9 -37.9 49 72 A S >> - 0 0 11 -2,-0.5 3,-1.2 -7,-0.1 4,-0.8 -0.745 50.8 -98.6-115.3 176.3 6.7 -27.6 -36.4 50 73 A C H >> S+ 0 0 23 -13,-0.8 4,-1.8 -14,-0.4 3,-0.8 0.897 124.0 61.0 -61.4 -34.3 6.4 -26.3 -32.8 51 74 A N H 34 S+ 0 0 26 -14,-1.4 -1,-0.3 1,-0.3 6,-0.1 0.718 89.6 70.9 -67.2 -18.2 3.1 -24.6 -33.9 52 75 A T H <4 S+ 0 0 63 -3,-1.2 3,-0.3 1,-0.2 -1,-0.3 0.926 115.8 21.5 -58.7 -48.0 1.7 -28.0 -34.8 53 76 A C H << S+ 0 0 24 -3,-0.8 2,-0.2 -4,-0.8 -2,-0.2 0.607 133.6 42.0 -98.3 -9.9 1.5 -29.0 -31.1 54 77 A H S < S- 0 0 39 -4,-1.8 2,-0.4 -5,-0.2 7,-0.2 -0.646 81.8-169.7-132.8 64.6 1.5 -25.5 -29.6 55 78 A N B > > -C 61 0C 50 6,-1.9 5,-2.6 -3,-0.3 3,-2.0 -0.489 18.1-150.8 -71.8 119.6 -0.8 -23.7 -32.0 56 79 A V G > 5S+ 0 0 23 -2,-0.4 3,-0.5 1,-0.3 -1,-0.2 0.761 98.1 54.5 -66.3 -18.4 -0.7 -20.0 -31.4 57 80 A G G 3 5S+ 0 0 62 1,-0.2 -1,-0.3 -6,-0.1 -2,-0.1 0.596 108.3 49.1 -82.3 -15.0 -4.3 -19.8 -32.7 58 81 A L G X 5S- 0 0 75 -3,-2.0 3,-1.2 3,-0.3 -1,-0.2 -0.360 130.8 -80.2-122.0 44.3 -5.6 -22.4 -30.1 59 82 A G T < 5S- 0 0 1 -3,-0.5 24,-0.4 1,-0.2 -3,-0.2 0.681 81.6 -66.2 70.3 19.9 -4.1 -21.1 -26.9 60 83 A G T 3 > +D 73 0D 7 4,-2.3 3,-1.9 -2,-0.5 4,-0.7 -0.176 42.9 5.3-121.5-145.1 3.8 -36.6 -33.8 70 93 A H G >4 S+ 0 0 8 43,-2.5 3,-0.8 1,-0.3 -1,-0.3 -0.066 129.4 6.3 -48.9 131.5 6.0 -38.3 -36.3 71 94 A G G 34 S- 0 0 60 1,-0.2 -1,-0.3 -3,-0.1 251,-0.0 0.702 125.9 -72.5 73.2 13.6 4.4 -41.4 -37.9 72 95 A W G <4 S+ 0 0 215 -3,-1.9 2,-0.5 1,-0.2 -1,-0.2 0.839 84.8 163.7 65.3 38.5 1.1 -40.6 -36.3 73 96 A Q E << -D 69 0D 81 -3,-0.8 -4,-2.3 -4,-0.7 2,-0.4 -0.752 31.6-139.1 -93.1 126.2 2.5 -41.8 -32.9 74 97 A K E -D 68 0D 124 -2,-0.5 -6,-0.2 -6,-0.2 -7,-0.1 -0.667 17.5-144.6 -83.4 135.0 0.6 -40.7 -29.8 75 98 A G - 0 0 13 -8,-2.8 -1,-0.1 -2,-0.4 38,-0.0 -0.317 19.8-110.8 -93.0 178.5 2.6 -39.6 -26.8 76 99 A P S S+ 0 0 98 0, 0.0 2,-0.3 0, 0.0 152,-0.1 0.631 88.4 53.5 -84.2 -18.3 1.9 -40.0 -23.1 77 100 A R 0 0 35 -10,-0.1 -10,-1.5 185,-0.0 184,-0.2 -0.901 360.0 360.0-126.8 154.1 1.2 -36.4 -22.1 78 101 A N 0 0 12 182,-2.6 -12,-0.2 -2,-0.3 -13,-0.1 -0.466 360.0 360.0 -72.5 360.0 -1.0 -33.5 -23.0 79 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 80 103 A P 0 0 51 0, 0.0 2,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 157.5 1.0 -27.7 -22.2 81 104 A T - 0 0 26 1,-0.2 -20,-0.2 2,-0.1 -21,-0.2 -0.428 360.0-151.0 -70.2 141.4 0.7 -24.1 -23.5 82 105 A V > + 0 0 8 -22,-1.1 3,-1.7 -2,-0.1 4,-0.4 0.647 68.7 110.0 -76.6 -15.8 3.7 -22.2 -24.6 83 106 A L T 3 S- 0 0 3 -24,-0.4 80,-0.2 1,-0.3 -2,-0.1 -0.422 99.1 -8.4 -69.2 126.6 1.8 -19.0 -23.6 84 107 A N T > S+ 0 0 0 78,-2.7 3,-2.4 75,-0.3 -1,-0.3 0.499 93.0 131.4 65.1 4.8 3.5 -17.6 -20.5 85 108 A A G X + 0 0 5 -3,-1.7 3,-2.1 77,-0.3 -2,-0.1 0.812 58.8 74.0 -60.6 -25.1 5.7 -20.7 -20.1 86 109 A V G 3 S+ 0 0 21 -4,-0.4 -1,-0.3 73,-0.3 14,-0.1 0.746 91.6 57.3 -57.0 -24.1 8.6 -18.4 -19.7 87 110 A Y G < S+ 0 0 52 -3,-2.4 -1,-0.3 116,-0.1 117,-0.2 0.393 83.0 104.3 -91.0 7.0 7.3 -17.6 -16.2 88 111 A N S < S- 0 0 20 -3,-2.1 120,-0.2 -4,-0.2 119,-0.1 -0.576 78.3-124.0 -84.8 154.2 7.3 -21.2 -14.9 89 112 A I S S- 0 0 88 118,-2.8 2,-0.3 -2,-0.2 -1,-0.1 0.752 90.2 -10.1 -69.3 -26.9 10.1 -22.3 -12.5 90 113 A A S S- 0 0 6 117,-0.2 2,-0.3 2,-0.1 8,-0.2 -0.922 81.1-102.7-159.4 169.6 11.1 -25.2 -14.9 91 114 A Q B S+E 97 0E 14 6,-3.1 6,-2.0 -2,-0.3 3,-0.1 -0.769 71.9 37.7-112.5 159.7 9.6 -26.7 -18.1 92 115 A F S > S- 0 0 33 -2,-0.3 3,-1.7 3,-0.2 153,-0.1 0.084 94.9 -81.0 80.9 161.7 7.7 -29.9 -18.9 93 116 A W T 3 S+ 0 0 25 1,-0.3 152,-2.8 2,-0.1 138,-0.2 0.711 135.9 43.8 -68.9 -17.4 5.0 -31.4 -16.6 94 117 A D T 3 S- 0 0 6 150,-0.2 -1,-0.3 136,-0.1 -2,-0.1 0.255 109.8-122.2-105.7 5.4 7.9 -33.0 -14.5 95 118 A G < + 0 0 7 -3,-1.7 -3,-0.2 -5,-0.1 -4,-0.2 0.717 63.2 144.0 63.0 24.0 10.1 -29.8 -14.5 96 119 A R + 0 0 127 -6,-0.1 2,-0.5 -5,-0.1 -4,-0.2 0.659 52.9 64.8 -76.9 -11.7 13.0 -31.7 -16.1 97 120 A A B S-E 91 0E 8 -6,-2.0 -6,-3.1 1,-0.1 6,-0.1 -0.908 73.3-146.0-109.9 136.2 14.2 -28.8 -18.2 98 121 A E S S- 0 0 157 -2,-0.5 2,-0.3 -8,-0.2 -1,-0.1 0.836 72.5 -11.6 -73.0 -27.6 15.6 -25.8 -16.5 99 122 A D S > S- 0 0 60 -9,-0.1 4,-2.2 -8,-0.1 -8,-0.1 -0.877 81.5 -80.9-160.2-180.0 14.4 -23.2 -19.0 100 123 A L H > S+ 0 0 5 -2,-0.3 4,-2.1 2,-0.2 -1,-0.0 0.830 122.9 53.6 -66.0 -35.2 12.9 -22.7 -22.5 101 124 A A H > S+ 0 0 14 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.954 112.2 44.5 -67.4 -43.8 16.2 -23.1 -24.3 102 125 A A H >4 S+ 0 0 36 1,-0.2 3,-0.6 2,-0.2 4,-0.4 0.902 112.7 53.7 -61.4 -42.8 16.9 -26.4 -22.6 103 126 A Q H >< S+ 0 0 26 -4,-2.2 3,-2.4 1,-0.2 -2,-0.2 0.930 96.9 64.5 -58.2 -38.8 13.3 -27.5 -23.2 104 127 A A H 3X S+ 0 0 7 -4,-2.1 4,-1.1 1,-0.3 -1,-0.2 0.722 91.7 63.7 -67.6 -23.6 13.4 -26.9 -27.0 105 128 A K H S+ 0 0 25 -3,-2.4 4,-1.6 -4,-0.4 3,-0.6 0.970 100.7 40.8 -68.7 -63.1 13.5 -32.2 -26.3 107 130 A P H 34 S+ 0 0 25 0, 0.0 7,-2.0 0, 0.0 8,-0.5 0.872 110.3 60.6 -59.3 -33.4 10.8 -32.2 -29.0 108 131 A V H 3< S+ 0 0 4 -4,-1.1 8,-2.7 1,-0.2 -64,-0.2 0.895 116.1 31.0 -58.2 -40.4 13.3 -31.9 -31.8 109 132 A Q H << S+ 0 0 78 -4,-1.1 2,-0.3 -3,-0.6 -1,-0.2 0.526 89.8 110.7 -93.8 -18.4 14.9 -35.2 -30.8 110 133 A A ><> - 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