==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 09-FEB-00 1C75 . COMPND 2 MOLECULE: CYTOCHROME C-553; . SOURCE 2 ORGANISM_SCIENTIFIC: SPOROSARCINA PASTEURII; . AUTHOR S.BENINI,S.CIURLI,W.R.RYPNIEWSKI,K.S.WILSON . 71 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4261.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 52 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 2.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 1.4 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 . 2 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 38.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.4 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 1 0 0 0 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 22 A V 0 0 111 0, 0.0 2,-1.3 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 137.1 -1.6 26.3 16.0 2 23 A D > - 0 0 106 1,-0.2 4,-2.1 2,-0.1 3,-0.4 -0.692 360.0-175.3 -89.3 86.7 1.5 24.6 17.3 3 24 A A H > S+ 0 0 12 -2,-1.3 4,-2.5 1,-0.3 -1,-0.2 0.875 78.2 51.8 -59.6 -34.4 4.0 25.9 14.7 4 25 A E H > S+ 0 0 110 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.890 109.8 48.9 -71.2 -36.0 7.0 24.0 15.9 5 26 A A H > S+ 0 0 34 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.889 110.7 51.4 -67.7 -35.1 5.1 20.7 15.9 6 27 A V H X S+ 0 0 12 -4,-2.1 4,-2.6 2,-0.2 5,-0.3 0.927 109.9 48.8 -65.2 -44.1 3.9 21.4 12.4 7 28 A V H X>S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-1.0 0.920 111.9 49.5 -62.5 -44.1 7.5 22.1 11.2 8 29 A Q H <5S+ 0 0 80 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.857 116.5 42.8 -63.9 -31.9 8.7 18.9 12.9 9 30 A Q H <5S+ 0 0 157 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.865 130.9 19.7 -74.3 -41.3 5.9 16.9 11.2 10 31 A K H <5S+ 0 0 71 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.566 124.0 37.2-115.7 -14.2 6.1 18.5 7.8 11 32 A C T >X5S+ 0 0 27 -4,-2.6 4,-2.2 -5,-0.3 3,-0.9 0.648 91.9 74.5-118.2 -22.5 9.4 20.3 7.0 12 33 A I H 3>< - 0 0 8 -4,-2.2 3,-1.8 4,-0.2 -1,-0.2 0.213 30.3 -84.8 91.1 151.0 16.8 18.8 8.7 17 38 A G T 3 S+ 0 0 44 1,-0.3 -1,-0.1 4,-0.1 -5,-0.1 0.797 132.4 36.2 -63.2 -31.9 15.7 18.1 12.2 18 39 A D T 3 S- 0 0 107 3,-0.2 -1,-0.3 -6,-0.1 -2,-0.1 0.176 115.5-113.6-103.0 12.2 17.2 21.3 13.5 19 40 A L S < S+ 0 0 8 -3,-1.8 8,-2.7 1,-0.1 9,-1.6 0.516 83.6 121.5 70.8 11.1 16.3 23.2 10.3 20 41 A T S S- 0 0 74 1,-0.3 6,-0.4 6,-0.2 -4,-0.2 0.346 82.8 -84.4 -88.9 8.9 20.0 23.6 9.3 21 42 A G + 0 0 26 -6,-2.7 -1,-0.3 4,-0.4 -6,-0.2 0.002 49.6 174.1 105.5 147.9 19.5 21.9 6.0 22 43 A A S S- 0 0 64 2,-2.4 -7,-0.2 -8,-0.7 -8,-0.1 -0.264 83.9 -14.1-146.3-112.2 19.5 18.3 4.8 23 44 A S S S+ 0 0 104 -10,-0.3 -8,-0.2 -2,-0.1 -9,-0.1 0.836 140.8 43.3 -64.5 -34.0 18.5 17.4 1.2 24 45 A A S S- 0 0 26 -10,-2.7 -2,-2.4 1,-0.2 26,-0.0 -0.670 105.2 -79.0-106.7 168.0 17.2 21.0 1.0 25 46 A P - 0 0 101 0, 0.0 -4,-0.4 0, 0.0 -1,-0.2 -0.060 55.0 -83.4 -65.9 164.1 18.8 24.3 2.2 26 47 A A + 0 0 52 -6,-0.4 -6,-0.2 1,-0.1 -10,-0.1 -0.344 36.7 177.0 -63.1 146.3 18.7 25.6 5.8 27 48 A I > + 0 0 29 -8,-2.7 3,-1.8 -12,-0.3 4,-0.2 0.215 51.5 106.6-126.5 8.0 15.6 27.4 7.1 28 49 A D T 3 S+ 0 0 47 -9,-1.6 -8,-0.1 1,-0.3 3,-0.1 0.670 94.5 29.3 -66.1 -18.4 16.7 28.0 10.7 29 50 A K T > S+ 0 0 105 -10,-0.2 3,-2.2 42,-0.2 4,-0.5 -0.122 80.2 133.7-123.8 28.8 17.3 31.7 10.0 30 51 A A G X> + 0 0 10 -3,-1.8 4,-2.1 1,-0.3 3,-1.6 0.819 64.2 64.3 -57.8 -32.7 14.8 32.2 7.3 31 52 A G G 34 S+ 0 0 11 39,-1.7 -1,-0.3 36,-1.0 40,-0.2 0.674 94.5 61.0 -65.7 -17.1 13.4 35.3 8.8 32 53 A A G <4 S+ 0 0 56 -3,-2.2 -1,-0.3 38,-0.7 -2,-0.2 0.675 117.7 29.3 -74.4 -21.6 16.8 37.0 8.2 33 54 A N T <4 S+ 0 0 119 -3,-1.6 2,-0.3 -4,-0.5 -2,-0.2 0.605 122.4 39.9-113.4 -19.8 16.4 36.4 4.4 34 55 A Y S < S- 0 0 91 -4,-2.1 -1,-0.2 34,-0.1 2,-0.1 -0.971 71.9-122.3-135.6 146.9 12.6 36.5 3.8 35 56 A S > - 0 0 59 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.405 38.1-104.7 -75.5 164.7 9.6 38.4 5.0 36 57 A E H > S+ 0 0 94 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.912 123.6 50.8 -56.5 -42.9 6.6 36.6 6.6 37 58 A E H > S+ 0 0 127 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.902 108.3 51.1 -65.0 -40.5 4.6 37.0 3.4 38 59 A E H > S+ 0 0 95 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.920 111.5 48.5 -60.8 -41.1 7.4 35.6 1.3 39 60 A I H X S+ 0 0 9 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.917 110.3 51.5 -64.9 -43.6 7.6 32.6 3.6 40 61 A L H X S+ 0 0 21 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.924 108.8 50.7 -58.2 -46.1 3.9 32.1 3.5 41 62 A D H X S+ 0 0 71 -4,-2.5 4,-2.7 1,-0.2 5,-0.4 0.918 110.3 50.0 -59.9 -41.8 4.0 32.2 -0.3 42 63 A I H X S+ 0 0 26 -4,-2.1 4,-2.4 3,-0.2 -1,-0.2 0.918 112.5 46.9 -60.2 -45.2 6.7 29.5 -0.3 43 64 A I H < S+ 0 0 18 -4,-2.5 12,-0.7 1,-0.2 11,-0.7 0.935 118.8 39.6 -63.6 -46.4 4.8 27.3 2.0 44 65 A L H < S+ 0 0 60 -4,-2.9 9,-1.9 -5,-0.2 -2,-0.2 0.922 134.2 18.1 -68.9 -43.5 1.5 27.6 0.1 45 66 A N H < S- 0 0 105 -4,-2.7 7,-0.5 -5,-0.3 -3,-0.2 0.531 95.9-128.8-113.3 -9.5 2.9 27.5 -3.4 46 67 A G < - 0 0 12 -4,-2.4 2,-0.2 5,-0.4 -1,-0.2 -0.171 15.8-132.1 76.1 178.5 6.4 26.1 -3.3 47 68 A Q B > -A 50 0A 105 3,-1.7 3,-2.6 1,-0.1 -1,-0.1 -0.829 57.7 -34.6-171.8 126.9 9.4 27.7 -5.0 48 69 A G T 3 S- 0 0 85 1,-0.3 -1,-0.1 -2,-0.2 0, 0.0 -0.285 135.2 -2.0 55.4-125.9 12.1 26.3 -7.2 49 70 A G T 3 S+ 0 0 86 -3,-0.1 -1,-0.3 2,-0.1 -3,-0.0 0.549 115.4 94.3 -71.6 -11.3 12.7 22.7 -6.0 50 71 A M B < S-A 47 0A 50 -3,-2.6 -3,-1.7 1,-0.0 2,-0.0 -0.759 72.7-132.6 -85.4 130.1 10.2 22.9 -3.1 51 72 A P - 0 0 80 0, 0.0 -5,-0.4 0, 0.0 3,-0.3 -0.347 18.0-121.0 -72.7 159.1 6.6 21.7 -3.9 52 73 A G S S+ 0 0 40 -7,-0.5 -7,-0.3 1,-0.2 -8,-0.2 -0.383 82.5 46.0 -85.0 169.7 3.5 23.6 -3.0 53 74 A G + 0 0 38 -9,-1.9 -1,-0.2 -10,-0.5 -9,-0.1 0.485 62.2 125.6 85.8 -0.3 0.7 22.5 -0.7 54 75 A I S S+ 0 0 66 -11,-0.7 2,-0.3 -3,-0.3 -10,-0.1 0.894 84.9 11.0 -68.1 -33.0 2.6 21.0 2.2 55 76 A A S S- 0 0 5 -12,-0.7 2,-0.3 4,-0.0 -2,-0.3 -0.953 75.4-167.6-137.7 159.3 0.8 23.3 4.6 56 77 A K >> - 0 0 153 -2,-0.3 4,-1.8 -3,-0.1 3,-1.0 -0.920 40.6 -15.5-139.4 160.0 -2.3 25.5 4.2 57 78 A G H 3> S- 0 0 42 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 -0.008 121.5 -0.2 53.0-137.1 -4.4 28.2 5.8 58 79 A A H 3> S+ 0 0 67 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.840 134.3 54.4 -61.7 -32.4 -4.0 29.0 9.5 59 80 A E H <> S+ 0 0 77 -3,-1.0 4,-2.3 2,-0.2 -2,-0.2 0.959 110.2 45.8 -63.1 -50.0 -1.3 26.3 9.9 60 81 A A H X S+ 0 0 0 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.908 113.3 50.0 -57.3 -43.1 0.8 27.8 7.1 61 82 A E H X S+ 0 0 108 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.882 110.1 50.2 -66.1 -39.5 0.3 31.3 8.4 62 83 A A H X S+ 0 0 26 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.906 112.2 47.4 -66.7 -40.6 1.4 30.2 11.9 63 84 A V H X S+ 0 0 4 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.917 111.6 50.9 -64.6 -42.9 4.5 28.5 10.5 64 85 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.918 111.0 47.8 -61.7 -42.8 5.3 31.6 8.4 65 86 A A H X S+ 0 0 36 -4,-2.4 4,-0.7 2,-0.2 -1,-0.2 0.895 113.2 48.6 -63.5 -40.4 5.0 33.9 11.4 66 87 A W H >< S+ 0 0 75 -4,-2.1 3,-0.8 1,-0.2 -2,-0.2 0.933 114.9 43.9 -66.5 -45.5 7.2 31.6 13.6 67 88 A L H >< S+ 0 0 8 -4,-2.8 3,-1.8 1,-0.2 -36,-1.0 0.849 103.4 65.0 -68.1 -33.1 9.9 31.3 10.9 68 89 A A H 3< S+ 0 0 9 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.756 100.1 53.6 -63.5 -23.1 9.8 35.0 10.2 69 90 A E T << S+ 0 0 137 -3,-0.8 2,-0.7 -4,-0.7 -1,-0.3 0.464 86.8 95.9 -87.6 -2.7 11.1 35.7 13.7 70 91 A K < 0 0 72 -3,-1.8 -39,-1.7 -4,-0.2 -38,-0.7 -0.830 360.0 360.0 -94.7 113.8 14.1 33.3 13.3 71 92 A K 0 0 160 -2,-0.7 -42,-0.2 -40,-0.2 -1,-0.2 0.434 360.0 360.0-134.5 360.0 17.1 35.3 12.3