==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 03-AUG-00 1FI3 . COMPND 2 MOLECULE: CYTOCHROME C-551; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS STUTZERI ZOBELL; . AUTHOR G.T.MILLER,J.K.HARDMAN,R.TIMKOVICH . 82 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6017.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 50 61.0 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 . 0 0.0 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 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 2.4 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 . 4 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 39.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.2 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 1 1 1 0 0 0 1 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 . 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 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 1 A Q > 0 0 213 0, 0.0 4,-1.2 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -27.4 -8.2 -2.4 14.6 2 2 A D H > + 0 0 94 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.716 360.0 75.5 -75.9 -17.5 -7.3 -5.0 11.9 3 3 A G H > S+ 0 0 8 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.973 102.3 36.7 -58.6 -53.3 -6.0 -2.2 9.7 4 4 A E H > S+ 0 0 124 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.914 117.6 52.8 -67.0 -39.7 -2.8 -1.7 11.7 5 5 A A H X S+ 0 0 50 -4,-1.2 4,-2.1 2,-0.2 5,-0.4 0.917 109.3 49.5 -62.8 -40.3 -2.6 -5.5 12.3 6 6 A L H X S+ 0 0 16 -4,-3.2 4,-1.8 1,-0.2 -2,-0.2 0.954 109.7 49.3 -64.8 -46.9 -2.8 -6.2 8.6 7 7 A F H < S+ 0 0 21 -4,-2.2 6,-0.7 -5,-0.3 -1,-0.2 0.737 112.4 54.5 -64.9 -17.1 -0.1 -3.6 7.8 8 8 A K H < S+ 0 0 147 -4,-1.1 -2,-0.2 -5,-0.2 6,-0.2 0.970 109.6 38.4 -79.7 -71.0 1.9 -5.4 10.5 9 9 A S H < S+ 0 0 106 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.1 0.834 111.8 70.2 -51.2 -26.4 1.9 -9.1 9.4 10 10 A K S >< S- 0 0 66 -4,-1.8 3,-1.1 -5,-0.4 2,-1.0 -0.788 81.5-152.5 -94.4 100.4 2.3 -7.6 6.0 11 11 A P T 3> + 0 0 89 0, 0.0 4,-1.3 0, 0.0 5,-0.4 0.262 62.0 122.4 -58.8 22.8 5.9 -6.2 6.0 12 12 A C H 3> S+ 0 0 56 -2,-1.0 4,-2.9 1,-0.3 3,-0.4 0.897 79.0 49.0 -52.7 -33.7 4.6 -3.7 3.4 13 13 A A H <4 S+ 0 0 29 -3,-1.1 -1,-0.3 -6,-0.7 -5,-0.1 0.861 93.0 73.2 -74.4 -33.9 5.8 -1.2 6.0 14 14 A A H 4 S+ 0 0 81 1,-0.2 -1,-0.2 -6,-0.2 -2,-0.2 0.874 119.4 20.2 -48.6 -31.6 9.2 -3.1 6.2 15 15 A C H < S+ 0 0 66 -4,-1.3 9,-1.3 -3,-0.4 8,-1.2 0.711 129.4 56.7-106.2 -32.0 9.7 -1.4 2.9 16 16 A H < - 0 0 32 -4,-2.9 2,-0.3 -5,-0.4 10,-0.2 -0.239 67.0-173.3 -89.6-176.4 7.1 1.4 3.2 17 17 A S - 0 0 27 8,-0.3 10,-2.0 1,-0.1 11,-0.3 -0.905 28.2-133.9-160.0-172.1 6.9 4.0 6.0 18 18 A V S S+ 0 0 93 -2,-0.3 10,-0.2 8,-0.3 11,-0.1 0.631 98.0 4.1-125.6 -40.7 4.8 6.8 7.5 19 19 A D S S+ 0 0 139 9,-0.1 -2,-0.0 8,-0.0 0, 0.0 -0.190 130.9 42.9-142.5 46.6 7.2 9.7 8.2 20 20 A T S S- 0 0 105 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 0.343 75.0-156.6-154.2 -50.2 10.6 8.6 6.9 21 21 A K + 0 0 103 4,-0.0 -5,-0.1 1,-0.0 -3,-0.0 0.538 21.3 164.5 67.5 135.4 10.5 6.8 3.5 22 22 A M S S- 0 0 155 2,-1.0 -6,-0.1 -7,-0.4 -7,-0.1 0.368 76.5 -0.7-147.2 -58.3 13.2 4.4 2.4 23 23 A V S S+ 0 0 78 -8,-1.2 -7,-0.2 1,-0.3 36,-0.1 0.734 132.4 20.0-111.4 -38.7 12.3 2.2 -0.5 24 24 A G S S- 0 0 10 -9,-1.3 -2,-1.0 1,-0.0 -1,-0.3 -0.788 93.8 -83.5-125.8 171.2 8.7 3.3 -1.2 25 25 A P - 0 0 7 0, 0.0 -8,-0.3 0, 0.0 5,-0.1 -0.513 54.5 -98.8 -76.1 138.8 6.7 6.4 -0.4 26 26 A A >> - 0 0 10 -2,-0.2 4,-2.2 -10,-0.2 3,-0.6 -0.153 37.9-103.4 -53.7 151.6 5.0 6.5 3.0 27 27 A L H 3> S+ 0 0 16 -10,-2.0 4,-2.7 1,-0.2 5,-0.2 0.773 122.6 62.9 -50.2 -23.3 1.3 5.5 3.0 28 28 A K H 3> S+ 0 0 142 -11,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.971 105.2 40.6 -69.6 -52.1 0.7 9.2 3.4 29 29 A E H <> S+ 0 0 99 -3,-0.6 4,-1.6 1,-0.2 -2,-0.2 0.922 122.7 43.0 -63.5 -39.4 2.2 10.2 0.0 30 30 A V H X S+ 0 0 22 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.899 114.6 49.4 -73.3 -38.2 0.6 7.1 -1.6 31 31 A A H < S+ 0 0 16 -4,-2.7 -2,-0.2 -5,-0.4 -1,-0.2 0.853 111.5 50.2 -69.6 -30.8 -2.7 7.7 0.2 32 32 A A H >X S+ 0 0 69 -4,-2.5 3,-0.9 -5,-0.2 4,-0.5 0.858 109.1 51.3 -75.6 -33.0 -2.6 11.4 -0.9 33 33 A K H 3< S+ 0 0 149 -4,-1.6 3,-0.3 1,-0.2 -2,-0.2 0.905 117.1 38.7 -70.6 -39.4 -2.0 10.4 -4.5 34 34 A N T 3< S+ 0 0 19 -4,-2.0 6,-0.3 1,-0.2 -1,-0.2 0.130 93.1 93.4 -96.7 22.8 -4.9 7.9 -4.5 35 35 A A T <4 S+ 0 0 72 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.1 0.906 86.5 45.1 -80.7 -41.7 -7.1 10.2 -2.4 36 36 A G S < S+ 0 0 77 -4,-0.5 2,-0.9 -3,-0.3 -1,-0.2 0.570 101.6 79.8 -77.5 -5.2 -8.8 11.9 -5.4 37 37 A V > - 0 0 67 1,-0.2 3,-1.5 -4,-0.1 -1,-0.1 -0.797 64.3-166.0-105.1 94.9 -9.3 8.4 -6.9 38 38 A E T 3 S+ 0 0 204 -2,-0.9 3,-0.3 1,-0.3 -1,-0.2 0.803 91.5 60.4 -49.6 -25.8 -12.3 6.8 -5.2 39 39 A G T 3> + 0 0 30 1,-0.2 4,-2.1 2,-0.1 -1,-0.3 -0.095 67.9 130.7 -94.0 37.9 -11.0 3.5 -6.8 40 40 A A H <> + 0 0 5 -3,-1.5 4,-3.0 -6,-0.3 5,-0.4 0.975 68.2 54.0 -54.7 -58.6 -7.7 3.8 -4.9 41 41 A A H > S+ 0 0 32 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.856 107.8 54.1 -46.9 -34.1 -7.7 0.2 -3.5 42 42 A D H > S+ 0 0 116 -3,-0.3 4,-2.2 2,-0.2 5,-0.3 0.977 110.7 43.1 -66.4 -52.1 -8.1 -0.8 -7.2 43 43 A T H X S+ 0 0 38 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.943 116.4 47.7 -59.5 -46.4 -5.0 1.1 -8.3 44 44 A L H X S+ 0 0 41 -4,-3.0 4,-1.9 -5,-0.2 5,-0.4 0.839 109.7 57.0 -65.1 -29.1 -3.0 -0.1 -5.3 45 45 A A H X>S+ 0 0 28 -4,-1.7 4,-2.2 -5,-0.4 5,-0.7 0.990 107.9 42.0 -67.1 -59.4 -4.3 -3.6 -6.0 46 46 A L H <5S+ 0 0 84 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.788 114.0 56.7 -60.7 -22.0 -3.0 -3.9 -9.6 47 47 A H H <5S+ 0 0 40 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.913 123.2 21.4 -77.0 -39.4 0.2 -2.3 -8.4 48 48 A I H ><5S+ 0 0 45 -4,-1.9 3,-1.8 -3,-0.3 16,-1.6 0.919 127.9 46.3 -90.0 -59.4 0.9 -4.8 -5.7 49 49 A K T 3<5S+ 0 0 81 -4,-2.2 -3,-0.2 -5,-0.4 -2,-0.1 0.736 131.5 27.4 -56.1 -19.3 -1.1 -7.8 -6.9 50 50 A N T 3 - 0 0 80 -2,-0.3 4,-3.9 1,-0.1 5,-0.4 -0.554 31.3-118.8 -80.0 143.9 -7.3 -11.7 -1.0 68 68 A E H > S+ 0 0 135 1,-0.2 4,-1.7 -2,-0.2 5,-0.2 0.833 117.0 55.9 -51.5 -29.1 -9.9 -9.1 -2.0 69 69 A E H > S+ 0 0 156 2,-0.2 4,-2.1 3,-0.2 -1,-0.2 0.965 115.0 34.5 -69.8 -50.0 -11.0 -9.2 1.7 70 70 A E H > S+ 0 0 63 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.911 118.3 53.1 -71.6 -39.9 -7.6 -8.4 3.0 71 71 A A H X S+ 0 0 22 -4,-3.9 4,-1.3 1,-0.2 -1,-0.2 0.879 110.4 49.3 -63.5 -34.0 -6.8 -6.1 0.1 72 72 A K H X S+ 0 0 127 -4,-1.7 4,-1.4 -5,-0.4 -2,-0.2 0.949 115.8 41.0 -71.1 -47.0 -10.0 -4.2 0.8 73 73 A I H X S+ 0 0 62 -4,-2.1 4,-2.5 1,-0.2 3,-0.5 0.954 117.1 48.0 -66.7 -46.5 -9.4 -3.8 4.5 74 74 A L H X S+ 0 0 24 -4,-3.3 4,-1.6 1,-0.2 -1,-0.2 0.832 111.6 52.3 -63.5 -27.9 -5.7 -3.0 3.9 75 75 A A H X S+ 0 0 8 -4,-1.3 4,-1.7 -5,-0.3 -1,-0.2 0.777 109.2 49.7 -79.6 -23.4 -6.8 -0.5 1.3 76 76 A E H X S+ 0 0 102 -4,-1.4 4,-2.3 -3,-0.5 5,-0.3 0.918 113.2 43.8 -80.5 -43.4 -9.2 1.1 3.7 77 77 A W H X S+ 0 0 56 -4,-2.5 4,-3.0 2,-0.2 -2,-0.2 0.893 116.0 49.8 -68.3 -36.2 -6.7 1.6 6.5 78 78 A V H < S+ 0 0 19 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.943 117.0 38.6 -68.7 -45.7 -4.1 2.8 4.0 79 79 A L H < S+ 0 0 89 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.836 124.1 42.2 -74.5 -29.2 -6.4 5.3 2.3 80 80 A S H < S+ 0 0 78 -4,-2.3 2,-1.2 1,-0.2 -2,-0.2 0.859 75.3 159.5 -83.9 -36.0 -7.9 6.3 5.8 81 81 A L < 0 0 40 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.1 -0.229 360.0 360.0 50.4 -88.9 -4.5 6.3 7.6 82 82 A K 0 0 245 -2,-1.2 -1,-0.1 -3,-0.2 -5,-0.0 -0.824 360.0 360.0-165.7 360.0 -5.7 8.4 10.5