==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 10-FEB-98 1NEW . COMPND 2 MOLECULE: CYTOCHROME C551.5; . SOURCE 2 ORGANISM_SCIENTIFIC: DESULFUROMONAS ACETOXIDANS; . AUTHOR M.ASSFALG,L.BANCI,I.BERTINI,M.BRUSCHI,P.TURANO . 68 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5804.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 35 51.5 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 . 7 10.3 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 . 0 0.0 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 . 10 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 4.4 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 0 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 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 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 ANTIPARALLEL 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 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 A 0 0 96 0, 0.0 3,-0.1 0, 0.0 17,-0.0 0.000 360.0 360.0 360.0 149.1 -2.9 -10.7 -7.9 2 2 A D + 0 0 89 1,-0.2 15,-3.0 15,-0.2 16,-1.9 0.715 360.0 21.0 -71.9 -34.6 -2.8 -7.7 -10.3 3 3 A V E S+A 16 0A 79 13,-0.3 2,-0.3 14,-0.2 -1,-0.2 -0.936 79.8 179.7-129.0 148.4 -5.3 -6.3 -7.7 4 4 A V E -A 15 0A 50 11,-3.0 11,-3.0 -2,-0.3 2,-0.3 -0.905 11.9-149.9-141.1 165.1 -5.7 -7.6 -4.1 5 5 A T E -A 14 0A 80 -2,-0.3 2,-0.4 9,-0.3 9,-0.2 -0.992 4.6-162.8-141.2 144.2 -8.0 -6.7 -1.2 6 6 A Y E -A 13 0A 103 7,-3.0 7,-3.1 -2,-0.3 2,-0.3 -0.973 13.6-153.1-126.0 111.4 -7.6 -6.9 2.6 7 7 A E + 0 0 168 -2,-0.4 2,-0.3 5,-0.3 5,-0.2 -0.712 23.9 172.9 -83.1 134.8 -10.8 -6.7 4.7 8 8 A N > - 0 0 63 -2,-0.3 3,-2.1 1,-0.1 -2,-0.0 -0.961 45.6-112.9-145.9 155.4 -10.2 -5.2 8.2 9 9 A K T 3 S+ 0 0 214 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.850 118.4 54.9 -61.3 -37.5 -12.4 -4.1 11.2 10 10 A K T 3 S- 0 0 165 1,-0.3 -1,-0.3 -3,-0.0 2,-0.1 0.386 134.5 -65.8 -75.3 2.1 -11.4 -0.5 10.6 11 11 A G < - 0 0 0 -3,-2.1 -1,-0.3 57,-0.3 57,-0.3 -0.227 60.8 -76.7 122.4 149.7 -12.6 -0.8 7.0 12 12 A N B -B 67 0B 47 55,-2.2 55,-2.7 -5,-0.2 2,-0.4 -0.522 40.0-152.3 -78.6 145.1 -11.5 -2.8 3.9 13 13 A V E -A 6 0A 14 -7,-3.1 -7,-3.0 53,-0.2 2,-0.3 -0.970 6.2-142.0-117.0 131.2 -8.5 -1.7 1.9 14 14 A T E -A 5 0A 76 51,-0.4 2,-0.4 -2,-0.4 -9,-0.3 -0.725 14.6-157.3 -78.8 139.5 -7.9 -2.4 -1.8 15 15 A F E -A 4 0A 52 -11,-3.0 -11,-3.0 -2,-0.3 2,-0.4 -0.981 1.3-158.4-108.9 134.9 -4.3 -3.2 -2.8 16 16 A D E +A 3 0A 58 -2,-0.4 -13,-0.3 -13,-0.2 -14,-0.1 -0.915 18.2 168.7-107.5 141.8 -3.3 -2.7 -6.4 17 17 A H S > S+ 0 0 107 -15,-3.0 4,-2.5 -2,-0.4 9,-0.2 0.685 84.6 22.3-112.9 -61.0 -0.2 -4.6 -7.5 18 18 A K H > S+ 0 0 103 -16,-1.9 4,-2.5 2,-0.2 -15,-0.1 0.977 126.0 52.6 -67.4 -56.4 -0.2 -4.1 -11.2 19 19 A A H 4 S+ 0 0 49 -17,-0.9 4,-0.5 1,-0.2 -1,-0.2 0.842 115.5 41.3 -55.9 -37.0 -2.3 -0.9 -11.1 20 20 A H H >> S+ 0 0 66 -18,-0.3 4,-2.7 1,-0.2 3,-2.2 0.971 111.5 57.5 -67.6 -54.5 0.2 0.5 -8.5 21 21 A A H 3X S+ 0 0 35 -4,-2.5 4,-1.9 1,-0.3 -2,-0.2 0.794 91.7 69.5 -45.3 -38.9 3.2 -0.9 -10.5 22 22 A E H 3< S+ 0 0 135 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.824 117.9 23.1 -53.3 -34.3 2.1 1.0 -13.7 23 23 A K H <4 S+ 0 0 182 -3,-2.2 -2,-0.2 -4,-0.5 -1,-0.2 0.834 131.8 42.8 -91.0 -47.8 3.2 4.2 -11.8 24 24 A L H < S- 0 0 53 -4,-2.7 -3,-0.2 -5,-0.1 -2,-0.2 0.909 84.7-143.0 -70.5 -53.2 5.6 2.7 -9.2 25 25 A G < - 0 0 45 -4,-1.9 2,-2.4 1,-0.1 -4,-0.1 0.877 46.8 -88.8 82.6 43.5 7.7 0.2 -11.2 26 26 A C S >> S+ 0 0 69 -9,-0.2 2,-2.7 1,-0.1 4,-2.6 -0.350 116.9 80.5 66.7 -69.9 8.1 -2.5 -8.5 27 27 A D T 34 S+ 0 0 104 -2,-2.4 4,-0.2 1,-0.2 -1,-0.1 -0.403 84.5 63.6 -73.9 66.4 11.2 -1.2 -6.7 28 28 A A T 34 S+ 0 0 66 -2,-2.7 -1,-0.2 3,-0.1 -3,-0.1 0.206 115.8 25.1-157.5 -47.1 9.3 1.4 -4.7 29 29 A C T <4 S+ 0 0 74 -3,-1.5 -2,-0.2 -8,-0.0 2,-0.1 0.823 138.9 32.4 -80.3 -48.4 7.1 -1.0 -2.6 30 30 A H S < S- 0 0 39 -4,-2.6 2,-0.3 7,-0.0 3,-0.0 -0.308 70.0-161.7 -90.6-179.5 9.8 -3.6 -3.1 31 31 A E - 0 0 168 -4,-0.2 -3,-0.1 2,-0.1 -5,-0.0 -0.909 61.9 -0.8-150.5 157.2 13.6 -3.5 -3.5 32 32 A G S S- 0 0 60 -2,-0.3 -1,-0.1 -5,-0.1 0, 0.0 0.703 132.0 -4.1 33.4 79.1 16.2 -6.0 -4.8 33 33 A T S S- 0 0 126 -3,-0.0 -2,-0.1 1,-0.0 -1,-0.0 0.942 88.3-123.7 74.7 93.4 14.3 -9.1 -5.8 34 34 A P + 0 0 75 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.303 43.2 152.3 -70.2 149.6 10.6 -8.7 -4.9 35 35 A A - 0 0 70 -2,-0.0 2,-0.8 0, 0.0 -2,-0.0 -0.900 55.4 -42.5-160.8 178.5 8.9 -11.3 -2.6 36 36 A K - 0 0 189 -2,-0.3 2,-0.1 1,-0.1 0, 0.0 -0.407 59.9-145.1 -60.8 99.8 6.0 -11.6 -0.1 37 37 A I - 0 0 72 -2,-0.8 2,-2.2 1,-0.1 -1,-0.1 -0.377 24.2-107.7 -63.9 142.9 6.3 -8.4 2.1 38 38 A A - 0 0 66 -2,-0.1 5,-0.4 5,-0.0 2,-0.3 -0.488 42.3-166.9 -75.0 74.3 5.4 -8.9 5.8 39 39 A I + 0 0 59 -2,-2.2 2,-0.3 4,-0.1 -3,-0.0 -0.544 32.1 120.6 -63.1 125.2 2.0 -7.1 5.6 40 40 A D S > S- 0 0 59 -2,-0.3 4,-2.3 0, 0.0 5,-0.4 -0.910 80.5 -79.3-165.8 175.6 0.8 -6.4 9.2 41 41 A K T 4 S+ 0 0 150 -2,-0.3 -2,-0.1 1,-0.2 0, 0.0 -0.015 127.0 54.9 -78.7 31.6 -0.1 -3.3 11.3 42 42 A K T 4 S+ 0 0 158 -4,-0.2 4,-0.2 -2,-0.1 -1,-0.2 0.540 118.2 27.8-113.0 -58.3 3.6 -2.8 11.9 43 43 A S T >4>S+ 0 0 44 -5,-0.4 3,-2.6 1,-0.2 5,-0.9 0.970 118.9 55.6 -63.8 -57.7 4.9 -2.6 8.3 44 44 A A I 3<>S+ 0 0 16 -4,-2.3 5,-2.5 1,-0.3 6,-1.4 0.835 109.9 45.6 -46.2 -47.5 1.7 -1.3 6.6 45 45 A H I 3 5S+ 0 0 89 -5,-0.4 -1,-0.3 4,-0.2 -2,-0.2 0.386 108.8 63.0 -86.6 1.7 1.4 1.7 8.8 46 46 A K I < 5S- 0 0 117 -3,-2.6 3,-0.3 -4,-0.2 4,-0.2 0.254 128.8 -48.1 -93.4-135.2 5.1 2.6 8.5 47 47 A D I >>S+ 0 0 84 1,-0.2 5,-0.7 3,-0.1 4,-0.6 0.749 124.0 83.6 -74.7 -22.5 6.5 3.5 5.1 48 48 A A I 4<5S+ 0 0 60 -2,-1.7 2,-2.3 -4,-0.6 3,-1.2 0.624 97.1 57.7-121.1 -60.6 4.2 7.3 3.3 52 52 A C T 3 S+ 0 0 34 -2,-2.3 3,-2.5 3,-0.1 -1,-0.2 0.547 79.9 75.3-139.5 -34.9 0.3 8.8 -0.6 54 54 A K T < S+ 0 0 127 -3,-1.2 -2,-0.1 1,-0.3 4,-0.1 0.798 102.9 46.6 -59.3 -29.3 0.6 12.2 1.0 55 55 A S T 3 S+ 0 0 114 -4,-0.4 -1,-0.3 2,-0.1 2,-0.2 0.001 115.6 58.6 -97.1 24.6 2.3 13.4 -2.2 56 56 A N S < S- 0 0 93 -3,-2.5 2,-0.1 3,-0.2 -3,-0.1 -0.795 88.4 -94.9-137.2 178.0 -0.4 11.7 -4.3 57 57 A N S S+ 0 0 128 -2,-0.2 -2,-0.1 3,-0.0 -1,-0.0 -0.444 86.0 29.8 -86.5 170.2 -4.2 11.8 -4.8 58 58 A G S S+ 0 0 51 -2,-0.1 3,-0.4 -4,-0.1 2,-0.2 -0.716 104.1 42.4 88.5-117.5 -6.8 9.5 -3.0 59 59 A P S S+ 0 0 36 0, 0.0 -3,-0.2 0, 0.0 5,-0.1 -0.459 70.9 98.5 -70.6 138.5 -5.9 8.2 0.4 60 60 A T + 0 0 85 -2,-0.2 2,-2.1 -5,-0.1 4,-0.1 0.011 57.4 83.9-177.2 -43.1 -4.3 10.6 2.9 61 61 A K S S- 0 0 160 -3,-0.4 2,-2.5 2,-0.3 -3,-0.0 -0.131 105.5-107.6 -73.4 41.7 -7.0 11.9 5.3 62 62 A C S > S+ 0 0 115 -2,-2.1 2,-2.1 1,-0.1 3,-0.5 -0.423 117.8 73.2 56.1 -66.7 -6.6 8.8 7.5 63 63 A G T 3 S+ 0 0 39 -2,-2.5 -2,-0.3 1,-0.2 -1,-0.1 -0.512 75.6 98.4 -64.9 78.5 -10.0 7.6 6.1 64 64 A G T 3 S+ 0 0 16 -2,-2.1 -1,-0.2 -4,-0.1 -3,-0.0 0.498 83.4 24.3-129.7 -74.6 -8.3 6.8 2.8 65 65 A C S < S+ 0 0 49 -3,-0.5 2,-0.5 -52,-0.1 -51,-0.4 0.957 112.2 72.6 -64.7 -54.4 -7.4 3.1 2.3 66 66 A H - 0 0 55 -4,-0.4 2,-0.4 -53,-0.1 -53,-0.2 -0.551 67.0-169.7 -71.2 115.5 -9.9 1.8 4.8 67 67 A I B B 12 0B 100 -55,-2.7 -55,-2.2 -2,-0.5 -2,-0.0 -0.906 360.0 360.0-106.5 137.2 -13.5 2.0 3.4 68 68 A K 0 0 204 -2,-0.4 -57,-0.3 -57,-0.3 -1,-0.2 0.908 360.0 360.0 59.1 360.0 -16.4 1.4 5.8