==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSFER 22-JAN-99 1B7V . COMPND 2 MOLECULE: PROTEIN (CYTOCHROME C-553); . SOURCE 2 ORGANISM_SCIENTIFIC: SPOROSARCINA PASTEURII; . AUTHOR A.GONZALEZ,S.BENINI,W.R.RYPNIEWSKI,K.S.WILSON,S.CIURLI . 71 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4266.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 53 74.6 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 . 28 39.4 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 2 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 0 115 0, 0.0 2,-1.0 0, 0.0 58,-0.0 0.000 360.0 360.0 360.0 142.5 -1.7 26.1 16.0 2 23 A D > - 0 0 108 1,-0.2 4,-1.9 2,-0.1 5,-0.2 -0.806 360.0-174.6 -94.7 90.7 1.6 24.5 17.4 3 24 A A H > S+ 0 0 11 -2,-1.0 4,-2.3 1,-0.2 -1,-0.2 0.845 77.6 53.1 -62.4 -40.9 4.0 25.8 14.7 4 25 A E H > S+ 0 0 115 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.907 111.0 47.9 -61.1 -41.7 7.1 24.0 15.9 5 26 A A H > S+ 0 0 34 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.900 109.5 52.2 -66.8 -38.4 5.3 20.7 15.9 6 27 A V H X S+ 0 0 10 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.945 110.7 49.6 -62.5 -39.7 3.9 21.3 12.4 7 28 A V H X>S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-1.1 0.926 110.5 49.0 -65.5 -42.7 7.5 22.0 11.3 8 29 A Q H <5S+ 0 0 80 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.847 115.8 44.7 -65.7 -35.0 8.8 18.8 12.9 9 30 A Q H <5S+ 0 0 156 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.890 130.0 17.3 -73.7 -39.5 6.0 16.8 11.2 10 31 A K H <5S+ 0 0 69 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.483 123.9 39.7-118.4 -7.0 6.1 18.3 7.7 11 32 A C T >X5S+ 0 0 28 -4,-2.6 4,-2.4 -5,-0.2 3,-0.9 0.650 91.7 73.1-121.6 -19.0 9.4 20.1 7.0 12 33 A I H 3>< - 0 0 8 -4,-2.2 3,-1.7 4,-0.2 -1,-0.2 0.172 30.0 -86.3 92.3 149.2 16.8 18.6 8.6 17 38 A G T 3 S+ 0 0 44 1,-0.3 -1,-0.1 4,-0.1 -5,-0.1 0.769 132.1 36.7 -62.2 -31.4 15.7 18.0 12.1 18 39 A D T 3 S- 0 0 108 3,-0.1 -1,-0.3 -6,-0.1 -2,-0.1 0.180 115.6-114.8-103.6 15.4 17.3 21.1 13.5 19 40 A L S < S+ 0 0 8 -3,-1.7 8,-2.8 1,-0.1 9,-1.7 0.549 83.3 121.9 64.1 13.7 16.4 23.0 10.3 20 41 A T S S- 0 0 77 1,-0.3 6,-0.4 6,-0.2 -4,-0.2 0.351 83.0 -82.1 -91.8 12.8 20.0 23.5 9.3 21 42 A G + 0 0 26 -6,-2.5 -1,-0.3 4,-0.3 -6,-0.2 0.028 50.3 173.7 104.3 145.4 19.6 21.7 6.0 22 43 A A S S- 0 0 66 2,-2.4 -7,-0.1 -8,-0.8 -8,-0.1 -0.239 83.4 -15.0-144.2-105.4 19.4 18.1 4.8 23 44 A S S S+ 0 0 105 -10,-0.4 -8,-0.2 -2,-0.1 -9,-0.1 0.854 140.2 42.6 -72.5 -33.7 18.5 17.3 1.2 24 45 A A S S- 0 0 25 -10,-2.6 -2,-2.4 1,-0.2 3,-0.1 -0.664 106.0 -76.4-103.8 171.2 17.2 20.8 0.9 25 46 A P - 0 0 99 0, 0.0 -4,-0.3 0, 0.0 -1,-0.2 -0.046 55.2 -85.2 -67.2 161.9 18.7 24.1 2.2 26 47 A A + 0 0 51 -6,-0.4 -6,-0.2 -5,-0.1 -10,-0.1 -0.342 36.1 177.5 -61.8 153.6 18.7 25.3 5.8 27 48 A I > + 0 0 28 -8,-2.8 3,-1.8 -12,-0.3 4,-0.2 0.245 50.5 107.8-136.9 11.6 15.7 27.2 7.0 28 49 A D T 3 S+ 0 0 47 -9,-1.7 -8,-0.1 1,-0.3 3,-0.1 0.671 94.8 28.7 -69.4 -20.3 16.7 27.7 10.7 29 50 A K T >> S+ 0 0 119 -10,-0.2 3,-1.9 42,-0.2 4,-0.5 -0.164 80.6 133.9-123.4 30.3 17.3 31.5 10.0 30 51 A A H X> + 0 0 11 -3,-1.8 4,-2.2 1,-0.3 3,-1.4 0.819 65.1 63.5 -54.3 -33.7 14.8 31.9 7.3 31 52 A G H 34 S+ 0 0 12 39,-1.6 -1,-0.3 36,-1.1 40,-0.2 0.712 95.3 60.8 -66.1 -16.6 13.4 35.1 8.8 32 53 A A H <4 S+ 0 0 55 -3,-1.9 -1,-0.3 38,-0.7 -2,-0.2 0.705 118.0 29.2 -77.9 -22.7 16.8 36.7 8.2 33 54 A N H << S+ 0 0 119 -3,-1.4 2,-0.3 -4,-0.5 -2,-0.2 0.644 122.6 40.0-111.5 -19.7 16.4 36.1 4.5 34 55 A Y S < S- 0 0 92 -4,-2.2 -1,-0.2 34,-0.1 2,-0.1 -0.962 72.1-121.8-135.0 148.2 12.6 36.2 3.9 35 56 A S > - 0 0 59 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.403 38.4-105.4 -79.1 162.5 9.6 38.2 5.0 36 57 A E H > S+ 0 0 94 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.923 123.4 50.5 -52.8 -46.3 6.7 36.4 6.7 37 58 A E H > S+ 0 0 125 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.908 108.8 51.0 -64.1 -39.1 4.6 36.8 3.4 38 59 A E H > S+ 0 0 93 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.900 111.4 48.8 -62.0 -41.8 7.5 35.4 1.3 39 60 A I H X S+ 0 0 9 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.931 110.6 50.5 -63.9 -39.8 7.7 32.4 3.6 40 61 A L H X S+ 0 0 20 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.918 108.6 51.8 -64.3 -44.2 3.9 31.9 3.5 41 62 A D H X S+ 0 0 73 -4,-2.5 4,-3.1 1,-0.2 5,-0.4 0.937 110.9 48.6 -58.2 -43.9 4.0 32.0 -0.4 42 63 A I H X S+ 0 0 26 -4,-2.2 4,-2.5 3,-0.2 -1,-0.2 0.920 112.7 47.7 -63.2 -43.4 6.7 29.3 -0.4 43 64 A I H < S+ 0 0 17 -4,-2.4 11,-0.7 2,-0.2 12,-0.6 0.960 119.6 37.5 -63.3 -49.1 4.8 27.1 2.0 44 65 A L H < S+ 0 0 58 -4,-2.8 9,-2.1 -5,-0.2 -2,-0.2 0.923 134.4 20.4 -68.9 -43.7 1.5 27.3 0.2 45 66 A N H < S- 0 0 107 -4,-3.1 7,-0.5 -5,-0.3 -3,-0.2 0.512 95.7-127.5-110.1 -10.2 2.9 27.3 -3.3 46 67 A G < - 0 0 11 -4,-2.5 2,-0.3 -5,-0.4 -1,-0.2 -0.165 15.2-134.4 81.7 173.3 6.4 25.9 -3.4 47 68 A Q B > -A 50 0A 105 3,-1.9 3,-2.9 1,-0.1 -1,-0.1 -0.834 57.6 -37.2-173.2 121.9 9.4 27.5 -5.0 48 69 A G T 3 S- 0 0 84 1,-0.3 -1,-0.1 -2,-0.3 0, 0.0 -0.211 134.8 -0.0 56.6-123.8 12.1 26.0 -7.3 49 70 A G T 3 S+ 0 0 86 -3,-0.1 -1,-0.3 2,-0.1 -3,-0.0 0.595 115.2 95.0 -72.8 -9.9 12.7 22.5 -6.0 50 71 A M B < S-A 47 0A 54 -3,-2.9 -3,-1.9 1,-0.0 2,-0.1 -0.750 72.8-132.4 -89.3 129.2 10.2 22.7 -3.2 51 72 A P - 0 0 82 0, 0.0 -5,-0.4 0, 0.0 3,-0.3 -0.349 19.4-122.7 -68.2 155.4 6.6 21.4 -3.9 52 73 A G S S+ 0 0 41 -7,-0.5 -7,-0.3 1,-0.2 -8,-0.2 -0.350 82.4 45.2 -89.7 169.7 3.6 23.5 -3.0 53 74 A G + 0 0 37 -9,-2.1 -1,-0.2 -10,-0.4 -9,-0.1 0.480 62.0 125.9 80.6 6.6 0.7 22.4 -0.7 54 75 A I S S+ 0 0 68 -11,-0.7 2,-0.3 -3,-0.3 -10,-0.1 0.881 85.0 13.5 -65.8 -35.9 2.7 20.9 2.2 55 76 A A S S- 0 0 7 -12,-0.6 2,-0.3 2,-0.0 -2,-0.2 -0.941 76.4-169.6-136.8 152.9 0.8 23.1 4.7 56 77 A K >> - 0 0 153 -2,-0.3 4,-1.8 -3,-0.1 3,-0.9 -0.911 40.7 -13.5-139.3 163.9 -2.3 25.3 4.2 57 78 A G H 3> S- 0 0 43 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 -0.003 121.4 -3.2 49.0-138.0 -4.4 28.0 5.8 58 79 A A H 3> S+ 0 0 68 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.837 134.4 56.1 -56.6 -33.8 -3.9 28.8 9.5 59 80 A E H <> S+ 0 0 65 -3,-0.9 4,-2.4 1,-0.2 -2,-0.2 0.960 110.2 43.9 -64.5 -48.0 -1.3 26.1 9.9 60 81 A A H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.873 113.5 52.6 -63.0 -39.6 0.8 27.5 7.1 61 82 A E H X S+ 0 0 110 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.884 108.7 49.1 -65.1 -38.7 0.3 31.0 8.5 62 83 A A H X S+ 0 0 26 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.905 112.7 48.0 -68.2 -40.8 1.4 30.0 12.0 63 84 A V H X S+ 0 0 4 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.920 110.6 51.0 -64.3 -44.4 4.5 28.4 10.5 64 85 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.917 111.8 47.8 -58.6 -43.8 5.3 31.4 8.4 65 86 A A H X S+ 0 0 36 -4,-2.3 4,-0.6 2,-0.2 -1,-0.2 0.883 113.2 48.1 -66.1 -37.9 5.0 33.7 11.4 66 87 A W H >< S+ 0 0 71 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.935 114.7 43.6 -68.2 -48.1 7.2 31.4 13.5 67 88 A L H >< S+ 0 0 9 -4,-2.9 3,-1.8 1,-0.2 -36,-1.1 0.826 103.3 66.8 -67.1 -31.9 9.9 31.0 10.9 68 89 A A H 3< S+ 0 0 11 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.755 100.4 51.5 -59.0 -25.1 9.8 34.8 10.2 69 90 A E T << S+ 0 0 137 -3,-1.0 2,-0.6 -4,-0.6 -1,-0.3 0.430 86.9 96.2 -92.8 -0.2 11.1 35.4 13.7 70 91 A K < 0 0 70 -3,-1.8 -39,-1.6 -4,-0.2 -38,-0.7 -0.811 360.0 360.0 -95.5 113.8 14.1 33.0 13.3 71 92 A K 0 0 152 -2,-0.6 -1,-0.2 -40,-0.2 -42,-0.2 0.449 360.0 360.0-136.7 360.0 17.2 35.0 12.3