==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 03-NOV-97 1AYF . COMPND 2 MOLECULE: ADRENODOXIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR A.MUELLER,J.J.MUELLER,U.HEINEMANN . 207 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10965.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 134 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 15.0 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 . 2 1.0 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 . 16 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 19.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 4 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 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 PARALLEL BRIDGES PER LADDER . 3 1 2 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 6 A K 0 0 178 0, 0.0 2,-0.3 0, 0.0 18,-0.2 0.000 360.0 360.0 360.0 151.6 -24.9 -11.0 -20.4 2 7 A I E -A 18 0A 8 16,-2.8 16,-2.0 94,-0.1 2,-0.3 -0.968 360.0-114.9-130.0 154.4 -21.4 -12.6 -20.3 3 8 A T E -A 17 0A 29 -2,-0.3 94,-2.1 14,-0.2 95,-0.6 -0.634 28.6-174.4 -87.8 134.9 -19.9 -15.9 -19.2 4 9 A V E -Ab 16 98A 0 12,-3.2 12,-2.4 -2,-0.3 2,-0.4 -1.000 9.9-154.1-129.6 132.9 -17.4 -16.0 -16.3 5 10 A H E -Ab 15 99A 47 93,-2.5 95,-2.7 -2,-0.4 2,-0.5 -0.912 6.6-162.4-107.0 134.6 -15.5 -19.1 -15.2 6 11 A F E -Ab 14 100A 0 8,-3.0 8,-3.6 -2,-0.4 2,-0.9 -0.974 10.8-151.9-116.8 121.5 -14.3 -19.4 -11.6 7 12 A I E -Ab 13 101A 35 93,-2.7 95,-2.9 -2,-0.5 6,-0.2 -0.865 26.6-150.3 -88.3 104.8 -11.6 -21.9 -10.6 8 13 A N > - 0 0 6 4,-2.9 3,-1.5 -2,-0.9 27,-0.1 -0.248 26.7-102.5 -72.5 169.3 -12.5 -22.5 -7.0 9 14 A R T 3 S+ 0 0 112 1,-0.3 -1,-0.1 94,-0.2 26,-0.1 0.793 122.3 60.1 -65.9 -25.3 -9.9 -23.5 -4.4 10 15 A D T 3 S- 0 0 95 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.641 120.5-109.1 -74.2 -14.8 -11.0 -27.1 -4.6 11 16 A G S < S+ 0 0 45 -3,-1.5 2,-0.2 1,-0.4 -2,-0.1 0.280 75.9 133.3 104.5 -9.4 -10.1 -27.1 -8.3 12 17 A E - 0 0 120 -5,-0.1 -4,-2.9 1,-0.1 2,-0.6 -0.529 54.3-130.2 -76.4 140.3 -13.7 -27.2 -9.5 13 18 A T E -A 7 0A 82 -6,-0.2 2,-0.6 -2,-0.2 -6,-0.2 -0.805 15.8-158.3 -94.3 120.9 -14.6 -24.8 -12.3 14 19 A L E -A 6 0A 33 -8,-3.6 -8,-3.0 -2,-0.6 2,-0.5 -0.923 7.7-165.3 -99.0 114.4 -17.8 -22.8 -11.7 15 20 A T E +A 5 0A 84 -2,-0.6 2,-0.3 -10,-0.2 -10,-0.2 -0.906 23.6 147.1-104.4 125.6 -19.3 -21.5 -14.9 16 21 A T E -A 4 0A 20 -12,-2.4 -12,-3.2 -2,-0.5 2,-0.4 -0.938 38.2-117.5-149.0 173.1 -21.9 -18.8 -14.6 17 22 A K E +A 3 0A 111 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.2 -0.919 24.4 174.6-120.5 145.0 -23.3 -15.7 -16.2 18 23 A G E -A 2 0A 7 -16,-2.0 -16,-2.8 -2,-0.4 2,-0.3 -0.927 31.5-108.3-137.5 165.5 -23.5 -12.0 -15.1 19 24 A K > - 0 0 135 -2,-0.3 3,-2.7 -18,-0.2 72,-0.4 -0.755 43.4 -93.6 -98.1 143.7 -24.7 -8.8 -16.7 20 25 A I T 3 S+ 0 0 102 -2,-0.3 72,-0.2 1,-0.3 3,-0.1 -0.205 116.5 32.7 -53.4 135.3 -22.3 -6.1 -17.8 21 26 A G T 3 S+ 0 0 47 70,-2.0 -1,-0.3 1,-0.4 2,-0.1 0.108 90.3 121.1 102.0 -22.7 -21.9 -3.6 -14.9 22 27 A D < - 0 0 23 -3,-2.7 69,-2.9 68,-0.1 -1,-0.4 -0.476 64.4-122.1 -69.3 142.7 -22.4 -6.3 -12.2 23 28 A S B > -E 90 0B 8 67,-0.3 4,-2.2 -2,-0.1 67,-0.3 -0.420 22.7-113.2 -77.8 165.7 -19.5 -6.7 -9.7 24 29 A L H > S+ 0 0 0 65,-1.9 4,-1.8 62,-1.5 63,-0.2 0.835 120.9 54.6 -69.9 -24.2 -17.8 -10.0 -9.4 25 30 A L H > S+ 0 0 13 61,-0.8 4,-3.5 2,-0.2 5,-0.2 0.944 105.1 52.8 -71.3 -42.6 -19.2 -10.3 -5.9 26 31 A D H > S+ 0 0 59 1,-0.2 4,-2.8 2,-0.2 5,-0.4 0.939 108.1 52.2 -53.1 -46.4 -22.7 -9.7 -7.4 27 32 A V H X S+ 0 0 0 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.886 113.4 42.8 -57.0 -45.4 -22.0 -12.6 -9.8 28 33 A V H <>S+ 0 0 7 -4,-1.8 5,-2.0 2,-0.2 -2,-0.2 0.934 117.7 45.3 -69.1 -43.9 -21.0 -14.9 -6.9 29 34 A V H ><5S+ 0 0 84 -4,-3.5 3,-1.5 1,-0.2 -2,-0.2 0.965 113.6 45.7 -69.2 -49.4 -23.9 -13.9 -4.6 30 35 A Q H 3<5S+ 0 0 115 -4,-2.8 -1,-0.2 1,-0.3 -3,-0.2 0.878 116.6 44.7 -62.1 -40.2 -26.8 -13.9 -7.1 31 36 A N T 3<5S- 0 0 63 -4,-1.3 -1,-0.3 -5,-0.4 -2,-0.2 0.263 106.0-125.7 -89.4 8.7 -25.8 -17.3 -8.6 32 37 A N T < 5 - 0 0 148 -3,-1.5 -3,-0.2 1,-0.2 -4,-0.1 0.829 36.3-169.3 48.9 45.3 -25.1 -18.9 -5.2 33 38 A L < - 0 0 29 -5,-2.0 2,-2.0 -6,-0.2 -1,-0.2 -0.366 26.5-121.0 -65.1 140.7 -21.6 -19.9 -6.2 34 39 A D + 0 0 102 -2,-0.1 2,-0.7 3,-0.0 -1,-0.1 -0.456 59.5 140.6 -85.4 66.6 -20.1 -22.3 -3.7 35 40 A I > - 0 0 11 -2,-2.0 3,-2.2 3,-0.1 -2,-0.0 -0.912 55.6-120.6-114.7 105.2 -17.0 -20.3 -2.7 36 41 A D T 3 S- 0 0 94 -2,-0.7 -27,-0.1 1,-0.3 110,-0.1 -0.158 86.9 -9.1 -49.8 127.1 -16.3 -20.6 1.0 37 42 A G T > S+ 0 0 17 1,-0.2 3,-1.1 108,-0.2 -1,-0.3 0.389 87.2 158.8 71.8 0.4 -16.4 -17.2 2.7 38 43 A F T < + 0 0 21 -3,-2.2 -1,-0.2 1,-0.2 12,-0.2 -0.336 65.0 14.4 -65.9 125.8 -16.6 -15.1 -0.4 39 44 A G T > S+ 0 0 9 -2,-0.1 3,-2.5 2,-0.0 -1,-0.2 0.725 72.4 162.7 89.6 28.1 -18.0 -11.6 0.1 40 45 A A T < S+ 0 0 7 -3,-1.1 105,-0.2 1,-0.3 -2,-0.1 0.820 77.8 37.6 -47.9 -51.7 -17.8 -11.5 3.9 41 46 A C T 3 S- 0 0 14 104,-0.0 -1,-0.3 105,-0.0 3,-0.1 0.338 110.2-119.5 -84.3 5.7 -18.1 -7.7 4.3 42 47 A E S < S- 0 0 149 -3,-2.5 -2,-0.1 1,-0.2 -4,-0.0 0.920 73.2 -50.7 54.6 44.3 -20.6 -7.6 1.4 43 48 A G S S+ 0 0 27 1,-0.1 -1,-0.2 -18,-0.0 -3,-0.1 0.815 101.9 121.7 65.9 48.0 -18.3 -5.3 -0.6 44 49 A T S S- 0 0 88 -3,-0.1 -1,-0.1 0, 0.0 -2,-0.1 0.120 82.5-107.5-119.0 15.6 -17.3 -2.5 1.8 45 50 A L S S+ 0 0 15 1,-0.1 -3,-0.0 27,-0.0 3,-0.0 0.864 89.7 113.5 59.0 45.7 -13.6 -3.0 1.6 46 51 A A S S+ 0 0 19 105,-0.0 2,-0.3 26,-0.0 107,-0.2 0.088 72.1 40.6-126.4 16.2 -13.3 -4.5 5.1 47 52 A C - 0 0 3 105,-0.2 105,-0.2 106,-0.1 29,-0.1 -0.924 62.0-140.3-153.8 171.0 -12.3 -8.0 4.2 48 53 A S S > S+ 0 0 9 103,-2.7 3,-1.4 -2,-0.3 29,-0.1 0.259 72.6 104.0-119.6 12.3 -10.1 -10.0 1.7 49 54 A T T 3 S+ 0 0 10 102,-0.6 103,-0.1 1,-0.3 -1,-0.1 0.574 73.1 59.7 -73.3 -15.1 -12.5 -12.8 0.9 50 55 A C T 3 S+ 0 0 2 -12,-0.2 36,-2.7 -3,-0.1 -1,-0.3 0.276 74.0 138.9 -98.6 15.3 -13.5 -11.6 -2.5 51 56 A H E < -C 85 0A 7 -3,-1.4 2,-0.3 34,-0.2 34,-0.2 -0.311 28.8-178.9 -59.5 129.9 -9.9 -11.7 -3.7 52 57 A L E -C 84 0A 0 32,-2.7 32,-2.1 50,-0.1 2,-0.5 -0.960 24.7-135.8-132.1 152.2 -9.7 -13.0 -7.3 53 58 A I E -CD 83 101A 15 48,-2.0 48,-2.3 -2,-0.3 30,-0.2 -0.940 29.2-157.2-110.7 119.5 -6.7 -13.7 -9.6 54 59 A F - 0 0 2 28,-2.7 2,-0.2 -2,-0.5 46,-0.1 -0.615 24.3 -95.6 -99.4 159.8 -7.3 -12.4 -13.2 55 60 A E >> - 0 0 67 44,-0.4 4,-3.2 -2,-0.2 3,-0.8 -0.502 42.1-117.4 -64.4 146.1 -5.9 -13.3 -16.6 56 61 A Q H 3> S+ 0 0 93 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.894 112.2 51.9 -57.9 -43.1 -3.1 -10.8 -17.5 57 62 A H H 34 S+ 0 0 108 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.790 115.8 42.5 -68.2 -28.6 -4.8 -9.3 -20.5 58 63 A I H X4 S+ 0 0 6 -3,-0.8 3,-1.9 2,-0.1 -2,-0.2 0.936 111.9 54.5 -74.9 -51.5 -7.9 -8.7 -18.4 59 64 A F H >< S+ 0 0 56 -4,-3.2 3,-1.3 1,-0.3 -2,-0.2 0.794 100.9 58.8 -49.6 -44.9 -6.0 -7.4 -15.4 60 65 A E T 3< S+ 0 0 120 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.1 0.649 107.8 45.5 -69.5 -11.7 -4.1 -4.7 -17.3 61 66 A K T < S+ 0 0 171 -3,-1.9 -1,-0.2 -4,-0.2 -2,-0.2 0.177 85.1 119.0-114.8 13.3 -7.3 -3.0 -18.5 62 67 A L S < S- 0 0 21 -3,-1.3 3,-0.1 -4,-0.2 27,-0.1 -0.404 79.2 -81.4 -73.9 157.8 -9.1 -3.0 -15.1 63 68 A E - 0 0 83 1,-0.1 -1,-0.1 -2,-0.1 3,-0.1 -0.316 63.3 -83.4 -58.2 141.9 -10.1 0.3 -13.5 64 69 A A - 0 0 93 1,-0.1 -1,-0.1 -3,-0.1 2,-0.1 -0.198 51.6-110.1 -48.5 135.4 -7.2 2.0 -11.6 65 70 A I - 0 0 66 -3,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.404 29.8-135.6 -73.4 138.1 -7.0 0.5 -8.1 66 71 A T > - 0 0 72 -2,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.555 19.5-115.4 -87.8 161.6 -7.9 2.8 -5.3 67 72 A D H > S+ 0 0 133 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.844 115.7 57.3 -62.6 -36.6 -5.9 3.2 -2.1 68 73 A E H > S+ 0 0 121 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.953 108.9 44.2 -62.0 -45.8 -8.8 1.8 -0.1 69 74 A E H >> S+ 0 0 2 1,-0.2 4,-3.4 2,-0.2 3,-0.6 0.957 111.4 55.0 -62.8 -45.9 -8.8 -1.4 -2.1 70 75 A N H 3X S+ 0 0 63 -4,-2.5 4,-2.6 1,-0.3 -1,-0.2 0.850 103.7 53.9 -55.7 -39.2 -5.0 -1.7 -1.9 71 76 A D H 3< S+ 0 0 91 -4,-2.1 4,-0.3 2,-0.2 -1,-0.3 0.854 115.7 39.2 -65.5 -38.5 -5.0 -1.5 1.9 72 77 A M H X< S+ 0 0 1 -4,-1.3 3,-1.5 -3,-0.6 4,-0.3 0.895 114.2 54.1 -76.3 -40.2 -7.4 -4.4 2.1 73 78 A L H >< S+ 0 0 12 -4,-3.4 3,-2.4 1,-0.3 -2,-0.2 0.898 96.1 68.1 -63.5 -34.5 -5.8 -6.3 -0.8 74 79 A D T 3< S+ 0 0 92 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.739 100.2 49.9 -52.5 -31.3 -2.4 -6.0 1.0 75 80 A L T < S+ 0 0 53 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.443 85.4 116.8 -90.2 -4.2 -3.8 -8.4 3.6 76 81 A A X - 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0 0 0 -3,-1.4 -65,-1.9 -4,-0.3 2,-0.3 -0.918 61.2-163.8-106.2 120.3 -14.5 -5.2 -10.4 90 95 A C B -E 23 0B 50 -2,-0.6 -67,-0.3 -67,-0.3 -68,-0.1 -0.791 29.8 -94.8-105.5 146.6 -17.6 -4.9 -12.6 91 96 A L - 0 0 1 -69,-2.9 -70,-2.0 -72,-0.4 2,-0.3 -0.222 42.4-178.8 -62.9 135.6 -18.2 -6.9 -15.7 92 97 A T > - 0 0 61 -72,-0.2 3,-1.7 -71,-0.1 4,-0.2 -0.888 42.7-101.6-126.8 167.4 -17.2 -5.5 -19.1 93 98 A K G > S+ 0 0 186 -2,-0.3 3,-2.0 1,-0.3 -1,-0.1 0.884 118.5 61.2 -52.2 -45.6 -17.6 -6.8 -22.7 94 99 A A G 3 S+ 0 0 75 1,-0.3 -1,-0.3 -36,-0.0 -3,-0.0 0.686 94.4 65.1 -61.7 -15.4 -13.9 -7.8 -22.8 95 100 A M G X + 0 0 4 -3,-1.7 3,-2.5 2,-0.1 -1,-0.3 0.418 66.5 129.9 -88.9 -1.0 -14.5 -10.2 -19.9 96 101 A D T < S+ 0 0 68 -3,-2.0 -92,-0.2 1,-0.3 -94,-0.1 -0.390 86.0 2.6 -54.7 130.9 -16.8 -12.5 -21.8 97 102 A N T 3 S+ 0 0 100 -94,-2.1 -1,-0.3 1,-0.2 -93,-0.2 0.502 96.8 148.8 69.7 7.7 -15.5 -16.1 -21.3 98 103 A M E < -b 4 0A 4 -3,-2.5 -93,-2.5 -95,-0.6 2,-0.4 -0.242 39.5-135.7 -65.7 164.2 -12.7 -15.0 -18.9 99 104 A T E -b 5 0A 46 -95,-0.2 -44,-0.4 -93,-0.0 2,-0.3 -0.973 17.3-171.2-122.6 134.5 -11.5 -17.2 -16.1 100 105 A V E -b 6 0A 0 -95,-2.7 -93,-2.7 -2,-0.4 2,-0.4 -0.890 14.6-137.6-117.6 153.3 -10.7 -16.0 -12.6 101 106 A R E -bD 7 53A 123 -48,-2.3 -48,-2.0 -2,-0.3 -93,-0.2 -0.935 2.8-144.3-116.4 133.3 -9.0 -18.0 -9.8 102 107 A V 0 0 3 -95,-2.9 -50,-0.1 -2,-0.4 -52,-0.0 -0.833 360.0 360.0 -92.7 115.3 -10.0 -18.2 -6.2 103 108 A P 0 0 42 0, 0.0 -94,-0.2 0, 0.0 -26,-0.1 -0.381 360.0 360.0 -75.6 360.0 -6.8 -18.5 -4.2 104 !* 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 0.0 105 5 B D 0 0 77 0, 0.0 19,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 127.2 -20.9 -26.9 26.8 106 6 B K + 0 0 145 17,-1.5 2,-0.4 1,-0.1 18,-0.2 0.642 360.0 64.1-122.7 -18.7 -19.9 -25.7 30.3 107 7 B I E -F 123 0C 4 16,-2.8 16,-2.4 94,-0.1 2,-0.4 -0.891 69.6-129.9-116.3 144.2 -19.3 -21.9 30.4 108 8 B T E -F 122 0C 20 -2,-0.4 94,-2.1 14,-0.2 95,-0.6 -0.692 19.8-173.7 -87.9 135.2 -21.8 -19.1 29.8 109 9 B V E -Fg 121 203C 0 12,-2.4 12,-1.9 -2,-0.4 2,-0.5 -0.994 11.6-152.7-128.3 131.4 -21.2 -16.2 27.4 110 10 B H E -Fg 120 204C 41 93,-2.6 95,-2.9 -2,-0.4 2,-0.6 -0.918 10.6-162.9-101.4 119.8 -23.5 -13.2 27.1 111 11 B F E -Fg 119 205C 0 8,-3.1 8,-3.1 -2,-0.5 2,-0.8 -0.945 10.3-149.6-106.1 115.7 -23.4 -11.5 23.7 112 12 B I E -Fg 118 206C 47 93,-3.5 95,-2.9 -2,-0.6 6,-0.2 -0.817 26.4-147.7 -82.9 110.7 -24.8 -8.0 23.5 113 13 B N > - 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