==== 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 BIOSYNTHETIC PROTEIN 08-MAR-09 3GJB . COMPND 2 MOLECULE: CYTC3; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES SP.; . AUTHOR C.WONG,C.L.DRENNAN . 531 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22000.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 340 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 130 24.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 . 47 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 1 1 0 2 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 . 10 9 4 2 2 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 5 0 0 0 1 1 1 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 8 A A 0 0 121 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 121.5 12.8 -9.6 -16.8 2 9 A N + 0 0 95 2,-0.1 76,-0.1 1,-0.0 261,-0.0 -0.970 360.0 178.3-150.1 129.0 10.1 -11.9 -18.1 3 10 A F + 0 0 63 -2,-0.3 82,-0.1 74,-0.2 -1,-0.0 0.079 32.7 139.8-120.9 26.1 8.4 -12.0 -21.5 4 11 A T - 0 0 58 1,-0.1 78,-0.2 259,-0.1 2,-0.1 -0.313 57.4-103.0 -65.6 152.4 6.0 -14.9 -21.1 5 12 A F - 0 0 16 76,-0.5 -1,-0.1 77,-0.3 -2,-0.0 -0.448 29.6-116.0 -79.0 153.4 2.6 -14.4 -22.7 6 13 A S > - 0 0 41 -2,-0.1 4,-2.8 1,-0.1 5,-0.2 -0.352 32.0-105.8 -78.6 164.7 -0.5 -13.6 -20.7 7 14 A P H > S+ 0 0 117 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.848 123.9 52.6 -61.4 -30.4 -3.4 -16.1 -20.7 8 15 A E H > S+ 0 0 141 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.976 110.1 44.2 -66.3 -58.3 -5.1 -13.7 -23.0 9 16 A E H > S+ 0 0 61 1,-0.3 4,-1.7 2,-0.2 5,-0.2 0.920 113.3 51.6 -53.1 -48.5 -2.3 -13.4 -25.5 10 17 A V H X S+ 0 0 30 -4,-2.8 4,-2.1 1,-0.2 -1,-0.3 0.870 107.9 55.3 -57.1 -37.4 -1.8 -17.2 -25.4 11 18 A A H X S+ 0 0 38 -4,-1.5 4,-1.5 -5,-0.2 -1,-0.2 0.910 107.1 46.3 -63.7 -46.4 -5.6 -17.5 -26.1 12 19 A R H X S+ 0 0 83 -4,-2.1 4,-2.5 2,-0.2 6,-0.4 0.773 109.4 55.4 -71.4 -23.6 -5.6 -15.5 -29.2 13 20 A F H X S+ 0 0 7 -4,-1.7 4,-3.2 -5,-0.2 5,-0.3 0.931 106.9 50.5 -70.6 -42.7 -2.5 -17.3 -30.5 14 21 A E H < S+ 0 0 149 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.843 114.4 46.7 -60.2 -31.9 -4.5 -20.5 -30.0 15 22 A R H < S+ 0 0 135 -4,-1.5 -2,-0.2 -5,-0.1 -1,-0.2 0.878 125.5 24.9 -78.4 -39.9 -7.3 -18.9 -32.0 16 23 A D H < S- 0 0 23 -4,-2.5 142,-0.2 2,-0.3 -2,-0.2 0.736 92.2-124.5 -99.8 -26.6 -5.3 -17.5 -34.9 17 24 A G S < S+ 0 0 13 -4,-3.2 164,-1.8 -5,-0.3 2,-0.3 0.556 88.0 55.2 90.0 7.2 -2.2 -19.6 -35.2 18 25 A Y E -A 180 0A 21 -6,-0.4 2,-0.3 -5,-0.3 -2,-0.3 -0.982 58.9-161.4-162.8 165.3 -0.1 -16.5 -34.9 19 26 A I E -A 179 0A 8 160,-2.5 160,-3.2 -2,-0.3 3,-0.1 -0.933 29.7-155.9-156.2 127.9 0.6 -13.5 -32.7 20 27 A G E + 0 0 24 -2,-0.3 158,-0.2 1,-0.3 2,-0.1 -0.919 46.9 28.2 177.2 162.8 2.3 -10.3 -33.7 21 28 A P E + 0 0 68 0, 0.0 2,-0.4 0, 0.0 -1,-0.3 0.520 62.3 167.1 -78.0 150.3 3.8 -7.7 -33.8 22 29 A V E -A 177 0A 12 155,-2.2 155,-2.3 -3,-0.1 2,-0.4 -0.997 35.8-119.7-128.7 133.8 5.9 -8.5 -30.7 23 30 A K E +A 176 0A 95 -2,-0.4 153,-0.2 153,-0.2 3,-0.1 -0.616 39.7 160.0 -78.9 126.6 8.9 -6.3 -29.9 24 31 A I S S+ 0 0 3 151,-2.7 2,-0.3 1,-0.5 152,-0.2 0.726 73.2 0.5-107.1 -45.4 12.2 -8.1 -29.7 25 32 A F S S- 0 0 13 150,-1.8 -1,-0.5 53,-0.1 0, 0.0 -0.939 81.3 -97.1-140.1 161.1 14.5 -5.1 -30.2 26 33 A E > - 0 0 94 -2,-0.3 4,-2.8 -3,-0.1 3,-0.4 -0.519 45.3-109.0 -75.0 151.1 14.1 -1.4 -30.6 27 34 A P H > S+ 0 0 37 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.861 118.3 49.0 -49.1 -43.3 14.2 -0.4 -34.3 28 35 A E H > S+ 0 0 128 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.872 112.8 48.0 -68.3 -36.1 17.6 1.3 -34.0 29 36 A E H > S+ 0 0 57 -3,-0.4 4,-2.8 2,-0.2 5,-0.2 0.947 110.8 49.8 -68.5 -49.4 19.1 -1.6 -32.2 30 37 A M H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.932 113.8 46.7 -53.9 -47.8 17.7 -4.2 -34.7 31 38 A T H X S+ 0 0 56 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.909 109.8 53.0 -61.6 -43.9 19.1 -2.0 -37.5 32 39 A R H X S+ 0 0 113 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.932 113.7 43.8 -57.6 -46.0 22.5 -1.7 -35.7 33 40 A R H X S+ 0 0 11 -4,-2.8 4,-3.1 1,-0.2 3,-0.5 0.912 111.7 51.8 -65.1 -45.9 22.7 -5.5 -35.4 34 41 A W H X S+ 0 0 10 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.785 102.8 61.1 -63.0 -28.0 21.5 -6.2 -38.9 35 42 A N H X S+ 0 0 91 -4,-2.0 4,-0.8 -5,-0.2 -1,-0.2 0.893 112.6 37.2 -66.1 -37.9 24.2 -3.8 -40.1 36 43 A I H >X S+ 0 0 42 -4,-1.1 4,-2.2 -3,-0.5 3,-0.6 0.962 117.6 49.8 -74.6 -55.5 26.8 -6.1 -38.6 37 44 A I H 3X S+ 0 0 1 -4,-3.1 4,-2.9 1,-0.2 5,-0.2 0.874 103.4 60.2 -50.1 -47.8 25.1 -9.3 -39.4 38 45 A R H 3X S+ 0 0 137 -4,-2.5 4,-0.6 1,-0.2 -1,-0.2 0.894 111.2 40.8 -50.3 -45.8 24.6 -8.4 -43.0 39 46 A R H X< S+ 0 0 144 -4,-0.8 3,-0.6 -3,-0.6 4,-0.4 0.872 114.1 52.3 -72.1 -38.9 28.4 -8.1 -43.4 40 47 A Q H >< S+ 0 0 70 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.831 95.6 67.9 -68.0 -32.3 29.2 -11.2 -41.4 41 48 A L H 3< S+ 0 0 18 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.876 92.1 65.4 -53.0 -36.7 26.8 -13.3 -43.4 42 49 A L T << S+ 0 0 128 -4,-0.6 2,-0.7 -3,-0.6 -1,-0.3 0.804 88.5 71.9 -57.6 -34.7 29.4 -12.8 -46.2 43 50 A D < + 0 0 74 -3,-1.4 3,-0.3 -4,-0.4 -1,-0.1 -0.777 53.0 170.4 -89.9 112.9 32.1 -14.7 -44.4 44 51 A R > + 0 0 60 -2,-0.7 3,-1.9 1,-0.2 -1,-0.1 0.248 38.8 118.9-105.3 12.7 31.3 -18.4 -44.4 45 52 A S T 3 S+ 0 0 86 1,-0.3 -1,-0.2 3,-0.0 -2,-0.0 0.782 91.6 25.2 -48.8 -32.3 34.7 -19.6 -43.0 46 53 A L T 3 S+ 0 0 64 -3,-0.3 -1,-0.3 20,-0.0 207,-0.2 0.192 88.4 129.0-119.6 15.4 32.9 -21.1 -40.0 47 54 A A < - 0 0 10 -3,-1.9 16,-0.1 1,-0.1 15,-0.1 -0.488 60.6-133.3 -69.2 140.8 29.4 -21.7 -41.4 48 55 A I S S+ 0 0 6 14,-0.3 183,-0.4 -2,-0.1 -1,-0.1 0.774 87.2 71.1 -69.4 -22.6 28.4 -25.3 -40.7 49 56 A Y S S- 0 0 5 12,-0.2 -2,-0.1 7,-0.1 3,-0.1 -0.816 82.3-127.3-100.1 133.5 27.1 -25.8 -44.3 50 57 A P - 0 0 72 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.082 41.5 -74.0 -67.2 168.2 29.6 -26.0 -47.2 51 58 A D S S+ 0 0 144 2,-0.1 2,-0.3 6,-0.0 175,-0.1 -0.495 76.3 127.9 -68.2 128.0 29.6 -24.0 -50.4 52 59 A S - 0 0 36 -2,-0.3 -3,-0.0 2,-0.2 0, 0.0 -0.912 66.9-110.6-161.9-175.8 26.8 -25.2 -52.7 53 60 A N S S+ 0 0 149 -2,-0.3 -2,-0.1 4,-0.1 173,-0.0 0.270 75.6 119.4-111.3 7.0 23.8 -24.0 -54.6 54 61 A G S >> S- 0 0 17 1,-0.1 4,-2.2 4,-0.0 3,-1.6 -0.333 79.9-111.0 -69.2 156.9 21.3 -25.6 -52.3 55 62 A K H 3> S+ 0 0 48 1,-0.3 4,-2.9 2,-0.2 6,-0.2 0.785 114.6 70.2 -62.7 -24.6 18.9 -23.3 -50.5 56 63 A A H 34>S+ 0 0 0 169,-2.7 5,-3.1 2,-0.2 -1,-0.3 0.828 111.9 32.3 -59.5 -30.1 20.6 -24.1 -47.2 57 64 A N H X45S+ 0 0 18 -3,-1.6 3,-1.5 168,-0.3 -2,-0.2 0.904 120.4 48.5 -89.3 -53.5 23.5 -22.0 -48.6 58 65 A I H 3<5S+ 0 0 110 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.2 0.796 120.4 37.6 -59.0 -36.0 21.6 -19.5 -50.7 59 66 A S T 3<5S- 0 0 40 -4,-2.9 39,-2.1 -5,-0.2 -1,-0.3 0.177 112.7-120.6-102.5 15.2 19.2 -18.6 -48.0 60 67 A N T X 5 - 0 0 30 -3,-1.5 3,-0.7 37,-0.2 -3,-0.2 0.927 34.2-159.3 43.8 69.2 21.8 -18.9 -45.3 61 68 A Y T 3 < - 0 0 6 -5,-3.1 36,-0.2 1,-0.2 -12,-0.2 -0.484 63.1 -0.4 -76.8 146.3 20.4 -21.6 -43.1 62 69 A D T > + 0 0 0 34,-3.0 3,-1.2 -2,-0.2 -14,-0.3 0.743 69.1 149.2 46.0 44.7 21.5 -21.9 -39.5 63 70 A R G X> + 0 0 2 -3,-0.7 4,-3.2 1,-0.3 3,-1.8 0.556 59.9 83.1 -78.7 -5.4 24.0 -19.0 -39.3 64 71 A H G 34 S+ 0 0 0 1,-0.3 -1,-0.3 6,-0.2 -2,-0.1 0.569 81.7 66.3 -71.0 -7.4 23.1 -18.7 -35.7 65 72 A L G <4 S+ 0 0 3 -3,-1.2 188,-3.6 187,-0.1 -1,-0.3 0.455 119.7 15.1 -91.8 -2.5 25.6 -21.5 -35.3 66 73 A D T <4 S+ 0 0 0 -3,-1.8 2,-0.6 186,-0.2 -2,-0.2 0.516 108.5 78.0-141.2 -21.4 28.5 -19.3 -36.3 67 74 A I >X - 0 0 2 -4,-3.2 4,-2.6 1,-0.2 3,-0.8 -0.854 66.6-147.8 -97.2 120.9 27.4 -15.6 -36.2 68 75 A D H 3> S+ 0 0 72 -2,-0.6 4,-2.3 1,-0.3 5,-0.2 0.856 96.4 51.4 -52.5 -45.0 27.4 -14.3 -32.6 69 76 A L H 3> S+ 0 0 22 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.780 113.3 45.1 -67.1 -27.3 24.6 -11.9 -33.1 70 77 A L H <> S+ 0 0 0 -3,-0.8 4,-2.0 -7,-0.2 -6,-0.2 0.847 110.2 55.0 -82.7 -34.3 22.4 -14.6 -34.6 71 78 A A H X S+ 0 0 0 -4,-2.6 4,-0.5 -8,-0.2 -2,-0.2 0.893 112.7 43.3 -61.8 -40.7 23.4 -17.0 -31.8 72 79 A E H >X S+ 0 0 45 -4,-2.3 4,-1.0 -5,-0.2 3,-0.8 0.875 106.9 61.9 -72.2 -38.5 22.3 -14.4 -29.3 73 80 A H H >< S+ 0 0 0 -4,-1.5 3,-1.1 1,-0.3 -2,-0.2 0.928 103.8 46.7 -53.6 -50.7 19.1 -13.7 -31.3 74 81 A I H 3< S+ 0 0 0 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.685 113.0 52.2 -69.0 -15.0 17.7 -17.2 -31.0 75 82 A M H << S+ 0 0 21 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.567 80.8 130.6 -93.5 -13.6 18.5 -17.2 -27.3 76 83 A R XX - 0 0 61 -3,-1.1 4,-3.3 -4,-1.0 3,-1.0 -0.120 58.0-140.5 -49.5 130.3 16.7 -13.9 -26.6 77 84 A P H 3>>S+ 0 0 31 0, 0.0 4,-2.4 0, 0.0 5,-0.5 0.832 103.2 62.4 -58.8 -36.0 14.3 -13.9 -23.6 78 85 A E H 345S+ 0 0 24 2,-0.2 4,-0.2 -54,-0.2 -2,-0.1 0.803 116.5 31.1 -62.3 -28.6 11.9 -11.7 -25.7 79 86 A I H <>5S+ 0 0 0 -3,-1.0 4,-2.8 -6,-0.2 3,-0.4 0.912 123.2 45.4 -90.5 -59.8 11.7 -14.7 -28.1 80 87 A V H X5S+ 0 0 0 -4,-3.3 4,-3.1 1,-0.2 5,-0.2 0.857 109.9 51.5 -52.6 -49.7 12.2 -17.6 -25.8 81 88 A D H X5S+ 0 0 0 -4,-2.4 4,-1.1 -5,-0.2 -76,-0.5 0.881 115.1 45.9 -59.8 -35.2 9.9 -16.6 -22.9 82 89 A R H >X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 3,-1.3 0.913 112.1 56.4 -60.4 -40.4 7.7 -19.3 -27.5 84 91 A G H 3X S+ 0 0 12 -4,-3.1 4,-1.5 1,-0.3 -1,-0.2 0.806 100.1 57.6 -61.0 -31.5 8.0 -21.1 -24.1 85 92 A S H 3< S+ 0 0 36 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.732 113.5 42.8 -70.0 -21.0 4.6 -19.8 -23.1 86 93 A L H << S+ 0 0 32 -3,-1.3 -2,-0.2 -4,-0.8 -1,-0.1 0.912 133.7 7.1 -93.1 -51.3 3.3 -21.6 -26.2 87 94 A I H < S- 0 0 27 -4,-2.6 -3,-0.2 1,-0.4 -2,-0.2 0.192 114.8 -75.8-122.5 22.3 5.0 -25.0 -26.4 88 95 A G < - 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