==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 19-NOV-09 3KRX . COMPND 2 MOLECULE: BETA-ADRENERGIC RECEPTOR KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.J.G.TESMER,V.M.TESMER . 1017 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49876.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 687 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 216 21.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 11 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.5 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 . 4 0.4 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 . 62 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 97 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 271 26.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.5 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 5 1 0 2 1 2 2 1 2 3 2 1 0 0 0 2 1 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 3 2 4 6 17 3 2 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 1 8 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 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 30 A K 0 0 229 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -34.4 27.7 17.6 67.7 2 31 A K - 0 0 179 1,-0.1 2,-0.2 181,-0.1 181,-0.1 -0.697 360.0 -87.0-107.0 155.8 30.0 20.1 66.0 3 32 A I - 0 0 16 179,-0.6 2,-0.5 -2,-0.3 -1,-0.1 -0.403 38.1-167.7 -62.2 122.7 33.7 20.9 66.6 4 33 A L - 0 0 133 -2,-0.2 -1,-0.0 146,-0.0 481,-0.0 -0.974 16.3-138.3-108.7 122.8 34.2 23.6 69.2 5 34 A L - 0 0 9 -2,-0.5 142,-0.1 480,-0.1 141,-0.1 -0.439 21.3-111.5 -74.4 153.3 37.7 25.0 69.3 6 35 A P - 0 0 30 0, 0.0 -1,-0.1 0, 0.0 140,-0.1 -0.320 43.6 -84.0 -75.4 169.6 39.4 25.6 72.7 7 36 A E > - 0 0 79 1,-0.1 3,-2.3 -2,-0.1 4,-0.1 -0.360 40.5-105.3 -75.2 156.2 40.2 29.1 73.9 8 37 A P T > S+ 0 0 45 0, 0.0 3,-2.7 0, 0.0 4,-0.2 0.776 112.1 77.0 -50.3 -35.7 43.4 30.9 72.8 9 38 A S T >> S+ 0 0 31 1,-0.3 3,-1.3 2,-0.2 4,-0.5 0.682 73.2 82.7 -52.1 -20.7 45.0 30.4 76.2 10 39 A I H X> S+ 0 0 11 -3,-2.3 4,-2.9 1,-0.2 3,-0.6 0.760 73.7 77.1 -53.5 -27.4 45.6 26.8 75.1 11 40 A R H <> S+ 0 0 46 -3,-2.7 4,-3.1 1,-0.2 5,-0.4 0.885 83.2 62.0 -48.3 -46.8 48.7 28.2 73.3 12 41 A S H <> S+ 0 0 22 -3,-1.3 4,-0.7 1,-0.2 -1,-0.2 0.872 115.0 32.1 -53.4 -42.8 50.6 28.4 76.6 13 42 A V H <>S+ 0 0 2 -4,-3.0 5,-1.9 2,-0.2 3,-1.0 0.922 110.9 55.9 -72.9 -45.8 55.3 21.4 70.4 19 48 A E H ><5S+ 0 0 113 -4,-3.5 3,-1.2 1,-0.3 -1,-0.2 0.880 105.3 54.6 -51.7 -41.8 58.6 23.1 71.2 20 49 A D H 3<5S+ 0 0 78 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.774 113.3 41.5 -64.2 -28.2 59.6 20.0 73.2 21 50 A R T <<5S- 0 0 102 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.249 111.4-119.7-102.8 9.4 59.0 17.8 70.0 22 51 A G T < 5S+ 0 0 37 -3,-1.2 -3,-0.2 -4,-0.4 6,-0.1 0.679 73.6 131.4 61.6 21.5 60.6 20.4 67.6 23 52 A E < + 0 0 49 -5,-1.9 2,-0.6 1,-0.2 -4,-0.2 0.360 47.4 84.8 -87.8 4.9 57.3 20.8 65.7 24 53 A V + 0 0 17 -6,-0.4 2,-0.3 -5,-0.1 -1,-0.2 -0.518 66.1 113.9-101.8 60.2 57.5 24.6 65.8 25 54 A T S >> S- 0 0 48 -2,-0.6 4,-2.5 1,-0.1 3,-0.5 -0.943 76.1-118.7-124.8 152.2 59.7 24.9 62.7 26 55 A F H 3> S+ 0 0 10 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.943 115.9 49.8 -49.4 -53.3 58.9 26.4 59.4 27 56 A E H 3> S+ 0 0 112 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.750 112.6 47.9 -63.2 -26.7 59.4 23.1 57.6 28 57 A K H <4 S+ 0 0 89 -3,-0.5 -1,-0.2 2,-0.1 -2,-0.2 0.885 120.4 33.9 -81.4 -42.5 57.2 21.2 60.1 29 58 A I H >< S+ 0 0 2 -4,-2.5 3,-1.8 1,-0.1 7,-0.3 0.911 114.7 56.6 -78.0 -45.2 54.2 23.6 60.1 30 59 A F H 3< S+ 0 0 28 -4,-3.0 -3,-0.2 -5,-0.3 6,-0.1 0.847 101.1 58.1 -57.8 -38.6 54.4 24.7 56.4 31 60 A S T 3< S+ 0 0 90 -4,-0.7 2,-0.4 -5,-0.3 -1,-0.3 0.152 92.8 87.5 -81.7 19.6 54.2 21.1 55.2 32 61 A Q S <> S- 0 0 27 -3,-1.8 4,-3.9 1,-0.1 5,-0.2 -0.977 76.9-134.9-120.0 139.3 50.8 20.7 57.0 33 62 A K H > S+ 0 0 99 -2,-0.4 4,-2.7 1,-0.2 5,-0.2 0.921 107.1 37.8 -57.6 -53.4 47.5 21.6 55.3 34 63 A L H > S+ 0 0 2 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.848 118.8 50.7 -67.8 -35.0 46.0 23.4 58.3 35 64 A G H > S+ 0 0 0 -6,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.913 112.8 46.5 -66.6 -42.9 49.5 24.9 59.2 36 65 A Y H X S+ 0 0 36 -4,-3.9 4,-3.1 -7,-0.3 5,-0.3 0.935 110.8 51.1 -64.5 -49.5 49.9 26.1 55.6 37 66 A L H X S+ 0 0 40 -4,-2.7 4,-1.7 -5,-0.2 -1,-0.2 0.903 113.3 44.5 -56.8 -45.6 46.4 27.6 55.3 38 67 A L H X S+ 0 0 3 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.883 113.7 52.2 -67.0 -39.1 46.8 29.6 58.6 39 68 A F H X S+ 0 0 3 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.940 110.2 46.3 -60.2 -51.0 50.3 30.7 57.5 40 69 A R H X S+ 0 0 66 -4,-3.1 4,-2.5 2,-0.2 5,-0.3 0.820 107.6 57.8 -66.1 -31.8 49.2 31.9 54.1 41 70 A D H X>S+ 0 0 50 -4,-1.7 4,-3.0 -5,-0.3 5,-0.5 0.973 110.3 45.0 -55.8 -53.3 46.3 33.8 55.7 42 71 A F H X5S+ 0 0 14 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.890 114.7 46.5 -58.3 -47.0 48.8 35.6 57.9 43 72 A C H X5S+ 0 0 0 -4,-2.3 4,-0.5 2,-0.2 8,-0.4 0.906 120.3 37.8 -66.0 -43.5 51.2 36.4 55.0 44 73 A L H <5S+ 0 0 27 -4,-2.5 -2,-0.2 -5,-0.2 3,-0.2 0.953 130.2 26.6 -72.6 -50.8 48.5 37.6 52.6 45 74 A N H <5S+ 0 0 94 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.761 130.5 30.7 -88.9 -28.2 46.2 39.5 55.0 46 75 A H H <X - 0 0 29 -4,-0.5 3,-1.4 -3,-0.2 4,-1.1 -0.463 52.8-167.6-167.7 92.3 52.0 41.2 56.5 48 77 A E T 34 S+ 0 0 115 1,-0.3 -1,-0.1 2,-0.2 -5,-0.0 0.745 88.0 63.1 -54.0 -29.7 52.6 43.1 53.3 49 78 A E T 34 S+ 0 0 93 1,-0.2 4,-0.4 2,-0.1 -1,-0.3 0.855 109.1 39.5 -64.8 -36.6 56.3 42.0 53.1 50 79 A A T <> S+ 0 0 0 -3,-1.4 4,-2.2 -7,-0.3 5,-0.3 0.673 95.5 86.8 -84.1 -19.4 55.3 38.3 52.8 51 80 A R H X S+ 0 0 62 -4,-1.1 4,-3.1 -8,-0.4 5,-0.3 0.909 90.0 41.9 -54.8 -58.5 52.3 38.8 50.4 52 81 A P H > S+ 0 0 15 0, 0.0 4,-3.0 0, 0.0 -1,-0.2 0.884 113.1 56.0 -57.8 -37.7 54.1 38.8 47.0 53 82 A L H > S+ 0 0 6 -4,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.915 114.4 37.3 -61.1 -47.1 56.3 35.9 48.1 54 83 A V H X S+ 0 0 3 -4,-2.2 4,-3.3 2,-0.2 5,-0.3 0.936 115.6 53.7 -69.0 -48.4 53.3 33.6 49.0 55 84 A E H X S+ 0 0 49 -4,-3.1 4,-1.5 -5,-0.3 -2,-0.2 0.912 112.6 45.9 -49.2 -45.1 51.2 34.9 46.1 56 85 A F H X S+ 0 0 0 -4,-3.0 4,-1.9 -5,-0.3 -1,-0.2 0.860 110.9 52.0 -69.0 -38.4 54.2 34.0 43.9 57 86 A Y H X S+ 0 0 27 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.956 110.9 47.5 -59.6 -51.1 54.6 30.6 45.5 58 87 A E H X S+ 0 0 47 -4,-3.3 4,-1.3 1,-0.2 -2,-0.2 0.796 109.2 54.3 -63.6 -30.5 50.9 29.8 45.0 59 88 A E H X S+ 0 0 51 -4,-1.5 4,-1.1 -5,-0.3 -1,-0.2 0.890 107.0 50.8 -69.8 -39.9 51.1 30.9 41.4 60 89 A I H X S+ 0 0 0 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.829 105.9 56.8 -64.9 -33.5 54.0 28.5 40.8 61 90 A K H X S+ 0 0 68 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.865 103.7 51.7 -68.0 -37.2 52.0 25.6 42.3 62 91 A K H < S+ 0 0 101 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.802 107.3 54.7 -67.3 -30.8 49.2 26.1 39.8 63 92 A Y H >< S+ 0 0 0 -4,-1.1 3,-1.3 1,-0.2 -2,-0.2 0.861 103.1 55.2 -69.2 -39.1 51.7 26.0 37.0 64 93 A E H 3< S+ 0 0 58 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.908 103.4 57.0 -56.4 -42.2 53.0 22.6 38.3 65 94 A K T 3< S+ 0 0 161 -4,-1.4 -1,-0.2 48,-0.1 -2,-0.2 0.413 78.7 120.9 -75.8 0.3 49.4 21.2 38.1 66 95 A L < - 0 0 23 -3,-1.3 -3,-0.0 1,-0.1 6,-0.0 -0.445 58.8-140.9 -67.3 141.0 49.1 22.1 34.3 67 96 A E + 0 0 78 -2,-0.1 2,-0.2 1,-0.0 -1,-0.1 0.974 66.8 20.9 -68.5 -60.3 48.4 19.0 32.2 68 97 A T S > S- 0 0 50 1,-0.0 4,-1.5 0, 0.0 3,-0.4 -0.640 74.3-105.4-123.3 167.5 50.4 19.4 29.0 69 98 A E H > S+ 0 0 143 1,-0.2 4,-1.8 -2,-0.2 5,-0.1 0.745 113.9 54.1 -61.6 -31.1 53.4 21.1 27.4 70 99 A E H > S+ 0 0 172 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.839 107.2 49.9 -79.4 -32.7 51.4 23.6 25.3 71 100 A E H > S+ 0 0 83 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.856 110.7 53.3 -66.8 -36.2 49.5 24.9 28.3 72 101 A R H X S+ 0 0 41 -4,-1.5 4,-3.8 2,-0.2 -2,-0.2 0.930 101.1 54.9 -66.1 -51.4 52.8 25.3 30.2 73 102 A V H X S+ 0 0 67 -4,-1.8 4,-1.5 2,-0.2 5,-0.3 0.866 110.9 50.6 -52.7 -38.0 54.6 27.5 27.6 74 103 A A H X S+ 0 0 55 -4,-1.0 4,-2.0 1,-0.2 -2,-0.2 0.992 116.8 36.5 -58.7 -64.7 51.6 29.8 27.8 75 104 A R H X S+ 0 0 80 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.781 110.6 65.6 -62.4 -30.7 51.6 30.1 31.7 76 105 A S H X S+ 0 0 0 -4,-3.8 4,-1.8 2,-0.2 3,-0.4 0.979 111.5 30.6 -56.1 -64.4 55.5 30.0 31.8 77 106 A R H X S+ 0 0 189 -4,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.864 115.7 63.0 -63.2 -37.5 56.1 33.3 30.0 78 107 A E H X S+ 0 0 129 -4,-2.0 4,-1.0 -5,-0.3 -1,-0.2 0.858 106.6 44.7 -54.2 -39.1 52.8 34.6 31.4 79 108 A I H <>S+ 0 0 7 -4,-2.2 5,-0.9 -3,-0.4 4,-0.4 0.934 111.2 50.1 -72.9 -48.7 54.3 34.2 34.9 80 109 A F H <5S+ 0 0 43 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.737 106.8 58.3 -64.3 -24.1 57.7 35.8 34.2 81 110 A D H <5S+ 0 0 114 -4,-1.8 4,-0.2 -5,-0.2 -1,-0.2 0.908 115.2 28.4 -71.0 -42.6 56.0 38.8 32.6 82 111 A S T >X5S+ 0 0 70 -4,-1.0 3,-1.2 -3,-0.4 4,-0.6 0.952 125.8 22.4 -88.1 -87.9 53.9 39.9 35.6 83 112 A Y H >>5S+ 0 0 57 -4,-0.4 4,-2.0 1,-0.2 3,-0.7 0.761 115.0 65.8 -57.0 -32.2 55.1 39.2 39.3 84 113 A I H 3> - 0 0 40 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.440 19.7-129.6 -77.4 149.5 70.0 35.3 43.0 96 126 A K H > S+ 0 0 188 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.924 111.4 56.3 -59.2 -45.1 71.8 35.5 39.7 97 127 A S H > S+ 0 0 91 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.834 109.3 46.0 -54.4 -37.9 72.6 31.8 40.0 98 128 A A H > S+ 0 0 7 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.883 112.8 47.1 -76.9 -42.2 68.8 31.0 40.3 99 129 A T H X S+ 0 0 25 -4,-2.1 4,-3.2 1,-0.2 5,-0.4 0.853 103.4 65.9 -66.7 -36.0 67.7 33.3 37.4 100 130 A E H X S+ 0 0 147 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.905 106.1 40.7 -50.1 -49.9 70.4 31.8 35.2 101 131 A H H X S+ 0 0 86 -4,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.925 117.2 47.2 -69.1 -47.0 68.8 28.3 35.2 102 132 A V H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.930 115.7 44.1 -61.3 -48.1 65.2 29.5 34.9 103 133 A Q H X S+ 0 0 108 -4,-3.2 4,-2.2 1,-0.2 -1,-0.2 0.770 107.7 61.7 -70.1 -26.3 66.0 32.0 32.0 104 134 A G H X S+ 0 0 36 -4,-1.4 4,-0.7 -5,-0.4 -1,-0.2 0.924 109.6 39.3 -63.4 -47.4 68.2 29.3 30.4 105 135 A H H ><>S+ 0 0 40 -4,-1.8 5,-1.6 1,-0.2 3,-0.9 0.927 114.6 54.2 -65.6 -47.4 65.2 26.9 30.0 106 136 A L H ><5S+ 0 0 39 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.868 101.9 58.0 -56.1 -42.1 62.8 29.8 29.0 107 137 A G H 3<5S+ 0 0 66 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.797 108.2 46.7 -58.9 -30.9 65.1 31.0 26.2 108 138 A K T <<5S- 0 0 155 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.358 111.6-119.2 -93.5 2.4 64.9 27.6 24.6 109 139 A K T < 5 + 0 0 171 -3,-1.5 2,-0.5 -4,-0.3 -3,-0.2 0.672 67.3 140.1 64.7 20.2 61.0 27.3 24.9 110 140 A Q < - 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