==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/SIGNALING PROTEIN 01-DEC-10 3PSC . COMPND 2 MOLECULE: BETA-ADRENERGIC RECEPTOR KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR D.M.THAL,J.J.TESMER . 1014 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48889.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 700 69.0 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 . 218 21.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 1.0 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 . 3 0.3 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 . 56 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 271 26.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.0 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 3 4 0 1 2 2 2 1 1 1 3 3 1 0 1 0 1 1 1 0 0 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 . 1 3 1 5 19 3 3 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 8 0 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 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 29 A S 0 0 156 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 176.2 26.6 17.8 69.9 2 30 A K + 0 0 156 181,-0.1 2,-0.2 2,-0.1 0, 0.0 0.089 360.0 107.4-110.9 20.5 28.6 15.8 67.3 3 31 A K S S- 0 0 123 1,-0.1 2,-0.3 182,-0.0 181,-0.1 -0.593 77.2 -97.2-104.3 157.1 30.4 18.9 65.8 4 32 A I - 0 0 10 180,-0.6 2,-0.4 -2,-0.2 -1,-0.1 -0.589 38.4-175.6 -74.0 130.6 34.0 20.1 66.1 5 33 A L - 0 0 144 -2,-0.3 477,-0.0 481,-0.0 0, 0.0 -0.997 18.3-134.9-128.2 126.2 34.6 22.8 68.8 6 34 A L - 0 0 16 -2,-0.4 143,-0.1 476,-0.1 142,-0.1 -0.488 21.7-111.9 -80.5 148.3 38.0 24.4 69.2 7 35 A P - 0 0 32 0, 0.0 -1,-0.1 0, 0.0 141,-0.1 -0.305 46.2 -85.9 -70.1 163.2 39.7 24.9 72.5 8 36 A E > - 0 0 78 1,-0.1 3,-2.5 2,-0.0 4,-0.2 -0.293 41.2-104.0 -70.6 157.1 40.1 28.5 73.8 9 37 A P G > S+ 0 0 48 0, 0.0 3,-2.0 0, 0.0 4,-0.2 0.725 114.2 75.3 -56.5 -23.9 43.2 30.4 72.7 10 38 A S G > S+ 0 0 32 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.620 73.5 82.4 -62.6 -15.5 44.8 29.9 76.2 11 39 A I G X> S+ 0 0 11 -3,-2.5 4,-2.6 1,-0.2 3,-0.6 0.662 73.9 79.0 -59.5 -16.0 45.5 26.4 75.1 12 40 A R H <> S+ 0 0 44 -3,-2.0 4,-3.7 1,-0.2 5,-0.4 0.913 80.7 62.1 -58.4 -46.7 48.5 27.9 73.3 13 41 A S H <> S+ 0 0 22 -3,-0.9 4,-0.5 1,-0.2 -1,-0.2 0.808 115.2 33.3 -50.8 -34.1 50.5 28.1 76.6 14 42 A V H <> S+ 0 0 1 -3,-0.6 4,-1.8 -4,-0.4 -2,-0.2 0.899 120.4 46.3 -92.1 -50.0 50.4 24.3 76.8 15 43 A M H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 5,-0.3 0.893 106.6 59.2 -60.4 -41.5 50.4 23.2 73.2 16 44 A Q H X S+ 0 0 42 -4,-3.7 4,-2.1 -5,-0.3 -1,-0.2 0.919 110.7 42.7 -57.5 -40.0 53.3 25.6 72.3 17 45 A K H X S+ 0 0 70 -4,-0.5 4,-1.9 -5,-0.4 -1,-0.2 0.835 110.7 56.6 -73.5 -33.8 55.5 23.8 74.9 18 46 A Y H X S+ 0 0 26 -4,-1.8 4,-0.5 2,-0.2 -2,-0.2 0.891 112.3 41.3 -61.4 -43.4 54.2 20.4 73.8 19 47 A L H ><>S+ 0 0 0 -4,-2.4 5,-2.8 2,-0.2 3,-0.8 0.864 111.1 55.1 -76.2 -39.4 55.3 21.0 70.3 20 48 A E H ><5S+ 0 0 103 -4,-2.1 3,-1.5 -5,-0.3 -2,-0.2 0.897 103.5 57.3 -61.1 -38.0 58.6 22.6 71.2 21 49 A D H 3<5S+ 0 0 71 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.765 112.0 41.5 -60.0 -29.0 59.5 19.5 73.2 22 50 A R T <<5S- 0 0 116 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.193 114.4-114.6-104.9 11.5 59.0 17.5 70.1 23 51 A G T < 5S+ 0 0 42 -3,-1.5 -3,-0.2 -4,-0.1 6,-0.2 0.750 77.6 129.7 60.8 28.3 60.8 19.9 67.8 24 52 A E < + 0 0 42 -5,-2.8 2,-0.9 1,-0.2 -4,-0.2 0.344 43.6 86.4 -94.5 4.0 57.6 20.5 65.9 25 53 A V + 0 0 25 -6,-0.4 2,-0.3 -5,-0.1 -1,-0.2 -0.569 66.8 109.9-103.7 69.3 57.7 24.4 66.0 26 54 A T S > S- 0 0 52 -2,-0.9 4,-2.3 1,-0.1 5,-0.3 -0.963 78.5-113.6-140.2 151.9 59.8 24.9 62.9 27 55 A F H > S+ 0 0 11 -2,-0.3 4,-3.2 103,-0.3 5,-0.3 0.951 114.7 50.2 -52.6 -57.5 59.1 26.3 59.5 28 56 A E H > S+ 0 0 150 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.923 113.4 45.0 -43.0 -58.2 59.6 22.9 57.7 29 57 A K H 4 S+ 0 0 104 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.852 121.2 37.1 -64.5 -38.9 57.3 20.9 60.1 30 58 A I H >< S+ 0 0 1 -4,-2.3 3,-1.7 1,-0.2 7,-0.3 0.940 115.0 52.9 -79.3 -46.4 54.4 23.5 60.1 31 59 A F H 3< S+ 0 0 21 -4,-3.2 -2,-0.2 -5,-0.3 -3,-0.2 0.752 106.5 54.7 -59.6 -28.6 54.7 24.6 56.5 32 60 A S T 3< S+ 0 0 96 -4,-1.7 2,-0.4 -5,-0.3 -1,-0.3 0.370 90.5 86.3 -93.8 4.3 54.4 21.0 55.2 33 61 A Q S <> S- 0 0 24 -3,-1.7 4,-2.8 1,-0.1 5,-0.2 -0.875 81.9-129.4 -97.3 142.3 51.2 20.2 57.1 34 62 A K H > S+ 0 0 83 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 0.923 107.8 41.0 -57.2 -50.5 48.0 21.1 55.2 35 63 A L H > S+ 0 0 2 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.779 114.3 54.0 -71.7 -26.7 46.4 23.1 58.1 36 64 A G H > S+ 0 0 0 -6,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.893 109.9 47.1 -71.2 -42.2 49.8 24.7 59.0 37 65 A Y H X S+ 0 0 42 -4,-2.8 4,-2.9 -7,-0.3 5,-0.3 0.973 111.2 50.4 -59.3 -56.2 50.2 25.9 55.5 38 66 A L H X S+ 0 0 42 -4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.847 115.3 43.4 -54.3 -38.9 46.7 27.3 55.2 39 67 A L H X S+ 0 0 7 -4,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.890 112.7 53.4 -73.5 -38.4 47.2 29.2 58.5 40 68 A F H X S+ 0 0 2 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.881 108.7 48.5 -63.7 -40.2 50.7 30.3 57.5 41 69 A R H X S+ 0 0 65 -4,-2.9 4,-3.4 2,-0.2 5,-0.2 0.870 106.6 55.6 -70.0 -38.6 49.5 31.8 54.2 42 70 A D H X S+ 0 0 49 -4,-1.3 4,-1.5 -5,-0.3 5,-0.5 0.906 108.7 48.7 -59.7 -42.1 46.7 33.8 55.8 43 71 A F H X S+ 0 0 13 -4,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.925 116.9 42.9 -60.4 -45.9 49.1 35.4 58.1 44 72 A C H X S+ 0 0 0 -4,-1.8 4,-0.6 1,-0.2 8,-0.3 0.886 114.7 47.5 -67.5 -43.0 51.4 36.2 55.2 45 73 A L H < S+ 0 0 42 -4,-3.4 -1,-0.2 1,-0.1 -2,-0.2 0.739 129.1 17.3 -75.4 -24.7 48.7 37.4 52.7 46 74 A K H < S+ 0 0 153 -4,-1.5 -2,-0.2 -5,-0.2 -3,-0.2 0.691 127.8 39.1-120.3 -30.0 46.8 39.7 55.1 47 75 A H H < S+ 0 0 114 -4,-1.8 2,-0.2 -5,-0.5 -3,-0.2 0.268 110.2 46.5-118.6 8.7 49.0 40.6 58.2 48 76 A L >X - 0 0 29 -4,-0.6 4,-1.1 -5,-0.2 3,-0.8 -0.746 55.6-164.3-155.3 110.1 52.6 41.1 56.9 49 77 A E T 34 S+ 0 0 151 1,-0.3 3,-0.2 -2,-0.2 -1,-0.1 0.797 89.2 56.2 -64.2 -38.4 53.4 43.2 53.7 50 78 A E T 34 S+ 0 0 99 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.813 110.7 45.5 -61.9 -32.0 57.0 41.8 53.2 51 79 A A T X> S+ 0 0 0 -3,-0.8 4,-2.1 -7,-0.2 3,-1.2 0.682 90.9 82.5 -90.2 -21.3 55.7 38.2 53.0 52 80 A K H 3X S+ 0 0 72 -4,-1.1 4,-2.9 -8,-0.3 5,-0.2 0.947 92.2 46.6 -46.2 -62.1 52.7 38.7 50.7 53 81 A P H 3> S+ 0 0 39 0, 0.0 4,-1.0 0, 0.0 -1,-0.3 0.563 110.1 55.4 -67.3 -8.1 54.7 38.6 47.4 54 82 A L H <> S+ 0 0 13 -3,-1.2 4,-2.7 2,-0.2 -2,-0.2 0.897 112.6 40.0 -83.4 -49.1 56.6 35.5 48.5 55 83 A V H X S+ 0 0 3 -4,-2.1 4,-2.6 2,-0.2 5,-0.3 0.920 116.0 52.1 -62.6 -44.2 53.5 33.5 49.2 56 84 A E H X S+ 0 0 63 -4,-2.9 4,-1.9 -5,-0.3 -1,-0.2 0.967 112.9 44.6 -55.4 -52.5 51.8 34.9 46.1 57 85 A F H X S+ 0 0 0 -4,-1.0 4,-2.0 -5,-0.2 -2,-0.2 0.909 112.3 53.0 -58.4 -44.4 54.8 33.9 44.0 58 86 A Y H X S+ 0 0 29 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.908 111.4 44.6 -58.5 -46.8 55.0 30.5 45.7 59 87 A E H X S+ 0 0 28 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.773 108.9 57.2 -73.1 -26.6 51.4 29.6 44.9 60 88 A E H X S+ 0 0 57 -4,-1.9 4,-1.8 -5,-0.3 -1,-0.2 0.883 109.6 45.9 -69.1 -37.4 51.8 30.9 41.4 61 89 A I H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.934 108.9 53.9 -66.4 -48.8 54.6 28.4 40.9 62 90 A K H X S+ 0 0 61 -4,-2.4 4,-1.1 1,-0.3 -2,-0.2 0.849 110.2 48.2 -59.1 -33.6 52.7 25.5 42.5 63 91 A K H X S+ 0 0 127 -4,-1.6 4,-0.8 1,-0.2 -1,-0.3 0.902 108.7 55.2 -66.4 -42.7 49.9 26.3 40.0 64 92 A Y H >< S+ 0 0 0 -4,-1.8 3,-0.6 1,-0.2 -2,-0.2 0.849 101.4 57.8 -57.7 -38.2 52.5 26.4 37.2 65 93 A E H 3< S+ 0 0 53 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.926 105.3 50.2 -59.3 -43.9 53.7 22.8 38.1 66 94 A K H 3< S+ 0 0 144 -4,-1.1 -1,-0.2 -3,-0.2 -2,-0.2 0.599 78.1 118.1 -76.4 -14.6 50.3 21.3 37.6 67 95 A L << - 0 0 44 -4,-0.8 6,-0.0 -3,-0.6 -3,-0.0 -0.339 55.2-150.5 -57.9 135.9 49.7 22.8 34.1 68 96 A E + 0 0 49 363,-0.0 2,-0.2 4,-0.0 -1,-0.1 0.904 63.8 46.6 -82.6 -47.5 49.3 19.9 31.7 69 97 A T S > S- 0 0 59 1,-0.1 4,-1.7 0, 0.0 5,-0.1 -0.605 72.9-124.2-104.9 161.8 50.5 21.1 28.2 70 98 A E H > S+ 0 0 109 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.813 109.1 58.8 -74.1 -32.8 53.6 23.0 27.0 71 99 A E H > S+ 0 0 169 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.877 109.2 47.0 -61.9 -36.5 51.6 25.8 25.3 72 100 A E H > S+ 0 0 74 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.909 113.1 48.4 -68.9 -42.7 50.0 26.5 28.7 73 101 A R H X S+ 0 0 38 -4,-1.7 4,-2.4 1,-0.2 5,-0.2 0.876 106.2 56.0 -67.7 -40.4 53.4 26.4 30.4 74 102 A L H X S+ 0 0 37 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.914 112.7 44.1 -55.0 -42.8 55.1 28.7 27.9 75 103 A V H X S+ 0 0 78 -4,-1.3 4,-1.7 -5,-0.2 3,-0.4 0.950 115.2 43.8 -71.9 -51.5 52.4 31.3 28.6 76 104 A C H X S+ 0 0 13 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.848 106.1 62.0 -67.9 -34.2 52.2 31.1 32.4 77 105 A S H X S+ 0 0 0 -4,-2.4 4,-1.6 -5,-0.2 -1,-0.2 0.892 106.1 47.8 -54.9 -40.7 56.1 31.1 32.7 78 106 A R H X S+ 0 0 109 -4,-1.0 4,-3.1 -3,-0.4 5,-0.3 0.927 109.5 51.2 -66.9 -46.6 56.1 34.6 31.1 79 107 A E H X S+ 0 0 109 -4,-1.7 4,-2.2 1,-0.2 5,-0.3 0.887 112.2 47.7 -56.8 -42.4 53.3 36.0 33.3 80 108 A I H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 5,-0.5 0.851 113.4 48.1 -66.5 -36.7 55.2 34.8 36.4 81 109 A F H X>S+ 0 0 33 -4,-1.6 5,-2.8 -5,-0.2 4,-1.0 0.924 114.5 43.7 -73.4 -46.3 58.5 36.3 35.1 82 110 A D H <>S+ 0 0 101 -4,-3.1 5,-1.3 3,-0.2 -2,-0.2 0.912 124.0 36.8 -60.6 -43.8 57.0 39.7 34.2 83 111 A T H <>S+ 0 0 57 -4,-2.2 5,-0.6 -5,-0.3 -3,-0.2 0.970 128.5 24.6 -79.5 -58.8 55.0 39.9 37.5 84 112 A Y H <5S+ 0 0 31 -4,-1.9 -3,-0.2 -5,-0.3 -2,-0.1 0.569 133.4 28.1 -91.4 -6.0 57.1 38.3 40.2 85 113 A I T X5S+ 0 0 1 -4,-1.0 4,-2.0 -5,-0.5 -3,-0.2 0.769 123.1 34.0-118.2 -64.6 60.6 38.8 38.7 86 114 A M H ><5S+ 0 0 65 -4,-2.0 3,-1.5 1,-0.2 -1,-0.2 0.909 109.9 46.9 -64.6 -46.9 63.3 43.9 40.3 90 118 A L H 3<5S+ 0 0 138 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.757 113.3 51.0 -65.3 -26.6 62.4 47.2 38.7 91 119 A A T 3<5S- 0 0 58 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.245 114.7-119.6 -91.4 10.8 60.8 48.2 42.0 92 120 A C T < 5S+ 0 0 122 -3,-1.5 -3,-0.2 -5,-0.2 -2,-0.1 0.890 85.9 111.6 50.9 45.5 64.0 47.3 43.9 93 121 A S < + 0 0 74 -5,-3.3 -4,-0.2 -6,-0.1 -1,-0.1 -0.141 33.9 113.3-139.1 35.0 61.9 44.7 45.8 94 122 A H - 0 0 21 -6,-0.3 2,-1.8 -5,-0.2 -2,-0.0 -0.820 39.4-174.4-119.8 90.6 63.3 41.4 44.6 95 123 A P + 0 0 72 0, 0.0 2,-0.3 0, 0.0 33,-0.1 -0.469 46.5 109.0 -87.4 67.7 65.2 39.5 47.4 96 124 A F - 0 0 23 -2,-1.8 -2,-0.1 1,-0.0 25,-0.1 -0.936 69.1 -87.8-140.5 163.1 66.5 36.6 45.3 97 125 A S > - 0 0 32 -2,-0.3 4,-1.6 1,-0.1 5,-0.1 -0.120 24.6-120.6 -77.1 164.0 69.8 35.5 44.0 98 126 A K H > S+ 0 0 171 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.913 117.6 50.4 -63.9 -44.2 71.7 36.4 40.8 99 127 A S H > S+ 0 0 82 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.882 104.7 58.1 -62.6 -39.1 71.7 32.7 39.9 100 128 A A H > S+ 0 0 3 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.918 106.9 47.5 -56.0 -47.6 68.0 32.4 40.5 101 129 A I H X S+ 0 0 41 -4,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.896 113.7 47.5 -60.1 -43.1 67.2 35.1 38.0 102 130 A E H X S+ 0 0 116 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.699 103.4 61.4 -77.6 -22.2 69.5 33.6 35.3 103 131 A H H X S+ 0 0 67 -4,-1.8 4,-1.1 -3,-0.2 -1,-0.2 0.965 112.1 36.8 -65.6 -51.9 68.2 30.0 35.7 104 132 A V H X S+ 0 0 0 -4,-1.4 4,-3.1 1,-0.2 3,-0.2 0.900 119.7 48.2 -67.8 -42.8 64.7 31.0 34.7 105 133 A Q H X S+ 0 0 93 -4,-1.8 4,-2.2 1,-0.2 5,-0.2 0.868 106.5 56.4 -69.6 -38.2 65.8 33.5 32.1 106 134 A G H < S+ 0 0 32 -4,-1.9 4,-0.5 2,-0.2 -1,-0.2 0.807 116.4 38.3 -60.4 -31.5 68.3 31.1 30.5 107 135 A H H ><>S+ 0 0 53 -4,-1.1 5,-1.9 -3,-0.2 3,-0.7 0.913 112.1 54.3 -84.5 -50.5 65.5 28.7 29.9 108 136 A L H ><5S+ 0 0 23 -4,-3.1 3,-1.5 1,-0.3 -2,-0.2 0.861 105.2 55.1 -53.2 -41.8 62.7 31.1 29.0 109 137 A V T 3<5S+ 0 0 107 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.853 110.1 46.3 -60.7 -35.5 64.8 32.6 26.2 110 138 A K T < 5S- 0 0 146 -3,-0.7 -1,-0.3 -4,-0.5 -2,-0.2 0.272 113.0-122.2 -89.2 10.5 65.2 29.1 24.7 111 139 A K T < 5 + 0 0 123 -3,-1.5 2,-0.6 1,-0.2 -3,-0.2 0.769 65.4 141.7 52.1 32.0 61.5 28.4 25.1 112 140 A Q < + 0 0 73 -5,-1.9 -1,-0.2 -6,-0.1 -2,-0.2 -0.914 20.2 168.4-106.3 114.5 62.2 25.4 27.3 113 141 A V + 0 0 4 -2,-0.6 -40,-0.1 -3,-0.1 -36,-0.1 -0.672 4.5 174.2-137.6 74.9 59.7 25.3 30.1 114 142 A P > - 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0 0 30 -3,-1.9 2,-0.5 -8,-0.1 3,-0.0 -0.202 60.6-153.0 -73.0 151.2 49.0 7.6 27.2 429 457 A D >> - 0 0 63 1,-0.1 4,-1.7 0, 0.0 3,-1.3 -0.979 13.2-155.2-116.4 110.6 50.1 10.7 29.1 430 458 A W H 3> S+ 0 0 37 -2,-0.5 4,-1.8 1,-0.3 5,-0.1 0.701 90.7 63.6 -70.9 -17.8 50.7 9.5 32.6 431 459 A Q H 3> S+ 0 0 64 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.873 107.9 44.9 -64.6 -36.0 50.1 12.9 34.2 432 460 A M H <4>S+ 0 0 38 -3,-1.3 5,-2.3 2,-0.2 6,-0.5 0.880 110.1 52.8 -75.3 -40.8 46.5 12.5 32.9 433 461 A V H ><5S+ 0 0 4 -4,-1.7 3,-0.9 3,-0.2 -1,-0.2 0.880 112.6 47.5 -57.7 -37.3 46.2 8.9 34.1 434 462 A F H 3<5S+ 0 0 99 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.939 107.9 51.6 -73.1 -47.6 47.3 10.2 37.5 435 463 A L T 3<5S- 0 0 75 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.306 113.0-122.1 -71.1 10.4 44.9 13.1 37.6 436 464 A Q T < 5S+ 0 0 58 -3,-0.9 -3,-0.2 1,-0.1 -2,-0.1 0.889 70.1 134.6 51.1 49.4 42.2 10.5 36.7 437 465 A K < + 0 0 124 -5,-2.3 -4,-0.2 2,-0.1 -1,-0.1 0.634 33.1 97.7-108.5 -17.6 41.1 12.3 33.5 438 466 A Y S S- 0 0 71 -6,-0.5 0, 0.0 1,-0.1 0, 0.0 -0.513 85.5-108.7 -65.9 138.9 40.9 9.5 31.1 439 467 A P - 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.591 31.8-122.4 -77.2 126.6 37.3 8.4 30.7 440 468 A P - 0 0 30 0, 0.0 -138,-0.1 0, 0.0 3,-0.1 -0.386 7.1-138.0 -71.9 147.5 36.5 5.0 32.3 441 469 A P S S+ 0 0 45 0, 0.0 2,-0.4 0, 0.0 -140,-0.1 0.691 86.4 42.3 -75.9 -23.5 35.0 2.2 30.2 442 470 A L - 0 0 26 -141,-0.2 -188,-0.0 -177,-0.1 -184,-0.0 -0.978 60.5-167.3-134.7 122.2 32.5 1.0 32.8 443 471 A I - 0 0 121 -2,-0.4 -143,-0.1 -3,-0.1 -142,-0.1 -0.938 32.1-120.6-104.9 114.7 30.3 3.1 35.0 444 472 A P - 0 0 15 0, 0.0 3,-0.1 0, 0.0 -195,-0.1 -0.149 27.4-130.1 -55.2 148.5 28.6 0.9 37.8 445 473 A P - 0 0 103 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.005 43.5 -45.0 -88.6-165.0 24.8 0.8 37.9 446 474 A R 0 0 216 1,-0.1 0, 0.0 -2,-0.0 0, 0.0 -0.447 360.0 360.0 -70.4 129.6 22.2 1.3 40.8 447 475 A G 0 0 100 -2,-0.2 -1,-0.1 -3,-0.1 -199,-0.0 0.733 360.0 360.0 -93.5 360.0 22.7 -0.4 44.2 448 ! 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 0.0 449 496 A I 0 0 196 0, 0.0 2,-0.2 0, 0.0 -252,-0.0 0.000 360.0 360.0 360.0 63.8 32.1 -17.4 72.1 450 497 A K + 0 0 146 2,-0.0 2,-0.3 0, 0.0 -250,-0.1 -0.795 360.0 152.4-164.1 117.4 35.7 -17.0 73.3 451 498 A L - 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