==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RECEPTOR 30-NOV-10 2Y04 . COMPND 2 MOLECULE: BETA-1 ADRENERGIC RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: MELEAGRIS GALLOPAVO; . AUTHOR A.WARNE,R.MOUKHAMETZIANOV,J.G.BAKER,R.NEHME,P.C.EDWARDS,A.G. . 584 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32146.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 490 83.9 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 0.3 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 . 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 . 12 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 411 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.2 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 0 0 1 2 1 0 0 6 0 0 0 0 0 0 2 1 0 3 0 0 2 0 0 0 0 0 6 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 33 A A > 0 0 114 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -85.8 -53.8 -24.1 30.0 2 34 A E H > + 0 0 161 1,-0.2 4,-1.2 2,-0.2 5,-0.0 0.578 360.0 52.4 -72.9 -12.8 -53.0 -25.6 26.6 3 35 A L H > S+ 0 0 138 2,-0.2 4,-2.4 3,-0.1 -1,-0.2 0.847 103.3 55.2 -84.2 -43.7 -54.8 -22.6 25.1 4 36 A L H > S+ 0 0 116 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.823 110.1 48.9 -56.9 -34.5 -52.8 -20.1 27.0 5 37 A S H X S+ 0 0 56 -4,-1.3 4,-3.7 2,-0.2 5,-0.2 0.951 109.2 49.5 -69.2 -55.5 -49.7 -21.8 25.5 6 38 A Q H X S+ 0 0 121 -4,-1.2 4,-2.2 2,-0.2 5,-0.2 0.862 110.4 51.9 -53.0 -42.5 -50.9 -21.8 21.9 7 39 A Q H X S+ 0 0 145 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.978 115.9 39.9 -58.2 -56.6 -51.8 -18.1 22.1 8 40 A W H X S+ 0 0 122 -4,-1.6 4,-2.5 1,-0.2 5,-0.3 0.936 113.4 54.4 -58.9 -50.3 -48.4 -17.2 23.4 9 41 A E H X S+ 0 0 64 -4,-3.7 4,-2.2 1,-0.2 -1,-0.2 0.911 115.3 39.2 -51.6 -46.2 -46.5 -19.6 21.1 10 42 A A H < S+ 0 0 64 -4,-2.2 4,-0.5 -5,-0.2 -1,-0.2 0.821 114.9 50.0 -81.2 -33.1 -48.1 -18.1 18.0 11 43 A G H X S+ 0 0 46 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.840 115.1 45.4 -70.1 -34.5 -48.0 -14.4 19.0 12 44 A M H X S+ 0 0 44 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.916 106.4 57.9 -74.3 -45.0 -44.3 -14.7 19.9 13 45 A S H X S+ 0 0 58 -4,-2.2 4,-1.3 -5,-0.3 -1,-0.2 0.716 109.8 49.4 -53.2 -21.3 -43.5 -16.6 16.7 14 46 A L H > S+ 0 0 128 -4,-0.5 4,-2.0 2,-0.2 -2,-0.2 0.914 108.4 46.8 -87.1 -50.9 -45.0 -13.5 15.0 15 47 A L H X S+ 0 0 92 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.876 115.2 50.6 -54.5 -41.8 -43.0 -10.8 16.9 16 48 A M H X S+ 0 0 15 -4,-2.8 4,-3.1 2,-0.2 5,-0.2 0.946 108.5 49.3 -62.3 -51.6 -39.9 -12.9 16.3 17 49 A A H X S+ 0 0 53 -4,-1.3 4,-2.3 -5,-0.2 -1,-0.2 0.846 110.9 53.4 -57.6 -34.8 -40.6 -13.3 12.5 18 50 A L H X S+ 0 0 106 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.926 110.6 44.1 -64.7 -49.4 -41.1 -9.5 12.5 19 51 A V H X S+ 0 0 39 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.934 112.9 52.1 -62.3 -48.7 -37.7 -8.8 14.1 20 52 A V H X S+ 0 0 36 -4,-3.1 4,-2.8 1,-0.2 5,-0.2 0.947 113.2 46.2 -47.8 -50.9 -36.0 -11.3 11.9 21 53 A L H X S+ 0 0 124 -4,-2.3 4,-2.5 -5,-0.2 5,-0.3 0.859 111.5 49.8 -64.0 -41.5 -37.6 -9.6 8.9 22 54 A L H X S+ 0 0 86 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.915 114.6 43.7 -66.1 -45.5 -36.7 -6.0 10.0 23 55 A I H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 5,-0.3 0.958 117.7 45.0 -62.9 -50.9 -33.0 -6.9 10.7 24 56 A V H X S+ 0 0 35 -4,-2.8 4,-1.5 -5,-0.3 -2,-0.2 0.860 118.5 42.4 -66.6 -37.1 -32.7 -8.9 7.4 25 57 A A H X S+ 0 0 51 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.977 114.5 50.6 -69.3 -54.4 -34.5 -6.3 5.3 26 58 A G H X S+ 0 0 10 -4,-2.5 4,-1.4 -5,-0.3 -2,-0.2 0.826 115.9 40.0 -51.7 -41.8 -32.8 -3.3 6.9 27 59 A N H X S+ 0 0 1 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.820 109.5 56.0 -88.0 -32.5 -29.3 -4.6 6.5 28 60 A V H X S+ 0 0 73 -4,-1.5 4,-3.1 -5,-0.3 5,-0.3 0.915 107.5 55.1 -59.2 -41.5 -29.6 -6.1 3.0 29 61 A L H X S+ 0 0 39 -4,-2.4 4,-3.2 2,-0.2 -2,-0.2 0.951 107.9 46.3 -54.0 -53.4 -30.7 -2.6 2.1 30 62 A V H X S+ 0 0 0 -4,-1.4 4,-2.4 2,-0.2 5,-0.3 0.926 114.3 47.4 -56.9 -48.0 -27.5 -1.0 3.5 31 63 A I H X S+ 0 0 45 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.936 116.2 43.9 -62.5 -45.7 -25.3 -3.6 1.8 32 64 A A H X S+ 0 0 34 -4,-3.1 4,-1.2 2,-0.2 -2,-0.2 0.903 111.8 53.2 -64.0 -44.2 -27.0 -3.3 -1.6 33 65 A A H >< S+ 0 0 0 -4,-3.2 3,-0.5 -5,-0.3 7,-0.2 0.940 117.2 37.2 -57.1 -52.3 -27.1 0.6 -1.4 34 66 A I H >< S+ 0 0 9 -4,-2.4 3,-0.9 -5,-0.2 -1,-0.2 0.862 115.7 57.7 -63.2 -35.3 -23.4 0.8 -0.7 35 67 A G H 3< S+ 0 0 57 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.667 114.3 35.8 -71.0 -16.9 -23.0 -2.1 -3.2 36 68 A S T << S+ 0 0 48 -4,-1.2 -1,-0.3 -3,-0.5 2,-0.2 -0.338 102.7 76.0-137.1 47.9 -24.6 -0.3 -6.0 37 69 A T < - 0 0 23 -3,-0.9 3,-0.1 1,-0.1 -1,-0.1 -0.709 46.3-170.2-161.6 107.8 -23.6 3.4 -5.6 38 70 A Q S > S+ 0 0 156 1,-0.2 3,-1.5 2,-0.2 -1,-0.1 0.877 95.5 62.1 -63.5 -38.3 -20.1 4.8 -6.5 39 71 A R T 3 S+ 0 0 191 1,-0.3 -1,-0.2 2,-0.1 3,-0.1 0.916 109.7 39.8 -47.5 -47.9 -21.2 7.9 -4.7 40 72 A L T 3 S+ 0 0 15 -7,-0.2 -1,-0.3 1,-0.2 -2,-0.2 0.126 84.1 100.0 -99.7 21.9 -21.5 5.9 -1.5 41 73 A Q < + 0 0 55 -3,-1.5 -1,-0.2 -6,-0.0 -2,-0.1 -0.193 50.0 147.8 -97.6 43.5 -18.4 3.7 -1.8 42 74 A T > - 0 0 70 -3,-0.1 4,-0.6 1,-0.1 -2,-0.0 -0.182 62.6-109.7 -63.8 165.3 -16.3 5.8 0.6 43 75 A L H >> S+ 0 0 27 1,-0.2 3,-1.7 2,-0.2 4,-0.9 0.955 118.8 57.3 -62.7 -47.6 -13.6 4.1 2.7 44 76 A T H >> S+ 0 0 16 1,-0.3 4,-1.5 2,-0.2 3,-0.5 0.820 101.0 56.3 -50.9 -39.1 -15.7 4.7 5.9 45 77 A N H 3> S+ 0 0 16 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.663 93.8 67.7 -73.1 -17.0 -18.7 2.9 4.4 46 78 A L H S+ 0 0 44 -4,-2.2 5,-1.7 1,-0.2 4,-1.6 0.827 106.7 52.7 -69.5 -30.6 -25.5 -12.6 10.9 58 90 A V H <>S+ 0 0 10 -4,-1.2 5,-3.2 3,-0.2 -1,-0.2 0.848 112.1 46.8 -68.2 -35.1 -27.6 -11.7 14.0 59 91 A G H <5S+ 0 0 0 -4,-1.7 -2,-0.2 3,-0.2 -1,-0.1 0.901 119.4 35.0 -74.8 -45.0 -30.7 -11.7 11.8 60 92 A L H <5S+ 0 0 99 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.821 137.9 8.0 -78.7 -32.1 -30.2 -14.9 9.8 61 93 A L T X5S+ 0 0 72 -4,-1.6 4,-1.3 -5,-0.3 5,-0.2 0.779 122.8 48.0-122.2 -47.2 -28.6 -17.0 12.5 62 94 A V H > S+ 0 0 37 0, 0.0 4,-2.3 0, 0.0 3,-0.4 0.965 113.3 44.7 -51.3 -54.0 -33.9 -17.3 14.6 65 97 A F H X S+ 0 0 48 -4,-1.3 4,-1.6 1,-0.3 -2,-0.2 0.942 114.7 47.8 -55.0 -50.5 -32.1 -19.9 16.8 66 98 A G H X S+ 0 0 3 -4,-2.3 4,-2.2 1,-0.2 -1,-0.3 0.753 108.8 56.9 -61.8 -27.7 -32.8 -17.8 19.9 67 99 A A H X S+ 0 0 12 -4,-2.2 4,-3.2 -3,-0.4 5,-0.3 0.953 102.5 52.0 -68.5 -52.2 -36.4 -17.5 18.8 68 100 A T H X S+ 0 0 37 -4,-2.3 4,-2.0 1,-0.2 6,-0.4 0.867 112.1 49.2 -51.5 -38.6 -37.0 -21.3 18.6 69 101 A L H X S+ 0 0 39 -4,-1.6 4,-1.8 -5,-0.2 -1,-0.2 0.962 114.3 42.7 -65.9 -51.6 -35.6 -21.5 22.1 70 102 A V H < S+ 0 0 51 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.909 120.9 41.0 -63.1 -43.4 -37.9 -18.7 23.5 71 103 A V H < S+ 0 0 13 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.969 122.1 35.6 -71.6 -55.0 -41.0 -19.9 21.7 72 104 A R H < S- 0 0 139 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.641 101.2-124.4 -81.8 -15.6 -40.8 -23.6 22.1 73 105 A G S < S+ 0 0 58 -4,-1.8 2,-0.3 -5,-0.3 -4,-0.1 0.288 78.6 48.7 93.0 -11.9 -39.3 -23.7 25.6 74 106 A T S S- 0 0 67 -6,-0.4 2,-0.5 92,-0.1 -2,-0.2 -0.952 89.1 -90.5-146.7 172.8 -36.2 -25.8 24.9 75 107 A W - 0 0 4 90,-2.7 3,-0.2 -2,-0.3 -9,-0.0 -0.766 35.1-179.7 -85.7 124.4 -33.2 -26.2 22.6 76 108 A L + 0 0 79 -2,-0.5 -1,-0.1 1,-0.1 89,-0.1 0.429 63.6 71.8-100.8 1.0 -34.2 -28.5 19.7 77 109 A W S > S- 0 0 114 1,-0.2 4,-0.5 87,-0.1 -1,-0.1 0.257 92.3-115.3-114.1 9.4 -30.9 -28.6 17.8 78 110 A G H > - 0 0 29 86,-0.5 4,-1.5 -3,-0.2 -1,-0.2 0.105 39.2 -61.2 83.1 168.8 -28.4 -30.6 19.8 79 111 A S H > S+ 0 0 69 1,-0.2 4,-1.9 2,-0.2 3,-0.2 0.906 124.8 47.8 -53.3 -55.8 -25.1 -30.0 21.6 80 112 A F H > S+ 0 0 144 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.907 112.1 48.0 -62.3 -46.5 -22.9 -28.9 18.7 81 113 A L H X S+ 0 0 59 -4,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.821 107.9 57.6 -65.2 -30.1 -25.3 -26.4 17.3 82 114 A a H X S+ 0 0 18 -4,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.924 110.2 42.4 -63.9 -46.4 -25.9 -24.9 20.7 83 115 A E H X S+ 0 0 37 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.941 115.5 49.2 -65.3 -46.0 -22.3 -24.1 21.2 84 116 A L H X S+ 0 0 61 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.871 109.9 52.6 -63.9 -37.5 -21.9 -22.8 17.7 85 117 A W H X S+ 0 0 22 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.956 110.4 47.0 -59.6 -50.6 -25.0 -20.7 18.2 86 118 A T H X S+ 0 0 10 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.907 110.4 54.4 -54.9 -46.5 -23.4 -19.2 21.4 87 119 A S H X S+ 0 0 4 -4,-3.0 4,-3.6 1,-0.2 -2,-0.2 0.945 108.1 47.5 -50.5 -55.8 -20.1 -18.7 19.5 88 120 A L H X S+ 0 0 30 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.866 110.0 54.2 -59.5 -38.4 -21.8 -16.6 16.7 89 121 A D H X S+ 0 0 24 -4,-2.1 4,-1.6 2,-0.2 5,-0.2 0.973 114.0 39.5 -58.7 -56.4 -23.6 -14.6 19.3 90 122 A V H X S+ 0 0 21 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.910 113.3 58.1 -59.4 -39.7 -20.4 -13.6 21.1 91 123 A L H X S+ 0 0 16 -4,-3.6 4,-2.4 -5,-0.2 -1,-0.2 0.904 105.6 49.1 -56.0 -44.4 -18.7 -13.2 17.7 92 124 A C H X S+ 0 0 2 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.898 109.6 47.5 -67.3 -48.6 -21.2 -10.6 16.5 93 125 A V H X S+ 0 0 11 -4,-1.6 4,-2.0 2,-0.2 5,-0.2 0.868 113.8 50.5 -58.3 -38.9 -21.1 -8.3 19.5 94 126 A T H X S+ 0 0 0 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.946 112.2 44.2 -69.9 -46.4 -17.3 -8.4 19.5 95 127 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.844 111.7 57.0 -64.1 -34.9 -17.0 -7.5 15.8 96 128 A S H X S+ 0 0 4 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.934 112.0 37.6 -63.3 -49.9 -19.6 -4.8 16.2 97 129 A I H X S+ 0 0 0 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.823 116.6 53.0 -75.5 -30.6 -17.9 -2.9 18.9 98 130 A E H X S+ 0 0 27 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.862 108.9 50.1 -70.7 -33.2 -14.4 -3.5 17.4 99 131 A T H X S+ 0 0 2 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.924 106.8 54.8 -69.8 -42.1 -15.7 -2.1 14.1 100 132 A L H X S+ 0 0 2 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.812 106.6 52.9 -56.4 -33.5 -17.1 1.0 15.9 101 133 A C H X S+ 0 0 14 -4,-1.4 4,-2.7 2,-0.2 -1,-0.2 0.945 107.5 49.4 -66.5 -48.6 -13.6 1.5 17.3 102 134 A V H X S+ 0 0 27 -4,-1.8 4,-3.7 2,-0.2 -2,-0.2 0.942 111.2 51.3 -52.4 -49.1 -12.0 1.4 13.8 103 135 A I H X S+ 0 0 1 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.912 110.6 46.8 -57.3 -49.0 -14.7 3.9 12.6 104 136 A A H X S+ 0 0 5 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.890 115.4 47.1 -63.3 -37.1 -14.0 6.3 15.4 105 137 A I H X S+ 0 0 83 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.960 109.2 53.0 -67.4 -49.6 -10.2 6.0 14.8 106 138 A D H X S+ 0 0 2 -4,-3.7 4,-2.2 1,-0.2 -2,-0.2 0.906 113.3 45.5 -47.2 -47.4 -10.7 6.4 11.0 107 139 A R H X S+ 0 0 63 -4,-2.5 4,-1.1 2,-0.2 -1,-0.2 0.873 109.3 53.3 -70.0 -40.0 -12.6 9.6 11.7 108 140 A Y H X S+ 0 0 80 -4,-2.2 4,-1.4 1,-0.2 3,-0.3 0.921 113.1 44.6 -59.2 -46.0 -10.1 10.9 14.3 109 141 A L H X S+ 0 0 55 -4,-2.6 4,-2.0 1,-0.2 3,-0.4 0.937 111.5 51.5 -61.1 -50.3 -7.3 10.5 11.8 110 142 A A H < S+ 0 0 22 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.702 114.3 46.1 -63.2 -20.1 -9.1 12.0 8.8 111 143 A I H < S+ 0 0 34 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.694 120.8 29.7-101.7 -26.1 -10.0 15.1 10.9 112 144 A T H < S+ 0 0 48 -4,-1.4 -2,-0.2 -3,-0.4 -3,-0.1 0.498 132.8 29.8-112.6 -6.8 -6.7 16.0 12.6 113 145 A S X + 0 0 42 -4,-2.0 4,-3.4 -5,-0.2 5,-0.4 -0.228 64.8 160.1-141.1 49.7 -4.2 14.8 10.0 114 146 A P H > S+ 0 0 85 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.747 81.0 47.6 -50.0 -27.0 -6.1 15.1 6.7 115 147 A F H > S+ 0 0 163 2,-0.2 4,-1.9 3,-0.1 5,-0.2 0.945 115.1 41.5 -77.0 -50.5 -2.8 15.0 4.9 116 148 A R H > S+ 0 0 176 1,-0.2 4,-1.3 2,-0.2 5,-0.2 0.930 115.5 53.5 -59.8 -45.5 -1.3 12.0 6.7 117 149 A Y H X S+ 0 0 32 -4,-3.4 4,-2.6 -8,-0.4 -1,-0.2 0.873 106.2 52.4 -54.2 -45.0 -4.7 10.3 6.5 118 150 A Q H < S+ 0 0 144 -4,-1.3 -1,-0.2 -5,-0.4 -2,-0.2 0.933 112.3 42.9 -61.9 -48.4 -4.9 10.8 2.7 119 151 A S H < S+ 0 0 72 -4,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.656 121.1 43.3 -76.6 -13.7 -1.5 9.2 1.9 120 152 A L H < S+ 0 0 58 -4,-1.3 2,-0.6 -3,-0.2 -2,-0.2 0.905 96.0 74.1 -92.5 -52.5 -2.1 6.4 4.4 121 153 A M < + 0 0 34 -4,-2.6 2,-0.2 -5,-0.2 -1,-0.1 -0.558 56.0 155.1 -78.9 111.6 -5.7 5.2 3.9 122 154 A T > - 0 0 57 -2,-0.6 4,-1.6 1,-0.1 5,-0.1 -0.669 53.7-104.7-120.8 178.6 -6.4 3.1 0.7 123 155 A R H > S+ 0 0 122 -2,-0.2 4,-1.8 2,-0.2 5,-0.1 0.922 119.0 52.6 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118.8 46.7 -66.5 -26.0 -12.6 -20.1 24.4 145 177 A I H ><5S+ 0 0 0 -4,-0.8 3,-1.3 -3,-0.4 -2,-0.2 0.931 115.1 42.5 -77.8 -47.9 -16.1 -21.4 23.7 146 178 A M H 3<5S+ 0 0 115 -4,-3.5 -3,-0.2 1,-0.3 -1,-0.2 0.706 114.4 53.9 -73.7 -16.7 -15.0 -24.4 21.6 147 179 A M T 3<5S- 0 0 98 -4,-2.2 -1,-0.3 -5,-0.4 -2,-0.2 0.343 110.2-125.6 -94.8 6.9 -12.3 -25.1 24.1 148 180 A H T X 5 + 0 0 75 -3,-1.3 3,-1.7 1,-0.1 -3,-0.2 0.645 64.8 139.9 60.8 21.1 -14.9 -25.1 27.0 149 181 A W T 3 < + 0 0 88 -5,-1.8 26,-0.2 1,-0.3 23,-0.2 0.651 68.7 63.5 -63.8 -15.8 -13.0 -22.4 29.0 150 182 A W T 3 S+ 0 0 16 -6,-0.8 22,-1.3 -5,-0.2 -1,-0.3 0.612 83.3 109.7 -82.9 -14.1 -16.5 -21.1 29.7 151 183 A R < - 0 0 83 -3,-1.7 2,-0.3 20,-0.2 21,-0.1 -0.182 51.9-149.6 -73.7 155.7 -17.7 -24.2 31.6 152 184 A D - 0 0 55 18,-0.3 -1,-0.1 19,-0.1 20,-0.1 -0.785 19.5-139.0-125.6 166.9 -18.4 -24.7 35.3 153 185 A E + 0 0 176 -2,-0.3 5,-0.1 4,-0.1 -1,-0.1 0.562 62.2 123.2-101.5 -16.4 -18.2 -27.4 38.0 154 186 A D S > S- 0 0 60 1,-0.1 4,-1.6 3,-0.1 5,-0.1 0.073 71.9-120.7 -39.1 151.7 -21.4 -26.5 39.7 155 187 A P H > S+ 0 0 109 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.954 116.3 50.4 -62.2 -52.2 -24.2 -29.2 40.0 156 188 A Q H > S+ 0 0 98 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.864 107.3 55.0 -45.6 -47.8 -26.6 -26.9 38.1 157 189 A A H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.922 111.5 42.1 -59.1 -48.4 -24.0 -26.4 35.4 158 190 A L H X S+ 0 0 84 -4,-1.6 4,-1.7 2,-0.2 5,-0.3 0.804 105.3 64.5 -72.0 -33.5 -23.6 -30.2 34.8 159 191 A K H X S+ 0 0 177 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.941 112.9 36.7 -45.7 -49.1 -27.4 -30.7 35.0 160 192 A b H < S+ 0 0 15 -4,-1.7 6,-0.4 2,-0.2 -2,-0.2 0.850 110.2 57.1 -80.2 -40.2 -27.6 -28.6 31.9 161 193 A Y H < S+ 0 0 29 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.813 110.4 45.9 -67.4 -30.8 -24.4 -29.6 29.9 162 194 A Q H < S+ 0 0 169 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.907 98.2 82.4 -73.6 -44.2 -25.5 -33.3 29.8 163 195 A D >< - 0 0 81 -4,-1.2 3,-1.2 -5,-0.3 -4,-0.0 -0.470 67.1-156.3 -64.8 119.4 -29.1 -32.4 28.9 164 196 A P T 3 S+ 0 0 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20.2 196 228 A L H X S+ 0 0 140 -4,-1.6 4,-1.8 -3,-0.3 3,-0.7 0.991 112.7 41.6 -64.3 -63.3 -13.3 18.1 20.7 201 233 A E H 3< S+ 0 0 65 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.595 110.2 62.2 -63.9 -12.1 -11.7 18.7 17.3 202 234 A A H 3< S+ 0 0 12 -4,-0.7 -1,-0.2 -5,-0.2 -2,-0.2 0.920 106.2 41.1 -76.5 -48.7 -15.2 18.8 15.7 203 235 A K H << S+ 0 0 159 -4,-1.4 2,-2.4 -3,-0.7 -2,-0.2 0.838 100.5 75.4 -67.5 -35.0 -16.3 21.9 17.6 204 236 A E < 0 0 139 -4,-1.8 -1,-0.2 -5,-0.1 -4,-0.1 -0.348 360.0 360.0 -77.0 57.4 -12.9 23.6 17.2 205 237 A Q 0 0 116 -2,-2.4 -3,-0.1 -3,-0.1 -2,-0.0 -0.678 360.0 360.0-151.3 360.0 -13.8 24.3 13.5 206 ! 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 0.0 207 278 A S > 0 0 132 0, 0.0 4,-0.9 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -45.1 -17.3 25.9 2.7 208 279 A R H > + 0 0 193 2,-0.2 4,-1.5 3,-0.1 5,-0.1 0.810 360.0 48.3 -78.5 -39.7 -19.7 26.5 5.7 209 280 A V H > S+ 0 0 103 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.909 111.2 51.6 -59.5 -43.6 -22.3 24.3 3.8 210 281 A 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2.1 -7.2 36.1 389 133 B C H X S+ 0 0 13 -4,-1.4 4,-2.8 2,-0.2 -1,-0.2 0.948 108.4 50.1 -64.7 -49.5 -1.4 -5.8 35.6 390 134 B V H X S+ 0 0 26 -4,-1.9 4,-3.5 1,-0.2 -2,-0.2 0.942 110.6 50.5 -53.2 -51.1 -2.9 -8.3 37.9 391 135 B I H X S+ 0 0 2 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.908 111.4 47.3 -52.1 -49.4 -0.3 -7.4 40.6 392 136 B A H X S+ 0 0 3 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.900 114.8 47.3 -62.2 -38.9 -1.0 -3.6 40.2 393 137 B I H X S+ 0 0 81 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.949 108.8 54.2 -67.0 -45.9 -4.7 -4.4 40.4 394 138 B D H X S+ 0 0 1 -4,-3.5 4,-2.1 1,-0.2 -2,-0.2 0.876 112.6 44.0 -52.6 -44.6 -4.2 -6.7 43.5 395 139 B R H X S+ 0 0 60 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.848 109.7 54.2 -72.4 -36.5 -2.4 -3.8 45.3 396 140 B Y H X S+ 0 0 80 -4,-2.1 4,-1.2 2,-0.2 3,-0.2 0.940 113.0 44.9 -60.7 -46.5 -4.9 -1.2 44.3 397 141 B L H >X S+ 0 0 63 -4,-2.6 4,-2.8 1,-0.2 3,-0.7 0.940 112.5 49.7 -61.1 -51.8 -7.6 -3.3 45.7 398 142 B A H 3< S+ 0 0 19 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.731 112.8 48.3 -61.2 -24.5 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113.6 42.7 -55.9 -47.3 -3.0 -17.0 37.4 419 163 B C H X S+ 0 0 80 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.878 110.1 54.8 -66.5 -41.4 -4.4 -19.6 35.0 420 164 B T H X S+ 0 0 39 -4,-2.8 4,-2.8 2,-0.2 5,-0.2 0.879 108.3 52.4 -59.4 -36.5 -6.9 -17.2 33.3 421 165 B V H X S+ 0 0 13 -4,-2.2 4,-2.3 -5,-0.3 -2,-0.2 0.951 110.9 45.5 -63.7 -49.3 -3.9 -15.0 32.6 422 166 B W H X S+ 0 0 60 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.854 113.5 50.5 -63.7 -33.9 -2.0 -17.9 31.0 423 167 B A H X S+ 0 0 26 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.957 111.7 45.8 -66.9 -53.0 -5.1 -18.9 29.0 424 168 B I H X S+ 0 0 36 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.892 115.4 49.7 -52.8 -42.6 -5.7 -15.4 27.6 425 169 B S H X S+ 0 0 0 -4,-2.3 4,-1.2 -5,-0.2 5,-0.2 0.923 111.5 45.3 -69.3 -45.7 -2.0 -15.2 26.9 426 170 B A H X>S+ 0 0 32 -4,-2.5 4,-2.0 2,-0.2 5,-0.9 0.885 112.5 54.2 -63.1 -38.5 -1.7 -18.5 25.1 427 171 B L H <5S+ 0 0 15 -4,-2.7 4,-0.5 1,-0.2 -2,-0.2 0.943 112.3 42.1 -57.5 -48.3 -4.9 -17.6 23.2 428 172 B V H <5S+ 0 0 18 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.609 126.2 32.6 -80.2 -14.8 -3.5 -14.3 21.9 429 173 B S H X5S+ 0 0 0 -4,-1.2 4,-0.9 -3,-0.2 -3,-0.2 0.851 119.0 38.8-110.1 -51.6 -0.0 -15.7 21.1 430 174 B F H X5S+ 0 0 53 -4,-2.0 4,-2.4 -5,-0.2 3,-0.4 0.955 110.3 54.9 -66.0 -55.8 -0.2 -19.4 19.9 431 175 B L H >S+ 0 0 8 0, 0.0 5,-1.1 0, 0.0 6,-0.5 0.834 114.9 49.2 -67.0 -28.1 -2.4 -16.5 15.4 433 177 B I H ><5S+ 0 0 0 -4,-0.9 3,-0.7 -3,-0.4 -2,-0.2 0.867 111.6 48.3 -76.0 -35.0 1.1 -17.8 14.9 434 178 B M H 3<5S+ 0 0 69 -4,-2.4 -1,-0.2 1,-0.2 -3,-0.1 0.609 109.6 53.8 -78.3 -14.2 -0.0 -21.4 14.2 435 179 B M T 3<5S- 0 0 100 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.390 108.9-125.4 -99.0 -0.9 -2.6 -20.0 11.7 436 180 B H T X 5 + 0 0 73 -3,-0.7 3,-2.8 -5,-0.2 -3,-0.2 0.505 63.3 142.9 71.3 7.4 0.0 -18.1 9.8 437 181 B W T 3 < + 0 0 87 -5,-1.1 26,-0.3 1,-0.3 23,-0.2 0.585 66.3 64.9 -53.0 -8.9 -1.9 -14.8 10.2 438 182 B W T 3 S+ 0 0 15 -6,-0.5 22,-1.4 -5,-0.2 -1,-0.3 0.671 77.9 111.0 -93.9 -14.6 1.5 -13.3 10.6 439 183 B R B < -A 459 0A 64 -3,-2.8 2,-0.2 20,-0.2 20,-0.1 -0.251 51.0-153.5 -65.7 140.0 2.8 -14.0 7.1 440 184 B D - 0 0 34 18,-0.5 20,-0.1 2,-0.1 -1,-0.1 -0.514 15.9-140.7-101.1 176.3 3.4 -11.4 4.4 441 185 B E + 0 0 154 -2,-0.2 5,-0.1 4,-0.1 -1,-0.1 0.446 58.6 126.6-118.6 -9.5 3.3 -11.7 0.6 442 186 B D S > S- 0 0 55 1,-0.1 4,-2.1 3,-0.1 3,-0.5 -0.173 73.4-111.5 -38.1 137.3 6.4 -9.4 -0.1 443 187 B P H > S+ 0 0 94 0, 0.0 4,-2.4 0, 0.0 3,-0.2 0.914 115.2 45.9 -42.8 -61.0 9.0 -11.2 -2.3 444 188 B Q H > S+ 0 0 147 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.752 109.4 55.9 -61.3 -30.7 11.7 -11.5 0.4 445 189 B A H > S+ 0 0 0 -3,-0.5 4,-1.6 2,-0.2 -1,-0.2 0.933 109.8 45.3 -65.0 -47.7 9.2 -12.8 3.0 446 190 B L H < S+ 0 0 80 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.891 111.0 54.4 -61.6 -41.2 8.2 -15.6 0.7 447 191 B K H >< S+ 0 0 161 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.864 111.0 45.6 -58.8 -39.6 11.9 -16.2 0.0 448 192 B d H >< S+ 0 0 17 -4,-1.9 3,-0.6 1,-0.2 -2,-0.2 0.696 103.9 61.0 -78.8 -20.9 12.3 -16.5 3.8 449 193 B Y T 3< S+ 0 0 47 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.420 109.2 47.3 -80.3 5.8 9.3 -18.8 4.2 450 194 B Q T < S+ 0 0 168 -3,-0.7 -1,-0.2 -5,-0.2 -2,-0.2 0.225 91.1 81.2-131.1 5.1 11.2 -21.1 1.9 451 195 B D X - 0 0 92 -3,-0.6 3,-1.3 3,-0.1 -1,-0.1 -0.987 65.8-157.0-110.0 115.4 14.7 -21.2 3.5 452 196 B P T 3 S+ 0 0 91 0, 0.0 -86,-0.4 0, 0.0 -87,-0.1 0.491 93.5 57.7 -79.2 2.1 14.4 -23.7 6.3 453 197 B G T 3 S+ 0 0 17 -88,-0.1 -90,-2.2 -89,-0.1 2,-0.6 0.425 87.6 91.9-102.9 -7.9 17.4 -21.9 8.0 454 198 B d < + 0 0 26 -3,-1.3 -3,-0.1 -6,-0.2 -92,-0.1 -0.810 41.2 163.4 -81.3 121.0 15.5 -18.7 8.0 455 199 B c + 0 0 8 -2,-0.6 2,-0.3 -85,-0.0 -1,-0.1 -0.323 24.2 143.0-130.5 48.2 13.6 -18.2 11.2 456 200 B D - 0 0 94 -8,-0.2 2,-1.2 -11,-0.1 -2,-0.1 -0.694 52.8-135.1 -82.1 140.4 13.0 -14.5 10.8 457 201 B F + 0 0 76 -2,-0.3 2,-1.1 -18,-0.0 -1,-0.1 -0.599 35.5 170.3 -95.8 68.0 9.6 -13.3 12.1 458 202 B V - 0 0 44 -2,-1.2 -18,-0.5 -13,-0.1 2,-0.1 -0.747 17.7-175.8 -78.5 102.4 9.0 -11.2 9.0 459 203 B T B -A 439 0A 23 -2,-1.1 2,-0.2 -20,-0.1 -20,-0.2 -0.415 26.3-105.0 -95.9 172.4 5.4 -10.3 9.7 460 204 B N > - 0 0 26 -22,-1.4 4,-2.2 -23,-0.2 5,-0.2 -0.609 38.2-104.6 -89.7 163.1 2.8 -8.4 7.7 461 205 B R H > S+ 0 0 100 -2,-0.2 4,-1.5 1,-0.2 5,-0.2 0.808 116.9 53.6 -60.4 -31.9 1.8 -4.9 8.8 462 206 B A H > S+ 0 0 21 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.959 110.2 44.2 -70.7 -50.1 -1.5 -6.0 10.3 463 207 B Y H > S+ 0 0 22 -26,-0.3 4,-2.9 1,-0.2 5,-0.4 0.883 110.7 56.6 -61.1 -40.2 -0.2 -8.7 12.6 464 208 B A H X S+ 0 0 5 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.909 115.1 36.6 -59.5 -41.0 2.7 -6.4 13.7 465 209 B I H X S+ 0 0 56 -4,-1.5 4,-2.6 -5,-0.2 5,-0.2 0.940 119.7 46.3 -79.9 -45.9 0.3 -3.7 14.9 466 210 B A H X S+ 0 0 19 -4,-2.9 4,-2.9 2,-0.2 5,-0.3 0.920 114.7 48.5 -59.0 -48.1 -2.5 -6.0 16.2 467 211 B S H X S+ 0 0 19 -4,-2.9 4,-3.1 -5,-0.3 5,-0.5 0.931 112.9 47.2 -59.8 -49.9 0.1 -8.2 18.1 468 212 B S H X>S+ 0 0 0 -4,-1.6 5,-2.4 -5,-0.4 4,-2.0 0.934 116.1 43.9 -57.3 -49.0 1.8 -5.2 19.6 469 213 B I H <>S+ 0 0 73 -4,-2.6 5,-2.5 3,-0.2 -2,-0.2 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