==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 02-NOV-09 3KJ6 . COMPND 2 MOLECULE: BETA-2 ADRENERGIC RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.P.BOKOCH,Y.ZOU,S.G.F.RASMUSSEN,C.W.LIU,R.NYGAARD, . 653 8 5 4 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32116.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 432 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 162 24.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 1 0.2 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 . 63 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 18.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.4 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 5 1 2 3 0 1 0 1 0 0 1 0 1 0 0 0 0 0 2 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 . 5 4 8 1 5 7 0 0 2 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 4 2 1 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 35 A G > 0 0 102 0, 0.0 4,-1.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -54.7 11.0 35.0 25.4 2 36 A M H > + 0 0 76 1,-0.2 4,-1.1 2,-0.2 5,-0.1 0.770 360.0 59.8 -70.6 -26.5 12.4 38.3 26.5 3 37 A G H >4 S+ 0 0 40 2,-0.2 3,-0.5 1,-0.2 -1,-0.2 0.940 105.5 44.7 -67.0 -49.7 11.0 37.7 30.0 4 38 A I H >4 S+ 0 0 134 1,-0.2 3,-1.2 2,-0.2 4,-0.5 0.801 108.4 60.7 -64.0 -29.2 13.0 34.5 30.6 5 39 A V H >< S+ 0 0 63 -4,-1.2 3,-0.7 1,-0.3 4,-0.5 0.836 100.7 53.4 -66.3 -32.7 16.0 36.2 29.1 6 40 A M T S+ 0 0 65 -3,-1.2 4,-0.9 2,-0.2 -1,-0.2 0.773 88.6 55.4 -82.1 -28.1 15.8 35.9 34.5 8 42 A L H <> S+ 0 0 74 -3,-0.7 4,-0.9 -4,-0.5 3,-0.2 0.821 100.1 60.4 -71.1 -33.2 19.6 35.4 34.1 9 43 A I H > S+ 0 0 80 -4,-0.5 4,-0.6 1,-0.2 3,-0.3 0.834 97.2 61.1 -62.2 -33.2 20.2 39.0 35.0 10 44 A V H >< S+ 0 0 27 -4,-0.6 3,-1.5 1,-0.2 4,-0.4 0.910 98.7 54.2 -61.2 -44.6 18.5 38.3 38.3 11 45 A L H >X S+ 0 0 117 -4,-0.9 3,-0.9 1,-0.3 4,-0.9 0.805 101.3 61.1 -59.9 -29.3 21.2 35.7 39.2 12 46 A A H 3X S+ 0 0 42 -4,-0.9 4,-0.9 -3,-0.3 -1,-0.3 0.730 105.2 47.5 -68.6 -22.0 23.7 38.4 38.5 13 47 A I H << S+ 0 0 2 -3,-1.5 36,-0.3 -4,-0.6 -1,-0.2 0.404 116.5 43.2 -98.8 -0.4 22.2 40.5 41.3 14 48 A V H <4 S+ 0 0 38 -3,-0.9 -2,-0.2 -4,-0.4 -3,-0.1 0.351 127.3 28.6-121.3 -2.4 22.1 37.5 43.7 15 49 A F H X S+ 0 0 48 -4,-0.9 4,-1.9 -5,-0.2 3,-0.4 0.620 115.8 54.3-124.4 -40.5 25.6 36.3 42.9 16 50 A G T < S+ 0 0 16 -4,-0.9 -3,-0.2 -5,-0.4 -4,-0.1 0.676 116.4 41.8 -71.4 -17.8 27.6 39.3 41.8 17 51 A N T > S+ 0 0 2 2,-0.1 4,-1.0 3,-0.1 -1,-0.2 0.446 110.9 55.8-107.5 -5.3 26.6 41.0 45.1 18 52 A V H > S+ 0 0 64 -3,-0.4 4,-2.0 2,-0.2 5,-0.3 0.806 100.3 56.7 -91.1 -38.8 27.1 38.0 47.3 19 53 A L H < S+ 0 0 19 -4,-1.9 -2,-0.1 1,-0.2 -1,-0.1 0.632 111.9 47.6 -65.8 -12.6 30.7 37.4 46.2 20 54 A V H > S+ 0 0 24 -5,-0.1 4,-1.9 2,-0.1 5,-0.2 0.844 107.6 51.4 -93.3 -43.6 31.2 41.0 47.4 21 55 A I H X S+ 0 0 41 -4,-1.0 4,-1.3 1,-0.2 -2,-0.2 0.871 115.9 41.2 -63.6 -39.5 29.5 40.8 50.8 22 56 A T H < S+ 0 0 82 -4,-2.0 -1,-0.2 3,-0.2 -3,-0.1 0.683 108.6 63.4 -82.6 -19.0 31.4 37.7 51.9 23 57 A A H 4 S+ 0 0 7 -5,-0.3 7,-0.3 2,-0.2 -2,-0.2 0.959 106.7 40.5 -68.3 -53.0 34.6 39.1 50.4 24 58 A I H < 0 0 16 -4,-1.9 -2,-0.2 11,-0.1 -1,-0.2 0.911 360.0 360.0 -60.9 -44.3 34.8 42.1 52.8 25 59 A A < 0 0 85 -4,-1.3 -3,-0.2 -5,-0.2 -2,-0.2 0.907 360.0 360.0 -93.2 360.0 33.6 39.9 55.7 26 ! 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 27 61 A F >> 0 0 81 0, 0.0 3,-0.9 0, 0.0 4,-0.6 0.000 360.0 360.0 360.0 140.1 39.5 38.6 53.9 28 62 A E G >4 + 0 0 153 1,-0.2 3,-0.5 2,-0.2 -4,-0.0 0.815 360.0 54.0 -58.4 -33.5 41.6 40.7 56.3 29 63 A R G 34 S+ 0 0 91 1,-0.2 -1,-0.2 3,-0.0 -5,-0.1 0.751 104.8 53.1 -75.9 -25.0 43.0 42.7 53.5 30 64 A L G <4 S+ 0 0 33 -3,-0.9 2,-1.4 -7,-0.3 -1,-0.2 0.552 80.4 105.8 -87.1 -9.0 39.6 43.7 52.0 31 65 A Q << + 0 0 86 -4,-0.6 2,-0.3 -3,-0.5 -1,-0.1 -0.583 48.9 130.1 -78.1 92.1 38.4 45.0 55.4 32 66 A T > - 0 0 72 -2,-1.4 4,-0.7 1,-0.1 5,-0.1 -0.951 68.4-112.7-141.0 159.8 38.5 48.8 54.9 33 67 A V H >> S+ 0 0 27 -2,-0.3 4,-0.8 1,-0.2 3,-0.7 0.897 118.9 51.3 -59.3 -43.3 36.2 51.8 55.4 34 68 A T H 3> S+ 0 0 57 1,-0.3 4,-0.6 2,-0.2 3,-0.3 0.847 114.7 44.1 -62.9 -33.0 35.9 52.4 51.7 35 69 A N H 3> S+ 0 0 19 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.529 103.4 67.1 -86.0 -7.9 35.0 48.8 51.3 36 70 A Y H << S+ 0 0 49 -4,-0.7 -2,-0.2 -3,-0.7 -1,-0.2 0.638 106.4 40.0 -87.1 -16.5 32.7 49.1 54.2 37 71 A F H X S+ 0 0 1 -4,-0.8 4,-1.3 -3,-0.3 -2,-0.2 0.575 108.1 62.1-100.6 -17.9 30.4 51.3 52.2 38 72 A I H < S+ 0 0 46 -4,-0.6 4,-0.4 1,-0.2 -2,-0.2 0.752 104.3 49.4 -75.4 -25.3 30.9 49.3 49.1 39 73 A T T X S+ 0 0 31 -4,-0.7 4,-1.5 2,-0.2 -1,-0.2 0.671 103.4 60.6 -84.2 -20.5 29.3 46.4 51.0 40 74 A S H > S+ 0 0 4 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.882 107.2 44.6 -69.2 -40.2 26.5 48.8 52.0 41 75 A L H X S+ 0 0 14 -4,-1.3 4,-0.6 2,-0.2 -2,-0.2 0.678 106.9 62.3 -74.6 -19.5 25.7 49.2 48.3 42 76 A A H > S+ 0 0 4 -4,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.876 107.3 41.8 -71.8 -38.9 26.1 45.4 48.0 43 77 A C H X S+ 0 0 36 -4,-1.5 4,-2.7 2,-0.2 5,-0.3 0.879 111.6 54.7 -73.7 -39.7 23.1 44.9 50.3 44 78 A A H < S+ 0 0 14 -4,-1.8 4,-0.5 1,-0.2 -1,-0.2 0.714 115.8 41.4 -64.2 -20.0 21.2 47.7 48.6 45 79 A D H < S+ 0 0 6 -4,-0.6 4,-0.3 2,-0.2 -2,-0.2 0.776 113.8 49.7 -97.1 -33.9 21.8 45.8 45.4 46 80 A L H X S+ 0 0 46 -4,-2.1 4,-1.0 2,-0.2 3,-0.2 0.836 111.6 49.5 -73.1 -34.9 21.2 42.3 46.7 47 81 A V H X>S+ 0 0 60 -4,-2.7 4,-1.5 1,-0.2 5,-0.5 0.876 110.6 49.6 -70.4 -38.2 17.9 43.4 48.4 48 82 A M H 4>S+ 0 0 4 -4,-0.5 5,-2.1 -5,-0.3 -1,-0.2 0.577 112.1 51.5 -75.1 -9.1 16.8 45.0 45.1 49 83 A G H 45S+ 0 0 0 -4,-0.3 -1,-0.2 -36,-0.3 -2,-0.2 0.635 118.1 33.4-100.2 -19.4 17.7 41.7 43.4 50 84 A L H <5S+ 0 0 98 -4,-1.0 -2,-0.2 -3,-0.3 -3,-0.1 0.499 134.1 25.0-110.8 -10.1 15.8 39.4 45.7 51 85 A A T <5S+ 0 0 32 -4,-1.5 -3,-0.2 -5,-0.1 4,-0.1 0.623 130.3 27.8-126.9 -27.6 12.8 41.6 46.5 52 86 A V T >4 S+ 0 0 47 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.975 118.1 37.8 -57.3 -63.3 11.9 39.3 40.6 55 89 A F H 34 S+ 0 0 156 1,-0.3 -2,-0.2 2,-0.2 -3,-0.1 0.777 115.9 56.0 -61.2 -27.9 8.4 40.5 41.5 56 90 A G H 3< 0 0 47 -4,-1.6 -1,-0.3 4,-0.1 -3,-0.1 0.572 360.0 360.0 -81.3 -9.8 8.9 43.5 39.2 57 91 A A << 0 0 94 -3,-1.7 -2,-0.2 -4,-0.7 -50,-0.1 0.737 360.0 360.0-102.5 360.0 9.7 41.2 36.2 58 ! 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 59 108 A F > 0 0 217 0, 0.0 4,-0.8 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -19.7 5.9 47.0 51.0 60 109 A W H > + 0 0 103 2,-0.2 4,-0.7 3,-0.1 -4,-0.1 0.782 360.0 36.4 -84.0 -32.5 7.2 45.9 47.6 61 110 A T H > S+ 0 0 88 2,-0.2 4,-1.4 1,-0.1 5,-0.2 0.698 108.9 66.3 -88.5 -24.4 7.5 49.6 46.5 62 111 A S H > S+ 0 0 77 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.874 106.6 41.3 -62.6 -38.4 8.5 50.6 50.0 63 112 A I H X S+ 0 0 22 -4,-0.8 4,-2.1 2,-0.2 -1,-0.2 0.785 104.5 65.8 -80.2 -29.7 11.8 48.6 49.6 64 113 A D H X S+ 0 0 31 -4,-0.7 4,-1.3 1,-0.2 -2,-0.2 0.849 109.8 39.2 -60.1 -34.7 12.2 49.8 46.0 65 114 A V H X S+ 0 0 40 -4,-1.4 4,-3.1 2,-0.2 5,-0.2 0.924 110.5 57.1 -78.7 -49.2 12.7 53.3 47.5 66 115 A L H < S+ 0 0 74 -4,-1.7 -2,-0.2 1,-0.2 -3,-0.1 0.824 110.9 46.7 -51.0 -35.7 14.7 52.3 50.5 67 116 A C H >X S+ 0 0 9 -4,-2.1 3,-1.3 2,-0.2 4,-1.1 0.981 118.3 35.4 -72.2 -60.1 17.3 50.6 48.2 68 117 A V H 3X S+ 0 0 13 -4,-1.3 4,-1.4 1,-0.3 3,-0.4 0.864 114.2 56.8 -66.0 -38.7 17.8 53.4 45.6 69 118 A T H 3< S+ 0 0 20 -4,-3.1 -1,-0.3 1,-0.2 -2,-0.2 0.420 110.1 48.4 -74.8 3.3 17.5 56.2 48.1 70 119 A A H <> S+ 0 0 3 -3,-1.3 4,-1.6 -5,-0.2 -1,-0.2 0.585 106.3 55.7-111.4 -22.8 20.3 54.6 50.0 71 120 A S H >X S+ 0 0 10 -4,-1.1 4,-3.0 -3,-0.4 3,-0.6 0.990 111.8 38.4 -72.2 -66.4 22.6 54.0 47.0 72 121 A I H 3< S+ 0 0 5 -4,-1.4 4,-0.5 1,-0.3 -1,-0.2 0.696 116.8 58.0 -58.0 -17.9 22.9 57.6 45.7 73 122 A E H 3> S+ 0 0 30 -5,-0.3 4,-1.0 2,-0.2 -1,-0.3 0.881 110.1 39.3 -78.8 -41.4 22.9 58.5 49.4 74 123 A T H S+ 0 0 18 -4,-0.5 4,-1.4 -5,-0.3 -1,-0.2 0.852 105.3 57.0 -76.2 -37.9 27.6 60.9 48.6 77 126 A V H X S+ 0 0 37 -4,-1.0 4,-1.9 1,-0.2 -2,-0.2 0.865 107.2 50.3 -59.9 -37.7 29.2 59.3 51.7 78 127 A I H X S+ 0 0 21 -4,-2.3 4,-3.2 2,-0.2 5,-0.4 0.966 107.6 49.1 -66.4 -55.6 32.1 58.0 49.6 79 128 A A H < S+ 0 0 4 -4,-1.4 4,-0.4 1,-0.2 -1,-0.2 0.761 116.8 45.1 -58.6 -25.9 33.0 61.2 47.8 80 129 A V H X S+ 0 0 51 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.810 113.8 48.2 -86.0 -34.2 33.0 63.0 51.2 81 130 A D H < S+ 0 0 12 -4,-1.9 4,-0.4 2,-0.2 -2,-0.2 0.930 111.5 48.4 -70.0 -47.4 34.9 60.3 53.0 82 131 A R T X S+ 0 0 9 -4,-3.2 4,-1.4 1,-0.2 3,-0.2 0.747 108.9 57.0 -66.3 -23.5 37.6 60.0 50.3 83 132 A Y H > S+ 0 0 66 -4,-0.4 4,-2.5 -5,-0.4 5,-0.4 0.923 101.4 53.0 -71.5 -46.4 37.9 63.8 50.4 84 133 A F H < S+ 0 0 111 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.564 111.6 51.2 -64.2 -7.1 38.7 63.8 54.1 85 134 A A H 4 S+ 0 0 6 -4,-0.4 8,-0.5 -3,-0.2 -1,-0.2 0.749 112.8 40.1-100.4 -33.2 41.4 61.4 53.2 86 135 A I H < S+ 0 0 11 -4,-1.4 -2,-0.2 -3,-0.3 -3,-0.1 0.927 118.6 44.8 -80.7 -50.8 43.1 63.3 50.4 87 136 A T S < S+ 0 0 80 -4,-2.5 -1,-0.2 -5,-0.1 -3,-0.2 0.628 97.7 113.0 -64.4 -11.2 42.9 66.7 52.0 88 137 A S - 0 0 20 -5,-0.4 -3,-0.1 1,-0.1 6,-0.0 -0.204 66.4-142.9 -60.4 153.9 44.1 64.8 55.0 89 138 A P S S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.836 81.7 36.8 -88.9 -36.0 47.6 65.5 56.4 90 139 A F S S- 0 0 185 1,-0.3 2,-0.3 3,-0.1 -5,-0.0 0.926 113.3 -5.2 -88.1 -93.6 48.8 62.1 57.4 91 140 A K S S- 0 0 118 2,-0.2 2,-2.2 67,-0.1 -1,-0.3 -0.708 73.7 -98.0-106.7 156.1 48.0 58.9 55.4 92 141 A Y S S+ 0 0 49 -2,-0.3 2,-0.3 -3,-0.1 -6,-0.1 -0.528 90.6 108.0 -68.1 82.9 45.8 58.3 52.4 93 142 A Q S S- 0 0 116 -2,-2.2 -2,-0.2 -8,-0.5 -3,-0.1 -0.925 72.4-109.8-169.6 129.5 43.1 57.1 54.8 94 143 A S - 0 0 15 -2,-0.3 -9,-0.1 1,-0.1 -61,-0.1 -0.268 19.0-134.4 -66.2 151.6 39.8 58.4 56.2 95 144 A L S S+ 0 0 122 -14,-0.2 2,-0.5 -11,-0.1 -1,-0.1 0.491 73.7 113.0 -85.3 -4.0 39.5 59.5 59.8 96 145 A L - 0 0 59 -15,-0.1 -63,-0.1 1,-0.1 5,-0.1 -0.592 66.2-136.2 -70.0 118.1 36.3 57.6 60.1 97 146 A T > - 0 0 59 -2,-0.5 4,-1.1 1,-0.1 3,-0.3 -0.293 19.9-107.1 -75.7 161.3 36.9 54.7 62.5 98 147 A K H > S+ 0 0 73 1,-0.2 4,-0.8 2,-0.2 3,-0.3 0.881 122.0 42.1 -54.4 -43.2 35.7 51.1 61.9 99 148 A N H > S+ 0 0 108 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.727 113.9 51.3 -80.0 -22.7 33.0 51.4 64.6 100 149 A K H > S+ 0 0 125 -3,-0.3 4,-0.7 2,-0.2 -1,-0.2 0.511 104.6 59.2 -88.2 -7.4 32.1 54.9 63.5 101 150 A A H X S+ 0 0 0 -4,-1.1 4,-0.7 -3,-0.3 -2,-0.2 0.739 103.3 51.4 -86.6 -27.9 31.7 53.6 60.0 102 151 A R H X S+ 0 0 158 -4,-0.8 4,-2.1 -5,-0.2 -2,-0.2 0.820 108.3 51.3 -75.4 -33.2 29.1 51.1 61.1 103 152 A V H X S+ 0 0 87 -4,-0.8 4,-1.1 2,-0.2 -1,-0.2 0.793 111.0 46.9 -76.2 -29.0 27.1 53.8 62.9 104 153 A I H X S+ 0 0 54 -4,-0.7 4,-0.7 2,-0.2 -1,-0.2 0.652 111.4 53.8 -84.2 -17.3 27.0 56.0 59.8 105 154 A I H X S+ 0 0 19 -4,-0.7 4,-1.0 2,-0.2 -2,-0.2 0.883 109.3 46.2 -77.6 -43.6 26.1 53.0 57.8 106 155 A L H X S+ 0 0 97 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.819 111.6 53.1 -67.2 -31.6 23.1 52.2 60.0 107 156 A M H X S+ 0 0 44 -4,-1.1 4,-2.0 1,-0.2 5,-0.2 0.766 100.6 60.8 -75.6 -26.6 22.1 55.9 59.9 108 157 A V H X S+ 0 0 23 -4,-0.7 4,-1.1 2,-0.2 -1,-0.2 0.849 108.2 44.7 -67.2 -34.1 22.1 55.8 56.1 109 158 A W H X S+ 0 0 107 -4,-1.0 4,-1.2 2,-0.2 -2,-0.2 0.930 112.1 49.4 -74.9 -48.3 19.4 53.2 56.1 110 159 A I H X S+ 0 0 94 -4,-1.8 4,-2.2 1,-0.2 3,-0.4 0.921 115.2 43.6 -58.9 -47.6 17.2 54.8 58.7 111 160 A V H < S+ 0 0 99 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.853 113.3 52.6 -65.6 -35.0 17.2 58.2 57.0 112 161 A S H < S+ 0 0 6 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.677 111.5 48.5 -73.0 -17.8 16.7 56.4 53.7 113 162 A G H < S+ 0 0 47 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.816 103.7 55.7 -90.5 -36.8 13.7 54.6 55.2 114 163 A L < 0 0 156 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.522 360.0 360.0 -72.5 -4.5 12.0 57.7 56.8 115 164 A T 0 0 71 -4,-0.3 -1,-0.2 -5,-0.2 -2,-0.2 0.338 360.0 360.0-117.1 360.0 12.1 59.1 53.2 116 ! 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 0.0 117 203 A S > 0 0 96 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -3.8 11.5 63.7 46.8 118 204 A S T 4> + 0 0 55 1,-0.2 5,-2.3 2,-0.2 67,-0.0 0.513 360.0 46.4 -74.4 -4.4 13.7 63.6 43.8 119 205 A I T 4>S+ 0 0 116 3,-0.2 5,-2.1 4,-0.2 -1,-0.2 0.652 116.2 42.6-104.5 -26.4 15.3 66.7 45.1 120 206 A V T 45S+ 0 0 105 3,-0.2 -2,-0.2 4,-0.1 -5,-0.0 0.810 131.5 21.8 -87.8 -34.1 15.7 65.5 48.7 121 207 A S T <5S+ 0 0 15 -4,-2.7 -3,-0.2 3,-0.1 -2,-0.1 0.417 139.0 22.2-117.0 -2.3 16.9 62.0 47.9 122 208 A F T >5S+ 0 0 29 -5,-0.3 4,-1.3 3,-0.0 5,-0.2 0.615 121.8 41.3-126.2 -59.9 18.3 62.4 44.4 123 209 A Y H >> S+ 0 0 9 -4,-0.5 4,-0.7 -5,-0.4 -1,-0.2 0.792 107.3 44.3 -62.7 -28.9 28.4 64.1 45.4 130 216 A V H X S+ 0 0 66 -4,-1.6 4,-1.3 -3,-0.4 -1,-0.2 0.851 118.5 40.5 -85.0 -37.9 29.5 65.4 42.0 131 217 A F H X S+ 0 0 143 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.900 114.6 50.4 -78.4 -43.2 31.2 68.6 43.2 132 218 A V H X S+ 0 0 42 -4,-3.0 4,-1.0 1,-0.2 -3,-0.2 0.880 116.4 43.5 -61.4 -37.7 32.8 67.1 46.4 133 219 A Y H X S+ 0 0 50 -4,-0.7 4,-2.5 -5,-0.4 -1,-0.2 0.808 108.6 57.6 -76.8 -31.5 34.2 64.3 44.2 134 220 A S H X S+ 0 0 55 -4,-1.3 4,-1.5 1,-0.2 -2,-0.2 0.913 105.3 51.5 -62.5 -42.3 35.2 66.8 41.5 135 221 A R H X S+ 0 0 162 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.853 110.5 51.4 -59.3 -35.8 37.3 68.6 44.1 136 222 A V H X S+ 0 0 1 -4,-1.0 4,-2.7 2,-0.2 -2,-0.2 0.959 107.3 47.6 -68.4 -54.8 38.9 65.2 44.9 137 223 A F H < S+ 0 0 91 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.794 114.2 50.8 -59.4 -28.8 39.9 64.1 41.4 138 224 A Q H >X S+ 0 0 120 -4,-1.5 4,-1.8 -5,-0.2 3,-0.9 0.925 112.8 42.3 -75.1 -47.4 41.4 67.6 40.9 139 225 A E H 3X S+ 0 0 68 -4,-2.0 4,-2.3 1,-0.2 5,-0.3 0.826 108.5 62.0 -66.5 -31.9 43.4 67.6 44.1 140 226 A A H 3X S+ 0 0 0 -4,-2.7 4,-0.7 1,-0.2 -1,-0.2 0.646 106.4 46.2 -69.0 -15.6 44.4 64.0 43.4 141 227 A K H <> S+ 0 0 45 -3,-0.9 4,-1.4 -4,-0.3 -2,-0.2 0.831 109.1 51.8 -91.6 -42.5 46.1 65.3 40.2 142 228 A R H < S+ 0 0 179 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.1 0.899 120.6 36.4 -57.8 -41.7 47.9 68.2 41.8 143 229 A Q H >< S+ 0 0 65 -4,-2.3 3,-1.3 1,-0.2 4,-0.3 0.827 105.1 70.2 -81.0 -34.6 49.3 65.8 44.4 144 230 A L H 3< S+ 0 0 22 -4,-0.7 3,-0.2 1,-0.3 -2,-0.2 0.852 113.8 26.2 -54.1 -40.7 49.7 62.9 42.0 145 231 A Q T 3< S+ 0 0 84 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.107 94.7 89.2-116.4 21.4 52.6 64.6 40.2 146 232 A K S < S+ 0 0 78 -3,-1.3 -1,-0.2 2,-0.1 -2,-0.2 0.404 72.6 113.2 -82.2 -1.9 53.8 66.8 43.0 147 233 A I S S- 0 0 53 -4,-0.3 2,-0.2 -3,-0.2 13,-0.0 -0.366 89.9 -88.2 -68.3 146.6 55.8 63.6 43.5 148 234 A D > - 0 0 80 1,-0.2 3,-2.2 2,-0.1 -1,-0.1 -0.415 33.4-143.4 -56.8 118.5 59.6 63.6 43.0 149 235 A K T 3 S+ 0 0 19 1,-0.3 -1,-0.2 -2,-0.2 4,-0.2 0.831 100.5 62.8 -56.8 -32.9 60.0 62.8 39.3 150 236 A S T >> S+ 0 0 7 2,-0.1 4,-1.9 3,-0.1 3,-1.4 0.723 80.9 100.8 -62.3 -22.1 63.1 60.8 40.2 151 237 A E T <4 S+ 0 0 92 -3,-2.2 -4,-0.0 1,-0.2 -1,-0.0 -0.559 87.9 18.7 -73.5 106.3 60.8 58.6 42.3 152 238 A G T 34 S+ 0 0 5 -2,-0.8 324,-2.0 323,-0.1 -1,-0.2 0.229 124.4 49.7 122.3 -12.1 60.2 55.4 40.2 153 239 A R T <4 S+ 0 0 3 -3,-1.4 391,-0.2 322,-0.2 392,-0.2 0.483 125.7 21.7-130.0 -18.2 63.0 55.5 37.7 154 240 A F S < S+ 0 0 12 -4,-1.9 -3,-0.1 390,-0.1 -4,-0.1 -0.137 75.4 149.5-135.9 39.5 66.0 56.1 39.9 155 241 A H 0 0 85 1,-0.2 -1,-0.1 319,-0.1 -2,-0.0 0.882 360.0 360.0 -34.7 -73.8 64.5 54.8 43.2 156 242 A V 0 0 127 -4,-0.0 -1,-0.2 -3,-0.0 127,-0.1 -0.747 360.0 360.0-169.5 360.0 67.9 53.6 44.4 157 ! 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 0.0 158 263 A K 0 0 111 0, 0.0 2,-0.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 127.2 51.4 58.2 50.5 159 264 A F + 0 0 11 -73,-0.1 2,-0.2 3,-0.1 -73,-0.0 -0.497 360.0 153.9 -69.2 125.5 49.2 59.0 47.6 160 265 A C - 0 0 46 -2,-0.3 4,-0.4 -15,-0.0 -16,-0.1 -0.702 60.1 -73.8-138.4-169.7 50.6 57.6 44.4 161 266 A L S S+ 0 0 16 1,-0.2 4,-0.1 -2,-0.2 339,-0.1 0.738 127.9 53.8 -65.6 -24.6 49.7 56.3 40.9 162 267 A K S > S+ 0 0 109 1,-0.2 3,-1.8 2,-0.2 4,-0.4 0.930 108.4 46.9 -73.2 -48.0 48.2 53.1 42.4 163 268 A E T 3 S+ 0 0 55 1,-0.3 4,-0.3 2,-0.2 -2,-0.2 0.513 103.2 68.2 -70.7 -3.4 46.0 55.1 44.8 164 269 A H T 3 S+ 0 0 21 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.511 96.6 51.1 -92.3 -8.5 45.1 57.1 41.8 165 270 A K S <> S+ 0 0 65 -3,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.472 96.5 68.7-101.4 -8.1 43.3 54.2 40.2 166 271 A A H > S+ 0 0 22 -4,-0.4 4,-0.6 2,-0.2 -2,-0.2 0.731 102.6 46.0 -76.6 -24.5 41.3 53.6 43.4 167 272 A L H 4 S+ 0 0 4 -4,-0.3 4,-0.3 2,-0.2 -1,-0.2 0.474 109.0 57.2 -93.4 -6.9 39.5 56.9 42.6 168 273 A K H > S+ 0 0 76 2,-0.2 4,-1.6 3,-0.2 -2,-0.2 0.866 108.4 43.7 -83.5 -45.9 39.1 55.7 39.0 169 274 A T H X S+ 0 0 18 -4,-1.9 4,-0.9 1,-0.2 -2,-0.2 0.765 120.8 43.1 -69.4 -25.9 37.3 52.5 40.1 170 275 A L H X S+ 0 0 25 -4,-0.6 4,-0.6 2,-0.2 -1,-0.2 0.663 110.1 57.3 -89.2 -21.0 35.3 54.7 42.5 171 276 A G H 4 S+ 0 0 16 -4,-0.3 4,-0.3 2,-0.2 -2,-0.2 0.759 111.2 41.5 -79.7 -26.7 34.9 57.4 39.8 172 277 A I H X S+ 0 0 63 -4,-1.6 4,-1.1 2,-0.2 5,-0.2 0.792 110.3 55.1 -89.5 -33.0 33.2 55.1 37.4 173 278 A I H X S+ 0 0 15 -4,-0.9 4,-0.6 1,-0.2 -2,-0.2 0.740 117.1 40.0 -69.0 -21.9 31.0 53.3 40.0 174 279 A M H < S+ 0 0 11 -4,-0.6 4,-0.3 2,-0.1 -1,-0.2 0.602 114.8 52.9 -97.5 -18.1 29.8 56.8 40.8 175 280 A G H > S+ 0 0 35 -4,-0.3 4,-0.6 2,-0.1 -2,-0.2 0.506 109.6 47.6 -95.3 -7.7 29.7 57.9 37.2 176 281 A T H X S+ 0 0 40 -4,-1.1 4,-0.7 2,-0.2 -3,-0.1 0.766 102.8 59.4 -99.1 -35.8 27.6 54.9 36.1 177 282 A F H < S+ 0 0 10 -4,-0.6 4,-0.5 -5,-0.2 -2,-0.1 0.761 106.8 51.7 -63.2 -25.2 24.9 55.1 38.8 178 283 A T H >> S+ 0 0 30 -4,-0.3 4,-1.5 2,-0.2 3,-0.7 0.918 108.9 46.0 -78.5 -45.9 24.2 58.7 37.5 179 284 A L H 3< S+ 0 0 127 -4,-0.6 -2,-0.2 1,-0.2 -1,-0.2 0.510 114.2 51.9 -75.6 -3.5 23.8 57.8 33.8 180 285 A C T 3< S+ 0 0 13 -4,-0.7 -1,-0.2 16,-0.1 -2,-0.2 0.556 123.1 26.1-104.5 -14.0 21.6 54.9 34.9 181 286 A W T <> S+ 0 0 6 -3,-0.7 4,-1.3 -4,-0.5 -2,-0.2 0.311 105.0 77.0-131.0 3.7 19.2 56.9 37.1 182 287 A L H X S+ 0 0 21 -4,-1.5 4,-1.8 2,-0.2 -3,-0.1 0.944 95.4 46.2 -79.8 -53.4 19.5 60.4 35.6 183 288 A P H 4 S+ 0 0 54 0, 0.0 -1,-0.1 0, 0.0 9,-0.1 0.785 113.8 54.4 -58.5 -25.3 17.2 59.9 32.6 184 289 A F H 4 S+ 0 0 76 8,-0.2 -2,-0.2 2,-0.2 9,-0.1 0.919 112.3 39.2 -73.1 -46.7 14.8 58.2 35.0 185 290 A F H < 0 0 59 -4,-1.3 -1,-0.2 1,-0.2 -3,-0.1 0.626 360.0 360.0 -78.9 -14.2 14.7 61.2 37.4 186 291 A I < 0 0 173 -4,-1.8 -2,-0.2 -5,-0.0 -1,-0.2 0.935 360.0 360.0 -79.8 360.0 14.7 63.6 34.5 187 ! 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 0.0 188 307 A V > 0 0 147 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -42.6 9.7 54.5 27.6 189 308 A Y H > + 0 0 81 1,-0.2 4,-0.9 2,-0.2 5,-0.0 0.801 360.0 47.7 -63.3 -29.6 9.2 55.4 31.3 190 309 A I H 4 S+ 0 0 81 2,-0.2 -1,-0.2 1,-0.2 -6,-0.0 0.744 108.8 54.2 -81.3 -25.7 9.4 51.7 32.2 191 310 A L H > S+ 0 0 101 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.831 109.5 46.3 -76.8 -34.2 12.5 51.2 30.0 192 311 A L H X S+ 0 0 46 -4,-2.1 4,-0.9 2,-0.2 -8,-0.2 0.765 110.3 53.3 -77.2 -27.5 14.4 54.0 31.8 193 312 A N H < S+ 0 0 42 -4,-0.9 4,-0.3 -5,-0.2 -1,-0.2 0.517 108.8 52.4 -77.9 -7.2 13.2 52.4 35.0 194 313 A W H 4 S+ 0 0 112 2,-0.2 -2,-0.2 -3,-0.1 -1,-0.2 0.685 101.5 57.1 -96.0 -27.6 14.8 49.3 33.5 195 314 A I H >< S+ 0 0 57 -4,-1.1 3,-1.0 1,-0.2 4,-0.4 0.786 99.8 62.0 -69.4 -28.5 18.1 51.1 32.8 196 315 A G G >< S+ 0 0 0 -4,-0.9 3,-1.1 1,-0.3 -1,-0.2 0.864 97.3 55.5 -63.9 -37.2 18.1 51.8 36.5 197 316 A Y G > S+ 0 0 46 -4,-0.3 3,-0.9 1,-0.2 -1,-0.3 0.536 91.4 76.7 -73.8 -5.7 18.3 48.1 37.3 198 317 A V G X S+ 0 0 70 -3,-1.0 3,-1.7 1,-0.2 -1,-0.2 0.768 77.9 69.9 -76.3 -26.1 21.4 48.0 35.1 199 318 A N G <> S+ 0 0 14 -3,-1.1 4,-0.5 -4,-0.4 -1,-0.2 0.452 86.3 73.0 -69.1 1.9 23.5 49.5 37.8 200 319 A S G <4 S+ 0 0 0 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.606 99.1 41.1 -92.4 -14.9 23.0 46.2 39.6 201 320 A G T <4 S+ 0 0 35 -3,-1.7 -1,-0.2 -4,-0.1 -2,-0.2 0.225 105.0 66.5-114.6 11.3 25.3 44.2 37.3 202 321 A F T > S+ 0 0 20 -4,-0.2 4,-2.7 -3,-0.1 3,-0.4 0.741 84.8 68.7-101.3 -31.3 28.1 46.9 37.0 203 322 A N H X S+ 0 0 28 -4,-0.5 4,-0.9 1,-0.2 -2,-0.1 0.927 107.3 36.5 -55.9 -52.8 29.4 46.9 40.6 204 323 A P H 4 S+ 0 0 21 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.573 117.4 57.6 -77.9 -8.0 30.9 43.4 40.5 205 324 A L H >> S+ 0 0 56 -3,-0.4 3,-1.1 2,-0.1 4,-0.7 0.927 109.0 38.3 -86.0 -53.6 32.0 44.0 36.9 206 325 A I H 3< S+ 0 0 39 -4,-2.7 -3,-0.1 1,-0.3 -1,-0.1 0.705 105.0 72.3 -70.1 -20.0 34.1 47.1 37.2 207 326 A Y T 3< S+ 0 0 19 -4,-0.9 -1,-0.3 -5,-0.4 7,-0.1 0.243 95.0 57.2 -80.4 14.9 35.5 45.7 40.5 208 327 A C T <4 S+ 0 0 44 -3,-1.1 2,-1.4 5,-0.1 6,-0.5 0.783 108.7 32.2-104.3 -73.9 37.4 43.2 38.4 209 328 A R S < S+ 0 0 232 -4,-0.7 -2,-0.1 1,-0.2 3,-0.1 -0.261 127.5 40.9 -83.4 50.1 39.7 45.0 35.9 210 329 A S S S+ 0 0 38 -2,-1.4 -1,-0.2 1,-0.4 -3,-0.2 0.304 109.1 30.7-153.6 -56.3 40.2 47.9 38.2 211 330 A P S > S- 0 0 40 0, 0.0 3,-0.7 0, 0.0 -1,-0.4 -0.227 88.4 -89.1-104.3-165.7 40.7 47.2 41.9 212 331 A D T >> S+ 0 0 92 1,-0.2 3,-1.9 2,-0.1 4,-1.2 0.695 105.1 90.6 -76.8 -20.5 42.2 44.3 44.0 213 332 A F H 3> + 0 0 18 1,-0.3 4,-3.9 2,-0.2 5,-0.3 0.771 69.6 75.8 -49.3 -30.9 38.8 42.6 44.1 214 333 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