==== 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 TRANSFERASE 07-JUN-05 2BTW . COMPND 2 MOLECULE: ALR0975 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ANABAENA SP.; . AUTHOR D.VIVARES,P.ARNOUX,D.PIGNOL . 420 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16701.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 310 73.8 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 . 78 18.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 31 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.4 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 0 0 2 4 4 2 0 1 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 . 2 2 2 4 4 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 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 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 L 0 0 104 0, 0.0 149,-0.1 0, 0.0 6,-0.1 0.000 360.0 360.0 360.0 117.8 8.7 29.5 17.0 2 30 A S > - 0 0 25 147,-0.4 3,-2.2 1,-0.1 148,-0.0 -0.187 360.0-109.3 -56.6 149.3 6.3 32.1 15.6 3 31 A P T 3 S+ 0 0 133 0, 0.0 -1,-0.1 0, 0.0 146,-0.1 0.714 114.3 67.8 -63.6 -19.7 5.9 31.8 11.8 4 32 A N T 3 S+ 0 0 45 144,-0.1 181,-0.5 2,-0.0 2,-0.3 0.639 93.9 72.8 -70.2 -12.3 7.9 35.1 11.2 5 33 A L E < -A 184 0A 11 -3,-2.2 2,-0.6 179,-0.1 179,-0.2 -0.798 68.4-149.1-109.0 141.6 11.1 33.3 12.4 6 34 A I E -A 183 0A 24 177,-1.8 177,-3.2 -2,-0.3 2,-0.2 -0.965 23.3-135.6-107.1 115.2 13.2 30.7 10.7 7 35 A G E -A 182 0A 4 -2,-0.6 6,-0.6 175,-0.2 3,-0.5 -0.461 6.7-139.7 -69.0 139.5 14.8 28.4 13.2 8 36 A F S S+ 0 0 1 173,-2.9 2,-1.3 1,-0.3 -1,-0.2 0.799 100.5 76.4 -65.4 -25.7 18.4 27.5 12.6 9 37 A N S S+ 0 0 89 172,-0.5 2,-0.3 4,-0.1 -1,-0.3 -0.152 89.1 74.1 -78.5 41.7 17.3 24.0 13.7 10 38 A S S > S- 0 0 40 -2,-1.3 4,-2.1 -3,-0.5 5,-0.2 -0.963 91.6-108.7-146.8 162.8 15.7 23.5 10.3 11 39 A N H > S+ 0 0 103 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.925 120.6 50.8 -59.3 -40.7 16.7 22.7 6.7 12 40 A E H > S+ 0 0 132 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.920 110.8 48.5 -61.8 -46.5 15.7 26.3 5.7 13 41 A G H > S+ 0 0 0 -6,-0.6 4,-1.0 2,-0.2 -1,-0.2 0.797 110.6 48.9 -67.9 -32.3 17.8 27.8 8.5 14 42 A E H >X S+ 0 0 34 -4,-2.1 4,-2.4 2,-0.2 3,-0.6 0.942 111.8 51.1 -68.1 -44.9 20.9 25.8 7.8 15 43 A K H 3X S+ 0 0 138 -4,-2.3 4,-2.7 1,-0.3 -2,-0.2 0.855 103.2 58.5 -60.1 -38.2 20.5 26.8 4.1 16 44 A L H 3< S+ 0 0 14 -4,-2.2 4,-0.3 1,-0.2 -1,-0.3 0.841 109.3 45.7 -59.8 -34.1 20.2 30.5 5.0 17 45 A L H X< S+ 0 0 6 -4,-1.0 3,-0.8 -3,-0.6 -2,-0.2 0.915 112.9 48.8 -72.3 -41.8 23.6 30.1 6.6 18 46 A L H 3< S+ 0 0 56 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.828 116.6 42.9 -68.7 -30.8 25.0 28.2 3.6 19 47 A T T 3< S+ 0 0 61 -4,-2.7 -1,-0.2 -5,-0.2 2,-0.2 0.445 91.7 110.9 -91.5 -2.0 23.7 30.8 1.1 20 48 A S < - 0 0 5 -3,-0.8 3,-0.2 -4,-0.3 143,-0.2 -0.524 48.3-167.4 -76.7 142.1 24.7 33.8 3.3 21 49 A R S S+ 0 0 215 141,-0.5 2,-0.2 -2,-0.2 -1,-0.1 0.224 84.3 57.9-104.9 7.1 27.5 36.0 2.1 22 50 A S B S+B 162 0A 0 140,-0.9 140,-2.7 1,-0.1 111,-0.2 -0.687 70.7 108.3-138.6 78.8 27.8 37.8 5.5 23 51 A R >> + 0 0 45 138,-0.2 3,-1.0 -2,-0.2 4,-0.6 0.188 26.7 117.2-146.9 11.5 28.6 34.9 7.9 24 52 A E T >4 S+ 0 0 94 108,-1.0 3,-0.7 1,-0.2 109,-0.2 0.845 79.1 56.4 -54.6 -37.3 32.3 35.2 9.0 25 53 A D T 3> S+ 0 0 1 107,-1.0 4,-2.3 135,-0.3 5,-0.2 0.770 91.3 73.5 -69.4 -23.8 31.2 35.8 12.7 26 54 A F H <> S+ 0 0 0 134,-1.0 4,-2.8 -3,-1.0 -1,-0.2 0.872 91.7 54.7 -58.0 -42.4 29.2 32.5 12.7 27 55 A F H S+ 0 0 31 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.871 118.8 51.8 -58.4 -39.6 34.1 31.8 15.9 29 57 A L H >X S+ 0 0 0 -4,-2.3 3,-1.1 2,-0.2 4,-0.8 0.920 106.5 53.6 -61.5 -42.7 30.7 32.4 17.7 30 58 A S H >< S+ 0 0 0 -4,-2.8 3,-0.8 1,-0.3 -1,-0.2 0.907 106.6 54.0 -59.1 -36.7 29.6 28.8 17.1 31 59 A X H 3< S+ 0 0 20 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.721 117.3 35.3 -70.0 -23.0 32.9 27.7 18.7 32 60 A Q H << S+ 0 0 26 -3,-1.1 -1,-0.2 -4,-0.8 -2,-0.2 0.305 82.8 142.9-107.3 -2.4 32.1 29.8 21.9 33 61 A F << + 0 0 0 -4,-0.8 2,-0.3 -3,-0.8 -3,-0.1 -0.180 26.6 175.7 -49.3 126.9 28.3 29.3 22.0 34 62 A V - 0 0 25 211,-0.1 2,-0.5 11,-0.1 142,-0.2 -0.924 33.0-113.3-132.7 161.4 27.2 29.0 25.6 35 63 A T - 0 0 27 -2,-0.3 140,-0.2 140,-0.1 139,-0.1 -0.835 38.6-113.7 -93.6 126.5 24.0 28.7 27.6 36 64 A Q - 0 0 0 138,-2.2 6,-0.1 -2,-0.5 3,-0.1 -0.345 16.8-130.0 -48.6 135.7 23.1 31.7 29.8 37 65 A V S S- 0 0 71 1,-0.2 2,-0.3 4,-0.2 -1,-0.1 0.910 86.0 -30.3 -53.7 -44.0 23.2 30.8 33.5 38 66 A N S > S- 0 0 59 237,-0.0 3,-0.9 1,-0.0 -1,-0.2 -0.901 78.9 -79.1-160.3-178.2 19.7 32.4 33.7 39 67 A Q G > S+ 0 0 62 1,-0.3 3,-1.8 -2,-0.3 4,-0.2 0.866 125.6 57.2 -61.6 -37.0 17.8 35.1 31.9 40 68 A A G 3 S+ 0 0 18 1,-0.3 3,-0.4 51,-0.3 -1,-0.3 0.760 104.9 54.7 -66.9 -27.8 19.5 37.9 33.8 41 69 A Y G <> S+ 0 0 29 -3,-0.9 4,-2.5 1,-0.2 -1,-0.3 0.286 72.2 107.4 -87.7 8.6 22.8 36.6 32.6 42 70 A C H <> S+ 0 0 9 -3,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.882 82.9 47.8 -55.6 -41.5 22.0 36.7 28.8 43 71 A G H > S+ 0 0 0 -3,-0.4 4,-2.6 -4,-0.2 -1,-0.2 0.871 110.4 50.8 -65.1 -43.1 24.3 39.7 28.3 44 72 A V H > S+ 0 0 0 2,-0.2 4,-2.4 -4,-0.2 5,-0.2 0.926 111.1 48.4 -59.5 -46.6 27.1 38.1 30.2 45 73 A A H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.917 113.8 48.6 -57.6 -43.5 26.8 34.9 28.1 46 74 A S H X S+ 0 0 0 -4,-2.2 4,-1.5 -5,-0.2 -2,-0.2 0.896 110.8 49.0 -64.2 -46.3 26.8 37.2 25.0 47 75 A I H X S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.2 3,-0.3 0.938 109.6 51.4 -60.7 -50.3 29.9 39.2 26.1 48 76 A I H X S+ 0 0 6 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.846 106.1 54.0 -64.6 -31.5 32.0 36.2 26.8 49 77 A X H X S+ 0 0 0 -4,-1.6 4,-1.6 -5,-0.2 -1,-0.2 0.920 115.0 41.6 -61.9 -41.8 31.3 34.5 23.5 50 78 A V H X S+ 0 0 1 -4,-1.5 4,-1.7 -3,-0.3 -2,-0.2 0.921 115.4 49.6 -72.9 -43.7 32.5 37.7 21.8 51 79 A L H X>S+ 0 0 0 -4,-3.3 4,-1.2 1,-0.2 5,-1.0 0.897 111.9 47.4 -64.1 -44.6 35.4 38.2 24.2 52 80 A N H <5S+ 0 0 29 -4,-2.8 3,-0.4 -5,-0.2 -1,-0.2 0.912 112.2 52.0 -57.2 -38.0 36.6 34.6 23.7 53 81 A S H <5S+ 0 0 28 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.808 106.9 52.0 -73.1 -27.3 36.2 35.1 20.0 54 82 A L H <5S- 0 0 41 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.667 99.7-137.9 -82.4 -19.1 38.4 38.3 20.0 55 83 A G T <5 + 0 0 64 -4,-1.2 3,-0.2 -3,-0.4 -3,-0.1 0.709 49.0 150.9 74.5 22.2 41.2 36.4 21.9 56 84 A I < - 0 0 47 -5,-1.0 2,-0.9 1,-0.2 52,-0.1 0.672 61.6 -42.7 -60.4-143.7 41.7 39.4 24.2 57 85 A N - 0 0 74 50,-0.4 -1,-0.2 12,-0.0 12,-0.1 -0.856 68.4-158.4 -88.9 99.7 43.0 39.4 27.8 58 86 A A - 0 0 11 -2,-0.9 12,-0.1 -3,-0.2 -6,-0.0 -0.540 22.4 -99.6 -81.9 148.2 41.1 36.4 29.3 59 87 A P - 0 0 10 0, 0.0 10,-1.1 0, 0.0 2,-0.6 -0.238 26.2-141.6 -57.9 149.7 40.6 36.0 33.1 60 88 A E + 0 0 137 8,-0.2 2,-0.3 14,-0.1 8,-0.1 -0.927 39.1 152.8-116.6 100.0 43.0 33.6 34.9 61 89 A T > - 0 0 38 -2,-0.6 4,-1.4 6,-0.5 3,-0.2 -0.811 57.0-103.4-127.2 172.3 41.0 31.8 37.6 62 90 A A T 4 S+ 0 0 86 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.844 107.3 71.7 -59.9 -40.4 41.0 28.4 39.4 63 91 A Q T 4 S+ 0 0 84 1,-0.2 -1,-0.2 186,-0.0 4,-0.1 0.921 121.5 7.5 -46.1 -58.7 38.2 26.9 37.4 64 92 A Y T >4 S+ 0 0 25 -3,-0.2 3,-2.2 3,-0.2 -1,-0.2 0.373 96.7 172.9-112.1 6.5 40.3 26.5 34.2 65 93 A S T 3< + 0 0 66 -4,-1.4 3,-0.1 1,-0.4 -5,-0.0 -0.186 65.7 35.8 -57.2 143.7 43.8 27.4 35.3 66 94 A P T 3 S+ 0 0 104 0, 0.0 -1,-0.4 0, 0.0 2,-0.1 -0.998 116.3 77.9 -71.1 -5.3 46.5 27.2 33.8 67 95 A Y < - 0 0 82 -3,-2.2 -6,-0.5 -4,-0.1 2,-0.5 -0.401 69.8-145.0 -78.0 143.7 44.1 28.2 30.9 68 96 A R + 0 0 120 320,-0.2 2,-0.3 -8,-0.1 -8,-0.2 -0.935 36.9 142.4-106.4 126.2 42.7 31.7 30.4 69 97 A V - 0 0 12 -10,-1.1 2,-0.4 -2,-0.5 -5,-0.1 -0.969 49.9-110.8-159.7 144.3 39.2 31.8 29.1 70 98 A F + 0 0 4 -2,-0.3 2,-0.3 -22,-0.2 -18,-0.1 -0.723 42.8 167.0 -81.5 138.7 36.1 34.0 29.6 71 99 A T > - 0 0 25 -2,-0.4 4,-0.9 1,-0.1 -2,-0.0 -0.906 48.4-114.1-142.3 160.4 33.3 32.2 31.4 72 100 A Q T 4 S+ 0 0 16 -2,-0.3 4,-0.3 1,-0.2 3,-0.3 0.857 118.4 53.6 -64.7 -37.2 30.1 33.5 32.9 73 101 A D T 4 S+ 0 0 143 1,-0.2 3,-0.2 2,-0.1 -1,-0.2 0.813 117.5 35.4 -66.5 -34.8 31.4 32.5 36.4 74 102 A N T >4 S+ 0 0 7 1,-0.1 3,-2.1 2,-0.1 4,-0.3 0.464 85.5 100.2-100.5 0.3 34.7 34.5 35.9 75 103 A F G >< S+ 0 0 0 -4,-0.9 3,-0.7 -3,-0.3 -1,-0.1 0.817 84.0 49.8 -57.4 -37.4 33.5 37.5 34.0 76 104 A F G 3 S+ 0 0 19 -4,-0.3 -1,-0.3 -3,-0.2 6,-0.2 0.139 78.8 97.1 -89.7 18.1 33.4 39.7 37.1 77 105 A S G < + 0 0 55 -3,-2.1 2,-0.4 4,-0.1 -1,-0.2 0.804 64.1 93.2 -69.0 -28.4 37.0 38.8 38.2 78 106 A N S <> S- 0 0 31 -3,-0.7 4,-2.1 -4,-0.3 3,-0.2 -0.530 75.2-146.1 -67.0 117.5 38.1 42.1 36.4 79 107 A E H > S+ 0 0 138 -2,-0.4 4,-1.3 1,-0.2 -1,-0.1 0.908 98.6 51.0 -56.4 -46.0 38.1 44.8 39.0 80 108 A K H > S+ 0 0 125 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.844 106.9 55.5 -55.7 -39.2 36.9 47.5 36.5 81 109 A T H >> S+ 0 0 0 1,-0.2 4,-1.1 -3,-0.2 3,-0.8 0.938 105.4 50.8 -64.8 -47.3 34.0 45.2 35.4 82 110 A K H 3< S+ 0 0 87 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.827 106.3 57.1 -54.1 -35.1 32.7 45.0 38.9 83 111 A A H 3< S+ 0 0 87 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.747 97.0 61.6 -72.6 -26.2 32.8 48.8 39.2 84 112 A V H << S- 0 0 41 -4,-1.0 2,-0.3 -3,-0.8 -1,-0.2 0.949 130.1 -20.5 -63.6 -50.1 30.6 49.3 36.2 85 113 A I S < S- 0 0 18 -4,-1.1 -1,-0.3 14,-0.0 5,-0.0 -0.925 79.3 -95.0-163.2 136.6 27.7 47.4 38.0 86 114 A A > - 0 0 34 -2,-0.3 4,-2.0 -3,-0.2 3,-0.5 -0.227 26.5-131.5 -53.9 135.7 27.6 45.0 40.9 87 115 A P H > S+ 0 0 24 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.882 109.2 58.0 -51.6 -41.5 27.7 41.3 39.8 88 116 A E H > S+ 0 0 132 1,-0.2 4,-0.6 2,-0.2 5,-0.1 0.804 105.2 48.9 -60.3 -37.1 24.7 40.8 42.3 89 117 A V H >> S+ 0 0 53 -3,-0.5 4,-3.1 2,-0.2 3,-1.2 0.941 111.5 47.2 -70.2 -51.2 22.7 43.4 40.4 90 118 A V H 3X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.3 -2,-0.2 0.869 106.6 60.1 -58.1 -39.1 23.3 41.9 37.0 91 119 A A H 3< S+ 0 0 42 -4,-2.4 -51,-0.3 -5,-0.2 -1,-0.3 0.728 117.5 31.0 -59.9 -23.8 22.4 38.4 38.4 92 120 A R H << S+ 0 0 230 -3,-1.2 -2,-0.2 -4,-0.6 -1,-0.2 0.847 136.4 17.7-102.3 -45.1 18.9 39.7 39.3 93 121 A Q H < S- 0 0 110 -4,-3.1 -3,-0.2 1,-0.3 -2,-0.2 0.396 90.1-137.6-117.2 1.6 18.1 42.4 36.7 94 122 A G < - 0 0 7 -4,-1.8 2,-0.3 -5,-0.5 -1,-0.3 -0.435 35.5 -69.7 74.7-155.1 20.4 41.8 33.8 95 123 A X - 0 0 15 -2,-0.1 2,-0.1 -55,-0.1 -52,-0.1 -0.981 34.1-125.5-141.3 151.2 22.0 44.7 32.1 96 124 A T > - 0 0 6 -2,-0.3 4,-2.9 103,-0.1 5,-0.2 -0.377 38.4 -98.5 -84.9 172.2 20.9 47.6 29.9 97 125 A L H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.901 125.9 47.3 -57.2 -48.4 22.4 48.4 26.5 98 126 A D H > S+ 0 0 39 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.874 113.4 49.0 -60.2 -39.9 24.6 51.2 27.9 99 127 A E H > S+ 0 0 30 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.907 107.5 53.9 -67.7 -42.7 25.7 48.8 30.7 100 128 A L H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 5,-0.2 0.959 110.8 48.5 -52.2 -53.2 26.4 46.1 28.1 101 129 A G H X S+ 0 0 3 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.944 113.6 45.0 -47.7 -55.2 28.7 48.7 26.4 102 130 A R H X S+ 0 0 115 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.867 111.7 52.4 -63.9 -37.1 30.4 49.7 29.6 103 131 A L H < S+ 0 0 0 -4,-3.0 4,-0.4 2,-0.2 -1,-0.2 0.893 112.9 44.2 -66.4 -42.4 31.0 46.0 30.7 104 132 A I H ><>S+ 0 0 1 -4,-2.3 3,-1.8 -5,-0.2 5,-0.7 0.951 111.2 54.5 -65.5 -49.4 32.6 45.0 27.4 105 133 A A H ><5S+ 0 0 40 -4,-2.7 3,-1.8 1,-0.3 -1,-0.2 0.734 94.3 71.3 -54.4 -27.8 34.7 48.3 27.4 106 134 A S T 3<5S+ 0 0 8 -4,-1.2 -1,-0.3 1,-0.3 -26,-0.2 0.680 91.1 58.0 -70.9 -19.9 36.0 47.3 30.9 107 135 A Y T < 5S- 0 0 8 -3,-1.8 -50,-0.4 -4,-0.4 -1,-0.3 0.190 124.1-103.2 -89.3 15.4 38.1 44.5 29.3 108 136 A G T < 5S+ 0 0 62 -3,-1.8 2,-0.3 1,-0.3 -3,-0.2 0.694 77.4 132.4 76.6 21.0 39.9 47.0 27.1 109 137 A V < - 0 0 20 -5,-0.7 2,-0.4 1,-0.0 -1,-0.3 -0.723 62.7-103.6-100.3 160.9 38.1 46.4 23.8 110 138 A K - 0 0 159 100,-2.3 100,-2.2 -2,-0.3 2,-0.4 -0.647 42.6-175.8 -84.4 130.1 36.6 49.0 21.5 111 139 A V E -C 209 0A 39 -2,-0.4 2,-0.5 98,-0.2 98,-0.2 -0.983 18.6-166.1-134.7 137.0 32.8 49.3 21.7 112 140 A K E -C 208 0A 111 96,-2.3 96,-2.4 -2,-0.4 2,-0.5 -0.977 14.2-155.5-124.3 115.6 30.3 51.4 19.8 113 141 A V E -C 207 0A 38 -2,-0.5 2,-0.6 94,-0.2 94,-0.2 -0.815 8.6-169.2 -94.9 127.7 26.8 51.5 21.4 114 142 A N E -C 206 0A 10 92,-2.9 92,-2.2 -2,-0.5 2,-0.2 -0.860 6.7-160.4-125.0 95.8 24.0 52.2 19.1 115 143 A H E > -C 205 0A 9 -2,-0.6 3,-2.0 90,-0.2 4,-0.3 -0.523 25.7-127.5 -64.5 136.9 20.6 53.0 20.5 116 144 A A G > S+ 0 0 1 88,-2.8 3,-1.5 77,-0.4 78,-0.1 0.833 109.1 62.7 -54.2 -37.8 17.8 52.4 17.9 117 145 A S G 3 S+ 0 0 79 87,-0.4 -1,-0.3 1,-0.3 88,-0.1 0.620 102.4 51.1 -63.2 -16.3 16.5 56.0 18.6 118 146 A D G < S+ 0 0 131 -3,-2.0 -1,-0.3 2,-0.0 2,-0.2 0.394 120.1 27.8-102.4 -3.4 19.9 57.3 17.3 119 147 A T S < S- 0 0 29 -3,-1.5 2,-0.3 -4,-0.3 3,-0.0 -0.626 72.6-126.1-131.8-158.6 19.8 55.4 14.1 120 148 A N > - 0 0 58 -2,-0.2 4,-2.6 1,-0.0 5,-0.2 -0.933 33.5 -97.9-150.8 165.9 17.4 53.8 11.6 121 149 A I H > S+ 0 0 26 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.825 117.5 55.3 -57.8 -38.1 16.8 50.4 10.0 122 150 A E H > S+ 0 0 116 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.950 113.0 41.3 -66.4 -46.2 18.7 51.2 6.7 123 151 A D H > S+ 0 0 68 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.909 115.8 51.0 -66.2 -43.8 21.9 52.2 8.6 124 152 A F H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.950 112.8 45.4 -54.0 -53.1 21.5 49.2 11.1 125 153 A R H X S+ 0 0 59 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.944 117.8 43.3 -60.7 -45.9 21.1 46.8 8.3 126 154 A K H X S+ 0 0 135 -4,-2.2 4,-1.7 -5,-0.3 -1,-0.2 0.902 116.1 44.2 -69.9 -46.0 23.9 48.1 6.2 127 155 A Q H X S+ 0 0 63 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.882 116.7 46.6 -70.6 -38.6 26.5 48.6 9.0 128 156 A V H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 -2,-0.2 0.937 108.9 53.3 -70.5 -46.7 25.8 45.2 10.6 129 157 A A H < S+ 0 0 9 -4,-2.5 4,-0.4 -5,-0.3 -2,-0.2 0.862 112.2 47.8 -53.2 -39.3 25.8 43.2 7.3 130 158 A E H >X S+ 0 0 94 -4,-1.7 3,-1.3 2,-0.2 4,-0.5 0.929 110.8 50.4 -61.5 -52.9 29.3 44.8 6.7 131 159 A N H >< S+ 0 0 17 -4,-2.2 3,-1.4 1,-0.3 6,-0.2 0.866 103.1 59.3 -52.9 -42.0 30.4 43.9 10.2 132 160 A L T 3< S+ 0 0 0 -4,-2.6 -108,-1.0 1,-0.3 -107,-1.0 0.658 103.8 52.9 -68.8 -17.1 29.3 40.3 9.8 133 161 A K T <4 S+ 0 0 90 -3,-1.3 2,-0.3 -4,-0.4 -1,-0.3 0.550 98.1 80.1 -86.1 -16.2 31.7 40.0 6.8 134 162 A Q S X< S- 0 0 81 -3,-1.4 3,-0.6 -4,-0.5 2,-0.2 -0.739 75.7-131.2 -98.7 140.6 34.8 41.3 8.8 135 163 A D T 3 S+ 0 0 133 -2,-0.3 3,-0.1 1,-0.2 -2,-0.1 -0.542 90.6 28.6 -77.3 155.7 36.9 39.3 11.1 136 164 A G T 3 S+ 0 0 29 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.619 100.4 96.4 73.1 12.7 37.6 40.8 14.6 137 165 A N < + 0 0 42 -3,-0.6 2,-0.3 -6,-0.2 73,-0.2 -0.997 51.6 179.7-133.2 125.0 34.4 42.8 14.6 138 166 A F E -D 209 0A 4 71,-2.8 71,-2.5 -2,-0.4 2,-0.4 -0.908 15.7-147.1-127.6 157.2 31.3 41.4 16.4 139 167 A V E -DE 208 159A 0 20,-0.5 20,-2.7 -2,-0.3 2,-0.4 -0.993 7.5-170.0-126.7 135.6 27.7 42.6 17.0 140 168 A I E -DE 207 158A 0 67,-2.3 67,-2.8 -2,-0.4 2,-0.3 -0.982 14.5-151.7-120.7 132.6 25.5 42.0 20.0 141 169 A V E -DE 206 157A 0 16,-2.7 16,-1.9 -2,-0.4 2,-0.4 -0.831 8.2-159.7-107.7 148.1 21.8 43.0 19.8 142 170 A N E +DE 205 156A 3 63,-3.4 63,-0.9 -2,-0.3 2,-0.3 -0.995 31.9 149.3-124.5 120.4 19.5 44.0 22.6 143 171 A Y E - E 0 155A 0 12,-2.1 12,-2.6 -2,-0.4 2,-0.6 -0.982 51.9-100.7-153.1 161.4 15.8 43.7 21.8 144 172 A L E > - E 0 154A 22 48,-2.5 3,-0.9 -2,-0.3 4,-0.4 -0.795 30.8-149.7 -90.6 116.6 12.3 43.0 23.1 145 173 A R G > >S+ 0 0 3 8,-2.5 5,-2.7 -2,-0.6 3,-2.3 0.866 90.9 62.9 -56.1 -40.0 11.5 39.3 22.3 146 174 A K G > 5S+ 0 0 120 6,-2.1 3,-1.7 1,-0.3 -1,-0.2 0.849 93.7 64.5 -63.4 -30.9 7.7 39.8 22.0 147 175 A E G < 5S+ 0 0 49 -3,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.655 106.2 43.6 -62.9 -17.0 8.3 42.1 19.0 148 176 A I G < 5S- 0 0 1 -3,-2.3 -1,-0.3 -4,-0.4 -2,-0.2 0.283 129.5 -97.6-107.8 11.9 9.8 39.2 17.1 149 177 A G T < 5S+ 0 0 42 -3,-1.7 -147,-0.4 1,-0.3 -3,-0.2 0.644 84.5 126.8 86.4 17.9 7.0 36.9 18.3 150 178 A Q S > - F 0 168A 0 5,-3.4 5,-1.5 -2,-0.4 4,-1.4 -0.906 5.8-167.1-106.5 107.8 21.2 36.5 4.7 164 192 A E T 45S+ 0 0 62 -2,-0.8 3,-0.2 1,-0.2 -1,-0.2 0.907 83.4 57.5 -56.9 -49.0 20.9 38.9 1.8 165 193 A Q T 45S+ 0 0 151 1,-0.2 -1,-0.2 -146,-0.2 -145,-0.0 0.826 122.7 24.0 -53.9 -40.2 18.2 36.9 -0.1 166 194 A T T 45S- 0 0 33 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.473 99.6-126.5-108.2 -6.2 15.7 36.9 2.8 167 195 A D T <5 + 0 0 35 -4,-1.4 19,-2.3 1,-0.2 2,-0.4 0.973 62.3 141.0 56.3 54.0 16.9 40.0 4.7 168 196 A R E < -FG 163 185A 26 -5,-1.5 -5,-3.4 17,-0.3 2,-0.3 -0.977 43.4-146.0-128.0 146.4 17.2 38.0 7.9 169 197 A F E -FG 162 184A 0 15,-2.7 15,-2.9 -2,-0.4 2,-0.7 -0.854 18.2-125.8-108.2 144.2 19.8 38.1 10.6 170 198 A L E -FG 161 183A 0 -9,-2.9 -10,-2.6 -2,-0.3 -9,-0.6 -0.813 20.4-159.1 -92.7 116.3 21.0 35.1 12.6 171 199 A I E -FG 159 182A 0 11,-2.8 2,-1.7 -2,-0.7 11,-1.2 -0.850 11.7-146.6 -96.4 120.2 20.7 35.5 16.4 172 200 A X - 0 0 1 -14,-2.7 2,-0.5 -2,-0.6 4,-0.1 -0.621 26.3-152.1 -81.7 78.8 22.9 33.2 18.4 173 201 A D - 0 0 1 -2,-1.7 -16,-0.1 1,-0.2 6,-0.1 -0.394 14.8-160.5 -68.9 111.0 20.3 33.0 21.2 174 202 A V S S+ 0 0 0 -2,-0.5 -138,-2.2 -18,-0.3 2,-1.8 0.641 80.4 83.9 -65.3 -14.6 22.1 32.2 24.5 175 203 A S >> + 0 0 0 1,-0.2 3,-2.4 -140,-0.2 4,-2.3 -0.322 58.0 158.4 -77.2 56.0 18.7 31.0 26.0 176 204 A R T 34 + 0 0 19 -2,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.700 63.4 57.9 -64.7 -28.2 19.5 27.6 24.4 177 205 A Y T 34 S+ 0 0 35 -3,-0.2 -1,-0.3 1,-0.1 102,-0.2 0.538 118.9 33.5 -68.0 -8.3 17.2 25.6 26.7 178 206 A K T <4 S+ 0 0 54 -3,-2.4 -2,-0.2 1,-0.4 -1,-0.1 0.751 125.4 14.4-118.6 -50.5 14.3 27.8 25.4 179 207 A Y < - 0 0 28 -4,-2.3 -1,-0.4 -6,-0.1 3,-0.1 -0.953 63.1-129.1-132.2 154.9 15.0 28.7 21.9 180 208 A P - 0 0 16 0, 0.0 -5,-0.1 0, 0.0 2,-0.1 -0.377 54.9 -76.1 -79.9 169.1 17.2 27.7 19.0 181 209 A P - 0 0 3 0, 0.0 -173,-2.9 0, 0.0 -172,-0.5 -0.469 61.1-150.4 -58.6 149.5 19.2 30.4 17.1 182 210 A V E -AG 7 171A 2 -11,-1.2 -11,-2.8 -175,-0.2 2,-0.7 -0.938 17.8-134.8-133.0 139.9 16.6 32.1 14.9 183 211 A W E -AG 6 170A 0 -177,-3.2 -177,-1.8 -2,-0.4 2,-0.4 -0.903 34.3-169.1 -92.6 110.4 16.8 33.9 11.5 184 212 A V E -AG 5 169A 0 -15,-2.9 -15,-2.7 -2,-0.7 -179,-0.1 -0.850 25.8-111.8-111.3 132.3 14.8 37.1 12.0 185 213 A K E >> - G 0 168A 75 -181,-0.5 4,-2.3 -2,-0.4 3,-0.5 -0.325 29.5-122.8 -53.8 138.6 13.6 39.6 9.3 186 214 A T H 3> S+ 0 0 0 -19,-2.3 4,-3.2 1,-0.2 5,-0.2 0.890 112.6 57.4 -55.5 -36.5 15.5 42.9 9.7 187 215 A T H 3> S+ 0 0 77 -20,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.855 107.8 45.6 -66.5 -37.2 12.2 44.7 10.1 188 216 A D H <> S+ 0 0 41 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.896 114.8 47.7 -64.8 -44.2 11.1 42.5 13.1 189 217 A L H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.896 110.5 52.3 -67.9 -39.4 14.6 42.9 14.7 190 218 A W H X S+ 0 0 38 -4,-3.2 4,-2.3 -5,-0.2 3,-0.3 0.956 110.7 46.6 -56.8 -51.1 14.4 46.7 14.1 191 219 A K H < S+ 0 0 122 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.850 111.8 52.9 -59.0 -38.0 11.0 46.9 15.8 192 220 A A H < S+ 0 0 0 -4,-2.0 -48,-2.5 1,-0.2 -1,-0.2 0.816 112.9 42.4 -67.3 -37.9 12.2 44.8 18.7 193 221 A X H < S+ 0 0 0 -4,-1.8 2,-1.9 -3,-0.3 11,-0.9 0.747 100.2 73.1 -75.9 -30.8 15.3 47.0 19.2 194 222 A N S < S+ 0 0 80 -4,-2.3 2,-0.4 -5,-0.2 -1,-0.2 -0.355 79.6 108.8 -82.2 53.7 13.2 50.2 18.8 195 223 A T S S- 0 0 17 -2,-1.9 9,-2.1 -3,-0.2 2,-0.6 -0.971 74.1-113.9-133.2 147.2 11.6 49.6 22.2 196 224 A V E -H 203 0B 100 -2,-0.4 2,-0.6 7,-0.2 7,-0.3 -0.719 21.1-142.0 -90.4 120.2 12.1 51.5 25.4 197 225 A D E >> -H 202 0B 17 5,-2.9 4,-2.4 -2,-0.6 5,-0.9 -0.738 8.8-148.2 -78.9 120.4 13.8 49.5 28.1 198 226 A S T 45S+ 0 0 102 -2,-0.6 -1,-0.2 1,-0.2 5,-0.0 0.817 95.2 58.4 -66.1 -29.0 12.0 50.5 31.3 199 227 A V T 45S+ 0 0 81 1,-0.2 -1,-0.2 3,-0.1 -103,-0.1 0.937 120.9 25.2 -64.6 -48.0 15.1 50.0 33.4 200 228 A S T 45S- 0 0 31 2,-0.2 -2,-0.2 -3,-0.1 -1,-0.2 0.661 92.1-137.3 -87.2 -16.4 17.2 52.5 31.3 201 229 A Q T <5S+ 0 0 167 -4,-2.4 2,-0.3 1,-0.3 -3,-0.2 0.751 74.9 106.9 54.8 26.0 14.3 54.7 30.0 202 230 A K E - 0 0 26 147,-0.4 3,-2.0 146,-0.1 148,-0.0 -0.275 360.0-109.4 -60.1 150.9 50.4 20.3 15.5 214 31 B P T 3 S+ 0 0 131 0, 0.0 -1,-0.1 0, 0.0 146,-0.1 0.723 114.5 66.3 -62.1 -21.6 50.8 20.6 11.7 215 32 B N T 3 S+ 0 0 39 144,-0.1 181,-0.5 2,-0.0 2,-0.3 0.583 93.6 73.8 -74.8 -9.5 48.8 17.4 11.0 216 33 B L E < -I 395 0C 11 -3,-2.0 2,-0.6 179,-0.1 179,-0.2 -0.828 68.9-149.0-108.2 139.3 45.6 19.1 12.4 217 34 B I E -I 394 0C 18 177,-2.0 177,-3.4 -2,-0.3 2,-0.2 -0.954 22.8-135.4-108.6 114.3 43.5 21.7 10.6 218 35 B G E -I 393 0C 5 -2,-0.6 6,-0.6 175,-0.2 3,-0.4 -0.449 7.3-140.6 -69.5 138.5 41.9 24.0 13.1 219 36 B F S S+ 0 0 1 173,-2.7 2,-1.3 1,-0.3 6,-0.1 0.806 101.0 74.5 -64.2 -27.6 38.2 24.9 12.7 220 37 B N S S+ 0 0 92 172,-0.5 2,-0.3 4,-0.1 -1,-0.3 -0.141 91.3 72.3 -77.7 43.0 39.4 28.3 13.8 221 38 B S S > S- 0 0 43 -2,-1.3 4,-2.3 -3,-0.4 5,-0.2 -0.969 91.4-106.3-149.8 162.0 41.0 28.9 10.4 222 39 B N H > S+ 0 0 137 -2,-0.3 4,-2.2 2,-0.2 5,-0.1 0.903 120.8 47.0 -54.9 -47.7 40.1 29.6 6.8 223 40 B E H > S+ 0 0 115 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.892 111.5 53.1 -63.7 -42.7 40.9 26.1 5.6 224 41 B G H > S+ 0 0 0 -6,-0.6 4,-0.9 2,-0.2 -2,-0.2 0.888 111.0 44.2 -58.2 -45.4 39.0 24.7 8.6 225 42 B E H >X S+ 0 0 38 -4,-2.3 4,-1.9 1,-0.2 3,-0.5 0.900 113.2 53.5 -64.7 -41.1 35.8 26.6 7.8 226 43 B K H 3X S+ 0 0 129 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.863 101.3 58.2 -62.7 -39.2 36.3 25.7 4.1 227 44 B L H 3< S+ 0 0 7 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.791 107.9 48.1 -61.4 -28.2 36.5 22.0 5.0 228 45 B L H X< S+ 0 0 6 -4,-0.9 3,-0.8 -3,-0.5 -2,-0.2 0.891 111.3 48.9 -75.6 -42.2 33.0 22.3 6.6 229 46 B L H 3< S+ 0 0 62 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.1 0.810 116.6 42.6 -65.9 -31.7 31.6 24.2 3.5 230 47 B T T 3< S+ 0 0 41 -4,-2.2 2,-0.3 -5,-0.2 146,-0.2 0.329 91.8 109.0 -98.3 5.5 33.0 21.6 1.1 231 48 B S < - 0 0 3 -3,-0.8 143,-0.2 -5,-0.1 3,-0.2 -0.658 48.6-167.8 -81.4 140.7 32.0 18.6 3.3 232 49 B R S S+ 0 0 167 141,-0.4 2,-0.2 -2,-0.3 142,-0.1 0.138 83.0 60.0-107.1 13.2 29.1 16.4 2.1 233 50 B S B S+J 373 0C 0 140,-0.8 140,-2.4 -5,-0.1 111,-0.2 -0.625 70.7 106.4-141.2 73.4 28.9 14.6 5.4 234 51 B R >> + 0 0 49 138,-0.2 3,-1.0 -2,-0.2 4,-0.6 0.159 24.7 119.3-147.3 16.3 28.1 17.3 7.9 235 52 B E T >4 S+ 0 0 69 108,-1.3 3,-0.8 1,-0.2 109,-0.2 0.874 78.5 57.9 -56.8 -37.6 24.4 17.1 9.0 236 53 B D T 3> S+ 0 0 2 107,-1.0 4,-2.2 1,-0.2 5,-0.3 0.764 90.8 73.4 -67.3 -23.4 25.5 16.6 12.7 237 54 B F H <> S+ 0 0 0 134,-1.1 4,-3.0 -3,-1.0 -1,-0.2 0.892 91.2 55.6 -57.7 -45.6 27.4 19.8 12.7 238 55 B F H S+ 0 0 33 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.837 118.1 53.5 -62.6 -35.0 22.6 20.6 15.9 240 57 B L H >X S+ 0 0 0 -4,-2.2 3,-0.7 1,-0.2 4,-0.7 0.905 106.2 53.6 -67.5 -38.2 26.0 19.9 17.7 241 58 B S H >< S+ 0 0 1 -4,-3.0 3,-0.8 -5,-0.3 -1,-0.2 0.906 106.4 53.2 -58.8 -38.2 27.0 23.5 17.1 242 59 B X H 3< S+ 0 0 24 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.720 117.8 36.5 -72.1 -21.2 23.8 24.7 18.8 243 60 B Q H << S+ 0 0 24 -4,-0.8 -1,-0.2 -3,-0.7 -2,-0.2 0.318 82.6 142.5-108.6 -1.8 24.5 22.5 21.8 244 61 B F << + 0 0 0 -3,-0.8 2,-0.3 -4,-0.7 -3,-0.1 -0.201 26.8 177.0 -52.6 127.2 28.3 23.0 22.0 245 62 B V - 0 0 19 -211,-0.1 2,-0.5 11,-0.1 142,-0.2 -0.943 32.2-115.0-132.1 157.4 29.5 23.2 25.6 246 63 B T - 0 0 33 -2,-0.3 140,-0.2 140,-0.1 139,-0.1 -0.822 38.8-113.1 -92.0 125.1 32.7 23.6 27.6 247 64 B Q - 0 0 0 138,-2.4 141,-0.1 -2,-0.5 6,-0.1 -0.282 16.7-129.5 -43.8 136.7 33.6 20.6 29.8 248 65 B V S S- 0 0 56 1,-0.2 2,-0.3 4,-0.2 -1,-0.1 0.924 86.1 -30.7 -54.7 -43.9 33.5 21.4 33.5 249 66 B N S > S- 0 0 58 -185,-0.0 3,-1.0 1,-0.0 -1,-0.2 -0.895 79.4 -78.7-162.5 177.9 37.0 19.8 33.6 250 67 B Q G > S+ 0 0 62 -2,-0.3 3,-1.8 1,-0.3 4,-0.2 0.852 126.2 57.4 -58.8 -38.2 38.9 17.1 31.8 251 68 B A G 3 S+ 0 0 18 1,-0.3 3,-0.5 51,-0.3 -1,-0.3 0.784 104.8 54.0 -64.7 -28.2 37.1 14.3 33.8 252 69 B Y G <> S+ 0 0 30 -3,-1.0 4,-2.4 1,-0.2 -1,-0.3 0.267 72.5 106.5 -90.5 11.1 33.8 15.6 32.5 253 70 B C H <> S+ 0 0 9 -3,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.868 82.9 49.1 -56.8 -38.0 34.7 15.5 28.8 254 71 B G H > S+ 0 0 1 -3,-0.5 4,-2.4 -4,-0.2 -1,-0.2 0.871 109.8 51.0 -65.5 -42.4 32.4 12.5 28.4 255 72 B V H > S+ 0 0 0 -4,-0.2 4,-2.6 2,-0.2 5,-0.2 0.924 111.1 47.7 -62.3 -47.5 29.5 14.2 30.2 256 73 B A H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.916 113.1 49.9 -56.0 -45.1 29.8 17.3 28.0 257 74 B S H X S+ 0 0 0 -4,-1.8 4,-1.5 -5,-0.2 -2,-0.2 0.904 111.2 47.2 -61.7 -48.5 29.9 15.1 24.9 258 75 B I H X S+ 0 0 0 -4,-2.4 4,-3.5 1,-0.2 5,-0.2 0.912 110.4 51.9 -61.6 -46.3 26.8 13.0 25.9 259 76 B I H X S+ 0 0 2 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.852 106.6 53.0 -68.8 -29.7 24.7 16.1 26.8 260 77 B X H X S+ 0 0 0 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.925 115.6 41.5 -63.1 -43.6 25.4 17.8 23.4 261 78 B V H X S+ 0 0 0 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.922 115.6 49.3 -70.3 -43.6 24.2 14.6 21.7 262 79 B L H X>S+ 0 0 0 -4,-3.5 5,-1.0 2,-0.2 4,-0.9 0.885 111.5 47.9 -64.4 -42.6 21.3 14.1 24.1 263 80 B N H ><5S+ 0 0 28 -4,-2.5 3,-0.7 -5,-0.2 -1,-0.2 0.910 111.6 52.7 -60.0 -38.9 20.1 17.7 23.7 264 81 B S H 3<5S+ 0 0 28 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.806 107.1 51.8 -71.2 -30.2 20.4 17.3 19.9 265 82 B L H 3<5S- 0 0 43 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.662 101.4-133.8 -79.5 -18.4 18.3 14.1 19.9 266 83 B G T <<5 + 0 0 66 -4,-0.9 3,-0.2 -3,-0.7 -3,-0.1 0.695 49.7 155.0 73.8 18.7 15.5 15.7 21.9 267 84 B I < - 0 0 32 -5,-1.0 2,-0.9 1,-0.2 52,-0.1 0.708 60.8 -49.3 -44.1-150.1 15.1 12.7 24.3 268 85 B N - 0 0 91 50,-0.4 -1,-0.2 12,-0.0 12,-0.1 -0.851 67.1-158.2 -94.3 97.2 13.7 12.9 27.9 269 86 B A - 0 0 10 -2,-0.9 12,-0.1 -3,-0.2 17,-0.0 -0.431 22.7 -99.0 -72.8 145.7 15.6 15.8 29.2 270 87 B P - 0 0 11 0, 0.0 10,-1.2 0, 0.0 2,-0.6 -0.279 25.7-140.3 -56.6 145.4 16.0 16.2 33.0 271 88 B E + 0 0 144 8,-0.2 2,-0.3 14,-0.1 8,-0.1 -0.937 39.5 154.1-107.8 103.0 13.7 18.6 34.9 272 89 B T > - 0 0 40 -2,-0.6 4,-1.0 6,-0.5 3,-0.4 -0.848 56.1-104.6-128.0 169.5 15.7 20.4 37.5 273 90 B A T 4 S+ 0 0 92 -2,-0.3 3,-0.3 1,-0.2 -1,-0.0 0.805 106.1 72.8 -60.9 -30.9 15.5 23.8 39.3 274 91 B Q T 4 S+ 0 0 72 1,-0.2 -1,-0.2 3,-0.1 4,-0.1 0.935 118.0 13.3 -58.3 -47.5 18.3 25.4 37.3 275 92 B Y T >4 S- 0 0 22 -3,-0.4 3,-2.3 3,-0.2 -1,-0.2 0.312 98.2-175.5-114.5 13.3 16.3 25.8 34.1 276 93 B S T 3< + 0 0 85 -4,-1.0 3,-0.1 1,-0.4 -3,-0.0 -0.172 68.0 23.9 -41.8 133.7 12.8 25.1 35.4 277 94 B P T 3 S+ 0 0 103 0, 0.0 -1,-0.4 0, 0.0 2,-0.1 -0.983 115.7 79.0 -82.8 5.9 10.2 24.9 33.8 278 95 B Y < - 0 0 85 -3,-2.3 2,-0.5 -6,-0.1 -6,-0.5 -0.429 69.7-142.2 -79.2 144.7 12.5 24.1 30.8 279 96 B R + 0 0 116 -102,-0.2 2,-0.3 -8,-0.1 -8,-0.2 -0.942 36.8 144.2-108.2 130.0 14.0 20.6 30.4 280 97 B V - 0 0 13 -10,-1.2 2,-0.4 -2,-0.5 -5,-0.1 -0.981 48.5-110.5-158.0 147.8 17.5 20.4 29.1 281 98 B F + 0 0 3 -2,-0.3 2,-0.3 -22,-0.2 -18,-0.1 -0.750 42.3 164.9 -84.1 138.9 20.6 18.2 29.5 282 99 B T > - 0 0 20 -2,-0.4 4,-0.9 1,-0.1 3,-0.2 -0.918 50.3-111.8-144.8 157.9 23.5 20.0 31.3 283 100 B Q T 4 S+ 0 0 21 -2,-0.3 3,-0.4 1,-0.2 4,-0.4 0.875 119.0 55.2 -58.9 -38.3 26.7 18.6 32.9 284 101 B D T 4 S+ 0 0 141 1,-0.2 -1,-0.2 2,-0.1 3,-0.2 0.807 116.3 33.8 -66.3 -33.4 25.2 19.7 36.2 285 102 B N T >4 S+ 0 0 8 -3,-0.2 3,-2.0 1,-0.1 4,-0.3 0.401 85.7 101.1-105.4 2.4 22.0 17.7 35.8 286 103 B F G >< S+ 0 0 0 -4,-0.9 3,-0.7 -3,-0.4 -1,-0.1 0.847 83.9 49.7 -57.7 -38.5 23.2 14.7 33.9 287 104 B F G 3 S+ 0 0 18 -4,-0.4 -1,-0.3 1,-0.2 6,-0.2 0.266 78.8 96.9 -87.1 16.1 23.2 12.4 37.0 288 105 B S G < + 0 0 51 -3,-2.0 2,-0.3 4,-0.1 -1,-0.2 0.806 64.5 93.9 -66.3 -28.4 19.7 13.4 38.1 289 106 B N S <> S- 0 0 35 -3,-0.7 4,-1.9 -4,-0.3 5,-0.2 -0.520 75.1-146.6 -68.8 118.1 18.6 10.1 36.3 290 107 B E H > S+ 0 0 138 -2,-0.3 4,-1.5 1,-0.2 -1,-0.1 0.912 98.4 50.1 -59.8 -43.7 18.6 7.4 38.9 291 108 B K H > S+ 0 0 155 2,-0.2 4,-1.2 26,-0.2 -1,-0.2 0.872 106.0 57.6 -60.7 -37.0 19.8 4.7 36.4 292 109 B T H >> S+ 0 0 0 1,-0.2 4,-1.2 25,-0.2 3,-0.8 0.952 105.5 48.9 -59.4 -49.9 22.6 7.0 35.2 293 110 B K H 3< S+ 0 0 74 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.836 106.1 59.3 -52.6 -39.8 24.0 7.2 38.8 294 111 B A H 3< S+ 0 0 82 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.793 97.7 59.0 -60.3 -35.1 23.7 3.4 39.0 295 112 B V H << S- 0 0 34 -4,-1.2 2,-0.3 -3,-0.8 -1,-0.2 0.942 130.6 -19.4 -62.9 -48.2 26.1 2.9 36.0 296 113 B I S < S- 0 0 18 -4,-1.2 -1,-0.3 18,-0.0 -2,-0.1 -0.896 78.8 -95.9-168.4 133.5 28.9 4.8 37.8 297 114 B A > - 0 0 31 -2,-0.3 4,-2.0 -3,-0.2 3,-0.4 -0.168 25.7-132.1 -56.7 135.7 29.1 7.2 40.7 298 115 B P H > S+ 0 0 25 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.813 107.6 57.1 -53.1 -34.7 29.1 10.8 39.8 299 116 B E H > S+ 0 0 140 2,-0.2 4,-0.6 1,-0.2 5,-0.1 0.811 106.4 49.1 -72.0 -34.3 32.0 11.3 42.2 300 117 B V H >> S+ 0 0 47 -3,-0.4 4,-3.2 2,-0.2 3,-0.9 0.933 111.7 46.7 -67.5 -52.7 34.1 8.8 40.4 301 118 B V H 3X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.881 107.5 60.0 -55.4 -41.3 33.4 10.3 36.9 302 119 B A H 3< S+ 0 0 44 -4,-2.3 -51,-0.3 -5,-0.2 -1,-0.2 0.754 117.6 30.7 -55.7 -26.6 34.2 13.8 38.4 303 120 B K H << S+ 0 0 146 -3,-0.9 -2,-0.2 -4,-0.6 -1,-0.2 0.874 137.3 15.5-102.2 -49.3 37.7 12.5 39.2 304 121 B Q H < S- 0 0 83 -4,-3.2 -3,-0.2 1,-0.3 -2,-0.2 0.364 89.2-139.8-117.8 3.2 38.6 9.9 36.6 305 122 B G < - 0 0 6 -4,-1.9 2,-0.3 -5,-0.4 -1,-0.3 -0.363 35.0 -67.1 69.1-151.1 36.2 10.4 33.8 306 123 B X - 0 0 15 -55,-0.1 2,-0.1 -2,-0.1 104,-0.1 -0.974 32.9-127.2-139.3 152.5 34.7 7.4 31.9 307 124 B T > - 0 0 8 -2,-0.3 4,-2.8 103,-0.1 5,-0.2 -0.394 40.8 -96.5 -87.8 175.7 35.9 4.7 29.7 308 125 B L H > S+ 0 0 3 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.901 125.7 48.5 -63.0 -44.8 34.3 3.8 26.3 309 126 B D H > S+ 0 0 45 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.887 112.9 48.4 -60.3 -40.7 32.1 1.1 27.8 310 127 B E H > S+ 0 0 33 2,-0.2 4,-3.1 1,-0.2 -2,-0.2 0.901 108.2 53.9 -69.0 -39.5 31.0 3.4 30.6 311 128 B L H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.942 109.3 49.7 -57.1 -49.7 30.2 6.2 28.1 312 129 B G H X S+ 0 0 5 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.925 113.7 44.4 -51.0 -50.0 28.0 3.6 26.2 313 130 B R H X S+ 0 0 123 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.852 110.7 54.3 -68.6 -36.1 26.2 2.6 29.4 314 131 B L H < S+ 0 0 0 -4,-3.1 4,-0.4 2,-0.2 3,-0.2 0.923 112.3 44.2 -62.0 -45.3 25.8 6.2 30.6 315 132 B I H ><>S+ 0 0 1 -4,-2.4 3,-1.9 1,-0.2 5,-0.6 0.948 111.6 52.4 -62.7 -49.4 24.1 7.2 27.3 316 133 B A H ><5S+ 0 0 48 -4,-2.5 3,-1.9 1,-0.3 -1,-0.2 0.714 93.8 73.8 -59.9 -25.6 21.9 4.0 27.2 317 134 B S T 3<5S+ 0 0 22 -4,-1.3 -1,-0.3 1,-0.3 -25,-0.2 0.688 91.6 56.4 -65.5 -20.3 20.7 4.9 30.8 318 135 B Y T < 5S- 0 0 7 -3,-1.9 -50,-0.4 -4,-0.4 -1,-0.3 0.258 123.3-105.3 -93.5 13.4 18.6 7.7 29.2 319 136 B G T < 5S+ 0 0 68 -3,-1.9 2,-0.3 1,-0.3 -3,-0.2 0.760 75.8 131.1 72.3 28.7 16.9 5.2 26.9 320 137 B V < - 0 0 25 -5,-0.6 2,-0.4 -53,-0.0 -1,-0.3 -0.743 64.6 -99.1-105.0 163.9 18.5 5.9 23.6 321 138 B K - 0 0 160 100,-2.6 100,-2.6 -2,-0.3 2,-0.4 -0.688 44.7-174.8 -84.8 131.2 20.0 3.3 21.3 322 139 B V E -K 420 0C 37 -2,-0.4 2,-0.5 98,-0.2 98,-0.2 -0.974 18.8-168.5-132.9 138.3 23.8 2.9 21.6 323 140 B K E -K 419 0C 112 96,-2.2 96,-2.4 -2,-0.4 2,-0.4 -0.959 14.2-155.6-127.4 113.7 26.4 0.9 19.7 324 141 B V E -K 418 0C 47 -2,-0.5 2,-0.5 94,-0.2 94,-0.2 -0.761 8.7-169.1 -91.9 129.1 29.8 0.8 21.3 325 142 B N E -K 417 0C 15 92,-3.2 92,-2.3 -2,-0.4 2,-0.2 -0.863 6.1-160.0-126.3 96.7 32.7 0.1 18.9 326 143 B H E > -K 416 0C 10 -2,-0.5 3,-2.4 90,-0.2 90,-0.3 -0.512 26.5-125.9 -67.1 137.4 36.1 -0.6 20.3 327 144 B A G > S+ 0 0 1 88,-3.2 3,-1.6 77,-0.4 78,-0.1 0.867 111.0 60.8 -53.5 -41.2 38.9 -0.1 17.8 328 145 B S G 3 S+ 0 0 74 87,-0.4 -1,-0.3 1,-0.3 88,-0.1 0.598 102.0 53.4 -62.5 -12.9 40.1 -3.7 18.4 329 146 B D G < S+ 0 0 130 -3,-2.4 -1,-0.3 2,-0.0 2,-0.2 0.337 119.2 19.9-103.4 5.2 36.7 -5.0 17.2 330 147 B T S < S- 0 0 30 -3,-1.6 2,-0.3 -4,-0.2 3,-0.0 -0.689 74.9-118.2-149.0-161.1 36.7 -3.1 13.8 331 148 B N > - 0 0 58 -2,-0.2 4,-2.4 1,-0.1 3,-0.3 -0.961 31.9 -98.5-150.8 164.5 39.1 -1.5 11.4 332 149 B I H > S+ 0 0 25 -2,-0.3 4,-2.9 1,-0.2 5,-0.3 0.835 117.4 56.8 -55.9 -37.6 39.7 1.9 9.8 333 150 B E H > S+ 0 0 110 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.950 113.3 39.3 -61.4 -48.2 37.9 1.1 6.6 334 151 B D H > S+ 0 0 52 -3,-0.3 4,-2.8 2,-0.2 5,-0.3 0.828 114.7 54.5 -71.1 -37.1 34.6 0.3 8.4 335 152 B F H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.957 112.4 42.6 -54.9 -56.5 35.2 3.2 10.9 336 153 B R H X S+ 0 0 60 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.937 118.9 45.2 -60.0 -46.5 35.5 5.7 8.0 337 154 B K H X S+ 0 0 131 -4,-2.3 4,-1.7 -5,-0.3 -2,-0.2 0.921 116.7 41.3 -66.9 -51.6 32.6 4.3 6.0 338 155 B Q H X S+ 0 0 53 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.883 118.8 46.6 -67.5 -37.6 30.1 3.8 8.8 339 156 B V H X S+ 0 0 0 -4,-2.5 4,-2.4 -5,-0.3 -2,-0.2 0.938 110.5 51.6 -70.3 -45.6 31.0 7.2 10.5 340 157 B A H X S+ 0 0 9 -4,-2.8 4,-0.7 -5,-0.3 -2,-0.2 0.892 112.3 48.8 -56.8 -38.0 30.9 9.1 7.1 341 158 B E H >X S+ 0 0 106 -4,-1.7 3,-1.2 -5,-0.2 4,-0.5 0.957 109.7 50.1 -65.8 -50.4 27.4 7.6 6.5 342 159 B N H >< S+ 0 0 18 -4,-2.2 3,-1.7 1,-0.3 6,-0.2 0.874 102.4 61.6 -56.1 -37.2 26.1 8.5 10.0 343 160 B L H 3< S+ 0 0 0 -4,-2.4 -108,-1.3 1,-0.3 -107,-1.0 0.766 103.2 51.5 -66.8 -23.5 27.3 12.1 9.6 344 161 B K H << S+ 0 0 85 -3,-1.2 2,-0.4 -4,-0.7 -1,-0.3 0.544 98.1 85.8 -82.0 -13.2 24.9 12.4 6.7 345 162 B Q S X< S- 0 0 63 -3,-1.7 3,-0.8 -4,-0.5 2,-0.1 -0.774 73.8-130.9 -96.6 133.3 21.9 11.0 8.7 346 163 B D T 3 S+ 0 0 114 -2,-0.4 3,-0.1 1,-0.2 -2,-0.1 -0.480 91.6 21.9 -64.2 148.5 19.6 13.1 11.0 347 164 B G T 3 S+ 0 0 38 1,-0.2 2,-0.3 -2,-0.1 -1,-0.2 0.632 102.0 98.4 71.7 15.5 19.0 11.7 14.5 348 165 B N < - 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