==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 14-MAY-10 3N0G . COMPND 2 MOLECULE: ISOPRENE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: POPULUS TREMULA X POPULUS ALBA; . AUTHOR M.KOKSAL,D.W.CHRISTIANSON . 1045 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46820.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 793 75.9 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 . 4 0.4 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 . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 0.1 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 . 22 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 118 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 618 59.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 26 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 4 1 0 0 3 1 1 4 9 7 1 0 1 4 0 0 0 0 2 2 5 1 0 0 0 0 2 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 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 63 A N > 0 0 106 0, 0.0 3,-0.8 0, 0.0 6,-0.3 0.000 360.0 360.0 360.0 169.6 69.4 25.3 72.6 2 64 A S T 3 + 0 0 63 1,-0.2 0, 0.0 5,-0.1 0, 0.0 0.470 360.0 37.0 -75.7 -3.3 67.7 22.8 70.3 3 65 A W T 3 S+ 0 0 39 253,-0.1 -1,-0.2 50,-0.1 6,-0.1 0.213 85.1 129.9-132.6 13.3 70.4 23.3 67.6 4 66 A D S <>>S- 0 0 38 -3,-0.8 4,-1.8 1,-0.1 5,-0.5 -0.261 73.4-106.4 -68.7 159.8 73.6 23.7 69.7 5 67 A Y I 4>S+ 0 0 0 1,-0.2 5,-0.9 3,-0.2 13,-0.1 0.166 119.2 50.3 -73.3 21.0 76.7 21.7 68.9 6 68 A D I 45S+ 0 0 66 3,-0.2 -1,-0.2 4,-0.2 8,-0.0 0.633 107.0 46.5-121.4 -49.5 75.9 19.6 72.0 7 69 A F I 45S+ 0 0 156 -6,-0.3 -2,-0.2 3,-0.1 -5,-0.1 0.842 134.8 17.8 -64.7 -33.2 72.3 18.6 71.6 8 70 A L I <5S+ 0 0 57 -4,-1.8 -3,-0.2 0, 0.0 -1,-0.1 0.861 126.0 46.0-102.9 -60.9 73.0 17.7 68.0 9 71 A L I < 0 0 54 -5,-0.5 -3,-0.2 1,-0.1 -4,-0.1 0.966 360.0 360.0 -50.2 -81.6 76.7 17.2 67.4 10 72 A S < 0 0 96 -5,-0.9 -4,-0.2 4,-0.0 -3,-0.1 0.783 360.0 360.0-106.5 360.0 77.8 15.0 70.3 11 ! 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 12 81 A V > 0 0 142 0, 0.0 4,-0.7 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 114.6 86.4 15.8 68.5 13 82 A Y H >> + 0 0 153 2,-0.2 4,-2.5 1,-0.2 3,-0.7 0.875 360.0 70.3 -78.1 -40.0 84.4 17.9 66.0 14 83 A K H 3> S+ 0 0 65 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.845 101.8 47.6 -42.8 -41.1 82.1 19.2 68.7 15 84 A D H 3> S+ 0 0 83 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.831 108.1 52.6 -73.4 -35.4 85.0 21.2 70.0 16 85 A K H < - 0 0 39 -4,-0.8 3,-1.1 -5,-0.2 -3,-0.1 -0.318 44.2-167.4 -54.6 109.4 81.9 43.4 68.3 31 100 A E T 3 S+ 0 0 151 -2,-0.3 -1,-0.2 1,-0.2 -4,-0.1 0.529 83.6 62.4 -78.1 -6.6 80.8 46.9 69.3 32 101 A K T 3 S+ 0 0 186 2,-0.1 -1,-0.2 3,-0.0 2,-0.2 0.355 81.5 118.2 -96.9 2.9 84.0 48.4 67.8 33 102 A A S < S- 0 0 25 -3,-1.1 2,-0.4 -6,-0.1 3,-0.0 -0.469 74.6-111.4 -76.5 141.1 83.0 47.1 64.4 34 103 A E >> - 0 0 142 -2,-0.2 4,-2.7 1,-0.1 3,-0.9 -0.570 28.7-128.8 -69.9 121.6 82.4 49.5 61.5 35 104 A F H 3> S+ 0 0 55 -2,-0.4 4,-2.8 1,-0.3 5,-0.2 0.841 105.9 49.3 -40.6 -52.2 78.7 49.3 60.7 36 105 A L H 3> S+ 0 0 62 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.890 114.7 45.4 -59.0 -38.5 79.1 48.6 57.0 37 106 A T H <> S+ 0 0 85 -3,-0.9 4,-1.5 2,-0.2 -1,-0.2 0.872 111.6 53.9 -69.7 -37.1 81.6 45.9 57.7 38 107 A L H X S+ 0 0 5 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.899 109.0 47.7 -64.3 -41.9 79.3 44.6 60.4 39 108 A L H X S+ 0 0 1 -4,-2.8 4,-2.7 -5,-0.2 -2,-0.2 0.897 109.5 51.4 -68.1 -41.2 76.3 44.4 58.0 40 109 A E H X S+ 0 0 58 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.823 108.8 54.0 -64.7 -29.6 78.4 42.6 55.3 41 110 A L H X S+ 0 0 32 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.968 109.5 45.8 -66.3 -53.2 79.4 40.1 58.0 42 111 A I H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.894 110.5 55.8 -56.2 -40.7 75.8 39.5 58.9 43 112 A D H X S+ 0 0 16 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.950 109.9 44.2 -57.9 -50.6 75.0 39.2 55.1 44 113 A N H X S+ 0 0 46 -4,-2.3 4,-2.9 1,-0.2 6,-0.2 0.903 111.5 53.4 -61.2 -43.0 77.6 36.4 54.7 45 114 A V H <>S+ 0 0 0 -4,-2.6 5,-2.5 2,-0.2 6,-0.6 0.907 113.1 44.2 -60.2 -41.5 76.6 34.6 57.8 46 115 A Q H ><5S+ 0 0 31 -4,-2.5 3,-1.9 4,-0.2 5,-0.4 0.970 115.4 44.8 -69.9 -53.1 73.0 34.5 56.6 47 116 A R H 3<5S+ 0 0 29 -4,-2.9 139,-0.3 1,-0.3 140,-0.2 0.892 107.9 59.5 -57.9 -40.1 73.7 33.5 52.9 48 117 A L T 3<5S- 0 0 5 -4,-2.9 -1,-0.3 -5,-0.3 -2,-0.2 0.619 122.4-109.1 -65.3 -10.0 76.2 30.9 54.1 49 118 A G T < 5S+ 0 0 1 -3,-1.9 3,-0.3 -4,-0.3 -3,-0.2 0.536 91.7 107.3 96.5 9.6 73.2 29.4 56.0 50 119 A L >>< + 0 0 1 -5,-2.5 3,-1.4 -6,-0.2 4,-0.8 0.425 41.4 105.2 -98.1 -4.0 74.2 30.2 59.6 51 120 A G G >4 S+ 0 0 12 -6,-0.6 3,-0.7 -5,-0.4 7,-0.2 0.797 75.4 56.2 -46.5 -41.0 71.6 32.9 60.3 52 121 A Y G >4 S+ 0 0 16 -3,-0.3 3,-0.7 1,-0.2 -1,-0.3 0.805 103.3 56.0 -64.2 -30.8 69.4 30.7 62.5 53 122 A R G <4 S+ 0 0 6 -3,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.732 117.7 32.9 -75.1 -22.4 72.4 30.0 64.8 54 123 A F G S+ 0 0 99 -3,-0.7 4,-1.6 1,-0.2 5,-0.2 0.902 78.6 42.3 -47.2 -55.0 69.4 35.0 65.2 56 125 A S H > S+ 0 0 68 -4,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.923 114.4 50.8 -61.8 -47.3 69.6 36.8 68.6 57 126 A D H > S+ 0 0 18 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.934 107.7 53.4 -57.6 -48.0 73.1 38.2 68.0 58 127 A I H X S+ 0 0 0 -4,-3.2 4,-2.6 1,-0.2 -1,-0.2 0.860 110.4 46.9 -57.0 -39.1 72.1 39.6 64.6 59 128 A R H X S+ 0 0 93 -4,-1.6 4,-2.9 -5,-0.2 -1,-0.2 0.946 109.0 54.4 -66.9 -48.8 69.1 41.5 66.1 60 129 A R H X S+ 0 0 105 -4,-2.5 4,-2.1 1,-0.2 5,-0.2 0.939 111.8 45.7 -47.8 -53.0 71.3 42.8 68.9 61 130 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.942 112.2 49.6 -57.9 -52.0 73.7 44.1 66.2 62 131 A L H X S+ 0 0 1 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.831 110.0 53.5 -58.7 -31.7 70.9 45.6 64.1 63 132 A D H X S+ 0 0 75 -4,-2.9 4,-3.0 2,-0.2 5,-0.2 0.910 107.1 48.2 -70.3 -43.3 69.4 47.3 67.2 64 133 A R H X S+ 0 0 69 -4,-2.1 4,-1.3 -5,-0.2 6,-0.3 0.851 110.7 55.1 -64.3 -32.9 72.7 49.0 68.1 65 134 A F H < S+ 0 0 13 -4,-2.0 5,-0.4 -5,-0.2 -2,-0.2 0.913 114.2 38.0 -66.6 -42.7 72.8 50.1 64.5 66 135 A V H >< S+ 0 0 66 -4,-1.9 3,-3.6 2,-0.2 -2,-0.2 0.972 111.1 56.6 -72.1 -55.6 69.4 51.7 64.7 67 136 A S H 3< S+ 0 0 106 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.773 113.6 43.1 -47.5 -30.5 69.6 53.1 68.2 68 137 A S T 3< S- 0 0 74 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.394 115.2-117.2 -97.6 3.0 72.7 55.0 67.1 69 138 A G < - 0 0 37 -3,-3.6 3,-0.2 2,-0.1 -3,-0.2 0.208 39.1-144.6 82.6 -17.7 71.2 56.0 63.8 70 139 A G - 0 0 20 -5,-0.4 2,-1.5 -6,-0.3 3,-0.2 -0.207 65.4 -19.4 55.1-146.1 73.9 54.0 62.0 71 140 A F S >> S+ 0 0 25 1,-0.2 4,-0.6 2,-0.1 3,-0.6 -0.476 77.9 154.0 -91.1 66.0 75.0 55.5 58.7 72 141 A D T 34 S+ 0 0 109 -2,-1.5 -1,-0.2 1,-0.2 -2,-0.1 0.619 77.5 50.5 -66.4 -10.9 71.9 57.7 58.4 73 142 A G T 34 S+ 0 0 39 -3,-0.2 3,-0.5 1,-0.1 -1,-0.2 0.679 102.2 56.0 -99.0 -23.3 74.2 60.0 56.4 74 143 A V T <> S+ 0 0 49 -3,-0.6 4,-3.4 1,-0.2 8,-0.4 0.470 83.0 86.0 -86.2 -3.8 75.6 57.3 54.0 75 144 A T T < S+ 0 0 28 -4,-0.6 -1,-0.2 1,-0.3 28,-0.2 0.265 103.7 34.2 -77.2 12.7 72.0 56.5 53.1 76 145 A K T 4 S+ 0 0 138 -3,-0.5 -1,-0.3 28,-0.0 -2,-0.2 0.282 119.6 53.5-138.7 -13.0 72.7 59.4 50.6 77 146 A T T 4 S+ 0 0 109 1,-0.3 2,-0.4 -4,-0.1 -2,-0.2 0.848 114.8 25.4 -94.6 -44.3 76.4 58.4 50.2 78 147 A S X - 0 0 35 -4,-3.4 4,-1.7 1,-0.1 -1,-0.3 -0.982 50.7-163.9-132.3 127.1 76.2 54.8 49.2 79 148 A L H > S+ 0 0 4 -2,-0.4 4,-3.2 2,-0.2 5,-0.2 0.928 93.8 57.4 -67.6 -46.4 73.4 52.9 47.5 80 149 A H H > S+ 0 0 15 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.904 109.1 43.7 -50.3 -51.5 74.9 49.5 48.5 81 150 A A H > S+ 0 0 2 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.943 114.0 50.9 -62.7 -47.8 74.9 50.3 52.2 82 151 A T H X S+ 0 0 2 -4,-1.7 4,-2.3 -8,-0.4 -2,-0.2 0.919 113.8 44.4 -55.7 -48.7 71.4 51.7 52.0 83 152 A A H X S+ 0 0 0 -4,-3.2 4,-3.1 2,-0.2 5,-0.2 0.955 115.1 47.0 -63.4 -51.4 70.0 48.7 50.2 84 153 A L H X S+ 0 0 2 -4,-2.8 4,-2.6 -5,-0.2 5,-0.2 0.944 115.4 45.2 -56.6 -50.5 71.8 46.1 52.4 85 154 A S H X S+ 0 0 9 -4,-3.0 4,-2.8 -5,-0.2 5,-0.2 0.896 114.0 50.5 -60.2 -41.5 70.8 47.9 55.6 86 155 A F H X S+ 0 0 4 -4,-2.3 4,-2.5 -5,-0.3 5,-0.3 0.965 112.8 45.9 -59.5 -54.3 67.2 48.3 54.3 87 156 A R H X S+ 0 0 13 -4,-3.1 4,-1.7 1,-0.2 -2,-0.2 0.855 116.2 45.1 -58.2 -40.5 67.0 44.6 53.4 88 157 A L H X S+ 0 0 0 -4,-2.6 4,-1.4 -5,-0.2 6,-0.2 0.910 112.2 49.7 -74.3 -41.9 68.4 43.4 56.7 89 158 A L H <>S+ 0 0 14 -4,-2.8 5,-2.3 -5,-0.2 3,-0.4 0.942 116.0 42.0 -62.3 -48.0 66.4 45.7 58.9 90 159 A R H ><5S+ 0 0 16 -4,-2.5 3,-2.2 -5,-0.2 -1,-0.2 0.891 106.9 62.2 -66.5 -38.2 63.1 44.8 57.3 91 160 A Q H 3<5S+ 0 0 66 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.850 108.6 44.9 -53.9 -34.3 64.1 41.1 57.1 92 161 A H T 3<5S- 0 0 22 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 -0.014 126.1 -96.4-101.3 27.8 64.2 41.2 60.9 93 162 A G T < 5S+ 0 0 35 -3,-2.2 -3,-0.2 1,-0.2 -2,-0.1 0.296 75.9 142.8 80.3 -11.4 61.0 43.1 61.5 94 163 A F < - 0 0 28 -5,-2.3 2,-0.4 -6,-0.2 -1,-0.2 -0.271 55.9-111.1 -61.8 149.5 62.5 46.6 61.8 95 164 A E + 0 0 193 -3,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.700 45.2 166.0 -86.4 134.2 60.5 49.4 60.3 96 165 A V - 0 0 32 -2,-0.4 2,-0.3 -6,-0.0 -10,-0.0 -0.994 26.2-133.7-148.8 144.5 61.9 51.1 57.2 97 166 A S > - 0 0 63 -2,-0.3 3,-1.8 1,-0.1 4,-0.1 -0.751 16.0-135.0-102.7 145.3 60.6 53.4 54.5 98 167 A Q G > S+ 0 0 21 -2,-0.3 3,-1.4 1,-0.3 4,-0.3 0.639 101.2 79.8 -68.3 -11.8 61.0 53.1 50.8 99 168 A E G 3> + 0 0 108 1,-0.3 4,-0.5 2,-0.2 3,-0.5 0.596 68.1 83.4 -70.3 -10.5 61.8 56.8 51.0 100 169 A A G <4 S+ 0 0 37 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.1 0.579 96.2 43.9 -69.3 -6.9 65.3 55.8 52.1 101 170 A F T X4 S+ 0 0 0 -3,-1.4 3,-2.8 1,-0.1 -1,-0.2 0.574 85.8 90.2-110.2 -16.7 66.0 55.5 48.4 102 171 A S G >4 S+ 0 0 52 -3,-0.5 3,-1.6 -4,-0.3 -2,-0.1 0.787 78.7 66.6 -51.4 -31.0 64.3 58.7 47.2 103 172 A G G 3< S+ 0 0 54 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.412 92.8 62.3 -73.3 4.7 67.6 60.4 47.6 104 173 A F G < S+ 0 0 11 -3,-2.8 8,-1.8 2,-0.1 2,-0.3 0.268 89.3 86.6-111.4 10.7 69.0 58.3 44.8 105 174 A K B < S-A 111 0A 45 -3,-1.6 6,-0.3 6,-0.3 2,-0.0 -0.767 72.0-124.8-110.2 155.3 66.6 59.6 42.1 106 175 A D - 0 0 48 4,-3.1 3,-0.1 -2,-0.3 -1,-0.1 -0.030 41.7 -82.2 -84.2-169.4 67.0 62.7 39.9 107 176 A Q S S+ 0 0 175 1,-0.2 -2,-0.0 2,-0.1 -1,-0.0 0.948 131.3 52.3 -61.2 -50.9 64.6 65.7 39.4 108 177 A N S S- 0 0 135 1,-0.1 -1,-0.2 2,-0.1 -3,-0.0 0.784 126.1-105.4 -56.2 -27.5 62.5 63.8 37.0 109 178 A G S S+ 0 0 23 1,-0.3 2,-0.3 -3,-0.1 -2,-0.1 0.823 76.8 123.8 101.8 44.9 62.3 61.1 39.6 110 179 A N - 0 0 90 -8,-0.1 -4,-3.1 35,-0.0 -1,-0.3 -0.983 67.7 -94.0-136.8 147.9 64.6 58.4 38.3 111 180 A F B -A 105 0A 13 -2,-0.3 -6,-0.3 -6,-0.3 -9,-0.0 -0.370 53.9 -99.5 -61.8 131.5 67.6 56.6 39.7 112 181 A L > - 0 0 64 -8,-1.8 3,-0.8 1,-0.1 4,-0.3 -0.188 24.0-135.8 -51.8 139.9 70.9 58.3 38.6 113 182 A E G > S+ 0 0 126 1,-0.2 3,-2.3 2,-0.2 4,-0.3 0.885 97.6 69.4 -67.2 -41.9 72.5 56.5 35.7 114 183 A N G >> S+ 0 0 90 1,-0.3 3,-1.5 2,-0.2 4,-0.5 0.677 83.3 75.4 -51.7 -21.9 76.0 56.7 37.1 115 184 A L G X4 S+ 0 0 21 -3,-0.8 3,-1.1 1,-0.3 -1,-0.3 0.866 79.9 69.9 -60.4 -36.5 74.9 54.2 39.7 116 185 A K G <4 S+ 0 0 40 -3,-2.3 -1,-0.3 -4,-0.3 -2,-0.2 0.743 84.8 71.8 -54.3 -23.4 75.1 51.4 37.1 117 186 A E G <4 S+ 0 0 157 -3,-1.5 2,-1.4 -4,-0.3 -1,-0.3 0.956 89.8 60.1 -57.6 -51.0 78.9 51.9 37.2 118 187 A D S+ 0 0 20 -2,-1.4 4,-1.5 1,-0.2 -1,-0.2 0.698 77.7 63.6 -60.6 -19.8 77.6 46.8 39.9 120 189 A K H > S+ 0 0 93 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.964 100.6 47.1 -70.2 -53.5 77.7 45.9 43.6 121 190 A A H > S+ 0 0 1 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.812 109.6 56.8 -57.8 -32.5 75.2 48.6 44.8 122 191 A I H X S+ 0 0 0 -4,-1.2 4,-3.0 -7,-0.2 -1,-0.2 0.938 106.3 47.8 -66.0 -47.1 72.9 47.5 41.9 123 192 A L H X S+ 0 0 11 -4,-1.5 4,-2.8 1,-0.2 -2,-0.2 0.912 111.5 51.8 -59.9 -42.9 72.8 43.9 43.1 124 193 A S H X S+ 0 0 8 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.896 111.9 45.5 -60.9 -41.2 72.1 45.1 46.6 125 194 A L H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.932 111.3 52.9 -67.7 -46.3 69.2 47.3 45.5 126 195 A Y H >X S+ 0 0 9 -4,-3.0 3,-0.8 1,-0.2 4,-0.7 0.963 110.7 47.4 -50.9 -57.4 67.8 44.5 43.3 127 196 A E H >< S+ 0 0 7 -4,-2.8 3,-0.8 1,-0.3 48,-0.3 0.863 110.7 51.9 -53.7 -41.9 67.9 42.1 46.3 128 197 A A H >< S+ 0 0 0 -4,-2.0 3,-1.4 1,-0.2 -1,-0.3 0.789 96.4 69.8 -68.7 -26.8 66.3 44.7 48.6 129 198 A S H X< S+ 0 0 0 -4,-1.9 3,-1.2 -3,-0.8 -1,-0.2 0.772 87.9 64.6 -62.7 -28.2 63.4 45.3 46.1 130 199 A F T << S+ 0 0 8 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.636 90.1 64.5 -74.8 -10.8 61.9 41.9 46.7 131 200 A L T < S+ 0 0 7 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.1 0.187 81.6 129.3 -94.2 18.9 61.1 42.6 50.3 132 201 A A < - 0 0 1 -3,-1.2 336,-0.2 1,-0.1 2,-0.2 -0.225 46.9-144.8 -75.0 161.6 58.6 45.3 49.2 133 202 A L > - 0 0 21 335,-0.1 3,-1.0 1,-0.1 2,-0.2 -0.552 41.0 -69.8-112.8 178.5 55.0 45.8 50.3 134 203 A E T 3 S+ 0 0 91 331,-0.3 -1,-0.1 1,-0.2 3,-0.1 -0.556 119.3 25.5 -73.8 136.4 52.0 47.0 48.3 135 204 A G T 3 S+ 0 0 63 -2,-0.2 2,-2.3 1,-0.1 -1,-0.2 0.012 81.9 119.1 102.2 -28.1 52.3 50.7 47.5 136 205 A E <> + 0 0 20 -3,-1.0 4,-1.5 1,-0.2 3,-0.4 -0.470 31.0 165.4 -75.4 78.5 56.1 51.0 47.6 137 206 A N H > + 0 0 79 -2,-2.3 4,-2.8 1,-0.2 5,-0.3 0.849 66.6 64.1 -62.4 -39.7 56.4 52.1 44.0 138 207 A I H > S+ 0 0 4 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.875 105.1 46.1 -54.2 -41.4 60.0 53.3 44.5 139 208 A L H > S+ 0 0 0 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.901 110.1 53.3 -69.8 -40.6 61.1 49.7 45.2 140 209 A D H X S+ 0 0 46 -4,-1.5 4,-1.6 1,-0.2 -2,-0.2 0.922 112.8 44.5 -57.8 -43.3 59.1 48.4 42.3 141 210 A E H X S+ 0 0 74 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.798 107.2 60.9 -69.5 -31.3 60.9 50.9 40.1 142 211 A A H X S+ 0 0 0 -4,-1.7 4,-3.1 -5,-0.3 -1,-0.2 0.902 105.6 46.2 -63.9 -40.9 64.2 50.0 41.7 143 212 A R H X S+ 0 0 28 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.899 112.6 49.2 -68.6 -41.3 63.8 46.4 40.5 144 213 A V H X S+ 0 0 106 -4,-1.6 4,-1.4 -5,-0.2 -2,-0.2 0.917 116.0 45.0 -62.7 -42.9 62.9 47.5 37.0 145 214 A F H X S+ 0 0 28 -4,-2.6 4,-1.1 2,-0.2 -2,-0.2 0.931 114.7 46.5 -66.4 -48.6 65.9 49.8 37.0 146 215 A A H >X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 3,-0.5 0.916 111.5 50.1 -62.4 -46.5 68.3 47.3 38.5 147 216 A I H 3X S+ 0 0 44 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.857 102.3 61.9 -62.9 -35.2 67.4 44.4 36.3 148 217 A S H 3X S+ 0 0 52 -4,-1.4 4,-0.6 -5,-0.2 -1,-0.2 0.874 112.4 38.2 -58.0 -38.2 67.7 46.6 33.1 149 218 A H H XX S+ 0 0 24 -4,-1.1 4,-1.4 -3,-0.5 3,-0.9 0.952 114.8 50.3 -77.4 -54.1 71.4 47.0 34.0 150 219 A L H 3< S+ 0 0 2 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.830 100.5 66.2 -54.4 -37.7 72.2 43.5 35.3 151 220 A K H 3< S+ 0 0 145 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.891 105.4 42.5 -51.7 -45.1 70.7 41.9 32.2 152 221 A E H << S+ 0 0 124 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.845 84.8 116.2 -73.8 -36.6 73.4 43.4 30.0 153 222 A L < - 0 0 24 -4,-1.4 2,-0.3 1,-0.1 -3,-0.0 -0.003 49.9-159.1 -38.5 127.5 76.4 42.7 32.3 154 223 A S >> - 0 0 34 1,-0.1 4,-1.6 0, 0.0 5,-0.5 -0.739 31.2-111.3-110.5 161.2 78.9 40.3 30.7 155 224 A E H >5S+ 0 0 121 -2,-0.3 4,-1.0 1,-0.2 8,-0.2 0.807 120.5 52.3 -60.6 -27.6 81.6 38.1 32.4 156 225 A E H 45S+ 0 0 183 2,-0.2 -1,-0.2 1,-0.2 4,-0.1 0.921 102.6 56.3 -73.6 -47.1 84.1 40.4 30.7 157 226 A K H 45S+ 0 0 141 1,-0.1 -2,-0.2 2,-0.1 -1,-0.2 0.892 131.7 5.5 -52.9 -46.0 82.6 43.7 31.9 158 227 A I H <5S- 0 0 49 -4,-1.6 4,-0.2 1,-0.1 -2,-0.2 0.780 109.9 -98.2-112.2 -38.5 82.8 42.7 35.6 159 228 A G X< - 0 0 24 -4,-1.0 4,-2.7 -5,-0.5 5,-0.2 -0.445 33.6 -79.6 130.3 155.4 84.6 39.4 36.0 160 229 A K H > S+ 0 0 133 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.904 125.6 44.9 -52.9 -49.5 83.9 35.7 36.5 161 230 A E H > S+ 0 0 96 1,-0.2 4,-1.4 2,-0.2 3,-0.2 0.976 116.7 43.0 -60.5 -58.5 83.2 36.0 40.2 162 231 A L H > S+ 0 0 46 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.828 112.3 55.4 -58.3 -34.4 81.0 39.1 40.0 163 232 A A H X S+ 0 0 6 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.907 103.1 53.8 -67.2 -41.6 79.2 37.7 37.0 164 233 A E H X S+ 0 0 60 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.2 0.842 106.9 54.4 -60.9 -33.0 78.3 34.5 38.8 165 234 A Q H X S+ 0 0 45 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.922 110.7 44.4 -65.8 -46.0 76.8 36.7 41.5 166 235 A V H X S+ 0 0 2 -4,-1.7 4,-3.0 2,-0.2 5,-0.3 0.954 113.1 48.8 -65.0 -50.9 74.6 38.5 39.1 167 236 A N H X S+ 0 0 99 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.843 110.8 54.0 -58.6 -31.6 73.5 35.4 37.2 168 237 A H H X S+ 0 0 14 -4,-1.6 4,-1.9 -5,-0.3 -1,-0.2 0.945 111.2 43.5 -66.5 -48.8 72.7 33.9 40.6 169 238 A A H < S+ 0 0 1 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.887 113.1 51.7 -63.9 -41.1 70.5 36.8 41.6 170 239 A L H < S+ 0 0 45 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.861 106.2 55.7 -66.1 -33.9 68.8 37.0 38.2 171 240 A E H < S- 0 0 94 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.958 135.3 -19.8 -61.5 -50.5 68.0 33.3 38.4 172 241 A L S < S- 0 0 16 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.1 -0.860 73.4-114.9-163.9 123.4 66.2 33.8 41.7 173 242 A P >> - 0 0 5 0, 0.0 3,-1.5 0, 0.0 4,-1.2 -0.214 28.6-115.1 -60.6 148.5 66.4 36.6 44.3 174 243 A L G >4 S+ 0 0 24 1,-0.3 3,-1.2 2,-0.2 8,-0.1 0.924 114.3 59.0 -47.4 -54.5 67.7 36.0 47.7 175 244 A H G 34 S+ 0 0 27 -48,-0.3 -1,-0.3 1,-0.3 315,-0.1 0.736 113.0 39.6 -51.1 -26.4 64.4 36.7 49.3 176 245 A R G <4 S+ 0 0 21 -3,-1.5 -1,-0.3 2,-0.1 317,-0.2 0.575 95.4 91.3-103.4 -10.5 62.8 33.9 47.3 177 246 A R S << S- 0 0 10 -3,-1.2 2,-0.2 -4,-1.2 314,-0.1 -0.448 81.6-102.7 -83.0 159.7 65.4 31.2 47.4 178 247 A T > - 0 0 6 312,-0.2 4,-2.4 -2,-0.1 5,-0.2 -0.537 24.8-118.8 -83.7 150.4 65.5 28.5 50.0 179 248 A Q H > S+ 0 0 39 72,-0.3 4,-2.1 1,-0.2 -1,-0.1 0.894 111.7 43.5 -51.5 -50.6 67.9 28.6 52.9 180 249 A R H > S+ 0 0 6 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.919 113.2 50.8 -66.0 -45.5 69.7 25.4 52.1 181 250 A L H > S+ 0 0 10 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.875 111.8 48.3 -60.7 -37.1 69.9 26.0 48.4 182 251 A E H X S+ 0 0 10 -4,-2.4 4,-3.1 2,-0.2 5,-0.2 0.918 109.0 56.3 -67.4 -41.6 71.4 29.4 49.1 183 252 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.2 5,-0.3 0.940 104.6 48.4 -55.6 -56.2 73.8 27.8 51.5 184 253 A V H X S+ 0 0 24 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.859 116.6 44.9 -54.7 -38.3 75.4 25.3 49.0 185 254 A W H X S+ 0 0 68 -4,-1.3 4,-2.1 -5,-0.2 -2,-0.2 0.955 113.9 46.4 -71.1 -52.8 75.9 28.0 46.5 186 255 A S H X S+ 0 0 9 -4,-3.1 4,-2.9 -139,-0.3 5,-0.2 0.857 110.7 53.2 -60.3 -38.4 77.3 30.7 48.8 187 256 A I H X S+ 0 0 0 -4,-2.7 4,-3.2 -5,-0.2 5,-0.2 0.963 110.6 45.9 -62.7 -50.7 79.7 28.2 50.4 188 257 A E H < S+ 0 0 78 -4,-1.5 4,-0.5 -5,-0.3 -1,-0.2 0.877 118.0 45.3 -58.3 -37.2 81.2 27.1 47.1 189 258 A A H X S+ 0 0 13 -4,-2.1 4,-0.7 2,-0.2 3,-0.3 0.837 114.1 47.7 -75.6 -34.8 81.4 30.8 46.1 190 259 A Y H >< S+ 0 0 22 -4,-2.9 3,-0.8 1,-0.2 -2,-0.2 0.883 104.3 59.2 -74.7 -38.6 82.8 31.9 49.4 191 260 A R T 3< S+ 0 0 40 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.690 102.6 56.4 -65.1 -15.7 85.5 29.1 49.5 192 261 A K T 34 S+ 0 0 115 -4,-0.5 -1,-0.2 -3,-0.3 -2,-0.2 0.775 84.2 99.2 -85.6 -27.9 86.8 30.5 46.3 193 262 A K X< - 0 0 49 -3,-0.8 3,-0.8 -4,-0.7 -3,-0.0 -0.337 66.7-145.9 -63.0 138.5 87.4 34.1 47.5 194 263 A E T 3 S+ 0 0 191 1,-0.2 -1,-0.1 -2,-0.0 -4,-0.0 0.845 101.8 46.7 -71.6 -35.7 91.0 34.9 48.5 195 264 A D T 3 S+ 0 0 138 2,-0.1 -1,-0.2 3,-0.0 -2,-0.1 0.219 83.3 140.1 -91.4 13.3 89.8 37.1 51.3 196 265 A A < - 0 0 6 -3,-0.8 2,-0.8 -6,-0.2 3,-0.0 -0.343 63.8-110.5 -60.2 133.4 87.3 34.6 52.6 197 266 A N > - 0 0 62 1,-0.2 4,-3.0 -2,-0.1 5,-0.2 -0.545 26.2-157.3 -69.0 107.6 87.1 34.4 56.4 198 267 A Q H > S+ 0 0 91 -2,-0.8 4,-1.6 1,-0.2 -1,-0.2 0.766 89.8 51.4 -58.6 -28.9 88.6 31.0 57.1 199 268 A V H > S+ 0 0 30 2,-0.2 4,-2.0 1,-0.1 -1,-0.2 0.955 114.7 41.2 -72.7 -50.6 86.9 30.7 60.5 200 269 A L H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.883 112.9 55.3 -62.9 -41.9 83.4 31.5 59.1 201 270 A L H X S+ 0 0 5 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.926 109.2 47.1 -58.3 -46.7 84.0 29.4 56.0 202 271 A E H X S+ 0 0 31 -4,-1.6 4,-2.7 -5,-0.2 -1,-0.2 0.885 111.2 50.4 -64.4 -40.1 84.8 26.4 58.2 203 272 A L H X S+ 0 0 0 -4,-2.0 4,-3.5 2,-0.2 5,-0.3 0.953 110.5 50.9 -63.3 -46.7 81.8 26.9 60.4 204 273 A A H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.935 112.8 44.8 -54.6 -52.3 79.6 27.1 57.4 205 274 A I H X S+ 0 0 2 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.965 116.7 45.8 -57.9 -54.5 80.9 23.9 55.9 206 275 A L H X S+ 0 0 16 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.940 114.3 46.6 -54.5 -54.0 80.7 22.1 59.2 207 276 A D H X S+ 0 0 1 -4,-3.5 4,-2.3 -5,-0.2 5,-0.3 0.881 111.5 52.3 -60.1 -39.3 77.3 23.2 60.1 208 277 A Y H X S+ 0 0 2 -4,-2.6 4,-3.0 -5,-0.3 -1,-0.2 0.969 113.4 41.7 -62.0 -53.8 75.9 22.5 56.6 209 278 A N H X S+ 0 0 38 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.836 112.9 56.7 -62.1 -31.6 77.1 18.9 56.6 210 279 A M H X S+ 0 0 19 -4,-2.3 4,-1.0 -5,-0.3 -1,-0.2 0.917 112.0 39.8 -65.8 -45.0 76.1 18.5 60.2 211 280 A I H >X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 3,-0.8 0.932 110.2 60.0 -69.4 -46.5 72.5 19.5 59.5 212 281 A Q H 3X S+ 0 0 3 -4,-3.0 4,-2.1 1,-0.3 -2,-0.2 0.861 100.5 56.4 -49.7 -37.6 72.6 17.5 56.2 213 282 A S H 3X S+ 0 0 57 -4,-1.7 4,-2.2 1,-0.2 -1,-0.3 0.900 102.4 55.1 -62.1 -40.7 73.3 14.4 58.3 214 283 A V H + 0 0 0 -5,-0.4 4,-1.8 1,-0.2 7,-0.2 0.843 66.3 53.8 -71.4 -34.5 52.0 1.8 48.1 232 301 A A H 4 S+ 0 0 21 1,-0.2 -1,-0.2 2,-0.2 6,-0.1 0.849 103.1 56.2 -70.1 -35.5 53.8 2.4 44.8 233 302 A T H 4 S+ 0 0 97 1,-0.2 -1,-0.2 3,-0.0 -2,-0.2 0.845 113.5 40.1 -66.7 -32.7 54.7 -1.3 44.3 234 303 A K H < S+ 0 0 144 -4,-1.0 2,-1.1 1,-0.2 -1,-0.2 0.798 107.3 65.3 -85.5 -31.7 51.1 -2.4 44.5 235 304 A L < - 0 0 5 -4,-1.8 3,-0.4 1,-0.2 -1,-0.2 -0.792 67.8-171.2 -94.5 95.9 49.7 0.5 42.5 236 305 A H S S+ 0 0 176 -2,-1.1 -1,-0.2 1,-0.2 -4,-0.1 0.682 83.9 50.1 -62.1 -18.9 51.2 -0.2 39.1 237 306 A F S S+ 0 0 56 -3,-0.1 -1,-0.2 2,-0.1 -5,-0.1 0.794 92.2 94.6 -89.8 -31.3 49.9 3.2 37.8 238 307 A A - 0 0 15 -3,-0.4 2,-0.4 -7,-0.2 36,-0.1 -0.196 67.5-134.5 -64.3 151.3 51.3 5.3 40.7 239 308 A R - 0 0 89 34,-0.1 2,-0.5 2,-0.0 38,-0.1 -0.851 15.3-124.8-109.2 142.8 54.6 7.1 40.7 240 309 A D + 0 0 83 -2,-0.4 4,-0.1 1,-0.1 3,-0.0 -0.761 38.3 156.7 -90.7 125.0 57.2 7.1 43.5 241 310 A R > + 0 0 80 -2,-0.5 4,-0.9 29,-0.1 32,-0.1 -0.304 25.9 124.9-142.6 52.5 58.3 10.5 44.8 242 311 A L H > S+ 0 0 4 2,-0.2 4,-2.1 3,-0.1 5,-0.1 0.914 80.7 42.6 -79.6 -44.7 59.5 9.9 48.3 243 312 A I H > S+ 0 0 96 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.925 114.4 51.8 -66.6 -44.3 63.0 11.4 47.9 244 313 A E H > S+ 0 0 87 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.864 109.6 52.7 -59.3 -35.6 61.5 14.3 45.9 245 314 A S H X S+ 0 0 0 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3,-1.9 2,-0.1 -252,-0.0 -0.257 74.2-131.1 -48.1 129.0 66.0 24.0 60.9 256 325 A P G > S+ 0 0 2 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.874 101.8 67.3 -54.1 -42.0 67.3 20.7 62.3 257 326 A Q G 3 S+ 0 0 59 1,-0.3 3,-0.4 2,-0.1 -2,-0.1 0.621 88.2 74.6 -56.6 -10.8 65.0 20.7 65.3 258 327 A Y G <> + 0 0 44 -3,-1.9 4,-2.0 1,-0.2 -1,-0.3 -0.033 47.3 127.5 -96.7 34.6 62.1 20.3 62.8 259 328 A S H <> S+ 0 0 28 -3,-0.8 4,-2.8 1,-0.2 5,-0.2 0.883 75.4 56.7 -54.4 -35.7 62.5 16.6 61.8 260 329 A D H > S+ 0 0 106 -3,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.965 106.9 44.3 -57.9 -58.6 58.9 16.2 62.7 261 330 A C H > S+ 0 0 0 128,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.811 113.6 54.4 -56.1 -34.2 57.5 18.8 60.4 262 331 A R H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.957 111.0 41.9 -67.6 -51.8 59.8 17.4 57.7 263 332 A N H X S+ 0 0 24 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.837 114.0 54.4 -63.8 -34.0 58.6 13.8 58.0 264 333 A S H X S+ 0 0 14 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.896 113.1 40.8 -68.8 -41.0 55.0 15.1 58.2 265 334 A V H X S+ 0 0 1 -4,-2.1 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111.3 54.4 -67.9 -57.8 46.3 7.2 54.3 318 387 A Y H X S+ 0 0 35 -4,-3.5 4,-2.5 1,-0.2 -2,-0.2 0.864 112.9 42.4 -41.8 -53.6 43.9 6.5 57.2 319 388 A N H X S+ 0 0 73 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.951 110.9 53.8 -64.4 -51.1 46.6 5.0 59.4 320 389 A T H X S+ 0 0 6 -4,-2.0 4,-1.7 -5,-0.2 -2,-0.2 0.914 114.7 41.9 -50.9 -47.0 49.3 7.5 58.6 321 390 A I H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.943 112.7 51.9 -65.6 -49.6 47.0 10.4 59.6 322 391 A N H X S+ 0 0 45 -4,-2.5 4,-1.9 -5,-0.3 -1,-0.2 0.807 108.7 54.5 -57.7 -27.5 45.7 8.6 62.7 323 392 A E H X S+ 0 0 113 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.896 108.2 46.6 -72.2 -42.6 49.3 8.1 63.6 324 393 A I H X S+ 0 0 18 -4,-1.7 4,-2.1 -5,-0.2 -2,-0.2 0.893 112.3 51.4 -65.9 -39.7 50.1 11.8 63.4 325 394 A A H X S+ 0 0 7 -4,-2.8 4,-2.5 1,-0.2 11,-0.3 0.912 107.6 52.5 -63.4 -42.4 47.0 12.5 65.4 326 395 A Y H X S+ 0 0 141 -4,-1.9 4,-2.5 -5,-0.2 -1,-0.2 0.886 107.4 53.0 -61.3 -39.2 48.1 10.0 68.1 327 396 A D H X S+ 0 0 63 -4,-1.9 4,-2.1 2,-0.2 5,-0.2 0.948 110.1 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106.8-124.9 -91.4 11.8 32.5 17.4 31.3 361 430 A K T < 5 + 0 0 182 -3,-1.9 -3,-0.2 -5,-0.2 -4,-0.1 0.782 50.5 174.4 50.9 28.4 34.8 19.3 29.0 362 431 A S < - 0 0 22 -5,-2.1 -1,-0.1 -6,-0.3 -5,-0.0 -0.147 29.2-155.9 -61.6 159.1 34.0 22.4 31.2 363 432 A T - 0 0 37 -3,-0.1 298,-0.4 72,-0.0 299,-0.2 -0.514 19.2-173.9-137.5 65.4 35.8 25.7 30.7 364 433 A P - 0 0 9 0, 0.0 80,-0.1 0, 0.0 296,-0.0 -0.212 32.8 -95.7 -60.9 151.5 35.5 27.5 34.0 365 434 A T >> - 0 0 8 1,-0.1 4,-2.5 78,-0.1 3,-1.1 -0.334 36.3-105.7 -67.9 150.2 36.7 31.1 34.3 366 435 A F H 3> S+ 0 0 12 74,-0.5 4,-2.9 1,-0.3 5,-0.4 0.873 120.4 57.1 -41.6 -48.8 40.2 31.8 35.5 367 436 A D H 3> S+ 0 0 85 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.865 111.5 40.4 -53.4 -43.2 38.8 32.9 38.8 368 437 A D H <> S+ 0 0 57 -3,-1.1 4,-1.0 2,-0.2 -1,-0.2 0.924 116.3 48.6 -73.6 -46.7 37.0 29.7 39.5 369 438 A Y H >X S+ 0 0 19 -4,-2.5 4,-2.8 1,-0.2 3,-0.6 0.924 115.5 43.2 -57.9 -49.8 39.7 27.4 38.2 370 439 A F H 3X S+ 0 0 20 -4,-2.9 4,-2.3 -5,-0.3 5,-0.3 0.888 105.3 62.8 -65.8 -40.1 42.4 29.0 40.2 371 440 A G H 3< S+ 0 0 22 -4,-1.5 -1,-0.2 -5,-0.4 4,-0.2 0.786 115.6 33.8 -56.4 -25.9 40.3 29.3 43.3 372 441 A N H 4 S+ 0 0 63 -3,-0.4 3,-1.5 -5,-0.3 6,-0.3 0.897 111.3 50.0 -78.7 -40.8 43.6 24.3 47.1 376 445 A S H 3< S+ 0 0 3 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.544 92.4 77.5 -73.7 -4.9 44.2 21.2 45.0 377 446 A S T 3< S- 0 0 8 -4,-0.6 -1,-0.3 -5,-0.2 -2,-0.2 0.781 100.9-133.0 -72.7 -23.3 47.9 22.1 45.0 378 447 A S S <> S+ 0 0 0 -3,-1.5 4,-3.0 -4,-0.3 5,-0.2 0.320 71.7 123.5 85.9 -3.8 47.9 20.6 48.5 379 448 A G H > S+ 0 0 0 -5,-0.4 4,-2.5 1,-0.2 5,-0.2 0.964 72.1 45.5 -51.6 -62.1 49.8 23.7 49.7 380 449 A P H > S+ 0 0 4 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.867 114.2 50.4 -52.5 -37.3 47.2 24.7 52.4 381 450 A L H > S+ 0 0 4 -6,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.914 108.5 52.2 -66.7 -42.4 47.0 21.1 53.6 382 451 A Q H X S+ 0 0 1 -4,-3.0 4,-2.6 -3,-0.2 -1,-0.2 0.941 112.5 45.4 -59.5 -45.0 50.8 20.8 53.8 383 452 A L H X S+ 0 0 1 -4,-2.5 4,-3.4 2,-0.2 -2,-0.2 0.941 107.6 55.7 -65.0 -46.5 50.9 24.0 55.9 384 453 A I H X S+ 0 0 8 -4,-2.8 4,-1.4 1,-0.3 -1,-0.2 0.929 112.6 44.6 -52.2 -43.8 48.0 22.9 58.2 385 454 A F H X S+ 0 0 3 -4,-2.3 4,-1.0 1,-0.2 -1,-0.3 0.931 112.0 51.6 -66.4 -42.4 50.0 19.8 58.9 386 455 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 3,-0.5 0.875 102.0 63.7 -60.1 -37.8 53.2 21.8 59.3 387 456 A Y H >X S+ 0 0 0 -4,-3.4 4,-2.6 1,-0.3 3,-0.7 0.952 103.2 44.7 -50.0 -59.3 51.4 24.1 61.8 388 457 A F H 3< S+ 0 0 5 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.726 117.5 47.9 -60.5 -21.9 50.9 21.3 64.3 389 458 A A H 3< S+ 0 0 25 -4,-1.0 -128,-0.4 -3,-0.5 -1,-0.2 0.675 116.7 39.6 -93.8 -19.7 54.5 20.2 63.8 390 459 A V H << S+ 0 0 13 -4,-2.1 2,-0.4 -3,-0.7 -2,-0.2 0.851 105.9 62.3 -97.7 -40.2 56.1 23.6 64.1 391 460 A V < - 0 0 13 -4,-2.6 3,-0.1 -5,-0.3 -1,-0.1 -0.726 59.6-161.7 -90.5 133.7 54.2 25.3 67.0 392 461 A Q S S+ 0 0 125 -2,-0.4 2,-0.7 1,-0.2 -1,-0.1 0.815 83.5 49.8 -81.5 -30.7 54.3 23.7 70.4 393 462 A N S S- 0 0 115 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.887 77.4-157.3-113.0 104.0 51.3 25.5 71.7 394 463 A I - 0 0 28 -2,-0.7 2,-0.5 -3,-0.1 3,-0.1 -0.597 7.0-150.7 -79.7 134.9 48.3 25.3 69.4 395 464 A K >> - 0 0 126 -2,-0.3 4,-1.7 1,-0.1 3,-0.9 -0.924 16.1-134.4-110.9 130.5 45.7 28.1 69.9 396 465 A K H 3> S+ 0 0 133 -2,-0.5 4,-1.7 1,-0.3 5,-0.2 0.863 106.2 55.6 -45.0 -43.8 42.1 27.4 69.1 397 466 A E H 3> S+ 0 0 112 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.883 106.6 48.8 -60.9 -41.3 41.9 30.7 67.2 398 467 A E H X> S+ 0 0 8 -3,-0.9 4,-2.5 2,-0.2 3,-0.6 0.971 109.5 49.4 -64.3 -55.3 44.8 29.9 64.8 399 468 A I H 3X S+ 0 0 5 -4,-1.7 4,-2.5 1,-0.3 -1,-0.2 0.858 109.2 54.4 -53.7 -37.4 43.6 26.4 63.8 400 469 A E H 3X S+ 0 0 76 -4,-1.7 4,-1.0 -5,-0.3 -1,-0.3 0.878 109.3 47.5 -64.9 -38.0 40.1 27.9 63.1 401 470 A N H <<>S+ 0 0 48 -4,-1.4 5,-1.5 -3,-0.6 3,-0.4 0.903 111.3 50.1 -69.7 -41.3 41.7 30.5 60.7 402 471 A L H ><5S+ 0 0 2 -4,-2.5 3,-2.1 1,-0.2 -2,-0.2 0.918 106.8 56.0 -62.3 -41.0 43.8 27.9 59.0 403 472 A Q H 3<5S+ 0 0 58 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.806 107.8 47.9 -60.8 -28.2 40.7 25.8 58.5 404 473 A K T 3<5S- 0 0 153 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.182 123.3-109.0 -97.2 15.5 39.1 28.8 56.8 405 474 A Y T < 5 - 0 0 38 -3,-2.1 -3,-0.2 1,-0.1 -2,-0.1 0.937 41.6-155.3 53.8 60.3 42.2 29.1 54.6 406 475 A H >>< - 0 0 42 -5,-1.5 4,-2.4 1,-0.1 3,-1.9 -0.147 29.5-103.0 -57.5 154.6 43.6 32.3 56.1 407 476 A D H 3> S+ 0 0 72 1,-0.3 4,-1.8 2,-0.2 -1,-0.1 0.737 114.6 74.4 -53.9 -25.8 45.9 34.4 53.9 408 477 A I H 34 S+ 0 0 7 1,-0.2 -1,-0.3 2,-0.2 -6,-0.0 0.814 116.0 17.7 -61.0 -31.2 49.0 33.1 55.8 409 478 A I H <> S+ 0 0 0 -3,-1.9 4,-0.8 2,-0.1 -2,-0.2 0.623 123.9 57.9-112.3 -23.4 48.7 29.8 54.1 410 479 A S H X S+ 0 0 5 -4,-2.4 4,-2.0 2,-0.2 3,-0.3 0.951 103.0 54.1 -72.5 -46.5 46.5 30.7 51.1 411 480 A R H X S+ 0 0 40 -4,-1.8 4,-1.5 1,-0.3 3,-0.4 0.930 110.6 43.8 -52.1 -55.4 48.8 33.3 49.8 412 481 A P H > S+ 0 0 2 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.777 111.7 56.5 -64.9 -23.2 51.9 31.0 49.6 413 482 A S H X S+ 0 0 0 -4,-0.8 4,-2.3 -3,-0.3 5,-0.2 0.850 98.8 60.5 -74.2 -33.2 49.6 28.4 48.1 414 483 A H H X S+ 0 0 41 -4,-2.0 4,-2.0 -3,-0.4 -1,-0.2 0.960 108.3 43.6 -55.6 -51.6 48.7 30.8 45.4 415 484 A I H X S+ 0 0 0 -4,-1.5 4,-3.5 2,-0.2 5,-0.3 0.900 108.4 58.1 -60.6 -44.6 52.3 31.0 44.3 416 485 A F H X S+ 0 0 3 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.951 110.2 43.2 -49.8 -56.8 52.8 27.2 44.6 417 486 A R H X S+ 0 0 24 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.864 116.1 49.1 -59.2 -40.5 50.0 26.6 42.1 418 487 A L H X S+ 0 0 1 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.932 108.1 49.9 -68.4 -48.7 51.3 29.4 39.8 419 488 A C H X S+ 0 0 12 -4,-3.5 4,-1.0 2,-0.2 -1,-0.2 0.894 115.5 48.1 -56.6 -37.6 54.9 28.4 39.7 420 489 A N H >X S+ 0 0 39 -4,-1.9 4,-1.7 -5,-0.3 3,-1.1 0.976 112.0 44.1 -66.1 -60.5 53.7 24.9 38.9 421 490 A D H 3X S+ 0 0 4 -4,-2.6 4,-1.4 1,-0.3 -1,-0.2 0.803 108.3 61.8 -57.0 -29.9 51.2 25.7 36.1 422 491 A L H 3< S+ 0 0 33 -4,-2.3 4,-0.5 -5,-0.2 -1,-0.3 0.866 103.8 48.9 -64.7 -35.3 53.8 28.1 34.6 423 492 A A H << S+ 0 0 55 -3,-1.1 4,-0.4 -4,-1.0 3,-0.2 0.926 119.4 36.2 -70.0 -45.2 56.2 25.1 34.1 424 493 A S H X S+ 0 0 28 -4,-1.7 4,-2.4 1,-0.2 5,-0.4 0.543 92.8 97.3 -85.0 -7.3 53.6 22.9 32.4 425 494 A A H X S+ 0 0 3 -4,-1.4 4,-2.8 -5,-0.2 5,-0.3 0.916 82.9 45.2 -46.7 -61.4 51.9 25.9 30.6 426 495 A S H > S+ 0 0 72 -4,-0.5 4,-2.8 -3,-0.2 5,-0.3 0.943 117.4 42.2 -49.7 -61.3 53.7 25.5 27.2 427 496 A A H > S+ 0 0 54 -4,-0.4 4,-1.5 1,-0.2 6,-0.2 0.956 118.0 44.2 -52.9 -60.1 53.3 21.7 26.9 428 497 A E H <>S+ 0 0 32 -4,-2.4 5,-2.9 1,-0.2 -1,-0.2 0.854 115.7 48.8 -56.2 -39.5 49.7 21.5 28.1 429 498 A I H ><5S+ 0 0 33 -4,-2.8 3,-1.9 -5,-0.4 -1,-0.2 0.952 112.4 46.7 -65.9 -50.5 48.6 24.5 26.0 430 499 A A H 3<5S+ 0 0 91 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.709 107.1 60.1 -63.9 -21.0 50.2 23.2 22.9 431 500 A R T 3<5S- 0 0 152 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.206 122.6-108.2 -92.3 14.8 48.6 19.9 23.6 432 501 A G T < 5S+ 0 0 65 -3,-1.9 -3,-0.2 1,-0.2 2,-0.2 0.583 71.4 145.3 71.1 12.2 45.2 21.6 23.5 433 502 A E < - 0 0 66 -5,-2.9 -1,-0.2 -6,-0.2 -2,-0.1 -0.512 35.6-173.2 -84.5 149.7 44.6 21.4 27.2 434 503 A T + 0 0 53 -2,-0.2 2,-1.8 1,-0.1 6,-0.2 0.326 59.7 103.5-119.9 1.4 42.8 24.1 29.3 435 504 A A + 0 0 34 -7,-0.1 2,-0.3 4,-0.1 -1,-0.1 -0.371 62.7 91.8 -82.9 59.0 43.5 22.6 32.7 436 505 A N S >> S- 0 0 0 -2,-1.8 4,-2.3 1,-0.1 3,-0.9 -0.929 76.5-130.4-156.6 126.6 46.2 25.1 33.5 437 506 A S H 3> S+ 0 0 0 -2,-0.3 4,-2.5 1,-0.3 5,-0.2 0.874 111.5 51.0 -42.6 -49.1 46.1 28.5 35.2 438 507 A V H 3> S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.879 110.0 50.7 -59.4 -38.1 48.0 30.2 32.4 439 508 A S H <> S+ 0 0 6 -3,-0.9 4,-2.4 2,-0.2 -1,-0.2 0.916 110.1 49.0 -65.8 -44.1 45.6 28.7 29.9 440 509 A C H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 -74,-0.5 0.887 108.1 54.4 -63.0 -38.8 42.6 29.9 31.8 441 510 A Y H X S+ 0 0 43 -4,-2.5 4,-1.6 -5,-0.3 -1,-0.2 0.869 108.3 50.9 -65.2 -31.7 44.1 33.3 32.0 442 511 A M H X>S+ 0 0 40 -4,-1.5 4,-1.3 -5,-0.2 5,-1.2 0.987 115.8 38.8 -65.8 -58.8 44.5 33.3 28.2 443 512 A R H <5S+ 0 0 86 -4,-2.4 216,-0.2 1,-0.2 -2,-0.2 0.888 116.0 51.5 -59.5 -43.3 40.9 32.3 27.5 444 513 A T H <5S+ 0 0 14 -4,-3.0 215,-0.3 1,-0.2 -1,-0.2 0.859 123.8 28.9 -64.5 -36.3 39.4 34.5 30.3 445 514 A K H <5S- 0 0 64 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.396 101.7-130.1-103.2 -1.5 41.3 37.6 29.1 446 515 A G T <5 + 0 0 64 -4,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.960 60.9 131.8 48.8 63.9 41.5 36.6 25.4 447 516 A I < - 0 0 50 -5,-1.2 -1,-0.2 -6,-0.1 -2,-0.1 -0.928 59.5 -86.0-141.0 164.6 45.2 37.3 25.1 448 517 A S > - 0 0 43 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.102 41.6-107.0 -64.9 166.9 48.4 35.6 23.8 449 518 A E H > S+ 0 0 48 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.944 119.9 53.5 -62.3 -46.1 50.4 33.1 25.9 450 519 A E H > S+ 0 0 130 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.896 111.6 45.1 -55.0 -44.7 53.2 35.7 26.4 451 520 A L H > S+ 0 0 82 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.908 113.5 49.6 -66.2 -43.1 50.8 38.2 27.7 452 521 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.911 110.8 50.7 -62.5 -42.5 49.1 35.6 29.9 453 522 A T H X S+ 0 0 37 -4,-3.2 4,-2.4 1,-0.2 -1,-0.2 0.902 107.6 52.4 -62.4 -43.0 52.5 34.5 31.3 454 523 A E H X S+ 0 0 112 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.898 109.2 50.7 -60.5 -40.0 53.5 38.1 32.1 455 524 A S H X S+ 0 0 30 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.903 107.9 51.5 -65.9 -40.4 50.3 38.5 34.0 456 525 A V H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.939 110.1 50.7 -60.8 -45.1 50.8 35.3 36.0 457 526 A M H X S+ 0 0 88 -4,-2.4 4,-2.1 1,-0.2 3,-0.3 0.944 111.8 46.4 -56.8 -50.6 54.3 36.6 36.9 458 527 A N H X S+ 0 0 95 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.846 108.6 55.8 -61.7 -34.1 52.9 40.0 38.0 459 528 A L H X S+ 0 0 60 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.866 107.3 50.5 -64.6 -36.6 50.2 38.2 40.0 460 529 A I H X S+ 0 0 6 -4,-1.9 4,-2.4 -3,-0.3 -2,-0.2 0.908 108.2 52.0 -66.2 -45.1 53.0 36.3 41.8 461 530 A D H X S+ 0 0 30 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.861 109.1 49.9 -60.6 -38.7 54.9 39.6 42.5 462 531 A E H X S+ 0 0 68 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.834 108.6 53.6 -70.5 -31.8 51.7 41.1 44.0 463 532 A T H X S+ 0 0 8 -4,-1.4 4,-2.7 2,-0.2 3,-0.3 0.945 104.8 53.6 -67.1 -46.8 51.3 38.0 46.2 464 533 A W H X S+ 0 0 2 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.935 105.4 54.8 -51.8 -49.5 54.8 38.3 47.6 465 534 A K H X S+ 0 0 12 -4,-1.8 4,-1.4 1,-0.2 -331,-0.3 0.884 108.9 47.8 -51.5 -44.1 54.1 41.9 48.6 466 535 A K H >X S+ 0 0 64 -4,-1.5 4,-1.9 -3,-0.3 3,-0.7 0.957 111.5 49.8 -63.9 -48.5 51.1 40.7 50.6 467 536 A M H 3X S+ 0 0 6 -4,-2.7 4,-2.0 1,-0.3 -2,-0.2 0.884 105.7 57.4 -56.1 -41.1 53.0 37.9 52.2 468 537 A N H 3X S+ 0 0 12 -4,-3.0 4,-1.9 -336,-0.2 -1,-0.3 0.855 105.6 51.3 -59.9 -33.9 55.8 40.4 53.1 469 538 A K H > - 0 0 46 1,-0.1 4,-2.1 -2,-0.1 3,-0.6 -0.444 33.9-118.8 -71.9 145.0 53.8 33.3 65.3 479 548 A K H 3> S+ 0 0 98 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.892 111.4 61.8 -50.1 -44.8 56.6 34.7 63.1 480 549 A P H 3> S+ 0 0 70 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.886 107.5 41.8 -48.4 -49.6 58.1 31.1 62.9 481 550 A F H <> S+ 0 0 1 -3,-0.6 4,-3.4 2,-0.2 5,-0.2 0.892 110.4 57.2 -69.3 -38.9 55.1 29.6 61.2 482 551 A V H X S+ 0 0 2 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.899 109.6 45.9 -59.1 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0.924 107.4 52.3 -59.6 -47.5 2.4 45.7 52.9 547 92 B E H X S+ 0 0 54 -4,-1.5 4,-1.9 1,-0.2 -1,-0.2 0.896 109.9 48.3 -57.7 -43.2 0.6 43.3 50.7 548 93 B V H X S+ 0 0 5 -4,-2.1 4,-2.1 2,-0.2 5,-0.2 0.942 110.2 51.2 -63.6 -45.9 3.4 43.1 48.3 549 94 B R H X S+ 0 0 119 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.872 108.0 55.1 -56.4 -37.3 5.9 42.5 51.1 550 95 B R H X S+ 0 0 141 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.905 108.7 46.6 -62.3 -44.4 3.6 39.8 52.3 551 96 B E H < S+ 0 0 68 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.801 112.3 48.8 -69.6 -31.9 3.8 38.1 48.9 552 97 B I H < S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.822 115.9 44.8 -76.7 -29.9 7.5 38.3 48.7 553 98 B N H < S+ 0 0 17 -4,-1.9 2,-0.5 -5,-0.2 -2,-0.2 0.535 79.5 122.7 -88.9 -10.5 7.9 36.9 52.2 554 99 B N >< - 0 0 47 -4,-0.8 3,-1.1 1,-0.2 -3,-0.0 -0.407 45.4-165.5 -58.2 109.5 5.3 34.1 51.7 555 100 B E T 3 S+ 0 0 131 -2,-0.5 -1,-0.2 1,-0.2 -4,-0.1 0.188 82.7 61.9 -83.4 16.8 7.4 31.0 52.5 556 101 B K T 3 S+ 0 0 182 2,-0.1 2,-0.2 3,-0.0 -1,-0.2 0.154 77.8 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127.2 85.2 4.4 33.6 64.1 32.1 903 448 B G H > S+ 0 0 0 -5,-0.4 4,-2.5 1,-0.2 5,-0.2 0.944 74.3 41.8 -56.1 -51.0 32.4 60.7 33.2 904 449 B P H > S+ 0 0 3 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.899 112.5 54.6 -66.6 -35.9 34.9 60.4 36.0 905 450 B L H > S+ 0 0 5 -6,-0.3 4,-1.8 1,-0.2 -2,-0.2 0.944 111.1 46.5 -61.8 -44.5 34.4 64.0 37.0 906 451 B Q H X S+ 0 0 2 -4,-3.0 4,-3.0 1,-0.2 -1,-0.2 0.950 113.2 46.4 -62.3 -48.5 30.7 63.4 37.4 907 452 B L H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.859 110.2 54.9 -63.3 -33.3 31.1 60.2 39.3 908 453 B I H X S+ 0 0 9 -4,-2.6 4,-1.0 2,-0.2 -1,-0.2 0.870 112.1 43.6 -65.8 -37.4 33.7 61.9 41.6 909 454 B F H X S+ 0 0 2 -4,-1.8 4,-0.7 -5,-0.2 -2,-0.2 0.896 111.9 53.4 -74.2 -38.9 31.1 64.6 42.3 910 455 B A H >X S+ 0 0 0 -4,-3.0 4,-1.1 1,-0.2 3,-0.9 0.856 98.6 67.0 -62.8 -34.5 28.4 62.0 42.7 911 456 B Y H >X S+ 0 0 1 -4,-2.3 4,-2.6 1,-0.3 3,-1.2 0.938 100.4 46.1 -49.9 -56.7 30.6 60.2 45.3 912 457 B F H 3< S+ 0 0 5 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.673 115.3 48.6 -63.0 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15.6 965 510 B Y T <> S+ 0 0 43 -3,-1.5 4,-1.3 -5,-0.2 5,-0.3 0.804 107.2 55.0-100.1 -48.1 41.0 52.9 15.9 966 511 B M T < S+ 0 0 46 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.1 0.242 110.5 52.5 -72.7 16.9 40.6 52.0 12.3 967 512 B R T 4 S+ 0 0 77 -5,-0.2 -1,-0.2 3,-0.2 -2,-0.2 0.658 107.6 44.9-117.1 -40.8 43.7 54.0 11.7 968 513 B T T 4 S+ 0 0 66 -4,-0.4 -2,-0.2 -3,-0.2 -3,-0.1 0.606 127.3 34.5 -79.6 -12.1 46.0 52.4 14.3 969 514 B K S < S- 0 0 133 -4,-1.3 -1,-0.2 2,-0.1 -3,-0.2 0.568 100.5-134.6-112.1 -21.3 44.7 49.0 13.1 970 515 B G + 0 0 64 -5,-0.3 2,-0.2 1,-0.2 -3,-0.2 0.877 58.0 136.5 66.8 38.6 44.3 49.9 9.4 971 516 B I - 0 0 54 -6,-0.2 -1,-0.2 1,-0.1 -2,-0.1 -0.575 57.3 -89.9-111.8 175.4 40.8 48.3 9.3 972 517 B S > - 0 0 53 -2,-0.2 4,-2.3 1,-0.1 -1,-0.1 -0.257 37.5-108.5 -78.1 170.5 37.5 49.2 7.8 973 518 B E H > S+ 0 0 43 2,-0.2 4,-3.6 1,-0.2 5,-0.3 0.905 120.0 57.9 -66.5 -38.8 34.8 51.2 9.6 974 519 B E H > S+ 0 0 130 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.937 111.4 40.2 -55.5 -49.1 32.8 48.0 9.9 975 520 B L H > S+ 0 0 71 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.857 115.3 52.5 -68.7 -35.8 35.6 46.2 11.7 976 521 B A H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.957 112.0 44.4 -64.7 -50.0 36.4 49.3 13.7 977 522 B T H X S+ 0 0 41 -4,-3.6 4,-2.1 2,-0.2 -2,-0.2 0.896 115.2 50.5 -60.5 -40.1 32.8 49.7 14.9 978 523 B E H X S+ 0 0 105 -4,-2.2 4,-1.7 -5,-0.3 -2,-0.2 0.957 111.7 45.5 -62.3 -52.6 32.6 45.9 15.5 979 524 B S H X S+ 0 0 30 -4,-3.2 4,-1.4 1,-0.2 -2,-0.2 0.901 112.8 52.0 -58.9 -41.2 35.8 45.9 17.6 980 525 B V H X S+ 0 0 1 -4,-2.8 4,-1.1 1,-0.2 -1,-0.2 0.867 106.0 54.5 -63.4 -37.2 34.6 49.0 19.5 981 526 B M H X S+ 0 0 97 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.861 106.6 51.3 -64.6 -36.4 31.3 47.2 20.3 982 527 B N H X S+ 0 0 85 -4,-1.7 4,-2.8 1,-0.2 -1,-0.2 0.815 102.6 59.8 -71.1 -29.4 33.2 44.3 21.8 983 528 B L H X S+ 0 0 43 -4,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.836 102.7 53.1 -66.7 -30.7 35.2 46.7 23.9 984 529 B I H X S+ 0 0 9 -4,-1.1 4,-2.5 -3,-0.2 -1,-0.2 0.924 110.3 47.2 -69.0 -43.4 31.9 47.8 25.4 985 530 B D H X S+ 0 0 37 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.918 110.6 51.3 -63.0 -44.2 31.0 44.2 26.2 986 531 B E H X S+ 0 0 76 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.898 111.3 49.0 -59.7 -42.4 34.4 43.5 27.7 987 532 B T H X S+ 0 0 5 -4,-2.1 4,-2.3 1,-0.2 3,-0.4 0.918 107.3 53.4 -65.1 -44.5 34.0 46.6 29.9 988 533 B W H X S+ 0 0 4 -4,-2.5 4,-2.6 1,-0.3 -1,-0.2 0.898 107.6 52.8 -57.4 -39.0 30.5 45.6 31.1 989 534 B K H X S+ 0 0 31 -4,-2.0 4,-0.9 1,-0.2 -331,-0.5 0.828 109.0 49.5 -65.6 -31.4 32.0 42.2 32.1 990 535 B K H X S+ 0 0 51 -4,-1.3 4,-1.6 -3,-0.4 -1,-0.2 0.842 110.5 49.4 -76.5 -34.1 34.7 44.0 34.1 991 536 B M H X S+ 0 0 5 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.930 104.8 57.4 -70.4 -44.1 32.1 46.2 35.8 992 537 B N H X S+ 0 0 11 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.835 105.7 52.8 -54.7 -32.3 29.9 43.2 36.8 993 538 B K H X S+ 0 0 69 -4,-0.9 4,-1.5 2,-0.2 3,-0.4 0.954 106.0 51.7 -67.5 -49.4 32.9 41.8 38.6 994 539 B E H < S+ 0 0 29 -4,-1.6 5,-0.4 1,-0.3 3,-0.2 0.878 111.2 48.2 -54.9 -40.6 33.5 45.0 40.6 995 540 B K H < S+ 0 0 51 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.809 107.2 58.8 -71.3 -29.0 29.8 44.9 41.7 996 541 B L H < S- 0 0 51 -4,-1.4 2,-0.3 -3,-0.4 -2,-0.2 0.783 116.4 -64.6 -74.1 -27.9 30.1 41.2 42.6 997 542 B G S < S+ 0 0 37 -4,-1.5 -1,-0.2 -3,-0.2 3,-0.1 -0.955 100.0 72.3 163.9 177.4 32.8 41.5 45.2 998 543 B G + 0 0 91 -2,-0.3 -4,-0.1 1,-0.2 -3,-0.1 0.380 69.8 145.7 68.1 -5.7 36.4 42.3 46.2 999 544 B S - 0 0 24 -5,-0.4 -1,-0.2 -6,-0.2 4,-0.1 -0.215 48.1-151.9 -63.5 152.4 35.5 45.9 45.7 1000 545 B L S S+ 0 0 55 -3,-0.1 -1,-0.1 2,-0.1 2,-0.1 0.751 78.3 71.9 -91.8 -32.3 37.0 48.6 48.0 1001 546 B F S S- 0 0 6 1,-0.1 2,-0.1 -79,-0.1 -2,-0.1 -0.442 97.0 -94.4 -84.3 157.0 34.0 50.9 47.5 1002 547 B A >> - 0 0 53 -2,-0.1 4,-1.8 1,-0.1 3,-0.5 -0.428 33.4-120.2 -69.2 143.8 30.5 50.3 49.0 1003 548 B K H 3> S+ 0 0 71 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.880 108.7 64.2 -53.2 -41.5 28.1 48.6 46.6 1004 549 B P H 3> S+ 0 0 72 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.915 109.0 38.9 -48.3 -51.1 25.6 51.5 46.6 1005 550 B F H <> S+ 0 0 2 -3,-0.5 4,-2.1 2,-0.2 -2,-0.2 0.830 110.7 58.7 -71.6 -32.6 28.2 53.8 45.0 1006 551 B V H X S+ 0 0 2 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.919 107.1 48.9 -62.0 -41.4 29.5 51.1 42.7 1007 552 B E H X S+ 0 0 55 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.884 107.2 55.4 -63.9 -39.9 26.0 50.7 41.3 1008 553 B T H X S+ 0 0 4 -4,-1.4 4,-0.9 -5,-0.3 -1,-0.2 0.892 106.6 51.2 -61.6 -37.3 25.8 54.5 40.9 1009 554 B A H >X S+ 0 0 0 -4,-2.1 3,-1.4 1,-0.2 4,-0.7 0.957 109.6 48.6 -63.9 -49.7 28.9 54.3 38.8 1010 555 B I H >X S+ 0 0 5 -4,-2.2 4,-2.1 1,-0.3 3,-1.1 0.857 100.5 67.5 -58.3 -36.1 27.5 51.6 36.6 1011 556 B N H 3X S+ 0 0 12 -4,-2.5 4,-2.9 1,-0.3 -1,-0.3 0.842 91.4 60.7 -55.1 -32.9 24.4 53.7 36.2 1012 557 B L H > - 0 0 61 -5,-0.2 4,-3.3 1,-0.1 3,-1.7 -0.691 22.9-112.3 -99.0 152.4 12.8 59.4 15.5 1029 574 B P H 3> S+ 0 0 51 0, 0.0 4,-1.4 0, 0.0 -6,-0.3 0.935 120.4 34.3 -44.9 -63.9 16.2 59.8 17.1 1030 575 B D H 34 S+ 0 0 140 1,-0.2 4,-0.4 2,-0.2 -8,-0.0 0.409 119.4 57.7 -74.7 4.1 15.6 63.3 18.4 1031 576 B E H <> S+ 0 0 58 -3,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.804 99.6 51.3-100.8 -40.0 12.0 62.3 19.0 1032 577 B L H X S+ 0 0 16 -4,-3.3 4,-2.6 1,-0.2 5,-0.2 0.883 109.7 53.8 -64.3 -36.9 12.5 59.3 21.3 1033 578 B T H X S+ 0 0 47 -4,-1.4 4,-2.0 -5,-0.4 -1,-0.2 0.903 108.5 49.4 -63.2 -39.6 14.7 61.5 23.4 1034 579 B R H > S+ 0 0 118 -4,-0.4 4,-1.7 2,-0.2 -2,-0.2 0.941 112.0 46.8 -64.0 -49.6 11.8 64.0 23.6 1035 580 B K H X S+ 0 0 99 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.921 111.8 51.9 -58.0 -47.4 9.2 61.4 24.6 1036 581 B R H X S+ 0 0 20 -4,-2.6 4,-2.3 1,-0.2 5,-0.3 0.892 105.6 53.4 -58.7 -44.2 11.5 59.9 27.2 1037 582 B V H X>S+ 0 0 18 -4,-2.0 4,-2.3 1,-0.2 5,-1.1 0.893 112.9 44.6 -59.8 -39.8 12.2 63.3 28.9 1038 583 B L H <>S+ 0 0 44 -4,-1.7 5,-1.1 3,-0.2 -2,-0.2 0.920 114.1 48.7 -71.7 -42.1 8.5 63.9 29.3 1039 584 B S H <5S+ 0 0 27 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.782 119.9 37.6 -68.1 -28.7 7.8 60.4 30.5 1040 585 B V H <5S+ 0 0 3 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.812 136.8 10.2 -93.4 -33.4 10.6 60.4 33.1 1041 586 B I T <5S+ 0 0 5 -4,-2.3 -3,-0.2 -5,-0.3 -301,-0.2 0.823 127.9 32.6-111.6 -52.5 10.4 64.0 34.3 1042 587 B T T