==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 14-OCT-10 3APD . COMPND 2 MOLECULE: PHOSPHATIDYLINOSITOL-4,5-BISPHOSPHATE 3-KINASE CA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.NAKAMURA,T.A.FUKAMI,T.MIYAZAKI,M.YOSHIDA . 839 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36293.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 579 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 110 13.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 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 . 56 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 95 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 291 34.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 2 2 2 3 4 1 0 5 0 2 2 1 0 1 2 0 0 1 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 3 3 2 4 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 2 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 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 1 144 A S > 0 0 132 0, 0.0 4,-0.8 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -47.4 36.5 -27.1 51.9 2 145 A E H > + 0 0 94 2,-0.2 4,-0.7 3,-0.1 0, 0.0 0.881 360.0 37.6 -74.6 -47.3 38.4 -25.4 54.7 3 146 A E H >> S+ 0 0 145 1,-0.2 3,-1.3 2,-0.2 4,-1.1 0.961 118.1 50.3 -59.2 -55.0 40.9 -24.5 52.1 4 147 A S H 3> S+ 0 0 56 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.707 101.9 60.9 -66.2 -23.6 38.2 -23.9 49.4 5 148 A Q H 3X S+ 0 0 65 -4,-0.8 4,-0.7 1,-0.2 -1,-0.3 0.799 104.0 51.5 -69.9 -29.2 36.2 -21.6 51.7 6 149 A A H X S+ 0 0 21 -4,-1.1 4,-2.5 1,-0.2 3,-1.1 0.937 100.6 53.5 -57.2 -50.8 39.4 -19.3 47.9 8 151 A Q H 3X S+ 0 0 27 -4,-1.4 4,-2.3 1,-0.3 -1,-0.2 0.787 104.4 56.8 -53.8 -33.6 35.8 -17.9 47.7 9 152 A R H 3X S+ 0 0 62 -4,-0.7 4,-0.9 -3,-0.3 -1,-0.3 0.793 107.8 47.8 -69.7 -30.6 37.0 -15.0 50.0 10 153 A Q H XX S+ 0 0 47 -4,-1.1 4,-2.3 -3,-1.1 3,-1.8 0.978 110.3 50.5 -69.9 -60.3 39.8 -14.3 47.5 11 154 A L H 3X S+ 0 0 0 -4,-2.5 4,-3.8 1,-0.3 5,-0.2 0.888 108.1 56.0 -38.6 -49.1 37.3 -14.4 44.6 12 155 A T H 3X S+ 0 0 37 -4,-2.3 4,-1.9 1,-0.2 5,-0.5 0.803 107.7 46.1 -60.1 -32.1 35.2 -12.0 46.6 13 156 A A H << S+ 0 0 58 -3,-1.8 -1,-0.2 -4,-0.9 -2,-0.2 0.865 116.1 45.5 -80.3 -37.8 38.0 -9.4 47.0 14 157 A L H < S+ 0 0 7 -4,-2.3 -2,-0.2 1,-0.1 -3,-0.2 0.960 116.2 46.9 -60.7 -52.4 38.9 -9.7 43.3 15 158 A I H < S- 0 0 1 -4,-3.8 -2,-0.2 -5,-0.3 -3,-0.2 0.871 97.5-137.8 -61.6 -43.7 35.2 -9.5 42.3 16 159 A G S < S+ 0 0 49 -4,-1.9 2,-0.3 -5,-0.2 -3,-0.1 0.509 79.7 60.9 91.9 8.4 34.3 -6.5 44.6 17 160 A Y S S- 0 0 42 -5,-0.5 2,-0.9 -6,-0.2 -2,-0.1 -0.917 86.4-115.5-164.2 137.3 31.0 -8.1 45.6 18 161 A D > - 0 0 55 -2,-0.3 3,-1.4 1,-0.2 -9,-0.1 -0.667 18.8-162.7 -84.5 108.6 30.2 -11.4 47.4 19 162 A V T 3 S+ 0 0 15 -2,-0.9 -1,-0.2 1,-0.3 15,-0.1 0.388 88.7 57.3 -73.6 4.4 28.2 -13.6 45.0 20 163 A T T 3 S+ 0 0 56 11,-0.0 2,-1.4 2,-0.0 -1,-0.3 0.575 70.8 111.0-104.3 -15.7 27.1 -15.7 48.0 21 164 A D < - 0 0 81 -3,-1.4 3,-0.5 1,-0.2 -3,-0.0 -0.418 45.4-180.0 -60.5 91.8 25.4 -12.8 50.0 22 165 A V > + 0 0 85 -2,-1.4 3,-0.7 1,-0.2 -1,-0.2 0.102 47.5 106.0 -89.9 22.9 21.9 -14.1 49.5 23 166 A S T 3 S+ 0 0 83 1,-0.2 2,-1.3 3,-0.0 -1,-0.2 0.997 78.8 51.6 -57.8 -56.9 20.1 -11.3 51.4 24 167 A N T 3 S+ 0 0 6 -3,-0.5 2,-0.4 2,-0.1 266,-0.3 -0.302 86.0 96.0 -89.7 50.6 18.9 -9.7 48.2 25 168 A V < - 0 0 46 -2,-1.3 264,-0.1 -3,-0.7 3,-0.0 -0.967 44.5-169.4-135.8 133.0 17.2 -12.4 46.2 26 169 A H S S+ 0 0 49 -2,-0.4 2,-0.3 244,-0.0 -2,-0.1 0.150 85.6 10.0 -89.5 13.9 13.5 -13.4 46.0 27 170 A D S S- 0 0 45 0, 0.0 3,-0.2 0, 0.0 0, 0.0 -0.932 84.5 -95.7-167.3-170.7 14.6 -16.5 44.1 28 171 A D S > S+ 0 0 59 -2,-0.3 4,-1.7 1,-0.1 5,-0.1 -0.244 71.9 119.8-112.9 39.8 17.6 -18.7 43.1 29 172 A E H > S+ 0 0 7 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.947 76.4 52.2 -74.6 -43.3 18.4 -17.4 39.5 30 173 A L H > S+ 0 0 24 2,-0.2 4,-3.4 1,-0.2 3,-0.3 0.953 111.6 45.3 -50.4 -56.2 21.9 -16.3 40.4 31 174 A E H > S+ 0 0 52 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.880 110.8 54.7 -59.1 -38.2 22.8 -19.6 42.0 32 175 A F H X S+ 0 0 74 -4,-1.7 4,-1.6 2,-0.2 -1,-0.3 0.878 112.7 42.9 -62.3 -37.3 21.3 -21.4 39.0 33 176 A T H X S+ 0 0 0 -4,-2.2 4,-3.0 -3,-0.3 -2,-0.2 0.949 110.3 53.3 -75.0 -52.2 23.5 -19.3 36.7 34 177 A R H < S+ 0 0 36 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.806 116.3 43.8 -43.3 -34.6 26.6 -19.8 38.9 35 178 A R H >< S+ 0 0 134 -4,-1.7 3,-0.6 -5,-0.3 4,-0.3 0.766 111.8 52.3 -84.1 -33.0 25.7 -23.4 38.5 36 179 A G H >< S+ 0 0 15 -4,-1.6 3,-0.8 1,-0.2 -2,-0.2 0.855 102.3 59.2 -67.3 -35.3 24.9 -23.1 34.8 37 180 A L T 3X S+ 0 0 3 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.504 83.0 82.6 -79.2 -4.5 28.3 -21.5 34.0 38 181 A V H <> S+ 0 0 39 -3,-0.6 4,-2.3 -5,-0.2 -1,-0.2 0.889 91.4 49.1 -65.6 -40.6 30.4 -24.4 35.3 39 182 A T H <> S+ 0 0 102 -3,-0.8 4,-2.8 -4,-0.3 5,-0.2 0.974 111.0 44.4 -67.0 -58.7 30.0 -26.4 32.0 40 183 A P H > S+ 0 0 8 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.889 116.4 49.9 -56.7 -39.7 31.0 -23.7 29.4 41 184 A R H X S+ 0 0 15 -4,-1.6 4,-2.8 2,-0.2 5,-0.2 0.942 113.7 42.7 -58.7 -54.2 33.9 -22.7 31.6 42 185 A M H X S+ 0 0 83 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.832 112.8 56.8 -65.6 -31.4 35.3 -26.2 32.1 43 186 A A H X S+ 0 0 57 -4,-2.8 4,-1.5 -5,-0.2 -2,-0.2 0.956 113.0 37.7 -62.3 -50.7 34.6 -26.8 28.4 44 187 A E H X S+ 0 0 15 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.862 115.2 53.6 -72.8 -36.6 36.8 -23.9 27.2 45 188 A V H < S+ 0 0 43 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.823 115.0 42.7 -64.6 -32.3 39.4 -24.5 29.9 46 189 A A H < S+ 0 0 85 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.772 115.5 50.7 -78.7 -26.9 39.6 -28.0 28.7 47 190 A S H < S+ 0 0 91 -4,-1.5 -2,-0.2 -5,-0.1 -3,-0.2 0.723 88.9 94.5 -86.6 -25.1 39.5 -27.0 25.0 48 191 A R S < S- 0 0 32 -4,-1.7 402,-0.1 1,-0.1 401,-0.0 -0.264 77.4-111.5 -78.0 155.6 42.3 -24.3 24.9 49 192 A D > - 0 0 85 400,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.739 20.4-149.6 -83.1 126.3 45.9 -24.8 23.9 50 193 A P H > S+ 0 0 63 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.892 93.8 46.5 -66.0 -41.1 48.2 -24.3 26.9 51 194 A K H > S+ 0 0 46 2,-0.2 4,-1.7 1,-0.2 3,-0.4 0.982 118.2 40.6 -63.8 -57.9 51.2 -22.9 25.0 52 195 A L H > S+ 0 0 75 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.711 116.6 51.3 -66.9 -21.3 49.2 -20.5 22.9 53 196 A Y H < S+ 0 0 6 -4,-1.9 398,-0.3 2,-0.2 -1,-0.2 0.785 109.0 52.1 -77.4 -30.8 47.0 -19.6 25.9 54 197 A A H < S+ 0 0 7 -4,-1.7 -2,-0.2 -3,-0.4 -3,-0.1 0.829 122.8 26.6 -78.0 -33.9 50.2 -18.9 28.0 55 198 A M H < S- 0 0 9 -4,-1.7 71,-0.7 -5,-0.1 -1,-0.2 0.523 90.8-156.4-106.1 -14.1 51.8 -16.5 25.5 56 199 A H < - 0 0 18 -4,-0.8 70,-0.2 -5,-0.3 -3,-0.1 0.836 9.2-141.4 43.4 67.2 48.6 -15.3 23.9 57 200 A P - 0 0 25 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 -0.403 7.0-142.1 -57.0 125.9 49.8 -14.1 20.5 58 201 A W + 0 0 68 68,-0.4 79,-1.6 -2,-0.1 80,-0.4 -0.848 43.2 150.5 -90.7 105.5 47.8 -10.9 19.6 59 202 A V B -A 136 0A 39 -2,-0.9 357,-0.4 77,-0.2 2,-0.3 -0.654 32.5-149.6-129.5 179.1 47.2 -11.3 15.9 60 203 A T - 0 0 3 75,-1.6 -2,-0.0 -2,-0.2 355,-0.0 -0.988 16.7-153.1-155.3 145.5 44.8 -10.4 13.1 61 204 A S + 0 0 97 -2,-0.3 3,-0.1 2,-0.1 -1,-0.1 0.633 65.2 113.4 -89.4 -20.3 43.5 -11.9 9.8 62 205 A K S S- 0 0 46 1,-0.1 2,-0.2 73,-0.1 -2,-0.1 -0.196 79.9-101.4 -53.7 147.9 42.7 -8.5 8.3 63 206 A P - 0 0 100 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.493 41.4 -94.8 -75.5 143.0 45.0 -7.7 5.4 64 207 A L - 0 0 10 -2,-0.2 5,-0.1 1,-0.1 71,-0.1 -0.396 52.9-113.0 -59.4 122.1 47.9 -5.3 6.1 65 208 A P >> - 0 0 9 0, 0.0 3,-1.3 0, 0.0 4,-1.2 -0.082 16.4-113.8 -60.9 159.0 46.5 -1.8 5.1 66 209 A E H >> S+ 0 0 50 1,-0.3 4,-2.6 2,-0.2 3,-0.9 0.917 113.5 61.3 -56.8 -47.9 47.8 0.2 2.2 67 210 A Y H 34 S+ 0 0 62 1,-0.3 -1,-0.3 2,-0.2 -3,-0.0 0.630 108.7 44.2 -59.0 -15.6 49.3 2.9 4.4 68 211 A L H X4 S+ 0 0 7 -3,-1.3 3,-0.5 2,-0.1 4,-0.4 0.613 109.4 54.4-101.7 -20.4 51.6 0.4 6.0 69 212 A W H X< S+ 0 0 91 -4,-1.2 3,-1.9 -3,-0.9 -2,-0.2 0.926 103.8 56.3 -69.6 -48.7 52.6 -1.4 2.8 70 213 A K T 3< S+ 0 0 119 -4,-2.6 -1,-0.2 1,-0.3 -3,-0.1 0.221 105.1 53.9 -72.7 16.1 53.7 2.0 1.4 71 214 A K T < S+ 0 0 113 -3,-0.5 2,-0.4 -5,-0.2 -1,-0.3 0.404 91.7 86.1-115.5 -15.6 56.0 2.2 4.5 72 215 A I < - 0 0 24 -3,-1.9 2,-0.4 -4,-0.4 3,-0.2 -0.756 68.9-156.6 -80.2 130.4 57.6 -1.2 3.7 73 216 A A > - 0 0 67 3,-0.4 3,-0.9 -2,-0.4 -3,-0.0 -0.931 67.8 -8.0-112.4 130.8 60.5 -0.8 1.3 74 217 A N T 3 S- 0 0 150 -2,-0.4 -1,-0.2 1,-0.2 3,-0.0 0.898 113.5 -78.5 50.2 47.8 61.8 -3.7 -0.9 75 218 A N T 3 S+ 0 0 116 -3,-0.2 2,-0.3 -6,-0.1 -1,-0.2 0.668 99.9 107.4 35.3 46.6 59.5 -6.3 0.8 76 219 A C < - 0 0 27 -3,-0.9 -3,-0.4 17,-0.2 2,-0.3 -0.986 51.6-149.7-143.9 155.6 61.5 -6.8 4.0 77 220 A I E -B 92 0B 7 15,-3.0 15,-2.9 -2,-0.3 2,-0.9 -0.940 18.2-129.3-124.1 148.3 61.2 -5.9 7.7 78 221 A F E -B 91 0B 108 -2,-0.3 2,-0.8 13,-0.2 71,-0.5 -0.779 21.3-170.8-105.7 91.4 64.1 -5.3 10.1 79 222 A I E -B 90 0B 2 11,-2.1 11,-1.1 -2,-0.9 2,-0.9 -0.737 11.6-152.6 -81.8 110.0 63.6 -7.4 13.3 80 223 A V E -Bc 89 150B 16 69,-2.0 71,-2.1 -2,-0.8 2,-0.3 -0.752 15.5-163.1 -82.4 104.7 66.2 -6.2 15.9 81 224 A I E -Bc 88 151B 2 7,-1.4 7,-1.9 -2,-0.9 71,-0.2 -0.650 6.3-169.8 -90.8 147.5 66.8 -9.3 18.1 82 225 A H E + c 0 152B 46 69,-2.1 71,-0.8 -2,-0.3 5,-0.1 -0.551 20.2 159.4-118.1-177.9 68.5 -8.9 21.5 83 226 A R S S- 0 0 158 -2,-0.2 4,-0.1 69,-0.1 -1,-0.1 -0.089 82.3 -17.8-164.0 -71.6 69.9 -11.3 24.2 84 227 A S S S- 0 0 82 2,-0.0 3,-0.1 68,-0.0 68,-0.0 -0.268 122.6 -56.4-139.0 46.9 72.5 -10.0 26.7 85 228 A T S S+ 0 0 125 1,-0.2 2,-1.8 0, 0.0 0, 0.0 -0.193 114.0 122.0 89.5 -32.5 73.4 -6.9 24.8 86 229 A T + 0 0 98 -4,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.407 42.3 164.9 -61.1 84.4 74.2 -9.4 22.0 87 230 A S + 0 0 66 -2,-1.8 2,-0.3 -5,-0.1 -5,-0.2 -0.766 19.2 179.6-108.8 152.7 71.9 -7.9 19.4 88 231 A Q E -B 81 0B 48 -7,-1.9 -7,-1.4 -2,-0.3 2,-0.1 -0.892 22.9-132.5-156.7 118.9 71.7 -8.4 15.6 89 232 A T E -B 80 0B 89 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.407 24.7-162.7 -70.5 147.2 69.3 -6.9 13.1 90 233 A I E -B 79 0B 28 -11,-1.1 -11,-2.1 -2,-0.1 2,-0.6 -0.980 20.1-133.5-140.4 126.7 67.7 -9.3 10.5 91 234 A K E +B 78 0B 162 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.2 -0.669 36.9 177.7 -73.5 116.2 65.9 -8.8 7.2 92 235 A V E -B 77 0B 3 -15,-2.9 -15,-3.0 -2,-0.6 9,-0.1 -0.912 29.3-115.2-123.2 148.7 62.7 -10.9 7.4 93 236 A S > - 0 0 46 -2,-0.3 3,-2.5 -17,-0.2 40,-0.2 -0.645 23.9-122.6 -82.4 140.4 59.9 -11.3 4.8 94 237 A P T 3 S+ 0 0 1 0, 0.0 40,-2.0 0, 0.0 41,-0.3 0.762 112.9 53.8 -51.9 -27.4 56.4 -10.1 5.8 95 238 A D T 3 S+ 0 0 105 38,-0.2 2,-0.4 37,-0.1 -2,-0.0 0.219 83.1 123.1 -94.5 14.9 55.0 -13.6 5.2 96 239 A D < - 0 0 49 -3,-2.5 37,-3.2 36,-0.1 38,-0.1 -0.618 59.9-131.1 -81.5 131.3 57.6 -15.3 7.5 97 240 A T - 0 0 34 -2,-0.4 33,-0.1 35,-0.2 32,-0.0 -0.423 22.4-121.0 -68.4 153.3 56.4 -17.5 10.4 98 241 A P S >> S+ 0 0 5 0, 0.0 4,-1.3 0, 0.0 3,-0.7 0.810 114.4 49.8 -75.3 -30.8 58.1 -16.6 13.7 99 242 A G H 3> S+ 0 0 44 1,-0.2 4,-1.3 2,-0.2 3,-0.1 0.868 108.5 55.6 -64.9 -38.2 59.5 -20.1 14.2 100 243 A A H 34 S+ 0 0 37 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.401 104.1 54.6 -74.1 -1.2 60.7 -19.8 10.6 101 244 A I H X> S+ 0 0 2 -3,-0.7 4,-1.9 2,-0.2 3,-1.0 0.713 100.2 56.7 -97.0 -35.0 62.5 -16.6 11.8 102 245 A L H 3X>S+ 0 0 43 -4,-1.3 4,-3.0 1,-0.3 5,-0.7 0.838 98.0 66.0 -59.9 -33.2 64.3 -18.4 14.6 103 246 A Q H 3<5S+ 0 0 107 -4,-1.3 -1,-0.3 3,-0.2 -2,-0.2 0.821 104.7 43.4 -52.2 -36.6 65.6 -20.6 11.7 104 247 A S H <>>S+ 0 0 33 -3,-1.0 5,-2.2 3,-0.2 4,-0.9 0.943 119.3 39.1 -77.3 -52.0 67.4 -17.5 10.4 105 248 A F H <5S+ 0 0 57 -4,-1.9 -2,-0.2 3,-0.2 -3,-0.2 0.961 132.4 25.3 -64.3 -52.5 68.8 -16.2 13.8 106 249 A F T <5S+ 0 0 70 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.1 0.991 131.3 33.2 -73.7 -71.2 69.7 -19.7 15.1 107 250 A T T 4 -D 151 0B 0 5,-3.6 3,-1.5 -2,-0.3 5,-0.3 -0.496 45.5-101.4 -72.0 138.9 58.6 -8.1 22.5 121 275 A C T 3 S+ 0 0 11 29,-2.4 462,-0.2 1,-0.2 29,-0.1 -0.444 102.1 4.5 -67.9 123.9 61.2 -6.2 24.5 122 276 A G T 3 S+ 0 0 5 -2,-0.3 430,-0.4 1,-0.2 2,-0.3 0.655 117.2 87.3 82.6 18.7 59.8 -4.7 27.7 123 277 A R S < S- 0 0 41 -3,-1.5 2,-1.6 2,-0.2 -1,-0.2 -0.985 82.5-117.9-149.8 151.5 56.4 -6.4 27.4 124 278 A D S S+ 0 0 36 426,-2.6 2,-0.3 -2,-0.3 427,-0.1 -0.702 77.7 120.2 -85.7 77.2 54.4 -9.5 28.1 125 279 A E - 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0 0 11 1,-0.1 3,-1.1 2,-0.1 -1,-0.1 0.048 36.8-102.1 -62.2 172.0 17.8 3.4 9.5 325 563 A P T 3 S+ 0 0 26 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.756 120.4 53.9 -73.6 -19.6 17.5 1.7 12.9 326 564 A L T 3 S+ 0 0 35 2,-0.1 -2,-0.1 476,-0.1 477,-0.1 0.355 78.4 108.8 -90.7 0.5 15.9 4.8 14.5 327 565 A N S < S- 0 0 55 -3,-1.1 -4,-0.0 -7,-0.1 0, 0.0 -0.725 72.5-130.9 -77.3 114.2 13.1 5.1 11.8 328 566 A P - 0 0 96 0, 0.0 2,-0.6 0, 0.0 -2,-0.1 -0.308 12.7-123.3 -69.3 152.6 10.0 4.0 13.7 329 567 A L - 0 0 33 27,-0.1 2,-0.1 3,-0.0 -9,-0.0 -0.859 18.0-144.0 -96.7 122.3 7.7 1.4 12.2 330 568 A T > - 0 0 79 -2,-0.6 4,-1.9 1,-0.1 5,-0.2 -0.396 33.0-105.2 -69.9 160.7 4.0 2.4 11.7 331 569 A A H > S+ 0 0 70 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.834 124.6 58.2 -55.0 -35.4 1.4 -0.3 12.2 332 570 A E H > S+ 0 0 70 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.955 104.6 49.0 -58.7 -51.8 1.2 -0.4 8.4 333 571 A D H > S+ 0 0 28 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.877 111.0 51.4 -54.5 -41.5 4.9 -1.2 8.0 334 572 A K H X S+ 0 0 84 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.844 106.1 50.7 -72.2 -36.7 4.6 -4.0 10.6 335 573 A E H X S+ 0 0 132 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.879 111.3 51.5 -69.1 -32.9 1.7 -5.9 9.1 336 574 A L H X S+ 0 0 20 -4,-1.6 4,-3.0 2,-0.2 -2,-0.2 0.981 111.4 45.0 -64.1 -58.7 3.6 -5.8 5.7 337 575 A L H < S+ 0 0 0 -4,-2.2 7,-0.3 1,-0.2 -2,-0.2 0.896 117.3 46.0 -45.6 -51.3 6.8 -7.2 7.2 338 576 A W H >< S+ 0 0 41 -4,-2.3 3,-1.2 1,-0.2 -1,-0.2 0.923 112.1 48.5 -66.9 -46.0 4.9 -9.8 9.1 339 577 A H H 3< S+ 0 0 133 -4,-2.8 2,-0.7 1,-0.3 3,-0.3 0.952 120.4 38.3 -62.7 -46.3 2.6 -10.9 6.2 340 578 A F T 3X S+ 0 0 35 -4,-3.0 4,-2.0 -5,-0.2 -1,-0.3 -0.369 78.7 140.2 -94.3 54.5 5.6 -11.2 3.9 341 579 A R H <> + 0 0 36 -3,-1.2 4,-1.9 -2,-0.7 -1,-0.2 0.849 66.9 52.9 -69.2 -33.3 7.9 -12.6 6.6 342 580 A Y H 4 S+ 0 0 94 -3,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.892 109.9 47.6 -72.9 -37.5 9.6 -15.2 4.3 343 581 A E H >4 S+ 0 0 30 1,-0.2 3,-1.2 2,-0.2 4,-0.4 0.908 112.4 50.5 -62.6 -40.4 10.5 -12.5 1.8 344 582 A S H >< S+ 0 0 0 -4,-2.0 3,-1.5 -7,-0.3 6,-0.3 0.865 100.7 65.1 -63.7 -33.3 11.8 -10.5 4.7 345 583 A L T 3< S+ 0 0 10 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.640 93.1 61.5 -64.4 -16.7 13.7 -13.6 5.8 346 584 A K T < S+ 0 0 120 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.671 96.0 66.3 -82.9 -18.4 15.9 -13.4 2.7 347 585 A H X - 0 0 72 -3,-1.5 3,-1.7 -4,-0.4 -1,-0.2 -0.875 62.4-169.0-109.2 103.4 17.2 -9.9 3.6 348 586 A P G > S+ 0 0 26 0, 0.0 3,-2.7 0, 0.0 -1,-0.2 0.936 83.4 69.2 -55.9 -47.3 19.4 -9.9 6.7 349 587 A K G 3 S+ 0 0 121 1,-0.3 4,-0.2 2,-0.1 -2,-0.0 0.625 101.0 53.2 -41.1 -16.3 19.5 -6.1 7.0 350 588 A A G <> S+ 0 0 0 -3,-1.7 4,-2.1 -6,-0.3 -1,-0.3 0.239 72.5 98.4-113.0 7.0 15.8 -6.5 7.9 351 589 A Y H <> S+ 0 0 0 -3,-2.7 4,-3.1 2,-0.2 5,-0.3 0.963 83.0 55.0 -63.0 -48.8 15.7 -9.0 10.8 352 590 A P H > S+ 0 0 1 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.909 114.0 39.5 -45.1 -52.4 15.5 -6.2 13.5 353 591 A K H 4 S+ 0 0 13 1,-0.2 -2,-0.2 2,-0.2 -3,-0.1 0.855 115.1 53.5 -72.6 -33.5 12.4 -4.7 11.9 354 592 A L H >< S+ 0 0 1 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.901 113.1 41.9 -67.4 -42.5 10.9 -8.0 11.1 355 593 A F H >< S+ 0 0 1 -4,-3.1 3,-1.0 1,-0.3 -1,-0.2 0.733 107.3 61.5 -80.2 -22.1 11.2 -9.2 14.7 356 594 A S T 3< S+ 0 0 38 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.264 100.4 59.2 -75.8 5.2 10.0 -5.8 15.9 357 595 A S T < S+ 0 0 10 -3,-1.0 2,-0.2 -5,-0.1 -1,-0.2 0.242 80.2 107.1-117.6 6.0 6.8 -6.7 14.0 358 596 A V S < S- 0 0 13 -3,-1.0 2,-1.0 1,-0.0 3,-0.1 -0.604 71.7-132.3 -79.4 145.4 6.0 -9.8 15.9 359 597 A K > - 0 0 131 -2,-0.2 3,-1.0 1,-0.2 7,-0.3 -0.872 27.6-176.8 -96.2 95.8 3.1 -9.7 18.3 360 598 A W T 3 S+ 0 0 26 -2,-1.0 -1,-0.2 1,-0.3 6,-0.1 0.779 72.5 69.5 -73.8 -24.7 5.0 -11.3 21.1 361 599 A G T 3 S+ 0 0 19 1,-0.1 2,-0.3 -3,-0.1 -1,-0.3 0.089 87.2 76.8 -77.2 24.1 1.9 -11.3 23.4 362 600 A Q X> - 0 0 83 -3,-1.0 4,-1.8 1,-0.1 3,-1.5 -0.820 69.8-154.2-139.9 96.6 0.2 -13.9 21.2 363 601 A Q H 3> S+ 0 0 98 -2,-0.3 4,-1.9 1,-0.3 -1,-0.1 0.725 91.5 52.9 -39.3 -43.0 1.5 -17.5 21.6 364 602 A E H 3> S+ 0 0 96 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.838 110.0 47.3 -72.0 -34.7 0.6 -18.8 18.1 365 603 A I H <> S+ 0 0 22 -3,-1.5 4,-3.0 2,-0.2 -2,-0.2 0.928 109.8 52.8 -69.9 -46.6 2.4 -15.9 16.4 366 604 A V H X S+ 0 0 17 -4,-1.8 4,-1.4 -7,-0.3 -2,-0.2 0.886 108.2 53.1 -52.4 -40.8 5.5 -16.4 18.5 367 605 A A H >X S+ 0 0 46 -4,-1.9 4,-1.9 -5,-0.3 3,-0.7 0.952 108.3 48.9 -57.6 -51.7 5.2 -20.1 17.4 368 606 A K H 3X S+ 0 0 85 -4,-2.0 4,-2.4 1,-0.3 -2,-0.2 0.877 106.6 56.9 -55.1 -44.3 5.2 -19.0 13.8 369 607 A T H 3< S+ 0 0 0 -4,-3.0 4,-0.3 1,-0.2 -1,-0.3 0.841 106.8 50.0 -55.6 -34.3 8.2 -16.8 14.5 370 608 A Y H 4 S+ 0 0 12 -3,-0.5 3,-0.5 -4,-0.3 -1,-0.2 0.547 98.9 65.3 -93.9 -13.5 13.6 -19.2 12.6 374 612 A A H 3< S+ 0 0 83 -4,-0.7 2,-0.2 -3,-0.4 -2,-0.2 0.690 101.7 52.2 -74.0 -19.9 14.0 -22.9 11.7 375 613 A R T 3< S+ 0 0 171 -4,-0.6 3,-0.3 1,-0.1 -1,-0.2 -0.448 70.6 125.0-115.0 55.0 14.3 -21.7 8.1 376 614 A R <> + 0 0 63 -3,-0.5 4,-2.1 -2,-0.2 3,-0.4 -0.152 17.7 133.8-110.9 38.0 17.1 -19.2 8.6 377 615 A E H > S+ 0 0 144 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.874 72.5 53.4 -51.4 -42.7 19.6 -20.6 6.0 378 616 A V H > S+ 0 0 50 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.846 108.5 47.9 -66.1 -38.0 20.3 -17.1 4.6 379 617 A W H 4 S+ 0 0 1 -3,-0.4 -1,-0.2 2,-0.2 -2,-0.2 0.922 111.2 51.1 -67.9 -45.4 21.1 -15.5 7.9 380 618 A D H < S+ 0 0 61 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.888 115.9 40.7 -59.5 -43.4 23.5 -18.3 8.9 381 619 A Q H < S+ 0 0 163 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.898 93.1 99.5 -75.0 -41.4 25.4 -18.0 5.6 382 620 A S S < S- 0 0 34 -4,-2.2 2,-0.2 -5,-0.2 3,-0.1 0.018 85.3 -97.8 -49.5 150.9 25.5 -14.2 5.3 383 621 A A - 0 0 94 1,-0.1 -1,-0.1 0, 0.0 -2,-0.1 -0.525 50.6 -90.4 -74.3 138.5 28.7 -12.4 6.3 384 622 A L - 0 0 43 -2,-0.2 2,-0.6 25,-0.1 -1,-0.1 -0.232 36.4-168.9 -53.1 117.7 28.6 -11.0 9.8 385 623 A D > - 0 0 58 1,-0.1 4,-2.3 -3,-0.1 5,-0.1 -0.980 5.4-163.4 -99.9 120.7 27.4 -7.4 10.1 386 624 A V H > S+ 0 0 14 -2,-0.6 4,-3.8 2,-0.2 5,-0.3 0.913 87.3 55.9 -71.4 -42.1 28.2 -6.3 13.6 387 625 A G H > S+ 0 0 0 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.875 112.9 42.5 -54.6 -41.0 25.9 -3.3 13.5 388 626 A L H > S+ 0 0 11 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.910 115.0 50.2 -70.4 -46.0 23.0 -5.7 12.6 389 627 A T H >< S+ 0 0 0 -4,-2.3 3,-0.6 1,-0.2 -2,-0.2 0.911 110.8 48.8 -58.8 -47.4 24.2 -8.2 15.2 390 628 A M H >< S+ 0 0 0 -4,-3.8 3,-2.0 1,-0.2 -1,-0.2 0.877 103.9 62.9 -57.9 -38.7 24.4 -5.6 17.9 391 629 A Q H >< S+ 0 0 19 -4,-1.3 3,-0.8 1,-0.3 -1,-0.2 0.790 99.1 52.0 -64.9 -30.9 20.9 -4.4 17.0 392 630 A L T << S+ 0 0 0 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.382 108.1 54.3 -82.5 1.3 19.3 -7.7 17.9 393 631 A L T < S+ 0 0 0 -3,-2.0 -1,-0.2 -4,-0.2 -2,-0.2 0.148 89.9 97.1-117.1 13.7 21.0 -7.6 21.3 394 632 A D S X S- 0 0 11 -3,-0.8 3,-1.3 -4,-0.1 -3,-0.0 -0.184 97.0 -78.3 -91.1-167.9 19.7 -4.1 22.3 395 633 A C T 3 S+ 0 0 9 1,-0.3 -3,-0.1 -2,-0.1 -4,-0.0 0.735 119.4 67.9 -70.6 -24.0 16.6 -3.4 24.5 396 634 A N T 3 S+ 0 0 79 -5,-0.2 2,-0.5 1,-0.1 -1,-0.3 0.444 92.4 66.3 -76.6 0.1 14.0 -4.0 21.8 397 635 A F < + 0 0 6 -3,-1.3 -1,-0.1 1,-0.1 -196,-0.1 -0.933 45.2 153.7-129.5 111.5 14.7 -7.7 21.7 398 636 A S + 0 0 11 -2,-0.5 2,-0.3 34,-0.1 -1,-0.1 0.505 43.6 103.8-113.1 -11.4 13.9 -9.8 24.7 399 637 A D > - 0 0 3 1,-0.1 4,-1.7 34,-0.1 5,-0.1 -0.581 63.7-145.5 -74.6 138.1 13.3 -13.2 23.1 400 638 A E H > S+ 0 0 57 -2,-0.3 4,-1.5 2,-0.2 -1,-0.1 0.790 94.4 52.0 -80.5 -32.1 16.2 -15.5 23.5 401 639 A N H > S+ 0 0 78 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.928 110.4 49.7 -71.5 -42.8 16.1 -17.4 20.2 402 640 A V H >> S+ 0 0 0 1,-0.2 4,-0.7 2,-0.2 3,-0.7 0.947 115.3 44.1 -54.2 -49.3 16.0 -14.1 18.3 403 641 A R H 3X S+ 0 0 3 -4,-1.7 4,-1.5 1,-0.2 3,-0.3 0.758 104.0 66.3 -70.1 -24.8 19.0 -13.0 20.4 404 642 A A H 3X S+ 0 0 36 -4,-1.5 4,-1.9 1,-0.2 -1,-0.2 0.827 95.5 55.6 -66.5 -33.1 20.7 -16.4 20.0 405 643 A I H X S+ 0 0 62 -4,-1.9 3,-1.5 1,-0.2 4,-0.6 0.950 103.2 50.6 -55.5 -50.9 25.8 -17.0 16.6 409 647 A K H >< S+ 0 0 14 -4,-1.6 3,-0.9 1,-0.3 -1,-0.2 0.865 105.4 56.8 -60.5 -33.8 27.1 -14.3 14.3 410 648 A L H >< S+ 0 0 0 -4,-1.4 3,-1.7 1,-0.2 -1,-0.3 0.691 89.6 75.9 -68.9 -19.0 29.6 -13.1 17.0 411 649 A E H << S+ 0 0 86 -3,-1.5 -1,-0.2 -4,-0.8 -2,-0.2 0.833 90.9 55.6 -60.4 -32.7 31.1 -16.7 17.2 412 650 A S T << S+ 0 0 89 -3,-0.9 2,-0.3 -4,-0.6 -1,-0.3 0.303 83.1 111.6 -88.0 6.6 32.9 -16.1 14.0 413 651 A L < - 0 0 15 -3,-1.7 2,-0.2 4,-0.0 -3,-0.0 -0.629 65.5-131.7 -78.4 140.3 34.6 -13.0 15.3 414 652 A E >> - 0 0 48 -2,-0.3 4,-2.1 1,-0.1 3,-1.9 -0.646 29.9-101.4 -89.2 153.2 38.4 -13.2 15.8 415 653 A D H 3> S+ 0 0 43 1,-0.3 4,-3.0 -2,-0.2 5,-0.2 0.824 120.5 59.0 -41.2 -48.7 39.9 -12.0 19.1 416 654 A D H 3> S+ 0 0 8 -357,-0.4 4,-0.7 1,-0.2 -1,-0.3 0.866 112.3 40.8 -51.6 -40.4 41.1 -8.7 17.5 417 655 A D H X> S+ 0 0 45 -3,-1.9 4,-1.6 2,-0.2 3,-1.2 0.938 109.8 56.1 -76.3 -48.3 37.5 -7.9 16.6 418 656 A V H 3X S+ 0 0 0 -4,-2.1 4,-0.6 1,-0.3 3,-0.3 0.894 104.9 57.5 -47.2 -42.8 36.0 -9.2 19.8 419 657 A L H 3< S+ 0 0 22 -4,-3.0 3,-0.4 -5,-0.2 4,-0.4 0.812 103.2 51.5 -57.0 -37.8 38.4 -6.7 21.5 420 658 A H H << S+ 0 0 34 -3,-1.2 -1,-0.2 -4,-0.7 4,-0.2 0.842 120.5 33.2 -69.9 -35.9 36.9 -3.7 19.6 421 659 A Y H X S+ 0 0 22 -4,-1.6 4,-1.3 -3,-0.3 -1,-0.2 0.276 91.5 101.4-102.2 8.8 33.4 -4.5 20.5 422 660 A L H >X S+ 0 0 2 -4,-0.6 4,-2.5 -3,-0.4 3,-0.6 0.930 76.8 52.3 -64.5 -53.2 34.1 -6.0 24.0 423 661 A L H 3> S+ 0 0 6 -4,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.925 115.7 41.8 -48.7 -49.2 33.1 -3.0 26.1 424 662 A Q H 3> S+ 0 0 4 2,-0.2 4,-0.8 -4,-0.2 -1,-0.2 0.623 110.1 55.6 -84.6 -12.6 29.7 -2.7 24.4 425 663 A L H < S+ 0 0 0 -4,-2.5 3,-1.8 1,-0.2 4,-0.5 0.939 112.3 51.1 -45.2 -51.4 29.5 -6.6 28.2 427 665 A Q H >< S+ 0 0 4 -4,-2.1 3,-1.1 -5,-0.3 -1,-0.2 0.824 100.1 64.6 -58.6 -31.8 27.2 -3.5 28.4 428 666 A A H >< S+ 0 0 0 -4,-0.8 3,-2.0 -3,-0.4 -1,-0.3 0.626 82.0 77.2 -67.9 -16.3 24.7 -5.4 26.2 429 667 A V G X< S+ 0 0 1 -3,-1.8 3,-2.8 -4,-0.6 -1,-0.2 0.894 79.7 72.0 -63.9 -32.4 24.3 -8.0 29.0 430 668 A K G < S+ 0 0 2 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.535 94.9 52.7 -54.5 -11.4 22.2 -5.3 30.7 431 669 A F G < S+ 0 0 13 -3,-2.0 -1,-0.3 -38,-0.2 -2,-0.2 0.311 83.6 109.6-107.4 2.8 19.4 -6.0 28.0 432 670 A E < - 0 0 19 -3,-2.8 -34,-0.1 -4,-0.2 5,-0.0 -0.584 61.9-150.6 -73.5 138.1 19.4 -9.7 28.7 433 671 A P S S+ 0 0 16 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.933 80.4 40.7 -69.5 -48.8 16.2 -10.8 30.4 434 672 A Y S S- 0 0 19 2,-0.1 -3,-0.0 1,-0.1 -174,-0.0 -0.620 78.5-127.3-101.5 159.9 17.9 -13.7 32.2 435 673 A H S S+ 0 0 18 -2,-0.2 2,-0.7 1,-0.2 -1,-0.1 0.751 101.5 61.2 -76.8 -27.2 21.3 -14.0 34.0 436 674 A D S S+ 0 0 38 4,-0.1 2,-0.3 3,-0.0 -1,-0.2 -0.916 76.5 149.5-104.7 109.5 22.2 -17.0 32.0 437 675 A S > - 0 0 12 -2,-0.7 4,-2.1 1,-0.1 5,-0.2 -0.897 61.1-107.3-137.0 163.7 22.3 -16.1 28.3 438 676 A A H > S+ 0 0 46 -2,-0.3 4,-2.2 1,-0.2 -1,-0.1 0.902 120.7 48.7 -53.0 -41.1 24.0 -17.0 25.0 439 677 A L H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.920 107.2 49.8 -71.0 -50.9 25.8 -13.8 25.2 440 678 A A H > S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.865 114.5 47.5 -59.3 -36.8 27.1 -14.0 28.8 441 679 A R H X S+ 0 0 87 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.885 109.8 54.0 -68.6 -40.9 28.4 -17.5 28.0 442 680 A F H X S+ 0 0 1 -4,-2.2 4,-2.4 -5,-0.2 5,-0.3 0.961 107.8 48.7 -53.4 -53.2 29.9 -16.1 24.8 443 681 A L H X S+ 0 0 3 -4,-3.1 4,-1.7 1,-0.2 -1,-0.2 0.886 112.3 51.7 -57.4 -37.1 31.8 -13.4 26.7 444 682 A L H X S+ 0 0 1 -4,-1.5 4,-2.0 -5,-0.2 -1,-0.2 0.919 108.7 47.4 -65.6 -49.8 32.9 -16.2 29.1 445 683 A K H X S+ 0 0 68 -4,-2.8 4,-1.3 1,-0.2 -2,-0.2 0.949 114.5 46.5 -58.7 -49.3 34.3 -18.5 26.4 446 684 A R H X S+ 0 0 9 -4,-2.4 4,-0.7 1,-0.2 8,-0.4 0.809 110.8 53.3 -67.4 -30.2 36.2 -15.7 24.7 447 685 A G H < S+ 0 0 0 -4,-1.7 7,-0.6 -5,-0.3 3,-0.5 0.906 113.8 42.6 -64.7 -40.4 37.5 -14.5 28.0 448 686 A L H < S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.633 110.0 56.8 -83.1 -16.7 38.8 -17.9 28.8 449 687 A R H < S+ 0 0 95 -4,-1.3 2,-0.3 1,-0.3 -1,-0.2 0.652 116.1 30.6 -85.9 -15.9 40.2 -18.6 25.4 450 688 A N X - 0 0 14 -4,-0.7 4,-3.1 -3,-0.5 -1,-0.3 -0.942 63.2-148.1-156.5 115.5 42.5 -15.5 25.4 451 689 A K H > S+ 0 0 25 -398,-0.3 4,-2.6 -2,-0.3 5,-0.1 0.700 100.0 56.2 -62.1 -22.7 44.2 -13.7 28.2 452 690 A R H > S+ 0 0 34 2,-0.2 4,-1.7 3,-0.1 -1,-0.2 0.923 111.4 40.3 -78.3 -47.8 43.9 -10.4 26.5 453 691 A I H > S+ 0 0 1 -7,-0.2 4,-2.7 -3,-0.2 -2,-0.2 0.969 116.7 53.9 -59.1 -49.3 40.1 -10.6 26.1 454 692 A G H X S+ 0 0 0 -4,-3.1 4,-2.4 -7,-0.6 -2,-0.2 0.895 104.2 54.2 -49.5 -53.0 40.1 -12.0 29.7 455 693 A H H X S+ 0 0 2 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.935 114.2 39.8 -46.0 -56.2 42.1 -9.1 31.1 456 694 A F H X S+ 0 0 22 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.820 109.5 58.7 -75.7 -34.4 39.7 -6.5 29.8 457 695 A L H >X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 3,-1.2 0.993 104.7 53.5 -46.8 -61.6 36.5 -8.5 30.6 458 696 A F H 3X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.3 5,-0.2 0.856 113.1 41.4 -41.3 -53.8 37.6 -8.6 34.2 459 697 A W H 3X S+ 0 0 0 -4,-1.5 4,-0.8 2,-0.2 -1,-0.3 0.725 115.0 51.1 -76.0 -20.9 38.0 -4.8 34.4 460 698 A F H X S+ 0 0 2 -4,-3.0 4,-2.4 1,-0.2 3,-1.4 0.982 116.0 50.8 -48.2 -62.3 32.7 -6.4 34.6 462 700 A R H 3X S+ 0 0 16 -4,-3.0 4,-1.7 -5,-0.3 -1,-0.2 0.765 104.0 60.6 -56.1 -26.7 34.4 -5.2 37.8 463 701 A S H 3< S+ 0 0 3 -4,-0.8 -1,-0.3 -5,-0.2 4,-0.3 0.905 111.4 38.1 -64.7 -42.3 33.7 -1.6 36.6 464 702 A E H XX S+ 0 0 2 -3,-1.4 3,-2.6 -4,-1.3 4,-2.1 0.954 111.2 58.1 -72.9 -53.2 30.0 -2.2 36.6 465 703 A I H 3< S+ 0 0 1 -4,-2.4 -2,-0.2 1,-0.3 3,-0.2 0.862 105.7 53.2 -39.8 -45.5 30.0 -4.4 39.7 466 704 A A T 3< S+ 0 0 49 -4,-1.7 168,-0.4 -5,-0.3 -1,-0.3 0.592 124.8 19.7 -71.7 -14.8 31.5 -1.5 41.6 467 705 A Q T <4 S+ 0 0 19 -3,-2.6 2,-0.5 -4,-0.3 -2,-0.2 0.397 103.8 79.2-144.6 7.9 28.9 1.1 40.6 468 706 A S X + 0 0 4 -4,-2.1 4,-2.5 -3,-0.2 -1,-0.2 -0.941 37.1 175.6-120.5 106.6 25.7 -0.5 39.5 469 707 A R T 4 S+ 0 0 123 -2,-0.5 4,-0.5 1,-0.2 -1,-0.1 0.924 87.7 60.3 -63.9 -43.7 23.3 -1.8 42.2 470 708 A H T 4 S+ 0 0 12 1,-0.2 -181,-0.4 -3,-0.1 -1,-0.2 0.741 124.6 12.8 -52.9 -33.7 21.0 -2.6 39.3 471 709 A Y T > S+ 0 0 5 -7,-0.2 4,-2.0 -3,-0.1 5,-0.3 0.543 91.9 102.8-130.6 -5.7 23.4 -5.0 37.7 472 710 A Q H X S+ 0 0 27 -4,-2.5 4,-2.6 -8,-0.2 -7,-0.1 0.822 83.6 52.7 -46.1 -40.6 26.3 -5.8 40.1 473 711 A Q H > S+ 0 0 15 -4,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.966 109.0 46.4 -68.5 -53.2 24.9 -9.2 41.0 474 712 A R H > S+ 0 0 8 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.892 116.7 44.5 -51.6 -48.0 24.5 -10.6 37.4 475 713 A F H X S+ 0 0 0 -4,-2.0 4,-3.6 1,-0.2 3,-0.5 0.920 106.3 62.1 -68.2 -40.5 27.9 -9.4 36.4 476 714 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 -5,-0.3 -1,-0.2 0.877 104.1 48.6 -49.9 -41.7 29.4 -10.8 39.6 477 715 A V H X S+ 0 0 4 -4,-1.9 4,-2.0 2,-0.2 -1,-0.3 0.832 112.7 48.3 -71.7 -29.3 28.3 -14.2 38.6 478 716 A I H X S+ 0 0 3 -4,-1.2 4,-2.2 -3,-0.5 -2,-0.2 0.933 115.3 43.5 -74.7 -45.5 29.8 -13.7 35.1 479 717 A L H X S+ 0 0 0 -4,-3.6 4,-2.9 2,-0.2 5,-0.3 0.977 113.7 52.1 -61.6 -51.8 33.1 -12.4 36.6 480 718 A E H X S+ 0 0 4 -4,-2.9 4,-1.4 -5,-0.3 -2,-0.2 0.924 108.8 49.9 -48.0 -54.4 33.1 -15.2 39.2 481 719 A A H >< S+ 0 0 1 -4,-2.0 3,-0.6 1,-0.2 -1,-0.2 0.921 113.2 47.1 -52.8 -45.9 32.6 -17.8 36.6 482 720 A Y H >X S+ 0 0 0 -4,-2.2 3,-2.2 1,-0.2 4,-1.0 0.899 106.0 56.6 -65.6 -45.7 35.5 -16.4 34.5 483 721 A L H 3< S+ 0 0 0 -4,-2.9 4,-0.5 1,-0.3 -1,-0.2 0.750 99.9 60.3 -58.5 -26.8 37.9 -16.1 37.4 484 722 A R T << S+ 0 0 27 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.334 112.2 41.3 -81.9 7.6 37.5 -19.8 38.2 485 723 A G T <4 S+ 0 0 0 -3,-2.2 -2,-0.2 2,-0.1 -1,-0.2 0.576 91.3 77.6-124.2 -17.5 38.9 -20.4 34.7 486 724 A C S < S- 0 0 0 -4,-1.0 4,-0.2 1,-0.2 3,-0.2 0.817 94.2-120.1 -72.6 -31.1 41.8 -18.0 34.0 487 725 A G > - 0 0 0 -4,-0.5 4,-2.0 1,-0.1 -323,-0.2 -0.357 30.5 -68.5 111.8 170.5 44.3 -20.0 36.0 488 726 A T H > S+ 0 0 87 -325,-2.4 4,-2.3 1,-0.2 -326,-0.2 0.826 124.4 57.8 -65.4 -33.8 46.5 -19.3 39.1 489 727 A A H > S+ 0 0 25 -328,-1.5 4,-2.9 2,-0.2 -1,-0.2 0.924 110.5 39.9 -64.6 -50.2 48.8 -16.8 37.2 490 728 A M H > S+ 0 0 6 2,-0.3 4,-4.3 1,-0.2 5,-0.4 0.910 112.8 55.4 -68.9 -43.4 46.0 -14.3 36.2 491 729 A L H X S+ 0 0 19 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.931 112.2 46.0 -51.1 -44.2 44.3 -14.7 39.5 492 730 A H H X S+ 0 0 105 -4,-2.3 4,-2.1 2,-0.2 -2,-0.3 0.913 114.0 46.6 -66.5 -44.4 47.7 -13.7 40.9 493 731 A D H X S+ 0 0 31 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.966 112.4 49.8 -61.1 -51.5 48.0 -10.8 38.4 494 732 A F H X S+ 0 0 0 -4,-4.3 4,-2.7 1,-0.2 5,-0.2 0.889 108.8 54.5 -56.1 -38.1 44.5 -9.6 39.1 495 733 A T H X S+ 0 0 47 -4,-2.1 4,-2.8 -5,-0.4 -1,-0.2 0.952 109.3 47.2 -56.8 -49.4 45.2 -9.7 42.8 496 734 A Q H X S+ 0 0 23 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.930 113.9 45.6 -62.2 -45.4 48.2 -7.5 42.3 497 735 A Q H X S+ 0 0 1 -4,-2.7 4,-2.9 2,-0.2 5,-0.3 0.937 113.4 49.5 -67.3 -42.9 46.5 -4.9 40.2 498 736 A V H X S+ 0 0 5 -4,-2.7 4,-2.5 -5,-0.2 5,-0.3 0.966 110.1 51.5 -57.5 -52.5 43.4 -4.8 42.4 499 737 A Q H X S+ 0 0 84 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.917 113.0 46.6 -48.2 -48.5 45.7 -4.4 45.5 500 738 A V H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.946 112.1 45.8 -63.2 -52.1 47.5 -1.5 43.8 501 739 A I H X S+ 0 0 6 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.861 112.3 51.5 -69.3 -33.5 44.4 0.5 42.5 502 740 A E H X S+ 0 0 88 -4,-2.5 4,-1.8 -5,-0.3 3,-0.3 0.966 111.5 50.0 -56.3 -53.6 42.6 0.2 45.8 503 741 A M H X S+ 0 0 55 -4,-2.1 4,-1.3 -5,-0.3 3,-0.4 0.931 114.5 41.9 -45.9 -55.7 45.8 1.5 47.4 504 742 A L H X S+ 0 0 9 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.714 106.7 62.8 -74.7 -21.8 46.1 4.5 45.0 505 743 A Q H X S+ 0 0 69 -4,-1.8 4,-1.9 -3,-0.3 -1,-0.2 0.881 100.1 55.2 -66.0 -39.5 42.3 5.2 45.2 506 744 A K H X S+ 0 0 42 -4,-1.8 4,-2.8 -3,-0.4 -2,-0.2 0.957 107.8 48.0 -54.8 -53.2 42.8 5.9 48.9 507 745 A V H X S+ 0 0 17 -4,-1.3 4,-2.8 1,-0.2 5,-0.3 0.877 107.4 55.8 -58.2 -42.5 45.4 8.5 48.2 508 746 A T H X S+ 0 0 1 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.925 112.8 40.5 -58.2 -49.4 43.4 10.2 45.5 509 747 A L H X S+ 0 0 71 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.939 113.5 54.0 -65.6 -49.1 40.4 10.8 47.8 510 748 A D H X S+ 0 0 93 -4,-2.8 4,-1.7 1,-0.2 3,-0.5 0.958 111.2 45.5 -46.2 -60.9 42.5 11.8 50.8 511 749 A I H < S+ 0 0 3 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.787 109.1 57.2 -57.4 -31.7 44.3 14.5 48.8 512 750 A K H >< S+ 0 0 48 -4,-1.4 3,-1.1 -5,-0.3 -1,-0.2 0.929 106.6 48.2 -67.2 -43.2 41.0 15.7 47.4 513 751 A S H 3< S+ 0 0 111 -4,-2.3 -2,-0.2 -3,-0.5 -1,-0.2 0.888 102.0 64.8 -60.3 -40.9 39.6 16.3 50.9 514 752 A L T 3< S+ 0 0 113 -4,-1.7 2,-0.3 -5,-0.2 -1,-0.2 0.405 104.0 45.6 -72.8 2.5 42.7 18.2 52.1 515 753 A S < 0 0 29 -3,-1.1 4,-0.1 -4,-0.2 0, 0.0 -0.996 360.0 360.0-146.6 153.4 42.3 21.1 49.6 516 754 A A 0 0 119 -2,-0.3 -3,-0.1 2,-0.2 -4,-0.0 -0.693 360.0 360.0-105.1 360.0 39.7 23.6 48.2 517 ! 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 0.0 518 758 A D 0 0 156 0, 0.0 2,-0.3 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0-179.6 44.9 26.0 43.9 519 759 A V - 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0 0 17 -3,-2.3 3,-0.6 1,-0.1 -3,-0.2 0.870 24.8-157.9 36.2 66.2 23.0 12.7 7.1 811 1057 A V T 3 - 0 0 83 -2,-0.3 4,-1.8 1,-0.1 5,-0.2 -0.072 32.7-106.4 -58.7 159.1 23.6 10.8 -1.5 815 1061 A E H > S+ 0 0 86 1,-0.2 4,-0.8 2,-0.2 -1,-0.1 0.783 115.7 46.5 -51.3 -33.7 27.4 10.4 -1.2 816 1062 A E H > S+ 0 0 127 2,-0.2 4,-2.0 1,-0.2 3,-0.2 0.926 109.2 46.4 -88.6 -49.9 28.0 13.8 -2.9 817 1063 A D H > S+ 0 0 99 1,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.857 112.1 57.0 -59.9 -32.6 25.6 16.2 -1.3 818 1064 A A H X S+ 0 0 0 -4,-1.8 4,-1.7 2,-0.2 -1,-0.3 0.856 102.0 55.5 -61.8 -38.0 26.9 14.6 1.9 819 1065 A K H X S+ 0 0 100 -4,-0.8 4,-1.6 -3,-0.2 3,-0.3 0.968 111.5 42.2 -54.1 -54.9 30.4 15.7 0.7 820 1066 A K H X S+ 0 0 42 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.847 107.7 60.9 -66.1 -36.2 29.2 19.3 0.4 821 1067 A Y H X S+ 0 0 68 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.902 106.7 45.9 -56.8 -43.0 27.3 19.2 3.7 822 1068 A F H X S+ 0 0 0 -4,-1.7 4,-1.9 -3,-0.3 -1,-0.2 0.856 108.1 55.6 -71.6 -35.0 30.5 18.5 5.6 823 1069 A L H X S+ 0 0 59 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.855 104.3 55.4 -63.1 -34.0 32.4 21.2 3.8 824 1070 A D H X S+ 0 0 95 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.848 105.7 52.7 -64.4 -34.1 29.7 23.6 5.0 825 1071 A Q H X S+ 0 0 34 -4,-1.1 4,-1.3 2,-0.2 -86,-0.2 0.890 110.3 45.3 -69.4 -41.2 30.4 22.5 8.6 826 1072 A I H X S+ 0 0 3 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.889 109.0 57.9 -67.4 -38.3 34.2 23.2 8.2 827 1073 A E H X S+ 0 0 72 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.823 101.9 55.6 -60.0 -33.0 33.3 26.5 6.6 828 1074 A V H X S+ 0 0 51 -4,-1.3 4,-1.9 2,-0.2 5,-0.2 0.907 103.5 53.0 -67.5 -41.5 31.3 27.5 9.7 829 1075 A C H X S+ 0 0 4 -4,-1.3 4,-1.9 1,-0.2 -1,-0.2 0.879 111.2 48.0 -60.2 -37.2 34.4 26.9 11.9 830 1076 A R H < S+ 0 0 37 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.895 114.3 45.6 -66.4 -41.5 36.3 29.2 9.6 831 1077 A D H < S+ 0 0 125 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.660 113.7 49.2 -78.4 -16.8 33.5 31.8 9.8 832 1078 A K H >< S+ 0 0 69 -4,-1.9 3,-1.5 1,-0.2 2,-0.3 0.781 84.1 168.0 -91.1 -33.6 33.1 31.5 13.6 833 1079 A G T 3< - 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