==== 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/TRANSFERASE INHIBITOR 16-MAY-11 3S2A . COMPND 2 MOLECULE: PHOSPHATIDYLINOSITOL-4,5-BISPHOSPHATE 3-KINASE CA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.A.WHITTINGTON,J.TANG,P.YAKOWEC . 834 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37307.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 578 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 116 13.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 5 0.6 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 . 58 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 92 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 282 33.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 4 2 3 1 3 2 1 3 1 2 0 2 0 2 2 1 0 0 0 0 0 1 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 4 3 2 3 3 0 3 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 4 1 0 1 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 0 127 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-178.5 30.2 -28.0 0.8 2 145 A E >> + 0 0 158 3,-0.1 4,-2.3 2,-0.1 3,-1.1 0.747 360.0 54.0 -97.5 -34.8 28.0 -25.1 -0.4 3 146 A E H 3> S+ 0 0 144 1,-0.3 4,-0.6 2,-0.2 2,-0.1 0.870 110.0 50.6 -62.3 -38.9 26.0 -24.9 2.8 4 147 A S H 34 S+ 0 0 57 2,-0.1 -1,-0.3 1,-0.1 -2,-0.1 -0.208 112.9 47.9 -90.8 40.9 29.3 -24.6 4.6 5 148 A Q H <> S+ 0 0 115 -3,-1.1 4,-1.6 -2,-0.1 3,-0.4 0.415 108.2 46.4-139.8 -54.0 30.4 -21.8 2.2 6 149 A A H X S+ 0 0 58 -4,-2.3 4,-0.9 1,-0.2 -2,-0.1 0.629 110.3 60.0 -66.2 -16.3 27.4 -19.4 2.1 7 150 A F H X S+ 0 0 22 -4,-0.6 4,-2.4 -5,-0.2 -1,-0.2 0.805 103.9 47.1 -79.8 -35.2 27.4 -19.7 5.9 8 151 A Q H > S+ 0 0 34 -3,-0.4 4,-3.1 2,-0.2 -2,-0.2 0.823 108.6 56.1 -72.3 -34.1 31.0 -18.4 6.1 9 152 A R H X S+ 0 0 189 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.851 109.4 47.3 -60.3 -37.7 29.8 -15.6 3.7 10 153 A Q H X S+ 0 0 72 -4,-0.9 4,-1.8 2,-0.2 -2,-0.2 0.927 111.3 49.0 -68.9 -49.0 27.2 -14.9 6.4 11 154 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.927 110.3 53.7 -53.3 -46.7 29.7 -15.0 9.2 12 155 A T H X>S+ 0 0 36 -4,-3.1 4,-2.8 1,-0.2 5,-0.7 0.919 108.3 46.9 -56.3 -49.8 31.9 -12.7 7.2 13 156 A A H <5S+ 0 0 55 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.790 114.6 47.8 -67.6 -30.1 29.2 -10.0 6.7 14 157 A L H <5S+ 0 0 4 -4,-1.8 -1,-0.2 -3,-0.1 -2,-0.2 0.820 116.4 44.3 -73.5 -34.2 28.3 -10.2 10.4 15 158 A I H <5S- 0 0 1 -4,-2.2 -2,-0.2 2,-0.2 -3,-0.2 0.819 96.8-137.0 -80.1 -35.7 31.9 -9.9 11.4 16 159 A G T <5S+ 0 0 48 -4,-2.8 2,-0.3 -5,-0.2 -3,-0.2 0.487 78.5 73.6 84.6 4.5 32.9 -7.1 9.0 17 160 A Y S - 0 0 57 -2,-0.3 3,-0.6 1,-0.2 462,-0.1 -0.786 26.2-175.9 -90.4 109.6 37.1 -12.1 6.2 19 162 A V T 3 S+ 0 0 8 -2,-0.8 -1,-0.2 1,-0.2 15,-0.1 0.795 80.1 57.0 -79.7 -31.7 38.6 -14.6 8.7 20 163 A T T 3 S+ 0 0 63 -12,-0.1 -1,-0.2 2,-0.0 2,-0.1 0.571 85.6 115.4 -72.7 -9.1 39.6 -17.3 6.2 21 164 A D < + 0 0 57 -3,-0.6 3,-0.1 1,-0.1 -4,-0.0 -0.350 39.8 177.9 -69.3 139.1 41.7 -14.6 4.4 22 165 A V > + 0 0 99 1,-0.1 3,-0.8 -2,-0.1 -1,-0.1 0.142 47.4 111.6-128.2 19.3 45.5 -15.0 4.3 23 166 A S T 3 S+ 0 0 86 1,-0.3 -1,-0.1 0, 0.0 2,-0.1 0.758 86.7 39.0 -60.6 -29.6 46.5 -12.0 2.3 24 167 A N T 3 S+ 0 0 13 -3,-0.1 260,-0.3 260,-0.0 2,-0.3 -0.437 94.0 96.2-126.4 59.6 48.1 -10.4 5.4 25 168 A V < - 0 0 49 -3,-0.8 3,-0.1 258,-0.1 -3,-0.1 -0.845 40.1-172.5-130.7 173.6 49.9 -13.2 7.3 26 169 A H S S+ 0 0 61 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.236 81.3 19.8-147.6 -0.3 53.4 -14.5 7.6 27 170 A D S S- 0 0 40 227,-0.0 -1,-0.3 0, 0.0 3,-0.2 -0.848 84.9-102.4-149.6-169.5 52.7 -17.5 9.8 28 171 A D S > S+ 0 0 55 -2,-0.3 4,-2.9 1,-0.2 3,-0.2 0.176 74.9 118.6-108.3 19.7 49.6 -19.6 10.8 29 172 A E H > S+ 0 0 8 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.882 76.3 49.8 -53.9 -48.1 48.8 -18.2 14.2 30 173 A L H > S+ 0 0 17 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.886 114.7 43.8 -57.5 -44.3 45.3 -16.9 13.3 31 174 A E H > S+ 0 0 66 -3,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.882 112.5 52.8 -70.1 -39.3 44.3 -20.2 11.7 32 175 A F H X S+ 0 0 71 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.867 108.2 52.3 -61.3 -38.1 45.8 -22.1 14.7 33 176 A T H X S+ 0 0 2 -4,-2.5 4,-1.5 -5,-0.2 -2,-0.2 0.856 105.0 54.5 -67.5 -38.5 43.7 -19.8 17.0 34 177 A R H < S+ 0 0 35 -4,-1.7 4,-0.4 1,-0.2 3,-0.2 0.928 112.6 42.6 -60.1 -45.8 40.5 -20.7 15.1 35 178 A R H >< S+ 0 0 146 -4,-1.8 3,-0.5 1,-0.2 4,-0.4 0.797 113.2 53.9 -72.3 -29.8 41.1 -24.4 15.5 36 179 A G H 3< S+ 0 0 20 -4,-1.6 3,-0.4 1,-0.2 -1,-0.2 0.743 102.3 57.2 -75.2 -24.4 42.2 -23.9 19.1 37 180 A L T 3X S+ 0 0 1 -4,-1.5 4,-1.6 -3,-0.2 -1,-0.2 0.533 86.2 80.7 -85.3 -6.7 39.0 -22.0 20.0 38 181 A V H <> S+ 0 0 49 -3,-0.5 4,-2.5 -4,-0.4 -1,-0.2 0.910 89.9 52.7 -63.5 -43.1 36.7 -24.9 19.0 39 182 A T H > S+ 0 0 103 -4,-0.4 4,-2.4 -3,-0.4 5,-0.2 0.938 110.2 43.1 -63.4 -54.1 37.3 -26.8 22.2 40 183 A P H > S+ 0 0 17 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.821 114.1 53.5 -64.1 -33.4 36.4 -24.0 24.7 41 184 A R H X S+ 0 0 4 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.949 110.6 47.1 -57.9 -52.5 33.3 -23.1 22.5 42 185 A M H X S+ 0 0 82 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.908 110.9 50.1 -57.6 -49.8 32.1 -26.7 22.6 43 186 A A H X S+ 0 0 58 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.937 114.4 43.9 -59.4 -49.2 32.6 -27.1 26.4 44 187 A E H X S+ 0 0 14 -4,-1.8 4,-0.8 2,-0.2 -1,-0.2 0.881 115.4 48.3 -63.5 -42.6 30.7 -23.9 27.2 45 188 A V H >< S+ 0 0 33 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.970 112.8 48.3 -60.3 -52.6 27.9 -24.7 24.7 46 189 A A H 3< S+ 0 0 90 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.738 114.4 45.3 -62.8 -25.7 27.5 -28.2 25.9 47 190 A S H 3< S+ 0 0 89 -4,-1.5 2,-0.4 -5,-0.2 -1,-0.2 0.471 87.0 101.8-102.8 -0.9 27.3 -27.3 29.6 48 191 A R S << S- 0 0 26 -3,-1.1 406,-0.0 -4,-0.8 3,-0.0 -0.682 81.7-112.1 -84.7 134.1 24.9 -24.3 29.5 49 192 A D > - 0 0 87 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 -0.532 23.6-146.3 -65.1 116.2 21.3 -25.0 30.5 50 193 A P H > S+ 0 0 79 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.855 96.3 48.8 -57.0 -38.7 19.4 -24.6 27.2 51 194 A K H > S+ 0 0 95 2,-0.2 4,-1.3 1,-0.2 5,-0.2 0.922 113.4 44.2 -66.2 -50.2 16.3 -23.1 29.0 52 195 A L H > S+ 0 0 77 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.784 111.1 56.7 -68.1 -28.2 18.3 -20.6 31.1 53 196 A Y H < S+ 0 0 5 -4,-2.4 402,-0.4 2,-0.2 -1,-0.2 0.877 107.4 47.4 -66.2 -39.4 20.3 -19.6 28.0 54 197 A A H < S+ 0 0 8 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.761 119.7 36.7 -79.2 -27.5 17.2 -18.7 26.0 55 198 A M H < S- 0 0 3 -4,-1.3 59,-0.6 -5,-0.1 -1,-0.2 0.546 88.5-161.1-100.0 -11.5 15.5 -16.6 28.7 56 199 A H < - 0 0 29 -4,-1.1 58,-0.2 -5,-0.2 -3,-0.1 0.788 11.0-145.8 35.7 58.7 18.8 -15.2 30.0 57 200 A P - 0 0 23 0, 0.0 2,-1.1 0, 0.0 -1,-0.2 -0.284 5.2-139.3 -54.0 127.9 17.7 -14.0 33.4 58 201 A W + 0 0 65 56,-0.5 67,-1.7 -3,-0.2 68,-0.4 -0.781 41.3 161.8 -91.3 98.0 19.6 -10.8 34.2 59 202 A V B -A 124 0A 45 -2,-1.1 361,-0.3 65,-0.2 2,-0.3 -0.775 28.6-159.9-122.1 160.0 20.3 -11.3 37.9 60 203 A T - 0 0 0 63,-2.1 -2,-0.0 -2,-0.3 359,-0.0 -0.973 14.3-159.3-133.2 148.9 22.6 -10.0 40.7 61 204 A S + 0 0 89 -2,-0.3 62,-0.1 2,-0.1 63,-0.0 0.167 59.2 117.2-109.8 16.3 23.7 -11.5 44.0 62 205 A K S S- 0 0 40 1,-0.1 -2,-0.1 61,-0.1 2,-0.1 -0.440 74.5 -95.0 -78.3 154.5 24.7 -8.1 45.5 63 206 A P - 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.381 39.9-106.4 -66.7 149.1 23.0 -6.6 48.5 64 207 A L - 0 0 17 1,-0.1 5,-0.1 -2,-0.1 59,-0.0 -0.692 46.3-115.7 -75.3 124.8 20.1 -4.1 47.9 65 208 A P >> - 0 0 5 0, 0.0 4,-1.5 0, 0.0 3,-0.9 -0.038 13.5-113.7 -63.4 162.9 21.5 -0.6 48.8 66 209 A E H 3> S+ 0 0 131 1,-0.2 4,-1.2 555,-0.2 559,-0.1 0.722 115.1 61.3 -68.0 -24.4 20.3 1.6 51.6 67 210 A Y H 34 S+ 0 0 45 1,-0.2 -1,-0.2 2,-0.2 558,-0.0 0.681 108.5 42.4 -77.1 -18.0 19.0 4.1 49.0 68 211 A L H X4 S+ 0 0 9 -3,-0.9 3,-1.1 2,-0.1 -2,-0.2 0.733 105.9 59.9 -98.2 -27.8 16.5 1.6 47.6 69 212 A W H >< S+ 0 0 98 -4,-1.5 3,-2.2 1,-0.2 5,-0.2 0.920 96.6 62.2 -62.9 -43.6 15.3 0.0 50.9 70 213 A K T 3< S+ 0 0 182 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.369 99.2 59.2 -65.9 5.7 13.9 3.4 52.0 71 214 A K T < S+ 0 0 123 -3,-1.1 -1,-0.3 2,-0.0 2,-0.2 0.234 83.7 100.7-119.0 8.8 11.6 3.3 49.0 72 215 A I S < S- 0 0 39 -3,-2.2 2,-1.0 5,-0.0 5,-0.1 -0.546 78.6-121.1 -87.1 158.5 9.7 0.1 49.8 73 216 A A S S- 0 0 70 3,-1.1 -3,-0.1 -2,-0.2 -1,-0.0 -0.631 75.4 -69.7 -94.5 70.3 6.3 -0.1 51.4 74 217 A N S S- 0 0 152 -2,-1.0 -1,-0.1 1,-0.2 3,-0.1 0.914 106.8 -26.5 36.9 82.2 7.6 -2.1 54.4 75 218 A N S S+ 0 0 106 1,-0.1 2,-0.3 18,-0.0 -1,-0.2 0.782 117.8 103.7 64.3 32.2 8.5 -5.5 53.1 76 219 A C - 0 0 35 17,-0.1 -3,-1.1 18,-0.1 2,-0.3 -0.950 42.7-178.5-149.0 123.6 6.0 -5.4 50.1 77 220 A I E -B 92 0B 11 15,-1.9 15,-1.7 -2,-0.3 2,-0.4 -0.926 24.3-125.7-119.1 150.7 6.4 -4.8 46.4 78 221 A F E -B 91 0B 116 -2,-0.3 59,-1.0 13,-0.2 2,-0.4 -0.793 21.9-176.3 -99.7 131.1 3.7 -4.6 43.7 79 222 A I E -Bc 90 137B 3 11,-1.9 11,-2.7 -2,-0.4 2,-0.8 -0.982 13.0-153.0-128.0 120.3 3.7 -6.8 40.5 80 223 A V E -Bc 89 138B 5 57,-2.9 59,-2.5 -2,-0.4 9,-0.2 -0.818 11.5-164.3 -95.2 107.1 1.0 -6.4 37.9 81 224 A I E -B 88 0B 20 7,-2.0 7,-2.4 -2,-0.8 2,-0.4 -0.621 16.9-132.8 -86.4 152.9 0.5 -9.6 35.9 82 225 A H E -B 87 0B 20 57,-0.4 59,-0.9 5,-0.2 5,-0.3 -0.874 24.8-176.9-122.2 142.9 -1.4 -9.3 32.6 83 226 A R - 0 0 168 3,-2.3 -1,-0.2 -2,-0.4 58,-0.1 0.672 62.5 -71.3 -89.0-111.7 -4.3 -11.0 30.7 84 227 A S S S- 0 0 122 3,-0.0 -2,-0.0 0, 0.0 3,-0.0 0.628 118.1 -7.5-111.6 -72.8 -5.0 -9.7 27.2 85 228 A T S S+ 0 0 140 -3,-0.0 2,-0.1 2,-0.0 0, 0.0 0.783 132.5 54.3 -89.7 -36.6 -6.7 -6.3 27.7 86 229 A T - 0 0 89 -4,-0.0 -3,-2.3 1,-0.0 2,-0.3 -0.209 67.9-148.3 -97.1-176.5 -6.9 -6.5 31.5 87 230 A S E -B 82 0B 58 -5,-0.3 2,-0.3 -4,-0.1 -5,-0.2 -0.998 8.0-141.2-156.3 148.2 -4.5 -7.1 34.4 88 231 A Q E -B 81 0B 108 -7,-2.4 -7,-2.0 -2,-0.3 2,-0.5 -0.872 18.3-143.7-111.4 147.4 -4.3 -8.6 37.9 89 232 A T E -B 80 0B 85 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.950 13.9-161.4-120.1 124.9 -2.2 -7.0 40.7 90 233 A I E -B 79 0B 55 -11,-2.7 -11,-1.9 -2,-0.5 2,-0.4 -0.853 16.4-133.9-113.3 136.3 -0.3 -9.1 43.3 91 234 A K E +B 78 0B 175 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.2 -0.736 38.3 178.2 -81.9 130.6 1.2 -8.3 46.7 92 235 A V E -B 77 0B 7 -15,-1.7 -15,-1.9 -2,-0.4 9,-0.0 -0.876 28.2-136.5-136.9 160.0 4.7 -9.6 47.0 93 236 A S > - 0 0 37 -2,-0.3 3,-3.2 -17,-0.2 28,-0.3 -0.969 35.2-110.7-120.8 142.3 7.8 -9.8 49.4 94 237 A P T 3 S+ 0 0 4 0, 0.0 28,-2.0 0, 0.0 27,-0.3 0.592 115.3 54.5 -46.6 -20.1 11.4 -9.3 48.2 95 238 A D T 3 S+ 0 0 103 25,-0.2 2,-1.3 26,-0.2 24,-0.0 0.467 73.0 121.8 -97.8 -3.5 12.3 -13.0 48.7 96 239 A D < - 0 0 43 -3,-3.2 25,-0.2 24,-0.1 5,-0.1 -0.459 58.4-143.4 -66.5 91.5 9.5 -14.4 46.6 97 240 A T > - 0 0 48 -2,-1.3 3,-3.7 23,-0.2 4,-0.3 -0.244 30.5-100.0 -51.4 139.3 11.3 -16.4 43.9 98 241 A P G > S+ 0 0 12 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.767 123.9 56.4 -31.9 -45.1 9.6 -16.2 40.5 99 242 A G G 3 S+ 0 0 75 18,-0.3 -2,-0.1 1,-0.2 19,-0.1 0.620 88.9 75.2 -67.9 -16.0 8.0 -19.6 41.0 100 243 A A G < 0 0 61 -3,-3.7 -1,-0.2 0, 0.0 -3,-0.1 0.530 360.0 360.0 -75.8 -7.1 6.3 -18.5 44.3 101 244 A I < 0 0 69 -3,-1.3 -9,-0.0 -4,-0.3 -4,-0.0 -0.753 360.0 360.0-142.7 360.0 3.7 -16.5 42.3 102 ! 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 0.0 103 269 A D 0 0 172 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-168.1 4.6 -24.3 31.7 104 270 A F - 0 0 144 39,-0.1 2,-0.3 2,-0.0 39,-0.2 -0.868 360.0-164.1-124.0 153.4 4.2 -20.5 32.1 105 271 A V E -D 142 0C 8 37,-2.2 37,-3.2 -2,-0.3 2,-1.0 -0.965 23.8-119.2-140.8 150.1 6.8 -17.7 32.5 106 272 A L E -D 141 0C 20 9,-0.4 9,-2.5 -2,-0.3 2,-0.4 -0.754 33.6-178.5 -96.9 94.1 6.8 -14.0 33.6 107 273 A R E -DE 140 114C 18 33,-2.2 33,-1.8 -2,-1.0 7,-0.2 -0.784 32.3-110.8 -94.8 132.3 8.1 -11.9 30.7 108 274 A V E > -D 139 0C 1 5,-3.0 3,-1.9 -2,-0.4 5,-0.4 -0.338 44.1 -95.5 -61.1 133.9 8.4 -8.1 31.2 109 275 A C T 3 S- 0 0 21 29,-2.3 479,-0.2 1,-0.3 478,-0.1 -0.292 103.6 -0.6 -57.7 123.3 5.9 -6.1 29.2 110 276 A G T 3 S+ 0 0 5 1,-0.1 447,-0.4 477,-0.1 2,-0.3 0.513 117.7 89.1 78.0 8.4 7.3 -4.8 25.9 111 277 A R S < S- 0 0 42 -3,-1.9 2,-2.1 2,-0.2 445,-0.2 -0.993 79.4-125.4-139.5 142.7 10.7 -6.4 26.4 112 278 A D S S+ 0 0 23 443,-2.0 2,-0.4 -2,-0.3 -3,-0.1 -0.475 75.1 121.0 -79.2 66.1 12.6 -9.6 25.8 113 279 A E - 0 0 12 -2,-2.1 -5,-3.0 -5,-0.4 2,-0.3 -0.999 47.4-156.5-137.6 129.5 13.4 -9.7 29.5 114 280 A Y B -E 107 0C 17 -59,-0.6 2,-0.8 -2,-0.4 -56,-0.5 -0.842 20.6-149.0-117.6 142.8 12.4 -12.5 31.8 115 281 A L + 0 0 5 -9,-2.5 -9,-0.4 -2,-0.3 2,-0.3 -0.727 57.2 126.5-103.4 77.5 11.8 -12.9 35.6 116 282 A V + 0 0 25 -2,-0.8 2,-0.1 -61,-0.1 -2,-0.1 -0.935 28.6 51.6-133.9 155.6 12.8 -16.6 35.9 117 283 A G S S- 0 0 18 -2,-0.3 2,-2.1 1,-0.1 -18,-0.3 -0.276 89.2 -48.5 110.8 170.4 15.2 -18.8 37.9 118 284 A E S S+ 0 0 178 -21,-0.1 -1,-0.1 -2,-0.1 -21,-0.0 -0.472 94.7 101.1 -81.8 72.5 16.3 -19.6 41.4 119 285 A T S S- 0 0 24 -2,-2.1 -58,-0.0 -23,-0.0 5,-0.0 -0.983 75.6-104.1-149.1 143.7 16.7 -16.1 42.8 120 286 A P > - 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0 0 12 1,-0.1 3,-1.8 2,-0.1 -1,-0.1 -0.141 37.2-102.7 -66.0 162.1 49.8 3.5 43.8 329 563 A P T 3 S+ 0 0 32 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.628 119.9 54.7 -62.7 -17.1 50.1 1.6 40.5 330 564 A L T 3 S+ 0 0 31 2,-0.1 -2,-0.1 473,-0.1 477,-0.0 0.256 77.6 111.9-101.8 9.6 51.7 4.6 38.8 331 565 A N S < S- 0 0 52 -3,-1.8 2,-0.1 1,-0.0 -4,-0.0 -0.773 73.4-123.1 -83.3 114.9 54.5 5.1 41.3 332 566 A P - 0 0 92 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.369 18.4-133.2 -64.1 130.7 57.7 4.2 39.5 333 567 A L - 0 0 32 -2,-0.1 2,-0.1 27,-0.0 -9,-0.0 -0.742 17.0-144.8 -83.5 127.6 59.8 1.4 41.1 334 568 A T > - 0 0 59 -2,-0.5 4,-2.2 1,-0.1 3,-0.3 -0.464 28.9-105.7 -81.4 162.1 63.5 2.2 41.4 335 569 A A H > S+ 0 0 54 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.893 123.4 57.4 -52.8 -43.3 66.2 -0.5 41.0 336 570 A E H > S+ 0 0 130 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.893 108.1 46.4 -54.3 -43.8 66.6 -0.5 44.8 337 571 A D H > S+ 0 0 27 -3,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.884 113.4 47.9 -66.6 -44.3 62.8 -1.3 45.2 338 572 A K H X S+ 0 0 74 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.917 110.9 50.0 -61.3 -48.6 62.9 -4.1 42.6 339 573 A E H X S+ 0 0 135 -4,-2.9 4,-1.7 1,-0.2 -1,-0.2 0.861 113.4 48.6 -61.2 -36.2 66.0 -5.7 44.1 340 574 A L H X S+ 0 0 20 -4,-1.6 4,-2.3 -5,-0.3 -2,-0.2 0.937 111.3 47.9 -67.8 -49.7 64.3 -5.5 47.5 341 575 A L H < S+ 0 0 0 -4,-2.7 7,-0.3 1,-0.2 -2,-0.2 0.857 114.2 47.4 -56.9 -41.1 61.0 -7.0 46.3 342 576 A W H >< S+ 0 0 37 -4,-2.5 3,-1.2 2,-0.2 -1,-0.2 0.871 110.8 49.8 -73.0 -38.9 62.8 -9.9 44.5 343 577 A H H 3< S+ 0 0 131 -4,-1.7 3,-0.4 1,-0.3 -2,-0.2 0.925 115.8 43.3 -65.9 -42.8 65.1 -10.7 47.4 344 578 A F T 3X S+ 0 0 35 -4,-2.3 4,-3.0 1,-0.2 3,-0.4 -0.079 79.1 140.3 -97.8 31.9 62.1 -10.8 49.7 345 579 A R H <> + 0 0 47 -3,-1.2 4,-1.7 1,-0.2 -1,-0.2 0.864 68.6 44.5 -20.4 -67.0 60.2 -12.7 47.1 346 580 A Y H 4 S+ 0 0 77 -3,-0.4 4,-0.3 1,-0.2 -1,-0.2 0.766 112.6 49.8 -75.7 -26.1 58.5 -15.1 49.5 347 581 A E H >4 S+ 0 0 16 -3,-0.4 3,-1.3 2,-0.2 -1,-0.2 0.905 110.9 51.7 -69.2 -43.9 57.5 -12.5 52.0 348 582 A S H >< S+ 0 0 0 -4,-3.0 3,-1.7 -7,-0.3 6,-0.3 0.810 99.0 64.9 -62.2 -33.8 56.0 -10.4 49.2 349 583 A L T 3< S+ 0 0 10 -4,-1.7 -1,-0.3 1,-0.3 34,-0.2 0.680 88.0 69.8 -62.7 -20.1 54.0 -13.4 47.9 350 584 A K T < S+ 0 0 107 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.469 94.4 65.0 -74.8 -2.0 52.0 -13.2 51.2 351 585 A H X - 0 0 65 -3,-1.7 3,-1.7 1,-0.1 4,-0.4 -0.933 65.1-162.7-128.1 105.8 50.5 -10.0 50.0 352 586 A P G > S+ 0 0 30 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.862 92.0 64.2 -53.9 -35.8 48.2 -10.0 46.9 353 587 A K G 3 S+ 0 0 123 1,-0.3 4,-0.4 2,-0.1 -5,-0.0 0.720 97.1 57.7 -59.2 -23.0 48.6 -6.3 46.5 354 588 A A G <> S+ 0 0 0 -3,-1.7 4,-3.1 -6,-0.3 5,-0.3 0.568 79.2 92.0 -84.6 -12.4 52.4 -6.8 45.9 355 589 A Y H <> S+ 0 0 1 -3,-1.6 4,-2.6 -4,-0.4 5,-0.2 0.914 84.4 48.6 -55.3 -48.7 51.9 -9.0 42.9 356 590 A P H > S+ 0 0 8 0, 0.0 4,-0.6 0, 0.0 -1,-0.2 0.927 118.1 40.5 -56.9 -44.2 52.0 -6.3 40.2 357 591 A K H 4 S+ 0 0 14 -4,-0.4 3,-0.5 2,-0.2 -2,-0.2 0.896 114.2 52.4 -72.1 -40.3 55.1 -4.7 41.6 358 592 A L H >< S+ 0 0 0 -4,-3.1 3,-1.5 1,-0.2 -1,-0.2 0.892 108.9 49.8 -61.5 -42.3 56.8 -8.0 42.4 359 593 A F H 3< S+ 0 0 1 -4,-2.6 3,-0.3 -5,-0.3 -1,-0.2 0.623 106.7 56.1 -77.5 -10.7 56.3 -9.2 38.8 360 594 A S T 3< S+ 0 0 34 -4,-0.6 -1,-0.3 -3,-0.5 -2,-0.2 0.335 98.0 64.8 -87.8 -1.1 57.8 -5.9 37.6 361 595 A S S < S+ 0 0 11 -3,-1.5 2,-0.4 -23,-0.1 -2,-0.2 0.397 80.4 109.0 -96.0 1.2 60.9 -6.9 39.7 362 596 A V - 0 0 3 -3,-0.3 2,-1.4 -4,-0.1 3,-0.1 -0.637 69.0-138.3 -87.7 129.6 61.6 -9.8 37.5 363 597 A K > - 0 0 124 -2,-0.4 3,-1.3 1,-0.2 7,-0.3 -0.736 24.7-175.0 -80.8 91.3 64.5 -9.8 35.1 364 598 A W T 3 S+ 0 0 14 -2,-1.4 -1,-0.2 1,-0.3 6,-0.1 0.667 74.2 63.4 -68.6 -17.3 62.6 -11.5 32.3 365 599 A G T 3 S+ 0 0 22 1,-0.1 2,-0.5 -139,-0.1 -1,-0.3 0.188 87.4 80.1 -92.9 17.1 65.7 -11.7 30.0 366 600 A Q S X> S- 0 0 97 -3,-1.3 4,-1.6 1,-0.1 3,-1.0 -0.928 71.0-150.6-128.6 104.4 67.5 -14.1 32.4 367 601 A Q H 3> S+ 0 0 30 -2,-0.5 4,-1.9 1,-0.3 -1,-0.1 0.778 92.3 49.8 -47.1 -44.3 66.4 -17.7 32.1 368 602 A E H 3> S+ 0 0 129 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.857 107.8 53.9 -69.2 -35.2 67.0 -18.8 35.7 369 603 A I H <> S+ 0 0 18 -3,-1.0 4,-1.7 2,-0.2 -1,-0.2 0.927 108.4 50.0 -61.6 -45.4 65.2 -15.8 37.2 370 604 A V H X S+ 0 0 17 -4,-1.6 4,-2.5 -7,-0.3 -2,-0.2 0.912 108.0 54.2 -59.6 -43.6 62.1 -16.7 35.1 371 605 A A H X S+ 0 0 20 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.871 109.3 46.9 -55.7 -43.0 62.4 -20.3 36.4 372 606 A K H X S+ 0 0 75 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.769 110.5 53.9 -69.9 -28.8 62.4 -19.1 40.0 373 607 A T H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.873 109.8 46.3 -70.8 -40.9 59.4 -16.8 39.1 374 608 A Y H X S+ 0 0 62 -4,-2.5 4,-1.1 2,-0.2 -2,-0.2 0.827 111.2 52.6 -71.6 -32.9 57.5 -19.8 37.7 375 609 A Q H < S+ 0 0 127 -4,-1.9 4,-0.4 -5,-0.2 -2,-0.2 0.885 108.6 52.4 -61.4 -40.4 58.5 -21.7 40.9 376 610 A L H >< S+ 0 0 0 -4,-1.6 3,-1.6 1,-0.2 -2,-0.2 0.919 105.7 51.4 -65.2 -46.7 57.1 -18.8 42.8 377 611 A L H >< S+ 0 0 7 -4,-2.2 3,-0.6 1,-0.3 -1,-0.2 0.776 99.9 65.5 -60.3 -28.9 53.7 -18.9 41.0 378 612 A A T 3< S+ 0 0 85 -4,-1.1 2,-0.3 1,-0.3 -1,-0.3 0.685 98.3 56.5 -66.9 -17.6 53.5 -22.6 41.8 379 613 A R T < S+ 0 0 146 -3,-1.6 2,-0.4 -4,-0.4 -1,-0.3 -0.460 70.2 130.1-112.1 56.8 53.2 -21.7 45.5 380 614 A R <> + 0 0 63 -3,-0.6 4,-1.6 -2,-0.3 -1,-0.1 -0.467 8.6 135.1-116.6 63.3 50.2 -19.3 45.4 381 615 A E H > S+ 0 0 128 -2,-0.4 4,-1.3 2,-0.2 -1,-0.2 0.939 77.9 49.7 -65.9 -48.2 47.9 -20.5 48.2 382 616 A V H > S+ 0 0 58 -3,-0.3 4,-2.0 1,-0.2 3,-0.2 0.885 111.5 47.4 -63.6 -43.8 47.2 -16.9 49.3 383 617 A W H 4 S+ 0 0 2 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.933 113.1 49.1 -60.2 -47.3 46.5 -15.5 45.9 384 618 A D H < S+ 0 0 68 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.696 115.3 45.9 -67.7 -20.1 44.1 -18.5 45.2 385 619 A Q H < S+ 0 0 154 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.791 90.6 95.4 -92.9 -32.8 42.3 -17.9 48.5 386 620 A S S < S- 0 0 36 -4,-2.0 2,-0.1 -5,-0.1 3,-0.1 -0.129 80.9-100.2 -63.3 154.1 41.8 -14.1 48.5 387 621 A A - 0 0 92 1,-0.1 -1,-0.1 0, 0.0 -2,-0.1 -0.458 51.4 -84.9 -73.3 149.2 38.6 -12.4 47.4 388 622 A L - 0 0 48 -2,-0.1 2,-0.5 25,-0.1 -1,-0.1 -0.293 38.2-173.0 -59.8 127.5 38.6 -10.8 44.0 389 623 A D > - 0 0 62 1,-0.1 4,-2.6 -3,-0.1 5,-0.2 -0.977 7.9-164.3-116.7 112.5 39.9 -7.3 43.5 390 624 A V H > S+ 0 0 16 -2,-0.5 4,-3.9 2,-0.2 5,-0.2 0.917 88.7 56.4 -61.7 -44.4 39.2 -6.2 40.0 391 625 A G H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.967 111.3 41.1 -46.4 -68.1 41.7 -3.3 40.3 392 626 A L H > S+ 0 0 11 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.878 117.2 49.8 -48.5 -46.9 44.5 -5.6 41.2 393 627 A T H < S+ 0 0 1 -4,-2.6 3,-0.4 1,-0.2 4,-0.3 0.909 110.2 49.6 -61.8 -44.9 43.4 -8.2 38.6 394 628 A M H >X S+ 0 0 1 -4,-3.9 3,-2.5 1,-0.2 4,-0.6 0.908 102.6 62.1 -59.4 -43.0 43.2 -5.5 35.9 395 629 A Q H >< S+ 0 0 10 -4,-2.7 3,-1.0 1,-0.3 5,-0.3 0.857 101.6 53.5 -51.4 -37.9 46.7 -4.2 36.8 396 630 A L T 3< S+ 0 0 0 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.507 104.5 54.6 -79.0 -6.0 47.9 -7.7 35.7 397 631 A L T <4 S+ 0 0 0 -3,-2.5 -1,-0.2 -4,-0.3 -2,-0.2 0.456 89.9 99.4-103.1 -0.4 46.3 -7.5 32.3 398 632 A D S X< S- 0 0 8 -3,-1.0 3,-1.5 -4,-0.6 -3,-0.0 0.020 94.8 -81.2 -81.6-172.4 47.8 -4.2 31.2 399 633 A C T 3 S+ 0 0 6 1,-0.3 -205,-0.2 -206,-0.1 -1,-0.1 0.571 117.9 72.6 -71.2 -11.8 50.8 -3.5 29.0 400 634 A N T 3 S+ 0 0 87 -5,-0.3 2,-0.4 -207,-0.2 -1,-0.3 0.537 92.6 61.4 -77.8 -7.4 53.4 -4.1 31.7 401 635 A F < + 0 0 11 -3,-1.5 -208,-0.1 1,-0.1 -1,-0.1 -0.982 42.2 154.9-129.8 125.2 52.8 -7.9 31.7 402 636 A S + 0 0 12 -2,-0.4 2,-0.6 34,-0.1 -1,-0.1 0.273 43.3 111.6-126.1 0.2 53.4 -10.2 28.8 403 637 A D > - 0 0 1 1,-0.2 4,-2.9 -211,-0.1 5,-0.2 -0.732 59.2-149.4 -83.8 120.4 54.0 -13.4 30.6 404 638 A E H > S+ 0 0 49 -2,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.869 96.9 50.8 -56.5 -40.5 51.1 -15.8 30.0 405 639 A N H > S+ 0 0 76 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.919 111.9 46.2 -66.7 -44.6 51.5 -17.4 33.4 406 640 A V H >> S+ 0 0 0 1,-0.2 4,-0.6 2,-0.2 3,-0.6 0.945 116.7 45.7 -58.0 -48.7 51.4 -14.1 35.2 407 641 A R H >X S+ 0 0 3 -4,-2.9 4,-1.9 1,-0.2 3,-0.7 0.824 106.2 60.2 -66.7 -31.4 48.4 -13.0 33.1 408 642 A A H 3X S+ 0 0 40 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.784 97.4 57.7 -69.2 -29.2 46.6 -16.3 33.6 409 643 A I H < S+ 0 0 1 -4,-1.5 3,-2.3 1,-0.3 -1,-0.2 0.775 91.1 74.6 -61.1 -28.1 37.9 -13.1 36.8 415 649 A E T 3< S+ 0 0 72 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.780 91.8 55.2 -57.5 -27.3 36.5 -16.7 36.5 416 650 A S T < S+ 0 0 89 -3,-1.4 -1,-0.3 -4,-0.3 2,-0.2 0.438 83.2 117.6 -88.5 -0.8 34.8 -16.1 39.9 417 651 A L < - 0 0 11 -3,-2.3 2,-0.2 -4,-0.1 -3,-0.0 -0.490 65.6-127.3 -66.0 130.0 33.1 -12.9 38.6 418 652 A E >> - 0 0 62 -2,-0.2 3,-2.0 1,-0.1 4,-1.2 -0.531 27.1-109.1 -73.5 148.0 29.3 -13.0 38.5 419 653 A D H 3> S+ 0 0 38 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.761 116.4 64.1 -51.2 -35.5 27.7 -12.1 35.1 420 654 A D H 3> S+ 0 0 5 -361,-0.3 4,-0.5 1,-0.2 -1,-0.3 0.876 109.2 41.5 -53.7 -38.7 26.4 -8.8 36.4 421 655 A D H <> S+ 0 0 29 -3,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.702 104.2 62.0 -87.5 -25.0 30.0 -7.7 36.9 422 656 A V H >X S+ 0 0 0 -4,-1.2 3,-1.3 1,-0.2 4,-1.2 0.973 103.7 53.1 -61.3 -49.9 31.4 -9.1 33.7 423 657 A L H 3< S+ 0 0 26 -4,-1.9 4,-0.4 1,-0.3 -1,-0.2 0.780 105.3 55.3 -49.9 -35.0 29.1 -6.7 32.0 424 658 A H H 3< S+ 0 0 34 -4,-0.5 -1,-0.3 1,-0.2 -2,-0.2 0.769 121.8 26.3 -70.4 -27.7 30.6 -3.9 34.1 425 659 A Y H S+ 0 0 3 -4,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.911 114.7 41.9 -59.2 -45.5 34.5 -3.2 27.5 428 662 A Q H > S+ 0 0 2 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.892 114.4 52.7 -73.7 -34.8 37.9 -2.8 29.3 429 663 A L H < S+ 0 0 0 -4,-2.8 4,-0.4 2,-0.2 -2,-0.2 0.916 109.9 47.9 -60.9 -46.4 38.4 -6.6 29.3 430 664 A V H >< S+ 0 0 0 -4,-3.0 3,-1.2 1,-0.2 4,-0.4 0.897 111.4 51.4 -60.5 -41.1 37.9 -6.7 25.5 431 665 A Q H >< S+ 0 0 6 -4,-2.1 3,-1.5 1,-0.2 -2,-0.2 0.860 101.6 62.3 -63.9 -31.2 40.3 -3.7 25.2 432 666 A A G >< S+ 0 0 1 -4,-1.8 3,-1.7 1,-0.3 -1,-0.2 0.604 82.4 77.8 -74.0 -10.8 42.8 -5.7 27.3 433 667 A V G X S+ 0 0 1 -3,-1.2 3,-1.7 -4,-0.4 -1,-0.3 0.845 83.2 68.5 -62.6 -30.5 42.9 -8.4 24.6 434 668 A K G < S+ 0 0 2 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.455 93.6 56.6 -63.5 -6.2 45.1 -5.8 22.8 435 669 A F G < S+ 0 0 12 -3,-1.7 -1,-0.3 -38,-0.1 -2,-0.2 0.430 81.2 109.9-106.5 -3.5 47.8 -6.4 25.5 436 670 A E < - 0 0 12 -3,-1.7 -34,-0.1 -4,-0.2 5,-0.0 -0.614 61.6-149.5 -75.1 123.2 48.0 -10.1 24.9 437 671 A P S S+ 0 0 14 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.879 83.1 44.9 -51.5 -43.0 51.3 -11.3 23.2 438 672 A Y S S- 0 0 6 2,-0.1 -3,-0.1 1,-0.1 -2,-0.0 -0.780 78.5-129.1-114.4 151.3 49.4 -14.2 21.5 439 673 A H S S+ 0 0 16 -2,-0.3 2,-0.7 1,-0.2 -1,-0.1 0.797 103.1 59.4 -65.0 -31.6 46.1 -14.4 19.6 440 674 A D S S+ 0 0 38 4,-0.1 2,-0.3 3,-0.0 -1,-0.2 -0.889 74.7 151.1-102.2 108.1 45.1 -17.3 21.8 441 675 A S > - 0 0 7 -2,-0.7 4,-1.9 1,-0.1 5,-0.2 -0.907 59.8-110.7-132.5 160.4 45.1 -16.3 25.4 442 676 A A H > S+ 0 0 46 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.820 119.8 54.2 -54.3 -32.8 43.3 -17.3 28.6 443 677 A L H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.915 104.9 51.1 -73.7 -43.6 41.6 -13.9 28.5 444 678 A A H > S+ 0 0 1 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.894 113.4 47.2 -53.9 -43.0 40.3 -14.4 24.9 445 679 A R H X S+ 0 0 84 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.870 109.1 53.6 -70.2 -38.9 38.9 -17.8 26.1 446 680 A F H X S+ 0 0 1 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.960 110.8 45.6 -56.7 -53.8 37.4 -16.3 29.2 447 681 A L H X S+ 0 0 2 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.866 112.2 54.9 -58.8 -36.8 35.5 -13.7 27.1 448 682 A L H X S+ 0 0 0 -4,-1.8 4,-1.7 -5,-0.2 -2,-0.2 0.959 113.0 38.2 -62.9 -52.2 34.5 -16.5 24.7 449 683 A K H X S+ 0 0 46 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.834 114.6 52.3 -76.7 -29.3 32.9 -18.7 27.3 450 684 A R H < S+ 0 0 4 -4,-2.6 4,-0.4 -5,-0.2 8,-0.3 0.879 111.2 49.9 -68.5 -37.0 31.3 -16.0 29.4 451 685 A G H >< S+ 0 0 0 -4,-1.8 7,-0.7 -5,-0.3 3,-0.6 0.868 112.1 46.4 -66.5 -38.7 29.7 -14.6 26.2 452 686 A L H 3< S+ 0 0 0 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.762 107.8 57.3 -76.3 -26.5 28.4 -18.1 25.2 453 687 A R T 3< S+ 0 0 95 -4,-1.6 2,-0.3 1,-0.2 -1,-0.2 0.617 115.7 36.6 -74.1 -11.3 27.1 -18.7 28.7 454 688 A N <> - 0 0 17 -3,-0.6 4,-3.0 -4,-0.4 3,-0.2 -0.900 62.6-151.0-155.2 114.4 24.9 -15.5 28.5 455 689 A K H > S+ 0 0 30 -402,-0.4 4,-1.5 -2,-0.3 -1,-0.1 0.726 101.1 52.2 -58.6 -27.1 23.0 -13.8 25.7 456 690 A R H > S+ 0 0 39 2,-0.2 4,-1.9 3,-0.1 -1,-0.2 0.891 112.3 42.7 -78.1 -43.0 23.4 -10.4 27.2 457 691 A I H > S+ 0 0 0 -3,-0.2 4,-3.1 -7,-0.2 -2,-0.2 0.957 116.1 51.5 -61.4 -46.7 27.2 -10.6 27.6 458 692 A G H X S+ 0 0 0 -4,-3.0 4,-2.3 -7,-0.7 -2,-0.2 0.830 106.9 53.0 -60.0 -37.6 27.3 -12.2 24.1 459 693 A H H X S+ 0 0 2 -4,-1.5 4,-1.7 -5,-0.2 -1,-0.2 0.968 115.4 38.8 -61.0 -55.1 25.3 -9.4 22.6 460 694 A F H X S+ 0 0 22 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.856 112.0 58.8 -67.7 -33.6 27.6 -6.7 23.9 461 695 A L H X S+ 0 0 0 -4,-3.1 4,-3.1 -5,-0.2 5,-0.3 0.968 104.2 52.8 -53.9 -52.6 30.6 -8.9 23.2 462 696 A F H X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.2 5,-0.2 0.932 114.1 39.9 -47.9 -58.9 29.6 -8.9 19.5 463 697 A W H X S+ 0 0 0 -4,-1.7 4,-3.0 2,-0.2 -1,-0.2 0.884 114.5 52.3 -63.3 -41.8 29.3 -5.1 19.1 464 698 A F H X S+ 0 0 11 -4,-2.7 4,-1.1 2,-0.2 -1,-0.2 0.959 115.7 41.3 -60.3 -49.7 32.4 -4.4 21.2 465 699 A L H >X S+ 0 0 1 -4,-3.1 4,-1.5 -5,-0.2 3,-0.6 0.930 116.4 49.4 -60.2 -46.3 34.5 -6.8 19.0 466 700 A R H 3X S+ 0 0 16 -4,-3.1 4,-1.9 -5,-0.3 -2,-0.2 0.835 103.8 60.6 -64.6 -36.1 32.8 -5.5 15.8 467 701 A S H 3X S+ 0 0 0 -4,-3.0 4,-0.7 -5,-0.2 -1,-0.2 0.860 110.0 41.2 -55.4 -38.2 33.5 -2.0 16.8 468 702 A E H S+ 0 0 5 -3,-0.4 4,-2.3 -7,-0.3 3,-0.3 0.395 91.9 108.5-133.2 2.9 43.9 -5.7 15.9 476 710 A Q H X S+ 0 0 32 -4,-1.1 4,-1.6 1,-0.2 5,-0.1 0.803 80.4 53.6 -53.7 -35.7 41.1 -6.5 13.5 477 711 A Q H > S+ 0 0 13 -4,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.933 111.4 44.5 -66.6 -46.6 42.4 -9.9 12.6 478 712 A R H > S+ 0 0 6 -3,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.934 115.4 46.4 -63.6 -50.1 42.6 -11.1 16.2 479 713 A F H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.797 110.6 55.4 -64.1 -28.9 39.2 -9.7 17.2 480 714 A A H X S+ 0 0 0 -4,-1.6 4,-2.8 -5,-0.3 -1,-0.2 0.916 106.3 49.2 -69.7 -46.2 37.7 -11.2 14.1 481 715 A V H X S+ 0 0 3 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.943 114.4 46.1 -55.5 -49.4 38.9 -14.7 14.9 482 716 A I H X S+ 0 0 3 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.882 112.6 50.4 -63.6 -41.0 37.5 -14.3 18.5 483 717 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.887 110.0 50.1 -65.1 -40.6 34.2 -13.0 17.1 484 718 A E H X S+ 0 0 4 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.922 108.2 52.6 -61.8 -45.7 33.9 -15.9 14.7 485 719 A A H < S+ 0 0 1 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.910 111.9 47.8 -57.2 -41.4 34.5 -18.3 17.5 486 720 A Y H >X S+ 0 0 0 -4,-2.1 3,-1.9 1,-0.2 4,-1.1 0.928 108.5 51.6 -61.6 -47.7 31.7 -16.6 19.4 487 721 A L H 3X S+ 0 0 1 -4,-2.4 4,-0.6 1,-0.3 -1,-0.2 0.762 101.1 62.1 -69.5 -25.4 29.2 -16.6 16.5 488 722 A R H 3< S+ 0 0 37 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.501 115.0 34.1 -74.8 -5.3 29.7 -20.3 15.9 489 723 A G H <4 S+ 0 0 0 -3,-1.9 -2,-0.2 -4,-0.2 -1,-0.2 0.539 94.6 82.7-122.0 -13.9 28.3 -20.9 19.4 490 724 A C H < S- 0 0 0 -4,-1.1 -2,-0.1 1,-0.1 -3,-0.1 0.802 94.6-118.4 -71.8 -29.4 25.8 -18.2 20.1 491 725 A G >X - 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0 0 2 -5,-1.7 2,-0.3 -8,-0.2 -1,-0.3 -0.876 38.9-164.1-130.3 154.8 22.8 30.6 46.5 753 998 A S - 0 0 75 -2,-0.3 2,-2.4 -5,-0.1 4,-0.0 -0.844 62.8 -50.6-146.8 104.2 24.4 33.7 44.8 754 999 A G S S+ 0 0 54 -2,-0.3 2,-0.1 1,-0.1 80,-0.1 -0.388 128.8 13.4 76.9 -68.4 28.1 34.5 44.6 755 1000 A K S S+ 0 0 196 -2,-2.4 2,-0.2 2,-0.0 -1,-0.1 -0.596 97.2 93.6-147.6 79.0 29.1 34.1 48.2 756 1001 A K - 0 0 153 -2,-0.1 2,-0.4 2,-0.0 -4,-0.1 -0.854 58.8-119.0-147.4-177.2 26.5 32.4 50.5 757 1002 A T - 0 0 99 -2,-0.2 -2,-0.0 -6,-0.1 3,-0.0 -0.974 26.3-170.7-136.8 124.4 25.6 28.9 52.0 758 1003 A S > - 0 0 9 -2,-0.4 4,-3.2 1,-0.1 5,-0.2 -0.786 34.3-118.2-113.2 152.9 22.2 27.3 51.4 759 1004 A P H > S+ 0 0 109 0, 0.0 4,-0.7 0, 0.0 -8,-0.1 0.881 120.2 44.3 -52.4 -43.6 20.6 24.1 52.9 760 1005 A H H > S+ 0 0 50 -10,-0.6 4,-1.3 2,-0.2 -9,-0.1 0.768 114.0 51.3 -73.0 -26.3 20.5 22.5 49.4 761 1006 A F H > S+ 0 0 4 -11,-0.4 4,-2.8 2,-0.2 5,-0.3 0.881 102.8 57.0 -75.6 -41.3 24.1 23.6 48.9 762 1007 A Q H X S+ 0 0 106 -4,-3.2 4,-1.3 1,-0.2 -1,-0.2 0.771 108.4 50.5 -57.5 -26.1 25.3 22.2 52.2 763 1008 A K H X S+ 0 0 66 -4,-0.7 4,-3.1 -5,-0.2 -1,-0.2 0.859 106.6 53.0 -78.5 -40.7 23.9 18.9 50.8 764 1009 A F H X S+ 0 0 0 -4,-1.3 4,-2.6 2,-0.2 5,-0.2 0.940 112.4 44.3 -58.4 -49.5 25.8 19.4 47.5 765 1010 A Q H X S+ 0 0 47 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.876 114.0 52.5 -62.2 -37.9 29.0 19.9 49.5 766 1011 A D H X S+ 0 0 82 -4,-1.3 4,-1.7 -5,-0.3 -2,-0.2 0.942 113.4 41.0 -59.9 -51.1 28.0 16.9 51.6 767 1012 A I H X S+ 0 0 20 -4,-3.1 4,-3.1 2,-0.2 5,-0.2 0.894 114.3 50.9 -72.0 -42.8 27.4 14.5 48.7 768 1013 A C H X S+ 0 0 0 -4,-2.6 4,-3.6 -5,-0.2 5,-0.3 0.982 110.8 48.3 -55.5 -60.4 30.4 15.6 46.6 769 1014 A V H X S+ 0 0 20 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.854 116.4 44.1 -48.4 -42.6 32.8 15.1 49.5 770 1015 A K H X S+ 0 0 115 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.873 115.3 47.5 -73.8 -38.2 31.3 11.7 50.2 771 1016 A A H X S+ 0 0 0 -4,-3.1 4,-2.0 2,-0.2 -2,-0.2 0.868 113.1 49.6 -66.6 -39.6 31.3 10.7 46.5 772 1017 A Y H X S+ 0 0 1 -4,-3.6 4,-1.9 -5,-0.2 -2,-0.2 0.939 112.3 46.2 -65.5 -48.2 34.8 11.9 46.1 773 1018 A L H X S+ 0 0 13 -4,-2.2 4,-1.1 -5,-0.3 -2,-0.2 0.844 109.1 55.9 -65.2 -36.3 36.1 10.0 49.1 774 1019 A A H >< S+ 0 0 0 -4,-1.9 3,-0.9 1,-0.2 -1,-0.2 0.940 107.6 48.6 -59.5 -47.8 34.2 6.8 48.0 775 1020 A L H >< S+ 0 0 0 -4,-2.0 3,-2.1 1,-0.2 7,-0.2 0.903 105.6 59.8 -56.9 -39.2 36.0 7.0 44.7 776 1021 A R H >< S+ 0 0 27 -4,-1.9 3,-1.4 1,-0.3 -1,-0.2 0.751 92.7 65.1 -63.5 -25.7 39.3 7.4 46.6 777 1022 A H T << S+ 0 0 97 -4,-1.1 -1,-0.3 -3,-0.9 -2,-0.2 0.472 107.4 43.5 -74.8 -2.0 38.7 4.0 48.4 778 1023 A H T <> S+ 0 0 59 -3,-2.1 4,-2.2 -4,-0.2 -1,-0.3 -0.141 74.5 136.0-130.2 34.9 39.1 2.5 44.9 779 1024 A T H <> S+ 0 0 22 -3,-1.4 4,-2.9 1,-0.2 5,-0.2 0.918 70.9 49.7 -47.1 -56.6 42.1 4.6 43.8 780 1025 A N H > S+ 0 0 42 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.903 110.8 48.9 -53.8 -50.1 44.0 1.7 42.3 781 1026 A L H > S+ 0 0 9 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.921 114.3 44.4 -57.2 -49.1 41.0 0.4 40.2 782 1027 A L H X S+ 0 0 5 -4,-2.2 4,-2.3 -7,-0.2 -1,-0.2 0.884 111.5 53.6 -66.2 -41.3 40.3 3.9 38.8 783 1028 A I H X S+ 0 0 0 -4,-2.9 4,-2.7 -5,-0.2 -1,-0.2 0.926 111.5 46.6 -54.4 -46.9 43.9 4.6 38.1 784 1029 A I H X S+ 0 0 4 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.920 112.5 47.3 -68.3 -43.8 44.2 1.3 36.1 785 1030 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.867 113.1 51.2 -62.2 -36.4 40.9 1.9 34.1 786 1031 A F H X S+ 0 0 11 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.943 110.9 47.2 -66.4 -48.6 42.2 5.4 33.4 787 1032 A S H X S+ 0 0 8 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.924 114.8 46.2 -55.5 -48.7 45.6 4.2 32.2 788 1033 A M H X S+ 0 0 3 -4,-2.5 4,-1.9 1,-0.2 5,-0.3 0.879 108.2 56.7 -66.1 -40.7 44.0 1.5 30.0 789 1034 A M H X>S+ 0 0 5 -4,-2.3 4,-2.0 1,-0.2 5,-0.7 0.932 110.8 43.6 -52.6 -51.9 41.4 3.9 28.5 790 1035 A L H X5S+ 0 0 11 -4,-2.0 4,-0.6 1,-0.2 6,-0.4 0.848 115.4 49.2 -65.8 -35.4 44.2 6.2 27.3 791 1036 A M H <5S+ 0 0 10 -4,-1.8 -514,-3.2 -5,-0.2 -513,-0.3 0.703 125.8 23.4 -79.5 -23.3 46.3 3.4 26.0 792 1037 A T H <5S+ 0 0 12 -4,-1.9 -2,-0.2 -3,-0.3 -1,-0.2 0.506 131.3 36.0-118.3 -14.1 43.6 1.5 24.0 793 1038 A G H <5S+ 0 0 7 -4,-2.0 -3,-0.2 -5,-0.3 -188,-0.2 0.751 103.3 61.1-115.9 -37.1 41.1 4.2 23.3 794 1039 A M X< - 0 0 12 -5,-0.7 2,-2.8 -4,-0.6 4,-0.5 -0.869 60.0-156.4-102.0 105.1 42.8 7.6 22.7 795 1040 A P T 4 + 0 0 92 0, 0.0 -4,-0.1 0, 0.0 -519,-0.1 -0.413 58.6 122.7 -71.8 68.5 45.2 7.7 19.7 796 1041 A Q T 4 S- 0 0 107 -2,-2.8 3,-0.1 -6,-0.4 -5,-0.1 0.110 86.5-112.4-118.5 15.8 46.9 10.6 21.5 797 1042 A L T 4 - 0 0 95 -3,-0.2 -522,-0.3 1,-0.1 -521,-0.1 0.858 53.2-139.1 47.7 40.3 50.4 9.1 21.6 798 1043 A T < - 0 0 0 -4,-0.5 -523,-1.6 -8,-0.3 2,-0.2 0.203 21.0-155.0 -45.3 138.7 49.6 9.1 25.4 799 1044 A S > - 0 0 22 -525,-0.2 4,-1.6 -3,-0.1 3,-0.2 -0.562 30.5-110.1-106.5 168.3 52.2 10.1 27.9 800 1045 A K H > S+ 0 0 114 1,-0.2 4,-4.3 2,-0.2 5,-0.2 0.899 119.4 58.8 -59.5 -42.5 52.8 9.4 31.6 801 1046 A E H 4 S+ 0 0 136 1,-0.3 -1,-0.2 2,-0.2 -3,-0.0 0.767 104.4 49.8 -63.1 -29.6 51.9 13.0 32.3 802 1047 A D H >4 S+ 0 0 65 -3,-0.2 3,-0.7 2,-0.1 4,-0.3 0.903 117.9 40.4 -69.8 -43.0 48.5 12.5 30.7 803 1048 A I H >< S+ 0 0 9 -4,-1.6 3,-1.5 1,-0.2 4,-0.3 0.905 107.3 60.6 -72.2 -44.6 48.1 9.4 32.9 804 1049 A E T 3< S+ 0 0 64 -4,-4.3 4,-0.5 1,-0.3 -1,-0.2 0.123 82.6 86.0 -78.9 23.8 49.6 10.8 36.1 805 1050 A Y T X> S+ 0 0 79 -3,-0.7 4,-2.3 -5,-0.2 3,-0.6 0.829 83.7 56.0 -79.2 -42.4 46.9 13.5 36.0 806 1051 A I H <> S+ 0 0 1 -3,-1.5 4,-2.0 -4,-0.3 -2,-0.2 0.728 97.0 63.8 -66.7 -23.8 44.5 11.1 37.9 807 1052 A R H 34>S+ 0 0 64 -4,-0.3 5,-1.9 2,-0.2 -1,-0.3 0.910 108.7 41.7 -61.1 -43.4 47.1 10.8 40.6 808 1053 A D H X45S+ 0 0 100 -3,-0.6 3,-2.5 -4,-0.5 -2,-0.2 0.977 113.2 52.1 -63.8 -57.7 46.6 14.5 41.3 809 1054 A A H 3<5S+ 0 0 1 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.805 112.5 44.6 -51.8 -38.4 42.8 14.4 40.9 810 1055 A L T 3<5S- 0 0 0 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.331 106.4-128.3 -91.6 8.4 42.4 11.6 43.4 811 1056 A T T X 5 - 0 0 15 -3,-2.5 3,-1.4 1,-0.1 -3,-0.2 0.884 30.9-153.4 42.0 55.0 44.9 13.2 45.9 812 1057 A V T 3 - 0 0 89 -2,-0.3 4,-1.8 -3,-0.1 5,-0.2 -0.332 31.3-110.1 -73.5 161.5 44.7 11.8 54.5 816 1061 A E H > S+ 0 0 85 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.906 116.8 56.1 -61.0 -45.0 40.9 12.0 54.3 817 1062 A E H > S+ 0 0 162 1,-0.2 4,-1.3 2,-0.2 3,-0.3 0.938 110.6 45.1 -48.3 -52.9 40.8 15.3 56.2 818 1063 A D H > S+ 0 0 77 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.810 109.1 55.2 -65.7 -35.2 43.1 16.9 53.6 819 1064 A A H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.834 104.0 54.9 -67.8 -35.4 41.3 15.4 50.6 820 1065 A K H X S+ 0 0 91 -4,-2.0 4,-1.8 -3,-0.3 -1,-0.2 0.888 109.6 48.1 -61.7 -41.4 38.0 17.0 51.8 821 1066 A K H X S+ 0 0 133 -4,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.909 108.0 54.4 -64.4 -45.7 39.7 20.4 51.8 822 1067 A Y H X S+ 0 0 71 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.893 111.2 43.5 -59.1 -46.7 41.2 20.0 48.4 823 1068 A F H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.892 108.7 57.8 -67.4 -40.9 37.9 19.3 46.7 824 1069 A L H X S+ 0 0 60 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.827 103.0 55.6 -60.0 -32.5 36.1 22.1 48.6 825 1070 A D H X S+ 0 0 83 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.925 103.6 54.0 -60.1 -46.5 38.7 24.4 47.1 826 1071 A Q H X S+ 0 0 31 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.908 106.1 52.1 -54.6 -46.9 37.7 23.2 43.6 827 1072 A I H X S+ 0 0 0 -4,-2.0 4,-1.3 1,-0.2 -1,-0.2 0.926 111.9 46.8 -52.1 -47.9 34.1 24.1 44.4 828 1073 A E H X S+ 0 0 111 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.786 106.3 57.8 -67.7 -31.2 35.3 27.6 45.4 829 1074 A V H X S+ 0 0 55 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.934 104.4 52.1 -64.0 -46.4 37.4 27.9 42.3 830 1075 A C H X S+ 0 0 6 -4,-2.2 4,-1.0 1,-0.2 -2,-0.2 0.847 107.0 54.8 -54.0 -39.1 34.2 27.4 40.2 831 1076 A R H >< S+ 0 0 29 -4,-1.3 3,-0.8 1,-0.2 -1,-0.2 0.954 103.4 53.9 -60.6 -51.6 32.6 30.2 42.2 832 1077 A D H 3< S+ 0 0 127 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.792 107.4 50.4 -54.7 -35.9 35.3 32.7 41.4 833 1078 A K H >< S+ 0 0 58 -4,-1.3 3,-3.0 1,-0.2 2,-1.6 0.733 74.8 170.5 -81.1 -26.5 35.1 32.3 37.6 834 1079 A G T << S- 0 0 23 -4,-1.0 -1,-0.2 -3,-0.8 -2,-0.1 -0.270 76.8 -18.0 58.0 -82.1 31.3 32.7 37.4 835 1080 A W T 3> S+ 0 0 52 -2,-1.6 4,-2.5 -92,-0.1 -1,-0.3 0.156 105.9 108.3-140.1 11.9 30.8 32.9 33.6 836 1081 A T H <> S+ 0 0 65 -3,-3.0 4,-1.5 1,-0.2 -2,-0.1 0.894 85.2 39.9 -65.0 -43.5 34.3 33.7 32.5 837 1082 A V H > S+ 0 0 13 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.902 114.1 53.5 -73.7 -41.3 35.1 30.3 30.9 838 1083 A Q H >> S+ 0 0 14 1,-0.2 3,-0.7 2,-0.2 4,-0.5 0.935 112.7 43.5 -58.8 -49.6 31.6 29.9 29.4 839 1084 A F H >< S+ 0 0 135 -4,-2.5 3,-1.2 1,-0.2 -1,-0.2 0.861 104.7 66.8 -61.0 -37.8 31.8 33.3 27.6 840 1085 A N H >< S+ 0 0 66 -4,-1.5 3,-0.7 1,-0.3 -1,-0.2 0.744 91.2 61.0 -59.5 -29.4 35.4 32.6 26.5 841 1086 A W H << S+ 0 0 111 -4,-1.0 2,-0.5 -3,-0.7 -1,-0.3 0.851 87.1 76.8 -61.6 -35.2 34.3 29.7 24.2 842 1087 A F T << 0 0 135 -3,-1.2 -1,-0.2 -4,-0.5 -2,-0.1 0.174 360.0 360.0 -74.6 22.3 32.2 32.1 22.1 843 1088 A L < 0 0 198 -3,-0.7 -1,-0.3 -2,-0.5 -2,-0.1 0.414 360.0 360.0 -66.2 360.0 35.3 33.6 20.3