==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-APR-08 3CSF . COMPND 2 MOLECULE: PHOSPHATIDYLINOSITOL-4,5-BISPHOSPHATE 3-KINASE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.XIE,R.MARMORSTEIN . 839 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37138.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 575 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 111 13.2 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 . 4 0.5 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 . 1 0.1 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 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 93 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 282 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.1 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 3 2 1 2 3 0 1 3 0 4 2 0 0 3 2 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 PARALLEL BRIDGES PER LADDER . 3 6 3 2 4 1 1 2 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 1 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 91 0, 0.0 4,-1.7 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 154.1 37.7 -28.5 50.8 2 145 A E H > + 0 0 144 2,-0.3 4,-3.7 1,-0.3 5,-0.3 0.829 360.0 63.5 -69.4 -31.9 38.7 -25.5 52.9 3 146 A E H > S+ 0 0 117 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.926 105.5 44.4 -53.3 -40.8 41.3 -25.2 50.3 4 147 A S H > S+ 0 0 56 2,-0.2 4,-2.7 1,-0.2 -2,-0.3 0.858 110.2 55.3 -69.2 -38.3 38.2 -24.7 48.1 5 148 A Q H X S+ 0 0 94 -4,-1.7 4,-0.7 2,-0.2 -2,-0.2 0.927 111.3 43.0 -60.7 -45.9 36.8 -22.3 50.8 6 149 A A H >X S+ 0 0 50 -4,-3.7 4,-1.9 2,-0.2 3,-0.5 0.921 111.7 55.1 -65.8 -45.9 39.9 -20.2 50.6 7 150 A F H >X S+ 0 0 15 -4,-2.4 4,-2.7 -5,-0.3 3,-1.1 0.960 107.2 48.2 -50.6 -57.9 39.9 -20.3 46.8 8 151 A Q H 3X S+ 0 0 24 -4,-2.7 4,-2.0 1,-0.3 -1,-0.3 0.755 109.8 56.7 -54.4 -25.0 36.4 -19.0 46.6 9 152 A R H S+ 0 0 39 -4,-2.0 4,-2.9 1,-0.2 5,-0.7 0.918 107.9 50.4 -54.7 -41.5 35.5 -13.0 45.9 13 156 A A H <5S+ 0 0 61 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.795 111.1 46.8 -67.9 -32.1 38.4 -10.6 46.3 14 157 A L H <5S+ 0 0 4 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.865 117.2 44.8 -74.0 -41.4 39.2 -10.4 42.6 15 158 A I H <5S- 0 0 2 -4,-2.5 -2,-0.2 2,-0.2 -3,-0.2 0.921 96.4-135.7 -70.2 -48.3 35.6 -10.0 41.7 16 159 A G T <5S+ 0 0 46 -4,-2.9 2,-0.3 1,-0.4 -3,-0.2 0.520 77.7 67.6 97.2 9.1 34.6 -7.4 44.3 17 160 A Y S - 0 0 58 -2,-0.3 3,-1.6 1,-0.1 467,-0.1 -0.873 17.4-176.0-118.7 104.3 30.2 -12.6 46.6 19 162 A V T 3 S+ 0 0 16 -2,-0.6 -1,-0.1 1,-0.3 15,-0.1 0.401 88.8 60.3 -74.7 3.8 28.5 -15.1 44.2 20 163 A T T 3 S+ 0 0 69 -12,-0.1 -1,-0.3 11,-0.0 2,-0.1 0.377 85.5 105.4-107.1 -1.7 27.8 -17.3 47.3 21 164 A D < + 0 0 48 -3,-1.6 -4,-0.0 1,-0.1 0, 0.0 -0.464 42.3 177.2 -77.1 149.7 25.7 -14.5 48.8 22 165 A V > + 0 0 110 -2,-0.1 3,-0.7 3,-0.1 -1,-0.1 0.051 45.2 113.6-143.6 24.9 21.9 -14.7 48.8 23 166 A S T 3 S+ 0 0 66 1,-0.2 268,-0.1 0, 0.0 -2,-0.0 0.763 84.1 37.2 -69.5 -29.1 21.0 -11.5 50.6 24 167 A N T 3 S+ 0 0 1 266,-0.0 263,-0.5 267,-0.0 2,-0.3 -0.375 96.4 97.8-125.4 56.4 19.3 -9.9 47.5 25 168 A V < - 0 0 54 -3,-0.7 3,-0.1 261,-0.1 -3,-0.1 -0.879 42.2-172.6-136.2 164.9 17.6 -12.7 45.7 26 169 A H S S+ 0 0 64 1,-0.4 2,-0.3 -2,-0.3 -1,-0.1 0.169 79.9 15.3-140.9 7.9 14.1 -14.2 45.5 27 170 A D S S- 0 0 37 0, 0.0 3,-0.4 0, 0.0 -1,-0.4 -0.951 84.5 -95.3-172.3 166.6 14.9 -17.3 43.4 28 171 A D S > S+ 0 0 68 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 -0.008 73.7 118.9 -89.5 34.7 17.9 -19.4 42.3 29 172 A E H > S+ 0 0 5 -2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.911 77.6 49.2 -63.5 -42.4 18.7 -18.0 38.8 30 173 A L H > S+ 0 0 25 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.928 114.4 43.6 -61.4 -47.9 22.2 -16.9 39.7 31 174 A E H > S+ 0 0 69 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.887 112.9 52.9 -64.3 -41.0 23.2 -20.2 41.3 32 175 A F H X S+ 0 0 61 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.906 111.3 48.6 -59.4 -42.1 21.6 -22.0 38.4 33 176 A T H X S+ 0 0 1 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.826 105.0 55.7 -70.6 -36.0 23.7 -19.8 36.1 34 177 A R H >X S+ 0 0 44 -4,-2.1 3,-0.9 2,-0.2 4,-0.7 0.988 113.8 42.4 -58.7 -53.7 27.0 -20.5 38.0 35 178 A R H >X S+ 0 0 178 -4,-2.2 3,-1.0 1,-0.2 4,-0.5 0.891 111.4 56.1 -57.6 -44.3 26.4 -24.2 37.4 36 179 A G H 3< S+ 0 0 20 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.756 102.7 54.5 -62.5 -25.1 25.3 -23.7 33.8 37 180 A L H S+ 0 0 12 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.906 113.8 46.2 -55.7 -44.0 31.0 -23.6 28.5 41 184 A R H >X S+ 0 0 8 -4,-2.3 4,-3.1 2,-0.2 3,-0.7 0.982 113.4 44.9 -61.1 -63.2 34.2 -22.9 30.4 42 185 A M H 3X S+ 0 0 74 -4,-2.5 4,-2.7 1,-0.3 5,-0.2 0.869 110.8 55.6 -52.7 -40.4 35.6 -26.3 30.6 43 186 A A H 3X S+ 0 0 62 -4,-2.8 4,-0.9 -5,-0.2 -1,-0.3 0.857 113.1 41.0 -62.1 -37.1 34.9 -26.9 26.9 44 187 A E H - 0 0 77 1,-0.1 4,-2.6 -2,-0.1 5,-0.3 -0.558 21.4-144.7 -69.6 112.2 46.2 -24.6 22.4 50 193 A P H > S+ 0 0 76 0, 0.0 4,-1.2 0, 0.0 -1,-0.1 0.778 94.9 48.2 -48.5 -35.7 48.4 -24.2 25.5 51 194 A K H > S+ 0 0 131 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.913 114.6 41.4 -74.5 -47.9 51.3 -22.7 23.6 52 195 A L H > S+ 0 0 72 -3,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.859 113.1 55.6 -70.1 -34.5 49.4 -20.0 21.7 53 196 A Y H < S+ 0 0 7 -4,-2.6 406,-0.3 2,-0.2 -1,-0.2 0.881 107.9 49.0 -64.7 -38.2 47.3 -19.2 24.7 54 197 A A H < S+ 0 0 6 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.916 120.0 36.4 -68.0 -40.7 50.4 -18.5 26.7 55 198 A M H < S- 0 0 2 -4,-1.7 68,-0.6 99,-0.1 -2,-0.2 0.522 84.9-163.0 -91.9 -5.6 51.9 -16.3 24.1 56 199 A H < - 0 0 19 -4,-1.5 -3,-0.1 1,-0.1 404,-0.1 0.712 13.1-153.4 26.9 49.7 48.6 -14.7 23.0 57 200 A P - 0 0 25 0, 0.0 2,-0.8 0, 0.0 67,-0.1 -0.160 8.0-135.2 -47.6 141.0 50.0 -13.4 19.7 58 201 A W + 0 0 70 65,-0.5 76,-2.5 -3,-0.1 77,-0.4 -0.834 40.9 158.2-107.1 98.7 48.0 -10.3 18.6 59 202 A V B -A 133 0A 33 -2,-0.8 365,-0.4 74,-0.2 2,-0.3 -0.793 26.7-157.4-121.1 161.0 47.3 -10.7 14.9 60 203 A T - 0 0 0 72,-2.3 -2,-0.0 -2,-0.3 363,-0.0 -0.963 14.6-153.6-135.5 150.5 44.8 -9.3 12.3 61 204 A S + 0 0 93 -2,-0.3 -1,-0.1 2,-0.1 71,-0.0 0.464 63.8 112.0-101.5 -5.5 43.6 -10.7 9.0 62 205 A K S S- 0 0 42 1,-0.1 -2,-0.1 70,-0.1 565,-0.0 -0.315 78.0 -98.7 -66.0 150.6 42.7 -7.3 7.6 63 206 A P - 0 0 104 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.299 40.5 -96.4 -69.8 156.4 44.9 -6.0 4.8 64 207 A L - 0 0 15 1,-0.1 5,-0.1 2,-0.0 4,-0.1 -0.636 50.8-113.4 -72.6 120.9 47.8 -3.6 5.4 65 208 A P >> - 0 0 14 0, 0.0 3,-1.7 0, 0.0 4,-1.3 -0.083 16.1-117.2 -56.5 155.5 46.3 -0.1 4.7 66 209 A E H 3> S+ 0 0 144 1,-0.3 4,-1.3 560,-0.2 3,-0.4 0.899 114.3 60.4 -58.7 -42.7 47.6 1.9 1.8 67 210 A Y H 34 S+ 0 0 61 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.488 106.9 47.9 -67.3 -1.2 48.9 4.7 4.1 68 211 A L H X4 S+ 0 0 6 -3,-1.7 3,-0.9 2,-0.1 -1,-0.2 0.667 100.9 60.9-108.1 -27.3 51.1 2.0 5.8 69 212 A W H >< S+ 0 0 89 -4,-1.3 3,-3.3 -3,-0.4 -2,-0.2 0.831 89.7 74.8 -67.3 -28.6 52.6 0.5 2.6 70 213 A K T 3< S+ 0 0 182 -4,-1.3 -1,-0.2 1,-0.3 3,-0.2 0.856 92.4 52.4 -50.7 -37.9 54.0 4.0 1.9 71 214 A K T < S+ 0 0 96 -3,-0.9 2,-0.3 1,-0.2 -1,-0.3 0.442 110.6 53.7 -79.1 0.8 56.6 3.3 4.6 72 215 A I < + 0 0 10 -3,-3.3 -1,-0.2 -4,-0.1 3,-0.2 -0.752 55.9 142.6-136.2 87.0 57.5 0.1 2.8 73 216 A A S S+ 0 0 96 -2,-0.3 -3,-0.1 -3,-0.2 -1,-0.1 -0.229 73.3 54.1-117.2 41.2 58.3 0.7 -0.9 74 217 A N S S- 0 0 87 2,-0.2 -1,-0.1 0, 0.0 3,-0.1 0.201 105.6-116.3-153.1 5.4 61.0 -1.9 -1.0 75 218 A N S S+ 0 0 80 1,-0.2 2,-0.4 -3,-0.2 20,-0.2 0.779 81.9 112.9 55.5 28.6 59.2 -5.0 0.2 76 219 A C - 0 0 44 17,-0.2 2,-0.4 18,-0.1 17,-0.3 -0.993 46.4-169.5-135.3 141.5 61.6 -5.0 3.2 77 220 A I E -B 92 0B 18 15,-3.9 15,-3.0 -2,-0.4 2,-0.6 -0.991 19.6-131.5-130.7 136.4 61.2 -4.4 6.9 78 221 A F E -B 91 0B 123 -2,-0.4 68,-0.9 13,-0.2 2,-0.5 -0.780 20.2-174.2 -96.7 118.2 63.8 -4.0 9.5 79 222 A I E -c 146 0C 12 11,-1.6 2,-0.9 -2,-0.6 11,-0.4 -0.930 17.1-144.5-109.1 125.6 63.6 -6.0 12.7 80 223 A V E -c 147 0C 16 66,-4.1 68,-3.3 -2,-0.5 2,-0.5 -0.780 17.4-162.5 -95.0 103.7 66.1 -5.3 15.5 81 224 A I E -c 148 0C 11 -2,-0.9 7,-1.6 66,-0.2 2,-0.3 -0.749 8.9-168.4 -89.7 126.1 67.0 -8.5 17.2 82 225 A H E +cD 149 87C 37 66,-2.1 68,-2.3 -2,-0.5 5,-0.2 -0.782 24.1 169.8-114.5 157.8 68.6 -8.3 20.7 83 226 A R E > S- D 0 86C 127 3,-0.9 3,-0.9 -2,-0.3 2,-0.7 -0.417 70.4 -61.4-166.2 75.6 70.3 -10.7 23.0 84 227 A S T 3 S- 0 0 115 1,-0.2 -1,-0.1 2,-0.1 0, 0.0 -0.732 123.3 -4.7 84.8-111.1 72.0 -8.9 25.9 85 228 A T T 3 S+ 0 0 141 -2,-0.7 -1,-0.2 -3,-0.1 2,-0.1 0.543 121.0 90.2 -91.0 -9.9 74.7 -6.5 24.6 86 229 A T E < +D 83 0C 75 -3,-0.9 -3,-0.9 1,-0.0 -2,-0.1 -0.296 45.8 169.1 -81.6 170.3 74.1 -7.8 21.0 87 230 A S E -D 82 0C 67 -5,-0.2 -5,-0.2 -4,-0.1 62,-0.0 -0.274 5.4-179.7 176.0 88.0 71.7 -6.3 18.5 88 231 A Q - 0 0 74 -7,-1.6 -7,-0.0 -2,-0.0 0, 0.0 0.086 23.9-134.9 -79.2-162.9 71.6 -7.2 14.8 89 232 A T - 0 0 75 -9,-0.2 -9,-0.2 2,-0.0 2,-0.2 -0.237 20.4-168.1-156.6 57.9 69.2 -5.8 12.2 90 233 A I - 0 0 5 -11,-0.4 -11,-1.6 -12,-0.1 2,-0.2 -0.303 19.6-132.9 -55.7 118.0 67.9 -8.6 10.0 91 234 A K E -B 78 0B 135 -13,-0.2 2,-0.3 -2,-0.2 -13,-0.2 -0.530 32.1-171.0 -72.6 137.1 66.1 -7.3 6.9 92 235 A V E -B 77 0B 2 -15,-3.0 -15,-3.9 -2,-0.2 9,-0.1 -0.881 22.9-124.9-132.8 163.1 62.7 -9.0 6.4 93 236 A S > - 0 0 32 -2,-0.3 3,-3.2 -17,-0.3 37,-0.3 -0.892 28.4-120.2-108.0 137.4 59.9 -9.3 3.9 94 237 A P T 3 S+ 0 0 1 0, 0.0 37,-1.5 0, 0.0 38,-0.2 0.606 113.8 47.9 -48.0 -21.4 56.2 -8.5 4.9 95 238 A D T 3 S+ 0 0 97 -20,-0.2 2,-0.7 34,-0.2 -20,-0.0 0.218 82.0 121.9-108.0 13.4 55.1 -12.0 4.0 96 239 A D < - 0 0 52 -3,-3.2 34,-1.0 1,-0.0 35,-0.1 -0.671 63.4-131.8 -80.3 118.1 57.9 -13.6 5.9 97 240 A T > - 0 0 40 -2,-0.7 3,-0.9 32,-0.2 30,-0.1 -0.355 20.4-118.0 -63.4 149.8 56.5 -15.9 8.5 98 241 A P G >> S+ 0 0 3 0, 0.0 3,-1.6 0, 0.0 4,-1.4 0.983 113.7 50.9 -53.0 -69.5 58.1 -15.4 11.9 99 242 A G G 34 S+ 0 0 43 1,-0.3 4,-0.2 27,-0.2 -2,-0.1 0.616 106.9 62.7 -47.1 -11.9 59.6 -18.8 12.4 100 243 A A G <4 S+ 0 0 51 -3,-0.9 -1,-0.3 2,-0.2 -3,-0.1 -0.157 103.3 43.3-107.9 33.1 61.0 -18.2 8.9 101 244 A I T <4 S+ 0 0 10 -3,-1.6 -2,-0.2 -5,-0.1 -1,-0.1 0.257 103.2 62.0-145.3 -22.3 63.2 -15.2 9.8 102 245 A L S >X S+ 0 0 19 -4,-1.4 4,-3.4 1,-0.2 3,-0.5 0.768 108.7 48.9 -74.5 -23.9 64.5 -16.7 13.0 103 246 A Q H 3> S+ 0 0 82 -5,-0.4 4,-0.6 2,-0.2 5,-0.5 0.765 104.4 53.8 -80.4 -30.8 65.8 -19.1 10.3 104 247 A S H 34 S+ 0 0 41 3,-0.1 -1,-0.2 2,-0.1 -2,-0.2 0.190 121.8 37.3 -86.4 17.7 67.0 -16.1 8.3 105 248 A F H <> S+ 0 0 21 -3,-0.5 4,-1.1 3,-0.1 -2,-0.2 0.537 112.2 46.2-125.2 -77.1 68.8 -15.4 11.6 106 249 A F H >< S+ 0 0 53 -4,-3.4 3,-0.9 1,-0.3 -3,-0.2 0.899 128.2 32.6 -37.5 -58.5 70.0 -18.5 13.5 107 250 A T T 3< S+ 0 0 116 -4,-0.6 -1,-0.3 -5,-0.3 -3,-0.1 0.866 112.0 62.4 -69.4 -36.8 71.5 -19.8 10.2 108 251 A K T 34 0 0 117 -5,-0.5 -1,-0.2 -6,-0.2 -2,-0.2 0.584 360.0 360.0 -65.0 -4.7 72.2 -16.2 9.0 109 252 A M << 0 0 137 -4,-1.1 -3,-0.2 -3,-0.9 -2,-0.2 0.207 360.0 360.0-150.3 360.0 74.5 -16.3 12.1 110 ! 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 0.0 111 268 A Q 0 0 149 0, 0.0 2,-1.2 0, 0.0 -9,-0.0 0.000 360.0 360.0 360.0 -2.2 66.5 -23.2 18.2 112 269 A D + 0 0 128 2,-0.0 2,-0.2 40,-0.0 0, 0.0 -0.339 360.0 110.7 -96.3 57.7 64.2 -23.4 21.1 113 270 A F - 0 0 71 -2,-1.2 2,-0.3 39,-0.1 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-68,-0.6 2,-0.8 -2,-0.4 -65,-0.5 -0.876 16.9-148.7-116.1 144.3 55.2 -12.1 21.2 124 281 A L + 0 0 7 -9,-2.8 -9,-0.5 -2,-0.4 2,-0.2 -0.721 56.2 112.4-106.9 79.9 55.6 -12.5 17.5 125 282 A V + 0 0 18 -2,-0.8 -11,-0.0 -70,-0.1 -2,-0.0 -0.697 26.1 72.4-135.0-171.7 54.8 -16.1 16.8 126 283 A G S S- 0 0 27 -2,-0.2 2,-2.0 1,-0.1 -27,-0.2 0.209 96.2 -54.3 78.4 155.6 52.3 -18.4 15.2 127 284 A E S S+ 0 0 164 -30,-0.1 -1,-0.1 -29,-0.1 -30,-0.1 -0.409 93.8 123.2 -68.1 84.9 51.8 -19.0 11.4 128 285 A T - 0 0 25 -2,-2.0 5,-0.1 -32,-0.1 -33,-0.0 -0.991 67.8-107.2-150.6 137.7 51.3 -15.4 10.5 129 286 A P > - 0 0 42 0, 0.0 3,-1.5 0, 0.0 -32,-0.2 -0.312 33.2-127.3 -56.7 142.4 52.9 -12.8 8.2 130 287 A I G > S+ 0 0 8 -34,-1.0 3,-1.6 -37,-0.3 6,-0.2 0.836 110.1 62.7 -64.8 -26.7 54.8 -10.3 10.3 131 288 A K G 3 S+ 0 0 37 -37,-1.5 -1,-0.3 1,-0.3 -36,-0.1 0.664 96.5 61.0 -70.5 -12.9 52.9 -7.5 8.5 132 289 A N G < S+ 0 0 23 -3,-1.5 -72,-2.3 -38,-0.2 2,-0.4 0.367 80.9 101.6 -94.0 4.0 49.8 -9.0 10.1 133 290 A F B <> 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3< S+ 0 0 10 -4,-1.7 -1,-0.3 1,-0.3 34,-0.2 0.558 90.1 65.9 -61.6 -9.9 13.7 -13.2 5.3 354 584 A K T < S+ 0 0 110 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.474 93.2 65.3 -92.5 -0.2 15.8 -12.7 2.1 355 585 A H X - 0 0 57 -3,-2.1 3,-2.1 1,-0.1 4,-0.4 -0.931 65.0-162.2-126.9 103.7 17.1 -9.4 3.3 356 586 A P G > S+ 0 0 30 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.851 92.6 59.5 -50.9 -38.9 19.4 -9.6 6.4 357 587 A K G 3 S+ 0 0 126 1,-0.3 4,-0.4 2,-0.1 -2,-0.0 0.655 97.8 63.1 -67.7 -11.3 19.0 -5.8 7.0 358 588 A A G <> S+ 0 0 0 -3,-2.1 4,-3.1 -6,-0.3 -1,-0.3 0.637 78.8 88.2 -86.6 -15.3 15.3 -6.5 7.3 359 589 A Y H <> S+ 0 0 0 -3,-1.5 4,-2.2 -4,-0.4 5,-0.2 0.868 85.1 47.5 -53.1 -48.2 15.6 -8.7 10.3 360 590 A P H > S+ 0 0 8 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.963 117.3 43.3 -60.2 -49.0 15.5 -6.1 13.1 361 591 A K H 4 S+ 0 0 17 -4,-0.4 4,-0.4 1,-0.2 3,-0.3 0.922 112.4 56.1 -59.7 -44.9 12.4 -4.4 11.5 362 592 A L H >< S+ 0 0 0 -4,-3.1 3,-0.9 1,-0.2 -1,-0.2 0.897 108.5 43.4 -54.0 -51.6 10.8 -7.8 10.9 363 593 A F H >< S+ 0 0 0 -4,-2.2 3,-0.8 1,-0.3 -1,-0.2 0.685 106.5 60.4 -72.6 -20.7 11.0 -9.1 14.5 364 594 A S T 3< S+ 0 0 35 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.572 101.6 59.0 -79.1 -8.3 9.8 -5.8 15.8 365 595 A S T < S+ 0 0 9 -3,-0.9 -1,-0.2 -4,-0.4 -2,-0.2 0.508 84.1 103.6 -95.5 -6.7 6.8 -6.7 13.6 366 596 A V S < S- 0 0 3 -3,-0.8 2,-1.4 -4,-0.1 3,-0.1 -0.535 74.2-130.9 -78.5 141.1 6.1 -9.9 15.5 367 597 A K > - 0 0 135 -2,-0.2 3,-1.8 1,-0.2 7,-0.4 -0.750 28.2-178.5 -91.3 87.4 3.2 -10.0 17.9 368 598 A W T 3 S+ 0 0 11 -2,-1.4 -1,-0.2 1,-0.3 6,-0.1 0.733 74.5 67.3 -62.4 -23.6 5.2 -11.6 20.8 369 599 A G T 3 S+ 0 0 17 -3,-0.1 2,-0.5 1,-0.1 -1,-0.3 0.339 87.7 79.6 -79.2 7.6 2.1 -11.6 23.0 370 600 A Q <> - 0 0 81 -3,-1.8 4,-2.3 1,-0.2 3,-0.5 -0.925 66.7-155.4-120.6 110.2 0.4 -14.3 20.7 371 601 A Q H > S+ 0 0 79 -2,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.874 94.3 49.8 -44.7 -52.0 1.5 -17.9 21.1 372 602 A E H > S+ 0 0 136 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.866 111.2 47.9 -57.8 -43.4 0.6 -18.9 17.5 373 603 A I H > S+ 0 0 19 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.946 111.7 48.2 -65.6 -49.1 2.4 -16.0 15.9 374 604 A V H X S+ 0 0 16 -4,-2.3 4,-2.4 -7,-0.4 5,-0.2 0.922 109.4 56.5 -55.6 -43.3 5.6 -16.5 17.9 375 605 A A H X S+ 0 0 42 -4,-2.4 4,-1.7 -5,-0.3 -1,-0.2 0.940 106.8 47.5 -53.5 -49.8 5.3 -20.2 17.0 376 606 A K H X S+ 0 0 65 -4,-2.1 4,-1.8 1,-0.2 -1,-0.3 0.820 107.2 59.3 -62.4 -31.1 5.3 -19.1 13.3 377 607 A T H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 5,-0.2 0.953 104.4 47.6 -62.8 -53.1 8.3 -16.9 14.0 378 608 A Y H X S+ 0 0 69 -4,-2.4 4,-1.1 1,-0.3 -1,-0.2 0.887 109.2 54.7 -56.2 -39.0 10.4 -19.9 15.1 379 609 A Q H X S+ 0 0 82 -4,-1.7 4,-0.9 -5,-0.2 3,-0.4 0.911 107.6 51.8 -59.6 -40.4 9.3 -21.8 12.1 380 610 A L H >< S+ 0 0 2 -4,-1.8 3,-0.8 1,-0.2 -2,-0.2 0.933 107.6 49.0 -60.6 -49.8 10.6 -18.8 10.1 381 611 A L H 3< S+ 0 0 5 -4,-2.4 3,-0.3 1,-0.2 -1,-0.2 0.668 96.7 75.6 -66.4 -15.0 14.0 -18.9 11.8 382 612 A A H 3< S+ 0 0 58 -4,-1.1 2,-1.4 -3,-0.4 -1,-0.2 0.928 94.4 48.9 -61.7 -46.2 14.1 -22.6 11.1 383 613 A R S << S+ 0 0 155 -4,-0.9 -1,-0.3 -3,-0.8 3,-0.3 -0.678 71.6 146.5 -95.1 79.1 14.9 -21.9 7.4 384 614 A R >> + 0 0 66 -2,-1.4 4,-2.3 -3,-0.3 3,-0.6 0.249 18.6 127.3-100.3 10.9 17.6 -19.5 8.1 385 615 A E H 3> S+ 0 0 115 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.826 73.6 48.3 -34.0 -56.8 19.7 -20.4 5.1 386 616 A V H 3> S+ 0 0 57 -3,-0.3 4,-0.6 1,-0.2 -1,-0.2 0.911 114.5 45.0 -54.8 -49.5 20.0 -16.8 3.8 387 617 A W H X4 S+ 0 0 3 -3,-0.6 3,-1.6 1,-0.2 -2,-0.2 0.954 110.8 52.3 -60.2 -53.8 21.0 -15.3 7.2 388 618 A D H 3< S+ 0 0 72 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.781 114.7 44.3 -56.9 -27.2 23.5 -18.1 8.0 389 619 A Q H 3< S+ 0 0 160 -4,-1.6 -1,-0.3 -5,-0.4 -2,-0.2 0.503 89.2 114.4 -97.2 -3.7 25.2 -17.4 4.7 390 620 A S S << S- 0 0 26 -3,-1.6 2,-0.2 -4,-0.6 3,-0.1 -0.324 79.4 -99.2 -67.9 148.6 25.2 -13.6 4.9 391 621 A A - 0 0 92 1,-0.1 -1,-0.1 -2,-0.0 -2,-0.1 -0.497 55.1 -94.0 -64.7 132.1 28.4 -11.6 5.1 392 622 A L - 0 0 59 -2,-0.2 2,-0.5 28,-0.1 -1,-0.1 -0.288 43.2-172.0 -55.7 125.0 28.9 -10.7 8.8 393 623 A D > - 0 0 66 1,-0.1 4,-2.7 -3,-0.1 5,-0.2 -0.931 9.7-169.2-124.0 102.1 27.5 -7.3 9.6 394 624 A V H > S+ 0 0 20 -2,-0.5 4,-2.8 1,-0.2 5,-0.2 0.881 88.1 56.0 -59.7 -39.3 28.4 -6.2 13.1 395 625 A G H > S+ 0 0 2 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.925 111.6 42.4 -59.5 -43.1 26.0 -3.3 13.0 396 626 A L H > S+ 0 0 9 2,-0.2 4,-1.2 1,-0.2 3,-0.3 0.934 113.2 52.9 -67.8 -46.5 23.1 -5.6 12.1 397 627 A T H >< S+ 0 0 1 -4,-2.7 3,-0.7 1,-0.2 4,-0.3 0.930 107.4 51.6 -55.4 -48.8 24.2 -8.1 14.7 398 628 A M H >X S+ 0 0 1 -4,-2.8 3,-1.3 1,-0.2 4,-0.6 0.821 101.9 60.9 -58.5 -35.1 24.3 -5.5 17.5 399 629 A Q H >< S+ 0 0 14 -4,-1.3 3,-0.8 1,-0.3 5,-0.3 0.869 101.8 52.4 -62.5 -35.1 20.8 -4.3 16.7 400 630 A L T << S+ 0 0 0 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.492 108.6 52.9 -79.0 -2.7 19.4 -7.8 17.5 401 631 A L T <4 S+ 0 0 0 -3,-1.3 -1,-0.2 -4,-0.3 -2,-0.2 0.517 92.1 94.0-106.9 -5.9 21.2 -7.6 20.8 402 632 A D S X< S- 0 0 10 -3,-0.8 3,-1.4 -4,-0.6 -3,-0.0 0.059 97.6 -76.4 -76.8-171.9 19.8 -4.3 22.0 403 633 A C T 3 S+ 0 0 7 1,-0.2 -1,-0.1 3,-0.0 -3,-0.1 0.552 118.7 71.1 -65.1 -8.4 16.8 -3.5 24.2 404 634 A N T 3 S+ 0 0 76 -5,-0.3 2,-0.5 1,-0.1 -1,-0.2 0.681 90.6 62.8 -85.7 -12.3 14.3 -4.1 21.5 405 635 A F < + 0 0 12 -3,-1.4 -207,-0.1 -6,-0.2 -1,-0.1 -0.938 44.5 159.3-118.2 122.1 14.7 -7.9 21.3 406 636 A S + 0 0 19 -2,-0.5 2,-0.5 34,-0.1 -1,-0.1 0.418 43.4 109.6-115.5 -4.2 13.9 -10.1 24.2 407 637 A D > - 0 0 1 1,-0.1 4,-2.5 -210,-0.1 5,-0.3 -0.636 61.0-145.4 -82.2 126.3 13.5 -13.3 22.4 408 638 A E H > S+ 0 0 62 -2,-0.5 4,-1.8 -175,-0.3 -1,-0.1 0.822 98.3 47.2 -54.5 -37.8 16.2 -15.9 23.0 409 639 A N H > S+ 0 0 62 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.871 112.1 49.7 -76.2 -35.4 16.1 -17.4 19.5 410 640 A V H >> S+ 0 0 0 1,-0.2 4,-0.9 2,-0.2 3,-0.5 0.970 114.9 44.2 -63.7 -52.9 16.2 -14.0 17.8 411 641 A R H 3X S+ 0 0 4 -4,-2.5 4,-2.2 1,-0.2 3,-0.2 0.816 107.1 61.6 -60.3 -35.5 19.2 -12.9 20.0 412 642 A A H 3X S+ 0 0 38 -4,-1.8 4,-2.9 -5,-0.3 -1,-0.2 0.845 98.3 54.2 -63.3 -37.0 21.0 -16.2 19.5 413 643 A I H X S+ 0 0 0 -4,-0.9 4,-1.4 2,-0.2 3,-0.9 0.989 110.8 43.3 -64.5 -56.2 22.9 -12.5 16.5 415 645 A V H 3X S+ 0 0 6 -4,-2.2 4,-1.9 1,-0.3 -2,-0.2 0.872 106.1 63.0 -55.4 -38.5 25.4 -14.3 18.6 416 646 A Q H 3< S+ 0 0 60 -4,-2.9 4,-0.4 1,-0.2 -1,-0.3 0.904 103.8 48.8 -52.1 -43.2 25.7 -17.0 16.0 417 647 A K H X< S+ 0 0 14 -4,-1.6 3,-1.0 -3,-0.9 -1,-0.2 0.831 104.9 57.6 -67.1 -34.8 27.1 -14.2 13.7 418 648 A L H >< S+ 0 0 2 -4,-1.4 3,-3.0 1,-0.2 -1,-0.2 0.873 88.5 76.5 -64.2 -38.1 29.5 -13.0 16.2 419 649 A E T 3< S+ 0 0 73 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.784 88.9 59.4 -43.0 -33.1 31.1 -16.4 16.4 420 650 A S T < S+ 0 0 83 -3,-1.0 2,-0.3 -4,-0.4 -1,-0.3 0.328 80.0 111.3 -85.9 11.3 32.8 -15.7 13.1 421 651 A L < - 0 0 9 -3,-3.0 2,-0.1 2,-0.0 -3,-0.0 -0.644 67.7-125.9 -84.8 139.3 34.7 -12.6 14.4 422 652 A E >> - 0 0 49 -2,-0.3 4,-1.8 1,-0.1 3,-1.6 -0.504 31.6-103.7 -79.2 156.0 38.5 -12.8 14.7 423 653 A D H 3> S+ 0 0 47 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.823 120.5 61.3 -46.2 -40.0 39.9 -11.9 18.1 424 654 A D H 3> S+ 0 0 6 -365,-0.4 4,-1.0 1,-0.2 -1,-0.3 0.866 108.4 43.1 -58.4 -37.2 41.1 -8.5 16.7 425 655 A D H <> S+ 0 0 40 -3,-1.6 4,-1.4 2,-0.2 -1,-0.2 0.827 106.8 59.3 -78.7 -31.7 37.5 -7.6 16.0 426 656 A V H X S+ 0 0 0 -4,-1.8 4,-1.1 1,-0.2 3,-0.3 0.915 104.4 52.8 -63.1 -35.7 36.2 -9.0 19.2 427 657 A L H < S+ 0 0 24 -4,-2.1 4,-0.4 1,-0.2 3,-0.3 0.869 102.7 58.2 -64.6 -37.2 38.5 -6.5 21.0 428 658 A H H < S+ 0 0 37 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.855 121.2 25.7 -59.7 -38.2 37.1 -3.7 18.9 429 659 A Y H X S+ 0 0 16 -4,-1.4 4,-2.5 -3,-0.3 5,-0.3 0.346 88.8 108.5-109.5 4.3 33.5 -4.4 20.2 430 660 A L H X S+ 0 0 2 -4,-1.1 4,-2.6 -3,-0.3 5,-0.2 0.864 79.6 48.5 -51.7 -47.6 34.2 -6.0 23.5 431 661 A L H > S+ 0 0 4 -4,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.945 114.8 46.2 -59.1 -47.5 33.1 -3.1 25.8 432 662 A Q H > S+ 0 0 1 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.831 112.7 49.9 -66.0 -34.2 29.8 -2.7 23.8 433 663 A L H X S+ 0 0 0 -4,-2.5 4,-0.8 2,-0.2 -1,-0.2 0.914 110.9 50.2 -71.5 -39.5 29.1 -6.5 23.8 434 664 A V H >< S+ 0 0 0 -4,-2.6 3,-1.3 -5,-0.3 4,-0.3 0.946 110.0 49.6 -62.3 -45.7 29.7 -6.6 27.5 435 665 A Q H >< S+ 0 0 5 -4,-2.6 3,-2.3 1,-0.3 4,-0.2 0.891 101.2 64.4 -60.2 -37.5 27.3 -3.7 28.0 436 666 A A H >< S+ 0 0 0 -4,-1.8 3,-2.7 1,-0.3 4,-0.4 0.752 81.3 79.3 -58.3 -24.6 24.7 -5.5 25.9 437 667 A V G X< S+ 0 0 0 -3,-1.3 3,-1.2 -4,-0.8 -1,-0.3 0.795 82.9 66.8 -54.6 -24.4 24.6 -8.3 28.5 438 668 A K G < S+ 0 0 4 -3,-2.3 -1,-0.3 -4,-0.3 -2,-0.2 0.735 94.8 56.3 -69.7 -19.5 22.3 -5.8 30.4 439 669 A F G < S+ 0 0 9 -3,-2.7 -1,-0.3 -4,-0.2 -2,-0.2 0.498 83.6 105.7 -90.6 -4.2 19.7 -6.2 27.7 440 670 A E < - 0 0 15 -3,-1.2 -34,-0.1 -4,-0.4 5,-0.1 -0.493 65.2-145.9 -74.3 138.2 19.6 -10.0 28.2 441 671 A P S S+ 0 0 14 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.829 82.2 40.8 -77.2 -22.6 16.5 -11.2 30.0 442 672 A Y S S- 0 0 9 2,-0.1 -184,-0.0 1,-0.1 -2,-0.0 -0.939 79.4-125.7-125.1 147.4 18.2 -14.0 31.8 443 673 A H S S+ 0 0 16 -2,-0.4 2,-0.4 5,-0.0 -1,-0.1 0.912 101.3 57.6 -51.7 -53.2 21.7 -14.2 33.5 444 674 A D S S+ 0 0 30 -415,-0.1 2,-0.3 4,-0.1 -2,-0.1 -0.690 79.2 152.7 -80.8 133.4 22.8 -17.2 31.5 445 675 A S > - 0 0 13 -2,-0.4 4,-2.9 1,-0.1 5,-0.3 -0.991 60.4-108.0-160.4 157.7 22.7 -16.3 27.8 446 676 A A H > S+ 0 0 48 -2,-0.3 4,-1.5 1,-0.2 -1,-0.1 0.865 122.1 50.0 -55.7 -37.3 24.2 -17.1 24.5 447 677 A L H > S+ 0 0 0 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.848 109.5 49.6 -71.4 -36.2 25.9 -13.7 24.6 448 678 A A H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.902 112.5 48.4 -69.7 -38.6 27.2 -14.2 28.1 449 679 A R H X S+ 0 0 83 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.799 107.0 56.4 -72.4 -25.7 28.6 -17.6 27.0 450 680 A F H X S+ 0 0 1 -4,-1.5 4,-2.4 -5,-0.3 -1,-0.2 0.866 106.7 48.7 -71.3 -32.9 30.1 -16.0 23.9 451 681 A L H X S+ 0 0 3 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.809 111.4 51.7 -73.8 -32.4 32.1 -13.6 26.1 452 682 A L H X S+ 0 0 2 -4,-1.6 4,-3.0 2,-0.2 5,-0.3 0.973 110.8 46.9 -66.2 -55.0 33.2 -16.5 28.2 453 683 A K H X S+ 0 0 72 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.972 116.8 42.7 -50.7 -60.5 34.4 -18.5 25.2 454 684 A R H X S+ 0 0 8 -4,-2.4 4,-0.9 1,-0.2 8,-0.3 0.826 114.5 50.7 -60.6 -31.6 36.3 -15.6 23.7 455 685 A G H >< S+ 0 0 0 -4,-1.9 3,-0.6 1,-0.2 7,-0.5 0.930 112.8 44.8 -71.8 -44.1 37.7 -14.5 27.0 456 686 A L H 3< S+ 0 0 0 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.768 110.8 57.0 -70.1 -22.8 39.0 -17.9 27.9 457 687 A R H 3< S+ 0 0 89 -4,-1.9 2,-0.3 -5,-0.3 -1,-0.2 0.662 113.6 31.4 -83.1 -19.0 40.4 -18.4 24.3 458 688 A N S+ 0 0 35 -2,-0.3 4,-2.1 -406,-0.3 5,-0.2 0.854 99.4 53.4 -61.4 -40.0 44.5 -13.7 27.1 460 690 A R H > S+ 0 0 37 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.921 113.4 42.6 -64.8 -43.9 44.2 -10.1 25.8 461 691 A I H > S+ 0 0 1 -7,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.908 113.6 53.2 -68.6 -39.7 40.4 -10.4 25.4 462 692 A G H X S+ 0 0 0 -4,-2.4 4,-1.7 -7,-0.5 -2,-0.2 0.845 106.9 53.1 -63.0 -33.4 40.2 -12.2 28.8 463 693 A H H X S+ 0 0 8 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.952 113.4 40.2 -65.1 -53.2 42.1 -9.3 30.5 464 694 A F H X S+ 0 0 26 -4,-1.7 4,-3.0 2,-0.2 5,-0.2 0.849 110.9 58.2 -67.9 -33.7 39.9 -6.6 29.3 465 695 A L H X S+ 0 0 1 -4,-2.3 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0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 741 981 A E 0 0 155 0, 0.0 2,-0.2 0, 0.0 104,-0.0 0.000 360.0 360.0 360.0 154.6 25.7 30.2 21.6 742 982 A R - 0 0 198 0, 0.0 100,-0.1 0, 0.0 3,-0.1 -0.809 360.0-154.9-133.4 171.8 27.1 26.9 20.2 743 983 A V - 0 0 18 -2,-0.2 -28,-0.1 1,-0.1 3,-0.1 -0.989 24.5-129.7-147.6 141.7 29.6 25.5 17.8 744 984 A P S S- 0 0 18 0, 0.0 -30,-0.3 0, 0.0 2,-0.3 0.841 86.3 -27.4 -61.5 -35.2 29.7 22.0 16.0 745 985 A F S S- 0 0 1 86,-0.2 2,-0.7 -31,-0.2 -30,-0.1 -0.908 79.7 -73.6-161.8-173.8 33.2 21.4 17.1 746 986 A V + 0 0 10 -2,-0.3 2,-0.1 -42,-0.1 -38,-0.1 -0.866 57.2 138.6-105.8 109.2 36.4 23.2 18.1 747 987 A L + 0 0 3 -2,-0.7 92,-0.1 92,-0.1 -1,-0.1 -0.648 32.7 174.7-142.7 72.1 38.3 24.8 15.2 748 988 A T >> - 0 0 10 -2,-0.1 4,-2.2 1,-0.1 3,-0.8 -0.282 47.6 -91.1 -83.3 168.6 39.4 28.1 16.7 749 989 A P H 3> S+ 0 0 15 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.866 123.8 55.8 -43.4 -49.6 41.7 30.8 15.2 750 990 A D H 3> S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -73,-0.2 0.897 107.3 48.9 -54.4 -43.8 44.8 29.3 16.7 751 991 A F H <> S+ 0 0 0 -3,-0.8 4,-1.3 1,-0.2 3,-0.5 0.958 113.0 48.1 -61.4 -47.5 44.2 26.0 15.0 752 992 A L H X>S+ 0 0 8 -4,-2.2 5,-1.2 1,-0.2 4,-0.6 0.903 105.0 58.8 -57.3 -44.3 43.6 27.8 11.8 753 993 A F H ><5S+ 0 0 54 -4,-3.1 3,-0.9 1,-0.3 -1,-0.2 0.853 104.0 52.0 -54.2 -37.6 46.8 29.8 12.3 754 994 A V H 3<5S+ 0 0 7 -4,-1.6 -1,-0.3 -3,-0.5 -2,-0.2 0.854 105.8 54.7 -67.6 -33.3 48.7 26.5 12.4 755 995 A M H 3<5S- 0 0 2 -4,-1.3 11,-0.6 -3,-0.5 10,-0.4 0.561 117.6-120.1 -75.9 -8.2 47.0 25.7 9.1 756 996 A G T <<5S+ 0 0 55 -3,-0.9 -3,-0.2 -4,-0.6 6,-0.1 0.377 79.8 96.3 88.1 -5.7 48.4 28.9 7.7 757 997 A T < + 0 0 9 -5,-1.2 -1,-0.2 6,-0.1 2,-0.2 0.182 46.4 168.2 -92.3-142.1 45.1 30.7 6.8 758 998 A S + 0 0 49 -3,-0.1 4,-0.2 -2,-0.0 -8,-0.0 -0.544 49.9 40.0 137.2 154.7 43.2 33.4 9.0 759 999 A G S S- 0 0 46 -2,-0.2 77,-0.0 1,-0.1 3,-0.0 0.879 128.8 -54.7 46.8 50.6 40.6 35.9 9.1 760 1000 A K S S+ 0 0 113 76,-0.1 -1,-0.1 1,-0.1 2,-0.1 0.953 108.5 110.7 48.7 84.2 38.4 33.7 6.9 761 1001 A K - 0 0 136 2,-0.0 2,-0.3 0, 0.0 -2,-0.1 -0.113 57.1 -99.8-144.5-118.1 40.7 33.0 3.9 762 1002 A T + 0 0 74 -4,-0.2 3,-0.1 -6,-0.1 0, 0.0 -0.979 24.9 175.5-170.8 179.1 42.5 29.9 2.6 763 1003 A S > - 0 0 17 -2,-0.3 4,-2.1 1,-0.1 5,-0.3 -0.804 49.6 -95.0 169.9 152.2 45.7 27.9 2.2 764 1004 A P H > S+ 0 0 112 0, 0.0 4,-0.8 0, 0.0 3,-0.2 0.890 124.6 46.5 -39.8 -47.8 46.9 24.5 0.8 765 1005 A H H >> S+ 0 0 37 -10,-0.4 4,-3.8 1,-0.3 3,-0.9 0.866 105.5 51.1 -68.0 -58.1 46.4 23.2 4.2 766 1006 A F H 3> S+ 0 0 4 -11,-0.6 4,-3.1 1,-0.3 -1,-0.3 0.821 114.8 49.1 -46.6 -35.2 43.1 24.4 5.3 767 1007 A Q H 3X S+ 0 0 99 -4,-2.1 4,-1.6 2,-0.2 -1,-0.3 0.758 109.8 49.8 -78.6 -27.5 42.0 22.9 2.0 768 1008 A K H < S+ 0 0 0 -4,-1.3 3,-1.9 -3,-0.4 -2,-0.2 0.853 104.1 60.6 -77.2 -34.2 31.5 7.3 8.6 781 1021 A R H >< S+ 0 0 31 -4,-1.5 3,-1.3 1,-0.3 -2,-0.2 0.723 92.0 69.7 -64.6 -18.0 28.2 7.7 6.8 782 1022 A H T 3< S+ 0 0 95 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.421 107.0 37.1 -78.1 2.4 29.0 4.4 5.0 783 1023 A H T <> S+ 0 0 64 -3,-1.9 4,-2.0 2,-0.1 3,-0.4 -0.033 75.6 140.2-140.1 25.9 28.4 2.8 8.4 784 1024 A T H <> S+ 0 0 20 -3,-1.3 4,-2.8 1,-0.2 5,-0.2 0.853 72.6 50.3 -40.5 -48.7 25.6 4.9 9.5 785 1025 A N H > S+ 0 0 53 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.919 107.5 51.0 -62.1 -46.2 23.8 1.9 11.0 786 1026 A L H > S+ 0 0 12 -3,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.939 115.5 43.1 -53.6 -53.0 26.7 0.6 13.1 787 1027 A L H X S+ 0 0 3 -4,-2.0 4,-3.5 -7,-0.2 5,-0.2 0.911 110.5 54.9 -61.4 -47.5 27.3 4.1 14.6 788 1028 A I H X S+ 0 0 0 -4,-2.8 4,-2.3 -5,-0.3 -1,-0.2 0.944 113.0 43.3 -52.9 -48.4 23.6 4.7 15.2 789 1029 A I H X S+ 0 0 5 -4,-2.5 4,-1.4 2,-0.2 -1,-0.2 0.871 114.8 48.3 -68.1 -36.2 23.4 1.5 17.2 790 1030 A L H X S+ 0 0 0 -4,-2.3 4,-2.9 -5,-0.2 3,-0.3 0.941 110.5 53.2 -67.7 -45.0 26.6 2.0 19.1 791 1031 A F H X S+ 0 0 11 -4,-3.5 4,-2.7 1,-0.2 -2,-0.2 0.957 111.2 44.5 -54.0 -55.0 25.5 5.6 19.9 792 1032 A S H X S+ 0 0 8 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.736 113.5 49.2 -66.9 -23.9 22.2 4.5 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803 1043 A T > - 0 0 34 -2,-0.6 2,-3.8 1,-0.1 5,-1.1 -0.823 34.8-130.8 -88.2 118.4 15.4 10.4 26.3 804 1044 A S T 5S+ 0 0 50 -2,-0.7 -1,-0.1 3,-0.1 2,-0.1 -0.010 97.7 29.0 -66.2 39.2 14.6 7.3 24.2 805 1045 A K T >5S+ 0 0 130 -2,-3.8 4,-2.5 0, 0.0 5,-0.2 -0.163 118.9 31.4-156.0-101.7 14.0 9.9 21.5 806 1046 A E H >5S+ 0 0 120 1,-0.2 4,-0.7 2,-0.2 -2,-0.1 0.823 119.3 49.3 -42.8 -49.8 15.6 13.3 21.1 807 1047 A D H >45S+ 0 0 61 -4,-0.4 3,-1.7 1,-0.2 4,-0.4 0.978 115.9 40.8 -57.2 -60.7 19.0 12.3 22.6 808 1048 A I H >4X S+ 0 0 76 -4,-2.5 4,-1.5 1,-0.2 3,-0.9 0.644 80.6 81.6 -66.5 -17.6 18.1 11.0 17.5 810 1050 A Y H S+ 0 0 2 -3,-0.7 4,-1.6 -4,-0.4 -1,-0.3 0.732 101.7 60.1 -59.5 -22.9 23.3 11.1 15.7 812 1052 A R H <4>S+ 0 0 52 -3,-0.9 5,-2.2 -4,-0.3 -1,-0.2 0.980 112.2 37.7 -65.6 -55.4 20.7 10.6 12.9 813 1053 A D H ><5S+ 0 0 107 -4,-1.5 3,-1.5 1,-0.2 -2,-0.2 0.888 115.6 53.5 -60.7 -45.2 20.8 14.4 12.1 814 1054 A A H 3<5S+ 0 0 1 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.842 109.7 47.9 -61.5 -34.1 24.6 14.5 12.7 815 1055 A L T 3<5S- 0 0 0 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.446 110.0-131.7 -85.1 0.8 25.1 11.7 10.2 816 1056 A T T < 5 - 0 0 18 -3,-1.5 -3,-0.2 1,-0.1 -2,-0.1 0.928 31.6-157.4 46.8 52.7 22.7 13.6 8.0 817 1057 A V < + 0 0 41 -5,-2.2 2,-1.0 1,-0.1 -1,-0.1 -0.206 62.9 19.3 -56.9 149.7 20.7 10.5 7.4 818 1058 A G S S+ 0 0 67 1,-0.2 -1,-0.1 -3,-0.1 -2,-0.0 -0.808 98.1 92.2 94.5-101.1 18.6 10.3 4.2 819 1059 A K S S- 0 0 149 -2,-1.0 -1,-0.2 1,-0.1 2,-0.2 0.612 78.3 -91.4 -14.6 178.7 20.2 13.0 2.0 820 1060 A N > - 0 0 62 -3,-0.1 4,-1.8 1,-0.1 5,-0.1 -0.560 30.2-100.6-109.0 174.2 22.9 12.3 -0.6 821 1061 A E H > S+ 0 0 97 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.883 120.4 52.8 -56.0 -40.5 26.7 12.3 -0.6 822 1062 A E H > S+ 0 0 137 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.935 111.9 43.6 -62.8 -47.6 26.8 15.7 -2.3 823 1063 A D H > S+ 0 0 60 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.747 112.5 56.4 -69.0 -23.1 24.5 17.4 0.2 824 1064 A A H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.959 108.0 44.3 -72.0 -53.0 26.4 15.6 3.0 825 1065 A K H X S+ 0 0 104 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.933 115.2 49.8 -57.2 -47.1 29.8 17.0 2.0 826 1066 A K H X S+ 0 0 125 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.953 108.3 55.1 -57.0 -47.8 28.2 20.4 1.5 827 1067 A Y H X S+ 0 0 73 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.855 109.3 44.2 -53.2 -45.2 26.6 20.1 5.0 828 1068 A F H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 3,-0.5 0.933 108.0 57.6 -69.0 -46.0 29.9 19.5 6.8 829 1069 A L H X S+ 0 0 34 -4,-2.2 4,-1.0 1,-0.3 -1,-0.2 0.811 105.9 52.4 -54.1 -30.7 31.8 22.2 5.0 830 1070 A D H X S+ 0 0 102 -4,-1.5 4,-2.1 2,-0.2 -1,-0.3 0.866 104.1 54.9 -73.5 -36.0 29.2 24.6 6.3 831 1071 A Q H X S+ 0 0 33 -4,-1.2 4,-1.4 -3,-0.5 -2,-0.2 0.919 105.0 54.2 -60.2 -42.6 29.7 23.4 9.8 832 1072 A I H X S+ 0 0 0 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.825 107.7 51.7 -59.5 -32.8 33.4 24.2 9.3 833 1073 A E H X S+ 0 0 70 -4,-1.0 4,-2.3 -5,-0.2 5,-0.2 0.894 101.2 58.4 -72.7 -40.4 32.3 27.7 8.4 834 1074 A V H X S+ 0 0 62 -4,-2.1 4,-1.3 1,-0.3 -1,-0.2 0.845 105.7 51.7 -57.6 -34.1 30.1 28.2 11.5 835 1075 A C H X S+ 0 0 4 -4,-1.4 4,-1.1 1,-0.2 -1,-0.3 0.886 108.5 52.0 -68.1 -38.7 33.3 27.6 13.5 836 1076 A R H < S+ 0 0 6 -4,-1.1 -2,-0.2 1,-0.2 3,-0.2 0.869 108.7 49.0 -65.6 -38.6 35.0 30.3 11.4 837 1077 A D H < S+ 0 0 118 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.780 111.2 51.6 -72.1 -27.2 32.3 32.8 12.0 838 1078 A K H >< S+ 0 0 16 -4,-1.3 3,-2.9 -5,-0.2 4,-0.3 0.684 76.3 167.7 -84.3 -20.5 32.4 32.1 15.8 839 1079 A G T 3< S- 0 0 17 -4,-1.1 4,-0.2 1,-0.3 -1,-0.2 -0.174 73.7 -18.9 47.5-109.5 36.1 32.6 16.2 840 1080 A W T 3> S+ 0 0 38 -92,-0.1 4,-2.7 1,-0.1 -1,-0.3 0.287 108.7 103.4-111.0 6.0 36.8 32.8 19.9 841 1081 A T H <> S+ 0 0 65 -3,-2.9 4,-2.4 2,-0.2 5,-0.1 0.945 85.2 39.2 -56.9 -55.4 33.3 33.6 21.0 842 1082 A V H > S+ 0 0 10 -4,-0.3 4,-0.7 2,-0.2 -1,-0.2 0.898 115.1 54.5 -63.3 -42.3 32.3 30.2 22.4 843 1083 A Q H >4 S+ 0 0 8 -4,-0.2 3,-1.5 1,-0.2 -1,-0.2 0.968 112.4 43.0 -54.2 -53.3 35.7 29.6 23.8 844 1084 A F H 3< S+ 0 0 105 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.862 104.7 63.8 -60.8 -40.8 35.6 32.8 25.8 845 1085 A N H 3< S+ 0 0 73 -4,-2.4 2,-2.2 -5,-0.2 -1,-0.3 0.676 74.1 96.9 -61.2 -12.8 32.0 32.2 26.8 846 1086 A W S << S+ 0 0 69 -3,-1.5 -1,-0.2 -4,-0.7 2,-0.2 -0.058 79.9 58.6 -74.3 44.3 33.2 29.2 28.8 847 1087 A F 0 0 87 -2,-2.2 -1,-0.1 -3,-0.1 0, 0.0 -0.717 360.0 360.0-170.7 118.6 33.3 31.3 32.0 848 1088 A L 0 0 200 -2,-0.2 -3,-0.0 0, 0.0 -2,-0.0 -0.627 360.0 360.0-153.3 360.0 30.5 33.3 33.6