==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 22-MAR-12 4ANX . COMPND 2 MOLECULE: PHOSPHATIDYLINOSITOL-4,5-BISPHOSPHATE 3-KINASE CA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.G.FOSTER,J.C.LOUGHEED . 833 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37366.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 572 68.7 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 . 107 12.8 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 . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 50 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 105 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 280 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.8 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 4 2 1 2 3 0 3 4 0 1 2 1 1 1 1 0 0 0 0 0 1 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 . 3 5 2 2 5 1 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 . 2 1 1 2 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 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 1 143 A S 0 0 138 0, 0.0 4,-0.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 96.4 34.3 -30.6 49.6 2 144 A S - 0 0 56 4,-0.0 4,-0.2 0, 0.0 0, 0.0 0.366 360.0-101.9 -83.2-149.1 38.0 -30.7 50.6 3 145 A E S S+ 0 0 150 2,-0.2 2,-0.3 3,-0.1 0, 0.0 -0.080 123.1 59.0-163.5 62.2 40.1 -27.7 51.9 4 146 A E S > S+ 0 0 120 0, 0.0 2,-4.9 0, 0.0 3,-1.1 0.360 99.9 52.5 55.4 172.1 41.5 -27.4 49.2 5 147 A S T 3> S+ 0 0 39 1,-0.3 4,-1.4 -2,-0.3 -2,-0.2 0.065 114.9 45.4 43.0 -51.1 38.2 -26.7 47.4 6 148 A Q H 3> S+ 0 0 94 -2,-4.9 4,-3.2 -4,-0.2 -1,-0.3 0.949 110.4 47.8 -76.9 -65.7 37.3 -24.0 49.9 7 149 A A H <> S+ 0 0 48 -3,-1.1 4,-1.5 2,-0.2 -2,-0.2 0.846 116.9 48.7 -47.4 -37.1 40.6 -22.0 50.1 8 150 A F H >> S+ 0 0 25 2,-0.2 4,-2.4 1,-0.2 3,-2.4 0.996 111.9 44.4 -61.6 -72.9 40.5 -22.1 46.3 9 151 A Q H 3X S+ 0 0 24 -4,-1.4 4,-2.1 1,-0.3 -2,-0.2 0.726 111.6 58.9 -41.7 -28.4 36.9 -20.9 46.0 10 152 A R H 3X S+ 0 0 157 -4,-3.2 4,-1.6 2,-0.2 -1,-0.3 0.886 106.4 44.0 -69.8 -40.3 38.0 -18.4 48.7 11 153 A Q H S+ 0 0 37 -4,-2.1 4,-2.3 -5,-0.3 5,-0.9 0.912 109.9 53.1 -59.3 -35.8 35.8 -15.0 45.8 14 156 A A H <5S+ 0 0 58 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.842 110.4 45.2 -70.9 -37.9 38.7 -12.7 46.3 15 157 A L H <5S+ 0 0 2 -4,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.943 116.6 43.8 -63.6 -53.7 39.3 -12.3 42.6 16 158 A I H <5S- 0 0 1 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.855 96.7-134.8 -64.0 -37.3 35.7 -11.8 41.6 17 159 A G T <5S+ 0 0 50 -4,-2.3 2,-0.3 -5,-0.3 -3,-0.2 0.703 77.0 80.1 80.5 23.0 34.8 -9.4 44.5 18 160 A Y S - 0 0 59 -2,-0.3 3,-0.7 1,-0.1 458,-0.0 -0.891 18.7-177.1-106.4 107.5 30.5 -14.5 46.7 20 162 A V T 3 S+ 0 0 15 -2,-0.7 -1,-0.1 1,-0.2 458,-0.0 0.419 81.4 64.6 -80.5 -2.8 28.6 -16.7 44.3 21 163 A T T 3 S+ 0 0 66 2,-0.0 2,-0.3 11,-0.0 -1,-0.2 0.631 77.4 104.9 -95.9 -15.7 27.9 -19.2 47.1 22 164 A D < - 0 0 55 -3,-0.7 3,-0.2 1,-0.1 -3,-0.0 -0.498 45.5-179.2 -69.0 127.4 25.8 -16.7 49.0 23 165 A V > + 0 0 102 -2,-0.3 3,-0.8 1,-0.2 -1,-0.1 0.099 48.6 108.3-118.5 20.6 22.1 -17.5 48.6 24 166 A S T 3 S+ 0 0 81 1,-0.2 -1,-0.2 3,-0.0 -2,-0.0 0.736 82.0 40.7 -69.9 -28.1 20.7 -14.6 50.6 25 167 A N T 3 S+ 0 0 6 -3,-0.2 264,-0.5 267,-0.0 -1,-0.2 0.002 96.9 91.6-118.1 28.1 19.3 -12.6 47.7 26 168 A V < - 0 0 48 -3,-0.8 3,-0.1 262,-0.1 -3,-0.0 -0.601 47.0-168.7-112.0 165.8 17.8 -15.3 45.5 27 169 A H S S+ 0 0 66 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.165 73.4 21.9-133.3 13.4 14.4 -16.9 45.3 28 170 A D S S- 0 0 44 231,-0.0 3,-0.3 1,-0.0 4,-0.3 -0.932 83.3 -88.9-160.2-170.0 15.3 -19.8 43.0 29 171 A D S > S+ 0 0 51 -2,-0.3 4,-3.3 1,-0.2 5,-0.3 0.517 81.5 104.2 -83.1 -13.1 17.9 -22.2 41.6 30 172 A E H > S+ 0 0 5 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.791 79.1 44.5 -60.5 -43.6 19.0 -20.3 38.5 31 173 A L H > S+ 0 0 24 -3,-0.3 4,-2.0 2,-0.2 3,-0.5 0.980 120.0 42.8 -63.4 -51.4 22.5 -18.9 39.5 32 174 A E H > S+ 0 0 72 -4,-0.3 4,-2.0 1,-0.3 5,-0.2 0.901 113.3 52.8 -57.6 -44.8 23.5 -22.2 41.1 33 175 A F H X S+ 0 0 78 -4,-3.3 4,-1.9 1,-0.2 -1,-0.3 0.824 108.0 51.9 -62.9 -29.6 22.0 -24.1 38.1 34 176 A T H X S+ 0 0 3 -4,-2.1 4,-2.9 -3,-0.5 -2,-0.2 0.851 104.9 55.6 -75.2 -34.4 24.1 -21.9 35.8 35 177 A R H X S+ 0 0 42 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.987 112.1 42.0 -59.8 -56.9 27.3 -22.7 37.7 36 178 A R H >X S+ 0 0 125 -4,-2.0 3,-0.5 1,-0.2 4,-0.5 0.902 115.6 53.6 -50.7 -45.3 26.7 -26.4 37.2 37 179 A G H >< S+ 0 0 21 -4,-1.9 3,-0.9 -5,-0.2 -2,-0.2 0.910 102.7 54.2 -58.3 -45.7 25.7 -25.6 33.6 38 180 A L H 3X S+ 0 0 2 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.724 90.0 79.1 -68.5 -21.6 28.7 -23.7 32.6 39 181 A V H S+ 0 0 19 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.927 113.9 52.4 -56.4 -47.0 31.4 -25.7 28.1 42 184 A R H X S+ 0 0 7 -4,-2.7 4,-3.0 2,-0.2 3,-0.2 0.961 114.6 42.9 -51.4 -56.0 34.4 -24.6 30.2 43 185 A M H X S+ 0 0 78 -4,-2.8 4,-3.3 1,-0.2 -1,-0.2 0.949 108.0 56.7 -55.4 -58.1 35.7 -28.1 30.2 44 186 A A H < S+ 0 0 64 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.868 115.7 39.4 -40.0 -45.3 35.0 -28.8 26.5 45 187 A E H >X S+ 0 0 16 -4,-2.1 4,-1.3 -3,-0.2 3,-1.3 0.902 114.2 51.4 -79.3 -45.4 37.1 -25.7 25.7 46 188 A V H 3< S+ 0 0 39 -4,-3.0 3,-0.4 1,-0.3 -2,-0.2 0.899 108.7 54.2 -50.9 -41.6 39.8 -26.2 28.3 47 189 A A T 3< S+ 0 0 89 -4,-3.3 -1,-0.3 1,-0.2 -2,-0.2 0.061 112.1 44.1 -87.9 30.3 40.2 -29.8 27.0 48 190 A S T <4 S+ 0 0 87 -3,-1.3 -1,-0.2 -5,-0.1 -2,-0.2 0.423 77.9 121.8-153.9 -25.3 40.7 -28.5 23.4 49 191 A R < - 0 0 33 -4,-1.3 3,-0.1 -3,-0.4 402,-0.1 -0.312 68.1-123.5 -37.7 123.7 43.2 -25.7 23.9 50 192 A D >> - 0 0 86 1,-0.2 4,-2.5 400,-0.2 3,-0.5 -0.733 28.7-144.8 -74.7 108.6 46.4 -26.1 21.9 51 193 A P H 3> S+ 0 0 78 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.727 87.2 44.9 -61.6 -29.5 48.6 -25.8 25.0 52 194 A K H 3> S+ 0 0 116 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.854 114.0 46.0 -87.1 -33.6 51.6 -24.0 23.4 53 195 A L H <> S+ 0 0 61 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.885 112.4 55.6 -65.5 -38.0 49.7 -21.4 21.4 54 196 A Y H < S+ 0 0 11 -4,-2.5 398,-0.3 1,-0.2 3,-0.3 0.948 108.6 46.1 -54.2 -48.5 47.6 -20.9 24.5 55 197 A A H < S+ 0 0 5 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.792 119.9 39.5 -69.7 -29.1 50.7 -20.1 26.5 56 198 A M H < S- 0 0 6 -4,-1.3 69,-0.4 -5,-0.1 -1,-0.2 0.522 85.8-158.7-101.5 -8.6 52.2 -17.8 23.9 57 199 A H < - 0 0 31 -4,-2.2 68,-0.1 -3,-0.3 -3,-0.1 0.723 11.2-150.0 37.8 49.5 49.0 -16.0 22.8 58 200 A P - 0 0 24 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 -0.156 3.3-142.7 -48.1 135.1 50.1 -14.8 19.4 59 201 A W + 0 0 68 66,-0.5 77,-2.3 394,-0.0 78,-0.4 -0.869 42.9 147.2-104.7 99.2 48.3 -11.6 18.5 60 202 A V B -A 135 0A 44 -2,-0.8 2,-0.3 75,-0.2 75,-0.2 -0.582 32.3-146.7-123.5-179.9 47.6 -11.9 14.8 61 203 A T - 0 0 6 73,-1.4 -2,-0.0 -2,-0.2 355,-0.0 -0.980 19.4-147.7-152.7 145.8 45.1 -10.9 12.1 62 204 A S + 0 0 95 -2,-0.3 72,-0.0 2,-0.1 -1,-0.0 0.408 68.4 115.6 -82.7 0.9 43.6 -12.2 8.8 63 205 A K S S- 0 0 56 71,-0.1 -2,-0.1 1,-0.1 2,-0.1 -0.422 75.0-104.5 -80.9 149.0 43.2 -8.6 7.6 64 206 A P - 0 0 97 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.428 41.7-102.8 -66.0 139.4 45.1 -7.2 4.6 65 207 A L - 0 0 4 -2,-0.1 5,-0.1 1,-0.1 69,-0.1 -0.499 49.0-114.3 -58.3 124.9 47.9 -4.9 5.5 66 208 A P > - 0 0 7 0, 0.0 4,-0.8 0, 0.0 3,-0.4 -0.091 24.5-103.3 -67.2 169.7 46.4 -1.5 4.8 67 209 A E H > S+ 0 0 105 552,-0.2 4,-2.0 2,-0.2 -2,-0.1 0.661 110.4 62.3 -61.4 -12.8 47.8 0.6 2.1 68 210 A Y H 4 S+ 0 0 71 1,-0.4 -1,-0.2 2,-0.3 556,-0.0 0.039 105.7 41.1-116.1 14.7 49.6 3.0 4.4 69 211 A L H >4 S+ 0 0 12 -3,-0.4 3,-1.0 0, 0.0 -1,-0.4 -0.183 105.0 66.2 106.1 -80.0 51.7 0.8 5.8 70 212 A W H >< S+ 0 0 96 -4,-0.8 3,-0.6 1,-0.2 -2,-0.3 0.974 100.4 54.0 -63.8 -51.0 52.4 -1.0 2.4 71 213 A K T 3< S+ 0 0 174 -4,-2.0 -1,-0.2 1,-0.3 -3,-0.1 0.198 94.5 73.7 -69.7 18.0 54.1 2.2 1.3 72 214 A K T < S+ 0 0 86 -3,-1.0 2,-0.4 -5,-0.0 -1,-0.3 -0.221 78.7 98.4-118.0 39.9 56.3 2.0 4.4 73 215 A I < - 0 0 35 -3,-0.6 5,-0.1 1,-0.1 -3,-0.0 -0.979 68.9-137.1-129.8 144.0 58.4 -0.9 3.1 74 216 A A S S- 0 0 73 3,-1.1 -1,-0.1 -2,-0.4 4,-0.1 0.962 80.4 -49.0 -57.9 -60.5 61.8 -0.8 1.4 75 217 A N S S- 0 0 152 2,-0.2 -1,-0.2 0, 0.0 3,-0.1 -0.292 110.0 -42.5 175.1 69.8 61.2 -3.3 -1.4 76 218 A N S S+ 0 0 105 1,-0.2 2,-0.4 18,-0.0 -3,-0.0 0.851 112.5 125.5 52.9 38.4 59.6 -6.4 0.2 77 219 A C + 0 0 26 17,-0.1 -3,-1.1 15,-0.1 2,-0.4 -0.995 37.4 179.9-130.6 126.3 62.1 -6.0 2.9 78 220 A I E -B 93 0B 7 15,-3.2 15,-0.8 -2,-0.4 2,-0.3 -0.997 21.1-135.8-129.1 128.0 61.4 -5.7 6.7 79 221 A F E -B 92 0B 123 -2,-0.4 69,-0.5 13,-0.2 2,-0.3 -0.585 21.0-178.7 -87.5 139.4 64.0 -5.3 9.3 80 222 A I E -B 91 0B 7 11,-1.3 11,-1.9 -2,-0.3 2,-0.6 -0.998 14.9-149.6-137.2 136.5 64.1 -7.1 12.6 81 223 A V E -Bc 90 149B 23 67,-2.3 69,-2.6 -2,-0.3 9,-0.2 -0.908 14.3-167.4-109.8 118.3 66.6 -6.9 15.5 82 224 A I E -Bc 89 150B 12 7,-2.1 7,-0.6 -2,-0.6 2,-0.3 -0.616 1.7-162.6 -99.5 160.1 67.3 -10.0 17.7 83 225 A H E +Bc 88 151B 53 67,-0.6 69,-1.8 -2,-0.2 5,-0.2 -0.981 19.1 172.4-143.4 151.9 69.1 -10.1 21.1 84 226 A R S S- 0 0 146 3,-0.8 4,-0.1 -2,-0.3 -1,-0.1 0.583 77.3 -34.6-137.8 -25.3 70.7 -12.9 23.2 85 227 A S S S- 0 0 110 2,-0.3 -2,-0.0 0, 0.0 3,-0.0 -0.003 125.9 -26.2-158.1 -71.4 72.6 -11.4 26.2 86 228 A T S S+ 0 0 145 2,-0.0 2,-0.2 0, 0.0 -3,-0.0 -0.119 117.9 107.7-132.6 28.6 74.2 -8.0 25.4 87 229 A T + 0 0 82 2,-0.0 -3,-0.8 0, 0.0 -2,-0.3 -0.674 42.9 175.6-108.4 159.2 74.4 -9.1 21.7 88 230 A S E +B 83 0B 78 -2,-0.2 2,-0.2 -5,-0.2 -5,-0.2 -0.862 9.4 170.1-149.9 179.0 72.4 -8.0 18.6 89 231 A Q E -B 82 0B 113 -7,-0.6 -7,-2.1 -2,-0.2 2,-0.2 -0.647 25.5-125.3 167.6 139.7 72.0 -8.4 14.8 90 232 A T E -B 81 0B 58 -9,-0.2 2,-0.4 -2,-0.2 -9,-0.2 -0.658 16.1-160.5 -94.5 150.5 69.5 -7.4 12.1 91 233 A I E -B 80 0B 10 -11,-1.9 -11,-1.3 -2,-0.2 2,-0.2 -0.989 16.2-136.1-129.5 128.1 67.8 -9.6 9.6 92 234 A K E -B 79 0B 153 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.2 -0.548 35.3-177.9 -63.1 141.8 66.2 -8.5 6.4 93 235 A V E -B 78 0B 9 -15,-0.8 -15,-3.2 -2,-0.2 -2,-0.0 -0.982 26.4-125.8-145.6 150.6 62.9 -10.3 6.1 94 236 A S > - 0 0 35 -2,-0.3 3,-3.3 -17,-0.2 38,-0.3 -0.873 30.6-115.9-100.6 136.9 60.1 -10.5 3.6 95 237 A P T 3 S+ 0 0 0 0, 0.0 38,-1.8 0, 0.0 37,-0.4 0.684 112.4 50.0 -38.9 -35.6 56.5 -9.8 4.8 96 238 A D T 3 S+ 0 0 103 35,-0.2 2,-0.3 36,-0.2 0, 0.0 0.441 79.5 121.6 -90.8 1.5 55.2 -13.3 4.1 97 239 A D < - 0 0 52 -3,-3.3 35,-1.0 34,-0.1 36,-0.1 -0.481 61.0-131.4 -69.2 123.1 58.0 -15.1 5.9 98 240 A T > - 0 0 35 -2,-0.3 4,-1.6 33,-0.2 31,-0.1 -0.195 22.4-112.5 -53.3 156.3 56.7 -17.4 8.7 99 241 A P H > S+ 0 0 9 0, 0.0 4,-2.6 0, 0.0 3,-0.5 0.979 120.2 53.5 -50.3 -60.2 58.4 -17.1 12.1 100 242 A G H > S+ 0 0 43 28,-0.3 4,-2.5 1,-0.3 5,-0.2 0.888 107.7 51.1 -39.6 -51.6 59.8 -20.6 11.7 101 243 A A H > S+ 0 0 39 2,-0.2 4,-2.0 3,-0.2 -1,-0.3 0.891 113.4 45.6 -55.6 -43.3 61.2 -19.6 8.3 102 244 A I H >< S+ 0 0 9 -4,-1.6 3,-0.7 -3,-0.5 -2,-0.2 0.999 110.7 50.7 -63.4 -65.0 62.8 -16.6 10.0 103 245 A L H 3X S+ 0 0 31 -4,-2.6 4,-1.1 1,-0.3 -2,-0.2 0.808 114.3 45.5 -40.1 -43.6 64.2 -18.5 13.0 104 246 A Q H 3X S+ 0 0 105 -4,-2.5 2,-2.8 -5,-0.3 4,-2.4 0.870 98.2 72.3 -73.1 -36.4 65.8 -21.1 10.6 105 247 A S H << S+ 0 0 50 -4,-2.0 -1,-0.2 -3,-0.7 -2,-0.1 -0.318 104.5 42.5 -71.2 59.6 67.1 -18.2 8.4 106 248 A F H 4 S+ 0 0 59 -2,-2.8 -1,-0.2 -3,-0.1 -2,-0.2 0.127 106.0 54.5-175.9 -54.9 69.5 -17.6 11.2 107 249 A F H < S+ 0 0 107 -4,-1.1 -2,-0.2 -3,-0.2 -3,-0.1 0.817 118.9 41.6 -62.2 -34.8 70.7 -21.1 12.2 108 250 A T S < S+ 0 0 104 -4,-2.4 2,-1.3 1,-0.1 -1,-0.2 0.868 101.9 81.0 -72.0 -44.3 71.5 -21.3 8.5 109 251 A K 0 0 124 -5,-0.4 -1,-0.1 1,-0.2 -4,-0.0 -0.529 360.0 360.0 -73.0 92.0 72.9 -17.7 8.7 110 252 A M 0 0 206 -2,-1.3 -1,-0.2 -3,-0.0 -2,-0.1 0.308 360.0 360.0-143.8 360.0 76.4 -18.2 10.1 111 ! 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 0.0 112 267 A E 0 0 169 0, 0.0 3,-0.1 0, 0.0 -5,-0.0 0.000 360.0 360.0 360.0 167.8 67.7 -26.7 18.2 113 268 A Q + 0 0 188 1,-0.2 2,-0.4 3,-0.0 -9,-0.0 0.260 360.0 101.6 -97.9 11.2 64.0 -25.8 18.0 114 269 A D + 0 0 67 40,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.123 67.2 83.3 -93.9 35.9 63.6 -25.1 21.7 115 270 A F - 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0 0 95 2,-0.0 2,-0.1 0, 0.0 0, 0.0 0.393 360.0-114.2 73.0 150.4 2.9 -18.6 -4.7 309 546 A E - 0 0 157 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.305 20.7-114.1-104.7-173.1 4.7 -15.4 -5.9 310 547 A M - 0 0 11 -2,-0.1 -2,-0.0 34,-0.0 31,-0.0 -0.997 28.2-114.1-132.4 128.4 4.7 -11.8 -4.9 311 548 A P >> - 0 0 64 0, 0.0 4,-1.6 0, 0.0 3,-0.9 -0.229 33.9-105.2 -58.1 142.5 3.4 -8.8 -6.9 312 549 A N H 3> S+ 0 0 115 1,-0.2 4,-1.5 2,-0.2 3,-0.1 0.848 112.8 38.4 -23.6 -81.4 5.8 -6.2 -8.1 313 550 A Q H 3> S+ 0 0 123 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.564 110.3 56.1 -75.1 -11.4 5.0 -3.4 -5.7 314 551 A L H X> S+ 0 0 53 -3,-0.9 4,-3.3 2,-0.2 3,-0.7 0.971 107.1 51.1 -71.3 -59.9 4.4 -5.3 -2.5 315 552 A R H 3X S+ 0 0 60 -4,-1.6 4,-3.1 1,-0.3 -2,-0.2 0.861 113.3 48.4 -34.1 -45.1 7.9 -6.8 -2.9 316 553 A K H 3X S+ 0 0 95 -4,-1.5 4,-2.1 -5,-0.3 -1,-0.3 0.876 109.0 49.5 -71.5 -39.3 8.9 -3.1 -3.3 317 554 A Q H - 0 0 16 1,-0.1 3,-1.6 4,-0.0 -1,-0.1 -0.357 34.9-103.5 -79.7 165.9 17.5 2.0 9.3 326 563 A P T 3 S+ 0 0 39 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.675 119.9 52.9 -65.3 -21.4 17.1 0.3 12.7 327 564 A L T 3 S+ 0 0 37 2,-0.1 474,-0.1 473,-0.1 -3,-0.0 0.475 80.1 109.4 -90.6 -2.9 15.5 3.3 14.4 328 565 A N S < S- 0 0 51 -3,-1.6 2,-0.2 -7,-0.1 -4,-0.0 -0.622 73.9-128.3 -76.7 116.5 12.9 3.5 11.6 329 566 A P - 0 0 96 0, 0.0 2,-0.4 0, 0.0 -2,-0.1 -0.438 13.8-131.9 -76.3 132.5 9.7 2.5 13.4 330 567 A L - 0 0 29 -2,-0.2 2,-0.1 27,-0.1 -9,-0.0 -0.675 18.8-138.0 -79.4 130.4 7.7 -0.2 11.7 331 568 A T > - 0 0 71 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.392 30.1-103.4 -75.9 162.8 4.0 0.5 11.4 332 569 A A H > S+ 0 0 67 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.854 129.0 53.5 -53.0 -35.9 1.5 -2.2 12.1 333 570 A E H > S+ 0 0 102 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.954 106.0 50.4 -59.7 -50.7 1.2 -2.2 8.3 334 571 A D H > S+ 0 0 28 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.891 115.2 45.2 -56.2 -39.2 4.9 -2.7 7.9 335 572 A K H X S+ 0 0 81 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.876 108.9 51.7 -74.9 -44.2 4.7 -5.5 10.4 336 573 A E H X S+ 0 0 132 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.872 112.6 50.1 -61.8 -34.8 1.7 -7.3 9.0 337 574 A L H X S+ 0 0 12 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.966 109.5 48.0 -68.8 -53.2 3.5 -7.2 5.7 338 575 A L H < S+ 0 0 0 -4,-2.3 7,-0.3 1,-0.2 -2,-0.2 0.873 117.3 43.9 -51.3 -43.7 6.8 -8.6 6.9 339 576 A W H >< S+ 0 0 42 -4,-2.4 3,-2.3 1,-0.2 -1,-0.2 0.972 110.1 51.4 -71.0 -53.4 5.0 -11.4 8.7 340 577 A H H 3< S+ 0 0 132 -4,-2.3 3,-0.2 1,-0.3 -1,-0.2 0.800 120.8 36.6 -57.4 -32.6 2.6 -12.4 6.0 341 578 A F T >X S+ 0 0 45 -4,-1.9 4,-2.3 -5,-0.2 3,-0.8 -0.233 77.5 137.9-110.3 39.7 5.5 -12.6 3.6 342 579 A R H <> + 0 0 44 -3,-2.3 4,-1.7 1,-0.3 -1,-0.2 0.750 66.6 58.4 -62.6 -22.2 7.8 -14.0 6.1 343 580 A Y H 34 S+ 0 0 102 2,-0.2 4,-0.3 -3,-0.2 -1,-0.3 0.862 106.9 45.7 -75.9 -32.7 9.2 -16.5 3.6 344 581 A E H X4 S+ 0 0 19 -3,-0.8 3,-1.7 1,-0.2 -2,-0.2 0.930 110.4 57.0 -69.6 -46.1 10.2 -13.8 1.2 345 582 A S H >< S+ 0 0 0 -4,-2.3 3,-2.3 -7,-0.3 6,-0.3 0.844 95.0 64.0 -48.9 -44.8 11.7 -12.0 4.2 346 583 A L T 3< S+ 0 0 6 -4,-1.7 -1,-0.3 1,-0.3 34,-0.2 0.687 88.8 70.3 -59.7 -18.1 13.9 -15.0 5.1 347 584 A K T < S+ 0 0 95 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.579 94.2 62.6 -78.1 -9.3 15.8 -14.5 1.8 348 585 A H X - 0 0 61 -3,-2.3 3,-2.3 -4,-0.2 4,-0.3 -0.920 64.4-164.2-119.5 105.9 17.3 -11.2 3.2 349 586 A P G > S+ 0 0 29 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.836 92.3 62.3 -48.2 -36.5 19.5 -11.5 6.3 350 587 A K G 3 S+ 0 0 125 1,-0.3 4,-0.3 2,-0.1 -4,-0.1 0.648 93.8 62.0 -68.2 -16.4 19.1 -7.8 6.7 351 588 A A G <> S+ 0 0 0 -3,-2.3 4,-3.0 -6,-0.3 -1,-0.3 0.531 79.2 92.1 -85.3 -5.8 15.3 -8.2 7.3 352 589 A Y H <> S+ 0 0 1 -3,-1.5 4,-3.3 -4,-0.3 5,-0.4 0.925 80.1 49.8 -62.1 -56.5 15.8 -10.3 10.4 353 590 A P H > S+ 0 0 8 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.900 118.9 40.9 -46.7 -45.1 15.7 -7.6 13.1 354 591 A K H 4 S+ 0 0 20 -4,-0.3 -2,-0.2 2,-0.2 -3,-0.1 0.886 114.2 52.5 -76.0 -37.8 12.5 -6.2 11.7 355 592 A L H >< S+ 0 0 1 -4,-3.0 3,-2.3 1,-0.2 -3,-0.2 0.972 113.7 41.7 -57.8 -55.2 11.0 -9.6 10.9 356 593 A F H >< S+ 0 0 1 -4,-3.3 3,-1.0 1,-0.3 -1,-0.2 0.770 107.6 62.0 -74.6 -21.3 11.4 -10.9 14.4 357 594 A S T 3< S+ 0 0 31 -4,-1.6 -1,-0.3 -5,-0.4 -2,-0.2 0.415 102.5 54.3 -67.3 -3.5 10.3 -7.6 15.7 358 595 A S T < S+ 0 0 10 -3,-2.3 2,-0.6 -23,-0.1 -1,-0.2 0.091 80.0 111.3-121.2 20.6 7.1 -8.3 13.9 359 596 A V S < S- 0 0 2 -3,-1.0 2,-1.4 -20,-0.0 3,-0.1 -0.878 70.2-133.7 -93.6 124.0 6.4 -11.7 15.6 360 597 A K > - 0 0 134 -2,-0.6 3,-1.2 1,-0.2 7,-0.3 -0.670 28.0-176.6 -73.3 88.5 3.4 -11.6 17.9 361 598 A W T 3 S+ 0 0 6 -2,-1.4 -1,-0.2 1,-0.3 6,-0.1 0.722 71.7 73.6 -69.7 -22.3 5.4 -13.5 20.6 362 599 A G T 3 S+ 0 0 21 -3,-0.1 2,-0.4 1,-0.1 -1,-0.3 0.221 86.3 75.3 -72.0 14.3 2.3 -13.5 22.8 363 600 A Q <> - 0 0 81 -3,-1.2 4,-3.2 1,-0.1 3,-0.3 -0.933 65.0-158.8-136.7 114.1 0.7 -16.2 20.6 364 601 A Q H > S+ 0 0 96 -2,-0.4 4,-2.8 1,-0.3 5,-0.1 0.821 93.2 54.2 -62.7 -38.2 1.9 -19.7 20.8 365 602 A E H > S+ 0 0 152 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.921 114.1 44.2 -60.9 -41.8 0.7 -20.8 17.3 366 603 A I H > S+ 0 0 26 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.920 110.9 51.2 -71.8 -44.7 2.6 -17.9 15.9 367 604 A V H X S+ 0 0 20 -4,-3.2 4,-2.3 -7,-0.3 3,-0.3 0.958 108.9 55.2 -52.3 -46.0 5.7 -18.5 18.0 368 605 A A H X S+ 0 0 35 -4,-2.8 4,-2.2 1,-0.3 -2,-0.2 0.903 107.6 48.0 -55.7 -42.7 5.5 -22.0 16.7 369 606 A K H X S+ 0 0 78 -4,-1.7 4,-1.6 2,-0.2 -1,-0.3 0.842 106.1 57.6 -69.2 -33.8 5.5 -20.8 13.2 370 607 A T H >X S+ 0 0 0 -4,-2.2 4,-2.0 -3,-0.3 3,-0.6 0.957 108.5 45.6 -62.4 -46.9 8.5 -18.5 13.9 371 608 A Y H 3X S+ 0 0 78 -4,-2.3 4,-1.1 1,-0.3 -2,-0.2 0.925 105.9 62.7 -61.1 -40.4 10.5 -21.5 14.9 372 609 A Q H 3< S+ 0 0 115 -4,-2.2 4,-0.5 1,-0.2 3,-0.3 0.864 108.2 41.2 -53.3 -39.3 9.2 -23.4 11.9 373 610 A L H << S+ 0 0 0 -4,-1.6 3,-0.5 -3,-0.6 -1,-0.2 0.759 104.8 62.0 -90.6 -20.5 10.9 -20.8 9.7 374 611 A L H >< S+ 0 0 5 -4,-2.0 3,-0.6 1,-0.2 -1,-0.2 0.658 96.8 64.8 -66.6 -14.4 14.1 -20.6 11.8 375 612 A A T 3< S+ 0 0 82 -4,-1.1 2,-0.5 -3,-0.3 -1,-0.2 0.816 94.9 57.3 -71.0 -32.6 14.3 -24.3 10.7 376 613 A R T > S+ 0 0 112 -3,-0.5 3,-0.6 -4,-0.5 -1,-0.2 -0.244 70.9 142.9 -89.4 45.0 14.7 -23.1 7.1 377 614 A R T <> + 0 0 78 -3,-0.6 4,-1.9 -2,-0.5 3,-0.4 0.431 23.6 119.9 -65.0 0.9 17.8 -21.1 8.2 378 615 A E H 3> S+ 0 0 143 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.689 72.8 42.4 -57.8 -31.4 19.6 -21.8 4.9 379 616 A V H <> S+ 0 0 60 -3,-0.6 4,-1.3 2,-0.2 -1,-0.2 0.947 114.1 50.8 -77.3 -47.9 20.1 -18.2 3.6 380 617 A W H >4 S+ 0 0 3 -3,-0.4 3,-1.4 -34,-0.2 -2,-0.2 0.956 109.4 51.6 -45.9 -60.6 21.1 -16.7 7.0 381 618 A D H 3< S+ 0 0 65 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.855 110.4 48.3 -48.8 -46.9 23.7 -19.4 7.6 382 619 A Q H 3< S+ 0 0 155 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.721 90.9 106.4 -68.0 -22.9 25.3 -18.8 4.2 383 620 A S S << S- 0 0 30 -3,-1.4 2,-0.2 -4,-1.3 3,-0.1 -0.204 80.7-102.9 -66.3 147.0 25.5 -15.0 4.6 384 621 A A - 0 0 92 1,-0.1 -1,-0.1 2,-0.0 -2,-0.1 -0.485 49.6 -97.2 -67.2 133.9 28.8 -13.2 5.3 385 622 A L - 0 0 50 -2,-0.2 2,-0.3 25,-0.1 -1,-0.1 -0.175 39.8-173.5 -51.0 146.1 29.0 -12.2 9.0 386 623 A D > - 0 0 67 1,-0.1 4,-2.8 -3,-0.1 5,-0.2 -0.861 10.9-160.0-152.5 97.6 27.9 -8.6 9.6 387 624 A V H > S+ 0 0 20 -2,-0.3 4,-3.6 1,-0.3 5,-0.2 0.885 89.9 52.9 -64.8 -41.9 28.6 -7.7 13.2 388 625 A G H > S+ 0 0 1 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.955 111.9 45.7 -48.9 -54.4 26.2 -4.8 13.2 389 626 A L H > S+ 0 0 12 2,-0.2 4,-0.8 1,-0.2 -2,-0.2 0.932 115.8 46.3 -61.0 -43.3 23.4 -7.0 12.0 390 627 A T H >< S+ 0 0 2 -4,-2.8 3,-2.2 1,-0.2 4,-0.2 0.981 109.0 54.7 -62.9 -51.3 24.2 -9.7 14.4 391 628 A M H >< S+ 0 0 0 -4,-3.6 3,-2.0 1,-0.3 -1,-0.2 0.808 98.3 63.6 -52.0 -35.2 24.5 -7.3 17.3 392 629 A Q H >< S+ 0 0 13 -4,-2.0 3,-1.2 1,-0.3 -1,-0.3 0.848 94.3 62.4 -58.0 -33.6 21.0 -6.0 16.6 393 630 A L T << S+ 0 0 0 -3,-2.2 -1,-0.3 -4,-0.8 -2,-0.2 0.433 103.0 50.7 -75.8 3.8 19.7 -9.5 17.4 394 631 A L T < S+ 0 0 0 -3,-2.0 -1,-0.2 -4,-0.2 38,-0.2 0.271 85.8 100.2-121.9 13.7 21.0 -9.1 21.0 395 632 A D S X S- 0 0 8 -3,-1.2 3,-1.0 -4,-0.2 390,-0.0 -0.074 95.1 -81.3 -84.0-168.0 19.6 -5.8 22.1 396 633 A C T 3 S+ 0 0 10 1,-0.2 -1,-0.1 3,-0.0 -3,-0.1 0.556 119.5 72.6 -73.2 -10.4 16.6 -5.3 24.3 397 634 A N T 3 S+ 0 0 71 -5,-0.2 2,-0.5 -195,-0.1 -1,-0.2 0.716 92.8 58.4 -75.5 -21.2 14.1 -5.8 21.4 398 635 A F < + 0 0 7 -3,-1.0 -1,-0.1 -6,-0.2 -41,-0.1 -0.925 50.2 158.1-117.0 123.8 14.7 -9.5 21.1 399 636 A S + 0 0 13 -2,-0.5 2,-0.4 34,-0.1 -1,-0.1 0.110 37.3 109.8-139.6 32.1 14.1 -11.8 24.0 400 637 A D > - 0 0 2 1,-0.1 4,-2.3 -199,-0.0 5,-0.3 -0.906 63.4-135.1-111.2 134.2 13.6 -15.2 22.5 401 638 A E H > S+ 0 0 107 -2,-0.4 4,-1.9 -165,-0.3 5,-0.1 0.869 102.1 47.3 -55.9 -45.2 16.2 -18.0 22.9 402 639 A N H > S+ 0 0 54 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.869 110.4 51.0 -73.7 -35.6 16.3 -19.1 19.4 403 640 A V H >> S+ 0 0 0 -3,-0.2 4,-1.4 2,-0.2 3,-0.6 0.974 112.5 45.6 -57.3 -56.2 16.6 -15.7 17.8 404 641 A R H 3X S+ 0 0 5 -4,-2.3 4,-2.4 1,-0.3 -2,-0.2 0.850 108.8 59.2 -62.6 -31.2 19.5 -14.7 20.0 405 642 A A H 3X S+ 0 0 38 -4,-1.9 4,-2.7 -5,-0.3 -1,-0.3 0.888 99.7 54.0 -65.1 -37.8 21.1 -18.1 19.3 406 643 A I H X S+ 0 0 0 -4,-1.4 4,-1.3 2,-0.2 3,-1.2 0.982 110.6 46.4 -57.0 -60.3 23.0 -14.2 16.2 408 645 A V H 3X S+ 0 0 5 -4,-2.4 4,-1.1 1,-0.3 3,-0.3 0.879 102.9 65.3 -53.6 -40.7 25.6 -15.9 18.5 409 646 A Q H >< S+ 0 0 75 -4,-2.7 3,-0.9 1,-0.3 4,-0.3 0.894 102.5 50.1 -43.9 -47.4 26.0 -18.6 15.8 410 647 A K H X< S+ 0 0 14 -4,-1.3 3,-1.5 -3,-1.2 -1,-0.3 0.861 100.4 60.5 -65.3 -38.6 27.4 -15.9 13.6 411 648 A L H >< S+ 0 0 1 -4,-1.3 3,-2.1 -3,-0.3 -1,-0.2 0.741 87.1 77.1 -64.2 -19.6 29.9 -14.5 16.1 412 649 A E T << S+ 0 0 74 -4,-1.1 -1,-0.3 -3,-0.9 -2,-0.2 0.818 87.9 59.6 -57.9 -31.3 31.6 -18.0 16.2 413 650 A S T < S+ 0 0 88 -3,-1.5 -1,-0.3 -4,-0.3 2,-0.2 0.503 82.1 107.4 -80.3 -7.5 33.2 -17.1 12.8 414 651 A L < - 0 0 9 -3,-2.1 2,-0.2 -4,-0.2 -3,-0.0 -0.554 67.6-134.9 -65.4 136.4 34.9 -14.1 14.3 415 652 A E >> - 0 0 52 -2,-0.2 4,-1.8 1,-0.1 3,-1.0 -0.531 31.4 -99.0 -81.0 158.9 38.6 -14.4 14.8 416 653 A D H 3> S+ 0 0 48 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.876 119.9 66.4 -40.6 -53.8 40.1 -13.3 18.1 417 654 A D H 3> S+ 0 0 7 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.893 107.6 38.9 -34.9 -56.3 41.2 -10.0 16.5 418 655 A D H <> S+ 0 0 37 -3,-1.0 4,-1.2 1,-0.2 3,-0.3 0.878 105.3 65.3 -72.1 -39.3 37.6 -8.9 16.1 419 656 A V H >X S+ 0 0 1 -4,-1.8 4,-2.0 1,-0.2 3,-1.4 0.931 99.9 53.3 -50.4 -46.3 36.3 -10.3 19.3 420 657 A L H 3< S+ 0 0 25 -4,-2.1 4,-0.5 1,-0.3 -1,-0.2 0.891 103.2 58.3 -56.3 -41.3 38.5 -7.8 21.2 421 658 A H H 3< S+ 0 0 42 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.769 122.9 22.9 -57.2 -30.7 36.9 -5.0 19.2 422 659 A Y H XX S+ 0 0 19 -3,-1.4 4,-2.9 -4,-1.2 3,-0.7 0.421 91.5 106.6-117.4 -3.0 33.5 -5.9 20.4 423 660 A L H 3X S+ 0 0 2 -4,-2.0 4,-2.7 -5,-0.3 5,-0.2 0.851 81.2 48.5 -47.5 -52.6 34.3 -7.7 23.6 424 661 A L H 3> S+ 0 0 5 -4,-0.5 4,-2.0 2,-0.2 -1,-0.3 0.861 113.9 46.2 -59.9 -36.0 33.1 -4.9 25.9 425 662 A Q H <> S+ 0 0 4 -3,-0.7 4,-2.5 2,-0.2 -2,-0.2 0.934 112.3 49.7 -80.1 -38.5 29.8 -4.5 24.1 426 663 A L H X S+ 0 0 1 -4,-2.9 4,-0.8 2,-0.2 -2,-0.2 0.925 110.0 51.6 -59.5 -44.2 29.1 -8.3 24.0 427 664 A V H >< S+ 0 0 0 -4,-2.7 3,-1.5 -5,-0.3 4,-0.3 0.965 112.7 46.0 -55.1 -47.4 29.8 -8.5 27.7 428 665 A Q H >< S+ 0 0 6 -4,-2.0 3,-2.2 1,-0.3 4,-0.3 0.856 100.1 68.6 -66.0 -32.9 27.4 -5.6 28.1 429 666 A A H >< S+ 0 0 0 -4,-2.5 3,-1.2 1,-0.3 4,-0.5 0.723 82.4 75.4 -58.0 -19.1 24.9 -7.4 25.8 430 667 A V G X< S+ 0 0 0 -3,-1.5 3,-1.0 -4,-0.8 -1,-0.3 0.796 80.3 71.8 -65.4 -22.3 24.6 -10.0 28.6 431 668 A K G < S+ 0 0 5 -3,-2.2 -1,-0.3 -4,-0.3 -2,-0.2 0.904 96.2 49.9 -56.7 -36.6 22.5 -7.4 30.3 432 669 A F G < S+ 0 0 10 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.578 85.2 110.6 -83.0 -9.7 19.7 -8.1 27.7 433 670 A E < - 0 0 16 -3,-1.0 -34,-0.1 -4,-0.5 5,-0.0 -0.441 59.6-152.5 -62.1 131.0 19.9 -11.8 28.3 434 671 A P S S+ 0 0 22 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.767 78.6 46.8 -73.2 -25.6 16.7 -13.1 30.0 435 672 A Y S S- 0 0 22 1,-0.1 -176,-0.0 2,-0.1 -2,-0.0 -0.895 76.4-130.3-121.9 150.4 18.6 -16.1 31.5 436 673 A H S S+ 0 0 18 -2,-0.3 2,-0.5 1,-0.1 -1,-0.1 0.926 101.6 53.1 -60.3 -49.1 21.9 -16.5 33.3 437 674 A D S S+ 0 0 42 4,-0.1 2,-0.3 -407,-0.1 3,-0.1 -0.813 79.1 150.6 -88.3 130.3 23.1 -19.4 31.0 438 675 A S > - 0 0 10 -2,-0.5 4,-2.6 1,-0.1 5,-0.3 -0.985 62.0-107.5-154.4 156.7 22.8 -18.2 27.4 439 676 A A H > S+ 0 0 46 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.949 122.6 50.6 -49.8 -46.9 24.4 -18.8 24.1 440 677 A L H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.928 108.9 49.3 -60.3 -49.2 26.0 -15.4 24.5 441 678 A A H > S+ 0 0 1 1,-0.2 4,-2.6 2,-0.2 3,-0.3 0.981 113.5 46.7 -52.7 -57.1 27.3 -16.0 27.9 442 679 A R H X S+ 0 0 81 -4,-2.6 4,-3.8 1,-0.3 -1,-0.2 0.869 108.6 55.1 -56.8 -42.0 28.9 -19.3 26.8 443 680 A F H X S+ 0 0 0 -4,-3.0 4,-2.7 -5,-0.3 5,-0.3 0.925 108.7 47.2 -59.6 -46.6 30.4 -17.8 23.7 444 681 A L H X S+ 0 0 3 -4,-2.4 4,-3.4 -3,-0.3 5,-0.3 0.990 115.5 46.5 -54.0 -55.8 32.2 -15.1 25.8 445 682 A L H X S+ 0 0 2 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.879 111.6 52.7 -53.5 -43.7 33.3 -17.9 28.1 446 683 A K H X S+ 0 0 58 -4,-3.8 4,-1.7 -5,-0.3 3,-0.3 0.996 115.4 38.5 -49.0 -66.4 34.4 -20.0 25.2 447 684 A R H X S+ 0 0 9 -4,-2.7 4,-1.8 1,-0.3 8,-0.3 0.821 113.1 54.5 -66.7 -36.5 36.5 -17.4 23.6 448 685 A G H < S+ 0 0 0 -4,-3.4 7,-0.7 -5,-0.3 -1,-0.3 0.943 112.4 44.3 -60.4 -47.6 37.9 -16.0 26.8 449 686 A L H < S+ 0 0 0 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.775 111.2 56.4 -66.6 -26.3 39.2 -19.4 27.8 450 687 A R H < S+ 0 0 91 -4,-1.7 2,-0.4 1,-0.2 -1,-0.2 0.852 114.8 31.4 -75.5 -36.0 40.4 -20.1 24.3 451 688 A N X - 0 0 15 -4,-1.8 4,-2.4 -3,-0.2 -1,-0.2 -0.993 69.0-144.4-131.6 129.7 42.7 -17.0 24.0 452 689 A K H > S+ 0 0 31 -2,-0.4 4,-2.0 -398,-0.3 5,-0.2 0.879 97.3 55.5 -60.8 -45.2 44.6 -15.4 26.9 453 690 A R H >> S+ 0 0 37 2,-0.2 4,-1.9 1,-0.2 3,-1.1 0.982 112.3 41.4 -57.3 -61.0 44.3 -11.8 25.7 454 691 A I H 3> S+ 0 0 0 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.930 111.9 58.1 -45.4 -49.6 40.5 -11.9 25.5 455 692 A G H 3X S+ 0 0 0 -4,-2.4 4,-1.6 -7,-0.7 -1,-0.3 0.830 106.3 49.8 -54.3 -31.6 40.5 -13.8 28.8 456 693 A H H X S+ 0 0 2 -4,-3.2 4,-2.7 1,-0.2 3,-1.9 0.994 115.9 48.1 -60.4 -59.8 33.2 -8.6 34.1 463 700 A R H 3X S+ 0 0 13 -4,-2.9 4,-2.0 -5,-0.3 -1,-0.2 0.818 103.9 63.8 -52.1 -37.4 34.9 -7.5 37.4 464 701 A S H 3< S+ 0 0 2 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.846 112.6 33.9 -50.9 -42.3 34.2 -3.9 36.4 465 702 A E H XX S+ 0 0 2 -3,-1.9 3,-1.5 -4,-1.1 4,-1.4 0.849 111.8 59.2 -87.3 -41.0 30.5 -4.5 36.5 466 703 A I H 3< S+ 0 0 1 -4,-2.7 -2,-0.2 1,-0.3 3,-0.2 0.842 105.5 53.3 -56.9 -31.7 30.4 -7.0 39.3 467 704 A A T 3< S+ 0 0 42 -4,-2.0 170,-0.4 -5,-0.3 -1,-0.3 0.645 127.0 16.7 -76.0 -16.6 32.0 -4.4 41.5 468 705 A Q T <4 S+ 0 0 35 -3,-1.5 2,-0.5 -4,-0.2 -2,-0.2 0.208 99.5 85.6-152.8 23.0 29.4 -1.8 40.8 469 706 A S X - 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0 0 39 -4,-1.0 3,-0.2 1,-0.2 -4,-0.0 -0.659 53.9-141.4-118.6 163.3 24.2 5.8 30.9 792 1040 A P S S+ 0 0 77 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.798 88.1 14.9 -80.0 -99.5 22.2 7.9 33.4 793 1041 A Q S S+ 0 0 141 2,-0.0 2,-0.2 -512,-0.0 -515,-0.0 -0.645 79.2 153.9 -81.9 127.2 19.3 9.7 31.8 794 1042 A L - 0 0 9 -2,-0.4 2,-0.3 -3,-0.2 4,-0.1 -0.756 33.5-135.0-137.2-176.0 18.5 8.4 28.2 795 1043 A T >> - 0 0 48 -2,-0.2 2,-3.4 -515,-0.1 5,-1.0 -0.814 17.9-131.1-155.9 106.6 15.4 8.3 25.9 796 1044 A S T 45S+ 0 0 62 -2,-0.3 2,-0.1 1,-0.2 -515,-0.1 -0.278 104.7 11.2 -62.7 69.9 14.2 5.3 23.9 797 1045 A K T >5S+ 0 0 151 -2,-3.4 4,-3.0 0, 0.0 -1,-0.2 -0.599 126.4 48.1 165.0 -76.2 13.9 7.4 20.8 798 1046 A E H >5S+ 0 0 111 1,-0.2 4,-0.9 2,-0.2 -2,-0.1 0.893 111.2 40.9 -65.3 -55.7 15.4 10.8 21.2 799 1047 A D H <5S+ 0 0 56 -4,-0.6 3,-0.5 1,-0.2 4,-0.3 0.890 121.9 43.8 -65.0 -36.0 18.9 10.4 22.7 800 1048 A I H >> S+ 0 0 2 -3,-1.4 4,-2.4 -4,-0.3 -1,-0.2 0.855 102.2 56.0 -71.8 -35.3 23.2 9.3 15.9 804 1052 A R H <>S+ 0 0 39 -4,-0.5 5,-1.8 2,-0.2 -1,-0.2 0.933 114.0 44.5 -59.7 -39.9 21.0 8.7 12.9 805 1053 A D H ><5S+ 0 0 90 -4,-1.6 3,-2.3 2,-0.2 -2,-0.2 0.938 111.2 49.3 -67.2 -52.3 20.9 12.5 12.5 806 1054 A A H 3<5S+ 0 0 2 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.866 115.0 47.4 -59.7 -32.2 24.6 13.1 13.0 807 1055 A L T 3<5S- 0 0 0 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.445 109.7-132.7 -83.3 0.0 25.1 10.3 10.4 808 1056 A T T < 5 - 0 0 16 -3,-2.3 -3,-0.2 -5,-0.1 -2,-0.1 0.952 23.1-157.3 41.7 68.6 22.5 12.0 8.1 809 1057 A V S - 0 0 88 -3,-0.1 4,-1.4 1,-0.1 3,-0.3 -0.442 49.3 -88.2 -81.2 169.9 23.0 10.7 -1.1 813 1061 A E H > S+ 0 0 88 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.754 123.2 59.9 -50.3 -26.9 26.8 10.9 -0.7 814 1062 A E H > S+ 0 0 109 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.949 99.2 45.4 -75.5 -55.6 26.5 14.6 -1.7 815 1063 A D H > S+ 0 0 83 -3,-0.3 4,-3.0 1,-0.2 -1,-0.2 0.830 110.2 59.3 -64.5 -31.7 24.3 16.3 0.9 816 1064 A A H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.993 105.7 46.5 -53.2 -65.4 26.3 14.5 3.6 817 1065 A K H X S+ 0 0 80 -4,-1.5 4,-1.5 1,-0.2 -2,-0.2 0.831 114.6 49.5 -44.9 -41.0 29.6 16.1 2.5 818 1066 A K H >X S+ 0 0 113 -4,-1.9 4,-1.9 2,-0.2 3,-0.8 0.993 106.5 53.3 -65.3 -59.8 27.9 19.4 2.3 819 1067 A Y H 3X S+ 0 0 84 -4,-3.0 4,-1.5 1,-0.3 -2,-0.2 0.799 109.2 51.9 -41.0 -41.0 26.3 19.2 5.8 820 1068 A F H 3X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.3 0.890 104.6 51.7 -71.5 -40.6 29.7 18.5 7.3 821 1069 A L H X S+ 0 0 47 -4,-2.8 4,-1.1 1,-0.2 3,-0.6 0.836 106.5 57.4 -65.0 -32.0 32.2 26.7 8.9 826 1074 A V H >< S+ 0 0 49 -4,-3.0 3,-2.1 1,-0.2 4,-0.3 0.993 103.2 54.4 -57.2 -57.8 30.0 26.9 12.0 827 1075 A C H 3< S+ 0 0 2 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.662 109.2 49.4 -46.2 -24.3 33.1 26.3 14.1 828 1076 A R H X< S+ 0 0 17 -4,-0.7 3,-0.6 -3,-0.6 -1,-0.3 0.725 101.0 61.2 -91.3 -23.3 34.8 29.2 12.4 829 1077 A D T << S+ 0 0 107 -3,-2.1 -2,-0.1 -4,-1.1 -1,-0.1 0.788 113.7 37.8 -54.6 -54.1 32.1 31.8 12.8 830 1078 A K T > S+ 0 0 63 -4,-0.3 3,-3.3 1,-0.1 -1,-0.3 -0.242 80.9 169.3 113.7 -62.7 32.3 31.5 16.1 831 1079 A G T < S- 0 0 17 -3,-0.6 4,-0.2 1,-0.3 3,-0.1 0.150 79.0 -0.6 27.5 -97.0 36.1 31.1 16.6 832 1080 A W T 3> S+ 0 0 46 1,-0.1 4,-2.7 -92,-0.1 5,-0.3 0.312 98.6 111.7-103.7 3.4 36.6 31.5 20.4 833 1081 A T H <> S+ 0 0 54 -3,-3.3 4,-2.7 1,-0.2 -1,-0.1 0.918 83.4 34.6 -41.7 -68.2 33.1 32.1 21.5 834 1082 A V H > S+ 0 0 14 2,-0.2 4,-1.6 -4,-0.2 -1,-0.2 0.918 114.9 55.7 -63.7 -46.8 32.4 28.9 23.5 835 1083 A Q H >4 S+ 0 0 6 1,-0.3 3,-0.6 -4,-0.2 -1,-0.2 0.927 112.7 43.9 -51.7 -50.1 35.9 28.5 24.8 836 1084 A F H >< S+ 0 0 144 -4,-2.7 3,-1.2 1,-0.2 -1,-0.3 0.937 105.5 64.2 -53.0 -50.4 35.6 31.9 26.3 837 1085 A N H 3< S+ 0 0 77 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.719 84.8 72.2 -51.9 -29.2 32.0 31.1 27.5 838 1086 A W T << 0 0 129 -4,-1.6 -1,-0.3 -3,-0.6 -2,-0.1 0.233 360.0 360.0 -67.0 17.5 33.4 28.4 29.9 839 1087 A F < 0 0 217 -3,-1.2 -1,-0.2 -177,-0.0 0, 0.0 -0.154 360.0 360.0 66.9 360.0 34.7 31.5 31.9