==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 06-JUN-12 4FHK . COMPND 2 MOLECULE: PHOSPHATIDYLINOSITOL 4,5-BISPHOSPHATE 3-KINASE CA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.L.SHAFFER,J.TANG,P.YAKOWEC . 819 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35528.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 555 67.8 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 . 113 13.8 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 . 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 . 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 . 52 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 289 35.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 4 2 2 1 3 3 2 2 4 1 1 1 0 1 2 1 0 0 0 0 0 1 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 4 3 2 3 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 145 A E 0 0 100 0, 0.0 4,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -54.4 28.8 -24.6 -1.9 2 146 A E > + 0 0 159 2,-0.2 4,-1.1 3,-0.1 5,-0.1 0.743 360.0 47.4 -93.4 -33.5 26.7 -24.5 1.2 3 147 A S H > S+ 0 0 92 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.860 112.5 49.5 -72.6 -38.9 29.7 -24.2 3.5 4 148 A Q H > S+ 0 0 50 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.751 109.7 51.7 -72.0 -27.1 31.2 -21.5 1.3 5 149 A A H > S+ 0 0 42 -4,-0.3 4,-1.1 2,-0.2 -1,-0.2 0.774 106.6 53.9 -78.1 -30.2 27.9 -19.5 1.3 6 150 A F H X S+ 0 0 47 -4,-1.1 4,-1.9 2,-0.2 -2,-0.2 0.811 104.3 55.8 -70.6 -33.1 27.8 -19.7 5.1 7 151 A Q H X S+ 0 0 26 -4,-1.2 4,-2.5 2,-0.2 -2,-0.2 0.844 104.6 52.4 -67.4 -36.1 31.3 -18.2 5.2 8 152 A R H X S+ 0 0 162 -4,-0.9 4,-1.7 2,-0.2 -1,-0.2 0.826 107.0 53.4 -67.8 -33.7 30.1 -15.2 3.1 9 153 A Q H X S+ 0 0 76 -4,-1.1 4,-1.6 2,-0.2 -2,-0.2 0.925 110.8 45.9 -63.8 -46.7 27.3 -14.8 5.7 10 154 A L H X S+ 0 0 0 -4,-1.9 4,-3.3 2,-0.2 5,-0.3 0.904 110.5 53.1 -62.3 -43.4 29.8 -14.7 8.5 11 155 A T H X S+ 0 0 35 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.845 109.8 49.1 -59.7 -36.1 32.0 -12.3 6.5 12 156 A A H < S+ 0 0 63 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.786 115.0 44.5 -73.3 -30.1 29.0 -10.0 6.1 13 157 A L H < S+ 0 0 2 -4,-1.6 -2,-0.2 -5,-0.1 -1,-0.2 0.865 120.5 39.5 -78.4 -40.7 28.3 -10.2 9.8 14 158 A I H < S- 0 0 1 -4,-3.3 -2,-0.2 2,-0.2 -3,-0.2 0.903 95.0-137.6 -75.2 -44.9 31.9 -9.7 10.8 15 159 A G S < S+ 0 0 52 -4,-2.5 2,-0.3 -5,-0.3 -3,-0.1 0.487 78.3 76.6 90.6 6.7 32.8 -7.1 8.2 16 160 A Y S S- 0 0 38 -5,-0.3 2,-0.9 -6,-0.2 -1,-0.2 -0.983 81.4-122.7-148.3 138.3 36.1 -8.8 7.6 17 161 A D > - 0 0 60 -2,-0.3 3,-1.1 1,-0.2 -9,-0.1 -0.720 19.7-170.9 -83.9 107.2 37.1 -11.9 5.7 18 162 A V T 3 S+ 0 0 12 -2,-0.9 -1,-0.2 1,-0.2 15,-0.1 0.673 83.3 63.8 -69.8 -18.9 38.9 -14.2 8.1 19 163 A T T 3 S+ 0 0 61 -12,-0.1 -1,-0.2 -3,-0.1 -2,-0.1 0.598 76.3 115.7 -82.8 -12.2 39.9 -16.6 5.3 20 164 A D < + 0 0 58 -3,-1.1 -4,-0.0 1,-0.1 0, 0.0 -0.322 37.0 176.2 -58.2 135.2 42.1 -13.8 3.7 21 165 A V > + 0 0 104 1,-0.1 3,-0.6 3,-0.0 -1,-0.1 0.114 53.1 98.8-130.1 18.1 45.8 -14.6 3.7 22 166 A S T 3 S+ 0 0 77 1,-0.2 2,-0.1 3,-0.0 -1,-0.1 0.733 86.0 47.9 -76.8 -24.3 47.1 -11.6 1.8 23 167 A N T 3 S+ 0 0 7 263,-0.0 260,-0.3 2,-0.0 2,-0.3 -0.416 94.1 89.7-118.4 54.9 48.2 -9.9 5.1 24 168 A V < - 0 0 50 -3,-0.6 3,-0.1 -2,-0.1 258,-0.0 -0.983 43.8-171.2-142.4 154.2 50.0 -12.7 7.0 25 169 A H S S+ 0 0 60 -2,-0.3 2,-0.2 238,-0.0 -1,-0.1 0.292 84.1 17.5-121.8 -0.2 53.6 -13.9 7.3 26 170 A D S S- 0 0 39 227,-0.0 3,-0.2 0, 0.0 4,-0.1 -0.802 84.3-101.3-149.2-167.1 52.7 -17.0 9.3 27 171 A D S > S+ 0 0 59 -2,-0.2 4,-2.8 1,-0.1 5,-0.2 0.054 73.5 121.1-115.1 24.7 49.6 -19.1 10.2 28 172 A E H > S+ 0 0 5 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.898 77.3 46.4 -55.4 -49.1 48.9 -17.7 13.7 29 173 A L H > S+ 0 0 22 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.903 115.4 46.2 -61.8 -44.2 45.3 -16.5 12.8 30 174 A E H > S+ 0 0 67 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.843 112.3 51.5 -67.5 -36.1 44.5 -19.8 11.1 31 175 A F H X S+ 0 0 61 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.827 111.5 48.3 -65.9 -35.1 46.0 -21.7 14.0 32 176 A T H X S+ 0 0 2 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.894 107.9 53.4 -73.9 -43.2 43.8 -19.6 16.3 33 177 A R H < S+ 0 0 41 -4,-2.6 3,-0.4 1,-0.2 4,-0.4 0.950 116.3 40.0 -51.8 -52.7 40.6 -20.2 14.3 34 178 A R H >< S+ 0 0 133 -4,-2.1 3,-0.9 1,-0.2 4,-0.4 0.854 112.9 56.1 -65.3 -38.4 41.3 -24.0 14.5 35 179 A G H 3< S+ 0 0 21 -4,-2.0 3,-0.2 1,-0.2 -1,-0.2 0.722 102.8 55.1 -68.3 -23.4 42.4 -23.7 18.2 36 180 A L T 3X S+ 0 0 3 -4,-1.6 4,-1.7 -3,-0.4 -1,-0.2 0.530 83.5 85.1 -90.1 -7.3 39.1 -22.0 19.2 37 181 A V H <> S+ 0 0 38 -3,-0.9 4,-2.9 -4,-0.4 5,-0.2 0.924 90.5 50.0 -57.6 -47.9 36.9 -24.8 17.9 38 182 A T H > S+ 0 0 104 -4,-0.4 4,-3.0 -3,-0.2 5,-0.2 0.960 110.8 44.9 -56.7 -60.2 37.3 -26.8 21.1 39 183 A P H > S+ 0 0 26 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.789 116.1 50.6 -59.6 -27.0 36.4 -24.1 23.6 40 184 A R H X S+ 0 0 7 -4,-1.7 4,-2.2 2,-0.2 3,-0.5 0.962 113.6 41.7 -70.4 -55.2 33.5 -23.1 21.4 41 185 A M H X S+ 0 0 94 -4,-2.9 4,-2.0 1,-0.2 5,-0.2 0.845 110.8 59.2 -61.4 -35.3 32.1 -26.6 21.1 42 186 A A H X S+ 0 0 57 -4,-3.0 4,-1.2 -5,-0.2 -1,-0.2 0.843 111.2 39.2 -63.9 -37.1 32.8 -27.3 24.8 43 187 A E H X S+ 0 0 18 -4,-1.0 4,-1.6 -3,-0.5 -2,-0.2 0.868 112.3 55.4 -81.2 -39.6 30.5 -24.4 25.9 44 188 A V H < S+ 0 0 34 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.868 112.8 45.0 -58.8 -38.4 27.8 -25.0 23.3 45 189 A A H < S+ 0 0 86 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.873 114.6 47.3 -71.4 -39.1 27.5 -28.5 24.6 46 190 A S H < S+ 0 0 81 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.628 87.9 100.6 -84.2 -16.2 27.6 -27.6 28.3 47 191 A R S < S- 0 0 28 -4,-1.6 3,-0.0 1,-0.1 396,-0.0 -0.468 79.8-112.1 -76.8 141.5 25.0 -24.8 28.3 48 192 A D > - 0 0 88 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.630 23.5-146.5 -74.4 116.2 21.4 -25.4 29.5 49 193 A P H > S+ 0 0 74 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.866 93.2 45.7 -51.0 -49.0 19.2 -25.0 26.3 50 194 A K H > S+ 0 0 41 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.893 115.6 44.1 -66.9 -45.5 16.1 -23.6 28.1 51 195 A L H > S+ 0 0 79 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.805 112.5 53.8 -70.5 -30.9 18.0 -21.0 30.3 52 196 A Y H < S+ 0 0 7 -4,-2.4 392,-0.3 2,-0.2 -2,-0.2 0.835 109.3 49.4 -69.0 -34.6 20.1 -20.0 27.3 53 197 A A H < S+ 0 0 8 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.914 118.5 36.5 -69.7 -44.9 17.0 -19.4 25.2 54 198 A M H < S- 0 0 17 -4,-1.9 67,-0.7 -5,-0.1 -2,-0.2 0.615 88.9-159.3 -87.0 -14.1 15.3 -17.2 27.9 55 199 A H < - 0 0 26 -4,-1.4 -3,-0.1 -5,-0.2 66,-0.1 0.814 10.3-150.4 37.7 57.2 18.5 -15.6 29.0 56 200 A P - 0 0 24 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 -0.307 3.5-141.0 -58.4 134.2 17.3 -14.4 32.5 57 201 A W + 0 0 71 64,-0.5 75,-2.0 388,-0.0 76,-0.4 -0.857 38.7 158.0-101.9 103.6 19.2 -11.2 33.5 58 202 A V B -A 131 0A 43 -2,-0.8 2,-0.3 73,-0.2 351,-0.3 -0.801 31.3-152.5-128.3 161.8 19.9 -11.6 37.2 59 203 A T - 0 0 7 71,-2.5 -2,-0.0 -2,-0.3 349,-0.0 -0.974 10.8-158.5-131.4 148.9 22.2 -10.3 40.0 60 204 A S + 0 0 84 -2,-0.3 3,-0.1 2,-0.1 -1,-0.1 0.341 61.6 113.7-104.0 3.0 23.3 -12.0 43.3 61 205 A K S S- 0 0 47 1,-0.1 -2,-0.1 69,-0.1 2,-0.1 -0.367 77.5 -96.1 -71.0 151.2 24.1 -8.6 44.9 62 206 A P - 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.407 42.6-102.2 -66.8 146.0 22.1 -7.4 47.9 63 207 A L - 0 0 16 1,-0.1 5,-0.1 -2,-0.1 67,-0.1 -0.549 45.4-112.3 -67.8 128.3 19.2 -5.0 47.2 64 208 A P >> - 0 0 6 0, 0.0 4,-1.3 0, 0.0 3,-0.8 -0.173 21.6-110.5 -65.3 159.7 20.3 -1.4 48.0 65 209 A E H 3> S+ 0 0 58 1,-0.2 4,-1.2 544,-0.2 5,-0.1 0.811 113.8 57.6 -62.2 -36.7 18.8 0.5 51.0 66 210 A Y H 34 S+ 0 0 57 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.791 106.8 49.5 -67.0 -29.1 17.0 3.1 48.8 67 211 A L H <4 S+ 0 0 7 -3,-0.8 3,-0.5 2,-0.2 -1,-0.2 0.814 106.5 54.8 -77.6 -33.1 15.1 0.3 47.0 68 212 A W H >< S+ 0 0 96 -4,-1.3 3,-0.7 1,-0.2 -2,-0.2 0.770 103.8 56.9 -68.2 -26.7 14.1 -1.3 50.3 69 213 A K T 3< S+ 0 0 86 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.706 101.2 57.5 -74.6 -21.7 12.6 2.0 51.4 70 214 A K T 3 S+ 0 0 120 -3,-0.5 2,-0.5 -4,-0.4 -1,-0.2 0.384 96.3 73.6 -90.9 1.7 10.4 2.0 48.2 71 215 A I < - 0 0 29 -3,-0.7 3,-0.3 -4,-0.1 2,-0.3 -0.974 66.0-168.2-120.7 120.9 8.7 -1.4 49.2 72 216 A A > + 0 0 73 -2,-0.5 3,-1.2 3,-0.4 -3,-0.0 -0.769 64.0 14.4-110.7 153.1 6.2 -1.5 52.0 73 217 A N T 3 S- 0 0 164 -2,-0.3 -1,-0.2 1,-0.2 3,-0.1 0.738 116.1 -81.9 57.9 28.8 4.6 -4.4 53.9 74 218 A N T 3 S+ 0 0 95 -3,-0.3 2,-0.4 1,-0.2 -1,-0.2 0.858 101.7 125.3 45.4 43.7 7.3 -6.8 52.5 75 219 A C < - 0 0 29 -3,-1.2 2,-0.4 17,-0.2 -3,-0.4 -0.993 43.6-170.1-140.5 127.2 5.1 -6.9 49.3 76 220 A I E -B 91 0B 11 15,-3.3 15,-2.6 -2,-0.4 2,-0.4 -0.957 20.4-135.6-116.7 137.8 5.7 -6.2 45.6 77 221 A F E -B 90 0B 127 -2,-0.4 67,-0.8 13,-0.2 2,-0.4 -0.754 18.1-174.0 -97.8 137.5 2.9 -6.0 43.1 78 222 A I E -Bc 89 144B 9 11,-1.4 11,-2.0 -2,-0.4 2,-0.6 -0.990 16.0-146.2-132.5 122.6 3.0 -7.7 39.7 79 223 A V E -Bc 88 145B 13 65,-2.4 67,-2.9 -2,-0.4 2,-0.5 -0.799 17.0-157.4 -89.5 117.0 0.4 -7.3 36.9 80 224 A I E -Bc 87 146B 2 7,-2.9 7,-1.9 -2,-0.6 2,-0.3 -0.861 8.2-159.8-102.5 124.2 0.0 -10.5 34.9 81 225 A H E +Bc 86 147B 51 65,-3.1 67,-2.6 -2,-0.5 2,-0.2 -0.733 17.3 171.9-105.6 148.8 -1.4 -10.2 31.4 82 226 A R E > -B 85 0B 30 3,-1.8 3,-2.2 -2,-0.3 2,-1.5 -0.781 65.0 -57.1-156.8 110.2 -3.1 -12.8 29.2 83 227 A S T 3 S- 0 0 143 1,-0.3 3,-0.0 -2,-0.2 -2,-0.0 -0.376 124.3 -13.4 58.8 -84.4 -4.8 -11.9 25.9 84 228 A T T 3 S+ 0 0 96 -2,-1.5 2,-0.4 1,-0.0 -1,-0.3 0.273 122.4 74.7-132.3 6.6 -7.4 -9.4 27.1 85 229 A T E < -B 82 0B 107 -3,-2.2 -3,-1.8 2,-0.0 2,-0.4 -0.974 50.9-176.1-128.9 141.2 -7.4 -9.8 30.9 86 230 A S E -B 81 0B 71 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.999 2.1-170.5-139.4 137.4 -4.9 -8.8 33.6 87 231 A Q E -B 80 0B 45 -7,-1.9 -7,-2.9 -2,-0.4 2,-0.5 -0.947 19.6-129.6-128.8 147.7 -4.7 -9.4 37.4 88 232 A T E -B 79 0B 91 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.829 23.9-166.4 -98.1 129.1 -2.6 -8.0 40.2 89 233 A I E -B 78 0B 32 -11,-2.0 -11,-1.4 -2,-0.5 2,-0.6 -0.959 21.6-127.0-121.0 131.6 -0.9 -10.5 42.6 90 234 A K E -B 77 0B 70 -2,-0.4 2,-0.4 -13,-0.2 -13,-0.2 -0.657 36.3-176.0 -74.5 118.1 0.8 -9.7 45.9 91 235 A V E -B 76 0B 3 -15,-2.6 -15,-3.3 -2,-0.6 -2,-0.0 -0.960 22.7-130.4-124.5 133.8 4.3 -11.2 45.7 92 236 A S > - 0 0 38 -2,-0.4 3,-2.0 -17,-0.2 36,-0.3 -0.554 28.9-115.4 -77.3 147.6 7.0 -11.5 48.4 93 237 A P T 3 S+ 0 0 4 0, 0.0 36,-1.7 0, 0.0 37,-0.2 0.700 114.9 54.0 -56.1 -21.1 10.5 -10.3 47.5 94 238 A D T 3 S+ 0 0 99 33,-0.2 2,-0.1 34,-0.1 -3,-0.0 0.516 80.7 121.6 -92.4 -7.5 11.8 -13.8 47.9 95 239 A D < - 0 0 56 -3,-2.0 33,-1.9 32,-0.1 34,-0.1 -0.347 55.7-137.6 -67.8 132.5 9.3 -15.6 45.6 96 240 A T >> - 0 0 37 31,-0.2 4,-2.2 -2,-0.1 3,-1.7 -0.693 20.5-120.2 -87.1 138.0 10.6 -17.6 42.7 97 241 A P H 3> S+ 0 0 6 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.745 115.6 59.1 -44.7 -31.4 8.8 -17.3 39.2 98 242 A G H 3> S+ 0 0 43 26,-0.3 4,-0.5 2,-0.2 27,-0.1 0.841 110.1 40.9 -67.5 -36.2 8.1 -21.0 39.5 99 243 A A H <> S+ 0 0 50 -3,-1.7 4,-0.8 2,-0.2 -1,-0.2 0.808 112.7 53.9 -80.9 -34.1 6.2 -20.5 42.7 100 244 A I H X S+ 0 0 6 -4,-2.2 4,-1.3 1,-0.2 3,-0.3 0.832 104.2 56.1 -68.6 -34.1 4.4 -17.3 41.6 101 245 A L H < S+ 0 0 23 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.756 101.3 57.6 -70.7 -26.0 3.1 -19.2 38.5 102 246 A Q H >X S+ 0 0 98 -4,-0.5 4,-0.9 1,-0.2 3,-0.7 0.767 102.1 55.2 -72.4 -28.4 1.6 -21.8 40.8 103 247 A S H 3X S+ 0 0 54 -4,-0.8 4,-2.0 -3,-0.3 2,-0.7 0.848 103.7 54.7 -69.7 -36.9 -0.4 -18.9 42.4 104 248 A F H 3< S+ 0 0 52 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.1 -0.341 111.0 47.4 -89.2 49.4 -1.7 -18.0 38.9 105 249 A F H <4 S+ 0 0 66 -3,-0.7 -2,-0.2 -2,-0.7 -1,-0.2 0.256 115.4 40.0-156.0 -26.4 -2.9 -21.6 38.6 106 250 A T H < S+ 0 0 115 -4,-0.9 -2,-0.2 -3,-0.3 -3,-0.1 0.784 118.0 45.9 -95.7 -40.3 -4.7 -22.1 42.0 107 251 A K < 0 0 79 -4,-2.0 -3,-0.1 1,-0.2 -4,-0.1 0.469 360.0 360.0 -83.7 -3.1 -6.3 -18.6 42.2 108 252 A M 0 0 110 -5,-0.1 -1,-0.2 0, 0.0 -2,-0.1 -0.198 360.0 360.0 55.7 360.0 -7.5 -18.9 38.5 109 ! 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 0.0 110 269 A D 0 0 165 0, 0.0 2,-0.1 0, 0.0 -9,-0.0 0.000 360.0 360.0 360.0 149.4 3.7 -24.9 31.9 111 270 A F - 0 0 108 39,-0.1 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0 0 0 -4,-2.4 7,-0.3 2,-0.2 -2,-0.2 0.885 114.4 44.6 -56.5 -44.0 60.6 -7.0 46.0 331 576 A W H >< S+ 0 0 39 -4,-2.2 3,-1.8 1,-0.2 -1,-0.2 0.937 110.0 52.2 -69.5 -49.4 62.4 -9.9 44.2 332 577 A H H 3< S+ 0 0 131 -4,-1.6 3,-0.2 1,-0.3 -1,-0.2 0.859 119.9 37.4 -55.4 -37.3 64.7 -10.8 47.0 333 578 A F T 3X S+ 0 0 42 -4,-1.9 4,-1.8 1,-0.2 3,-0.5 -0.288 77.6 134.2-109.0 45.4 61.7 -11.1 49.2 334 579 A R H <> + 0 0 42 -3,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.800 67.2 58.1 -64.2 -31.6 59.3 -12.5 46.7 335 580 A Y H 4 S+ 0 0 129 -3,-0.2 4,-0.2 2,-0.2 -1,-0.2 0.786 110.2 42.3 -74.4 -27.9 58.0 -15.2 49.0 336 581 A E H >4 S+ 0 0 26 -3,-0.5 3,-0.6 2,-0.2 -1,-0.2 0.780 114.2 53.3 -80.9 -31.9 56.8 -12.6 51.5 337 582 A S H >< S+ 0 0 0 -4,-1.8 3,-1.5 -7,-0.3 6,-0.3 0.808 99.2 63.0 -68.1 -32.4 55.6 -10.5 48.6 338 583 A L T 3< S+ 0 0 13 -4,-1.9 -1,-0.2 1,-0.3 34,-0.2 0.698 91.6 66.6 -66.5 -20.6 53.6 -13.6 47.4 339 584 A K T < S+ 0 0 97 -3,-0.6 -1,-0.3 -4,-0.2 -2,-0.2 0.573 94.2 65.7 -77.8 -11.2 51.6 -13.4 50.6 340 585 A H X> - 0 0 69 -3,-1.5 3,-1.9 -4,-0.1 4,-0.5 -0.929 64.4-164.2-116.7 107.1 50.0 -10.0 49.5 341 586 A P G >4 S+ 0 0 31 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.845 91.0 62.8 -54.7 -35.3 47.8 -10.2 46.5 342 587 A K G 34 S+ 0 0 139 1,-0.3 4,-0.3 2,-0.1 -5,-0.0 0.657 97.8 57.7 -64.9 -17.5 48.1 -6.4 46.1 343 588 A A G X> S+ 0 0 0 -3,-1.9 4,-2.6 -6,-0.3 3,-0.5 0.655 79.0 94.5 -84.7 -17.9 51.8 -6.8 45.5 344 589 A Y H < S+ 0 0 0 -4,-2.6 3,-1.2 1,-0.2 4,-0.2 0.919 109.8 47.6 -67.3 -45.1 56.3 -8.2 42.0 348 593 A F T 3< S+ 0 0 1 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.496 107.3 58.0 -78.7 -3.5 56.0 -9.4 38.4 349 594 A S T 3 S+ 0 0 43 -4,-0.4 -1,-0.3 -3,-0.3 -2,-0.2 0.452 98.0 60.8 -97.3 -7.8 57.4 -6.0 37.2 350 595 A S S < S+ 0 0 13 -3,-1.2 2,-0.3 -4,-0.3 -2,-0.2 0.438 82.5 110.6 -93.6 -3.9 60.6 -6.7 39.3 351 596 A V - 0 0 11 -4,-0.2 2,-1.3 1,-0.1 3,-0.1 -0.578 69.3-137.8 -77.2 127.3 61.2 -9.8 37.2 352 597 A K > - 0 0 142 -2,-0.3 3,-0.8 1,-0.2 7,-0.3 -0.751 24.6-176.2 -80.0 92.9 64.2 -9.7 34.8 353 598 A W T 3 S+ 0 0 24 -2,-1.3 -1,-0.2 1,-0.3 6,-0.1 0.621 71.5 72.5 -71.0 -14.5 62.3 -11.4 32.0 354 599 A G T 3 S+ 0 0 23 -127,-0.1 2,-0.4 -3,-0.1 -1,-0.3 0.026 85.3 79.6 -88.9 27.3 65.4 -11.5 29.8 355 600 A Q X> - 0 0 86 -3,-0.8 4,-2.2 1,-0.1 3,-0.6 -0.930 65.9-154.5-141.9 112.5 66.9 -14.2 32.0 356 601 A Q H 3> S+ 0 0 108 -2,-0.4 4,-1.7 1,-0.2 -1,-0.1 0.849 95.3 49.6 -54.4 -45.4 65.9 -17.9 31.6 357 602 A E H 3> S+ 0 0 52 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.814 111.4 49.5 -65.9 -33.9 66.8 -18.9 35.2 358 603 A I H <> S+ 0 0 22 -3,-0.6 4,-1.8 2,-0.2 -2,-0.2 0.934 109.7 49.3 -71.6 -48.6 64.9 -16.0 36.7 359 604 A V H X S+ 0 0 14 -4,-2.2 4,-1.9 -7,-0.3 -2,-0.2 0.849 108.6 56.2 -58.2 -36.0 61.7 -16.6 34.7 360 605 A A H X S+ 0 0 44 -4,-1.7 4,-2.0 -5,-0.3 -1,-0.2 0.910 107.1 47.4 -61.2 -45.0 62.0 -20.3 35.8 361 606 A K H X S+ 0 0 99 -4,-1.5 4,-1.2 1,-0.2 -2,-0.2 0.800 109.4 55.5 -64.9 -31.4 62.0 -19.2 39.5 362 607 A T H X S+ 0 0 0 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.851 108.9 45.8 -70.2 -38.1 59.0 -17.0 38.7 363 608 A Y H X S+ 0 0 79 -4,-1.9 4,-0.7 2,-0.2 -2,-0.2 0.836 111.3 52.3 -72.4 -34.5 57.1 -20.0 37.4 364 609 A Q H < S+ 0 0 58 -4,-2.0 -2,-0.2 1,-0.2 4,-0.2 0.790 108.6 52.8 -66.8 -29.1 58.2 -22.0 40.4 365 610 A L H >< S+ 0 0 0 -4,-1.2 3,-1.4 1,-0.2 -2,-0.2 0.871 104.2 53.8 -73.1 -40.1 56.8 -19.0 42.5 366 611 A L H 3< S+ 0 0 10 -4,-1.7 3,-0.5 1,-0.3 -1,-0.2 0.631 94.0 71.7 -69.4 -16.2 53.4 -19.2 40.7 367 612 A A T 3< S+ 0 0 88 -4,-0.7 2,-0.4 1,-0.3 -1,-0.3 0.674 93.2 58.6 -70.3 -18.7 53.2 -22.9 41.6 368 613 A R < + 0 0 51 -3,-1.4 3,-0.4 -4,-0.2 -1,-0.3 -0.511 64.2 140.6-108.4 61.1 52.7 -21.7 45.2 369 614 A R > + 0 0 69 -3,-0.5 4,-3.0 -2,-0.4 5,-0.3 0.015 20.9 126.6 -93.4 27.8 49.5 -19.6 44.6 370 615 A E H > S+ 0 0 61 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.894 78.2 39.2 -52.5 -48.3 47.8 -20.6 47.8 371 616 A V H > S+ 0 0 62 -3,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.921 117.1 49.0 -70.8 -46.5 47.1 -17.0 48.9 372 617 A W H 4 S+ 0 0 3 -34,-0.2 3,-0.4 1,-0.2 -2,-0.2 0.930 112.0 48.6 -57.6 -50.5 46.2 -15.6 45.5 373 618 A D H < S+ 0 0 69 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.874 115.3 43.9 -58.4 -41.6 43.8 -18.4 44.7 374 619 A Q H < S+ 0 0 162 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.658 91.5 106.2 -82.0 -17.4 42.0 -18.1 48.0 375 620 A S S < S- 0 0 29 -4,-1.4 3,-0.1 -3,-0.4 2,-0.1 -0.318 80.7-102.4 -66.5 143.4 41.8 -14.3 48.0 376 621 A A - 0 0 93 1,-0.1 2,-0.1 -2,-0.0 -1,-0.1 -0.371 52.2 -88.2 -62.7 144.4 38.5 -12.5 47.3 377 622 A L - 0 0 55 25,-0.1 2,-0.5 -3,-0.1 -1,-0.1 -0.335 39.4-171.8 -64.6 127.1 38.3 -11.2 43.8 378 623 A D > - 0 0 69 1,-0.2 4,-2.6 -2,-0.1 5,-0.2 -0.939 5.3-168.6-118.6 104.7 39.6 -7.7 43.2 379 624 A V H > S+ 0 0 19 -2,-0.5 4,-3.4 1,-0.2 5,-0.2 0.911 87.7 54.7 -58.2 -46.5 38.7 -6.6 39.6 380 625 A G H > S+ 0 0 1 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.903 112.5 42.5 -53.2 -48.0 41.1 -3.5 39.8 381 626 A L H > S+ 0 0 12 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.888 114.8 50.7 -64.6 -42.6 44.0 -5.7 40.7 382 627 A T H < S+ 0 0 1 -4,-2.6 4,-0.3 1,-0.2 -2,-0.2 0.877 107.8 53.4 -65.4 -39.7 43.0 -8.3 38.1 383 628 A M H >< S+ 0 0 0 -4,-3.4 3,-1.5 1,-0.2 4,-0.3 0.862 101.1 62.0 -59.5 -39.1 42.8 -5.6 35.5 384 629 A Q H >< S+ 0 0 12 -4,-1.5 3,-1.4 1,-0.3 5,-0.3 0.903 99.7 52.7 -55.6 -46.0 46.3 -4.5 36.3 385 630 A L T 3< S+ 0 0 0 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.504 106.1 56.2 -71.9 -5.0 47.8 -7.8 35.3 386 631 A L T < S+ 0 0 0 -3,-1.5 -1,-0.3 -4,-0.3 38,-0.2 0.386 88.6 96.5-106.2 1.5 46.1 -7.7 31.9 387 632 A D S X S- 0 0 4 -3,-1.4 3,-1.6 -4,-0.3 -3,-0.0 -0.095 96.1 -80.4 -84.0-173.3 47.5 -4.3 30.7 388 633 A C T 3 S+ 0 0 7 1,-0.3 -1,-0.1 3,-0.0 -3,-0.1 0.633 118.1 73.9 -63.9 -16.8 50.5 -3.5 28.5 389 634 A N T 3 S+ 0 0 79 -5,-0.3 2,-0.5 1,-0.1 -1,-0.3 0.559 91.5 61.5 -75.0 -9.1 53.0 -4.0 31.3 390 635 A F < + 0 0 10 -3,-1.6 -196,-0.1 1,-0.1 -1,-0.1 -0.960 43.7 159.8-130.7 116.5 52.6 -7.8 31.3 391 636 A S + 0 0 16 -2,-0.5 2,-0.4 34,-0.1 -1,-0.1 0.538 44.6 110.7-105.6 -14.2 53.5 -10.0 28.3 392 637 A D > - 0 0 2 1,-0.1 4,-2.6 -199,-0.1 5,-0.2 -0.523 58.8-148.7 -75.9 125.1 53.8 -13.3 30.1 393 638 A E H > S+ 0 0 59 -2,-0.4 4,-2.3 -164,-0.2 -1,-0.1 0.864 96.8 47.3 -57.7 -43.4 51.1 -15.9 29.4 394 639 A N H > S+ 0 0 77 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.899 111.8 49.0 -70.2 -42.6 51.2 -17.5 32.8 395 640 A V H > S+ 0 0 0 1,-0.2 4,-0.8 2,-0.2 3,-0.4 0.958 115.8 44.8 -56.9 -51.1 51.2 -14.2 34.7 396 641 A R H >X S+ 0 0 3 -4,-2.6 4,-2.0 1,-0.2 3,-0.8 0.868 107.1 60.4 -62.9 -38.0 48.2 -13.1 32.6 397 642 A A H 3X S+ 0 0 37 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.844 97.6 57.5 -59.0 -38.0 46.5 -16.4 33.0 398 643 A I H 3X S+ 0 0 3 -4,-1.5 4,-0.9 -3,-0.4 -1,-0.2 0.777 107.6 49.7 -67.6 -25.2 46.3 -16.1 36.8 399 644 A A H XX S+ 0 0 0 -3,-0.8 4,-1.4 -4,-0.8 3,-0.9 0.947 108.1 50.3 -72.7 -52.0 44.4 -12.9 36.3 400 645 A V H 3X S+ 0 0 4 -4,-2.0 4,-0.7 1,-0.3 -2,-0.2 0.806 105.5 60.3 -56.4 -30.8 41.9 -14.4 33.8 401 646 A Q H >< S+ 0 0 76 -4,-1.9 3,-0.6 1,-0.2 4,-0.4 0.877 102.8 50.3 -61.9 -40.6 41.4 -17.2 36.5 402 647 A K H X< S+ 0 0 20 -3,-0.9 3,-0.8 -4,-0.9 -2,-0.2 0.808 104.6 58.0 -68.8 -30.4 40.2 -14.5 38.9 403 648 A L H >< S+ 0 0 0 -4,-1.4 3,-1.5 1,-0.2 -1,-0.2 0.678 87.9 78.4 -70.7 -19.2 37.7 -13.2 36.3 404 649 A E T << S+ 0 0 72 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.796 87.0 57.3 -61.0 -30.7 36.1 -16.6 36.1 405 650 A S T < S+ 0 0 87 -3,-0.8 -1,-0.3 -4,-0.4 2,-0.2 0.514 80.4 112.3 -83.8 -5.6 34.2 -16.1 39.3 406 651 A L < - 0 0 8 -3,-1.5 2,-0.1 -4,-0.1 -3,-0.0 -0.486 67.4-129.9 -64.1 131.9 32.5 -12.9 38.0 407 652 A E >> - 0 0 49 -2,-0.2 4,-2.2 1,-0.1 3,-0.8 -0.428 28.9-100.8 -77.2 162.1 28.8 -13.4 37.5 408 653 A D H 3> S+ 0 0 47 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.809 123.3 58.9 -54.6 -34.4 27.2 -12.4 34.1 409 654 A D H 3> S+ 0 0 5 -351,-0.3 4,-0.7 1,-0.2 -1,-0.3 0.895 110.1 41.7 -60.0 -44.0 26.0 -9.2 35.7 410 655 A D H <> S+ 0 0 33 -3,-0.8 4,-1.2 2,-0.2 -2,-0.2 0.805 108.2 59.6 -75.8 -32.3 29.6 -8.2 36.6 411 656 A V H >X S+ 0 0 0 -4,-2.2 4,-1.5 1,-0.2 3,-0.7 0.939 101.8 55.2 -60.5 -45.3 31.0 -9.3 33.2 412 657 A L H 3< S+ 0 0 24 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.807 103.7 56.4 -55.6 -33.9 28.7 -6.9 31.5 413 658 A H H 3< S+ 0 0 34 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.845 121.4 25.6 -67.2 -35.1 30.1 -4.1 33.6 414 659 A Y H S+ 0 0 7 -4,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.934 115.1 43.1 -59.8 -50.2 34.0 -3.4 27.0 417 662 A Q H > S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.890 112.7 54.4 -63.1 -39.8 37.4 -2.9 28.8 418 663 A L H < S+ 0 0 0 -4,-2.8 4,-0.3 2,-0.2 -1,-0.2 0.857 108.8 48.2 -62.2 -37.5 38.0 -6.6 28.8 419 664 A V H >< S+ 0 0 0 -4,-2.3 3,-1.3 -5,-0.2 4,-0.3 0.923 112.7 47.7 -66.2 -45.1 37.5 -6.7 25.0 420 665 A Q H >< S+ 0 0 5 -4,-2.3 3,-1.5 1,-0.3 -2,-0.2 0.801 101.2 67.4 -64.5 -28.7 39.9 -3.7 24.7 421 666 A A G >< S+ 0 0 0 -4,-2.0 3,-1.2 1,-0.3 -1,-0.3 0.646 82.6 74.9 -66.6 -16.4 42.3 -5.6 27.0 422 667 A V G X S+ 0 0 0 -3,-1.3 3,-1.4 -4,-0.3 -1,-0.3 0.767 80.7 71.4 -66.2 -25.6 42.8 -8.1 24.2 423 668 A K G < S+ 0 0 2 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.2 0.741 94.3 54.6 -62.0 -23.1 44.9 -5.5 22.4 424 669 A F G < S+ 0 0 10 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 0.549 82.8 108.6 -88.6 -9.5 47.6 -6.2 25.1 425 670 A E < 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0 0 2 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.903 109.7 46.0 -65.4 -44.7 37.2 -16.3 28.5 436 681 A L H X S+ 0 0 2 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.862 114.1 50.2 -67.1 -36.7 35.3 -13.7 26.5 437 682 A L H X S+ 0 0 0 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.940 111.2 48.3 -62.4 -50.5 34.3 -16.5 24.1 438 683 A K H X S+ 0 0 67 -4,-2.7 4,-1.2 1,-0.2 -2,-0.2 0.908 114.4 44.0 -57.6 -47.9 33.1 -18.7 26.9 439 684 A R H X S+ 0 0 7 -4,-2.3 4,-1.4 1,-0.2 8,-0.3 0.848 112.0 52.3 -72.0 -35.8 31.0 -16.1 28.6 440 685 A G H < S+ 0 0 0 -4,-1.8 7,-0.5 1,-0.2 -1,-0.2 0.825 111.7 46.6 -68.0 -34.5 29.5 -14.7 25.4 441 686 A L H < S+ 0 0 0 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.732 111.0 53.4 -78.1 -25.3 28.4 -18.2 24.4 442 687 A R H < S+ 0 0 87 -4,-1.2 2,-0.4 1,-0.2 -2,-0.2 0.795 115.9 35.9 -78.4 -30.8 27.0 -18.9 27.9 443 688 A N X - 0 0 19 -4,-1.4 4,-2.4 1,-0.1 -1,-0.2 -0.990 64.9-148.3-134.7 129.4 24.8 -15.8 28.0 444 689 A K H > S+ 0 0 32 -2,-0.4 4,-2.0 -392,-0.3 -1,-0.1 0.829 99.7 51.3 -65.1 -35.6 22.8 -14.1 25.2 445 690 A R H 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29.9 10.8 50.1 757 1016 A A H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.893 113.4 48.9 -78.4 -44.3 30.1 10.1 46.4 758 1017 A Y H X S+ 0 0 0 -4,-3.1 4,-1.8 1,-0.2 -2,-0.2 0.894 113.7 46.2 -63.0 -43.3 33.7 11.3 46.0 759 1018 A L H X S+ 0 0 23 -4,-2.9 4,-0.9 2,-0.2 -1,-0.2 0.808 108.7 57.1 -68.7 -31.9 35.0 9.4 49.0 760 1019 A A H < S+ 0 0 0 -4,-0.8 3,-0.2 -5,-0.3 -2,-0.2 0.871 108.5 45.8 -66.7 -39.5 33.1 6.3 47.7 761 1020 A L H >< S+ 0 0 0 -4,-1.8 3,-2.2 1,-0.2 7,-0.2 0.881 106.3 59.6 -67.7 -40.1 35.0 6.5 44.4 762 1021 A R H >< S+ 0 0 32 -4,-1.8 3,-1.2 1,-0.3 -1,-0.2 0.730 92.7 67.6 -62.0 -23.6 38.3 7.0 46.3 763 1022 A H T 3< S+ 0 0 108 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.642 105.9 42.8 -67.7 -15.2 37.6 3.6 48.0 764 1023 A H T <> S+ 0 0 64 -3,-2.2 4,-2.0 -4,-0.2 -1,-0.3 -0.221 75.5 138.2-123.3 41.7 38.2 2.2 44.6 765 1024 A T H <> + 0 0 20 -3,-1.2 4,-2.1 1,-0.2 5,-0.2 0.921 69.4 49.4 -53.6 -56.6 41.2 4.3 43.6 766 1025 A N H > S+ 0 0 54 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.919 110.7 50.0 -50.9 -53.3 43.3 1.5 42.0 767 1026 A L H > S+ 0 0 12 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.915 111.8 47.2 -53.1 -50.9 40.4 0.2 39.8 768 1027 A L H X S+ 0 0 4 -4,-2.0 4,-1.8 -7,-0.2 -1,-0.2 0.821 110.9 53.0 -64.1 -33.0 39.5 3.7 38.5 769 1028 A I H X S+ 0 0 0 -4,-2.1 4,-3.2 -5,-0.2 -1,-0.2 0.915 112.1 44.2 -66.5 -45.2 43.2 4.4 37.7 770 1029 A I H X S+ 0 0 4 -4,-2.4 4,-3.1 2,-0.2 5,-0.2 0.918 113.3 49.8 -67.1 -44.5 43.6 1.2 35.7 771 1030 A L H X S+ 0 0 0 -4,-2.7 4,-1.8 -5,-0.2 -1,-0.2 0.872 115.4 45.3 -60.6 -38.2 40.3 1.8 33.8 772 1031 A F H X S+ 0 0 10 -4,-1.8 4,-2.0 -5,-0.2 5,-0.2 0.958 112.7 49.2 -67.1 -54.5 41.5 5.3 33.1 773 1032 A S H X S+ 0 0 9 -4,-3.2 4,-1.2 1,-0.2 -2,-0.2 0.902 114.8 45.9 -50.4 -48.6 45.0 4.2 32.1 774 1033 A M H X S+ 0 0 2 -4,-3.1 4,-1.7 1,-0.2 5,-0.3 0.861 107.6 58.0 -63.8 -39.4 43.5 1.6 29.8 775 1034 A M H X>S+ 0 0 4 -4,-1.8 4,-2.1 -5,-0.2 5,-0.8 0.891 107.9 45.8 -59.4 -42.4 41.0 4.0 28.3 776 1035 A L H <5S+ 0 0 35 -4,-2.0 -1,-0.2 3,-0.2 4,-0.2 0.794 113.7 49.4 -72.6 -29.2 43.7 6.4 27.1 777 1036 A M H <5S+ 0 0 14 -4,-1.2 -501,-2.6 -5,-0.2 -500,-0.3 0.759 125.6 25.3 -81.0 -25.9 45.8 3.6 25.6 778 1037 A T H <5S+ 0 0 8 -4,-1.7 -2,-0.2 -503,-0.2 -3,-0.2 0.602 130.3 34.1-112.4 -18.1 42.9 1.9 23.7 779 1038 A G T <5 0 0 2 -4,-2.1 -3,-0.2 -5,-0.3 -186,-0.2 0.819 360.0 360.0-111.9 -45.0 40.5 4.8 23.1 780 1039 A M < 0 0 85 -5,-0.8 -1,-0.1 -4,-0.2 0, 0.0 -0.739 360.0 360.0 -88.4 360.0 42.2 8.2 22.6 781 ! 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 0.0 782 1044 A S >> 0 0 54 0, 0.0 4,-1.1 0, 0.0 3,-0.8 0.000 360.0 360.0 360.0 168.6 51.3 10.5 27.5 783 1045 A K H 3> + 0 0 154 1,-0.2 4,-1.6 2,-0.2 3,-0.1 0.826 360.0 58.4 -59.5 -35.2 52.3 9.6 31.1 784 1046 A E H 34 S+ 0 0 142 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.722 101.2 55.3 -70.3 -24.7 51.3 13.2 32.1 785 1047 A D H X4 S+ 0 0 98 -3,-0.8 3,-0.6 1,-0.2 4,-0.3 0.845 109.1 46.6 -74.2 -36.1 47.8 12.6 30.9 786 1048 A I H >< S+ 0 0 26 -4,-1.1 3,-1.1 1,-0.2 4,-0.4 0.831 101.7 65.1 -74.5 -34.0 47.3 9.5 33.0 787 1049 A E T 3X S+ 0 0 77 -4,-1.6 4,-1.1 1,-0.2 -1,-0.2 0.493 81.1 82.0 -72.8 -3.8 48.7 11.1 36.2 788 1050 A Y H <> S+ 0 0 96 -3,-0.6 4,-2.2 1,-0.2 -1,-0.2 0.901 86.5 55.4 -62.6 -43.0 45.8 13.6 36.3 789 1051 A I H <> S+ 0 0 2 -3,-1.1 4,-1.8 -4,-0.3 -1,-0.2 0.749 98.8 61.2 -68.2 -26.9 43.5 11.0 38.0 790 1052 A R H 4>S+ 0 0 56 -4,-0.4 5,-1.8 2,-0.2 -1,-0.2 0.947 110.8 39.5 -61.6 -50.0 46.0 10.5 40.9 791 1053 A D H ><5S+ 0 0 113 -4,-1.1 3,-1.3 1,-0.2 -2,-0.2 0.884 113.4 55.9 -66.0 -40.9 45.7 14.1 41.9 792 1054 A A H 3<5S+ 0 0 3 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.809 113.2 40.6 -62.6 -33.1 42.0 14.1 41.2 793 1055 A L T 3<5S- 0 0 0 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.242 108.3-130.1 -99.0 10.3 41.5 11.2 43.6 794 1056 A T T X 5 - 0 0 21 -3,-1.3 3,-1.5 1,-0.2 2,-0.2 0.865 25.7-156.1 41.5 58.6 44.0 12.7 46.1 795 1057 A V T 3 - 0 0 98 -2,-0.2 4,-2.6 -3,-0.1 5,-0.2 -0.383 30.4-100.0 -85.0 167.3 43.0 10.9 54.4 799 1061 A E H > S+ 0 0 97 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.873 121.1 48.8 -55.2 -46.6 39.2 11.1 54.2 800 1062 A E H > S+ 0 0 71 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.938 114.9 44.9 -59.5 -48.7 38.9 14.3 56.3 801 1063 A D H > S+ 0 0 102 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.850 114.9 48.7 -64.0 -37.4 41.6 16.0 54.2 802 1064 A A H X S+ 0 0 0 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.798 103.9 60.6 -73.3 -31.7 40.0 14.7 51.0 803 1065 A K H X S+ 0 0 21 -4,-2.2 4,-1.2 -5,-0.2 -2,-0.2 0.911 108.5 43.6 -60.3 -44.9 36.5 15.8 52.1 804 1066 A K H X S+ 0 0 47 -4,-1.5 4,-1.9 1,-0.2 -2,-0.2 0.862 105.6 64.1 -67.9 -38.3 37.7 19.5 52.3 805 1067 A Y H X S+ 0 0 68 -4,-1.4 4,-1.4 1,-0.2 -2,-0.2 0.896 107.9 39.5 -53.3 -48.4 39.6 19.1 48.9 806 1068 A F H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.797 110.8 58.6 -75.3 -29.7 36.4 18.6 46.9 807 1069 A L H X S+ 0 0 58 -4,-1.2 4,-1.4 2,-0.2 -2,-0.2 0.778 105.5 51.7 -66.8 -28.1 34.5 21.2 49.0 808 1070 A D H X S+ 0 0 96 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.891 106.0 53.7 -68.4 -43.4 37.2 23.6 47.8 809 1071 A Q H X S+ 0 0 34 -4,-1.4 4,-1.2 1,-0.2 -82,-0.2 0.841 107.8 50.2 -61.6 -36.6 36.5 22.5 44.2 810 1072 A I H X S+ 0 0 0 -4,-1.8 4,-1.2 1,-0.2 3,-0.2 0.901 109.3 51.7 -65.9 -42.4 32.8 23.3 44.7 811 1073 A E H X S+ 0 0 69 -4,-1.4 4,-1.2 1,-0.2 -2,-0.2 0.688 103.0 59.6 -69.0 -21.1 33.7 26.7 46.1 812 1074 A V H X S+ 0 0 53 -4,-1.3 4,-1.4 2,-0.2 -1,-0.2 0.880 102.6 52.6 -70.8 -39.8 35.9 27.3 43.0 813 1075 A C H X S+ 0 0 2 -4,-1.2 4,-1.6 -3,-0.2 -2,-0.2 0.821 110.4 47.2 -64.8 -34.3 32.8 26.9 40.8 814 1076 A R H < S+ 0 0 65 -4,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.792 112.6 49.5 -76.7 -30.2 30.9 29.6 42.9 815 1077 A D H < S+ 0 0 132 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.682 113.4 47.2 -79.8 -20.2 33.9 31.9 42.7 816 1078 A K H >< S+ 0 0 67 -4,-1.4 3,-1.7 1,-0.2 2,-0.2 0.803 82.0 167.0 -87.9 -35.2 34.2 31.4 38.9 817 1079 A G T 3< - 0 0 21 -4,-1.6 4,-0.3 1,-0.3 -1,-0.2 -0.369 69.2 -18.4 62.3-121.0 30.5 32.0 38.2 818 1080 A W T 3> S+ 0 0 43 -2,-0.2 4,-3.5 1,-0.1 5,-0.3 0.507 108.9 101.2 -95.2 -9.0 29.7 32.5 34.5 819 1081 A T H <> S+ 0 0 69 -3,-1.7 4,-2.2 1,-0.2 -1,-0.1 0.854 85.7 41.5 -45.9 -51.6 33.3 33.4 33.5 820 1082 A V H > S+ 0 0 8 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.918 118.3 45.5 -66.6 -46.6 34.1 30.0 32.1 821 1083 A Q H > S+ 0 0 4 -4,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.866 112.5 52.1 -63.6 -39.7 30.7 29.5 30.4 822 1084 A F H X S+ 0 0 99 -4,-3.5 4,-1.7 2,-0.2 -2,-0.2 0.880 109.7 49.2 -62.9 -41.5 30.9 33.1 29.0 823 1085 A N H X S+ 0 0 69 -4,-2.2 4,-1.9 -5,-0.3 -2,-0.2 0.852 109.2 52.7 -66.0 -37.5 34.4 32.3 27.6 824 1086 A W H X S+ 0 0 80 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.890 107.2 52.3 -61.2 -43.3 33.0 29.1 26.0 825 1087 A F H < S+ 0 0 53 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.866 110.9 46.7 -61.8 -40.0 30.3 31.2 24.4 826 1088 A L H >< S+ 0 0 91 -4,-1.7 3,-1.3 1,-0.2 -1,-0.2 0.841 108.0 57.5 -69.5 -34.9 32.9 33.6 22.9 827 1089 A H H >< S+ 0 0 130 -4,-1.9 3,-0.5 1,-0.3 -2,-0.2 0.828 101.8 54.8 -65.0 -34.6 35.0 30.7 21.8 828 1090 A L T 3< S+ 0 0 106 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.378 100.1 62.6 -82.7 3.1 32.1 29.3 19.7 829 1091 A V T < 0 0 103 -3,-1.3 -1,-0.3 1,-0.4 -2,-0.1 -0.391 360.0 360.0-116.9 51.0 31.9 32.7 17.9 830 1092 A L < 0 0 130 -3,-0.5 -1,-0.4 0, 0.0 0, 0.0 -0.260 360.0 360.0 54.4 360.0 35.4 32.4 16.4