==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 29-MAY-13 4KZ0 . COMPND 2 MOLECULE: PHOSPHATIDYLINOSITOL 4,5-BISPHOSPHATE 3-KINASE CA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.S.KNAPP,R.A.ELLING . 833 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35044.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 561 67.3 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 . 113 13.6 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 . 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 . 53 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 79 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 291 34.9 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 6 3 2 2 3 2 1 1 4 1 1 2 1 1 1 0 1 0 0 0 0 1 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 4 3 2 3 4 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 144 A S > 0 0 121 0, 0.0 4,-2.1 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 162.6 29.5 -28.4 0.3 2 145 A E H > + 0 0 88 1,-0.2 4,-1.1 2,-0.2 5,-0.1 0.835 360.0 45.4 -61.4 -39.5 27.2 -25.9 -1.7 3 146 A E H > S+ 0 0 62 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.621 113.0 51.8 -79.6 -17.9 25.0 -25.1 1.4 4 147 A S H > S+ 0 0 41 -3,-0.3 4,-1.3 2,-0.2 -2,-0.2 0.825 107.0 52.5 -83.7 -36.7 28.2 -24.8 3.5 5 148 A Q H X S+ 0 0 46 -4,-2.1 4,-0.6 1,-0.2 -2,-0.2 0.805 110.9 47.4 -66.4 -34.7 29.8 -22.3 1.0 6 149 A A H X S+ 0 0 45 -4,-1.1 4,-1.1 2,-0.2 3,-0.3 0.799 104.8 60.1 -76.2 -33.5 26.6 -20.1 1.2 7 150 A F H X S+ 0 0 17 -4,-0.8 4,-1.6 1,-0.2 3,-0.3 0.863 102.7 52.8 -62.0 -38.4 26.6 -20.3 5.1 8 151 A Q H X S+ 0 0 22 -4,-1.3 4,-2.8 1,-0.2 -1,-0.2 0.772 105.7 53.6 -67.9 -30.2 30.1 -18.6 5.0 9 152 A R H X S+ 0 0 168 -4,-0.6 4,-1.5 -3,-0.3 -1,-0.2 0.750 108.4 50.0 -75.8 -26.1 28.7 -15.8 2.8 10 153 A Q H X S+ 0 0 86 -4,-1.1 4,-1.5 -3,-0.3 -2,-0.2 0.851 112.9 47.3 -75.7 -38.3 25.9 -15.2 5.4 11 154 A L H X S+ 0 0 1 -4,-1.6 4,-3.0 2,-0.2 3,-0.3 0.975 110.2 51.9 -65.6 -54.1 28.6 -15.1 8.1 12 155 A T H X>S+ 0 0 37 -4,-2.8 4,-2.7 1,-0.2 5,-0.6 0.838 111.5 46.6 -49.3 -47.3 30.9 -12.7 6.0 13 156 A A H <5S+ 0 0 67 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.861 116.4 45.5 -67.3 -36.4 28.0 -10.2 5.5 14 157 A L H <5S+ 0 0 4 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.911 118.2 41.2 -70.9 -48.2 27.1 -10.4 9.2 15 158 A I H <5S- 0 0 1 -4,-3.0 -2,-0.2 2,-0.2 -3,-0.2 0.889 98.5-134.7 -65.6 -48.3 30.7 -10.1 10.5 16 159 A G T <5S+ 0 0 46 -4,-2.7 2,-0.3 -5,-0.3 -3,-0.2 0.469 78.8 79.8 96.7 10.0 31.7 -7.4 8.0 17 160 A Y S + 0 0 103 -2,-0.4 3,-0.7 1,-0.1 -1,-0.1 0.193 51.3 103.3-121.9 12.3 44.6 -15.5 3.7 23 166 A S T 3 S+ 0 0 79 1,-0.2 -1,-0.1 0, 0.0 -2,-0.0 0.477 85.0 45.8 -75.7 -5.2 46.0 -12.6 1.6 24 167 A N T 3 S+ 0 0 5 -3,-0.1 263,-0.4 267,-0.0 2,-0.3 -0.335 93.6 92.7-134.9 53.8 47.2 -10.8 4.8 25 168 A V < - 0 0 50 -3,-0.7 3,-0.1 261,-0.1 261,-0.0 -0.995 44.8-169.1-147.8 146.8 49.0 -13.5 6.9 26 169 A H S S+ 0 0 60 -2,-0.3 2,-0.3 243,-0.0 -1,-0.1 0.213 86.5 21.3-112.8 3.4 52.6 -14.9 7.3 27 170 A D S S- 0 0 29 232,-0.0 3,-0.2 0, 0.0 4,-0.1 -0.895 85.0-102.1-156.3 179.7 51.3 -17.8 9.4 28 171 A D S > S+ 0 0 71 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 -0.219 73.5 123.9-106.8 39.7 48.1 -19.9 10.0 29 172 A E H > S+ 0 0 5 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.930 74.6 44.1 -67.2 -48.6 47.3 -18.2 13.4 30 173 A L H > S+ 0 0 16 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.901 117.5 46.2 -63.3 -40.8 43.8 -17.0 12.5 31 174 A E H > S+ 0 0 83 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.870 110.9 52.1 -68.6 -38.0 42.9 -20.5 10.9 32 175 A F H X S+ 0 0 66 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.787 113.3 46.8 -64.9 -29.8 44.5 -22.3 13.9 33 176 A T H X S+ 0 0 1 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.860 108.8 51.2 -84.0 -39.1 42.2 -20.1 16.1 34 177 A R H < S+ 0 0 38 -4,-2.5 4,-0.4 2,-0.2 -2,-0.2 0.962 119.5 39.6 -58.3 -50.5 39.0 -20.6 14.0 35 178 A R H >< S+ 0 0 64 -4,-2.3 3,-1.0 1,-0.2 4,-0.4 0.866 114.0 54.0 -63.6 -43.8 39.7 -24.4 14.3 36 179 A G H >< S+ 0 0 21 -4,-1.9 3,-0.5 1,-0.2 -1,-0.2 0.818 106.3 52.4 -62.1 -34.8 40.9 -24.0 18.0 37 180 A L T 3X S+ 0 0 3 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.547 85.2 86.8 -80.6 -10.5 37.6 -22.3 19.0 38 181 A V H <> S+ 0 0 17 -3,-1.0 4,-2.4 -4,-0.4 -1,-0.2 0.864 89.6 49.5 -57.6 -41.2 35.4 -25.1 17.5 39 182 A T H <> S+ 0 0 100 -3,-0.5 4,-2.8 -4,-0.4 5,-0.2 0.965 111.6 44.1 -68.5 -56.1 35.6 -27.1 20.8 40 183 A P H > S+ 0 0 13 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.810 116.0 52.2 -61.5 -24.8 34.6 -24.3 23.3 41 184 A R H X S+ 0 0 13 -4,-1.8 4,-1.8 2,-0.2 3,-0.3 0.954 114.4 38.9 -69.1 -56.1 31.8 -23.3 20.8 42 185 A M H X S+ 0 0 68 -4,-2.4 4,-2.1 1,-0.2 -3,-0.2 0.815 113.9 57.6 -66.5 -31.7 30.3 -26.9 20.6 43 186 A A H X S+ 0 0 51 -4,-2.8 4,-1.1 2,-0.2 -1,-0.2 0.819 110.0 42.1 -67.6 -36.2 30.9 -27.4 24.3 44 187 A E H X S+ 0 0 19 -4,-1.2 4,-1.2 -3,-0.3 -2,-0.2 0.842 112.7 52.6 -82.2 -33.5 28.8 -24.3 25.3 45 188 A V H < S+ 0 0 33 -4,-1.8 3,-0.5 1,-0.2 -2,-0.2 0.943 114.4 44.2 -61.4 -48.8 26.0 -25.1 22.7 46 189 A A H < S+ 0 0 89 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.790 113.6 51.0 -68.0 -29.1 25.7 -28.6 24.2 47 190 A S H < S+ 0 0 96 -4,-1.1 2,-0.3 -5,-0.1 -1,-0.2 0.664 88.5 98.7 -82.2 -21.8 25.9 -27.4 27.9 48 191 A R S < S- 0 0 27 -4,-1.2 399,-0.0 -3,-0.5 398,-0.0 -0.563 79.2-116.2 -79.9 136.6 23.1 -24.7 27.7 49 192 A D > - 0 0 81 -2,-0.3 4,-1.6 1,-0.1 5,-0.2 -0.467 23.0-149.2 -60.8 121.2 19.5 -25.4 28.9 50 193 A P H > S+ 0 0 82 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.893 93.4 49.3 -68.0 -35.7 17.4 -25.1 25.7 51 194 A K H 4 S+ 0 0 48 1,-0.2 4,-0.5 2,-0.2 -2,-0.0 0.802 116.2 40.9 -69.3 -37.6 14.3 -23.7 27.5 52 195 A L H > S+ 0 0 67 2,-0.2 4,-0.9 3,-0.1 -1,-0.2 0.698 112.4 54.6 -86.4 -23.3 16.2 -21.1 29.6 53 196 A Y H < S+ 0 0 7 -4,-1.6 3,-0.5 2,-0.2 395,-0.4 0.925 106.1 52.8 -72.7 -44.9 18.4 -20.0 26.6 54 197 A A T < S+ 0 0 6 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.735 119.1 35.7 -58.4 -30.0 15.3 -19.3 24.4 55 198 A M T 4 S- 0 0 12 -4,-0.5 68,-0.6 -5,-0.1 -1,-0.2 0.476 88.1-157.1-105.9 -8.7 13.8 -17.1 27.2 56 199 A H < - 0 0 22 -4,-0.9 -3,-0.1 -3,-0.5 393,-0.1 0.756 12.6-148.8 34.2 53.6 17.1 -15.5 28.5 57 200 A P - 0 0 24 0, 0.0 2,-0.8 0, 0.0 -1,-0.2 -0.270 5.6-142.2 -51.8 125.0 15.8 -14.5 32.0 58 201 A W + 0 0 71 65,-0.3 76,-1.9 391,-0.0 77,-0.3 -0.860 39.5 154.7 -94.8 104.4 17.7 -11.4 33.0 59 202 A V B -A 133 0A 44 -2,-0.8 354,-0.3 74,-0.2 2,-0.3 -0.926 31.7-152.2-133.6 160.7 18.4 -11.7 36.8 60 203 A T - 0 0 5 72,-2.3 -2,-0.0 -2,-0.3 352,-0.0 -0.970 13.8-160.4-131.5 144.2 20.7 -10.7 39.7 61 204 A S + 0 0 90 -2,-0.3 3,-0.1 2,-0.1 -1,-0.1 0.327 58.4 122.0-100.4 3.1 21.7 -12.3 43.0 62 205 A K S S- 0 0 74 1,-0.1 2,-0.1 70,-0.1 -2,-0.1 -0.335 79.7 -88.8 -64.1 144.8 22.8 -8.9 44.4 63 206 A P - 0 0 116 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.410 51.0-100.8 -61.3 127.5 21.1 -7.8 47.7 64 207 A L - 0 0 58 -2,-0.1 5,-0.1 1,-0.1 68,-0.1 -0.257 52.1 -99.0 -47.7 120.4 17.8 -5.8 46.8 65 208 A P > - 0 0 25 0, 0.0 4,-1.6 0, 0.0 5,-0.1 -0.117 18.7-130.9 -52.6 146.8 18.8 -2.1 47.2 66 209 A E H > S+ 0 0 63 549,-0.3 4,-1.5 2,-0.2 5,-0.1 0.872 109.1 51.2 -62.3 -42.8 17.8 -0.3 50.5 67 210 A Y H 4 S+ 0 0 59 1,-0.2 4,-0.4 551,-0.2 -1,-0.2 0.890 114.1 45.0 -61.7 -41.7 16.3 2.7 48.6 68 211 A L H 4 S+ 0 0 22 2,-0.2 4,-0.4 1,-0.2 -2,-0.2 0.709 106.0 58.1 -77.0 -25.9 14.2 0.3 46.5 69 212 A W H >< S+ 0 0 47 -4,-1.6 3,-0.9 1,-0.2 5,-0.3 0.871 104.9 53.6 -69.9 -35.4 13.1 -1.9 49.5 70 213 A K T 3< S+ 0 0 80 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.705 92.8 73.3 -66.7 -26.3 11.6 1.3 50.9 71 214 A K T 3 S+ 0 0 61 -4,-0.4 2,-0.4 -3,-0.1 -1,-0.2 0.759 90.1 70.0 -61.5 -29.3 9.6 1.8 47.6 72 215 A I S < S- 0 0 26 -3,-0.9 2,-2.2 -4,-0.4 3,-0.1 -0.764 90.5-127.5 -90.7 138.9 7.4 -1.1 48.7 73 216 A A S > S- 0 0 109 -2,-0.4 3,-0.5 1,-0.2 -3,-0.1 -0.729 76.7 -93.4 -82.4 78.4 4.9 -0.5 51.6 74 217 A N T 3 S+ 0 0 119 -2,-2.2 2,-1.6 -5,-0.3 -1,-0.2 0.773 87.9 13.3 -7.9 158.2 6.9 -3.7 52.6 75 218 A N T 3 S+ 0 0 105 -3,-0.1 2,-0.4 2,-0.0 20,-0.2 -0.129 112.3 53.5 69.9 -36.9 6.5 -7.5 52.2 76 219 A C < + 0 0 80 -2,-1.6 2,-0.4 -3,-0.5 17,-0.2 -0.907 63.4 178.4-135.4 108.3 3.6 -7.8 49.6 77 220 A I E -B 92 0B 30 15,-2.1 15,-2.9 -2,-0.4 2,-0.2 -0.889 20.0-130.9-112.8 141.7 3.8 -6.0 46.3 78 221 A F E -B 91 0B 59 -2,-0.4 68,-0.4 13,-0.3 2,-0.3 -0.638 20.0-178.2 -98.6 146.0 1.3 -6.1 43.4 79 222 A I E -B 90 0B 16 11,-1.9 11,-2.8 -2,-0.2 2,-0.4 -0.966 25.4-119.8-136.4 146.3 1.9 -6.7 39.6 80 223 A V E -Bc 89 147B 19 66,-3.0 68,-2.8 -2,-0.3 2,-0.4 -0.799 21.9-163.6 -97.2 131.8 -0.6 -6.6 36.6 81 224 A I E -Bc 88 148B 19 7,-1.6 7,-1.5 -2,-0.4 2,-0.3 -0.930 6.0-160.5-114.5 136.2 -1.1 -9.7 34.3 82 225 A H E +Bc 87 149B 31 66,-2.0 68,-3.2 -2,-0.4 5,-0.2 -0.828 23.6 157.8-116.6 153.9 -2.8 -9.6 30.9 83 226 A R S S- 0 0 112 3,-0.9 3,-0.2 -2,-0.3 66,-0.0 -0.368 82.3 -29.6-177.3 81.5 -4.5 -12.2 28.7 84 227 A S S S- 0 0 86 1,-0.2 3,-0.1 -2,-0.0 65,-0.0 0.899 121.2 -45.9 69.4 53.6 -7.0 -10.8 26.1 85 228 A T S S+ 0 0 144 1,-0.3 2,-0.8 0, 0.0 -1,-0.2 0.510 112.5 120.7 68.8 6.5 -8.3 -7.5 27.9 86 229 A T + 0 0 93 -3,-0.2 -3,-0.9 2,-0.0 2,-0.4 -0.925 41.5 170.6 -97.2 104.1 -8.7 -9.8 31.0 87 230 A S E +B 82 0B 69 -2,-0.8 2,-0.4 -5,-0.2 -5,-0.2 -0.959 10.7 174.5-128.0 112.5 -6.3 -7.9 33.3 88 231 A Q E -B 81 0B 110 -7,-1.5 -7,-1.6 -2,-0.4 2,-0.4 -0.984 25.0-137.3-124.1 129.6 -6.1 -8.6 37.0 89 232 A T E -B 80 0B 85 -2,-0.4 2,-0.4 -9,-0.2 -9,-0.2 -0.681 23.4-160.9 -81.0 129.8 -3.7 -7.1 39.5 90 233 A I E -B 79 0B 30 -11,-2.8 -11,-1.9 -2,-0.4 2,-0.6 -0.978 16.8-135.9-121.9 126.8 -2.2 -9.7 41.9 91 234 A K E +B 78 0B 75 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.3 -0.717 35.9 179.4 -79.1 114.7 -0.5 -9.0 45.3 92 235 A V E -B 77 0B 10 -15,-2.9 -15,-2.1 -2,-0.6 9,-0.0 -0.955 29.6-114.0-122.8 143.0 2.7 -11.2 45.2 93 236 A S > - 0 0 51 -2,-0.3 3,-1.8 -17,-0.2 37,-0.3 -0.468 23.8-125.9 -72.6 143.6 5.5 -11.6 47.9 94 237 A P T 3 S+ 0 0 34 0, 0.0 37,-2.0 0, 0.0 38,-0.2 0.774 111.3 55.6 -63.0 -23.1 9.0 -10.4 46.8 95 238 A D T 3 S+ 0 0 133 -20,-0.2 2,-0.4 34,-0.2 -2,-0.1 0.152 84.2 122.5 -93.4 19.0 10.4 -13.8 47.7 96 239 A D < - 0 0 11 -3,-1.8 34,-2.4 2,-0.0 35,-0.1 -0.733 59.1-134.5 -91.2 127.2 8.0 -15.6 45.3 97 240 A T >> - 0 0 45 -2,-0.4 3,-1.1 32,-0.2 4,-1.0 -0.369 29.1-111.2 -67.5 149.0 9.3 -17.8 42.4 98 241 A P H 3> S+ 0 0 10 0, 0.0 4,-1.8 0, 0.0 3,-0.4 0.857 119.2 58.8 -53.8 -34.0 7.5 -17.1 38.9 99 242 A G H 3> S+ 0 0 21 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.778 97.8 58.1 -61.8 -34.5 5.9 -20.6 39.3 100 243 A A H <4 S+ 0 0 49 -3,-1.1 4,-0.4 2,-0.2 -1,-0.2 0.842 112.3 40.8 -65.0 -36.5 4.2 -19.6 42.6 101 244 A I H X S+ 0 0 14 -4,-1.0 4,-0.5 -3,-0.4 -2,-0.2 0.781 112.9 56.7 -79.2 -32.1 2.5 -16.8 40.7 102 245 A L H < S+ 0 0 35 -4,-1.8 3,-0.4 1,-0.2 4,-0.3 0.875 112.6 39.2 -66.6 -41.7 1.9 -19.2 37.8 103 246 A Q T X S+ 0 0 121 -4,-2.5 4,-0.7 1,-0.2 3,-0.3 0.575 105.6 67.4 -85.4 -10.3 -0.0 -21.7 40.0 104 247 A S H > S+ 0 0 44 -4,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.636 89.3 68.6 -77.7 -19.0 -1.7 -18.7 41.9 105 248 A F H X S+ 0 0 40 -4,-0.5 4,-2.9 -3,-0.4 -1,-0.2 0.819 94.0 53.2 -68.5 -36.5 -3.5 -18.1 38.5 106 249 A F H 4 S+ 0 0 85 -4,-0.3 -1,-0.2 -3,-0.3 -2,-0.2 0.871 114.5 42.8 -64.9 -39.1 -5.6 -21.4 38.9 107 250 A T H < S+ 0 0 128 -4,-0.7 -2,-0.2 2,-0.2 -1,-0.2 0.866 117.8 46.5 -71.4 -44.1 -6.7 -20.1 42.4 108 251 A K H < 0 0 45 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.888 360.0 360.0 -68.2 -46.6 -7.3 -16.5 41.0 109 252 A M < 0 0 112 -4,-2.9 -1,-0.2 -5,-0.1 -2,-0.2 -0.470 360.0 360.0-152.8 360.0 -9.2 -17.5 37.9 110 ! 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 3,-0.1 0, 0.0 -8,-0.0 0.000 360.0 360.0 360.0 -98.6 2.8 -25.1 33.1 112 269 A D + 0 0 118 1,-0.1 2,-0.3 40,-0.0 0, 0.0 0.279 360.0 52.6-131.1 -11.3 1.7 -24.6 29.5 113 270 A F - 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0 0 96 -2,-0.1 -1,-0.1 1,-0.1 -2,-0.1 -0.571 49.6 -98.7 -73.7 128.4 36.8 -12.9 46.8 381 622 A L - 0 0 50 -2,-0.3 2,-0.5 25,-0.1 -1,-0.1 -0.252 35.2-165.8 -51.1 121.2 36.8 -11.7 43.1 382 623 A D > - 0 0 81 1,-0.1 4,-2.4 -3,-0.1 3,-0.2 -0.992 6.0-163.7-114.3 111.3 38.1 -8.1 42.8 383 624 A V H > S+ 0 0 22 -2,-0.5 4,-2.2 1,-0.2 5,-0.2 0.852 92.2 54.8 -67.3 -33.7 37.1 -6.9 39.2 384 625 A G H > S+ 0 0 1 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.750 113.5 40.3 -68.7 -27.7 39.6 -4.1 39.6 385 626 A L H > S+ 0 0 11 -3,-0.2 4,-0.8 2,-0.2 -2,-0.2 0.826 114.2 51.8 -87.8 -40.0 42.5 -6.6 40.4 386 627 A T H >< S+ 0 0 1 -4,-2.4 3,-1.1 1,-0.2 4,-0.2 0.948 112.2 45.8 -60.8 -52.0 41.4 -9.2 37.8 387 628 A M H >< S+ 0 0 0 -4,-2.2 3,-1.4 1,-0.3 4,-0.3 0.763 101.1 67.7 -63.8 -29.7 41.3 -6.6 35.0 388 629 A Q H >< S+ 0 0 14 -4,-0.5 3,-0.6 1,-0.3 -1,-0.3 0.800 100.6 50.0 -60.2 -32.6 44.7 -5.1 36.1 389 630 A L T << S+ 0 0 0 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.450 103.3 60.6 -86.4 -4.4 46.3 -8.4 35.0 390 631 A L T < S+ 0 0 0 -3,-1.4 -1,-0.2 -4,-0.2 -2,-0.2 0.374 87.3 100.2-101.5 1.3 44.6 -8.3 31.5 391 632 A D S X S- 0 0 13 -3,-0.6 3,-1.4 -4,-0.3 -3,-0.0 -0.049 94.2 -84.2 -81.6-177.3 46.2 -5.0 30.5 392 633 A C T 3 S+ 0 0 9 1,-0.3 -1,-0.1 3,-0.0 -3,-0.1 0.565 119.1 69.2 -61.8 -21.3 49.2 -4.2 28.2 393 634 A N T 3 S+ 0 0 77 -5,-0.2 2,-0.5 1,-0.1 -1,-0.3 0.545 91.8 68.3 -78.8 -9.9 51.8 -4.7 31.0 394 635 A F < + 0 0 8 -3,-1.4 -1,-0.1 1,-0.1 -194,-0.1 -0.945 43.3 155.6-119.3 109.6 51.0 -8.5 31.1 395 636 A S + 0 0 20 -2,-0.5 2,-0.4 34,-0.1 -1,-0.1 0.432 44.3 109.8-105.9 -5.6 52.1 -10.7 28.1 396 637 A D > - 0 0 4 1,-0.1 4,-2.3 34,-0.0 3,-0.1 -0.638 58.6-151.2 -80.8 127.4 52.3 -14.0 30.1 397 638 A E H > S+ 0 0 58 -2,-0.4 4,-2.0 1,-0.2 -1,-0.1 0.798 95.4 49.1 -61.9 -40.2 49.5 -16.5 29.3 398 639 A N H > S+ 0 0 70 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.756 112.0 48.1 -76.8 -27.7 49.5 -18.2 32.7 399 640 A V H > S+ 0 0 0 2,-0.2 4,-1.0 -3,-0.1 3,-0.3 0.927 113.3 47.6 -73.7 -49.9 49.3 -14.8 34.5 400 641 A R H >X S+ 0 0 2 -4,-2.3 4,-2.3 1,-0.2 3,-0.6 0.889 108.3 57.7 -57.3 -41.3 46.5 -13.7 32.2 401 642 A A H 3X S+ 0 0 38 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.843 99.0 56.3 -60.3 -41.9 44.7 -17.1 32.8 402 643 A I H 3X S+ 0 0 3 -4,-1.1 4,-1.3 -3,-0.3 -1,-0.2 0.814 111.2 45.9 -61.6 -30.9 44.5 -16.7 36.7 403 644 A A H < S+ 0 0 62 -4,-2.2 3,-1.0 1,-0.2 4,-0.3 0.923 102.8 49.5 -66.6 -48.7 39.8 -17.8 36.0 406 647 A K H >< S+ 0 0 19 -4,-1.3 3,-1.0 1,-0.2 -1,-0.2 0.801 105.2 59.9 -62.5 -28.0 38.4 -15.2 38.6 407 648 A L H >< S+ 0 0 0 -4,-1.2 3,-2.1 1,-0.2 -1,-0.2 0.739 86.5 75.1 -71.0 -26.2 36.1 -14.0 35.8 408 649 A E T << S+ 0 0 83 -3,-1.0 -1,-0.2 -4,-0.7 -2,-0.2 0.730 92.3 56.5 -57.4 -23.0 34.5 -17.5 35.5 409 650 A S T < S+ 0 0 83 -3,-1.0 2,-0.3 -4,-0.3 -1,-0.3 0.321 78.4 113.1 -93.0 2.1 32.6 -16.7 38.8 410 651 A L < - 0 0 8 -3,-2.1 2,-0.2 4,-0.1 -3,-0.0 -0.622 69.4-127.2 -76.0 134.4 30.9 -13.4 37.5 411 652 A E >> - 0 0 45 -2,-0.3 3,-1.6 1,-0.1 4,-1.3 -0.544 30.3-102.5 -76.8 149.8 27.1 -13.9 37.2 412 653 A D H 3> S+ 0 0 46 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.746 122.9 62.7 -45.3 -28.8 25.7 -13.0 33.7 413 654 A D H 34 S+ 0 0 18 -354,-0.3 4,-0.3 1,-0.2 -1,-0.3 0.916 108.3 39.6 -63.7 -43.7 24.5 -9.7 35.3 414 655 A D H <> S+ 0 0 23 -3,-1.6 4,-1.0 2,-0.2 -2,-0.2 0.637 111.0 58.3 -79.4 -22.0 28.2 -8.6 36.0 415 656 A V H >X S+ 0 0 1 -4,-1.3 4,-1.1 2,-0.2 3,-1.0 0.962 105.4 49.9 -70.0 -51.5 29.5 -10.0 32.7 416 657 A L H 3< S+ 0 0 24 -4,-1.9 4,-0.3 1,-0.3 -1,-0.2 0.627 111.1 54.0 -55.1 -21.6 27.1 -7.7 30.7 417 658 A H H 34 S+ 0 0 32 -4,-0.3 -1,-0.3 -5,-0.1 -2,-0.2 0.725 118.5 28.5 -88.4 -36.4 28.4 -4.9 32.9 418 659 A Y H X S+ 0 0 1 -4,-1.1 4,-3.0 2,-0.2 3,-0.7 0.923 73.2 50.0 -52.1 -65.8 31.7 -6.7 28.7 420 661 A L H 3> S+ 0 0 4 -4,-0.3 4,-2.1 1,-0.3 -1,-0.2 0.854 116.3 43.6 -44.5 -47.0 32.8 -3.7 26.6 421 662 A Q H 3> S+ 0 0 1 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.802 113.9 50.0 -71.8 -31.8 36.0 -3.4 28.6 422 663 A L H << S+ 0 0 0 -4,-2.1 4,-0.3 -3,-0.7 -2,-0.2 0.887 112.2 47.9 -72.1 -38.8 36.6 -7.2 28.6 423 664 A V H >< S+ 0 0 0 -4,-3.0 3,-1.0 1,-0.2 4,-0.2 0.882 114.1 47.7 -64.0 -40.4 36.1 -7.3 24.8 424 665 A Q H >< S+ 0 0 4 -4,-2.1 3,-2.1 -5,-0.3 -2,-0.2 0.888 99.4 67.3 -68.4 -38.1 38.5 -4.3 24.6 425 666 A A G >< S+ 0 0 0 -4,-2.1 3,-1.2 1,-0.3 -1,-0.2 0.616 84.1 75.8 -56.2 -12.9 41.0 -6.2 26.9 426 667 A V G X S+ 0 0 1 -3,-1.0 3,-1.5 -4,-0.3 -1,-0.3 0.768 80.2 68.9 -71.7 -27.1 41.4 -8.6 23.8 427 668 A K G < S+ 0 0 4 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.563 96.5 55.5 -64.8 -11.8 43.6 -6.0 22.1 428 669 A F G < S+ 0 0 10 -3,-1.2 -1,-0.3 -38,-0.2 -2,-0.2 0.453 82.4 106.0-102.4 -4.0 46.2 -6.8 24.9 429 670 A E < - 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0 0 20 -4,-1.3 4,-2.7 -3,-0.2 -1,-0.2 -0.989 65.9-148.5-124.1 124.0 23.1 -16.0 27.4 448 689 A K H > S+ 0 0 31 -2,-0.4 4,-2.9 -395,-0.4 5,-0.2 0.806 100.7 51.4 -57.8 -38.5 21.3 -14.1 24.5 449 690 A R H > S+ 0 0 40 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.960 112.9 44.9 -66.5 -47.1 21.7 -10.7 26.1 450 691 A I H > S+ 0 0 0 -7,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.908 117.9 48.2 -57.1 -43.0 25.6 -11.2 26.6 451 692 A G H X S+ 0 0 0 -4,-2.7 4,-2.3 -7,-0.6 -2,-0.2 0.879 108.0 50.7 -66.1 -45.8 25.6 -12.6 23.0 452 693 A H H X S+ 0 0 5 -4,-2.9 4,-1.5 2,-0.2 -2,-0.2 0.938 116.2 42.2 -58.6 -50.1 23.6 -9.8 21.3 453 694 A F H X S+ 0 0 17 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.913 110.2 57.2 -64.4 -42.3 25.9 -7.1 22.9 454 695 A L H X S+ 0 0 0 -4,-2.4 4,-2.9 -5,-0.2 5,-0.3 0.916 104.9 53.9 -52.1 -49.8 29.1 -9.3 22.1 455 696 A F H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.897 114.4 38.1 -49.5 -57.6 28.0 -9.3 18.4 456 697 A W H X S+ 0 0 1 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.845 114.7 54.7 -66.2 -39.3 27.8 -5.4 18.2 457 698 A F H X S+ 0 0 9 -4,-2.9 4,-1.0 2,-0.2 -2,-0.2 0.910 116.6 37.5 -61.5 -43.2 30.8 -4.8 20.4 458 699 A L H X S+ 0 0 0 -4,-2.9 4,-2.0 -5,-0.2 -2,-0.2 0.909 115.3 54.9 -73.0 -44.0 33.0 -7.0 18.1 459 700 A R H X S+ 0 0 27 -4,-2.8 4,-1.8 -5,-0.3 -2,-0.2 0.791 102.0 57.5 -59.8 -34.9 31.2 -5.7 15.0 460 701 A S H < S+ 0 0 1 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.937 111.9 41.2 -61.9 -46.6 32.1 -2.1 15.9 461 702 A E H >X S+ 0 0 4 -4,-1.0 4,-1.0 1,-0.2 3,-0.7 0.814 113.1 53.6 -68.5 -38.6 35.9 -2.9 16.0 462 703 A I H 3< S+ 0 0 2 -4,-2.0 3,-0.2 1,-0.2 -1,-0.2 0.867 108.6 51.8 -61.8 -40.9 35.7 -5.1 12.9 463 704 A A T 3< S+ 0 0 40 -4,-1.8 170,-0.5 1,-0.2 -1,-0.2 0.456 124.0 21.8 -76.6 -10.2 34.0 -2.3 10.9 464 705 A Q T <4 S+ 0 0 28 -3,-0.7 2,-0.4 -4,-0.3 -1,-0.2 0.304 105.7 73.7-148.7 17.2 36.6 0.5 11.7 465 706 A S X - 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0 0 83 -5,-0.1 -3,-0.1 -6,-0.0 3,-0.0 -0.952 360.0-177.9-143.2 160.4 22.8 28.1 51.3 752 1003 A S > - 0 0 12 -2,-0.3 4,-1.8 -5,-0.1 5,-0.2 -0.885 46.3 -96.4-148.0 169.6 19.3 26.6 51.1 753 1004 A P H > S+ 0 0 102 0, 0.0 4,-1.3 0, 0.0 -7,-0.1 0.871 123.8 44.0 -64.5 -33.3 17.7 23.2 52.3 754 1005 A H H > S+ 0 0 68 -9,-0.8 4,-2.2 2,-0.2 -8,-0.1 0.871 112.3 49.2 -76.3 -42.4 18.2 21.6 48.8 755 1006 A F H > S+ 0 0 19 -10,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.830 109.3 54.3 -64.9 -35.5 21.7 22.9 48.1 756 1007 A Q H X S+ 0 0 111 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.942 111.9 45.2 -58.4 -48.0 22.7 21.6 51.6 757 1008 A K H X S+ 0 0 32 -4,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.826 107.4 58.4 -63.7 -40.2 21.3 18.2 50.4 758 1009 A F H X S+ 0 0 7 -4,-2.2 4,-2.5 2,-0.2 3,-0.4 0.953 109.1 43.5 -55.7 -54.7 23.1 18.5 47.0 759 1010 A Q H X S+ 0 0 43 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.849 110.6 56.6 -59.0 -40.7 26.6 18.7 48.7 760 1011 A D H X S+ 0 0 113 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.850 112.2 40.8 -59.8 -41.3 25.6 15.9 51.1 761 1012 A I H X S+ 0 0 40 -4,-1.8 4,-2.0 -3,-0.4 -2,-0.2 0.881 114.6 54.2 -74.5 -40.3 24.9 13.5 48.2 762 1013 A C H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 -2,-0.2 0.892 111.7 42.9 -58.0 -47.7 28.0 14.8 46.3 763 1014 A V H X S+ 0 0 31 -4,-2.8 4,-2.1 2,-0.2 5,-0.2 0.934 114.7 49.3 -66.7 -47.6 30.3 14.1 49.3 764 1015 A K H X S+ 0 0 44 -4,-1.8 4,-0.8 -5,-0.2 -2,-0.2 0.794 116.9 45.6 -60.6 -29.9 28.6 10.6 49.9 765 1016 A A H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.929 111.0 47.6 -78.2 -54.3 29.1 10.0 46.1 766 1017 A Y H X S+ 0 0 1 -4,-3.0 4,-1.0 1,-0.2 -2,-0.2 0.824 115.8 47.1 -59.8 -34.5 32.8 11.2 45.6 767 1018 A L H X S+ 0 0 22 -4,-2.1 4,-0.8 -5,-0.2 -1,-0.2 0.795 107.4 56.5 -76.7 -31.6 33.8 9.2 48.6 768 1019 A A H < S+ 0 0 2 -4,-0.8 3,-0.4 -5,-0.2 -2,-0.2 0.860 107.7 47.8 -67.7 -37.2 31.9 6.0 47.4 769 1020 A L H >< S+ 0 0 0 -4,-1.8 3,-1.4 1,-0.2 7,-0.2 0.835 105.2 61.8 -69.3 -34.5 33.8 6.0 44.1 770 1021 A R H >< S+ 0 0 30 -4,-1.0 3,-1.2 1,-0.3 -1,-0.2 0.717 90.7 64.8 -64.4 -26.7 37.1 6.4 46.1 771 1022 A H T 3< S+ 0 0 111 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.593 107.5 45.2 -72.0 -9.3 36.5 3.0 47.9 772 1023 A H T <> S+ 0 0 53 -3,-1.4 4,-2.0 -4,-0.1 -1,-0.3 -0.306 74.5 137.6-124.4 38.9 36.9 1.6 44.3 773 1024 A T H <> S+ 0 0 22 -3,-1.2 4,-2.4 1,-0.2 5,-0.1 0.942 71.1 47.8 -53.1 -57.0 40.0 3.7 43.4 774 1025 A N H > S+ 0 0 59 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.851 110.9 50.7 -58.0 -41.2 42.0 0.8 41.7 775 1026 A L H > S+ 0 0 13 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.951 113.6 44.8 -61.0 -51.5 38.9 -0.4 39.6 776 1027 A L H X S+ 0 0 6 -4,-2.0 4,-2.2 -7,-0.2 -2,-0.2 0.850 111.4 54.3 -60.9 -37.5 38.3 3.1 38.3 777 1028 A I H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.925 113.1 40.8 -65.1 -45.7 42.0 3.7 37.6 778 1029 A I H X S+ 0 0 2 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.925 115.0 50.7 -71.5 -41.9 42.4 0.5 35.4 779 1030 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.915 115.2 44.6 -56.3 -45.6 39.0 1.0 33.6 780 1031 A F H X S+ 0 0 9 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.954 114.6 46.0 -63.2 -55.8 40.1 4.6 32.8 781 1032 A S H X S+ 0 0 12 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.876 117.0 45.9 -58.9 -38.3 43.7 3.8 31.7 782 1033 A M H X S+ 0 0 3 -4,-2.7 4,-2.7 2,-0.2 5,-0.3 0.893 109.9 54.7 -67.3 -45.5 42.4 0.9 29.6 783 1034 A M H X>S+ 0 0 2 -4,-2.5 4,-1.7 -5,-0.2 5,-0.8 0.871 110.3 45.7 -55.3 -46.5 39.6 3.1 28.1 784 1035 A L H X5S+ 0 0 6 -4,-2.2 4,-0.7 3,-0.2 -1,-0.2 0.936 115.6 46.7 -63.7 -48.7 42.1 5.7 26.9 785 1036 A M H <5S+ 0 0 16 -4,-1.8 -505,-2.0 1,-0.2 -504,-0.3 0.875 123.5 31.2 -61.2 -45.6 44.5 3.1 25.4 786 1037 A T H <5S+ 0 0 6 -4,-2.7 -1,-0.2 -507,-0.2 -2,-0.2 0.592 132.6 25.8 -91.0 -17.7 41.8 1.0 23.6 787 1038 A G H <5S+ 0 0 9 -4,-1.7 -3,-0.2 -5,-0.3 -2,-0.1 0.790 116.7 38.7-115.1 -49.8 39.3 3.7 22.7 788 1039 A M << - 0 0 0 -5,-0.8 -1,-0.2 -4,-0.7 3,-0.2 -0.906 50.8-179.2-114.7 103.9 40.6 7.3 22.4 789 1040 A P S > S+ 0 0 67 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.604 77.4 69.9 -80.4 -9.4 44.1 7.5 20.8 790 1041 A Q T 3 S+ 0 0 69 1,-0.2 2,-1.0 -62,-0.2 -61,-0.1 0.958 101.8 44.7 -65.8 -51.8 44.2 11.4 21.2 791 1042 A L T 3 S+ 0 0 52 -63,-0.2 -1,-0.2 -3,-0.2 -3,-0.1 -0.470 75.9 120.2 -94.1 60.0 44.6 11.1 25.0 792 1043 A T < + 0 0 13 -2,-1.0 2,-0.2 -3,-0.5 -1,-0.2 -0.133 38.7 117.8-118.7 39.9 47.3 8.3 25.2 793 1044 A S S > S- 0 0 42 1,-0.1 4,-1.9 -515,-0.1 5,-0.2 -0.648 77.0-113.3 -98.9 160.4 50.1 10.1 27.1 794 1045 A K H > S+ 0 0 77 1,-0.2 4,-1.6 -2,-0.2 -1,-0.1 0.876 121.6 48.9 -56.7 -39.7 51.6 9.2 30.5 795 1046 A E H 4 S+ 0 0 73 2,-0.2 -1,-0.2 1,-0.2 4,-0.2 0.850 107.2 53.1 -68.5 -42.4 50.1 12.5 31.8 796 1047 A D H >4 S+ 0 0 56 1,-0.2 3,-0.9 2,-0.2 4,-0.2 0.884 111.0 47.2 -61.0 -42.4 46.5 11.9 30.2 797 1048 A I H >< S+ 0 0 17 -4,-1.9 3,-1.0 1,-0.2 -2,-0.2 0.889 105.7 59.6 -64.7 -45.4 46.3 8.5 31.9 798 1049 A E T >X S+ 0 0 81 -4,-1.6 4,-1.0 1,-0.2 3,-0.7 0.411 78.7 91.1 -69.2 -0.4 47.4 9.9 35.3 799 1050 A Y H <> S+ 0 0 77 -3,-0.9 4,-2.4 1,-0.2 -1,-0.2 0.890 78.6 60.0 -60.4 -44.0 44.5 12.4 35.5 800 1051 A I H <> S+ 0 0 2 -3,-1.0 4,-2.2 -4,-0.2 -1,-0.2 0.693 98.9 60.3 -57.1 -26.3 42.2 9.8 37.4 801 1052 A R H <>>S+ 0 0 48 -3,-0.7 5,-1.2 2,-0.2 4,-1.0 0.976 111.5 35.7 -65.6 -58.5 44.9 9.8 40.2 802 1053 A D H <5S+ 0 0 114 -4,-1.0 -2,-0.2 2,-0.2 3,-0.1 0.878 118.2 52.8 -63.4 -44.7 44.6 13.6 41.0 803 1054 A A H <5S+ 0 0 1 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.953 117.2 36.9 -57.8 -53.6 40.8 13.6 40.3 804 1055 A L H <5S- 0 0 0 -4,-2.2 -1,-0.2 -104,-0.2 -2,-0.2 0.588 108.0-132.2 -74.6 -12.3 40.2 10.7 42.7 805 1056 A T T <5 - 0 0 15 -4,-1.0 3,-0.4 1,-0.1 2,-0.3 0.992 24.4-149.9 53.6 73.9 42.9 12.1 45.1 806 1057 A V S - 0 0 105 1,-0.1 4,-2.3 -3,-0.1 5,-0.3 -0.371 29.0-116.7 -67.8 145.8 42.7 11.1 53.9 810 1061 A E H > S+ 0 0 86 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.848 117.2 41.8 -52.6 -40.8 38.9 10.6 53.6 811 1062 A E H > S+ 0 0 151 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.851 113.1 53.2 -75.5 -36.8 38.2 13.9 55.5 812 1063 A D H > S+ 0 0 99 1,-0.2 4,-0.9 2,-0.2 -2,-0.2 0.819 113.2 43.2 -66.0 -38.2 40.9 15.9 53.5 813 1064 A A H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.766 103.7 64.5 -79.0 -30.5 39.5 14.7 50.1 814 1065 A K H X S+ 0 0 10 -4,-1.2 4,-1.1 -5,-0.3 -2,-0.2 0.746 106.1 47.3 -62.7 -25.2 35.8 15.4 51.3 815 1066 A K H X S+ 0 0 52 -4,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.840 103.1 61.8 -80.8 -41.3 37.0 19.1 51.5 816 1067 A Y H X S+ 0 0 68 -4,-0.9 4,-1.0 1,-0.2 -2,-0.2 0.830 108.7 42.2 -55.2 -39.8 38.7 18.9 48.0 817 1068 A F H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.904 112.9 50.8 -75.4 -44.0 35.3 18.2 46.3 818 1069 A L H X S+ 0 0 63 -4,-1.1 4,-0.8 1,-0.2 -2,-0.2 0.752 112.8 49.5 -62.0 -27.7 33.3 20.8 48.4 819 1070 A D H X S+ 0 0 99 -4,-1.9 4,-0.7 2,-0.2 -1,-0.2 0.771 106.9 54.7 -77.5 -34.6 36.1 23.2 47.3 820 1071 A Q H >X S+ 0 0 32 -4,-1.0 3,-0.7 2,-0.2 4,-0.6 0.877 104.1 54.1 -67.2 -38.1 35.6 22.1 43.7 821 1072 A I H >X S+ 0 0 3 -4,-2.0 3,-1.0 1,-0.2 4,-0.9 0.854 103.8 57.2 -60.3 -39.1 31.8 23.0 44.0 822 1073 A E H 3X S+ 0 0 113 -4,-0.8 4,-2.1 1,-0.2 -1,-0.2 0.716 95.1 63.1 -67.3 -24.1 33.0 26.5 45.1 823 1074 A V H S+ 0 0 47 -91,-0.1 4,-2.3 2,-0.1 5,-0.3 0.236 102.2 117.8-122.0 5.1 28.4 31.8 33.8 830 1081 A T T 4 S+ 0 0 76 1,-0.2 4,-0.4 2,-0.2 -2,-0.1 0.786 90.4 20.9 -46.4 -47.2 32.1 32.8 33.1 831 1082 A V T > S+ 0 0 26 -4,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.681 116.2 65.4-102.2 -17.9 32.9 29.8 30.7 832 1083 A Q H > S+ 0 0 9 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.838 110.6 41.7 -66.6 -30.1 29.2 28.9 29.8 833 1084 A F H X S+ 0 0 120 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.795 115.1 50.2 -77.4 -38.7 29.3 32.4 28.1 834 1085 A N H > S+ 0 0 99 -4,-0.4 4,-2.2 -5,-0.3 -2,-0.2 0.849 111.8 47.7 -68.5 -39.1 32.8 31.7 26.8 835 1086 A W H X S+ 0 0 35 -4,-3.1 4,-2.7 2,-0.2 5,-0.2 0.925 112.0 49.2 -65.6 -51.2 31.7 28.2 25.4 836 1087 A F H < S+ 0 0 9 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.799 116.1 44.4 -57.8 -34.6 28.6 29.9 23.7 837 1088 A L H >< S+ 0 0 42 -4,-1.4 3,-0.8 2,-0.1 -2,-0.2 0.866 113.2 51.9 -76.9 -39.8 31.0 32.5 22.3 838 1089 A H H >< S+ 0 0 109 -4,-2.2 3,-1.8 1,-0.2 -2,-0.2 0.842 102.1 55.9 -66.1 -43.0 33.6 29.8 21.3 839 1090 A L T 3< S+ 0 0 78 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.1 0.483 115.7 40.7 -72.8 -1.4 31.2 27.5 19.3 840 1091 A V T < 0 0 120 -3,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 -0.226 360.0 360.0-131.7 30.4 30.4 30.7 17.2 841 1092 A L < 0 0 187 -3,-1.8 -4,-0.1 0, 0.0 -2,-0.0 -0.517 360.0 360.0 69.8 360.0 34.2 31.6 17.3