==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-SEP-08 2V4L . COMPND 2 MOLECULE: PHOSPHATIDYLINOSITOL-4,5-BISPHOSPHATE 3-KINASE CA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.APSEL,B.GONZALEZ,J.A.BLAIR,T.M.NAZIF,M.E.FELDMAN,R.L.WILLI . 844 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37620.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 577 68.4 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 13.4 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 . 50 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 93 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 291 34.5 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 2 4 3 1 1 4 0 3 3 0 1 3 0 0 2 2 0 0 0 0 1 0 0 1 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 . 0 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 77 0, 0.0 4,-1.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 166.2 37.0 -30.8 50.2 2 145 A E T 4 + 0 0 131 1,-0.2 0, 0.0 2,-0.2 0, 0.0 0.244 360.0 47.9 -86.1 11.6 39.2 -28.2 52.1 3 146 A E T > S+ 0 0 66 2,-0.1 4,-2.5 3,-0.1 -1,-0.2 0.557 104.3 56.2-116.5 -28.9 40.9 -27.1 48.9 4 147 A S H > S+ 0 0 41 1,-0.2 4,-0.9 2,-0.2 -2,-0.2 0.790 109.0 51.3 -71.4 -25.6 37.9 -26.7 46.7 5 148 A Q H X S+ 0 0 107 -4,-1.2 4,-0.7 2,-0.2 -1,-0.2 0.773 111.6 46.0 -77.9 -29.3 36.7 -24.3 49.5 6 149 A A H > S+ 0 0 38 2,-0.2 4,-2.3 1,-0.2 3,-0.4 0.896 109.5 52.7 -76.6 -45.3 40.0 -22.4 49.4 7 150 A F H X S+ 0 0 13 -4,-2.5 4,-2.0 1,-0.3 -2,-0.2 0.827 109.5 51.6 -58.3 -31.9 40.1 -22.2 45.6 8 151 A Q H X S+ 0 0 24 -4,-0.9 4,-1.8 2,-0.2 -1,-0.3 0.736 106.3 53.1 -77.6 -28.1 36.6 -20.7 45.9 9 152 A R H X S+ 0 0 135 -4,-0.7 4,-1.5 -3,-0.4 -2,-0.2 0.834 108.1 51.6 -72.5 -35.7 37.9 -18.1 48.4 10 153 A Q H X S+ 0 0 72 -4,-2.3 4,-2.1 2,-0.2 3,-0.4 0.967 110.4 48.7 -56.8 -53.5 40.5 -17.2 45.8 11 154 A L H X S+ 0 0 1 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.875 107.9 53.7 -57.9 -41.3 37.7 -16.8 43.2 12 155 A T H X>S+ 0 0 38 -4,-1.8 4,-2.3 1,-0.2 5,-0.7 0.858 108.9 49.4 -64.6 -37.8 35.6 -14.6 45.5 13 156 A A H <5S+ 0 0 63 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.879 113.2 45.8 -68.3 -42.4 38.5 -12.3 46.1 14 157 A L H <5S+ 0 0 4 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.888 118.2 43.3 -64.0 -40.7 39.2 -12.0 42.3 15 158 A I H <5S- 0 0 2 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.866 94.8-139.7 -76.6 -37.7 35.5 -11.5 41.5 16 159 A G T <5S+ 0 0 52 -4,-2.3 2,-0.3 -5,-0.2 -3,-0.2 0.664 77.5 73.3 78.0 20.4 34.7 -9.0 44.3 17 160 A Y S - 0 0 58 -2,-0.3 3,-1.4 1,-0.1 -9,-0.0 -0.795 17.5-169.2 -98.3 103.9 30.4 -14.2 46.4 19 162 A V T 3 S+ 0 0 9 -2,-0.8 -1,-0.1 1,-0.2 15,-0.1 0.355 86.4 57.4 -72.2 -0.0 28.5 -16.4 43.9 20 163 A T T 3 S+ 0 0 67 10,-0.0 2,-0.3 11,-0.0 -1,-0.2 0.426 79.8 105.9-100.7 -9.2 27.5 -18.9 46.7 21 164 A D < + 0 0 70 -3,-1.4 3,-0.1 1,-0.1 0, 0.0 -0.580 44.2 179.9 -75.1 137.0 25.7 -16.2 48.7 22 165 A V > + 0 0 85 -2,-0.3 3,-0.6 1,-0.1 -1,-0.1 -0.011 45.1 112.6-134.2 27.8 22.0 -16.7 48.4 23 166 A S T 3 S+ 0 0 80 1,-0.2 -1,-0.1 3,-0.0 -2,-0.0 0.635 84.4 43.2 -76.9 -16.7 20.6 -13.9 50.6 24 167 A N T 3 S+ 0 0 7 -3,-0.1 268,-0.3 271,-0.0 2,-0.3 -0.443 95.4 91.9-129.0 56.4 19.2 -12.1 47.5 25 168 A V < - 0 0 51 -3,-0.6 3,-0.1 266,-0.1 -3,-0.1 -0.879 42.7-172.5-139.2 163.1 17.6 -14.9 45.4 26 169 A H S S+ 0 0 69 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.257 81.3 18.4-140.0 1.1 14.1 -16.5 45.2 27 170 A D S S- 0 0 42 235,-0.0 -1,-0.3 0, 0.0 3,-0.3 -0.881 87.1-101.4-150.2-175.9 14.9 -19.4 42.9 28 171 A D S > S+ 0 0 63 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.051 72.3 123.2-104.8 30.8 18.1 -21.2 41.9 29 172 A E H > S+ 0 0 6 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.923 77.2 50.8 -58.1 -47.2 18.8 -19.7 38.5 30 173 A L H > S+ 0 0 21 -3,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.954 113.6 44.2 -52.7 -54.3 22.3 -18.4 39.5 31 174 A E H >> S+ 0 0 40 1,-0.2 4,-2.0 2,-0.2 3,-0.6 0.926 112.3 53.1 -56.5 -46.6 23.3 -21.9 40.9 32 175 A F H 3X S+ 0 0 84 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.913 106.9 52.6 -57.1 -42.2 21.8 -23.6 37.8 33 176 A T H 3X S+ 0 0 1 -4,-2.7 4,-1.5 -5,-0.3 -1,-0.2 0.773 105.4 55.1 -66.2 -27.7 23.9 -21.4 35.6 34 177 A R H < S+ 0 0 123 -4,-2.0 3,-1.0 1,-0.2 4,-0.4 0.921 114.5 53.7 -60.9 -40.6 26.4 -26.0 36.9 36 179 A G H >< S+ 0 0 20 -4,-2.5 3,-0.6 1,-0.3 -1,-0.2 0.799 101.7 55.2 -66.1 -33.2 25.5 -25.2 33.3 37 180 A L H 3X S+ 0 0 2 -4,-1.5 4,-1.8 1,-0.2 -1,-0.3 0.600 87.9 81.0 -82.6 -5.9 28.7 -23.3 32.4 38 181 A V H S+ 0 0 102 -3,-0.6 4,-2.5 -4,-0.4 5,-0.2 0.953 112.5 39.0 -67.2 -55.4 30.3 -28.0 30.1 40 183 A P H > S+ 0 0 4 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.863 116.1 54.8 -66.2 -32.5 31.2 -25.2 27.7 41 184 A R H X S+ 0 0 3 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.963 112.7 42.0 -57.7 -51.0 34.1 -24.2 30.0 42 185 A M H X S+ 0 0 90 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.839 109.2 57.2 -72.8 -34.6 35.5 -27.7 29.9 43 186 A A H X S+ 0 0 55 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.889 113.5 41.3 -58.6 -37.4 34.9 -28.2 26.2 44 187 A E H X S+ 0 0 10 -4,-1.7 4,-1.0 2,-0.2 -2,-0.2 0.838 111.6 55.1 -82.6 -34.5 37.1 -25.1 25.5 45 188 A V H >< S+ 0 0 37 -4,-2.3 3,-0.5 -5,-0.2 -2,-0.2 0.963 112.6 43.1 -56.9 -49.9 39.7 -26.0 28.1 46 189 A A H 3< S+ 0 0 89 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.786 116.3 44.8 -74.1 -29.2 40.3 -29.4 26.6 47 190 A S H 3< S+ 0 0 87 -4,-1.2 -1,-0.2 -5,-0.2 2,-0.2 0.547 86.4 107.3 -96.6 -5.9 40.3 -28.4 22.9 48 191 A R S << S- 0 0 29 -4,-1.0 3,-0.0 -3,-0.5 410,-0.0 -0.517 77.5-113.9 -76.1 140.9 42.5 -25.3 23.2 49 192 A D > - 0 0 79 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.648 19.3-149.1 -74.7 114.1 46.1 -25.7 21.9 50 193 A P H > S+ 0 0 75 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.896 92.6 48.9 -48.4 -49.4 48.5 -25.5 24.8 51 194 A K H > S+ 0 0 133 1,-0.2 4,-1.4 2,-0.2 5,-0.2 0.937 115.1 41.2 -60.8 -51.2 51.4 -23.9 22.7 52 195 A L H > S+ 0 0 79 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.778 113.2 54.9 -75.9 -25.1 49.4 -21.1 21.1 53 196 A Y H < S+ 0 0 6 -4,-1.9 407,-0.4 2,-0.2 -1,-0.2 0.908 107.3 48.8 -68.9 -46.2 47.4 -20.3 24.2 54 197 A A H < S+ 0 0 9 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.856 123.0 33.6 -59.9 -37.6 50.5 -19.7 26.3 55 198 A M H < S- 0 0 10 -4,-1.4 70,-0.5 -5,-0.2 -2,-0.2 0.698 87.4-163.9 -96.3 -26.1 52.0 -17.5 23.7 56 199 A H < - 0 0 18 -4,-2.1 69,-0.2 -5,-0.2 -3,-0.1 0.842 12.5-146.4 43.3 58.1 48.7 -15.9 22.4 57 200 A P - 0 0 26 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.224 6.5-136.5 -47.8 138.1 49.9 -14.4 19.1 58 201 A W + 0 0 67 67,-0.4 78,-2.3 403,-0.0 79,-0.4 -0.905 45.5 154.1-104.2 110.9 48.0 -11.2 18.3 59 202 A V B -A 135 0A 39 -2,-0.7 366,-0.3 76,-0.2 2,-0.3 -0.753 30.1-160.6-137.1 166.0 47.2 -11.6 14.7 60 203 A T - 0 0 1 74,-1.8 -2,-0.0 -2,-0.2 0, 0.0 -0.994 20.2-149.7-152.3 155.9 44.8 -10.6 11.9 61 204 A S + 0 0 96 -2,-0.3 3,-0.1 2,-0.1 -1,-0.1 0.468 65.6 111.5-101.6 -10.6 43.7 -11.7 8.4 62 205 A K S S- 0 0 51 1,-0.1 -2,-0.1 72,-0.1 2,-0.1 -0.290 78.1-100.8 -57.1 151.9 42.9 -8.2 7.1 63 206 A P - 0 0 97 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.464 39.9 -95.4 -73.1 150.4 45.3 -6.9 4.4 64 207 A L - 0 0 6 -2,-0.1 5,-0.1 1,-0.1 70,-0.1 -0.555 54.1-112.0 -60.2 123.4 48.0 -4.4 5.4 65 208 A P >> - 0 0 9 0, 0.0 4,-1.6 0, 0.0 3,-1.3 -0.183 22.3-109.1 -60.1 155.2 46.3 -1.1 4.6 66 209 A E H 3> S+ 0 0 144 1,-0.3 4,-2.0 2,-0.2 -2,-0.1 0.834 117.6 58.4 -54.7 -38.8 47.7 1.0 1.6 67 210 A Y H 34 S+ 0 0 50 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.741 108.0 45.7 -66.3 -25.8 49.2 3.6 4.0 68 211 A L H X4 S+ 0 0 6 -3,-1.3 3,-0.7 2,-0.1 -1,-0.2 0.760 107.8 56.5 -85.7 -29.1 51.3 0.9 5.7 69 212 A W H >< S+ 0 0 90 -4,-1.6 3,-2.9 1,-0.2 -2,-0.2 0.943 97.0 63.4 -61.0 -48.5 52.5 -0.7 2.5 70 213 A K T 3< S+ 0 0 168 -4,-2.0 -1,-0.2 1,-0.3 3,-0.2 0.622 94.0 64.0 -54.2 -14.7 53.9 2.7 1.3 71 214 A K T < S+ 0 0 89 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.161 96.9 60.1 -93.0 14.5 56.2 2.4 4.3 72 215 A I X + 0 0 14 -3,-2.9 3,-0.8 5,-0.1 -1,-0.2 -0.646 58.5 165.1-136.0 77.7 57.8 -0.8 2.7 73 216 A A T 3 S+ 0 0 107 1,-0.2 -3,-0.1 -3,-0.2 -4,-0.0 0.260 75.3 44.1 -79.8 19.3 59.3 0.5 -0.7 74 217 A N T 3 S- 0 0 87 2,-0.3 -1,-0.2 0, 0.0 3,-0.1 0.365 103.5-112.3-143.8 -3.1 61.4 -2.7 -1.1 75 218 A N S < S+ 0 0 88 -3,-0.8 2,-0.3 1,-0.2 -2,-0.1 0.873 87.2 106.2 46.1 41.9 59.3 -5.8 -0.2 76 219 A C - 0 0 23 17,-0.1 2,-0.4 18,-0.1 -2,-0.3 -0.992 54.8-157.2-142.9 151.5 61.6 -6.3 2.8 77 220 A I E -B 92 0B 6 15,-3.5 15,-0.8 -2,-0.3 2,-0.6 -0.992 17.6-132.7-135.2 122.9 61.1 -5.7 6.6 78 221 A F E +B 91 0B 115 -2,-0.4 70,-0.8 13,-0.2 2,-0.3 -0.670 28.8 175.0 -85.7 115.3 63.9 -5.0 9.1 79 222 A I E -Bc 90 148B 7 11,-1.6 11,-1.4 -2,-0.6 2,-0.5 -0.927 18.2-148.0-120.4 146.5 63.7 -7.1 12.3 80 223 A V E -Bc 89 149B 14 68,-1.9 70,-2.1 -2,-0.3 2,-0.2 -0.938 9.5-160.4-124.4 109.2 66.4 -7.2 15.1 81 224 A I E -Bc 88 150B 3 7,-1.4 7,-1.3 -2,-0.5 2,-0.3 -0.642 12.1-157.2 -92.3 146.9 67.0 -10.4 17.1 82 225 A H E +Bc 87 151B 43 68,-0.9 70,-1.7 -2,-0.2 2,-0.2 -0.861 20.0 163.1-127.6 154.3 68.7 -10.4 20.6 83 226 A R E > S-B 86 0B 131 3,-1.7 3,-0.6 -2,-0.3 70,-0.1 -0.841 71.1 -22.6-145.4-176.8 70.7 -12.5 23.0 84 227 A S T 3 S- 0 0 116 1,-0.3 -2,-0.0 -2,-0.2 3,-0.0 0.385 128.8 -45.5 11.3 -86.3 73.0 -11.9 26.1 85 228 A T T 3 S+ 0 0 139 2,-0.0 -1,-0.3 -3,-0.0 2,-0.1 0.012 117.7 112.2-141.3 23.7 73.7 -8.4 24.8 86 229 A T E < +B 83 0B 93 -3,-0.6 -3,-1.7 2,-0.0 2,-0.3 -0.471 40.5 179.1 -92.9 165.8 74.3 -9.4 21.2 87 230 A S E -B 82 0B 65 -5,-0.2 2,-0.3 -2,-0.1 -5,-0.2 -0.876 12.3-172.1-169.6 136.9 72.1 -8.5 18.2 88 231 A Q E -B 81 0B 88 -7,-1.3 -7,-1.4 -2,-0.3 2,-0.6 -0.878 23.9-125.7-127.9 162.6 71.9 -8.9 14.4 89 232 A T E -B 80 0B 68 -2,-0.3 2,-0.6 -9,-0.2 -9,-0.2 -0.891 20.3-163.5-117.5 104.0 69.6 -7.5 11.7 90 233 A I E -B 79 0B 13 -11,-1.4 -11,-1.6 -2,-0.6 2,-0.2 -0.753 15.6-138.2 -89.4 118.9 67.8 -9.9 9.4 91 234 A K E -B 78 0B 162 -2,-0.6 2,-0.3 -13,-0.2 -13,-0.2 -0.576 35.2-176.0 -68.3 137.5 66.2 -8.5 6.2 92 235 A V E -B 77 0B 5 -15,-0.8 -15,-3.5 -2,-0.2 9,-0.0 -0.964 26.9-122.9-144.4 147.4 62.8 -10.2 5.9 93 236 A S > - 0 0 26 -2,-0.3 3,-2.0 -17,-0.3 39,-0.4 -0.768 25.5-125.1 -93.2 143.8 59.8 -10.4 3.5 94 237 A P T 3 S+ 0 0 0 0, 0.0 39,-1.7 0, 0.0 38,-0.4 0.849 110.6 54.5 -52.2 -38.8 56.3 -9.5 4.7 95 238 A D T 3 S+ 0 0 99 36,-0.2 2,-0.1 37,-0.2 -3,-0.0 0.528 85.6 114.9 -76.6 -5.4 54.9 -12.9 3.7 96 239 A D < - 0 0 53 -3,-2.0 36,-2.3 35,-0.1 37,-0.2 -0.423 62.4-133.9 -70.6 137.6 57.5 -14.7 5.7 97 240 A T > - 0 0 33 34,-0.2 4,-1.1 -2,-0.1 32,-0.1 -0.456 22.2-114.7 -77.0 154.4 56.4 -16.8 8.7 98 241 A P H > S+ 0 0 5 0, 0.0 4,-1.5 0, 0.0 3,-0.2 0.861 119.7 56.0 -50.6 -42.8 58.1 -16.6 12.1 99 242 A G H > S+ 0 0 42 29,-0.3 4,-1.4 1,-0.2 3,-0.5 0.950 107.3 47.7 -52.8 -52.5 59.2 -20.2 11.5 100 243 A A H 4 S+ 0 0 55 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.686 108.0 56.5 -65.2 -22.8 60.8 -19.3 8.2 101 244 A I H < S+ 0 0 1 -4,-1.1 -1,-0.2 -3,-0.2 3,-0.2 0.824 101.9 54.2 -82.3 -33.8 62.6 -16.3 9.7 102 245 A L H >X S+ 0 0 30 -4,-1.5 4,-3.3 -3,-0.5 3,-1.0 0.913 107.3 50.2 -64.6 -45.7 64.4 -18.4 12.4 103 246 A Q T 3< S+ 0 0 148 -4,-1.4 4,-0.4 1,-0.3 -1,-0.2 0.623 106.2 57.7 -71.2 -13.8 65.9 -20.7 9.9 104 247 A S T 34 S+ 0 0 51 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 -0.313 116.7 35.1-103.3 43.8 67.1 -17.6 8.0 105 248 A F T <> S+ 0 0 21 -3,-1.0 4,-0.8 5,-0.1 -2,-0.2 0.205 112.0 54.9-153.2 -52.1 69.0 -16.6 11.1 106 249 A F H X S+ 0 0 58 -4,-3.3 4,-0.8 2,-0.2 -3,-0.2 0.775 117.4 41.4 -55.4 -33.5 70.1 -20.0 12.6 107 250 A T H 4 S+ 0 0 94 -4,-0.4 -1,-0.2 -5,-0.3 -3,-0.1 0.805 110.2 56.8 -81.9 -36.9 71.7 -20.5 9.1 108 251 A K H 4 S+ 0 0 122 1,-0.2 -2,-0.2 -5,-0.0 -1,-0.2 0.594 120.4 31.7 -67.8 -10.1 72.9 -16.9 9.0 109 252 A M H < S+ 0 0 121 -4,-0.8 2,-0.3 1,-0.2 -2,-0.2 0.525 119.3 43.1-124.6 -10.6 74.7 -17.7 12.4 110 253 A A < 0 0 69 -4,-0.8 -1,-0.2 -5,-0.1 -5,-0.1 -0.945 360.0 360.0-147.2 120.5 75.8 -21.4 12.3 111 254 A K 0 0 254 -2,-0.3 -4,-0.0 -3,-0.1 -5,-0.0 -0.816 360.0 360.0-150.9 360.0 77.3 -23.6 9.6 112 ! 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 0.0 113 268 A Q 0 0 179 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 103.1 66.9 -26.6 20.9 114 269 A D + 0 0 123 41,-0.1 2,-0.3 2,-0.0 0, 0.0 -0.942 360.0 166.2-130.2 107.6 63.5 -24.8 20.9 115 270 A F - 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0 0 84 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.538 360.0 -81.3 -83.0 141.4 3.6 -18.0 -3.6 317 546 A E - 0 0 142 -2,-0.2 -1,-0.1 1,-0.1 0, 0.0 -0.014 42.5-123.6 -71.7 138.9 5.0 -15.0 -5.5 318 547 A M - 0 0 21 1,-0.1 -1,-0.1 -3,-0.1 2,-0.1 0.112 17.8-114.8 -62.9 163.7 4.4 -11.3 -4.6 319 548 A P - 0 0 66 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 -0.055 36.6-108.1 -79.0-159.4 3.0 -8.4 -6.6 320 549 A N S > S+ 0 0 115 2,-0.1 4,-1.6 3,-0.1 3,-0.1 0.896 103.8 43.7-110.2 -55.2 5.3 -5.5 -7.5 321 550 A Q H > S+ 0 0 109 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.732 110.2 61.0 -70.0 -20.3 4.8 -2.2 -5.7 322 551 A L H > S+ 0 0 40 2,-0.2 4,-3.4 1,-0.2 -1,-0.2 0.915 102.3 50.4 -69.4 -45.2 4.4 -4.2 -2.4 323 552 A R H > S+ 0 0 59 -4,-0.3 4,-3.7 1,-0.2 5,-0.2 0.903 108.1 54.5 -54.9 -42.4 8.0 -5.5 -2.8 324 553 A K H X S+ 0 0 146 -4,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.887 110.9 45.0 -55.5 -42.4 8.9 -1.9 -3.3 325 554 A Q H X S+ 0 0 60 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.944 115.3 47.1 -64.9 -46.9 7.2 -1.1 0.0 326 555 A L H X S+ 0 0 4 -4,-3.4 4,-2.3 1,-0.2 -2,-0.2 0.942 113.4 47.7 -62.3 -50.6 8.8 -4.1 1.6 327 556 A E H X S+ 0 0 89 -4,-3.7 4,-1.8 2,-0.2 -1,-0.2 0.738 109.8 53.4 -59.0 -32.1 12.3 -3.2 0.2 328 557 A A H X S+ 0 0 61 -4,-1.6 4,-0.6 -5,-0.2 -2,-0.2 0.958 110.2 46.9 -69.4 -51.5 11.8 0.4 1.4 329 558 A I H >< S+ 0 0 13 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.885 114.3 49.0 -49.4 -47.1 11.0 -0.7 5.0 330 559 A I H 3< S+ 0 0 18 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.908 108.4 51.5 -64.0 -42.4 14.0 -3.1 4.8 331 560 A A H 3< S+ 0 0 87 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.559 92.2 103.5 -72.8 -6.1 16.5 -0.4 3.5 332 561 A T S << S- 0 0 40 -3,-0.8 -3,-0.0 -4,-0.6 -4,-0.0 -0.332 79.5 -94.2 -85.4 157.1 15.4 1.9 6.3 333 562 A D > - 0 0 14 1,-0.1 3,-1.9 -2,-0.1 -1,-0.1 -0.197 32.5-104.3 -79.2 166.3 17.6 2.5 9.4 334 563 A P T 3 S+ 0 0 33 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.545 116.5 50.6 -68.5 -8.0 17.4 0.8 12.8 335 564 A L T 3 S+ 0 0 39 2,-0.1 -2,-0.1 473,-0.0 473,-0.0 0.297 79.0 117.1-109.7 8.0 15.7 3.7 14.7 336 565 A N S < S- 0 0 56 -3,-1.9 2,-0.1 -7,-0.1 -4,-0.0 -0.651 72.5-119.7 -75.2 119.0 13.0 4.1 12.1 337 566 A P - 0 0 90 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.414 21.5-131.1 -62.0 130.3 9.7 3.3 13.8 338 567 A L - 0 0 30 -2,-0.1 2,-0.1 27,-0.1 -9,-0.0 -0.778 21.2-137.8 -81.5 126.3 7.9 0.4 12.2 339 568 A T > - 0 0 74 -2,-0.5 4,-3.0 1,-0.1 5,-0.2 -0.440 21.0-113.3 -78.9 156.8 4.3 1.3 11.6 340 569 A A H > S+ 0 0 66 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.866 123.9 52.5 -56.4 -40.4 1.5 -1.2 12.3 341 570 A E H > S+ 0 0 121 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.906 110.6 47.2 -53.3 -48.8 1.0 -1.3 8.5 342 571 A D H > S+ 0 0 32 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.922 109.8 52.1 -65.5 -48.9 4.7 -2.0 8.1 343 572 A K H X S+ 0 0 77 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.913 110.4 47.4 -53.3 -50.5 4.8 -4.8 10.7 344 573 A E H X S+ 0 0 137 -4,-2.0 4,-3.0 2,-0.2 5,-0.3 0.847 110.6 54.0 -63.6 -37.9 1.8 -6.6 9.2 345 574 A L H X S+ 0 0 24 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.956 110.4 45.3 -57.2 -55.4 3.5 -6.3 5.8 346 575 A L H < S+ 0 0 0 -4,-2.7 7,-0.3 2,-0.2 -2,-0.2 0.911 117.2 46.3 -54.8 -43.7 6.8 -7.8 7.1 347 576 A W H >< S+ 0 0 37 -4,-2.4 3,-1.7 1,-0.2 4,-0.2 0.961 111.7 47.5 -69.0 -53.0 4.8 -10.6 8.8 348 577 A H H 3< S+ 0 0 134 -4,-3.0 3,-0.2 1,-0.3 -1,-0.2 0.858 122.1 37.9 -54.6 -39.9 2.4 -11.5 5.9 349 578 A F T 3X S+ 0 0 33 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.3 -0.290 78.4 135.1-104.5 43.4 5.4 -11.6 3.6 350 579 A R H <> + 0 0 40 -3,-1.7 4,-2.4 1,-0.2 5,-0.2 0.932 67.7 55.7 -59.1 -46.3 7.8 -13.2 6.1 351 580 A Y H > S+ 0 0 76 -3,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.909 110.1 43.9 -55.2 -44.3 9.1 -15.7 3.7 352 581 A E H >4 S+ 0 0 26 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.908 112.6 54.6 -66.2 -39.9 10.2 -13.0 1.2 353 582 A S H >< S+ 0 0 0 -4,-2.4 3,-1.8 -7,-0.3 6,-0.3 0.851 98.3 63.5 -58.0 -35.7 11.6 -11.0 4.1 354 583 A L H 3< S+ 0 0 12 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.698 89.3 68.1 -65.9 -19.5 13.7 -14.0 5.2 355 584 A K T << S+ 0 0 112 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.608 93.5 65.5 -74.2 -8.9 15.6 -13.8 1.9 356 585 A H X - 0 0 56 -3,-1.8 3,-2.8 -4,-0.2 4,-0.4 -0.903 67.1-162.2-118.6 100.9 17.1 -10.4 3.1 357 586 A P G > S+ 0 0 29 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.773 92.3 62.1 -52.6 -28.6 19.4 -10.9 6.2 358 587 A K G 3 S+ 0 0 122 1,-0.2 4,-0.3 2,-0.1 -4,-0.1 0.555 93.9 61.6 -71.1 -12.7 19.0 -7.1 6.8 359 588 A A G <> S+ 0 0 0 -3,-2.8 4,-3.3 -6,-0.3 -1,-0.2 0.541 78.7 94.4 -85.2 -7.3 15.2 -7.5 7.3 360 589 A Y H <> S+ 0 0 0 -3,-0.9 4,-3.4 -4,-0.4 5,-0.4 0.908 80.5 47.3 -62.3 -50.5 15.7 -9.7 10.3 361 590 A P H > S+ 0 0 7 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.905 118.7 41.7 -52.4 -46.3 15.5 -7.0 13.1 362 591 A K H 4 S+ 0 0 14 -4,-0.3 -2,-0.2 2,-0.2 -3,-0.1 0.927 114.8 52.1 -73.4 -41.6 12.4 -5.5 11.6 363 592 A L H >< S+ 0 0 0 -4,-3.3 3,-1.9 1,-0.2 -3,-0.2 0.938 113.1 42.9 -54.2 -52.2 10.9 -8.9 10.8 364 593 A F H >< S+ 0 0 0 -4,-3.4 3,-0.8 1,-0.3 -1,-0.2 0.773 110.7 56.2 -75.5 -15.9 11.4 -10.2 14.3 365 594 A S T 3< S+ 0 0 33 -4,-1.4 -1,-0.3 -5,-0.4 -2,-0.2 0.346 99.5 62.9 -91.3 10.6 10.2 -7.0 15.7 366 595 A S T < S+ 0 0 12 -3,-1.9 2,-0.4 -23,-0.1 -1,-0.2 0.214 82.9 107.0-106.1 10.6 7.0 -7.5 13.6 367 596 A V S < S- 0 0 2 -3,-0.8 2,-1.3 -20,-0.0 3,-0.1 -0.721 72.5-132.1 -91.3 138.5 6.1 -10.7 15.6 368 597 A K > - 0 0 126 -2,-0.4 3,-1.2 1,-0.2 6,-0.2 -0.758 25.5-175.4 -84.6 92.8 3.2 -10.8 18.1 369 598 A W T 3 S+ 0 0 8 -2,-1.3 -1,-0.2 1,-0.3 6,-0.1 0.712 74.0 69.3 -66.1 -19.2 5.3 -12.5 20.8 370 599 A G T 3 S+ 0 0 16 -3,-0.1 2,-0.4 -134,-0.1 -1,-0.3 0.130 86.5 74.5 -86.3 19.4 2.1 -12.7 23.0 371 600 A Q X> - 0 0 85 -3,-1.2 4,-1.9 1,-0.1 3,-1.1 -0.953 68.2-153.3-136.6 111.3 0.4 -15.3 20.8 372 601 A Q H 3> S+ 0 0 76 -2,-0.4 4,-2.0 1,-0.3 5,-0.1 0.835 92.3 53.1 -60.8 -37.1 1.7 -18.9 21.0 373 602 A E H 3> S+ 0 0 145 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.771 111.8 47.2 -71.0 -26.3 0.7 -20.0 17.4 374 603 A I H <> S+ 0 0 24 -3,-1.1 4,-1.8 2,-0.2 -1,-0.2 0.828 108.7 53.0 -82.6 -34.3 2.5 -17.0 15.9 375 604 A V H X S+ 0 0 18 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.894 109.8 51.2 -61.2 -39.6 5.6 -17.6 18.0 376 605 A A H X S+ 0 0 32 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.883 107.2 51.2 -70.4 -39.0 5.6 -21.1 16.7 377 606 A K H X S+ 0 0 87 -4,-1.3 4,-1.4 1,-0.2 -1,-0.2 0.856 108.0 53.4 -64.8 -35.1 5.3 -20.0 13.1 378 607 A T H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.875 107.2 51.6 -65.6 -38.1 8.3 -17.7 13.8 379 608 A Y H X S+ 0 0 79 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.874 109.4 48.8 -68.2 -38.4 10.2 -20.7 15.0 380 609 A Q H < S+ 0 0 122 -4,-2.0 4,-0.5 2,-0.2 -1,-0.2 0.748 107.7 57.8 -67.5 -29.3 9.3 -22.7 11.8 381 610 A L H >< S+ 0 0 0 -4,-1.4 3,-1.3 1,-0.2 -2,-0.2 0.987 109.5 42.7 -61.3 -56.0 10.5 -19.6 9.9 382 611 A L H >< S+ 0 0 3 -4,-2.1 3,-0.8 1,-0.3 -2,-0.2 0.547 97.2 72.7 -68.5 -18.1 14.0 -19.7 11.5 383 612 A A T 3< S+ 0 0 79 -4,-0.8 2,-0.3 1,-0.3 -1,-0.3 0.770 99.4 52.1 -66.3 -23.5 14.4 -23.5 11.2 384 613 A R T < S+ 0 0 168 -3,-1.3 3,-0.4 -4,-0.5 -1,-0.3 -0.455 72.4 135.4-106.3 52.3 14.8 -22.7 7.5 385 614 A R X> + 0 0 74 -3,-0.8 4,-2.3 -2,-0.3 3,-0.7 0.078 17.5 127.1 -94.0 29.0 17.5 -20.1 8.0 386 615 A E H 3> S+ 0 0 141 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.833 73.0 52.4 -61.5 -31.0 19.9 -21.2 5.3 387 616 A V H 3> S+ 0 0 62 -3,-0.4 4,-0.9 1,-0.2 -1,-0.3 0.875 111.0 48.8 -66.6 -39.3 20.1 -17.7 3.7 388 617 A W H X4 S+ 0 0 1 -3,-0.7 3,-0.6 1,-0.2 -2,-0.2 0.913 108.7 53.3 -59.5 -47.5 21.0 -16.3 7.1 389 618 A D H 3< S+ 0 0 70 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.656 112.0 44.2 -70.5 -17.3 23.7 -19.0 7.6 390 619 A Q H 3< S+ 0 0 154 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.606 88.4 104.3-100.6 -15.5 25.4 -18.2 4.3 391 620 A S S << S- 0 0 29 -4,-0.9 3,-0.1 -3,-0.6 2,-0.1 -0.312 81.7-101.8 -65.2 147.6 25.4 -14.4 4.5 392 621 A A - 0 0 90 1,-0.1 -1,-0.1 -2,-0.0 2,-0.1 -0.429 50.0 -87.3 -66.4 147.3 28.7 -12.7 5.4 393 622 A L - 0 0 46 25,-0.1 2,-0.5 -2,-0.1 -1,-0.1 -0.366 42.3-171.8 -53.1 122.7 28.9 -11.6 9.1 394 623 A D > - 0 0 59 1,-0.1 4,-1.8 -2,-0.1 3,-0.5 -0.944 6.5-163.6-118.8 103.5 27.5 -8.1 9.4 395 624 A V H > S+ 0 0 21 -2,-0.5 4,-2.4 1,-0.3 5,-0.2 0.882 85.8 55.4 -66.2 -33.4 28.4 -7.1 12.9 396 625 A G H > S+ 0 0 0 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.863 106.8 49.1 -61.6 -42.2 25.9 -4.2 13.0 397 626 A L H > S+ 0 0 11 -3,-0.5 4,-1.0 2,-0.2 -1,-0.2 0.890 112.1 50.9 -59.3 -42.7 22.9 -6.5 12.0 398 627 A T H >X S+ 0 0 1 -4,-1.8 4,-0.7 1,-0.2 3,-0.6 0.904 104.8 52.9 -69.2 -44.9 24.0 -8.9 14.7 399 628 A M H >< S+ 0 0 0 -4,-2.4 3,-0.6 1,-0.2 -1,-0.2 0.820 102.9 61.1 -58.0 -34.8 24.2 -6.4 17.5 400 629 A Q H >< S+ 0 0 16 -4,-1.3 3,-1.0 1,-0.2 5,-0.3 0.881 102.8 50.7 -60.5 -38.4 20.7 -5.2 16.7 401 630 A L H << S+ 0 0 0 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.652 108.1 53.3 -72.8 -16.3 19.4 -8.7 17.5 402 631 A L T << S+ 0 0 0 -4,-0.7 -1,-0.2 -3,-0.6 38,-0.2 0.244 94.2 97.5-100.9 11.8 21.2 -8.7 20.9 403 632 A D S X S- 0 0 11 -3,-1.0 3,-1.3 -4,-0.1 -3,-0.1 -0.106 95.0 -81.5 -93.9-171.7 19.7 -5.5 22.0 404 633 A C T 3 S+ 0 0 8 1,-0.2 -3,-0.1 3,-0.1 -4,-0.1 0.607 117.1 69.6 -69.3 -15.2 16.7 -4.6 24.3 405 634 A N T 3 S+ 0 0 84 -5,-0.3 2,-0.4 1,-0.1 -1,-0.2 0.468 93.4 62.1 -82.9 -1.6 14.1 -5.1 21.5 406 635 A F < + 0 0 10 -3,-1.3 -1,-0.1 1,-0.1 -203,-0.1 -0.935 43.7 159.8-129.8 110.8 14.6 -9.0 21.4 407 636 A S + 0 0 17 -2,-0.4 2,-0.6 34,-0.1 -1,-0.1 0.197 44.3 112.2-108.9 10.8 13.9 -11.3 24.4 408 637 A D > - 0 0 1 1,-0.2 4,-2.3 -206,-0.1 5,-0.2 -0.776 60.1-148.4 -88.9 126.6 13.5 -14.5 22.4 409 638 A E H > S+ 0 0 97 -2,-0.6 4,-1.2 1,-0.2 -1,-0.2 0.879 97.1 50.9 -56.2 -38.3 16.3 -17.0 22.9 410 639 A N H > S+ 0 0 57 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.837 110.9 44.8 -77.7 -34.6 15.9 -18.3 19.4 411 640 A V H > S+ 0 0 0 1,-0.2 4,-0.7 2,-0.2 3,-0.4 0.883 115.7 50.0 -68.3 -41.4 16.2 -15.0 17.6 412 641 A R H X S+ 0 0 4 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.750 104.6 58.8 -69.3 -21.7 19.1 -14.0 19.9 413 642 A A H X S+ 0 0 34 -4,-1.2 4,-2.4 1,-0.2 -1,-0.2 0.785 97.5 57.0 -83.5 -26.8 20.9 -17.3 19.2 414 643 A I H X S+ 0 0 4 -4,-0.7 4,-1.1 -3,-0.4 -1,-0.2 0.726 106.5 52.7 -78.5 -21.2 21.2 -16.8 15.5 415 644 A A H X S+ 0 0 0 -4,-0.7 4,-1.6 2,-0.2 3,-0.4 0.937 110.1 46.4 -70.7 -49.5 23.0 -13.5 16.2 416 645 A V H X S+ 0 0 6 -4,-1.6 4,-0.9 1,-0.2 3,-0.4 0.910 107.3 58.6 -59.9 -39.1 25.4 -15.3 18.5 417 646 A Q H >< S+ 0 0 75 -4,-2.4 3,-0.6 1,-0.3 4,-0.3 0.871 105.3 49.8 -58.5 -41.4 25.9 -18.0 15.8 418 647 A K H >< S+ 0 0 9 -4,-1.1 3,-1.0 -3,-0.4 -1,-0.3 0.800 101.0 62.5 -65.0 -35.3 27.0 -15.3 13.4 419 648 A L H >< S+ 0 0 1 -4,-1.6 3,-2.0 -3,-0.4 -1,-0.2 0.776 85.2 81.1 -62.2 -23.0 29.6 -13.9 15.9 420 649 A E T << S+ 0 0 90 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.801 85.0 55.8 -54.1 -36.8 31.3 -17.3 15.8 421 650 A S T < S+ 0 0 90 -3,-1.0 2,-0.3 -4,-0.3 -1,-0.3 0.443 80.6 114.3 -81.3 -1.1 33.2 -16.4 12.6 422 651 A L < - 0 0 6 -3,-2.0 2,-0.0 -4,-0.2 -3,-0.0 -0.561 66.9-131.5 -60.4 124.7 34.7 -13.3 14.2 423 652 A E >> - 0 0 46 -2,-0.3 4,-2.0 1,-0.1 3,-0.6 -0.333 28.2-101.9 -71.6 165.0 38.5 -13.6 14.5 424 653 A D H 3> S+ 0 0 45 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.869 123.1 62.2 -57.5 -38.1 40.0 -12.8 17.9 425 654 A D H 3> S+ 0 0 8 -366,-0.3 4,-0.9 1,-0.2 -1,-0.3 0.914 107.9 42.0 -50.1 -48.9 41.1 -9.5 16.4 426 655 A D H <> S+ 0 0 36 -3,-0.6 4,-1.2 2,-0.2 -1,-0.2 0.810 108.5 58.4 -74.8 -28.8 37.4 -8.5 15.8 427 656 A V H >X S+ 0 0 0 -4,-2.0 4,-1.4 1,-0.2 3,-1.1 0.967 101.5 57.0 -62.8 -48.1 36.2 -9.8 19.1 428 657 A L H 3< S+ 0 0 26 -4,-2.6 4,-0.3 1,-0.3 3,-0.3 0.841 106.0 51.4 -49.1 -38.9 38.7 -7.5 20.8 429 658 A H H 3< S+ 0 0 36 -4,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.780 121.1 29.4 -71.2 -30.5 37.0 -4.6 19.0 430 659 A Y H XX S+ 0 0 20 -4,-1.2 4,-2.0 -3,-1.1 3,-0.7 0.425 90.3 105.4-108.3 4.8 33.4 -5.4 20.1 431 660 A L H 3X S+ 0 0 1 -4,-1.4 4,-2.3 1,-0.3 5,-0.2 0.809 75.3 51.0 -66.5 -38.7 34.1 -7.1 23.3 432 661 A L H 3> S+ 0 0 4 -4,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.837 113.8 44.8 -67.8 -36.3 33.0 -4.4 25.7 433 662 A Q H <> S+ 0 0 3 -3,-0.7 4,-1.6 2,-0.2 -1,-0.2 0.807 110.3 53.7 -80.1 -27.9 29.7 -4.0 24.1 434 663 A L H X S+ 0 0 1 -4,-2.0 4,-0.5 2,-0.2 -2,-0.2 0.911 109.8 49.5 -65.3 -40.0 29.1 -7.7 23.8 435 664 A V H >< S+ 0 0 0 -4,-2.3 3,-1.5 1,-0.2 4,-0.3 0.941 112.1 47.7 -62.4 -45.0 29.7 -7.9 27.5 436 665 A Q H >< S+ 0 0 7 -4,-1.8 3,-2.0 1,-0.3 -1,-0.2 0.823 101.2 65.4 -67.1 -26.7 27.3 -5.0 28.1 437 666 A A H >< S+ 0 0 1 -4,-1.6 3,-1.7 1,-0.3 4,-0.3 0.637 81.9 77.9 -72.8 -14.9 24.7 -6.7 25.8 438 667 A V G X< S+ 0 0 1 -3,-1.5 3,-1.1 -4,-0.5 -1,-0.3 0.755 81.3 69.8 -58.3 -24.2 24.5 -9.5 28.5 439 668 A K G < S+ 0 0 4 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.527 94.0 54.8 -73.1 -5.6 22.4 -7.0 30.3 440 669 A F G < S+ 0 0 11 -3,-1.7 -1,-0.2 -38,-0.2 -2,-0.2 0.497 81.9 107.2-104.9 -7.2 19.6 -7.5 27.7 441 670 A E < - 0 0 17 -3,-1.1 -34,-0.1 -4,-0.3 5,-0.0 -0.535 62.3-149.3 -67.2 130.4 19.4 -11.3 28.1 442 671 A P S S+ 0 0 17 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.898 82.1 45.8 -63.2 -39.9 16.3 -12.4 30.0 443 672 A Y S S- 0 0 20 1,-0.1 -3,-0.0 2,-0.1 -2,-0.0 -0.698 79.2-129.3-108.3 155.8 18.1 -15.5 31.5 444 673 A H S S+ 0 0 19 -2,-0.2 2,-0.8 1,-0.2 -1,-0.1 0.851 100.7 59.2 -70.4 -38.4 21.6 -15.7 33.2 445 674 A D S S+ 0 0 43 4,-0.1 2,-0.3 3,-0.0 -1,-0.2 -0.842 76.7 151.5 -93.3 107.9 22.6 -18.6 31.0 446 675 A S > - 0 0 10 -2,-0.8 4,-2.1 1,-0.1 5,-0.2 -0.851 61.4-109.6-128.6 167.8 22.5 -17.5 27.4 447 676 A A H > S+ 0 0 43 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.814 121.0 55.1 -62.2 -26.3 24.1 -18.2 24.1 448 677 A L H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.856 105.7 49.8 -77.9 -34.4 25.8 -14.8 24.4 449 678 A A H > S+ 0 0 1 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.960 112.6 48.1 -66.2 -46.5 27.2 -15.6 27.8 450 679 A R H X S+ 0 0 84 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.892 107.2 55.2 -66.1 -37.8 28.6 -18.9 26.5 451 680 A F H X S+ 0 0 5 -4,-2.1 4,-2.6 1,-0.2 5,-0.3 0.957 110.9 45.4 -55.7 -47.8 30.2 -17.2 23.4 452 681 A L H X S+ 0 0 1 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.884 112.3 51.2 -64.4 -42.8 32.1 -14.8 25.7 453 682 A L H X S+ 0 0 2 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.952 113.9 44.6 -52.5 -55.3 33.2 -17.5 28.0 454 683 A K H X S+ 0 0 69 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.894 115.2 45.4 -63.9 -44.4 34.5 -19.6 25.1 455 684 A R H X S+ 0 0 8 -4,-2.6 4,-0.9 -5,-0.2 8,-0.2 0.886 112.2 53.7 -69.6 -35.5 36.2 -16.8 23.3 456 685 A G H >< S+ 0 0 0 -4,-2.3 3,-0.7 -5,-0.3 7,-0.7 0.931 110.8 45.5 -59.1 -47.2 37.7 -15.7 26.6 457 686 A L H 3< S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.713 108.0 57.0 -72.3 -22.0 39.1 -19.1 27.3 458 687 A R H 3< S+ 0 0 97 -4,-1.2 2,-0.4 1,-0.2 -1,-0.2 0.735 114.3 33.8 -83.1 -19.6 40.5 -19.5 23.8 459 688 A N S+ 0 0 28 -407,-0.4 4,-3.1 -2,-0.4 5,-0.2 0.829 100.4 54.9 -57.2 -36.8 44.5 -14.7 26.9 461 690 A R H > S+ 0 0 37 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.955 112.7 41.9 -65.8 -47.5 44.1 -11.2 25.4 462 691 A I H > S+ 0 0 0 -7,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.923 114.8 53.0 -60.0 -43.1 40.4 -11.7 25.2 463 692 A G H X S+ 0 0 0 -4,-2.7 4,-2.6 -7,-0.7 -2,-0.2 0.955 106.6 52.2 -58.7 -50.8 40.3 -13.4 28.6 464 693 A H H X S+ 0 0 7 -4,-3.1 4,-1.8 1,-0.2 -1,-0.2 0.932 114.3 40.6 -51.3 -57.6 42.2 -10.5 30.2 465 694 A F H X S+ 0 0 23 -4,-1.9 4,-2.6 1,-0.2 5,-0.3 0.910 110.6 58.0 -62.4 -42.4 39.8 -7.8 29.0 466 695 A L H X S+ 0 0 0 -4,-3.0 4,-2.7 -5,-0.2 5,-0.3 0.922 106.4 52.4 -48.2 -45.4 36.8 -10.0 29.6 467 696 A F H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.950 113.2 40.1 -58.2 -56.7 37.9 -10.2 33.2 468 697 A W H X S+ 0 0 1 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.771 114.9 52.4 -64.8 -29.9 38.2 -6.4 33.7 469 698 A F H X S+ 0 0 15 -4,-2.6 4,-1.0 2,-0.2 -1,-0.2 0.919 114.6 42.0 -76.6 -42.4 35.1 -5.6 31.8 470 699 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 -5,-0.3 3,-0.4 0.902 114.3 51.8 -62.1 -48.7 33.0 -8.1 33.9 471 700 A R H X S+ 0 0 17 -4,-2.8 4,-1.2 -5,-0.3 -2,-0.2 0.823 102.4 60.6 -60.3 -30.9 34.7 -7.0 37.1 472 701 A S H < S+ 0 0 2 -4,-1.5 4,-0.4 1,-0.2 -1,-0.2 0.893 111.3 38.7 -61.6 -42.9 33.9 -3.3 36.2 473 702 A E H >X S+ 0 0 2 -4,-1.0 4,-2.6 -3,-0.4 3,-0.9 0.853 110.5 59.9 -74.9 -38.2 30.1 -4.1 36.2 474 703 A I H 3< S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.766 107.8 45.8 -64.1 -25.4 30.3 -6.5 39.2 475 704 A A T 3< S+ 0 0 47 -4,-1.2 170,-0.4 -5,-0.1 -1,-0.2 0.564 125.6 25.8 -94.3 -10.2 31.7 -3.7 41.4 476 705 A Q T <4 S+ 0 0 24 -3,-0.9 2,-0.8 -4,-0.4 -2,-0.2 0.604 102.6 74.9-126.0 -28.1 29.3 -0.9 40.5 477 706 A S X - 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