==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 21-OCT-11 3UAH . COMPND 2 MOLECULE: PROTEIN SHQ1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR K.YE . 312 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15084.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 15 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 162 51.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 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 1 3 0 1 1 0 1 1 1 2 0 2 1 2 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 164 A G 0 0 78 0, 0.0 35,-0.1 0, 0.0 33,-0.0 0.000 360.0 360.0 360.0 -36.2 30.0 36.2 22.9 2 165 A I + 0 0 155 33,-0.1 2,-0.2 1,-0.1 34,-0.1 0.958 360.0 38.6 -85.0 -54.2 28.2 38.1 20.2 3 166 A L S S- 0 0 135 32,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.620 80.8-107.5-106.2 156.8 25.1 39.7 21.9 4 167 A K - 0 0 169 -2,-0.2 2,-0.4 31,-0.1 31,-0.2 -0.578 26.1-171.9 -79.6 139.4 24.5 41.4 25.2 5 168 A T - 0 0 51 29,-2.1 31,-0.3 -2,-0.3 6,-0.0 -0.999 19.9-133.9-128.7 129.8 22.5 39.7 28.0 6 169 A K - 0 0 105 -2,-0.4 2,-0.3 5,-0.2 8,-0.2 -0.187 27.0-174.6 -74.6 172.1 21.6 41.7 31.1 7 170 A Y B +A 13 0A 0 6,-2.2 6,-2.6 2,-0.1 5,-0.3 -0.873 31.8 54.0-155.7-178.1 21.9 40.3 34.6 8 171 A G S > S+ 0 0 4 -2,-0.3 3,-2.4 3,-0.2 243,-0.3 -0.366 96.2 14.6 77.6-160.1 21.3 40.9 38.3 9 172 A F G > S- 0 0 0 241,-2.8 3,-1.7 1,-0.3 4,-0.1 -0.318 142.2 -16.2 -56.1 123.7 18.0 41.7 40.0 10 173 A D G 3 S- 0 0 48 1,-0.3 -1,-0.3 121,-0.1 -2,-0.1 0.722 114.3 -79.1 47.6 29.8 15.2 41.0 37.5 11 174 A N G < S+ 0 0 78 -3,-2.4 -1,-0.3 239,-0.1 -5,-0.2 0.858 99.2 130.8 51.8 41.5 17.8 41.0 34.7 12 175 A L < + 0 0 94 -3,-1.7 2,-0.2 -5,-0.3 -4,-0.2 0.563 43.5 83.1 -95.9 -13.0 17.9 44.8 34.7 13 176 A Y B +A 7 0A 44 -6,-2.6 -6,-2.2 237,-0.2 2,-0.3 -0.626 42.2 154.5-108.3 155.1 21.6 45.5 34.9 14 177 A D + 0 0 64 -2,-0.2 2,-2.6 -8,-0.2 -8,-0.1 -0.946 51.9 30.3-157.1 175.3 24.6 45.7 32.6 15 178 A T S > S+ 0 0 77 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 -0.240 93.8 83.8 72.7 -48.1 28.0 47.3 32.0 16 179 A V H > S+ 0 0 33 -2,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.787 85.7 52.7 -66.6 -33.6 29.1 47.5 35.6 17 180 A I H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.951 109.7 49.2 -67.1 -44.4 30.4 43.9 36.1 18 181 A S H 4 S+ 0 0 54 1,-0.2 4,-0.5 2,-0.2 3,-0.4 0.925 112.8 48.1 -56.7 -45.3 32.7 44.2 33.0 19 182 A V H >< S+ 0 0 79 -4,-2.0 3,-1.4 1,-0.2 4,-0.2 0.907 108.0 56.2 -60.6 -42.2 34.0 47.5 34.4 20 183 A S H ><>S+ 0 0 12 -4,-2.2 5,-2.0 1,-0.3 3,-1.3 0.798 96.6 62.3 -64.6 -28.5 34.5 46.0 37.8 21 184 A T T 3<5S+ 0 0 57 -4,-1.5 3,-0.4 -3,-0.4 -1,-0.3 0.659 101.2 53.3 -75.0 -13.9 36.8 43.2 36.5 22 185 A S T < 5S+ 0 0 103 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.422 109.0 52.2 -89.9 -2.1 39.3 45.8 35.3 23 186 A N T < 5S- 0 0 113 -3,-1.3 -2,-0.2 -4,-0.2 -1,-0.2 0.083 132.8 -77.8-126.1 21.9 39.3 47.2 38.8 24 187 A G T 5 + 0 0 46 -3,-0.4 2,-1.3 1,-0.2 -3,-0.2 0.587 69.3 156.0 99.8 15.9 40.0 44.1 40.9 25 188 A N < + 0 0 9 -5,-2.0 -1,-0.2 1,-0.2 -2,-0.0 -0.621 4.8 164.8 -75.3 97.3 36.7 42.2 41.0 26 189 A D + 0 0 86 -2,-1.3 -1,-0.2 1,-0.2 -5,-0.1 0.337 62.5 74.5 -96.6 5.9 38.0 38.7 41.6 27 190 A I S S+ 0 0 0 -3,-0.1 -1,-0.2 145,-0.0 -2,-0.1 0.903 75.3 90.9 -79.9 -44.0 34.6 37.3 42.6 28 191 A N + 0 0 23 1,-0.1 146,-0.2 -11,-0.1 145,-0.1 -0.264 49.6 177.9 -53.3 136.3 33.3 37.3 39.1 29 192 A E + 0 0 30 144,-2.6 2,-0.3 143,-0.2 145,-0.2 0.360 42.1 108.7-123.6 -0.9 34.0 34.0 37.4 30 193 A L - 0 0 6 143,-0.6 4,-0.1 1,-0.1 11,-0.0 -0.660 60.3-146.2 -78.7 135.1 32.4 34.5 34.0 31 194 A D S S+ 0 0 117 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.0 0.870 98.7 16.9 -62.1 -37.5 34.8 34.9 31.0 32 195 A D S > S+ 0 0 54 1,-0.1 3,-1.2 -3,-0.0 -1,-0.3 -0.679 71.1 176.2-139.7 78.7 32.4 37.3 29.4 33 196 A P T 3 S+ 0 0 9 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.734 80.2 50.2 -65.1 -23.6 29.9 38.6 31.9 34 197 A E T 3 S+ 0 0 13 1,-0.2 -29,-2.1 -19,-0.1 -18,-0.0 0.693 116.5 38.9 -84.3 -19.2 28.2 41.0 29.4 35 198 A H S < S+ 0 0 56 -3,-1.2 2,-0.5 -31,-0.2 -1,-0.2 -0.222 85.7 103.4-129.6 42.8 27.7 38.5 26.6 36 199 A T - 0 0 13 -3,-0.4 5,-0.1 -31,-0.3 -31,-0.1 -0.961 59.7-139.7-128.4 115.4 26.7 35.2 28.2 37 200 A D > - 0 0 73 -2,-0.5 4,-2.0 1,-0.1 -32,-0.1 -0.195 32.2 -98.0 -69.1 167.5 23.0 34.1 28.1 38 201 A A H > S+ 0 0 38 1,-0.2 4,-1.4 2,-0.2 140,-0.2 0.877 121.9 45.7 -58.1 -43.6 21.4 32.4 31.2 39 202 A N H > S+ 0 0 42 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.899 111.4 52.8 -69.2 -36.3 21.8 28.8 30.0 40 203 A D H > S+ 0 0 80 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.813 102.8 58.7 -68.2 -28.7 25.4 29.4 28.9 41 204 A R H X S+ 0 0 5 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.905 107.6 47.1 -63.5 -41.0 26.2 30.8 32.4 42 205 A V H X S+ 0 0 0 -4,-1.4 4,-2.8 2,-0.2 5,-0.2 0.946 112.6 48.7 -63.7 -49.2 25.0 27.4 33.9 43 206 A I H X S+ 0 0 63 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.931 114.6 45.2 -57.2 -47.3 27.1 25.4 31.3 44 207 A E H X S+ 0 0 15 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.904 112.8 51.3 -63.3 -43.5 30.2 27.6 32.0 45 208 A R H X S+ 0 0 1 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.926 110.0 48.1 -61.0 -45.7 29.7 27.4 35.8 46 209 A L H X S+ 0 0 51 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.915 113.3 48.2 -64.2 -41.9 29.4 23.6 35.8 47 210 A R H X S+ 0 0 141 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.941 113.9 46.6 -59.4 -47.9 32.5 23.2 33.7 48 211 A K H X S+ 0 0 41 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.820 108.4 55.6 -69.0 -30.2 34.4 25.6 35.9 49 212 A E H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.917 107.7 49.0 -67.6 -43.6 33.3 23.9 39.1 50 213 A N H < S+ 0 0 35 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.928 113.9 46.7 -59.8 -42.4 34.6 20.5 37.9 51 214 A L H < S+ 0 0 118 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.884 114.5 46.8 -65.6 -37.8 37.9 22.2 37.0 52 215 A K H < S+ 0 0 77 -4,-2.3 -2,-0.2 -5,-0.1 -1,-0.2 0.881 88.4 98.6 -73.2 -40.3 38.1 24.0 40.4 53 216 A F < - 0 0 10 -4,-2.6 146,-0.1 -5,-0.2 143,-0.0 -0.246 59.8-159.5 -53.6 131.5 37.3 21.0 42.5 54 217 A D > - 0 0 66 144,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.932 7.7-167.7-118.5 102.9 40.4 19.4 43.9 55 218 A P H > S+ 0 0 44 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.862 89.0 52.8 -61.5 -35.4 39.8 15.8 44.9 56 219 A E H > S+ 0 0 133 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.905 110.5 47.1 -67.4 -38.7 43.2 15.6 46.8 57 220 A Y H > S+ 0 0 67 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.944 113.1 50.6 -63.2 -47.3 42.3 18.7 48.8 58 221 A Y H X S+ 0 0 3 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.923 113.3 42.8 -58.2 -49.3 38.8 17.3 49.5 59 222 A V H X S+ 0 0 12 -4,-2.7 4,-2.9 2,-0.2 -1,-0.2 0.853 110.5 56.4 -73.5 -27.7 40.1 13.9 50.7 60 223 A S H X S+ 0 0 68 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.917 109.2 47.5 -62.7 -41.6 42.9 15.5 52.7 61 224 A E H X S+ 0 0 22 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.904 113.5 48.1 -62.8 -43.5 40.3 17.5 54.5 62 225 A Y H X S+ 0 0 19 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.919 111.3 49.2 -63.7 -45.9 38.2 14.4 55.1 63 226 A M H X S+ 0 0 27 -4,-2.9 4,-2.7 1,-0.2 5,-0.5 0.874 110.7 50.4 -65.5 -37.6 41.1 12.3 56.3 64 227 A T H X S+ 0 0 39 -4,-2.2 4,-1.9 3,-0.2 -1,-0.2 0.940 112.2 47.5 -63.0 -47.3 42.1 15.0 58.8 65 228 A H H < S+ 0 0 27 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.936 122.1 33.8 -58.7 -47.5 38.6 15.3 60.1 66 229 A K H < S+ 0 0 113 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.819 137.3 14.8 -83.4 -32.6 38.1 11.6 60.5 67 230 A Y H < S+ 0 0 62 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.436 89.4 121.3-125.8 -4.6 41.6 10.3 61.5 68 231 A G < - 0 0 22 -4,-1.9 -4,-0.1 -5,-0.5 2,-0.0 -0.272 59.3-118.0 -66.7 148.8 43.6 13.4 62.5 69 232 A N > - 0 0 94 1,-0.1 4,-2.6 4,-0.0 5,-0.2 -0.165 40.0 -87.7 -73.3 178.8 45.2 13.7 65.9 70 233 A E H > S+ 0 0 162 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.900 127.3 45.4 -59.3 -44.3 44.4 16.4 68.4 71 234 A E H > S+ 0 0 126 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.900 112.0 50.1 -70.1 -42.3 46.9 18.9 67.0 72 235 A D H > S+ 0 0 81 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.908 112.2 49.2 -61.9 -40.2 46.1 18.3 63.3 73 236 A L H X S+ 0 0 30 -4,-2.6 4,-2.5 2,-0.2 6,-0.4 0.883 111.9 49.0 -62.4 -40.4 42.4 18.8 64.2 74 237 A E H < S+ 0 0 134 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.923 112.9 46.0 -66.6 -45.5 43.3 22.0 66.0 75 238 A I H < S+ 0 0 121 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.935 116.3 45.8 -62.2 -45.5 45.5 23.4 63.1 76 239 A N H < S- 0 0 31 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.906 93.9-150.8 -66.2 -45.0 42.8 22.5 60.5 77 240 A G X + 0 0 11 -4,-2.5 4,-2.4 -5,-0.2 3,-0.4 0.219 55.2 123.6 98.3 -12.1 40.0 23.9 62.6 78 241 A I H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.846 72.8 51.0 -56.3 -42.3 37.2 21.6 61.3 79 242 A K H > S+ 0 0 107 -6,-0.4 4,-0.7 1,-0.2 -1,-0.2 0.914 112.5 46.2 -64.0 -42.6 36.1 20.3 64.8 80 243 A E H >4 S+ 0 0 107 -3,-0.4 3,-0.8 -7,-0.3 4,-0.5 0.902 111.9 51.9 -64.5 -43.3 35.9 23.8 66.2 81 244 A L H >< S+ 0 0 5 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.907 104.7 55.7 -59.9 -41.3 33.9 25.1 63.2 82 245 A L H 3< S+ 0 0 42 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.686 108.0 50.0 -69.3 -16.9 31.4 22.2 63.4 83 246 A K T << S+ 0 0 168 -3,-0.8 2,-0.3 -4,-0.7 -1,-0.3 0.494 89.6 105.8 -93.1 -5.4 30.7 23.3 67.0 84 247 A F < - 0 0 44 -3,-1.5 71,-0.1 -4,-0.5 70,-0.0 -0.575 49.2-165.5 -85.8 137.7 30.1 27.0 66.2 85 248 A T - 0 0 42 -2,-0.3 5,-0.1 69,-0.1 -3,-0.0 -0.964 21.6-129.6-120.3 114.2 26.7 28.6 66.2 86 249 A P > - 0 0 0 0, 0.0 4,-2.6 0, 0.0 3,-0.5 -0.248 24.4-113.1 -59.5 149.6 26.4 32.0 64.5 87 250 A S H > S+ 0 0 80 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.837 114.9 54.4 -50.2 -43.9 24.6 34.7 66.5 88 251 A I H > S+ 0 0 7 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.896 113.1 42.8 -62.6 -38.6 21.6 35.0 64.2 89 252 A V H > S+ 0 0 0 -3,-0.5 4,-2.9 2,-0.2 5,-0.2 0.918 113.5 52.1 -71.6 -43.1 21.0 31.3 64.5 90 253 A K H X S+ 0 0 124 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.914 107.4 51.9 -61.8 -43.6 21.6 31.3 68.2 91 254 A Q H X S+ 0 0 52 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.912 113.1 45.4 -62.8 -39.9 19.1 34.1 68.8 92 255 A Y H X S+ 0 0 1 -4,-1.5 4,-2.8 -5,-0.2 -2,-0.2 0.947 113.3 48.1 -64.1 -50.0 16.4 32.2 66.8 93 256 A L H X S+ 0 0 54 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.867 111.5 51.4 -64.9 -33.0 17.1 28.9 68.5 94 257 A Q H X S+ 0 0 98 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.934 112.4 45.6 -65.3 -45.4 17.0 30.6 71.9 95 258 A W H X S+ 0 0 55 -4,-2.0 4,-1.7 -5,-0.2 -2,-0.2 0.915 112.4 51.7 -64.3 -41.3 13.7 32.2 71.1 96 259 A Y H < S+ 0 0 92 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.889 109.9 48.9 -62.6 -41.1 12.3 28.9 69.8 97 260 A K H < S+ 0 0 148 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.890 120.0 37.0 -63.8 -39.2 13.3 27.0 72.9 98 261 A D H < S+ 0 0 93 -4,-1.9 -2,-0.2 -5,-0.1 -1,-0.2 0.540 90.9 111.7 -97.5 -9.9 11.7 29.6 75.2 99 262 A S < - 0 0 30 -4,-1.7 4,-0.0 -5,-0.1 -4,-0.0 -0.383 59.1-147.2 -72.9 141.2 8.6 30.6 73.2 100 263 A T S S+ 0 0 152 1,-0.3 -1,-0.1 -2,-0.1 -4,-0.0 0.709 104.6 30.2 -73.5 -22.8 5.0 29.8 74.3 101 264 A N > + 0 0 71 1,-0.1 3,-1.4 3,-0.0 -1,-0.3 -0.622 68.9 170.0-134.5 83.0 4.2 29.6 70.6 102 265 A P T 3 + 0 0 45 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.595 69.7 72.8 -71.9 -12.3 7.3 28.4 68.7 103 266 A N T 3 S+ 0 0 108 2,-0.1 3,-0.1 -4,-0.0 -7,-0.0 0.745 84.0 86.9 -65.6 -30.2 5.4 27.8 65.4 104 267 A L S < S- 0 0 90 -3,-1.4 2,-0.1 1,-0.1 -3,-0.0 -0.158 93.3 -91.0 -70.5 166.0 5.1 31.6 64.9 105 268 A V - 0 0 56 1,-0.1 118,-0.2 121,-0.0 117,-0.1 -0.442 52.0 -95.7 -72.0 153.9 7.7 33.8 63.2 106 269 A M - 0 0 18 116,-2.5 120,-0.2 115,-0.1 119,-0.2 -0.546 34.4-123.0 -73.0 127.1 10.3 35.3 65.5 107 270 A P - 0 0 89 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.504 34.0-170.6 -63.9 136.2 9.6 38.8 66.7 108 271 A I - 0 0 5 -2,-0.2 2,-0.6 2,-0.0 117,-0.0 -0.991 18.7-162.8-134.7 126.6 12.5 41.0 65.7 109 272 A E - 0 0 162 -2,-0.4 2,-0.1 116,-0.0 0, 0.0 -0.954 29.7-128.8-103.1 118.4 13.1 44.6 66.7 110 273 A F - 0 0 23 -2,-0.6 -2,-0.0 1,-0.1 115,-0.0 -0.429 22.8-118.2 -67.9 140.0 15.6 46.0 64.3 111 274 A T > - 0 0 69 -2,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.258 26.8-105.0 -69.0 163.3 18.7 47.7 65.9 112 275 A D H > S+ 0 0 131 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.906 124.2 51.4 -53.3 -43.7 19.4 51.4 65.4 113 276 A E H > S+ 0 0 131 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.910 109.8 48.4 -63.3 -43.7 22.2 50.4 63.1 114 277 A E H > S+ 0 0 21 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.899 111.3 50.5 -63.2 -41.2 19.9 48.2 61.0 115 278 A Q H X S+ 0 0 76 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.929 111.0 48.4 -61.0 -44.7 17.3 50.9 60.8 116 279 A K H X S+ 0 0 117 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.902 110.0 52.9 -63.3 -41.1 19.9 53.4 59.6 117 280 A Q H X>S+ 0 0 18 -4,-2.5 4,-2.5 2,-0.2 5,-0.5 0.924 110.4 46.9 -58.4 -47.7 21.1 50.9 57.0 118 281 A M H X5S+ 0 0 30 -4,-2.4 4,-0.6 1,-0.2 -1,-0.2 0.902 118.8 41.5 -62.4 -38.7 17.6 50.4 55.6 119 282 A Q H <5S+ 0 0 104 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.834 126.1 31.2 -76.1 -35.5 17.0 54.2 55.5 120 283 A D H <5S+ 0 0 116 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.729 124.5 34.4 -98.7 -27.6 20.4 55.2 54.2 121 284 A N H <5S+ 0 0 41 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.1 0.586 95.6 80.1-113.9 -12.5 21.7 52.4 52.0 122 285 A L S <> + 0 0 71 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426 A Y H <>>S+ 0 0 1 -3,-2.2 5,-2.6 2,-0.2 4,-1.2 0.771 103.9 48.5 -75.7 -26.0 27.1 43.2 43.7 248 427 A D H <4>S+ 0 0 0 -3,-1.3 5,-2.9 -4,-0.4 6,-0.5 0.922 112.4 51.1 -69.0 -45.5 25.0 45.4 45.9 249 428 A K H <5S+ 0 0 95 -4,-2.2 -2,-0.2 1,-0.2 5,-0.2 0.915 120.7 30.7 -56.3 -47.8 24.4 47.7 42.9 250 429 A V H <5S- 0 0 0 -4,-2.5 -241,-2.8 -5,-0.1 -238,-0.2 0.619 140.5 -3.9 -94.5 -12.6 23.3 44.9 40.5 251 430 A L T X5S+ 0 0 3 -4,-1.2 4,-2.7 -243,-0.3 -3,-0.2 0.544 121.1 50.4-140.2 -57.8 21.6 42.4 42.9 252 431 A L H > S+ 0 0 2 -6,-0.5 4,-3.1 2,-0.2 5,-0.4 0.881 115.4 57.4 -72.0 -38.4 17.1 45.6 45.0 255 434 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.930 113.2 41.2 -57.7 -43.0 16.9 42.0 46.5 256 435 A T H X S+ 0 0 2 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.935 117.9 44.9 -72.3 -45.8 16.9 43.5 50.0 257 436 A A H X S+ 0 0 11 -4,-2.3 4,-2.2 -5,-0.3 -2,-0.2 0.908 115.7 48.1 -65.7 -41.3 14.5 46.4 49.2 258 437 A W H X>S+ 0 0 8 -4,-3.1 4,-3.2 2,-0.2 5,-0.7 0.922 111.9 50.2 -63.6 -43.0 12.2 44.2 47.2 259 438 A F H X5S+ 0 0 0 -4,-2.2 4,-1.9 -5,-0.4 -2,-0.2 0.931 109.5 50.1 -65.2 -42.5 12.2 41.6 50.0 260 439 A I H <5S+ 0 0 53 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.938 121.8 34.0 -57.8 -46.7 11.4 44.1 52.7 261 440 A S H <5S+ 0 0 64 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.844 137.6 14.5 -80.9 -32.1 8.5 45.5 50.7 262 441 A Q H <5S+ 0 0 107 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.487 85.0 124.4-125.8 -12.2 7.1 42.5 48.9 263 442 A G << - 0 0 8 -4,-1.9 2,-0.5 -5,-0.7 -39,-0.0 -0.279 54.1-132.7 -60.1 142.5 8.6 39.3 50.5 264 443 A S > - 0 0 40 1,-0.1 4,-2.5 -40,-0.0 5,-0.2 -0.846 10.9-153.3-105.2 127.0 5.9 36.9 51.7 265 444 A E H > S+ 0 0 64 -2,-0.5 4,-2.4 1,-0.2 5,-0.2 0.898 101.0 50.7 -56.6 -43.0 5.9 35.2 55.2 266 445 A N H > S+ 0 0 136 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.903 109.8 48.6 -66.9 -38.0 4.0 32.2 53.7 267 446 A V H > S+ 0 0 58 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.935 111.7 50.7 -65.9 -43.1 6.4 31.8 50.8 268 447 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.911 110.8 47.7 -62.3 -41.5 9.4 31.9 53.2 269 448 A R 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0 -12,-2.1 4,-1.8 -15,-0.8 -14,-0.1 0.758 115.8 58.4 -71.1 -21.1 32.5 12.2 47.0 300 489 A R H > S+ 0 0 82 -16,-0.4 4,-2.4 -13,-0.2 -1,-0.2 0.923 104.0 52.5 -69.7 -41.8 31.9 9.1 49.1 301 490 A E H > S+ 0 0 82 -3,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.910 108.5 51.5 -54.7 -44.6 33.7 7.0 46.4 302 491 A M H X S+ 0 0 11 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.909 110.3 48.2 -60.0 -43.7 36.6 9.5 46.7 303 492 A E H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.885 111.3 49.3 -62.2 -43.0 36.8 9.1 50.5 304 493 A I H X S+ 0 0 79 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.935 109.7 51.0 -66.1 -45.0 36.7 5.3 50.4 305 494 A L H X S+ 0 0 99 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.913 114.3 45.5 -57.6 -42.3 39.4 5.1 47.8 306 495 A A H X S+ 0 0 13 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.820 109.7 53.1 -69.6 -37.5 41.6 7.5 50.1 307 496 A E H X S+ 0 0 11 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.893 107.0 53.7 -64.0 -40.4 40.8 5.6 53.3 308 497 A S H X S+ 0 0 59 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.899 108.8 47.7 -62.6 -43.4 42.0 2.4 51.6 309 498 A E H X S+ 0 0 111 -4,-1.5 4,-1.6 1,-0.2 -1,-0.2 0.864 112.3 50.0 -64.9 -38.4 45.3 3.9 50.6 310 499 A Y H X S+ 0 0 76 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.876 109.0 51.2 -67.7 -39.8 45.8 5.3 54.2 311 500 A R H < S+ 0 0 160 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.835 110.7 49.4 -66.8 -33.2 45.0 1.9 55.8 312 501 A E H < S+ 0 0 168 -4,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.827 109.7 50.7 -73.4 -34.2 47.6 0.3 53.5 313 502 A Q H < 0 0 158 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.790 360.0 360.0 -72.9 -29.7 50.2 2.9 54.4 314 503 A Q < 0 0 165 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.535 360.0 360.0 -72.0 360.0 49.5 2.2 58.0