==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 16-NOV-02 1N7Q . COMPND 2 MOLECULE: HYALURONIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; . AUTHOR M.NUKUI,K.B.TAYLOR,D.T.MCPHERSON,M.SHIGENAGA,M.J.JEDRZEJAS . 720 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28350.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 499 69.3 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 . 155 21.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.0 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 . 54 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 82 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 183 25.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 3 1 0 0 1 0 1 1 2 1 1 0 3 2 1 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 . 4 5 4 1 5 3 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 3 1 1 0 0 0 0 0 0 1 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 1 170 A V 0 0 74 0, 0.0 2,-0.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 116.9 2.8 -9.6 -2.2 2 171 A K + 0 0 130 3,-0.1 2,-0.2 4,-0.1 0, 0.0 -0.775 360.0 113.5-108.3 117.7 -0.3 -11.9 -1.3 3 172 A D S > S- 0 0 58 -2,-0.5 4,-1.3 0, 0.0 5,-0.1 -0.538 79.7 -52.0-156.2-157.3 -0.2 -15.7 -0.8 4 173 A T H > S+ 0 0 93 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.798 126.9 59.2 -73.5 -28.2 -0.7 -18.3 2.0 5 174 A Y H > S+ 0 0 37 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.959 110.3 42.6 -59.0 -50.6 1.8 -16.7 4.5 6 175 A T H > S+ 0 0 10 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.802 108.6 58.6 -70.5 -27.6 -0.3 -13.5 4.4 7 176 A D H X S+ 0 0 77 -4,-1.3 4,-1.6 2,-0.2 -1,-0.2 0.932 108.2 47.6 -58.1 -44.4 -3.5 -15.6 4.6 8 177 A R H X S+ 0 0 35 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.908 110.6 51.3 -62.2 -41.9 -2.0 -16.9 7.9 9 178 A L H X S+ 0 0 3 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.832 104.1 56.9 -65.5 -35.5 -1.2 -13.4 9.0 10 179 A D H X S+ 0 0 63 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.919 108.8 48.1 -56.8 -44.4 -4.8 -12.3 8.2 11 180 A D H X S+ 0 0 64 -4,-1.6 4,-1.0 2,-0.2 -2,-0.2 0.922 110.4 50.2 -64.1 -44.8 -5.8 -15.0 10.7 12 181 A W H >X S+ 0 0 2 -4,-2.4 4,-2.5 1,-0.2 3,-0.5 0.893 107.9 54.0 -56.7 -44.2 -3.3 -13.8 13.3 13 182 A N H 3X>S+ 0 0 12 -4,-2.6 5,-2.1 1,-0.3 4,-1.9 0.874 105.0 54.6 -57.7 -42.5 -4.6 -10.2 12.9 14 183 A G H 3<5S+ 0 0 2 -4,-1.6 338,-0.3 3,-0.2 -1,-0.3 0.778 114.0 42.2 -61.5 -30.7 -8.1 -11.5 13.7 15 184 A I H <<5S+ 0 0 10 -4,-1.0 -2,-0.2 -3,-0.5 338,-0.2 0.862 119.2 38.7 -82.0 -42.6 -6.7 -13.1 16.9 16 185 A I H <5S+ 0 0 5 -4,-2.5 -3,-0.2 336,-0.1 -2,-0.2 0.657 142.8 1.5 -91.8 -18.6 -4.4 -10.3 18.2 17 186 A A T <5S- 0 0 6 -4,-1.9 334,-1.9 -5,-0.3 -3,-0.2 0.592 74.2-157.8-127.4 -56.3 -6.7 -7.4 17.3 18 187 A G > < + 0 0 0 -5,-2.1 3,-2.0 332,-0.2 4,-0.4 0.740 28.0 159.3 75.1 34.4 -9.9 -8.7 15.6 19 188 A N G > S+ 0 0 17 -6,-0.3 3,-1.7 1,-0.3 68,-0.1 0.813 70.5 67.4 -44.2 -37.2 -10.9 -5.6 13.7 20 189 A Q G 3 S+ 0 0 116 1,-0.3 -1,-0.3 65,-0.0 -6,-0.1 0.722 104.0 44.3 -60.7 -30.0 -13.0 -7.9 11.5 21 190 A Y G < S+ 0 0 106 -3,-2.0 -1,-0.3 -7,-0.1 -2,-0.2 0.410 82.3 128.5 -92.2 -6.7 -15.3 -8.6 14.5 22 191 A Y < - 0 0 34 -3,-1.7 2,-0.4 -4,-0.4 -4,-0.0 -0.293 32.3-179.0 -63.3 137.3 -15.6 -5.0 15.7 23 192 A D > - 0 0 82 3,-0.1 3,-2.1 1,-0.1 7,-0.3 -0.935 20.7-156.2-140.4 105.7 -19.2 -3.9 16.2 24 193 A S T 3 S+ 0 0 81 -2,-0.4 -1,-0.1 1,-0.3 6,-0.1 0.633 95.4 62.7 -58.1 -17.5 -19.7 -0.3 17.4 25 194 A K T 3 S+ 0 0 196 -3,-0.0 2,-0.8 4,-0.0 -1,-0.3 0.390 80.3 97.0 -83.8 0.8 -23.1 -1.4 18.8 26 195 A N <> - 0 0 27 -3,-2.1 4,-2.3 1,-0.2 5,-0.2 -0.851 66.1-156.2-100.8 111.8 -21.4 -3.7 21.2 27 196 A D H > S+ 0 0 145 -2,-0.8 4,-1.1 1,-0.2 -1,-0.2 0.860 92.8 44.1 -46.9 -50.8 -21.0 -1.9 24.6 28 197 A Q H > S+ 0 0 50 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.861 115.4 46.4 -76.9 -32.2 -17.9 -4.0 25.7 29 198 A M H > S+ 0 0 6 -6,-0.2 4,-2.2 1,-0.2 3,-0.3 0.925 111.0 53.9 -70.0 -42.2 -16.1 -3.8 22.3 30 199 A A H X S+ 0 0 27 -4,-2.3 4,-1.4 -7,-0.3 -1,-0.2 0.743 104.8 54.9 -64.6 -30.7 -16.7 -0.1 22.1 31 200 A K H X S+ 0 0 147 -4,-1.1 4,-1.9 2,-0.2 -1,-0.2 0.859 109.3 44.4 -71.3 -41.7 -15.2 0.4 25.4 32 201 A L H X S+ 0 0 15 -4,-1.2 4,-2.0 -3,-0.3 -2,-0.2 0.867 112.2 54.2 -69.6 -38.9 -11.8 -1.3 24.5 33 202 A N H X S+ 0 0 4 -4,-2.2 4,-3.1 2,-0.2 -2,-0.2 0.885 107.0 51.8 -63.2 -37.8 -11.8 0.6 21.2 34 203 A Q H X S+ 0 0 118 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.926 106.7 52.5 -64.4 -41.9 -12.2 3.8 23.3 35 204 A E H X S+ 0 0 77 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.876 111.4 46.3 -64.4 -39.3 -9.2 2.7 25.4 36 205 A L H X S+ 0 0 13 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.928 109.8 55.1 -66.5 -47.5 -7.0 2.2 22.2 37 206 A E H X S+ 0 0 7 -4,-3.1 4,-2.7 1,-0.2 -2,-0.2 0.923 111.7 43.4 -44.2 -49.7 -8.3 5.6 20.8 38 207 A G H X S+ 0 0 28 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.871 112.5 52.3 -75.5 -32.8 -7.1 7.4 23.9 39 208 A K H X S+ 0 0 75 -4,-1.7 4,-2.1 -5,-0.2 -1,-0.2 0.872 111.6 46.0 -66.6 -41.0 -3.8 5.5 24.0 40 209 A V H X S+ 0 0 1 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.931 111.2 52.7 -68.4 -51.7 -3.0 6.5 20.4 41 210 A A H X S+ 0 0 27 -4,-2.7 4,-1.6 -5,-0.2 -2,-0.2 0.885 110.2 49.9 -38.9 -47.9 -4.0 10.2 21.0 42 211 A D H X S+ 0 0 96 -4,-2.0 4,-0.8 1,-0.2 -2,-0.2 0.944 112.7 44.9 -68.4 -42.4 -1.6 10.2 24.0 43 212 A S H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.826 114.6 49.9 -60.6 -37.4 1.3 8.8 22.0 44 213 A L H < S+ 0 0 45 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.801 112.8 43.8 -77.7 -30.8 0.5 11.1 19.1 45 214 A S H < S+ 0 0 100 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.566 120.7 43.8 -86.8 -13.5 0.4 14.3 21.2 46 215 A S H < S+ 0 0 61 -4,-0.8 12,-0.3 -5,-0.2 -2,-0.2 0.695 84.1 111.5-101.1 -35.7 3.5 13.2 23.1 47 216 A I S < S- 0 0 24 -4,-1.7 2,-0.4 1,-0.1 10,-0.2 -0.157 75.5-101.8 -54.2 143.2 5.9 11.9 20.5 48 217 A S - 0 0 31 8,-2.6 2,-0.1 7,-0.1 -1,-0.1 -0.504 45.6-175.0 -66.6 119.0 9.2 13.8 19.6 49 218 A S + 0 0 96 -2,-0.4 -1,-0.1 -3,-0.1 0, 0.0 -0.399 35.4 25.2-108.0-174.9 8.8 15.7 16.4 50 219 A Q S S+ 0 0 188 -2,-0.1 3,-0.2 3,-0.0 -2,-0.0 0.186 95.6 24.7 37.4-158.2 11.2 17.7 14.2 51 220 A A S S- 0 0 95 1,-0.2 -2,-0.0 2,-0.0 0, 0.0 0.117 106.8 -63.1 -70.5 136.3 14.9 17.6 13.8 52 221 A D - 0 0 119 1,-0.1 -1,-0.2 2,-0.0 2,-0.1 0.641 66.0-153.8 -45.8 145.0 16.4 14.4 14.5 53 222 A R - 0 0 46 -3,-0.2 3,-0.1 -5,-0.1 -1,-0.1 -0.261 29.8-127.5-116.8 174.5 16.1 13.3 18.0 54 223 A I S S+ 0 0 143 1,-0.3 2,-0.3 -2,-0.1 -1,-0.0 0.476 92.7 7.3-106.4 -10.9 17.5 11.3 20.8 55 224 A Y - 0 0 67 1,-0.1 -1,-0.3 7,-0.1 3,-0.1 -0.963 55.2-135.5-158.8 164.5 14.2 9.4 21.6 56 225 A L S S+ 0 0 3 1,-0.3 -8,-2.6 4,-0.3 2,-0.4 0.874 97.6 20.8 -86.8 -52.8 10.7 8.8 20.4 57 226 A W - 0 0 1 3,-0.4 3,-0.4 -10,-0.2 -1,-0.3 -0.967 65.0-148.3-121.9 135.3 9.0 9.2 23.8 58 227 A E S > S+ 0 0 122 -2,-0.4 3,-1.1 -12,-0.3 4,-0.2 0.861 99.2 57.3 -63.6 -42.6 10.5 10.8 26.9 59 228 A K T 3 S+ 0 0 106 1,-0.3 -1,-0.2 2,-0.1 3,-0.1 0.784 119.9 36.2 -61.6 -21.6 8.8 8.5 29.5 60 229 A F T 3 S+ 0 0 66 -3,-0.4 -3,-0.4 1,-0.1 -1,-0.3 -0.338 86.8 114.3-127.4 58.0 10.6 5.8 27.6 61 230 A S < + 0 0 40 -3,-1.1 2,-1.3 -6,-0.1 -1,-0.1 0.767 41.5 88.5-104.0 -32.8 13.9 7.4 26.6 62 231 A N > - 0 0 89 -4,-0.2 3,-0.8 1,-0.2 6,-0.3 -0.595 54.9-169.4 -77.8 98.9 16.8 5.6 28.3 63 232 A Y T 3 S+ 0 0 111 -2,-1.3 -1,-0.2 1,-0.2 56,-0.1 0.441 79.0 72.8 -73.1 3.4 17.4 2.9 25.7 64 233 A K T 3 S+ 0 0 147 1,-0.1 2,-0.8 4,-0.0 -1,-0.2 0.862 83.8 70.1 -80.5 -43.5 19.8 1.2 28.3 65 234 A T S X S- 0 0 73 -3,-0.8 3,-1.7 1,-0.1 4,-0.3 -0.652 82.9-153.5 -58.2 105.1 16.7 0.1 30.4 66 235 A S T >> S+ 0 0 5 -2,-0.8 3,-1.2 1,-0.3 4,-1.2 0.668 84.7 74.9 -69.3 -14.3 15.5 -2.5 27.9 67 236 A A H 3> S+ 0 0 52 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.728 88.8 64.7 -66.1 -22.3 11.8 -2.3 29.1 68 237 A N H <> S+ 0 0 25 -3,-1.7 4,-0.8 -6,-0.3 -1,-0.3 0.664 95.7 55.7 -69.8 -24.9 11.9 1.0 27.2 69 238 A L H X> S+ 0 0 2 -3,-1.2 4,-2.3 -4,-0.3 3,-0.7 0.967 112.4 40.6 -68.4 -55.0 12.4 -0.8 23.8 70 239 A T H 3X S+ 0 0 8 -4,-1.2 4,-2.3 1,-0.3 -2,-0.2 0.880 113.2 53.4 -63.3 -38.5 9.3 -3.0 24.2 71 240 A A H 3X S+ 0 0 22 -4,-2.0 4,-1.1 2,-0.2 -1,-0.3 0.805 110.4 50.0 -63.1 -29.8 7.2 -0.1 25.6 72 241 A T H < S+ 0 0 0 -4,-1.6 3,-1.4 2,-0.2 6,-0.3 0.878 111.3 57.6 -75.5 -33.9 -6.4 1.7 15.3 83 252 A V H 3< S+ 0 0 0 -4,-2.3 9,-1.8 1,-0.3 -2,-0.2 0.845 110.8 43.5 -70.7 -29.2 -5.0 2.4 11.8 84 253 A T T 3< S+ 0 0 35 -4,-1.5 -1,-0.3 7,-0.2 -2,-0.2 0.215 93.4 97.9 -99.2 13.1 -6.5 -0.9 10.5 85 254 A N X - 0 0 1 -3,-1.4 3,-1.4 1,-0.1 6,-0.2 -0.919 63.5-152.9 -98.3 106.4 -9.9 -0.4 12.4 86 255 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.773 96.1 49.6 -39.7 -36.1 -12.7 1.0 10.1 87 256 A S T 3 S+ 0 0 61 -68,-0.1 2,-0.2 3,-0.1 -5,-0.1 0.560 88.4 98.7 -88.6 -11.5 -14.4 2.6 13.2 88 257 A S S X S- 0 0 8 -3,-1.4 3,-1.3 -6,-0.3 -54,-0.0 -0.470 78.6-128.6 -67.1 143.5 -11.3 4.4 14.7 89 258 A R T 3 S+ 0 0 136 1,-0.2 -1,-0.1 -2,-0.2 -6,-0.1 0.653 110.8 59.2 -61.1 -11.6 -10.8 8.0 14.1 90 259 A Y T > S+ 0 0 22 -8,-0.2 3,-2.5 -5,-0.1 -1,-0.2 0.264 72.3 144.1-102.0 6.4 -7.2 7.0 12.9 91 260 A Y T < S- 0 0 93 -3,-1.3 -8,-0.2 1,-0.3 -7,-0.2 -0.286 86.4 -18.0 -54.4 114.8 -8.5 4.7 10.2 92 261 A Q T 3 S+ 0 0 115 -9,-1.8 -1,-0.3 1,-0.2 2,-0.2 0.745 94.1 173.9 53.8 24.7 -6.0 4.9 7.3 93 262 A D <> - 0 0 52 -3,-2.5 4,-2.5 1,-0.1 -1,-0.2 -0.448 31.1-142.4 -64.7 130.2 -4.9 8.2 8.8 94 263 A E H > S+ 0 0 141 -2,-0.2 4,-2.1 2,-0.2 5,-0.2 0.854 99.4 50.1 -65.8 -37.3 -1.8 9.6 6.9 95 264 A T H > S+ 0 0 53 2,-0.2 4,-3.1 3,-0.2 5,-0.2 0.976 112.6 48.6 -65.9 -45.7 -0.0 10.9 10.0 96 265 A V H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.874 112.2 45.9 -65.2 -46.0 -0.5 7.6 11.7 97 266 A V H X S+ 0 0 20 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.938 117.2 45.2 -57.0 -55.0 0.8 5.4 8.8 98 267 A R H X S+ 0 0 156 -4,-2.1 4,-2.7 1,-0.2 5,-0.3 0.881 112.9 52.9 -54.2 -45.4 3.8 7.8 8.3 99 268 A T H X S+ 0 0 16 -4,-3.1 4,-1.6 -5,-0.2 -1,-0.2 0.856 109.1 47.1 -66.6 -38.0 4.5 7.9 12.0 100 269 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 -5,-0.2 -1,-0.2 0.947 115.2 46.6 -67.5 -47.1 4.5 4.1 12.3 101 270 A R H X S+ 0 0 72 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.937 115.4 43.5 -56.3 -54.0 6.9 3.7 9.3 102 271 A D H X S+ 0 0 83 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.817 114.0 52.0 -66.2 -38.8 9.3 6.5 10.4 103 272 A S H X S+ 0 0 2 -4,-1.6 4,-2.6 -5,-0.3 5,-0.2 0.899 108.7 49.7 -63.7 -40.8 9.3 5.2 14.0 104 273 A M H X S+ 0 0 1 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.972 115.0 46.0 -61.7 -49.1 10.1 1.6 12.8 105 274 A E H X S+ 0 0 64 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.883 112.3 49.2 -53.3 -52.3 13.0 3.0 10.7 106 275 A W H X>S+ 0 0 15 -4,-2.5 4,-2.6 2,-0.2 5,-0.5 0.917 113.5 46.9 -58.7 -50.0 14.3 5.3 13.5 107 276 A M H X>S+ 0 0 6 -4,-2.6 5,-2.3 2,-0.2 4,-1.9 0.940 113.4 49.5 -52.6 -47.6 14.2 2.4 16.0 108 277 A H H <5S+ 0 0 47 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.939 116.2 41.4 -59.9 -46.5 16.0 0.2 13.5 109 278 A K H <5S+ 0 0 142 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.854 131.9 17.8 -74.6 -34.7 18.7 2.8 12.7 110 279 A H H <5S+ 0 0 66 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.813 130.2 19.2-114.0 -37.5 19.4 4.0 16.3 111 280 A V T < S- 0 0 16 -2,-0.5 3,-1.2 -3,-0.1 -4,-0.1 -0.863 74.9 -82.7-147.1-179.7 19.3 -3.7 15.2 114 283 A S T 3 S+ 0 0 33 -2,-0.3 -1,-0.0 1,-0.3 -2,-0.0 0.737 121.2 61.2 -68.0 -24.9 21.7 -6.7 14.5 115 284 A E T 3 S+ 0 0 159 2,-0.0 -1,-0.3 0, 0.0 2,-0.1 0.649 90.3 96.6 -71.3 -16.2 24.8 -4.6 15.5 116 285 A K < - 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0 0 24 -3,-0.5 4,-2.5 1,-0.1 3,-1.0 -0.219 64.7 -79.3 -60.7 169.0 -4.0 -8.8 41.3 302 471 A G H 3> S+ 0 0 0 133,-0.3 -16,-2.1 1,-0.3 4,-1.9 0.776 128.5 45.7 -51.5 -35.2 -5.6 -12.2 41.6 303 472 A H H 3> S+ 0 0 3 -18,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.810 114.0 49.2 -81.1 -28.6 -8.8 -11.7 39.6 304 473 A V H <> S+ 0 0 27 -3,-1.0 4,-0.6 2,-0.2 3,-0.5 0.883 112.5 48.0 -69.9 -45.7 -7.0 -9.9 36.8 305 474 A A H >X S+ 0 0 3 -4,-2.5 3,-1.4 1,-0.2 4,-0.9 0.901 102.1 63.3 -59.1 -44.2 -4.4 -12.6 36.5 306 475 A A H 3X S+ 0 0 0 -4,-1.9 4,-2.0 -5,-0.3 3,-0.5 0.828 94.3 63.1 -49.1 -33.5 -7.0 -15.3 36.5 307 476 A V H 3X S+ 0 0 3 -4,-0.6 4,-2.7 -3,-0.5 5,-0.3 0.755 92.9 62.0 -73.7 -26.4 -8.4 -13.9 33.1 308 477 A E H X S+ 0 0 1 -4,-2.1 3,-1.1 1,-0.2 4,-0.7 0.956 110.4 52.6 -55.1 -52.7 -8.8 -24.0 23.5 317 486 A A H >< S+ 0 0 0 -4,-2.5 3,-0.7 1,-0.2 -1,-0.2 0.825 105.8 54.6 -46.7 -42.3 -12.6 -24.7 23.9 318 487 A D H 3< S+ 0 0 68 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.710 108.5 46.7 -70.9 -26.9 -13.3 -22.9 20.6 319 488 A M H << S+ 0 0 63 -4,-1.1 -1,-0.2 -3,-1.1 -2,-0.2 0.444 105.5 73.8 -97.5 -0.4 -10.9 -25.0 18.6 320 489 A S S << S- 0 0 13 -4,-0.7 2,-0.3 -3,-0.7 -3,-0.0 -0.258 72.2-142.7 -91.6-174.1 -12.2 -28.3 20.1 321 490 A E >> - 0 0 121 -2,-0.1 4,-1.4 0, 0.0 3,-0.8 -0.888 46.1 -4.5-145.9-179.8 -15.5 -29.9 19.3 322 491 A G H 3> S- 0 0 60 -2,-0.3 4,-1.3 1,-0.2 -2,-0.1 0.053 122.3 -0.3 38.8-121.0 -18.5 -31.8 20.7 323 492 A E H 3> S+ 0 0 177 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.887 130.5 53.6 -68.5 -39.7 -18.2 -32.7 24.3 324 493 A T H <> S+ 0 0 36 -3,-0.8 4,-1.7 1,-0.2 5,-0.2 0.933 107.8 53.0 -69.6 -38.1 -14.8 -31.3 25.2 325 494 A K H X S+ 0 0 57 -4,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.832 110.1 47.6 -52.0 -43.7 -15.8 -27.8 23.9 326 495 A Q H X S+ 0 0 88 -4,-1.3 4,-2.0 -3,-0.2 -2,-0.2 0.931 110.7 50.6 -72.2 -43.2 -19.0 -27.7 26.1 327 496 A R H X S+ 0 0 98 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.866 113.8 43.4 -60.8 -37.8 -17.2 -28.7 29.2 328 497 A L H X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.869 111.9 53.7 -82.2 -36.3 -14.5 -26.1 28.9 329 498 A Q H X S+ 0 0 15 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.887 111.8 47.2 -55.0 -40.1 -17.1 -23.5 27.9 330 499 A S H X S+ 0 0 20 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.840 107.4 54.3 -77.0 -36.1 -18.9 -24.5 31.1 331 500 A L H X S+ 0 0 25 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.929 114.0 42.8 -60.9 -49.5 -15.8 -24.3 33.3 332 501 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.889 114.1 50.6 -62.5 -45.2 -15.1 -20.8 32.1 333 502 A K H X S+ 0 0 12 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.951 111.9 46.4 -62.2 -55.4 -18.8 -19.7 32.4 334 503 A T H X S+ 0 0 16 -4,-2.6 4,-1.9 33,-0.4 -2,-0.2 0.918 113.8 49.3 -55.7 -39.2 -19.2 -21.0 36.0 335 504 A I H < S+ 0 0 1 -4,-2.2 4,-0.3 1,-0.2 -2,-0.2 0.963 114.1 45.6 -63.7 -50.3 -15.8 -19.4 37.2 336 505 A V H >< S+ 0 0 19 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.856 112.2 49.8 -58.2 -42.8 -16.8 -16.1 35.6 337 506 A Q H 3< S+ 0 0 101 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.837 104.3 59.2 -73.5 -29.0 -20.4 -16.1 37.1 338 507 A S T 3< S+ 0 0 47 -4,-1.9 2,-1.0 -5,-0.2 -1,-0.2 0.607 87.4 91.5 -65.7 -12.8 -19.1 -16.9 40.6 339 508 A D < + 0 0 22 -3,-1.0 5,-0.1 -4,-0.3 -1,-0.1 -0.723 39.0 159.5 -99.7 98.6 -17.1 -13.7 40.5 340 509 A S S S+ 0 0 113 -2,-1.0 -1,-0.2 1,-0.1 3,-0.1 0.389 74.1 56.7 -88.5 -2.1 -19.1 -10.8 41.9 341 510 A Y S S+ 0 0 77 -58,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.839 103.1 42.3 -99.8 -40.4 -16.0 -8.8 42.5 342 511 A Y - 0 0 44 -6,-0.1 2,-0.9 -39,-0.0 -1,-0.2 -0.882 68.5-134.7-123.3 135.1 -14.2 -8.4 39.1 343 512 A D > - 0 0 58 -2,-0.3 3,-1.9 1,-0.2 4,-0.2 -0.817 17.0-151.4 -90.8 105.8 -15.6 -7.7 35.6 344 513 A V G > S+ 0 0 9 -2,-0.9 3,-1.9 1,-0.3 -1,-0.2 0.784 89.7 70.1 -46.2 -32.8 -13.8 -10.3 33.4 345 514 A F G > S+ 0 0 34 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.708 81.6 73.7 -67.2 -18.6 -14.1 -7.9 30.4 346 515 A K G < S+ 0 0 136 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.708 104.4 37.7 -73.5 -19.2 -11.5 -5.6 32.0 347 516 A N G < S+ 0 0 23 -3,-1.9 2,-0.6 -4,-0.2 -1,-0.3 0.034 91.1 100.0-112.7 27.5 -8.8 -8.1 31.1 348 517 A L < + 0 0 3 -3,-1.5 6,-0.0 1,-0.1 -40,-0.0 -0.925 48.3 176.8-111.4 109.1 -10.2 -9.2 27.7 349 518 A K + 0 0 68 -2,-0.6 2,-0.3 4,-0.0 -1,-0.1 0.162 50.0 56.5-112.0 16.2 -8.1 -7.1 25.2 350 519 A T S > S- 0 0 11 -332,-0.0 4,-2.0 1,-0.0 -332,-0.2 -0.971 80.6-117.4-140.9 150.4 -9.0 -8.2 21.7 351 520 A Y H > S+ 0 0 3 -334,-1.9 4,-2.1 -2,-0.3 -333,-0.2 0.751 112.7 53.8 -57.0 -31.9 -12.5 -8.1 20.0 352 521 A K H > S+ 0 0 29 -338,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.869 107.0 51.1 -82.0 -33.4 -12.6 -11.9 19.5 353 522 A D H > S+ 0 0 10 -338,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.932 112.1 47.3 -59.6 -42.5 -11.9 -12.5 23.1 354 523 A I H X S+ 0 0 3 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.945 114.2 47.6 -60.4 -45.7 -14.7 -10.2 24.0 355 524 A S H X S+ 0 0 44 -4,-2.1 4,-2.2 1,-0.2 5,-0.2 0.854 109.1 51.8 -64.0 -48.9 -17.0 -11.9 21.5 356 525 A L H X S+ 0 0 17 -4,-2.7 4,-1.3 2,-0.2 -1,-0.2 0.881 113.2 46.1 -53.3 -43.1 -16.1 -15.5 22.6 357 526 A M H X S+ 0 0 3 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.926 110.7 53.0 -72.5 -48.2 -17.0 -14.5 26.3 358 527 A Q H X S+ 0 0 54 -4,-2.8 4,-1.1 1,-0.2 -2,-0.2 0.911 111.0 44.6 -48.6 -53.3 -20.2 -12.8 25.3 359 528 A S H X S+ 0 0 57 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.836 112.6 54.2 -63.1 -33.5 -21.6 -15.7 23.4 360 529 A L H < S+ 0 0 0 -4,-1.3 -2,-0.2 -5,-0.2 6,-0.2 0.939 109.2 45.6 -67.3 -47.7 -20.5 -18.1 26.1 361 530 A L H < S+ 0 0 47 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.674 118.7 42.2 -65.3 -25.4 -22.4 -16.1 28.9 362 531 A S H < S+ 0 0 97 -4,-1.1 2,-0.8 -5,-0.2 -1,-0.2 0.543 86.7 101.7-106.2 -10.4 -25.6 -15.8 26.9 363 532 A D >< - 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