==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 31-MAY-10 3N9M . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS; . AUTHOR Y.YANG,L.HU,P.WANG,H.HOU,C.D.CHEN,Y.XU . 984 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46666.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 670 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 134 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 63 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 121 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 273 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.5 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 5 2 2 1 2 3 3 3 2 0 0 0 0 2 0 0 0 0 0 0 3 0 0 0 1 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 0 2 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 2 7 3 5 1 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 4 0 0 0 0 0 2 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 1 193 A K 0 0 159 0, 0.0 3,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 140.3 -3.0 49.5 49.0 2 194 A E - 0 0 167 1,-0.2 11,-0.3 11,-0.0 0, 0.0 -0.358 360.0 -47.6 89.6-163.6 -4.7 52.9 49.6 3 195 A S S S+ 0 0 90 -2,-0.1 10,-0.5 9,-0.1 -1,-0.2 0.847 93.2 118.5 -75.4 -39.0 -6.7 55.3 47.4 4 196 A D - 0 0 46 -3,-0.2 9,-0.7 8,-0.1 2,-0.1 0.280 61.8-113.8 -31.8 155.0 -4.2 55.1 44.4 5 197 A R B -A 12 0A 141 7,-0.2 43,-0.6 1,-0.1 2,-0.5 -0.382 22.6 -97.1-100.0 171.2 -5.4 53.8 41.0 6 198 A C B > -b 48 0B 2 5,-1.1 4,-1.5 1,-0.1 43,-0.2 -0.751 15.8-149.1 -90.4 127.9 -4.7 50.8 38.8 7 199 A G T 4 S+ 0 0 45 41,-2.5 42,-0.2 -2,-0.5 -1,-0.1 0.668 97.3 48.1 -66.4 -15.5 -2.2 51.3 36.0 8 200 A G T 4 S+ 0 0 43 40,-0.3 -1,-0.1 3,-0.1 41,-0.1 0.939 129.2 9.5 -87.2 -75.3 -4.3 48.6 34.1 9 201 A C T 4 S- 0 0 64 2,-0.1 -2,-0.1 1,-0.0 3,-0.1 0.366 90.1-128.8 -93.9 4.4 -8.0 49.4 34.3 10 202 A G < + 0 0 28 -4,-1.5 2,-0.3 1,-0.2 -3,-0.1 0.425 61.3 140.6 67.1 -3.6 -7.6 52.9 35.8 11 203 A K - 0 0 88 -6,-0.1 -5,-1.1 1,-0.0 -1,-0.2 -0.527 49.6-135.9 -74.9 133.5 -10.0 51.9 38.5 12 204 A F B -A 5 0A 90 -2,-0.3 2,-1.3 -7,-0.2 -7,-0.2 -0.504 56.3 -67.1 -74.7 158.0 -9.4 53.1 42.1 13 205 A T S S+ 0 0 61 -9,-0.7 -1,-0.1 -10,-0.5 -8,-0.0 -0.262 88.5 129.5 -53.8 87.9 -10.1 50.4 44.7 14 206 A H + 0 0 121 -2,-1.3 -1,-0.1 1,-0.0 2,-0.0 0.931 32.5 105.8 -63.6 -92.9 -13.9 49.9 44.3 15 207 A E + 0 0 41 -3,-0.1 -2,-0.0 0, 0.0 -3,-0.0 -0.438 29.6 161.8-139.8 -56.9 -14.7 47.0 43.9 16 208 A D - 0 0 152 1,-0.2 2,-0.9 -2,-0.0 0, 0.0 0.925 45.3-159.5 38.4 78.0 -16.3 43.9 45.5 17 209 A D + 0 0 75 1,-0.1 2,-0.4 2,-0.0 -1,-0.2 -0.754 37.8 156.1-101.6 98.6 -17.1 42.3 42.2 18 210 A L 0 0 179 -2,-0.9 -1,-0.1 0, 0.0 -2,-0.0 -0.607 360.0 360.0-103.9 66.0 -19.7 39.6 41.9 19 211 A I 0 0 183 -2,-0.4 -2,-0.0 0, 0.0 -3,-0.0 0.433 360.0 360.0 -98.7 360.0 -20.2 40.3 38.2 20 ! 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 21 223 A K 0 0 220 0, 0.0 3,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 149.6 -22.8 26.6 32.3 22 224 A P - 0 0 90 0, 0.0 2,-0.4 0, 0.0 451,-0.0 -0.189 360.0 -83.7 -77.3 170.3 -20.9 24.1 34.7 23 225 A L + 0 0 71 1,-0.1 4,-0.1 4,-0.1 3,-0.0 -0.651 39.2 174.9 -76.1 125.6 -17.5 22.5 34.2 24 226 A M + 0 0 20 -2,-0.4 252,-3.2 388,-0.1 2,-0.3 0.322 64.6 52.9-110.7 4.8 -17.7 19.3 32.1 25 227 A S S S- 0 0 26 250,-0.1 2,-0.5 252,-0.1 252,-0.1 -0.936 101.7 -74.0-139.0 162.2 -13.9 18.7 32.1 26 228 A K + 0 0 39 250,-0.4 197,-0.4 -2,-0.3 2,-0.3 -0.359 64.7 151.9 -61.1 106.9 -11.0 18.5 34.5 27 229 A K + 0 0 63 -2,-0.5 -4,-0.1 194,-0.1 159,-0.0 -1.000 18.8 153.7-142.4 139.1 -10.2 22.0 35.7 28 230 A K > + 0 0 59 -2,-0.3 3,-0.6 169,-0.1 4,-0.3 0.385 62.4 78.5-141.5 -5.0 -8.8 23.4 39.0 29 231 A S T 3 S+ 0 0 1 1,-0.2 3,-0.4 2,-0.1 169,-0.2 0.677 75.4 77.1 -85.7 -18.3 -7.2 26.7 38.1 30 232 A H T 3 S+ 0 0 53 1,-0.2 3,-0.5 2,-0.1 -1,-0.2 0.445 81.9 75.7 -71.7 2.5 -10.5 28.7 38.1 31 233 A H S X S+ 0 0 59 -3,-0.6 2,-0.8 1,-0.2 3,-0.6 0.950 87.5 49.6 -83.0 -54.1 -10.4 28.6 41.9 32 234 A H G > + 0 0 52 -3,-0.4 3,-0.7 -4,-0.3 -1,-0.2 -0.151 67.9 115.4 -83.4 43.3 -7.7 31.2 42.8 33 235 A K G 3 + 0 0 108 -2,-0.8 3,-0.4 -3,-0.5 4,-0.4 0.397 59.2 86.6 -77.2 -0.7 -9.3 33.8 40.5 34 236 A K G < S+ 0 0 180 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.1 0.316 87.1 49.2 -79.0 6.5 -9.8 35.3 44.0 35 237 A N S X S+ 0 0 60 -3,-0.7 3,-1.2 1,-0.0 -1,-0.2 0.509 82.3 89.6-116.5 -16.0 -6.3 36.8 43.5 36 238 A D T 3 S+ 0 0 19 -3,-0.4 16,-2.3 1,-0.3 17,-0.4 0.784 98.5 37.7 -55.5 -29.6 -6.8 38.3 40.0 37 239 A F E 3 S+C 51 0B 103 -4,-0.4 -1,-0.3 14,-0.2 14,-0.1 -0.492 87.3 106.5-118.0 60.3 -8.0 41.5 41.7 38 240 A Q E < S- 0 0 103 -3,-1.2 13,-0.1 12,-0.7 -1,-0.1 0.187 76.6-116.9-130.6 15.4 -5.6 41.5 44.6 39 241 A W E - 0 0 36 11,-1.0 2,-0.3 -3,-0.2 11,-0.3 0.881 27.7-168.1 58.9 116.2 -3.1 44.3 43.8 40 242 A I E -C 49 0B 45 9,-2.5 9,-3.1 -39,-0.0 2,-0.4 -0.941 17.2-136.4-124.6 152.9 0.7 44.0 43.2 41 243 A G E -C 48 0B 21 -2,-0.3 2,-0.6 7,-0.2 26,-0.4 -0.900 14.3-118.2-116.9 141.1 3.0 47.0 43.0 42 244 A C > - 0 0 1 5,-2.5 4,-1.3 -2,-0.4 26,-0.2 -0.627 16.1-148.3 -74.9 119.8 5.8 47.9 40.6 43 245 A D T 4 S+ 0 0 68 24,-2.8 -1,-0.2 -2,-0.6 25,-0.1 0.589 93.1 41.0 -62.7 -10.0 9.0 48.2 42.5 44 246 A S T 4 S+ 0 0 50 23,-0.4 -1,-0.1 3,-0.1 24,-0.1 0.851 125.5 21.3-103.0 -73.4 10.2 50.8 40.0 45 247 A C T 4 S- 0 0 54 2,-0.1 -2,-0.1 1,-0.1 3,-0.1 0.456 92.6-133.3 -81.3 0.2 7.5 53.2 38.9 46 248 A Q < + 0 0 131 -4,-1.3 2,-0.2 1,-0.2 -3,-0.1 0.548 53.7 148.4 62.6 6.5 5.5 52.5 42.1 47 249 A T - 0 0 51 -6,-0.1 -5,-2.5 1,-0.0 2,-0.4 -0.524 43.3-132.0 -71.7 139.7 2.3 52.2 40.0 48 250 A W E -bC 6 41B 52 -43,-0.6 -41,-2.5 -7,-0.2 2,-0.3 -0.755 22.5-169.7 -94.3 140.0 -0.2 49.7 41.5 49 251 A Y E - C 0 40B 14 -9,-3.1 -9,-2.5 -2,-0.4 5,-0.1 -0.913 28.4-128.4-124.9 155.8 -1.8 47.0 39.3 50 252 A H E - 0 0 4 -2,-0.3 -11,-1.0 -11,-0.3 -12,-0.7 0.995 47.2-113.2 -60.0 -63.2 -4.7 44.6 40.0 51 253 A F E > >S+ C 0 37B 20 -12,-0.2 3,-2.4 -14,-0.1 5,-0.8 -0.522 115.3 55.6 153.5 -72.6 -2.8 41.5 38.9 52 254 A L G > 5S+ 0 0 82 -16,-2.3 3,-0.9 1,-0.3 -15,-0.1 0.914 111.0 49.6 -45.5 -43.0 -4.9 40.6 35.9 53 255 A C G 3 5S+ 0 0 35 -17,-0.4 -1,-0.3 1,-0.2 -16,-0.1 0.469 95.4 74.6 -80.7 -1.6 -4.0 44.2 34.8 54 256 A S G < 5S- 0 0 2 -3,-2.4 -1,-0.2 2,-0.1 -2,-0.2 0.534 106.7-111.4 -91.2 -7.7 -0.3 43.7 35.5 55 257 A G T < 5S+ 0 0 58 -3,-0.9 2,-0.2 -4,-0.4 -3,-0.1 0.443 77.6 132.1 86.6 -0.0 0.6 41.6 32.4 56 258 A L < - 0 0 23 -5,-0.8 -1,-0.4 2,-0.0 2,-0.3 -0.548 53.5-133.0 -79.8 149.4 1.2 38.7 34.8 57 259 A E >> - 0 0 22 -2,-0.2 3,-2.6 -3,-0.1 4,-0.6 -0.753 30.4-102.8 -98.9 155.3 -0.3 35.3 34.2 58 260 A Q G >4 S+ 0 0 10 -2,-0.3 3,-0.9 1,-0.3 4,-0.3 0.791 119.0 55.7 -45.9 -38.1 -2.1 33.4 37.0 59 261 A F G 34 S+ 0 0 11 139,-1.1 -1,-0.3 1,-0.2 3,-0.2 0.653 106.8 49.3 -76.1 -15.6 0.9 31.0 37.5 60 262 A E G X> S+ 0 0 27 -3,-2.6 3,-1.0 1,-0.1 4,-0.8 0.442 79.2 99.9-102.4 -0.7 3.4 33.9 38.1 61 263 A Y T << S+ 0 0 28 -3,-0.9 3,-0.2 -4,-0.6 -1,-0.1 0.876 94.7 31.3 -47.6 -45.2 1.2 35.8 40.7 62 264 A Y T 34 S+ 0 0 38 -4,-0.3 -1,-0.3 -3,-0.2 20,-0.1 0.403 102.5 81.0 -99.7 0.6 3.2 34.3 43.6 63 265 A L T <4 S+ 0 0 2 -3,-1.0 19,-2.4 18,-0.1 2,-0.3 0.854 75.9 77.5 -77.7 -35.5 6.6 34.0 42.0 64 266 A Y E < +D 81 0C 45 -4,-0.8 17,-0.3 17,-0.3 3,-0.2 -0.621 36.9 173.5 -96.1 133.4 8.0 37.5 42.2 65 267 A E E S+ 0 0 111 15,-2.4 2,-0.6 -2,-0.3 16,-0.2 0.837 89.6 36.4 -91.0 -47.5 9.5 39.4 45.2 66 268 A K E S-D 80 0C 98 14,-1.8 14,-1.7 2,-0.0 2,-0.5 -0.938 83.9-160.5-106.3 113.8 10.5 42.4 43.1 67 269 A F - 0 0 5 -2,-0.6 -24,-2.8 -26,-0.4 2,-0.5 -0.822 10.6-171.3-101.8 129.6 7.9 43.1 40.4 68 270 A F - 0 0 21 -2,-0.5 11,-0.3 -26,-0.2 5,-0.1 -0.950 20.1-139.0-118.4 111.7 8.6 45.2 37.3 69 271 A C >> - 0 0 0 -2,-0.5 3,-2.4 -22,-0.1 4,-2.0 -0.127 32.4 -94.6 -64.3 163.2 5.5 46.0 35.2 70 272 A P T 34 S+ 0 0 75 0, 0.0 -1,-0.1 0, 0.0 -15,-0.1 0.852 124.3 55.2 -44.1 -47.1 5.6 46.0 31.4 71 273 A K T 34 S+ 0 0 164 1,-0.2 4,-0.1 2,-0.1 -2,-0.1 0.569 115.8 38.5 -70.3 -7.8 6.4 49.7 31.1 72 274 A C T X> S+ 0 0 5 -3,-2.4 4,-1.9 2,-0.1 3,-1.5 0.675 91.3 85.3-112.2 -28.2 9.5 49.3 33.3 73 275 A V H 3X S+ 0 0 37 -4,-2.0 4,-2.7 1,-0.3 -2,-0.1 0.845 79.2 67.6 -43.6 -48.1 10.9 45.9 32.2 74 276 A P H 34 S+ 0 0 107 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.829 119.1 19.1 -43.4 -42.9 12.9 47.5 29.3 75 277 A H H <4 S+ 0 0 136 -3,-1.5 -2,-0.2 2,-0.1 -3,-0.1 0.550 128.1 48.8-110.0 -11.3 15.2 49.4 31.7 76 278 A T H < S- 0 0 42 -4,-1.9 -3,-0.2 1,-0.3 2,-0.2 0.715 99.9-129.8 -98.1 -26.0 14.8 47.4 35.0 77 279 A G < - 0 0 34 -4,-2.7 -1,-0.3 -5,-0.3 2,-0.2 -0.503 48.0 -37.1 96.8-175.8 15.2 43.9 33.7 78 280 A H S S- 0 0 154 -2,-0.2 -9,-0.1 1,-0.1 -11,-0.0 -0.560 79.3 -83.3 -83.5 150.0 12.8 41.0 34.3 79 281 A S - 0 0 21 -11,-0.3 2,-0.5 -2,-0.2 -12,-0.2 -0.072 45.0-116.3 -50.9 148.0 11.1 40.7 37.8 80 282 A I E -D 66 0C 73 -14,-1.7 -15,-2.4 -3,-0.1 -14,-1.8 -0.788 27.4-140.3 -94.3 128.9 13.1 39.0 40.5 81 283 A R E -D 64 0C 79 -2,-0.5 -17,-0.3 -17,-0.3 -18,-0.1 -0.391 30.3 -85.7 -84.5 161.1 11.7 35.8 41.9 82 284 A Y - 0 0 82 -19,-2.4 -1,-0.1 -20,-0.1 2,-0.1 -0.323 50.4-103.1 -59.9 145.9 11.7 34.7 45.5 83 285 A K - 0 0 156 10,-0.2 2,-1.6 1,-0.1 3,-0.2 -0.476 34.0-111.3 -67.3 143.0 14.9 32.9 46.6 84 286 A V + 0 0 88 1,-0.2 9,-0.2 -2,-0.1 -1,-0.1 -0.631 54.9 157.2 -80.0 90.2 14.5 29.2 46.9 85 287 A V + 0 0 41 -2,-1.6 8,-0.2 7,-1.4 -1,-0.2 0.806 68.0 27.1 -88.1 -34.4 14.7 29.0 50.7 86 288 A A > + 0 0 0 6,-2.4 3,-2.3 -3,-0.2 -1,-0.2 -0.641 59.4 172.0-134.1 77.5 12.9 25.7 51.4 87 289 A P T 3 S+ 0 0 44 0, 0.0 21,-1.4 0, 0.0 20,-0.7 0.680 81.0 60.3 -59.7 -19.1 13.2 23.3 48.4 88 290 A H T 3 S+ 0 0 29 19,-0.2 15,-3.0 20,-0.2 2,-0.3 0.293 98.9 70.4 -93.5 7.4 11.6 20.6 50.5 89 291 A R S < S- 0 0 29 -3,-2.3 3,-0.3 13,-0.2 18,-0.2 -0.940 80.1-128.4-127.9 148.0 8.4 22.5 51.1 90 292 A Y S S+ 0 0 42 -2,-0.3 2,-1.6 1,-0.3 3,-0.2 0.895 112.5 57.1 -58.3 -41.6 5.5 23.5 48.8 91 293 A R S > S+ 0 0 98 1,-0.2 3,-1.6 2,-0.1 -1,-0.3 -0.521 72.4 167.2 -87.8 68.3 6.0 27.1 50.0 92 294 A W T 3 + 0 0 8 -2,-1.6 -6,-2.4 -3,-0.3 -7,-1.4 0.640 67.8 60.2 -60.2 -16.1 9.6 27.0 48.8 93 295 A Y T 3 S+ 0 0 50 -9,-0.2 -1,-0.3 -8,-0.2 -10,-0.2 0.740 84.7 89.4 -85.3 -25.0 9.8 30.8 49.2 94 296 A S X - 0 0 16 -3,-1.6 3,-0.9 1,-0.1 4,-0.1 -0.651 54.0-164.8 -87.5 123.4 9.1 31.0 52.9 95 297 A P G > S+ 0 0 80 0, 0.0 3,-1.5 0, 0.0 4,-0.3 0.737 86.0 73.1 -71.0 -26.8 12.0 30.9 55.4 96 298 A N G 3 S+ 0 0 128 1,-0.3 3,-0.1 2,-0.1 -2,-0.0 0.575 100.7 45.6 -64.8 -9.4 9.6 30.2 58.3 97 299 A E G X S+ 0 0 33 -3,-0.9 3,-1.5 -6,-0.2 -1,-0.3 0.372 79.5 101.2-113.4 0.7 9.1 26.7 56.8 98 300 A K T < S+ 0 0 132 -3,-1.5 -2,-0.1 1,-0.3 -1,-0.1 0.724 84.8 49.8 -59.0 -21.4 12.8 25.9 56.2 99 301 A H T 3 S+ 0 0 149 -4,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.567 92.4 97.6 -97.2 -10.0 12.8 23.8 59.4 100 302 A L S < S- 0 0 65 -3,-1.5 3,-0.1 1,-0.2 -12,-0.1 -0.220 82.5 -75.2 -79.1 169.4 9.7 21.7 58.7 101 303 A G - 0 0 39 1,-0.1 2,-0.4 -2,-0.0 -1,-0.2 -0.119 52.3 -89.5 -67.7 158.3 9.5 18.2 57.2 102 304 A I - 0 0 79 233,-0.1 2,-0.3 -13,-0.1 -13,-0.2 -0.529 44.2-137.6 -71.1 121.9 10.1 17.2 53.6 103 305 A E > - 0 0 15 -15,-3.0 3,-1.1 -2,-0.4 6,-0.4 -0.615 13.7-120.5 -90.6 142.4 6.8 17.4 51.7 104 306 A V T 3 S+ 0 0 3 230,-2.9 231,-0.1 -2,-0.3 -1,-0.1 0.746 108.3 41.4 -54.3 -33.2 5.8 14.6 49.2 105 307 A G T 3 S+ 0 0 0 229,-0.2 -1,-0.3 87,-0.1 89,-0.1 0.750 90.9 112.2 -85.6 -21.8 5.5 16.8 46.1 106 308 A S S <> S- 0 0 0 -3,-1.1 4,-2.4 -18,-0.2 5,-0.2 0.106 77.6-112.1 -60.6 162.2 8.5 19.1 46.7 107 309 A K H > S+ 0 0 63 -20,-0.7 4,-2.5 -18,-0.2 5,-0.2 0.932 117.1 50.8 -56.1 -50.5 11.7 19.2 44.6 108 310 A T H > S+ 0 0 40 -21,-1.4 4,-1.9 1,-0.2 5,-0.2 0.930 111.1 48.6 -55.3 -49.0 13.8 17.8 47.4 109 311 A W H > S+ 0 0 23 -6,-0.4 4,-2.6 -22,-0.3 -1,-0.2 0.907 111.7 48.7 -59.1 -45.6 11.5 14.9 47.9 110 312 A I H X S+ 0 0 2 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.955 108.6 52.1 -62.1 -52.1 11.3 14.0 44.2 111 313 A E H X S+ 0 0 99 -4,-2.5 4,-0.7 1,-0.2 -1,-0.2 0.910 115.0 42.4 -50.6 -48.5 15.0 14.0 43.6 112 314 A D H >X S+ 0 0 99 -4,-1.9 3,-1.1 -5,-0.2 4,-0.7 0.900 110.1 57.5 -64.6 -42.5 15.6 11.7 46.6 113 315 A F H >X S+ 0 0 1 -4,-2.6 4,-1.9 1,-0.3 3,-0.7 0.824 99.1 60.4 -59.0 -33.0 12.6 9.6 45.5 114 316 A I H 3< S+ 0 0 75 -4,-2.2 4,-0.3 1,-0.2 -1,-0.3 0.801 100.4 55.2 -66.1 -28.1 14.3 9.0 42.1 115 317 A T H << S+ 0 0 100 -3,-1.1 -1,-0.2 -4,-0.7 -2,-0.2 0.716 122.0 26.2 -76.4 -20.2 17.2 7.4 43.9 116 318 A R H X< S+ 0 0 71 -4,-0.7 3,-1.7 -3,-0.7 -2,-0.2 0.493 92.7 92.9-121.3 -8.6 15.0 4.8 45.6 117 319 A E G >< S+ 0 0 19 -4,-1.9 3,-2.0 1,-0.3 -3,-0.1 0.797 73.7 71.8 -61.5 -29.3 11.9 4.4 43.4 118 320 A N G 3 S+ 0 0 96 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.537 85.7 68.9 -67.8 -4.0 13.4 1.5 41.5 119 321 A T G < + 0 0 100 -3,-1.7 -1,-0.3 2,-0.1 -2,-0.2 0.340 68.2 113.1 -97.5 5.1 13.0 -0.7 44.6 120 322 A V S < S- 0 0 16 -3,-2.0 228,-0.2 1,-0.1 227,-0.1 -0.703 79.1-104.8 -76.5 124.1 9.2 -0.7 44.4 121 323 A P - 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0 0 0 -13,-0.4 -13,-2.4 -2,-0.2 -2,-0.0 -0.868 38.2-108.6-167.8 130.4 -0.9 29.5 31.6 200 402 A K B > -M 185 0E 83 -2,-0.3 4,-2.2 -15,-0.2 -15,-0.2 -0.334 30.9-125.1 -56.3 144.2 -1.0 30.5 27.9 201 403 A L H > S+ 0 0 0 -17,-2.0 4,-2.1 1,-0.2 -18,-0.2 0.852 113.4 52.8 -62.7 -33.4 -0.3 27.4 25.8 202 404 A D H > S+ 0 0 53 -20,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.935 105.6 52.2 -65.9 -49.0 2.5 29.4 24.1 203 405 A T H > S+ 0 0 15 -21,-0.4 4,-2.6 1,-0.2 5,-0.2 0.916 109.3 51.1 -53.4 -45.6 4.0 30.3 27.5 204 406 A F H X S+ 0 0 0 -4,-2.2 4,-3.1 2,-0.2 -1,-0.2 0.945 109.1 49.4 -57.1 -50.7 4.1 26.6 28.4 205 407 A R H X S+ 0 0 59 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.918 109.3 54.2 -54.7 -45.6 5.8 25.8 25.1 206 408 A K H X S+ 0 0 128 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.949 113.5 40.4 -51.3 -54.3 8.3 28.5 25.9 207 409 A L H < S+ 0 0 49 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.849 112.8 56.0 -66.2 -36.5 9.1 27.0 29.3 208 410 A F H < S+ 0 0 19 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.885 106.7 49.2 -63.8 -40.7 9.0 23.4 27.9 209 411 A R H < S+ 0 0 107 -4,-2.5 2,-1.1 -5,-0.2 -1,-0.2 0.821 88.6 87.3 -73.5 -31.3 11.6 24.2 25.3 210 412 A D < + 0 0 76 -4,-1.5 -1,-0.1 -5,-0.2 -4,-0.0 -0.595 56.3 169.8 -68.1 102.6 14.0 25.8 27.8 211 413 A T + 0 0 101 -2,-1.1 -1,-0.2 1,-0.1 3,-0.2 0.784 65.1 47.9 -90.8 -32.5 15.8 22.6 28.9 212 414 A K S S+ 0 0 178 1,-0.2 2,-0.6 0, 0.0 -1,-0.1 0.777 109.5 51.3 -85.5 -28.5 18.7 23.9 30.9 213 415 A N + 0 0 96 -6,-0.1 -1,-0.2 1,-0.0 3,-0.1 -0.820 58.2 145.0-118.9 94.8 16.8 26.4 33.1 214 416 A R + 0 0 44 -2,-0.6 -3,-0.0 -3,-0.2 -1,-0.0 -0.717 9.3 167.0-129.6 80.8 13.8 25.0 34.9 215 417 A P S S+ 0 0 75 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.928 78.7 27.0 -58.5 -47.7 13.3 26.6 38.3 216 418 A L S S- 0 0 10 -3,-0.1 2,-0.4 -25,-0.0 -26,-0.0 -0.813 82.6-128.8-110.9 157.9 9.8 25.1 38.5 217 419 A L - 0 0 8 -2,-0.3 -26,-1.6 70,-0.1 2,-0.4 -0.878 22.8-164.3-104.9 139.8 8.4 22.1 36.8 218 420 A Y E +O 190 0F 9 -2,-0.4 2,-0.3 -28,-0.2 67,-0.2 -0.969 17.3 163.6-133.4 120.1 5.2 22.3 34.8 219 421 A N E -O 189 0F 9 -30,-1.5 -30,-3.9 -2,-0.4 2,-0.4 -0.942 38.6-115.0-118.9 148.8 2.8 19.6 33.6 220 422 A F E -O 188 0F 3 63,-1.9 -32,-0.3 -2,-0.3 63,-0.2 -0.755 12.8-137.6 -96.0 137.8 -0.7 20.3 32.4 221 423 A L S S- 0 0 19 -34,-1.5 -1,-0.1 -2,-0.4 -33,-0.1 0.927 73.6 -37.1 -44.7 -72.1 -3.8 19.0 34.3 222 424 A S - 0 0 4 -35,-0.3 59,-0.4 -196,-0.3 -2,-0.1 0.644 48.3-167.5-126.6 -78.3 -6.1 17.9 31.5 223 425 A L - 0 0 9 -197,-0.4 58,-2.5 57,-0.2 2,-0.5 0.989 21.8-160.5 66.6 71.3 -6.4 19.8 28.1 224 426 A E B -G 280 0D 6 56,-0.2 56,-0.2 -198,-0.1 3,-0.2 -0.750 13.3-177.6 -89.2 123.4 -9.5 18.0 26.9 225 427 A F > + 0 0 2 54,-2.0 3,-1.2 -2,-0.5 7,-0.3 -0.001 43.4 116.5-116.5 27.9 -9.8 18.5 23.1 226 428 A S T 3 S+ 0 0 11 53,-0.4 -1,-0.2 1,-0.2 54,-0.1 0.552 81.5 50.9 -74.2 -5.3 -13.0 16.7 22.2 227 429 A D T 3 S+ 0 0 101 -3,-0.2 2,-0.8 49,-0.1 -1,-0.2 0.301 83.6 95.3-115.2 4.6 -14.5 20.1 21.0 228 430 A N <> - 0 0 33 -3,-1.2 4,-3.0 1,-0.1 5,-0.3 -0.863 69.7-146.7 -98.1 104.8 -11.6 21.1 18.7 229 431 A N T 4 S+ 0 0 131 -2,-0.8 4,-0.2 1,-0.2 -1,-0.1 0.714 94.9 41.2 -48.9 -28.4 -12.7 20.0 15.3 230 432 A E T >> S+ 0 0 120 2,-0.1 3,-1.4 -51,-0.1 4,-0.6 0.956 118.4 41.8 -82.3 -57.4 -9.1 19.3 14.2 231 433 A M H >> S+ 0 0 1 1,-0.2 3,-1.8 2,-0.2 4,-1.5 0.881 103.6 67.6 -53.6 -43.8 -7.7 17.6 17.3 232 434 A K H 3< S+ 0 0 32 -4,-3.0 -1,-0.2 1,-0.3 -3,-0.1 0.646 106.5 41.0 -61.1 -14.6 -10.8 15.6 18.0 233 435 A E H <4 S+ 0 0 98 -3,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.525 107.0 65.1-104.5 -10.7 -10.1 13.6 14.8 234 436 A I H << S+ 0 0 42 -3,-1.8 2,-0.4 -4,-0.6 -2,-0.2 0.882 110.5 23.9 -81.7 -44.1 -6.3 13.3 15.4 235 437 A A S < S+ 0 0 1 -4,-1.5 -1,-0.3 -69,-0.2 -69,-0.2 -0.969 74.3 168.8-130.4 119.3 -6.3 11.2 18.6 236 438 A K - 0 0 20 -71,-2.7 3,-0.1 -2,-0.4 -3,-0.1 -0.791 37.3 -96.2-125.3 162.7 -9.2 8.9 19.5 237 439 A P - 0 0 2 0, 0.0 -72,-0.4 0, 0.0 5,-0.1 -0.431 56.6 -83.9 -72.5 157.3 -9.8 6.2 22.1 238 440 A P >> - 0 0 0 0, 0.0 4,-1.8 0, 0.0 3,-0.9 -0.233 41.8-111.4 -55.1 149.7 -9.4 2.5 21.0 239 441 A R H 3> S+ 0 0 117 -76,-0.9 4,-2.2 -77,-0.8 5,-0.2 0.896 118.4 56.3 -52.1 -45.0 -12.4 1.1 19.2 240 442 A F H 34 S+ 0 0 31 -78,-0.4 4,-0.5 1,-0.2 -1,-0.3 0.812 106.8 50.2 -62.1 -30.3 -13.2 -1.3 22.1 241 443 A V H X> S+ 0 0 0 -3,-0.9 4,-1.8 2,-0.2 3,-0.7 0.869 109.5 50.0 -72.8 -37.5 -13.3 1.8 24.4 242 444 A Q H 3< S+ 0 0 32 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.850 107.6 56.1 -67.8 -32.7 -15.7 3.6 22.1 243 445 A E T 3< S+ 0 0 140 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.631 118.8 30.0 -75.7 -14.2 -17.9 0.5 22.0 244 446 A I T <4 S+ 0 0 45 -3,-0.7 139,-0.4 -4,-0.5 2,-0.3 0.512 85.8 118.4-120.5 -11.6 -18.3 0.3 25.8 245 447 A S X - 0 0 2 -4,-1.8 4,-0.9 1,-0.2 137,-0.2 -0.408 51.9-154.4 -60.8 119.4 -18.0 4.0 26.8 246 448 A M H >> S+ 0 0 0 135,-2.8 4,-1.1 -2,-0.3 3,-0.5 0.887 96.1 52.1 -62.9 -39.0 -21.3 5.0 28.5 247 449 A V H >> S+ 0 0 6 134,-0.3 4,-2.8 1,-0.2 3,-0.8 0.937 108.9 50.6 -61.8 -44.1 -20.8 8.6 27.5 248 450 A N H 34 S+ 0 0 30 1,-0.2 -1,-0.2 2,-0.2 5,-0.2 0.667 105.8 57.6 -66.2 -17.5 -20.2 7.5 23.9 249 451 A R H << S+ 0 0 96 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.771 117.6 30.4 -83.5 -26.8 -23.5 5.5 24.0 250 452 A L H << S+ 0 0 1 -4,-1.1 19,-1.3 -3,-0.8 -2,-0.2 0.650 133.6 31.8-106.9 -26.4 -25.6 8.5 25.0 251 453 A W S < S- 0 0 5 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.1 -0.605 91.9-161.0-124.2 68.5 -23.6 11.2 23.2 252 454 A P > - 0 0 14 0, 0.0 3,-0.7 0, 0.0 -3,-0.1 -0.212 19.2-128.4 -62.0 139.9 -22.3 9.1 20.3 253 455 A D T 3 S+ 0 0 39 1,-0.2 2,-0.7 -5,-0.2 6,-0.1 0.891 75.7 110.6 -50.8 -57.8 -19.3 10.4 18.4 254 456 A V T 3 + 0 0 59 1,-0.2 4,-0.3 4,-0.1 5,-0.3 0.271 33.1 159.2 28.9 -60.5 -20.7 10.2 14.9 255 457 A S < + 0 0 51 -3,-0.7 -1,-0.2 -2,-0.7 2,-0.1 0.525 49.2 80.1 11.9 57.5 -20.9 13.9 14.6 256 458 A G S > S- 0 0 45 0, 0.0 4,-0.6 0, 0.0 -1,-0.1 -0.136 113.2 -38.5-143.4-124.3 -21.0 13.5 10.8 257 459 A A H > S+ 0 0 82 -3,-0.2 4,-0.8 2,-0.2 3,-0.2 0.783 137.3 58.2 -82.5 -32.1 -23.9 12.7 8.5 258 460 A E H > S+ 0 0 99 -4,-0.3 4,-3.1 1,-0.2 5,-0.2 0.733 95.1 66.0 -69.6 -23.1 -25.2 10.2 11.1 259 461 A Y H > S+ 0 0 73 -5,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.937 95.8 55.0 -63.7 -46.6 -25.4 12.9 13.7 260 462 A I H < S+ 0 0 111 -4,-0.6 -1,-0.2 -3,-0.2 -2,-0.2 0.849 117.7 36.8 -52.8 -37.1 -28.2 14.7 11.8 261 463 A K H >< S+ 0 0 91 -4,-0.8 3,-1.0 2,-0.2 -2,-0.2 0.888 111.0 54.3 -87.4 -43.1 -30.2 11.5 11.8 262 464 A L H 3<>S+ 0 0 21 -4,-3.1 5,-1.5 1,-0.3 3,-0.3 0.691 112.0 46.7 -72.5 -14.9 -29.5 10.0 15.2 263 465 A L T ><5S+ 0 0 67 -4,-1.5 3,-1.6 -5,-0.2 -1,-0.3 0.491 90.8 82.6 -97.5 -6.2 -30.5 13.2 17.0 264 466 A Q T < 5S+ 0 0 144 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.2 0.275 102.9 36.2 -74.3 11.6 -33.6 13.2 14.7 265 467 A R T 3 5S- 0 0 188 -3,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.066 124.6-101.2-147.7 18.2 -34.9 10.8 17.4 266 468 A E T < 5S+ 0 0 154 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.663 77.4 141.1 60.0 19.3 -33.2 12.5 20.4 267 469 A E < + 0 0 55 -5,-1.5 2,-0.3 -6,-0.2 -4,-0.2 -0.017 62.9 65.6 -77.1 30.8 -30.5 9.8 20.4 268 470 A Y S S- 0 0 24 -5,-0.2 -17,-0.2 -17,-0.1 3,-0.1 -0.813 79.1-148.2-151.4 115.6 -28.2 12.7 21.3 269 471 A L - 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