==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 26-FEB-10 3LY9 . COMPND 2 MOLECULE: TRANSCRIPTIONAL ACTIVATOR CADC; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.EICHINGER,A.SKERRA . 322 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16324.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 238 73.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 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 . 25 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 46.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 0 0 1 1 1 1 0 0 2 2 1 1 2 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 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 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 1 0 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 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 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 1 190 A S 0 0 167 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 2.4 3.9 2.4 -6.2 2 191 A R - 0 0 251 1,-0.0 2,-0.5 2,-0.0 0, 0.0 -0.329 360.0-140.0 -51.8 137.5 7.5 3.0 -5.3 3 192 A I - 0 0 117 59,-0.1 2,-0.5 -2,-0.0 59,-0.1 -0.955 15.6-130.0-107.9 127.9 8.2 6.2 -3.4 4 193 A L - 0 0 157 -2,-0.5 2,-0.1 1,-0.1 61,-0.1 -0.612 19.2-128.9 -78.3 123.6 11.3 8.1 -4.5 5 194 A L - 0 0 61 -2,-0.5 59,-0.2 59,-0.1 58,-0.1 -0.465 14.3-143.4 -68.2 139.8 13.6 9.1 -1.6 6 195 A N E > -a 64 0A 66 57,-2.9 59,-2.3 -2,-0.1 3,-1.7 -0.942 3.5-157.5-108.6 112.7 14.6 12.8 -1.7 7 196 A P E 3 S+ 0 0 74 0, 0.0 -1,-0.1 0, 0.0 57,-0.1 0.622 91.6 56.2 -72.0 -9.0 18.1 13.1 -0.5 8 197 A R E 3 S+ 0 0 95 40,-0.1 41,-3.0 39,-0.0 2,-0.5 0.153 89.1 88.5-106.0 18.3 17.5 16.8 0.5 9 198 A D E < - b 0 49A 17 -3,-1.7 57,-1.7 39,-0.2 56,-1.0 -0.984 59.5-171.9-113.2 129.2 14.6 16.0 2.8 10 199 A I E -ab 66 50A 4 39,-2.8 41,-2.4 -2,-0.5 2,-0.4 -0.980 13.4-157.3-125.8 127.4 15.5 15.2 6.4 11 200 A D E -ab 67 51A 9 55,-1.9 57,-3.3 -2,-0.4 2,-0.5 -0.811 10.9-150.1 -92.9 144.0 13.4 13.9 9.4 12 201 A I E -ab 68 52A 0 39,-2.2 41,-1.7 -2,-0.4 2,-0.3 -0.979 20.8-173.9-115.1 126.4 14.6 14.6 12.9 13 202 A N E -a 69 0A 50 55,-3.2 57,-2.1 -2,-0.5 2,-0.4 -0.818 13.5-153.4-119.6 152.8 13.5 11.8 15.4 14 203 A M E +a 70 0A 29 39,-0.4 57,-0.2 -2,-0.3 2,-0.2 -0.980 17.5 172.7-125.2 142.4 13.7 11.5 19.1 15 204 A V + 0 0 60 55,-2.6 57,-0.4 -2,-0.4 3,-0.2 -0.633 52.0 41.5-129.8-169.4 13.9 8.2 21.1 16 205 A N - 0 0 89 1,-0.2 2,-0.7 -2,-0.2 3,-0.1 0.758 69.9-162.5 34.0 47.0 14.4 6.9 24.7 17 206 A K + 0 0 114 1,-0.2 -1,-0.2 -3,-0.1 4,-0.1 -0.397 69.7 19.5 -62.3 102.8 12.3 9.7 26.2 18 207 A S S S- 0 0 40 -2,-0.7 3,-0.4 -3,-0.2 -1,-0.2 0.853 78.9-135.3 100.9 69.2 13.2 9.7 29.9 19 208 A a S S- 0 0 43 1,-0.2 2,-0.3 5,-0.2 55,-0.1 0.708 93.5 -0.4 -14.8 -55.3 16.6 8.0 30.4 20 209 A N S S- 0 0 98 2,-0.3 -1,-0.2 1,-0.2 -2,-0.1 -0.845 122.0 -29.0-152.4 108.4 14.9 6.3 33.3 21 210 A S S S- 0 0 92 -3,-0.4 -1,-0.2 -2,-0.3 3,-0.1 -0.304 102.9 -10.4 83.2-169.0 11.4 6.7 34.6 22 211 A W S S- 0 0 227 1,-0.1 2,-0.4 -3,-0.1 -2,-0.3 0.184 100.5 -36.3 -51.6 179.3 9.2 9.8 34.3 23 212 A S - 0 0 82 1,-0.1 -1,-0.1 -4,-0.1 3,-0.1 -0.779 37.1-177.2 -96.9 137.1 10.6 13.2 33.1 24 213 A S > - 0 0 36 -2,-0.4 4,-0.7 1,-0.3 3,-0.3 -0.977 14.5-163.4 107.4 7.7 13.1 14.2 33.7 25 214 A P T 4 + 0 0 65 0, 0.0 2,-1.7 0, 0.0 -1,-0.3 0.399 63.8 64.5 -50.6-161.2 13.3 17.7 32.2 26 215 A Y T > S+ 0 0 107 1,-0.3 4,-1.7 123,-0.1 5,-0.1 -0.609 109.4 38.9 81.8 -83.9 16.6 19.5 31.7 27 216 A Q H > S+ 0 0 35 -2,-1.7 4,-2.4 -3,-0.3 -1,-0.3 0.852 115.9 52.7 -69.0 -37.3 18.2 17.1 29.2 28 217 A L H X S+ 0 0 36 -4,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.948 111.2 44.5 -67.0 -47.2 15.0 16.5 27.2 29 218 A S H > S+ 0 0 4 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.836 111.7 54.7 -68.4 -30.5 14.2 20.2 26.7 30 219 A Y H X S+ 0 0 2 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.970 110.2 45.6 -64.2 -50.3 17.8 20.9 25.8 31 220 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.852 112.1 51.8 -60.3 -38.8 17.6 18.2 23.1 32 221 A I H X S+ 0 0 17 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.919 111.2 48.0 -62.4 -45.8 14.2 19.5 21.9 33 222 A G H X S+ 0 0 2 -4,-2.5 4,-3.2 1,-0.2 -2,-0.2 0.914 111.9 49.0 -59.6 -45.9 15.7 23.0 21.6 34 223 A V H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.885 112.2 48.2 -60.4 -41.7 18.8 21.8 19.7 35 224 A G H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.917 111.9 48.8 -72.9 -43.3 16.6 19.8 17.3 36 225 A D H X S+ 0 0 15 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.952 111.5 51.8 -57.2 -46.9 14.3 22.8 16.7 37 226 A L H X S+ 0 0 21 -4,-3.2 4,-2.2 -5,-0.2 -2,-0.2 0.915 110.8 47.0 -59.9 -38.7 17.4 24.9 16.1 38 227 A V H X S+ 0 0 3 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.939 113.9 47.7 -64.1 -51.7 18.8 22.4 13.5 39 228 A A H X S+ 0 0 3 -4,-2.5 4,-3.3 2,-0.2 5,-0.3 0.953 114.7 44.1 -48.8 -56.6 15.5 22.1 11.7 40 229 A T H X S+ 0 0 19 -4,-2.7 4,-2.6 1,-0.2 219,-0.5 0.914 113.7 50.5 -67.5 -40.6 14.9 25.9 11.5 41 230 A S H X S+ 0 0 6 -4,-2.2 4,-2.5 -5,-0.3 -1,-0.2 0.928 114.9 43.9 -59.1 -44.3 18.6 26.7 10.5 42 231 A L H X S+ 0 0 2 -4,-2.4 4,-1.2 -5,-0.2 6,-0.4 0.946 115.0 46.9 -71.7 -49.4 18.5 24.1 7.7 43 232 A N H < S+ 0 0 16 -4,-3.3 -1,-0.2 -5,-0.2 -2,-0.2 0.906 121.0 40.0 -53.9 -38.2 15.0 25.1 6.4 44 233 A T H < S+ 0 0 29 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.835 124.2 30.9 -83.4 -38.0 15.9 28.7 6.5 45 234 A F H < S+ 0 0 33 -4,-2.5 2,-0.3 -5,-0.2 -1,-0.2 0.251 116.3 37.3-113.9 12.9 19.5 28.8 5.2 46 235 A S S < S- 0 0 21 -4,-1.2 81,-0.0 2,-0.3 83,-0.0 -0.931 81.3-105.9-148.9 172.8 19.8 25.9 2.8 47 236 A T S S+ 0 0 114 -2,-0.3 2,-0.3 2,-0.1 -4,-0.1 0.231 85.2 111.1 -90.8 16.0 17.9 24.0 0.1 48 237 A F - 0 0 8 -6,-0.4 2,-0.5 -39,-0.1 -2,-0.3 -0.658 60.8-146.2 -77.2 147.5 17.4 21.1 2.6 49 238 A M E -b 9 0A 108 -41,-3.0 -39,-2.8 -2,-0.3 2,-0.4 -0.977 16.4-165.7-109.7 129.6 13.8 20.6 3.8 50 239 A V E -b 10 0A 2 -2,-0.5 2,-0.7 -41,-0.2 -39,-0.2 -0.951 16.2-159.1-120.5 131.3 13.5 19.3 7.5 51 240 A H E -b 11 0A 32 -41,-2.4 -39,-2.2 -2,-0.4 2,-1.2 -0.948 17.6-147.7 -97.7 105.3 10.5 17.8 9.2 52 241 A D E +b 12 0A 2 238,-3.0 3,-0.4 -2,-0.7 -39,-0.1 -0.657 27.0 169.4 -72.5 99.2 11.2 18.3 12.9 53 242 A K > + 0 0 22 -41,-1.7 3,-2.0 -2,-1.2 -39,-0.4 0.166 38.6 114.6 -97.8 19.4 9.4 15.1 14.2 54 243 A I T 3 S+ 0 0 16 1,-0.3 -1,-0.2 -41,-0.2 -41,-0.1 0.835 84.8 40.5 -57.2 -32.5 10.7 15.3 17.7 55 244 A N T 3 S+ 0 0 34 -3,-0.4 239,-0.7 237,-0.3 2,-0.5 0.132 96.7 97.4-102.4 18.2 7.1 15.9 19.0 56 245 A Y < - 0 0 25 -3,-2.0 -42,-0.2 237,-0.2 237,-0.1 -0.944 48.5-172.2-115.7 118.8 5.5 13.4 16.7 57 246 A N + 0 0 127 -2,-0.5 2,-0.3 2,-0.0 -1,-0.1 0.550 56.7 99.8 -82.4 -6.0 4.7 9.9 18.0 58 247 A I - 0 0 91 -5,-0.0 2,-0.7 1,-0.0 -2,-0.1 -0.649 58.6-151.8-101.7 132.8 3.6 8.5 14.6 59 248 A D + 0 0 162 -2,-0.3 -2,-0.0 2,-0.0 -1,-0.0 -0.892 32.7 159.8 -96.7 111.0 5.5 6.4 12.1 60 249 A E - 0 0 66 -2,-0.7 2,-0.3 0, 0.0 -2,-0.0 -0.882 49.6 -80.9-128.3 160.2 4.2 7.2 8.6 61 250 A P - 0 0 120 0, 0.0 2,-0.4 0, 0.0 -2,-0.0 -0.455 53.1-175.9 -67.8 122.8 5.7 6.7 5.2 62 251 A S - 0 0 47 -2,-0.3 -59,-0.1 2,-0.1 -51,-0.1 -0.955 35.4-148.6-124.6 143.4 8.2 9.4 4.3 63 252 A S + 0 0 44 -2,-0.4 -57,-2.9 -58,-0.1 2,-0.3 0.153 54.4 139.1 -84.0 16.3 10.2 10.2 1.3 64 253 A S E -a 6 0A 2 -59,-0.2 -54,-0.2 1,-0.2 -2,-0.1 -0.511 42.4-158.9 -67.4 123.2 12.9 11.7 3.6 65 254 A G E S+ 0 0 1 -59,-2.3 27,-2.6 -56,-1.0 28,-0.8 0.711 74.3 32.2 -74.1 -23.1 16.3 10.6 2.3 66 255 A K E -aC 10 91A 20 -57,-1.7 -55,-1.9 -60,-0.3 2,-0.4 -0.944 64.7-158.1-138.3 154.5 18.0 11.2 5.6 67 256 A T E -aC 11 90A 19 23,-2.1 23,-2.8 -2,-0.3 2,-0.6 -0.996 5.7-155.2-138.3 126.6 17.1 10.9 9.2 68 257 A L E -aC 12 89A 4 -57,-3.3 -55,-3.2 -2,-0.4 2,-0.4 -0.920 18.9-162.5-100.3 117.7 18.7 12.6 12.2 69 258 A S E -aC 13 88A 35 19,-3.4 19,-2.1 -2,-0.6 2,-0.5 -0.875 11.2-166.4-107.1 135.2 18.1 10.6 15.4 70 259 A I E +aC 14 87A 2 -57,-2.1 -55,-2.6 -2,-0.4 2,-0.4 -0.977 19.7 167.6-116.2 123.8 18.5 11.9 19.0 71 260 A A E - C 0 86A 12 15,-2.9 15,-3.8 -2,-0.5 2,-0.6 -0.998 33.8-135.9-142.0 135.6 18.6 9.2 21.7 72 261 A F E - C 0 85A 4 -57,-0.4 2,-0.3 -2,-0.4 13,-0.2 -0.825 36.5-177.3 -89.6 117.3 19.5 9.1 25.4 73 262 A V E - C 0 84A 44 11,-3.2 11,-2.8 -2,-0.6 2,-0.4 -0.856 20.3-159.1-119.1 150.5 21.6 6.0 26.0 74 263 A N - 0 0 38 -2,-0.3 9,-0.1 9,-0.2 -2,-0.0 -0.992 17.4-143.5-124.3 143.2 23.2 4.3 29.0 75 264 A Q - 0 0 139 -2,-0.4 -1,-0.1 7,-0.4 8,-0.1 0.821 40.1-125.5 -69.0 -33.8 26.1 1.9 28.8 76 265 A R + 0 0 216 2,-0.1 3,-0.1 -3,-0.1 -2,-0.0 0.922 64.5 135.6 86.4 52.6 24.6 -0.2 31.7 77 266 A Q S S- 0 0 93 1,-0.2 2,-0.3 2,-0.0 -3,-0.0 0.566 74.2 -14.4-103.4 -14.8 27.6 -0.3 34.1 78 267 A Y S > S- 0 0 186 0, 0.0 3,-0.7 0, 0.0 2,-0.3 -0.943 86.6 -60.2-167.6-175.0 25.5 0.5 37.3 79 268 A R T 3 S+ 0 0 226 -2,-0.3 -2,-0.0 1,-0.2 0, 0.0 -0.666 114.2 4.2 -87.5 137.5 22.2 1.7 38.7 80 269 A A T 3 S- 0 0 70 -2,-0.3 -1,-0.2 1,-0.1 3,-0.1 0.859 91.7-178.9 59.5 36.7 21.0 5.2 37.8 81 270 A Q < - 0 0 54 -3,-0.7 2,-0.3 1,-0.1 -1,-0.1 -0.080 33.0 -88.4 -62.1 166.6 24.0 5.7 35.5 82 271 A Q - 0 0 114 1,-0.1 -7,-0.4 -63,-0.0 -1,-0.1 -0.618 43.3-126.3 -82.1 136.7 24.7 8.9 33.6 83 272 A a - 0 0 11 -2,-0.3 2,-0.4 -9,-0.1 22,-0.3 -0.426 13.1-152.6 -76.8 149.6 23.1 9.3 30.2 84 273 A F E -C 73 0A 26 -11,-2.8 -11,-3.2 -2,-0.1 2,-0.9 -0.973 19.3-126.3-117.1 146.9 24.8 10.1 27.0 85 274 A M E -CD 72 103A 3 18,-3.1 18,-2.2 -2,-0.4 2,-0.4 -0.790 25.6-159.6 -90.3 104.4 23.0 11.9 24.1 86 275 A S E -CD 71 102A 14 -15,-3.8 -15,-2.9 -2,-0.9 2,-0.4 -0.716 10.0-175.3 -85.6 129.5 23.5 9.8 21.0 87 276 A I E +CD 70 101A 1 14,-2.5 14,-2.9 -2,-0.4 2,-0.4 -0.959 4.7 176.8-130.1 115.5 22.9 11.6 17.8 88 277 A K E -CD 69 100A 85 -19,-2.1 -19,-3.4 -2,-0.4 2,-0.6 -0.938 20.4-156.2-121.5 143.1 23.1 9.8 14.4 89 278 A L E -CD 68 99A 1 10,-2.3 9,-3.2 -2,-0.4 10,-1.2 -0.968 21.8-171.2-113.8 116.7 22.5 11.0 10.8 90 279 A V E -CD 67 97A 36 -23,-2.8 -23,-2.1 -2,-0.6 2,-0.7 -0.858 22.7-137.7-113.1 142.1 21.5 8.1 8.6 91 280 A D E > -C 66 0A 19 5,-3.0 4,-0.8 -2,-0.4 -25,-0.2 -0.905 13.4-164.7 -95.9 113.6 21.2 8.0 4.8 92 281 A N T 4 S+ 0 0 69 -27,-2.6 -26,-0.2 -2,-0.7 -1,-0.1 0.626 83.4 55.3 -76.9 -17.4 18.0 6.0 4.1 93 282 A A T 4 S+ 0 0 73 -28,-0.8 -1,-0.2 1,-0.1 -27,-0.1 0.953 123.2 20.5 -76.3 -57.7 18.9 5.5 0.4 94 283 A D T 4 S- 0 0 102 2,-0.1 -2,-0.2 1,-0.0 -1,-0.1 0.296 100.3-126.7 -98.1 7.0 22.3 3.9 0.7 95 284 A G < + 0 0 55 -4,-0.8 -3,-0.1 1,-0.2 -1,-0.0 0.240 59.9 142.4 69.5 -12.8 21.8 2.7 4.4 96 285 A S - 0 0 49 -6,-0.1 -5,-3.0 1,-0.1 2,-0.7 -0.117 55.4-123.2 -70.3 156.0 25.0 4.4 5.6 97 286 A T E -D 90 0A 81 -7,-0.2 -7,-0.2 1,-0.1 3,-0.1 -0.877 26.9-178.9 -90.5 118.7 25.7 6.2 8.9 98 287 A M E + 0 0 54 -9,-3.2 2,-0.3 -2,-0.7 -8,-0.2 0.685 68.5 10.4 -91.9 -23.0 26.8 9.7 8.0 99 288 A L E -D 89 0A 14 -10,-1.2 -10,-2.3 2,-0.0 2,-0.3 -0.957 57.9-177.1-160.4 135.8 27.4 11.0 11.5 100 289 A D E +D 88 0A 78 -2,-0.3 2,-0.4 -12,-0.2 -12,-0.2 -0.858 14.2 175.2-144.1 101.4 27.5 9.3 14.8 101 290 A K E -D 87 0A 55 -14,-2.9 -14,-2.5 -2,-0.3 2,-0.5 -0.867 19.3-162.4-116.1 144.7 28.1 11.5 17.9 102 291 A R E -D 86 0A 185 -2,-0.4 2,-0.5 -16,-0.2 -16,-0.2 -0.961 18.6-171.3-122.5 108.8 28.0 10.6 21.6 103 292 A Y E -D 85 0A 17 -18,-2.2 -18,-3.1 -2,-0.5 2,-0.6 -0.885 16.3-160.5-105.2 128.3 27.6 13.7 23.8 104 293 A V - 0 0 81 -2,-0.5 2,-0.3 -20,-0.2 -20,-0.1 -0.939 21.3-144.6 -98.3 117.8 27.9 13.9 27.6 105 294 A I + 0 0 23 -2,-0.6 -22,-0.1 -22,-0.3 -78,-0.0 -0.674 22.6 175.4 -84.9 134.5 26.2 17.0 28.8 106 295 A T - 0 0 84 -2,-0.3 -1,-0.1 0, 0.0 39,-0.0 0.434 49.9 -99.4-124.0 -0.8 27.8 18.8 31.8 107 296 A N S S+ 0 0 100 38,-0.1 39,-0.6 1,-0.0 42,-0.1 0.292 120.5 45.2 89.0 -13.1 26.3 22.1 32.9 108 297 A G S S+ 0 0 52 37,-0.2 37,-0.5 38,-0.1 3,-0.4 0.551 100.9 60.7-126.2 -23.3 29.1 24.0 31.0 109 298 A N > + 0 0 43 1,-0.2 4,-2.8 2,-0.1 5,-0.2 0.189 67.1 107.5 -96.4 18.4 29.3 22.4 27.6 110 299 A Q H > S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.906 85.3 41.5 -65.8 -44.5 25.8 23.0 26.3 111 300 A L H > S+ 0 0 22 -3,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.896 114.3 53.9 -64.6 -39.3 26.8 25.6 23.8 112 301 A A H > S+ 0 0 63 -4,-0.3 4,-2.5 1,-0.2 -2,-0.2 0.911 107.9 48.4 -66.5 -45.0 29.8 23.6 22.8 113 302 A I H X S+ 0 0 9 -4,-2.8 4,-3.4 2,-0.2 -1,-0.2 0.936 112.1 48.9 -57.7 -45.9 27.9 20.4 22.0 114 303 A Q H X S+ 0 0 1 -4,-1.5 4,-2.7 1,-0.2 -2,-0.2 0.930 112.2 48.6 -66.0 -45.1 25.3 22.3 19.9 115 304 A N H X S+ 0 0 73 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.917 110.9 50.5 -59.2 -42.9 28.1 24.1 18.0 116 305 A D H X S+ 0 0 48 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.933 109.4 52.0 -60.7 -46.3 29.9 20.8 17.4 117 306 A L H X S+ 0 0 2 -4,-3.4 4,-2.9 1,-0.2 5,-0.2 0.955 111.0 46.6 -52.3 -51.7 26.6 19.3 16.1 118 307 A L H X S+ 0 0 7 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.846 113.4 48.1 -65.8 -37.7 26.1 22.2 13.7 119 308 A E H X S+ 0 0 115 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.902 112.7 50.0 -60.0 -45.6 29.7 22.0 12.4 120 309 A S H X S+ 0 0 18 -4,-2.8 4,-3.3 -5,-0.2 -2,-0.2 0.940 111.6 46.4 -64.0 -44.5 29.4 18.2 12.0 121 310 A L H X S+ 0 0 3 -4,-2.9 4,-2.7 1,-0.2 6,-0.3 0.923 107.4 58.2 -62.3 -45.6 26.2 18.5 10.1 122 311 A S H <>S+ 0 0 27 -4,-2.1 5,-3.6 -5,-0.2 4,-0.2 0.891 114.1 38.5 -49.3 -42.6 27.7 21.2 7.9 123 312 A K H ><5S+ 0 0 181 -4,-1.9 3,-1.5 3,-0.2 -2,-0.2 0.956 114.5 51.2 -75.3 -52.2 30.4 18.7 6.9 124 313 A A H 3<5S+ 0 0 33 -4,-3.3 -2,-0.2 1,-0.3 -3,-0.2 0.831 121.0 36.4 -56.3 -31.8 28.3 15.6 6.6 125 314 A L T 3<5S- 0 0 11 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.394 104.7-123.9 -99.5 -1.6 25.9 17.5 4.4 126 315 A N T < 5 + 0 0 143 -3,-1.5 -3,-0.2 -4,-0.2 -4,-0.1 0.954 65.6 143.5 54.4 49.3 28.4 19.6 2.5 127 316 A Q < - 0 0 26 -5,-3.6 -1,-0.2 -6,-0.3 2,-0.2 -0.857 39.3-156.6-126.0 94.0 26.4 22.5 3.7 128 317 A P - 0 0 89 0, 0.0 -9,-0.0 0, 0.0 -5,-0.0 -0.482 24.1-118.9 -66.9 142.3 28.3 25.6 4.7 129 318 A W - 0 0 33 -2,-0.2 -83,-0.1 1,-0.1 -87,-0.0 -0.733 31.0-123.8 -81.2 126.7 26.5 27.9 7.1 130 319 A P > - 0 0 46 0, 0.0 4,-2.5 0, 0.0 3,-0.3 -0.197 20.0-110.2 -66.3 154.0 25.8 31.4 5.6 131 320 A Q H > S+ 0 0 160 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.895 118.8 55.1 -49.5 -49.4 26.9 34.7 7.2 132 321 A R H > S+ 0 0 87 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.927 108.9 48.9 -55.8 -38.4 23.3 35.6 8.0 133 322 A M H > S+ 0 0 4 -3,-0.3 4,-2.6 2,-0.2 5,-0.2 0.972 112.5 46.7 -63.7 -51.3 23.0 32.3 9.9 134 323 A Q H X S+ 0 0 123 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.924 114.7 47.1 -59.8 -41.8 26.2 32.7 11.8 135 324 A E H X S+ 0 0 115 -4,-3.2 4,-1.4 -5,-0.2 -1,-0.2 0.823 110.1 53.5 -68.6 -30.7 25.3 36.3 12.7 136 325 A T H X S+ 0 0 23 -4,-2.2 4,-1.9 -5,-0.3 -2,-0.2 0.930 108.9 49.2 -67.1 -44.7 21.8 35.3 13.8 137 326 A L H X S+ 0 0 20 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.869 107.1 52.9 -65.3 -38.6 23.1 32.7 16.1 138 327 A Q H < S+ 0 0 134 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.880 113.3 47.3 -63.9 -34.5 25.6 35.0 17.8 139 328 A K H < S+ 0 0 68 -4,-1.4 46,-0.3 -5,-0.2 -2,-0.2 0.814 118.1 38.5 -70.7 -32.3 22.7 37.4 18.4 140 329 A I H < S+ 0 0 25 -4,-1.9 -2,-0.2 44,-0.1 -3,-0.2 0.705 100.4 83.4 -98.2 -16.4 20.3 34.7 19.8 141 330 A L < - 0 0 24 -4,-2.1 44,-0.1 -5,-0.2 2,-0.1 -0.622 66.9-137.8 -93.9 139.4 22.6 32.6 21.9 142 331 A P - 0 0 6 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.349 16.3-134.1 -74.5 174.5 23.8 33.2 25.4 143 332 A H S S+ 0 0 135 -2,-0.1 2,-0.4 1,-0.1 -32,-0.1 0.840 80.8 76.8-101.8 -34.6 27.5 32.5 26.2 144 333 A R S >> S- 0 0 137 1,-0.1 3,-1.0 -33,-0.1 4,-0.9 -0.622 78.6-133.0 -79.7 126.8 27.3 30.5 29.4 145 334 A G H >> S+ 0 0 5 -37,-0.5 4,-1.3 -2,-0.4 3,-1.2 0.851 102.1 52.9 -37.5 -55.2 26.2 26.8 29.0 146 335 A A H 3> S+ 0 0 16 -39,-0.6 4,-2.1 1,-0.3 -1,-0.2 0.774 100.5 60.6 -64.7 -30.7 23.6 26.8 31.8 147 336 A L H <> S+ 0 0 6 -3,-1.0 4,-3.0 1,-0.2 -1,-0.3 0.801 103.3 53.5 -63.9 -30.5 21.8 29.9 30.4 148 337 A L H S- 0 0 46 -5,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.203 71.9-102.6 -69.4 161.8 -1.2 26.1 26.7 163 352 A D H > S+ 0 0 67 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.865 120.3 45.1 -52.0 -48.7 -1.9 28.8 29.3 164 353 A K H > S+ 0 0 163 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.916 111.8 52.8 -69.9 -42.8 -0.0 27.2 32.1 165 354 A S H > S+ 0 0 14 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.941 111.5 46.8 -54.6 -49.5 3.0 26.4 29.9 166 355 A L H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.861 109.6 52.5 -62.3 -40.8 3.2 30.0 28.8 167 356 A N H X S+ 0 0 76 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.948 112.4 46.6 -60.9 -45.2 2.8 31.3 32.4 168 357 A R H X S+ 0 0 149 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.916 111.6 51.3 -59.0 -42.7 5.7 29.0 33.3 169 358 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.918 109.8 50.6 -60.2 -46.7 7.7 30.2 30.2 170 359 A S H X S+ 0 0 9 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.923 112.2 44.9 -57.8 -45.8 7.2 33.8 31.2 171 360 A E H X S+ 0 0 127 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.907 113.3 50.3 -71.3 -41.4 8.3 33.4 34.8 172 361 A L H X S+ 0 0 22 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.936 112.1 47.9 -58.8 -47.3 11.4 31.3 33.8 173 362 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.807 107.1 55.5 -67.9 -30.6 12.4 34.0 31.3 174 363 A G H X S+ 0 0 26 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.916 110.5 47.3 -64.8 -38.7 11.9 36.7 33.9 175 364 A E H X S+ 0 0 103 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.973 111.5 49.4 -63.4 -50.2 14.3 34.8 36.1 176 365 A I H X S+ 0 0 3 -4,-2.6 4,-1.8 1,-0.3 -2,-0.2 0.888 112.2 48.4 -56.0 -46.0 16.8 34.3 33.2 177 366 A V H < S+ 0 0 20 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.853 109.3 53.2 -66.2 -38.6 16.7 38.0 32.4 178 367 A Q H < S+ 0 0 160 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.920 113.8 41.9 -59.3 -46.2 17.2 39.0 36.0 179 368 A S H < S+ 0 0 76 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.746 132.0 23.1 -77.6 -22.0 20.3 36.9 36.4 180 369 A S >< + 0 0 11 -4,-1.8 3,-2.1 -5,-0.3 -1,-0.3 -0.551 63.8 171.9-143.9 77.6 21.7 37.9 33.0 181 370 A P T 3 S+ 0 0 73 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.634 77.5 65.0 -64.0 -15.3 20.3 41.2 31.7 182 371 A E T 3 S+ 0 0 140 1,-0.1 2,-2.4 2,-0.0 3,-0.2 0.597 75.1 96.3 -75.7 -15.7 22.7 41.3 28.8 183 372 A F X> + 0 0 12 -3,-2.1 3,-1.2 1,-0.2 4,-0.9 -0.480 53.8 173.7 -79.7 75.7 21.0 38.2 27.4 184 373 A T H >> + 0 0 14 -2,-2.4 4,-1.9 1,-0.3 3,-0.6 0.820 67.0 62.4 -57.7 -34.2 18.8 40.3 25.1 185 374 A Y H 3> S+ 0 0 23 -46,-0.3 4,-2.6 1,-0.3 -1,-0.3 0.771 97.5 57.8 -66.8 -30.2 17.2 37.4 23.3 186 375 A A H <> S+ 0 0 0 -3,-1.2 4,-2.1 2,-0.2 -1,-0.3 0.832 104.7 51.9 -62.9 -39.6 15.7 36.1 26.5 187 376 A R H X S+ 0 0 55 -4,-2.4 3,-1.6 1,-0.2 4,-1.3 0.985 114.5 45.9 -54.8 -56.7 -0.6 35.2 26.7 198 387 A H H 3< S+ 0 0 62 -4,-2.3 3,-0.4 1,-0.3 -1,-0.2 0.842 104.9 61.6 -57.0 -39.8 -2.3 38.5 26.6 199 388 A S H 3< S+ 0 0 12 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.751 108.7 43.7 -55.1 -28.7 -3.8 37.9 23.1 200 389 A Q H << S+ 0 0 41 -3,-1.6 -1,-0.2 -4,-1.0 -2,-0.2 0.696 124.1 32.8 -97.4 -23.7 -5.7 34.9 24.4 201 390 A H S >< S+ 0 0 84 -4,-1.3 3,-0.8 -3,-0.4 -1,-0.2 -0.532 73.6 167.7-126.8 63.3 -6.9 36.6 27.6 202 391 A P T 3 + 0 0 76 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.520 64.5 66.8 -65.6 -9.1 -7.3 40.2 26.3 203 392 A L T 3 S+ 0 0 180 -3,-0.1 2,-0.3 -5,-0.0 -5,-0.0 -0.137 81.1 100.5-100.1 37.7 -9.3 41.5 29.3 204 393 A D < - 0 0 112 -3,-0.8 2,-0.3 -6,-0.2 -3,-0.1 -0.943 45.7-171.5-124.1 146.4 -6.5 41.2 32.0 205 394 A E - 0 0 137 -2,-0.3 2,-0.6 3,-0.1 -2,-0.0 -0.959 13.6-153.8-144.0 124.7 -4.1 43.8 33.6 206 395 A K S S- 0 0 121 -2,-0.3 2,-4.8 1,-0.2 4,-0.2 -0.820 81.4 -46.4 -94.1 123.0 -1.0 43.6 35.9 207 396 A Q S S- 0 0 193 -2,-0.6 -1,-0.2 1,-0.1 -2,-0.0 0.439 112.5 -87.1 36.3 -12.7 -0.5 46.8 37.9 208 397 A L S S+ 0 0 92 -2,-4.8 -1,-0.1 0, 0.0 -3,-0.1 0.789 98.2 39.6 39.5 117.6 -1.1 48.2 34.5 209 398 A A + 0 0 65 -3,-0.1 -2,-0.1 0, 0.0 -4,-0.0 0.261 65.6 106.1-177.2 121.5 0.7 48.6 32.4 210 399 A A > + 0 0 39 -4,-0.2 4,-1.7 2,-0.2 5,-0.1 0.060 61.5 63.4 147.7 -99.2 3.0 46.7 31.8 211 400 A L H > S+ 0 0 23 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.870 106.5 60.3 -55.2 -42.3 3.1 44.4 28.8 212 401 A N H > S+ 0 0 102 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.809 102.7 49.6 -61.7 -31.9 3.1 47.6 26.8 213 402 A T H > S+ 0 0 93 2,-0.2 4,-3.7 3,-0.2 5,-0.2 0.989 112.1 47.9 -69.7 -56.8 6.3 48.8 28.4 214 403 A E H X S+ 0 0 41 -4,-1.7 4,-2.7 1,-0.2 -2,-0.2 0.871 117.0 42.1 -43.1 -51.1 8.0 45.4 27.7 215 404 A I H X S+ 0 0 16 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.878 114.1 51.8 -72.2 -40.1 6.8 45.4 24.1 216 405 A D H < S+ 0 0 112 -4,-2.3 4,-0.2 -5,-0.3 -2,-0.2 0.955 113.9 44.7 -59.2 -52.4 7.6 49.1 23.7 217 406 A N H >< S+ 0 0 80 -4,-3.7 3,-2.8 1,-0.2 4,-0.4 0.988 110.2 54.6 -49.3 -64.9 11.2 48.5 25.0 218 407 A I H >< S+ 0 0 5 -4,-2.7 3,-1.6 1,-0.3 6,-0.2 0.778 101.3 54.3 -47.7 -47.8 11.8 45.3 22.9 219 408 A V T 3< S+ 0 0 60 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.1 0.491 108.0 54.8 -70.0 2.4 11.1 46.7 19.4 220 409 A T T < S+ 0 0 97 -3,-2.8 -1,-0.3 -4,-0.2 -2,-0.2 0.476 74.2 109.8-109.6 -7.1 13.7 49.5 20.1 221 410 A L X - 0 0 33 -3,-1.6 3,-2.0 -4,-0.4 4,-0.2 -0.642 57.3-155.4 -77.9 115.8 16.7 47.3 21.0 222 411 A P G > S+ 0 0 92 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.803 89.7 69.6 -64.4 -27.6 19.1 47.8 18.1 223 412 A E G 3 S+ 0 0 102 1,-0.3 -2,-0.1 -3,-0.1 -38,-0.0 0.755 95.8 53.2 -56.1 -28.4 20.6 44.4 19.0 224 413 A L G X S+ 0 0 4 -3,-2.0 3,-1.4 -6,-0.2 6,-0.3 0.333 78.5 135.5 -98.4 5.7 17.4 42.6 17.8 225 414 A N T < S+ 0 0 93 -3,-1.6 3,-0.1 1,-0.3 -5,-0.0 -0.258 72.8 10.2 -45.8 135.4 17.4 44.3 14.4 226 415 A N T 3 S+ 0 0 98 1,-0.2 2,-0.4 2,-0.1 -1,-0.3 0.740 92.8 131.8 61.5 28.8 16.6 41.9 11.7 227 416 A L X> - 0 0 5 -3,-1.4 4,-0.9 1,-0.1 3,-0.8 -0.907 60.5-132.0-104.4 143.7 15.6 39.0 13.8 228 417 A S H >> S+ 0 0 7 -2,-0.4 4,-2.7 1,-0.2 3,-0.9 0.888 101.5 68.5 -57.1 -40.3 12.4 37.1 13.1 229 418 A I H 3> S+ 0 0 2 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.827 96.9 52.3 -55.4 -34.1 11.3 37.2 16.7 230 419 A I H <> S+ 0 0 9 -3,-0.8 4,-2.1 -6,-0.3 -1,-0.3 0.826 110.3 49.0 -68.7 -36.1 10.7 41.0 16.5 231 420 A Y H S+ 0 0 0 -4,-2.5 5,-3.1 2,-0.2 4,-0.2 0.871 111.6 52.0 -70.8 -32.9 -0.9 44.2 15.0 239 428 A L H ><5S+ 0 0 10 -4,-2.2 3,-2.3 3,-0.2 -2,-0.2 0.962 106.4 53.1 -66.8 -45.8 -3.3 41.3 14.9 240 429 A V H 3<5S+ 0 0 72 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.911 111.2 48.4 -52.0 -39.6 -4.5 42.0 18.5 241 430 A K T 3<5S- 0 0 135 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.450 116.3-115.8 -82.1 1.5 -5.2 45.6 17.3 242 431 A G T < 5S+ 0 0 48 -3,-2.3 2,-0.9 -4,-0.2 -3,-0.2 0.836 70.6 140.0 62.9 35.1 -7.1 44.4 14.2 243 432 A K >< + 0 0 104 -5,-3.1 4,-1.9 1,-0.2 -1,-0.2 -0.750 21.9 170.2-104.8 80.7 -4.5 45.9 12.0 244 433 A T H > + 0 0 31 -2,-0.9 4,-2.7 1,-0.2 -1,-0.2 0.853 68.0 51.6 -69.7 -41.7 -4.4 43.1 9.5 245 434 A D H > S+ 0 0 104 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.881 112.3 48.7 -59.7 -39.5 -2.3 44.6 6.7 246 435 A E H > S+ 0 0 93 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.845 111.9 49.1 -71.1 -34.7 0.4 45.5 9.2 247 436 A S H X S+ 0 0 0 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.918 110.0 51.7 -68.3 -44.6 0.3 42.1 10.7 248 437 A Y H X S+ 0 0 70 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.906 111.8 46.3 -54.7 -48.8 0.5 40.5 7.2 249 438 A Q H X S+ 0 0 120 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.911 112.6 50.3 -64.5 -46.3 3.6 42.6 6.3 250 439 A A H X S+ 0 0 10 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.939 111.4 45.8 -59.4 -49.1 5.2 41.9 9.6 251 440 A I H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.860 108.7 56.2 -69.4 -35.7 4.8 38.1 9.5 252 441 A N H X S+ 0 0 47 -4,-2.2 4,-1.7 -5,-0.2 -1,-0.2 0.855 108.3 47.5 -61.7 -37.7 5.9 37.9 5.8 253 442 A T H X S+ 0 0 55 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.890 110.4 54.2 -62.1 -41.3 9.2 39.6 6.8 254 443 A G H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.919 107.0 50.1 -57.5 -45.0 9.5 37.2 9.7 255 444 A I H < S+ 0 0 21 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.875 105.8 55.9 -64.5 -39.3 9.1 34.3 7.3 256 445 A D H < S+ 0 0 118 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.881 115.0 40.7 -55.7 -35.3 11.9 35.8 5.1 257 446 A L H < S+ 0 0 28 -4,-1.8 2,-0.3 1,-0.3 -2,-0.2 0.716 130.7 15.0 -87.0 -25.1 14.2 35.7 8.2 258 447 A E < - 0 0 43 -4,-1.8 2,-1.2 -5,-0.1 -1,-0.3 -0.885 59.7-150.2-156.0 116.5 13.2 32.4 9.7 259 448 A M + 0 0 52 -219,-0.5 2,-0.3 -2,-0.3 -215,-0.1 -0.739 46.2 150.8 -88.6 90.7 11.2 29.4 8.1 260 449 A S > - 0 0 2 -2,-1.2 4,-1.9 1,-0.1 5,-0.2 -0.910 62.2-116.9-129.7 154.7 9.6 28.0 11.2 261 450 A W H > S+ 0 0 10 -2,-0.3 4,-1.4 1,-0.2 5,-0.1 0.877 116.5 51.7 -50.7 -41.9 6.4 26.1 12.2 262 451 A L H > S+ 0 0 10 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.888 104.1 53.5 -71.3 -41.1 5.5 29.2 14.3 263 452 A N H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.884 109.9 49.6 -60.2 -33.4 5.8 31.8 11.6 264 453 A Y H X S+ 0 0 46 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.845 110.1 50.2 -79.4 -27.2 3.5 29.7 9.4 265 454 A V H X S+ 0 0 0 -4,-1.4 4,-2.7 2,-0.2 -2,-0.2 0.911 110.6 49.7 -67.3 -47.7 0.9 29.4 12.2 266 455 A L H X S+ 0 0 4 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.909 111.1 49.4 -59.9 -42.9 1.1 33.1 12.7 267 456 A L H X S+ 0 0 11 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.910 109.0 52.2 -59.7 -46.0 0.6 33.6 8.9 268 457 A G H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.938 108.4 53.1 -52.0 -44.5 -2.4 31.2 9.0 269 458 A K H X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.3 -2,-0.2 0.905 109.3 47.0 -61.4 -42.2 -3.8 33.3 11.8 270 459 A V H X S+ 0 0 1 -4,-2.1 4,-1.4 1,-0.2 -1,-0.3 0.858 107.9 56.4 -67.1 -40.7 -3.5 36.5 9.8 271 460 A Y H <>S+ 0 0 35 -4,-2.6 5,-3.1 2,-0.2 -1,-0.2 0.851 105.3 51.4 -57.9 -34.7 -5.0 34.8 6.8 272 461 A E H ><5S+ 0 0 34 -4,-1.8 3,-2.1 1,-0.2 -2,-0.2 0.925 108.4 51.8 -70.3 -38.5 -8.1 34.0 8.9 273 462 A M H 3<5S+ 0 0 83 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.790 105.6 56.1 -67.4 -23.1 -8.3 37.6 9.9 274 463 A K T 3<5S- 0 0 68 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.431 119.8-112.5 -83.7 3.4 -8.2 38.4 6.2 275 464 A G T < 5S+ 0 0 47 -3,-2.1 2,-0.5 1,-0.1 -3,-0.2 0.757 80.9 126.9 69.2 29.6 -11.2 36.2 5.6 276 465 A M >< + 0 0 55 -5,-3.1 4,-2.1 1,-0.2 -1,-0.1 -0.669 24.6 164.8-122.3 77.1 -9.0 33.8 3.6 277 466 A N H > S+ 0 0 63 -2,-0.5 4,-2.7 1,-0.2 5,-0.2 0.783 73.8 54.3 -65.9 -31.5 -9.5 30.3 5.1 278 467 A R H > S+ 0 0 168 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.927 110.7 45.9 -73.3 -39.7 -8.0 28.4 2.2 279 468 A E H > S+ 0 0 67 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.888 113.7 53.1 -65.4 -34.0 -4.7 30.4 2.4 280 469 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.946 107.5 47.7 -66.0 -50.9 -4.9 29.9 6.2 281 470 A A H X S+ 0 0 20 -4,-2.7 4,-1.9 31,-0.3 -1,-0.2 0.789 110.1 54.3 -60.9 -35.7 -5.3 26.1 6.0 282 471 A N H X S+ 0 0 107 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.915 109.3 46.9 -63.2 -44.7 -2.3 26.0 3.6 283 472 A A H X S+ 0 0 2 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.914 112.5 50.5 -59.9 -44.7 -0.1 27.9 6.0 284 473 A Y H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.864 109.5 50.3 -63.6 -38.5 -1.2 25.6 8.9 285 474 A L H X S+ 0 0 45 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.869 108.4 52.5 -69.7 -36.6 -0.5 22.6 6.9 286 475 A T H X S+ 0 0 36 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.952 109.4 50.8 -57.6 -48.6 3.0 24.0 6.1 287 476 A A H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.881 109.2 50.6 -53.6 -38.9 3.4 24.5 9.9 288 477 A F H < S+ 0 0 9 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.835 107.9 51.8 -74.6 -33.0 2.4 20.9 10.4 289 478 A N H < S+ 0 0 78 -4,-1.9 -1,-0.2 -3,-0.2 -2,-0.2 0.879 110.4 50.1 -66.8 -36.7 4.9 19.6 7.9 290 479 A L H < S+ 0 0 14 -4,-2.1 -238,-3.0 1,-0.2 -2,-0.2 0.882 135.7 3.2 -68.8 -41.6 7.7 21.6 9.6 291 480 A R S < S- 0 0 2 -4,-2.0 5,-0.4 -240,-0.2 -1,-0.2 -0.583 80.4-164.7-144.6 78.0 6.9 20.3 13.1 292 481 A P + 0 0 5 0, 0.0 -237,-0.3 0, 0.0 2,-0.2 -0.313 42.9 62.3 -70.5 151.3 4.1 17.7 13.1 293 482 A G S > S- 0 0 9 1,-0.1 4,-2.6 -237,-0.1 5,-0.2 -0.779 95.3 -45.5 133.1-173.5 2.5 16.8 16.5 294 483 A A H > S+ 0 0 66 -239,-0.7 4,-3.4 -2,-0.2 5,-0.2 0.823 122.5 56.5 -68.6 -36.2 0.4 18.0 19.4 295 484 A N H > S+ 0 0 8 -240,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.965 114.1 37.6 -59.8 -54.2 2.4 21.2 20.0 296 485 A T H > S+ 0 0 0 -5,-0.4 4,-2.7 2,-0.2 -2,-0.2 0.945 118.2 51.2 -66.2 -46.9 1.9 22.6 16.5 297 486 A L H X S+ 0 0 36 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.931 109.2 52.1 -50.2 -48.9 -1.7 21.2 16.5 298 487 A Y H X S+ 0 0 77 -4,-3.4 4,-1.6 1,-0.2 5,-0.3 0.879 110.3 47.6 -55.5 -40.9 -2.3 22.9 19.7 299 488 A W H X S+ 0 0 2 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.857 110.2 51.6 -71.8 -36.8 -1.0 26.2 18.3 300 489 A I H < S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.975 117.0 40.2 -61.6 -47.1 -3.2 25.9 15.1 301 490 A E H < S+ 0 0 64 -4,-2.5 6,-2.2 -5,-0.2 -2,-0.2 0.718 135.5 12.9 -75.4 -25.1 -6.3 25.3 17.3 302 491 A N H < S+ 0 0 44 -4,-1.6 2,-0.2 4,-0.2 -3,-0.2 0.577 83.4 121.3-129.1 -17.1 -5.6 27.8 20.0 303 492 A G S < S- 0 0 2 -4,-2.2 2,-2.4 -5,-0.3 -141,-0.0 -0.395 95.1 -20.2 -72.9 131.2 -2.9 30.3 19.3 304 493 A I S S+ 0 0 9 -108,-0.2 2,-0.3 -2,-0.2 -1,-0.2 -0.337 141.3 0.0 76.5 -56.8 -3.8 34.0 19.4 305 494 A F S S- 0 0 60 -2,-2.4 2,-0.1 -105,-0.0 -105,-0.1 -0.949 94.7 -80.0-150.1 166.9 -7.5 33.0 18.9 306 495 A Q - 0 0 160 -2,-0.3 2,-0.4 -106,-0.1 -4,-0.2 -0.418 40.4-171.4 -77.4 146.2 -9.4 29.7 18.5 307 496 A T - 0 0 5 -6,-2.2 2,-0.8 -2,-0.1 -4,-0.1 -0.995 20.7-132.7-141.0 126.3 -9.5 27.9 15.2 308 497 A S >> - 0 0 43 -2,-0.4 4,-2.7 1,-0.2 5,-0.6 -0.694 11.5-166.4 -80.3 116.7 -11.6 24.9 14.2 309 498 A V H >5S+ 0 0 3 -2,-0.8 4,-1.9 3,-0.2 8,-0.4 0.964 89.5 54.2 -66.8 -46.7 -9.5 22.4 12.5 310 499 A P H 45S+ 0 0 73 0, 0.0 -1,-0.2 0, 0.0 8,-0.1 0.908 122.0 28.3 -53.0 -43.9 -12.6 20.5 11.3 311 500 A Y H 45S+ 0 0 207 2,-0.1 -2,-0.2 1,-0.1 -4,-0.0 0.845 133.7 29.7 -85.3 -37.0 -14.1 23.7 9.7 312 501 A V H <5S+ 0 0 17 -4,-2.7 -31,-0.3 1,-0.2 -3,-0.2 0.831 129.6 32.2 -96.6 -30.8 -11.0 25.7 8.8 313 502 A V >X< + 0 0 2 -4,-1.9 4,-2.5 -5,-0.6 3,-0.5 -0.527 65.5 157.9-122.6 57.9 -8.3 23.0 8.1 314 503 A P H 3> S+ 0 0 78 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.856 73.1 58.5 -55.4 -33.0 -10.4 20.0 6.7 315 504 A Y H 3> S+ 0 0 135 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.924 112.2 39.7 -62.9 -39.7 -7.3 18.5 5.0 316 505 A L H <> S+ 0 0 0 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.855 112.2 55.5 -78.6 -34.9 -5.6 18.3 8.3 317 506 A D H X S+ 0 0 67 -4,-2.5 4,-1.2 -8,-0.4 -2,-0.2 0.958 114.0 41.8 -58.4 -49.9 -8.7 17.2 10.2 318 507 A K H < S+ 0 0 156 -4,-2.5 4,-0.2 2,-0.2 -2,-0.2 0.827 112.1 54.5 -66.6 -39.0 -9.1 14.3 7.8 319 508 A F H >< S+ 0 0 55 -4,-2.0 3,-1.5 -5,-0.3 -1,-0.2 0.930 108.6 48.3 -60.0 -48.9 -5.4 13.4 7.7 320 509 A L H 3< S+ 0 0 69 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.794 109.5 53.7 -66.8 -26.9 -5.2 13.1 11.5 321 510 A A T 3< 0 0 89 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.453 360.0 360.0 -80.7 1.7 -8.4 10.9 11.5 322 511 A S < 0 0 127 -3,-1.5 -3,-0.1 -4,-0.2 -4,-0.0 -0.230 360.0 360.0-113.3 360.0 -6.9 8.4 8.9