==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/TRANSCRIPTION AGONIST 18-MAR-11 3R5M . COMPND 2 MOLECULE: RETINOIC ACID RECEPTOR RXR-ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.ZHANG,L.CHEN,J.CHEN,L.HU,H.JIANG,X.SHEN . 448 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19929.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 326 72.8 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 . 9 2.0 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 . 2 0.4 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 . 9 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 250 55.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.2 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 0 3 4 2 1 0 3 1 2 0 0 0 0 0 0 0 1 3 2 2 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 . 0 0 1 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 . 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 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 1 227 A N 0 0 84 0, 0.0 5,-0.1 0, 0.0 156,-0.0 0.000 360.0 360.0 360.0 -14.5 -4.6 37.5 4.4 2 228 A E + 0 0 198 1,-0.2 0, 0.0 2,-0.1 0, 0.0 0.921 360.0 35.4 -72.0 -44.0 -6.5 37.2 1.1 3 229 A D S S+ 0 0 93 1,-0.3 -1,-0.2 150,-0.0 150,-0.0 0.810 135.2 24.3 -79.4 -33.8 -3.5 35.7 -0.8 4 230 A M S S- 0 0 1 149,-0.2 -1,-0.3 42,-0.0 2,-0.2 -0.765 85.5-158.7-133.9 86.8 -2.3 33.6 2.1 5 231 A P > - 0 0 19 0, 0.0 4,-1.1 0, 0.0 3,-0.4 -0.442 17.8-147.1 -75.7 136.9 -5.1 32.9 4.6 6 232 A V H > S+ 0 0 11 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.639 98.9 63.4 -71.9 -17.3 -4.5 32.0 8.2 7 233 A E H > S+ 0 0 120 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.845 106.3 42.8 -73.3 -34.7 -7.6 29.8 8.2 8 234 A R H > S+ 0 0 135 -3,-0.4 4,-1.1 2,-0.2 -2,-0.2 0.706 109.2 57.4 -84.5 -24.7 -6.1 27.5 5.5 9 235 A I H X S+ 0 0 0 -4,-1.1 4,-1.1 2,-0.2 3,-0.2 0.905 110.0 45.2 -68.6 -43.8 -2.7 27.5 7.2 10 236 A L H X S+ 0 0 44 -4,-1.5 4,-3.4 1,-0.2 3,-0.5 0.891 107.3 59.0 -61.5 -42.9 -4.5 26.1 10.3 11 237 A E H X S+ 0 0 111 -4,-1.4 4,-1.3 1,-0.3 -1,-0.2 0.792 102.8 52.9 -61.0 -30.3 -6.4 23.7 8.2 12 238 A A H X S+ 0 0 0 -4,-1.1 4,-0.7 -3,-0.2 -1,-0.3 0.809 112.3 45.1 -72.8 -32.8 -3.1 22.2 7.0 13 239 A E H >< S+ 0 0 9 -4,-1.1 3,-0.7 -3,-0.5 4,-0.3 0.929 116.0 45.2 -70.7 -48.5 -2.1 21.8 10.6 14 240 A L H 3< S+ 0 0 80 -4,-3.4 3,-0.3 1,-0.2 -2,-0.2 0.715 107.9 59.9 -70.8 -21.1 -5.5 20.3 11.6 15 241 A A H 3< S+ 0 0 52 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.793 110.7 40.3 -71.6 -28.8 -5.5 18.1 8.5 16 242 A V S << S+ 0 0 24 -3,-0.7 -2,-0.2 -4,-0.7 -1,-0.2 0.262 78.0 139.1-110.7 9.3 -2.3 16.4 9.7 17 243 A E 0 0 89 -4,-0.3 -3,-0.0 -3,-0.3 -4,-0.0 -0.327 360.0 360.0 -53.8 131.0 -3.0 16.0 13.4 18 244 A P 0 0 106 0, 0.0 -1,-0.1 0, 0.0 67,-0.0 0.985 360.0 360.0 -65.8 360.0 -1.8 12.6 14.6 19 ! 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 20 262 A N 0 0 183 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -11.2 12.5 0.8 23.1 21 263 A D > - 0 0 65 1,-0.1 4,-2.0 2,-0.0 3,-0.3 -0.700 360.0-134.4 -68.9 121.5 15.7 3.0 22.8 22 264 A P H > S+ 0 0 21 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.880 105.5 52.2 -50.1 -43.3 14.2 6.5 23.0 23 265 A V H > S+ 0 0 6 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.909 105.6 54.2 -59.1 -46.1 16.3 7.6 20.0 24 266 A T H > S+ 0 0 18 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.887 110.2 48.2 -52.5 -44.2 15.0 4.6 17.9 25 267 A N H X S+ 0 0 37 -4,-2.0 4,-3.0 2,-0.2 -2,-0.2 0.932 109.5 52.6 -59.9 -46.9 11.5 5.8 18.7 26 268 A I H X S+ 0 0 48 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.854 111.0 46.7 -62.4 -39.0 12.4 9.4 17.8 27 269 A C H X S+ 0 0 2 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.944 111.6 49.3 -66.5 -51.0 13.7 8.3 14.4 28 270 A Q H X S+ 0 0 95 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.934 113.1 49.1 -53.8 -48.1 10.7 6.0 13.6 29 271 A A H X S+ 0 0 4 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.925 108.6 52.6 -53.2 -48.9 8.5 9.0 14.5 30 272 A A H X S+ 0 0 18 -4,-2.2 4,-0.8 1,-0.2 -2,-0.2 0.857 110.9 48.6 -57.4 -36.7 10.7 11.3 12.3 31 273 A D H X S+ 0 0 20 -4,-2.3 4,-1.1 2,-0.2 3,-0.4 0.892 111.5 46.4 -71.4 -45.9 10.1 8.8 9.4 32 274 A K H X S+ 0 0 109 -4,-2.5 4,-1.2 1,-0.2 3,-0.3 0.903 113.5 53.5 -58.5 -38.8 6.3 8.5 9.9 33 275 A Q H X S+ 0 0 26 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.640 96.9 63.0 -80.3 -16.0 6.3 12.3 10.1 34 276 A L H X S+ 0 0 2 -4,-0.8 4,-1.3 -3,-0.4 -1,-0.2 0.912 102.3 50.0 -71.4 -42.8 8.2 13.0 6.9 35 277 A F H X S+ 0 0 71 -4,-1.1 4,-1.0 -3,-0.3 3,-0.4 0.934 114.9 45.0 -57.8 -47.3 5.4 11.4 4.8 36 278 A T H >X S+ 0 0 38 -4,-1.2 4,-2.7 1,-0.2 3,-0.6 0.910 103.3 62.7 -63.4 -47.5 2.8 13.5 6.6 37 279 A L H 3X S+ 0 0 4 -4,-2.1 4,-2.6 1,-0.3 -1,-0.2 0.818 99.0 58.1 -47.1 -36.7 4.9 16.7 6.3 38 280 A V H 3X S+ 0 0 3 -4,-1.3 4,-2.5 -3,-0.4 -1,-0.3 0.917 107.9 44.5 -64.2 -45.7 4.5 16.4 2.5 39 281 A E H < S+ 0 0 1 -4,-2.7 3,-0.7 1,-0.2 -2,-0.2 0.914 111.9 44.4 -48.6 -50.2 0.9 19.4 5.3 41 283 A A H >< S+ 0 0 0 -4,-2.6 3,-2.6 1,-0.3 6,-0.3 0.921 107.3 58.3 -62.7 -46.3 3.0 21.3 2.8 42 284 A K H 3< S+ 0 0 49 -4,-2.5 6,-0.3 1,-0.3 -1,-0.3 0.727 106.8 51.1 -54.1 -24.7 0.8 20.4 -0.1 43 285 A R T << S+ 0 0 124 -4,-1.5 -1,-0.3 -3,-0.7 -2,-0.2 0.425 85.3 101.7 -94.7 0.1 -2.0 22.1 1.9 44 286 A I S X S- 0 0 2 -3,-2.6 3,-2.5 -5,-0.2 4,-0.3 -0.784 92.5 -96.4 -86.0 118.7 0.0 25.2 2.5 45 287 A P T 3 S+ 0 0 4 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.006 101.8 0.8 -43.0 124.5 -1.3 27.8 0.1 46 288 A H T 3 S+ 0 0 45 -4,-0.1 4,-0.5 1,-0.0 -4,-0.1 0.377 95.6 115.1 81.4 0.3 0.7 28.1 -3.2 47 289 A F S X S+ 0 0 0 -3,-2.5 3,-1.9 -6,-0.3 -5,-0.1 0.980 76.4 46.8 -63.7 -56.5 3.2 25.4 -2.2 48 290 A S T 3 S+ 0 0 62 -4,-0.3 -1,-0.2 -6,-0.3 7,-0.1 0.805 102.1 67.0 -52.1 -36.8 2.1 22.9 -5.0 49 291 A E T 3 S+ 0 0 154 2,-0.1 -1,-0.3 3,-0.0 -2,-0.2 0.631 83.3 95.3 -63.9 -17.7 2.2 25.7 -7.6 50 292 A L S < S- 0 0 5 -3,-1.9 5,-0.1 -4,-0.5 -4,-0.0 -0.391 97.5 -80.6 -71.4 153.2 6.0 26.0 -7.2 51 293 A P >> - 0 0 56 0, 0.0 4,-1.6 0, 0.0 3,-1.5 -0.344 43.8-118.7 -55.8 133.4 8.4 24.1 -9.6 52 294 A L H 3> S+ 0 0 67 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.782 112.9 54.9 -46.9 -39.7 8.6 20.5 -8.4 53 295 A D H 3> S+ 0 0 110 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.848 105.8 51.8 -63.2 -37.5 12.4 20.8 -7.8 54 296 A D H <> S+ 0 0 3 -3,-1.5 4,-2.8 2,-0.2 5,-0.2 0.860 106.0 54.1 -69.4 -38.0 11.9 23.8 -5.5 55 297 A Q H X S+ 0 0 10 -4,-1.6 4,-1.9 2,-0.2 5,-0.2 0.929 110.6 48.2 -54.4 -47.7 9.3 21.8 -3.4 56 298 A V H X S+ 0 0 7 -4,-1.8 4,-2.6 -5,-0.2 -2,-0.2 0.949 113.1 47.1 -58.8 -51.2 12.0 19.1 -3.1 57 299 A I H X S+ 0 0 39 -4,-2.4 4,-1.8 2,-0.2 5,-0.2 0.941 110.3 50.6 -57.6 -55.4 14.7 21.7 -2.0 58 300 A L H X S+ 0 0 1 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.873 115.8 42.8 -52.0 -45.0 12.5 23.5 0.5 59 301 A L H X S+ 0 0 2 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.829 110.7 54.2 -73.5 -34.8 11.5 20.3 2.2 60 302 A R H < S+ 0 0 44 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.787 118.9 38.3 -65.6 -25.7 15.1 18.8 2.0 61 303 A A H < S+ 0 0 45 -4,-1.8 3,-0.3 -5,-0.2 4,-0.3 0.844 124.1 35.8 -89.4 -40.3 16.1 22.1 3.8 62 304 A G H >X S+ 0 0 2 -4,-2.8 4,-2.5 -5,-0.2 3,-0.8 0.731 81.9 97.9 -94.5 -17.7 13.2 22.6 6.2 63 305 A W H 3X S+ 0 0 9 -4,-1.9 4,-2.2 1,-0.3 5,-0.2 0.694 83.7 54.6 -53.3 -32.7 12.2 19.2 7.4 64 306 A N H 3> S+ 0 0 12 -3,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.958 112.3 35.9 -64.8 -49.6 14.1 19.4 10.5 65 307 A E H <> S+ 0 0 16 -3,-0.8 4,-2.4 -4,-0.3 -2,-0.2 0.833 117.7 58.3 -71.7 -33.2 12.9 22.6 12.1 66 308 A L H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.944 109.6 38.6 -60.5 -54.2 9.6 21.7 10.7 67 309 A L H X S+ 0 0 18 -4,-2.2 4,-2.1 -5,-0.2 5,-0.2 0.882 118.5 50.3 -65.1 -39.2 9.2 18.3 12.5 68 310 A I H X S+ 0 0 8 -4,-1.9 4,-1.6 -5,-0.2 -2,-0.2 0.868 107.8 53.3 -69.1 -38.0 10.8 19.7 15.6 69 311 A A H X S+ 0 0 6 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.933 110.2 47.8 -61.2 -46.8 8.5 22.7 15.7 70 312 A S H X S+ 0 0 19 -4,-1.8 4,-1.7 1,-0.2 -2,-0.2 0.940 113.5 44.0 -63.6 -50.4 5.4 20.5 15.5 71 313 A F H X S+ 0 0 34 -4,-2.1 4,-0.7 2,-0.2 12,-0.5 0.781 110.2 57.4 -69.3 -23.8 6.4 18.0 18.3 72 314 A S H >< S+ 0 0 0 -4,-1.6 3,-0.6 2,-0.2 -1,-0.2 0.936 111.0 41.8 -66.8 -48.4 7.5 20.9 20.5 73 315 A H H >< S+ 0 0 21 -4,-1.9 3,-0.9 1,-0.2 4,-0.2 0.784 111.3 57.5 -65.8 -30.1 4.1 22.5 20.4 74 316 A R H 3< S+ 0 0 48 -4,-1.7 3,-0.5 1,-0.2 -1,-0.2 0.732 102.3 58.4 -69.1 -21.9 2.6 19.0 20.7 75 317 A S T X< S+ 0 0 0 -4,-0.7 3,-0.8 -3,-0.6 6,-0.3 0.323 72.4 94.6 -97.8 4.9 4.5 18.7 24.0 76 318 A I T < S+ 0 0 54 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.1 0.827 83.3 57.5 -62.5 -31.7 3.1 21.7 25.9 77 319 A A T 3 S+ 0 0 97 -3,-0.5 2,-0.3 -4,-0.2 -1,-0.2 0.675 97.5 75.2 -73.7 -18.1 0.5 19.4 27.5 78 320 A V S < S- 0 0 27 -3,-0.8 3,-0.1 3,-0.2 5,-0.1 -0.735 72.4-145.2-101.5 149.0 3.3 17.1 28.9 79 321 A K S S+ 0 0 171 -2,-0.3 -1,-0.1 1,-0.2 -4,-0.0 0.895 84.1 3.5 -87.0 -44.5 5.4 18.1 31.9 80 322 A D S S+ 0 0 55 2,-0.0 12,-2.8 0, 0.0 13,-0.3 -0.208 120.8 31.1-140.5 53.7 9.0 16.7 31.3 81 323 A G E S-A 91 0A 5 10,-0.3 2,-0.4 -6,-0.3 10,-0.3 -0.916 78.8 -83.3-172.1-165.0 9.1 15.1 27.9 82 324 A I E -A 90 0A 3 8,-1.9 8,-2.3 -2,-0.3 2,-0.7 -0.962 22.6-131.5-124.9 145.9 7.8 15.1 24.4 83 325 A L E -A 89 0A 44 -12,-0.5 2,-0.3 -2,-0.4 6,-0.2 -0.859 27.7-151.7 -88.8 117.0 4.7 13.7 22.8 84 326 A L E >> -A 88 0A 6 4,-3.5 3,-2.3 -2,-0.7 4,-0.8 -0.665 24.0-116.6 -86.2 148.9 5.8 11.9 19.6 85 327 A A T 34 S+ 0 0 10 1,-0.3 -1,-0.1 -2,-0.3 -2,-0.0 0.775 111.6 70.4 -53.8 -28.5 3.3 11.7 16.7 86 328 A T T 34 S- 0 0 67 -61,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.534 122.2-102.0 -68.8 -6.8 3.3 7.9 17.2 87 329 A G T <4 S+ 0 0 59 -3,-2.3 2,-0.3 1,-0.3 -2,-0.2 0.804 85.1 124.0 82.8 34.5 1.4 8.3 20.5 88 330 A L E < -A 84 0A 57 -4,-0.8 -4,-3.5 -63,-0.0 2,-0.4 -0.932 51.5-141.1-123.3 150.5 4.5 7.7 22.6 89 331 A H E -A 83 0A 114 -2,-0.3 2,-0.6 -6,-0.2 -6,-0.2 -0.916 4.2-156.5-112.6 137.7 6.0 10.0 25.2 90 332 A V E -A 82 0A 3 -8,-2.3 -8,-1.9 -2,-0.4 2,-0.2 -0.953 12.3-154.0-112.8 111.0 9.7 10.6 25.8 91 333 A H E >> -A 81 0A 88 -2,-0.6 4,-1.9 -10,-0.3 3,-0.5 -0.536 26.7-116.6 -78.2 150.5 10.6 11.7 29.3 92 334 A R H 3> S+ 0 0 83 -12,-2.8 4,-2.6 1,-0.2 5,-0.1 0.735 115.2 59.0 -62.5 -23.1 13.8 13.7 29.8 93 335 A N H 3> S+ 0 0 92 -13,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.886 104.0 49.3 -70.9 -41.6 15.3 10.9 31.9 94 336 A S H <4 S+ 0 0 52 -3,-0.5 -2,-0.2 2,-0.2 6,-0.2 0.925 113.0 50.3 -56.9 -45.8 14.9 8.4 29.1 95 337 A A H ><>S+ 0 0 1 -4,-1.9 3,-1.4 2,-0.2 5,-1.3 0.925 112.4 43.8 -57.8 -52.2 16.6 11.1 26.9 96 338 A H H ><5S+ 0 0 124 -4,-2.6 3,-2.3 4,-0.3 5,-0.4 0.945 111.2 54.8 -59.7 -48.5 19.5 11.6 29.4 97 339 A S T 3<5S+ 0 0 106 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.362 108.4 52.5 -66.4 4.7 19.8 7.8 29.8 98 340 A A T < 5S- 0 0 32 -3,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.416 117.4-111.8-114.5 -6.4 20.1 7.7 26.0 99 341 A G T < 5S+ 0 0 63 -3,-2.3 3,-0.4 -4,-0.3 -3,-0.2 0.144 99.8 98.5 90.0 -17.1 23.0 10.3 25.8 100 342 A V >< + 0 0 13 -5,-1.3 4,-1.9 -6,-0.2 -4,-0.3 0.084 44.7 117.4 -89.0 26.2 20.6 12.8 24.1 101 343 A G H > S+ 0 0 3 -6,-0.5 4,-2.0 -5,-0.4 -5,-0.2 0.911 70.5 48.6 -58.3 -50.7 20.0 14.6 27.4 102 344 A A H > S+ 0 0 77 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.920 113.7 43.4 -59.1 -51.4 21.5 18.0 26.5 103 345 A I H > S+ 0 0 18 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.887 114.0 51.9 -67.3 -37.5 19.7 18.4 23.1 104 346 A F H X S+ 0 0 12 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.868 109.8 50.0 -61.2 -39.6 16.4 17.2 24.6 105 347 A D H X S+ 0 0 40 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.839 107.5 53.1 -69.8 -33.1 17.0 19.8 27.4 106 348 A R H X S+ 0 0 51 -4,-2.1 4,-1.1 2,-0.2 5,-0.5 0.852 110.3 48.7 -65.7 -35.1 17.6 22.4 24.6 107 349 A V H X>S+ 0 0 6 -4,-2.1 5,-2.2 3,-0.2 4,-0.6 0.838 113.7 46.7 -70.8 -33.6 14.2 21.2 23.2 108 350 A L H <>S+ 0 0 17 -4,-2.0 5,-2.1 3,-0.2 -2,-0.2 0.949 121.7 33.4 -74.3 -45.2 12.6 21.5 26.6 109 351 A T H <>S+ 0 0 67 -4,-2.7 5,-0.5 3,-0.1 -3,-0.2 0.996 125.4 35.1 -70.3 -67.7 14.0 25.0 27.6 110 352 A E H <5S+ 0 0 7 -4,-1.1 -3,-0.2 -5,-0.3 -1,-0.1 0.729 132.1 16.1 -65.1 -30.1 14.2 26.9 24.3 111 353 A L T X5S+ 0 0 2 -4,-0.6 4,-2.2 -5,-0.5 -3,-0.2 0.852 122.7 37.7-113.9 -64.1 11.1 25.5 22.5 112 354 A V H >S+ 0 0 8 -4,-2.2 5,-2.4 1,-0.2 3,-0.3 0.830 114.4 43.5 -58.5 -33.8 5.5 27.8 23.4 116 358 A R H ><5S+ 0 0 81 -4,-1.7 3,-1.4 3,-0.2 -2,-0.2 0.897 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0.5 137 379 A D T 3 S+ 0 0 20 2,-0.1 3,-0.1 3,-0.0 199,-0.1 0.709 71.2 118.5 -74.0 -23.5 18.2 30.9 1.7 138 380 A S X - 0 0 12 -3,-1.5 3,-1.0 1,-0.1 2,-0.3 -0.187 69.5-119.8 -57.9 132.6 17.8 27.4 0.6 139 381 A K T 3 S+ 0 0 151 1,-0.2 -1,-0.1 -82,-0.1 -2,-0.1 -0.513 88.2 28.7 -82.3 134.6 20.4 26.6 -2.0 140 382 A G T 3 S+ 0 0 65 1,-0.3 -1,-0.2 -2,-0.3 -2,-0.1 0.241 74.4 151.8 108.3 -13.3 19.5 25.6 -5.4 141 383 A L < - 0 0 16 -3,-1.0 -1,-0.3 1,-0.1 -87,-0.0 -0.182 42.4-144.5 -54.2 138.7 16.1 27.3 -5.7 142 384 A S S S+ 0 0 84 1,-0.3 -1,-0.1 -91,-0.1 -2,-0.0 0.884 96.0 14.2 -70.9 -39.5 15.1 28.3 -9.3 143 385 A N >> + 0 0 70 1,-0.1 4,-1.1 2,-0.0 3,-0.5 -0.731 64.4 175.2-138.2 86.5 13.4 31.5 -8.0 144 386 A P H 3> S+ 0 0 58 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.794 81.0 63.2 -60.0 -30.1 14.3 32.4 -4.4 145 387 A A H 3> S+ 0 0 62 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.877 99.1 52.0 -61.8 -43.0 12.3 35.7 -4.8 146 388 A E H <> S+ 0 0 90 -3,-0.5 4,-1.2 2,-0.2 -1,-0.2 0.842 110.7 48.8 -62.2 -36.9 9.0 33.8 -5.3 147 389 A V H X S+ 0 0 0 -4,-1.1 4,-1.6 2,-0.2 -2,-0.2 0.874 111.7 49.6 -66.3 -40.2 9.8 31.8 -2.1 148 390 A E H X S+ 0 0 30 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.807 106.2 56.1 -68.7 -32.3 10.5 35.2 -0.4 149 391 A A H X S+ 0 0 37 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.832 110.6 44.2 -68.0 -33.7 7.3 36.6 -1.6 150 392 A L H X S+ 0 0 9 -4,-1.2 4,-2.2 2,-0.2 -2,-0.2 0.731 109.3 56.0 -84.3 -25.8 5.4 33.8 0.0 151 393 A R H X S+ 0 0 11 -4,-1.6 4,-2.4 2,-0.2 5,-0.3 0.970 109.2 48.0 -61.9 -53.8 7.5 34.2 3.2 152 394 A E H X S+ 0 0 72 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.914 111.3 50.4 -48.2 -51.1 6.3 37.8 3.2 153 395 A K H X S+ 0 0 73 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.895 110.5 49.2 -59.1 -43.5 2.7 36.7 2.7 154 396 A V H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.907 116.0 41.2 -63.0 -43.9 2.9 34.1 5.5 155 397 A Y H X S+ 0 0 6 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.698 111.3 56.0 -83.2 -17.5 4.3 36.6 8.1 156 398 A A H X S+ 0 0 53 -4,-2.1 4,-2.2 -5,-0.3 -2,-0.2 0.931 112.4 43.7 -69.6 -47.0 2.1 39.5 6.9 157 399 A S H X S+ 0 0 2 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.871 113.2 51.5 -62.3 -41.4 -0.9 37.2 7.7 158 400 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.916 110.5 47.5 -66.2 -45.0 0.6 36.0 11.0 159 401 A E H X S+ 0 0 26 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.929 112.9 49.4 -58.5 -48.2 1.2 39.5 12.2 160 402 A A H X S+ 0 0 51 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.910 110.6 51.0 -57.0 -45.0 -2.3 40.6 11.2 161 403 A Y H X S+ 0 0 24 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.886 112.4 45.7 -59.0 -44.8 -3.7 37.5 13.0 162 404 A C H X S+ 0 0 3 -4,-2.2 4,-1.7 2,-0.2 7,-0.3 0.848 113.3 49.9 -67.7 -39.0 -1.7 38.3 16.2 163 405 A K H < S+ 0 0 77 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.922 117.6 41.1 -62.0 -45.7 -2.8 42.0 16.0 164 406 A H H < S+ 0 0 147 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.880 126.9 28.8 -72.6 -42.7 -6.4 41.0 15.5 165 407 A K H < S+ 0 0 124 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.504 130.2 33.5-107.3 -6.2 -6.7 38.1 18.0 166 408 A Y >< + 0 0 51 -4,-1.7 3,-2.3 -5,-0.2 6,-0.2 -0.310 65.9 153.5-136.2 57.1 -4.1 39.1 20.7 167 409 A P T 3 + 0 0 90 0, 0.0 -2,-0.1 0, 0.0 -3,-0.1 0.772 69.1 64.9 -60.6 -27.7 -4.3 42.9 20.7 168 410 A E T 3 S+ 0 0 130 1,-0.2 -5,-0.1 -3,-0.1 -3,-0.0 0.535 94.4 65.5 -70.6 -8.3 -3.1 43.1 24.3 169 411 A Q X + 0 0 58 -3,-2.3 3,-1.8 -7,-0.3 4,-0.4 -0.739 58.4 173.3-117.9 81.9 0.3 41.7 23.2 170 412 A P T 3 S+ 0 0 86 0, 0.0 3,-0.2 0, 0.0 4,-0.2 0.808 82.9 43.0 -59.6 -31.3 1.9 44.2 20.9 171 413 A G T 3> S+ 0 0 22 1,-0.2 4,-1.5 2,-0.1 5,-0.1 0.082 81.4 102.0-103.9 22.1 5.2 42.2 20.7 172 414 A R H <> S+ 0 0 4 -3,-1.8 4,-1.8 -6,-0.2 5,-0.2 0.952 78.2 56.2 -66.0 -49.6 3.7 38.7 20.3 173 415 A F H > S+ 0 0 2 -4,-0.4 4,-1.6 1,-0.2 3,-0.2 0.886 110.5 44.4 -49.5 -48.2 4.4 38.6 16.6 174 416 A A H > S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.849 107.4 59.4 -65.3 -36.7 8.1 39.3 17.2 175 417 A K H < S+ 0 0 49 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.838 106.8 48.6 -62.0 -34.2 8.3 36.7 20.1 176 418 A L H >< S+ 0 0 0 -4,-1.8 3,-1.1 -3,-0.2 -1,-0.2 0.902 111.6 48.1 -68.0 -46.2 7.1 34.1 17.6 177 419 A L H >< S+ 0 0 1 -4,-1.6 3,-1.1 1,-0.2 -2,-0.2 0.775 105.0 59.2 -68.5 -28.3 9.8 35.0 15.0 178 420 A L T 3X S+ 0 0 3 -4,-2.1 4,-0.5 1,-0.3 -1,-0.2 0.460 89.3 72.8 -83.6 -1.3 12.5 35.1 17.6 179 421 A R H <> S+ 0 0 17 -3,-1.1 4,-1.9 1,-0.2 -1,-0.3 0.486 82.7 76.8 -79.6 -6.9 11.8 31.4 18.4 180 422 A L H <> S+ 0 0 4 -3,-1.1 4,-3.2 2,-0.2 5,-0.3 0.816 84.5 55.1 -81.2 -34.4 13.4 30.7 15.0 181 423 A P H > S+ 0 0 4 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.964 112.2 46.7 -59.1 -44.2 17.1 31.1 16.0 182 424 A A H X S+ 0 0 0 -4,-0.5 4,-3.1 2,-0.2 5,-0.3 0.932 114.9 47.0 -54.6 -50.2 16.4 28.5 18.7 183 425 A L H X S+ 0 0 8 -4,-1.9 4,-3.2 2,-0.2 -1,-0.2 0.938 116.1 43.0 -57.9 -52.7 14.6 26.3 16.1 184 426 A R H X S+ 0 0 19 -4,-3.2 4,-1.4 2,-0.2 -2,-0.2 0.913 116.7 48.8 -58.9 -44.2 17.3 26.6 13.5 185 427 A S H X S+ 0 0 7 -4,-3.1 4,-0.8 -5,-0.3 -2,-0.2 0.876 116.8 40.1 -69.2 -42.8 20.0 26.2 16.2 186 428 A I H >X S+ 0 0 0 -4,-3.1 4,-2.8 -5,-0.2 3,-0.6 0.900 110.1 60.6 -68.2 -44.9 18.4 23.1 17.7 187 429 A G H 3X S+ 0 0 3 -4,-3.2 4,-1.4 -5,-0.3 -2,-0.2 0.786 105.4 48.7 -52.6 -33.1 17.5 21.8 14.2 188 430 A L H 3X S+ 0 0 67 -4,-1.4 4,-1.7 2,-0.2 -1,-0.3 0.777 110.3 50.4 -78.4 -31.0 21.2 21.7 13.4 189 431 A K H X S+ 0 0 51 -4,-2.4 4,-3.0 2,-0.2 3,-0.5 0.958 108.3 56.6 -61.1 -52.1 23.1 13.7 16.1 194 436 A L H 3X S+ 0 0 19 -4,-3.2 4,-1.4 1,-0.3 -1,-0.2 0.811 107.6 49.5 -50.0 -36.5 21.1 12.1 13.3 195 437 A F H 3X S+ 0 0 90 -4,-1.8 4,-3.4 2,-0.2 -1,-0.3 0.835 110.7 49.8 -72.1 -36.5 24.3 11.8 11.2 196 438 A F H - 0 0 71 -2,-0.5 4,-3.1 -179,-0.1 5,-0.2 -0.356 28.0 -99.2 -83.1 164.7 14.0 4.2 7.7 207 449 A T H > S+ 0 0 95 1,-0.2 4,-3.0 2,-0.2 5,-0.1 0.803 119.5 44.8 -53.8 -44.4 14.1 5.0 4.0 208 450 A F H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.909 116.1 46.1 -70.4 -44.4 12.6 8.5 4.1 209 451 A L H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.907 115.6 48.4 -60.5 -42.5 14.8 9.6 7.1 210 452 A M H < S+ 0 0 68 -4,-3.1 3,-0.2 2,-0.2 -2,-0.2 0.933 108.0 52.7 -62.8 -49.5 17.7 8.0 5.3 211 453 A E H >< S+ 0 0 17 -4,-3.0 3,-1.2 1,-0.2 -1,-0.2 0.893 111.2 48.5 -51.9 -43.9 16.9 9.7 2.0 212 454 A M H 3< S+ 0 0 11 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.813 105.2 58.5 -66.6 -33.8 16.9 13.0 3.9 213 455 A L T 3< S+ 0 0 1 -4,-1.6 2,-0.3 -3,-0.2 -1,-0.3 0.250 88.3 107.3 -79.7 11.5 20.2 12.2 5.6 214 456 A E S < S- 0 0 100 -3,-1.2 -3,-0.0 -5,-0.1 -4,-0.0 -0.700 79.5-107.6 -95.1 145.4 21.8 11.9 2.1 215 457 A A 0 0 87 -2,-0.3 -2,-0.1 1,-0.0 -1,-0.1 -0.512 360.0 360.0 -66.8 136.0 24.2 14.5 0.7 216 458 A P 0 0 148 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 0.759 360.0 360.0 -26.2 360.0 22.5 16.6 -2.1 217 !* 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 0.0 218 1 B H > 0 0 83 0, 0.0 4,-1.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 85.6 15.4 11.5 -3.9 219 2 B K H > + 0 0 143 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.921 360.0 42.3 -64.6 -51.0 13.0 8.8 -4.8 220 3 B I H > S+ 0 0 31 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.943 110.7 53.3 -68.2 -51.8 10.3 9.1 -2.2 221 4 B L H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.927 111.2 46.0 -48.1 -58.1 10.0 12.9 -2.0 222 5 B H H X S+ 0 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-2,-1.3 3,-2.0 -3,-0.6 13,-0.1 -0.716 22.4-170.0 -85.4 99.1 19.7 36.1 24.2 362 378 C P T 3 S+ 0 0 12 0, 0.0 -1,-0.2 0, 0.0 12,-0.1 0.616 82.3 71.4 -66.9 -10.3 17.4 34.8 27.1 363 379 C D T 3 S+ 0 0 10 10,-0.1 -253,-0.1 2,-0.1 -2,-0.0 0.593 70.5 123.3 -79.4 -11.8 18.1 31.3 25.8 364 380 C S X - 0 0 13 -3,-2.0 3,-0.7 1,-0.1 2,-0.2 -0.234 65.8-119.0 -51.7 133.4 21.7 31.6 27.1 365 381 C K T 3 S+ 0 0 101 1,-0.2 -1,-0.1 -82,-0.1 -2,-0.1 -0.546 89.0 20.9 -80.1 140.4 22.5 28.8 29.6 366 382 C G T 3 S+ 0 0 69 1,-0.3 -1,-0.2 -2,-0.2 -83,-0.1 0.329 79.1 155.7 90.5 -7.1 23.4 29.5 33.2 367 383 C L < - 0 0 17 -3,-0.7 -1,-0.3 1,-0.1 -87,-0.0 -0.238 39.6-147.5 -53.9 135.7 21.8 33.0 33.3 368 384 C S S S+ 0 0 83 1,-0.3 -1,-0.1 -91,-0.1 -2,-0.1 0.894 92.6 21.0 -72.2 -41.3 20.9 34.1 36.8 369 385 C N > + 0 0 78 1,-0.1 4,-0.9 2,-0.0 3,-0.3 -0.788 60.2 161.0-134.3 90.1 17.9 36.1 35.5 370 386 C P H > S+ 0 0 55 0, 0.0 4,-2.9 0, 0.0 5,-0.1 0.664 79.2 65.2 -74.6 -21.2 16.6 35.1 32.0 371 387 C A H > S+ 0 0 64 2,-0.2 4,-0.7 1,-0.2 -2,-0.0 0.671 104.4 45.8 -74.8 -18.1 13.3 36.9 32.8 372 388 C E H > S+ 0 0 71 -3,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.742 113.7 47.7 -89.6 -29.4 15.3 40.1 32.9 373 389 C V H X S+ 0 0 0 -4,-0.9 4,-2.5 2,-0.2 5,-0.3 0.921 110.4 52.4 -72.4 -45.3 17.1 39.3 29.7 374 390 C E H X S+ 0 0 47 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.894 111.1 48.5 -53.5 -43.6 13.8 38.3 28.1 375 391 C A H X S+ 0 0 25 -4,-0.7 4,-2.1 2,-0.2 -1,-0.2 0.881 110.4 50.1 -65.6 -41.2 12.4 41.7 29.1 376 392 C L H X S+ 0 0 2 -4,-1.6 4,-2.6 2,-0.2 3,-0.2 0.966 110.7 47.5 -66.8 -53.4 15.4 43.6 27.8 377 393 C R H X S+ 0 0 12 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.901 110.6 54.7 -46.9 -47.1 15.3 42.0 24.3 378 394 C E H X S+ 0 0 51 -4,-1.9 4,-1.6 -5,-0.3 -1,-0.2 0.890 107.3 49.4 -59.2 -41.1 11.6 42.7 24.3 379 395 C K H X S+ 0 0 65 -4,-2.1 4,-2.2 -3,-0.2 3,-0.2 0.955 110.4 51.8 -58.4 -51.9 12.3 46.4 25.0 380 396 C V H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.925 113.8 40.8 -51.2 -54.8 14.8 46.4 22.1 381 397 C Y H X S+ 0 0 9 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.706 110.8 56.3 -76.8 -21.0 12.5 44.9 19.5 382 398 C A H X S+ 0 0 55 -4,-1.6 4,-1.8 -5,-0.3 -1,-0.2 0.863 110.9 46.1 -70.7 -38.5 9.5 46.9 20.6 383 399 C S H X S+ 0 0 8 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.810 110.2 55.6 -67.2 -33.5 11.6 50.0 20.0 384 400 C L H X S+ 0 0 0 -4,-1.5 4,-2.3 -5,-0.2 -2,-0.2 0.839 105.9 49.4 -71.0 -35.5 12.7 48.4 16.7 385 401 C E H X S+ 0 0 29 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.962 109.7 51.7 -66.7 -48.2 9.1 48.1 15.5 386 402 C A H X S+ 0 0 58 -4,-1.8 4,-1.5 1,-0.2 -2,-0.2 0.895 112.8 45.6 -52.6 -47.4 8.3 51.7 16.4 387 403 C Y H X S+ 0 0 37 -4,-1.9 4,-4.0 2,-0.2 5,-0.5 0.934 112.9 49.1 -61.4 -50.3 11.4 52.9 14.4 388 404 C C H X S+ 0 0 4 -4,-2.3 4,-0.6 1,-0.2 7,-0.3 0.814 113.3 47.6 -61.7 -33.8 10.6 50.6 11.4 389 405 C K H < S+ 0 0 112 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.772 121.3 38.2 -73.9 -29.6 7.0 51.9 11.4 390 406 C H H < S+ 0 0 148 -4,-1.5 -2,-0.2 -5,-0.3 -3,-0.2 0.919 122.8 35.6 -86.7 -53.2 8.3 55.5 11.7 391 407 C K H < S+ 0 0 118 -4,-4.0 -3,-0.2 1,-0.3 3,-0.1 0.946 135.3 20.7 -71.3 -52.2 11.4 55.6 9.4 392 408 C Y S >< S+ 0 0 34 -4,-0.6 3,-1.0 -5,-0.5 -1,-0.3 -0.634 70.9 153.1-116.1 69.9 10.2 53.2 6.7 393 409 C P T 3 + 0 0 81 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.721 66.5 69.7 -71.1 -18.1 6.4 53.2 7.1 394 410 C E T 3 S+ 0 0 127 1,-0.2 -5,-0.1 -3,-0.1 -2,-0.0 0.654 93.0 60.3 -71.9 -18.8 6.0 52.4 3.4 395 411 C Q X + 0 0 72 -3,-1.0 3,-1.5 -7,-0.3 4,-0.3 -0.833 61.4 177.8-115.5 91.3 7.3 48.9 3.9 396 412 C P T 3 S+ 0 0 103 0, 0.0 4,-0.3 0, 0.0 3,-0.2 0.658 81.1 54.9 -68.3 -18.7 5.0 47.1 6.4 397 413 C G T 3> S+ 0 0 25 1,-0.2 4,-2.3 2,-0.1 5,-0.1 0.350 81.7 94.2 -95.2 4.4 7.0 43.8 6.2 398 414 C R H <> S+ 0 0 6 -3,-1.5 4,-2.1 -6,-0.2 5,-0.2 0.931 78.1 54.2 -63.6 -50.3 10.3 45.5 7.1 399 415 C F H > S+ 0 0 8 -4,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.909 115.0 40.9 -51.8 -48.5 10.3 44.8 10.9 400 416 C A H > S+ 0 0 2 -4,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.921 109.3 59.6 -65.2 -45.1 9.8 41.1 10.3 401 417 C K H < S+ 0 0 49 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.863 105.7 49.9 -50.6 -41.0 12.2 41.0 7.4 402 418 C L H >< S+ 0 0 0 -4,-2.1 3,-1.3 1,-0.2 -1,-0.2 0.951 111.7 44.8 -65.1 -55.6 15.0 42.2 9.8 403 419 C L H >< S+ 0 0 1 -4,-1.5 3,-2.6 1,-0.3 -1,-0.2 0.862 102.1 70.5 -52.9 -38.5 14.4 39.7 12.5 404 420 C L T 3< S+ 0 0 3 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.157 86.1 65.4 -76.2 21.8 14.1 37.0 9.8 405 421 C R T <> S+ 0 0 12 -3,-1.3 4,-2.4 2,-0.1 -1,-0.3 0.280 85.4 79.2-107.9 -0.8 17.9 37.4 9.2 406 422 C L H <> S+ 0 0 6 -3,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.810 86.5 50.6 -84.5 -33.3 18.4 36.0 12.7 407 423 C P H > S+ 0 0 4 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.889 114.9 48.3 -66.0 -35.0 17.9 32.3 12.0 408 424 C A H > S+ 0 0 1 2,-0.2 4,-3.2 1,-0.2 -2,-0.2 0.926 110.9 48.1 -64.4 -49.6 20.4 32.8 9.2 409 425 C L H X S+ 0 0 7 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.867 112.6 51.0 -58.8 -36.7 22.9 34.7 11.4 410 426 C R H X S+ 0 0 20 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.926 112.3 44.8 -65.4 -49.3 22.5 31.8 14.0 411 427 C S H X S+ 0 0 10 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.956 116.7 46.1 -57.1 -52.6 23.2 29.1 11.4 412 428 C I H X S+ 0 0 0 -4,-3.2 4,-2.1 1,-0.2 -2,-0.2 0.810 108.8 57.2 -64.5 -32.4 26.1 31.1 10.0 413 429 C G H X S+ 0 0 5 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.942 110.1 42.8 -60.2 -50.0 27.5 31.8 13.5 414 430 C L H X S+ 0 0 59 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.880 114.8 48.3 -67.8 -42.6 27.7 28.1 14.3 415 431 C K H X S+ 0 0 82 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.920 114.2 48.2 -62.1 -43.4 29.1 27.0 11.0 416 432 C C H X S+ 0 0 32 -4,-2.1 4,-1.3 -5,-0.2 -2,-0.2 0.840 109.0 53.4 -63.8 -37.8 31.7 29.8 11.3 417 433 C L H X S+ 0 0 40 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.865 101.9 58.6 -68.3 -40.6 32.5 28.8 14.9 418 434 C E H X S+ 0 0 84 -4,-2.1 4,-2.2 1,-0.2 5,-0.2 0.949 102.7 54.4 -50.5 -54.5 33.2 25.2 13.8 419 435 C H H X S+ 0 0 45 -4,-1.5 4,-2.4 1,-0.2 -1,-0.2 0.879 106.0 52.1 -46.2 -48.5 35.9 26.5 11.5 420 436 C L H X S+ 0 0 13 -4,-1.3 4,-1.7 2,-0.2 -1,-0.2 0.944 107.8 51.0 -55.3 -51.3 37.6 28.3 14.4 421 437 C F H X S+ 0 0 89 -4,-2.1 4,-2.3 1,-0.3 -1,-0.2 0.851 112.9 46.2 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13.6-132.5-119.9 124.4 45.1 32.5 17.4 432 448 C D > - 0 0 58 -2,-0.5 4,-2.6 -179,-0.3 3,-0.3 -0.281 27.7 -97.9 -78.9 161.3 45.6 35.4 19.7 433 449 C T H > S+ 0 0 105 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.817 116.8 45.4 -47.8 -54.6 44.8 35.4 23.4 434 450 C F H > S+ 0 0 0 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.901 116.2 46.4 -63.3 -42.1 41.3 37.0 23.6 435 451 C L H > S+ 0 0 0 -3,-0.3 4,-1.3 1,-0.2 3,-0.5 0.894 110.4 54.6 -64.3 -39.7 40.0 34.9 20.7 436 452 C M H X S+ 0 0 57 -4,-2.6 4,-1.7 1,-0.2 3,-0.4 0.913 103.6 56.6 -57.4 -42.4 41.6 31.8 22.3 437 453 C E H < S+ 0 0 23 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.799 104.7 51.2 -61.6 -33.1 39.6 32.6 25.5 438 454 C M H < S+ 0 0 9 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.795 112.1 44.5 -77.9 -32.8 36.2 32.6 23.7 439 455 C L H < S+ 0 0 7 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.788 95.4 99.5 -78.1 -29.8 36.7 29.2 22.1 440 456 C E S < S- 0 0 89 -4,-1.7 -4,-0.0 -5,-0.2 0, 0.0 -0.377 82.6 -85.8 -75.9 141.2 38.1 27.6 25.3 441 457 C A 0 0 81 -2,-0.1 -1,-0.1 1,-0.1 -2,-0.0 0.367 360.0 360.0 -49.6 156.9 35.8 25.5 27.5 442 458 C P 0 0 155 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.546 360.0 360.0 -95.6 360.0 33.4 26.4 30.3 443 !* 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 0.0 444 1 D H > 0 0 94 0, 0.0 4,-1.0 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 85.6 38.4 33.3 31.5 445 2 D K H >> + 0 0 140 1,-0.2 4,-1.5 2,-0.2 3,-1.0 0.916 360.0 53.9 -53.6 -71.1 40.6 36.2 32.6 446 3 D I H 3> S+ 0 0 36 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.780 106.4 53.0 -42.4 -48.1 40.7 38.9 29.8 447 4 D L H 3> S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 3,-0.4 0.908 108.4 49.1 -57.3 -47.6 36.9 39.2 29.5 448 5 D H H << S+ 0 0 64 -4,-1.0 -1,-0.2 -3,-1.0 -2,-0.2 0.852 109.2 52.5 -63.2 -38.0 36.4 39.9 33.2 449 6 D R H < S+ 0 0 160 -4,-1.5 -1,-0.2 1,-0.2 3,-0.2 0.792 112.7 45.8 -66.4 -30.2 39.1 42.6 33.3 450 7 D L H < S+ 0 0 49 -4,-1.4 -2,-0.2 -3,-0.4 -1,-0.2 0.841 100.8 62.4 -85.0 -39.0 37.5 44.4 30.4 451 8 D L S < S+ 0 0 16 -4,-2.4 2,-0.5 -5,-0.2 -1,-0.2 0.472 94.9 78.6 -66.5 -1.4 33.9 44.2 31.7 452 9 D Q 0 0 147 -3,-0.2 0, 0.0 -5,-0.2 0, 0.0 -0.969 360.0 360.0-102.6 122.8 35.4 46.3 34.4 453 10 D D 0 0 187 -2,-0.5 -2,-0.1 -185,-0.0 -3,-0.1 0.059 360.0 360.0 -30.5 360.0 35.8 50.0 33.1