==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE RECEPTOR 06-MAR-07 2P1U . COMPND 2 MOLECULE: RETINOIC ACID RECEPTOR RXR-ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.BOURGUET,V.NAHOUM . 221 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11174.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 73.3 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 . 4 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 3 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 127 57.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.3 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 0 3 1 1 0 2 0 1 0 0 0 0 0 0 0 0 2 1 1 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 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 229 A D 0 0 137 0, 0.0 149,-0.1 0, 0.0 148,-0.1 0.000 360.0 360.0 360.0 144.8 19.4 -2.8 12.9 2 230 A M - 0 0 2 147,-0.2 2,-0.3 40,-0.0 151,-0.0 -0.647 360.0-164.7-143.3 77.1 18.6 -0.8 16.1 3 231 A P >> - 0 0 35 0, 0.0 4,-1.6 0, 0.0 3,-0.8 -0.493 17.1-147.2 -75.3 131.3 21.5 -0.1 18.4 4 232 A V H 3> S+ 0 0 16 -2,-0.3 4,-3.0 1,-0.3 5,-0.2 0.766 99.5 64.3 -64.9 -26.4 20.7 1.1 21.9 5 233 A E H 3> S+ 0 0 130 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.838 103.8 46.5 -64.2 -34.1 23.9 3.1 21.9 6 234 A R H <> S+ 0 0 109 -3,-0.8 4,-1.8 2,-0.2 -2,-0.2 0.862 112.8 49.6 -72.7 -39.7 22.4 5.2 19.0 7 235 A I H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.935 112.2 47.7 -63.5 -46.0 19.1 5.5 20.9 8 236 A L H X S+ 0 0 42 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.920 108.7 54.3 -60.1 -45.6 21.0 6.6 24.1 9 237 A E H X S+ 0 0 122 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.868 105.7 54.2 -54.9 -39.5 23.0 9.1 22.0 10 238 A A H X S+ 0 0 0 -4,-1.8 4,-0.9 2,-0.2 -1,-0.2 0.925 110.3 45.6 -60.3 -48.3 19.6 10.5 20.8 11 239 A E H >< S+ 0 0 11 -4,-1.9 3,-0.6 1,-0.2 4,-0.4 0.917 115.0 46.9 -57.0 -47.7 18.5 11.1 24.4 12 240 A L H 3< S+ 0 0 83 -4,-2.7 3,-0.4 1,-0.2 -1,-0.2 0.716 104.3 62.8 -73.8 -21.5 21.8 12.6 25.4 13 241 A A H 3< S+ 0 0 46 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.809 105.5 44.6 -68.7 -31.1 21.9 14.9 22.4 14 242 A V << 0 0 34 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.377 360.0 360.0-103.8 2.6 18.7 16.8 23.4 15 243 A E 0 0 152 -3,-0.4 -3,-0.0 -4,-0.4 66,-0.0 -0.425 360.0 360.0 -64.1 360.0 19.3 17.4 27.1 16 ! 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 17 263 A D > 0 0 108 0, 0.0 4,-1.6 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0-173.5 0.3 30.5 36.6 18 264 A P H > + 0 0 15 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.862 360.0 63.6 -58.5 -35.6 1.9 27.1 36.2 19 265 A V H > S+ 0 0 8 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.922 103.6 46.7 -57.7 -46.0 -0.4 26.2 33.3 20 266 A T H > S+ 0 0 26 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.948 114.8 47.0 -58.3 -50.6 1.1 29.1 31.2 21 267 A N H X S+ 0 0 54 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.861 111.9 51.5 -55.9 -39.7 4.7 28.0 32.2 22 268 A I H X S+ 0 0 55 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.901 110.2 47.9 -68.0 -42.4 3.7 24.3 31.4 23 269 A C H X S+ 0 0 7 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.903 111.2 51.3 -64.1 -44.0 2.5 25.3 27.9 24 270 A Q H X S+ 0 0 111 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.937 111.1 48.5 -53.8 -51.6 5.6 27.4 27.3 25 271 A A H X S+ 0 0 4 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.897 110.9 49.9 -56.5 -46.6 7.8 24.4 28.2 26 272 A A H X S+ 0 0 26 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.928 110.7 48.6 -62.1 -50.1 5.9 21.9 26.0 27 273 A D H X S+ 0 0 14 -4,-2.3 4,-0.9 1,-0.2 3,-0.4 0.925 111.0 51.8 -53.5 -48.6 6.1 24.2 22.9 28 274 A K H X S+ 0 0 100 -4,-2.3 4,-1.0 1,-0.2 3,-0.4 0.875 109.9 49.3 -55.7 -40.5 9.8 24.6 23.5 29 275 A Q H X S+ 0 0 27 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.720 95.5 70.8 -77.2 -22.4 10.3 20.8 23.7 30 276 A L H X S+ 0 0 1 -4,-1.5 4,-1.4 -3,-0.4 -1,-0.2 0.887 99.4 49.2 -57.9 -39.8 8.4 20.2 20.5 31 277 A F H X S+ 0 0 80 -4,-0.9 4,-1.2 -3,-0.4 3,-0.2 0.919 112.6 47.1 -63.0 -45.0 11.3 21.7 18.6 32 278 A T H X S+ 0 0 37 -4,-1.0 4,-2.0 1,-0.2 -2,-0.2 0.827 105.6 61.0 -65.9 -34.3 13.8 19.5 20.5 33 279 A L H X S+ 0 0 4 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.859 99.4 54.3 -62.0 -41.5 11.6 16.4 19.9 34 280 A V H X S+ 0 0 2 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.920 109.0 49.4 -59.1 -43.0 12.0 16.7 16.1 35 281 A E H X S+ 0 0 79 -4,-1.2 4,-0.8 2,-0.2 -2,-0.2 0.892 110.8 49.9 -63.0 -40.8 15.8 16.7 16.6 36 282 A W H >< S+ 0 0 1 -4,-2.0 3,-1.0 1,-0.2 4,-0.4 0.932 108.4 52.1 -61.8 -48.3 15.6 13.6 18.8 37 283 A A H >< S+ 0 0 0 -4,-2.6 3,-1.2 1,-0.3 6,-0.2 0.872 104.7 56.7 -57.7 -39.9 13.4 11.8 16.3 38 284 A K H 3< S+ 0 0 55 -4,-1.8 6,-0.3 1,-0.2 -1,-0.3 0.763 105.5 52.5 -61.1 -27.4 16.0 12.5 13.5 39 285 A R T << S+ 0 0 126 -3,-1.0 -1,-0.2 -4,-0.8 -2,-0.2 0.466 84.9 98.2 -91.4 -5.2 18.6 10.8 15.6 40 286 A I S X S- 0 0 1 -3,-1.2 3,-1.7 -4,-0.4 4,-0.5 -0.754 92.4 -96.2 -82.5 127.8 16.6 7.6 16.2 41 287 A P T 3 S- 0 0 3 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.112 99.1 -1.6 -51.5 133.8 17.9 5.0 13.7 42 288 A H T 3> S+ 0 0 63 -4,-0.1 4,-0.5 1,-0.1 3,-0.3 0.264 97.6 108.6 75.0 -8.4 15.8 4.7 10.5 43 289 A F T X4 S+ 0 0 0 -3,-1.7 3,-1.4 -6,-0.2 -5,-0.1 0.935 79.2 50.0 -61.7 -47.7 13.2 7.3 11.4 44 290 A S T 34 S+ 0 0 62 -4,-0.5 -1,-0.2 -6,-0.3 7,-0.1 0.703 102.2 64.0 -64.8 -20.3 14.5 9.8 8.9 45 291 A E T 34 S+ 0 0 139 -3,-0.3 -1,-0.3 2,-0.1 -2,-0.2 0.620 84.3 95.0 -78.9 -17.4 14.4 7.1 6.2 46 292 A L S << S- 0 0 5 -3,-1.4 5,-0.1 -4,-0.5 -4,-0.0 -0.414 96.8 -83.8 -66.5 151.9 10.6 6.9 6.5 47 293 A P >> - 0 0 55 0, 0.0 4,-1.8 0, 0.0 3,-0.5 -0.249 39.6-118.0 -50.3 144.9 8.5 8.9 4.1 48 294 A L H 3> S+ 0 0 54 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.890 113.7 57.2 -56.9 -41.6 8.1 12.6 5.3 49 295 A D H 3> S+ 0 0 109 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.845 108.8 45.6 -54.6 -40.6 4.3 12.1 5.6 50 296 A D H <> S+ 0 0 2 -3,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.807 108.3 55.3 -78.3 -31.6 4.7 9.2 8.0 51 297 A Q H X S+ 0 0 11 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.873 110.5 48.4 -61.8 -39.6 7.3 11.0 10.0 52 298 A V H X S+ 0 0 7 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.936 111.6 48.0 -64.0 -50.2 4.7 13.8 10.4 53 299 A I H X S+ 0 0 40 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.896 111.6 50.3 -58.8 -43.7 2.0 11.3 11.4 54 300 A L H X S+ 0 0 1 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.869 113.3 44.4 -65.9 -39.7 4.2 9.6 13.9 55 301 A L H X S+ 0 0 1 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.834 114.1 49.2 -75.2 -35.8 5.2 12.8 15.6 56 302 A R H < S+ 0 0 42 -4,-2.4 4,-0.3 1,-0.2 -2,-0.2 0.888 116.7 43.1 -67.0 -40.0 1.7 14.2 15.6 57 303 A A H < S+ 0 0 54 -4,-2.4 4,-0.2 -5,-0.2 -2,-0.2 0.785 126.8 29.7 -73.0 -30.6 0.3 11.0 17.1 58 304 A G H X S+ 0 0 4 -4,-1.5 4,-2.3 -5,-0.2 5,-0.2 0.593 85.6 98.0-111.1 -11.6 3.1 10.5 19.7 59 305 A W H X S+ 0 0 12 -4,-1.8 4,-2.3 1,-0.2 5,-0.2 0.812 85.1 50.9 -52.5 -41.0 4.4 13.9 20.7 60 306 A N H > S+ 0 0 27 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.968 114.3 41.3 -67.8 -53.5 2.4 14.2 23.9 61 307 A E H > S+ 0 0 26 -4,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.836 114.5 55.1 -57.1 -36.0 3.4 10.8 25.4 62 308 A L H X S+ 0 0 0 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.896 112.1 41.6 -67.3 -40.7 7.0 11.4 24.2 63 309 A L H X S+ 0 0 15 -4,-2.3 4,-2.3 -5,-0.2 5,-0.2 0.833 113.2 52.5 -76.9 -35.6 7.3 14.7 26.0 64 310 A I H X S+ 0 0 3 -4,-2.5 4,-2.4 -5,-0.2 5,-0.2 0.951 108.2 51.9 -63.5 -48.4 5.5 13.4 29.2 65 311 A A H X S+ 0 0 5 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.901 112.1 48.5 -49.6 -46.1 7.9 10.4 29.3 66 312 A S H X S+ 0 0 14 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.911 112.9 42.3 -65.5 -51.2 10.8 12.8 29.1 67 313 A F H X S+ 0 0 40 -4,-2.3 4,-1.0 2,-0.2 12,-0.5 0.836 112.4 56.7 -69.2 -28.5 9.8 15.3 31.8 68 314 A S H >< S+ 0 0 0 -4,-2.4 3,-0.5 -5,-0.2 -2,-0.2 0.942 111.1 42.1 -63.7 -47.2 8.8 12.5 34.1 69 315 A H H >< S+ 0 0 25 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.873 111.1 56.5 -67.4 -38.3 12.2 10.9 33.9 70 316 A R H 3< S+ 0 0 83 -4,-2.2 3,-0.4 1,-0.2 -1,-0.2 0.754 104.2 56.2 -59.3 -25.6 13.9 14.3 34.2 71 317 A S T X< + 0 0 0 -4,-1.0 3,-1.8 -3,-0.5 6,-0.2 0.296 69.5 106.8 -97.7 6.5 12.0 14.8 37.5 72 318 A I T < S+ 0 0 42 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.805 82.9 48.5 -55.5 -33.5 13.2 11.7 39.4 73 319 A A T 3 S+ 0 0 107 -3,-0.4 2,-0.3 -4,-0.2 -1,-0.3 0.466 94.3 97.2 -86.9 -1.9 15.4 13.9 41.7 74 320 A V S < S- 0 0 19 -3,-1.8 2,-0.6 3,-0.2 3,-0.3 -0.683 73.3-131.4 -89.1 139.9 12.6 16.3 42.4 75 321 A K S S- 0 0 158 -2,-0.3 3,-0.1 1,-0.2 -2,-0.1 -0.836 81.3 -22.3 -93.5 119.2 10.5 15.9 45.6 76 322 A D S S+ 0 0 81 -2,-0.6 12,-2.2 1,-0.2 2,-0.3 0.847 126.8 61.7 51.7 42.5 6.7 16.1 45.0 77 323 A G E S-A 87 0A 0 -3,-0.3 2,-0.3 10,-0.3 10,-0.3 -0.974 74.0-105.6-170.4-176.6 7.1 17.9 41.7 78 324 A I E -A 86 0A 8 8,-2.7 8,-2.5 -2,-0.3 2,-0.6 -0.955 18.3-133.3-129.2 150.5 8.4 18.1 38.1 79 325 A L E -A 85 0A 44 -12,-0.5 6,-0.2 -2,-0.3 -9,-0.1 -0.913 25.8-149.7-102.8 120.5 11.2 19.9 36.4 80 326 A L > - 0 0 10 4,-3.1 3,-1.5 -2,-0.6 -58,-0.1 -0.374 26.3-109.1 -84.9 166.4 10.2 21.6 33.1 81 327 A A T 3 S+ 0 0 23 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.715 117.1 62.6 -71.3 -22.0 12.4 22.2 30.1 82 328 A T T 3 S- 0 0 55 -61,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.533 121.3-106.7 -75.6 -8.3 12.5 25.9 30.8 83 329 A G S < S+ 0 0 44 -3,-1.5 2,-0.2 1,-0.4 -2,-0.1 0.264 80.5 129.9 95.3 -9.7 14.2 25.2 34.1 84 330 A L - 0 0 79 -63,-0.1 -4,-3.1 -5,-0.1 2,-0.4 -0.476 49.7-139.4 -75.7 145.1 11.0 26.0 36.1 85 331 A H E -A 79 0A 96 -6,-0.2 2,-0.5 -2,-0.2 -6,-0.2 -0.866 8.4-160.4-102.9 141.0 9.7 23.6 38.7 86 332 A V E -A 78 0A 4 -8,-2.5 -8,-2.7 -2,-0.4 2,-0.2 -0.989 14.7-167.1-115.3 124.1 6.1 22.7 39.3 87 333 A H E > -A 77 0A 88 -2,-0.5 4,-2.3 -10,-0.3 -10,-0.3 -0.641 35.7-102.1-103.9 165.0 5.2 21.2 42.7 88 334 A R H > S+ 0 0 98 -12,-2.2 4,-2.8 1,-0.2 5,-0.2 0.858 120.1 53.2 -47.3 -48.6 2.0 19.5 44.0 89 335 A N H > S+ 0 0 132 -13,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.908 110.9 46.0 -59.2 -44.4 0.8 22.6 45.9 90 336 A S H > S+ 0 0 42 -3,-0.2 4,-0.6 2,-0.2 -2,-0.2 0.895 113.7 48.1 -66.0 -42.9 1.1 24.8 42.7 91 337 A A H ><>S+ 0 0 2 -4,-2.3 5,-2.3 1,-0.2 3,-0.9 0.922 112.8 48.5 -63.8 -45.2 -0.6 22.2 40.5 92 338 A H H ><5S+ 0 0 141 -4,-2.8 3,-1.5 4,-0.3 5,-0.4 0.900 108.8 54.2 -60.2 -41.0 -3.4 21.8 43.0 93 339 A S H 3<5S+ 0 0 92 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.580 105.4 53.9 -72.2 -12.7 -3.8 25.6 43.3 94 340 A A T <<5S- 0 0 33 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.365 121.7-105.6 -98.0 -0.6 -4.2 25.8 39.5 95 341 A G T < 5S+ 0 0 66 -3,-1.5 -3,-0.2 -4,-0.3 -2,-0.1 0.601 100.2 96.8 85.6 14.2 -7.1 23.3 39.5 96 342 A V >< + 0 0 22 -5,-2.3 4,-1.9 -6,-0.2 -4,-0.3 0.014 39.0 124.2-121.7 27.7 -5.0 20.4 38.1 97 343 A G H > + 0 0 8 -5,-0.4 4,-2.6 -6,-0.4 -5,-0.2 0.887 69.5 51.8 -54.3 -49.1 -4.1 18.6 41.3 98 344 A A H > S+ 0 0 82 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.889 111.8 42.9 -63.0 -47.8 -5.4 15.1 40.4 99 345 A I H > S+ 0 0 20 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.895 113.9 53.9 -66.5 -38.0 -3.8 14.6 37.0 100 346 A F H X S+ 0 0 19 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.921 107.4 50.1 -58.9 -47.4 -0.5 16.1 38.4 101 347 A D H X S+ 0 0 45 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.880 106.6 56.3 -57.8 -41.3 -0.7 13.5 41.2 102 348 A R H X>S+ 0 0 72 -4,-1.9 4,-3.0 2,-0.2 5,-0.5 0.903 106.1 50.5 -55.0 -46.3 -1.2 10.7 38.6 103 349 A V H X>S+ 0 0 6 -4,-1.9 5,-2.3 1,-0.2 4,-1.9 0.942 113.1 45.4 -57.8 -50.3 2.0 11.7 36.8 104 350 A L H <>S+ 0 0 13 -4,-1.9 5,-2.9 3,-0.2 6,-0.2 0.899 121.5 36.7 -60.2 -44.8 4.0 11.6 40.1 105 351 A T H <5S+ 0 0 81 -4,-2.6 -2,-0.2 3,-0.2 -1,-0.2 0.874 125.9 33.9 -80.8 -39.3 2.6 8.3 41.3 106 352 A E H <5S+ 0 0 48 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.710 136.0 13.0 -93.2 -22.4 2.3 6.3 38.0 107 353 A L T X S+ 0 0 97 -6,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.888 112.3 47.8 -67.9 -41.3 7.8 4.2 39.3 111 357 A M H <>S+ 0 0 8 -4,-2.5 5,-2.2 2,-0.2 4,-0.4 0.900 115.0 46.8 -62.1 -43.4 10.7 5.5 37.2 112 358 A R H ><5S+ 0 0 89 -4,-2.3 3,-0.9 -5,-0.2 -2,-0.2 0.952 111.7 50.1 -62.3 -49.2 12.6 6.5 40.4 113 359 A D H 3<5S+ 0 0 121 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.790 117.2 37.8 -66.4 -33.7 11.9 3.2 42.2 114 360 A M T 3<5S- 0 0 18 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.431 106.8-127.7 -93.7 -0.5 13.1 0.9 39.4 115 361 A Q T < 5 - 0 0 148 -3,-0.9 -3,-0.2 -4,-0.4 2,-0.1 0.940 27.7-155.6 50.3 53.7 15.9 3.3 38.6 116 362 A M < - 0 0 7 -5,-2.2 -1,-0.2 -6,-0.2 2,-0.1 -0.397 11.6-142.1 -55.6 124.9 14.9 3.5 34.9 117 363 A D > - 0 0 25 -2,-0.1 4,-2.3 -3,-0.1 5,-0.2 -0.389 22.1-101.9 -91.4 171.8 18.1 4.5 33.1 118 364 A K H > S+ 0 0 80 1,-0.2 4,-2.0 2,-0.2 -107,-0.1 0.744 120.2 54.7 -66.9 -25.3 18.4 6.8 30.0 119 365 A T H > S+ 0 0 16 2,-0.2 4,-2.3 3,-0.1 -1,-0.2 0.923 110.0 46.7 -69.6 -46.8 18.8 3.9 27.6 120 366 A E H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.902 113.4 48.3 -62.0 -42.8 15.6 2.3 28.8 121 367 A L H X S+ 0 0 7 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.937 110.8 52.4 -62.3 -46.8 13.8 5.7 28.6 122 368 A G H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.886 111.3 45.6 -52.7 -46.8 15.1 6.2 25.1 123 369 A C H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.875 110.1 53.6 -69.8 -40.7 13.9 2.8 23.9 124 370 A L H X S+ 0 0 10 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.919 111.4 47.3 -57.8 -43.6 10.5 3.3 25.5 125 371 A R H X S+ 0 0 7 -4,-2.4 4,-3.1 2,-0.2 -2,-0.2 0.898 109.8 51.6 -65.0 -41.8 10.2 6.5 23.6 126 372 A A H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.869 109.0 51.9 -63.2 -36.6 11.3 5.0 20.3 127 373 A I H < S+ 0 0 4 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.927 112.5 45.2 -62.4 -45.0 8.6 2.3 20.9 128 374 A V H < S+ 0 0 9 -4,-2.1 3,-0.4 1,-0.2 -2,-0.2 0.895 112.6 51.6 -63.3 -44.6 6.1 5.1 21.4 129 375 A L H < S+ 0 0 0 -4,-3.1 2,-2.1 1,-0.3 -2,-0.2 0.959 104.8 57.6 -55.6 -53.9 7.5 7.0 18.3 130 376 A F S < S+ 0 0 0 -4,-2.9 -1,-0.3 -5,-0.1 17,-0.2 -0.412 74.8 159.8 -80.3 66.2 7.2 3.9 16.1 131 377 A N > - 0 0 19 -2,-2.1 3,-1.2 -3,-0.4 13,-0.1 -0.806 25.8-169.2 -96.4 109.2 3.4 3.4 16.7 132 378 A P T 3 S+ 0 0 24 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.600 82.2 68.0 -74.8 -9.9 1.9 1.2 13.9 133 379 A D T 3 S+ 0 0 115 2,-0.1 -2,-0.0 11,-0.0 4,-0.0 0.566 70.0 121.3 -82.8 -12.2 -1.6 2.1 15.1 134 380 A S S X S- 0 0 11 -3,-1.2 3,-1.0 1,-0.1 -80,-0.1 -0.309 71.5-108.7 -55.3 130.3 -1.3 5.7 14.0 135 381 A K T 3 S+ 0 0 176 1,-0.2 -1,-0.1 -82,-0.1 -78,-0.1 -0.329 92.2 16.5 -66.3 139.7 -4.0 6.6 11.4 136 382 A G T 3 S+ 0 0 68 1,-0.2 -1,-0.2 -2,-0.1 2,-0.1 0.528 75.3 159.9 82.5 7.2 -3.1 7.1 7.7 137 383 A L < - 0 0 19 -3,-1.0 -1,-0.2 1,-0.1 -87,-0.0 -0.418 36.7-146.2 -60.1 134.3 0.4 5.6 7.7 138 384 A S S S+ 0 0 88 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.813 94.1 19.6 -75.7 -30.1 1.4 4.6 4.2 139 385 A N > + 0 0 67 1,-0.1 4,-1.3 2,-0.0 3,-0.3 -0.698 63.8 169.8-139.7 84.6 3.3 1.6 5.4 140 386 A P H > S+ 0 0 63 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.841 79.9 62.0 -59.5 -33.4 2.2 0.5 8.9 141 387 A A H > S+ 0 0 57 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.867 101.6 49.9 -62.8 -41.3 4.3 -2.7 8.5 142 388 A E H > S+ 0 0 76 -3,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.877 113.1 46.8 -63.2 -41.2 7.6 -0.8 8.2 143 389 A V H X S+ 0 0 0 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.936 112.3 49.9 -65.4 -47.5 6.8 1.2 11.3 144 390 A E H X S+ 0 0 96 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.877 108.0 54.5 -57.7 -40.0 5.8 -2.0 13.2 145 391 A A H X S+ 0 0 31 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.867 108.1 49.1 -62.3 -38.1 9.1 -3.6 12.0 146 392 A L H X S+ 0 0 10 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.919 110.0 50.6 -67.8 -42.6 11.0 -0.7 13.5 147 393 A R H X S+ 0 0 52 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.938 108.4 53.4 -56.1 -49.0 9.1 -1.0 16.8 148 394 A E H X S+ 0 0 83 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.853 108.1 50.5 -54.9 -39.5 9.9 -4.7 16.9 149 395 A K H X S+ 0 0 92 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.833 108.2 52.6 -71.0 -34.9 13.6 -3.9 16.5 150 396 A V H X S+ 0 0 0 -4,-1.8 4,-3.0 -3,-0.2 -2,-0.2 0.928 112.3 43.9 -65.0 -45.4 13.6 -1.4 19.3 151 397 A Y H X S+ 0 0 92 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.860 110.5 53.5 -75.9 -29.5 12.0 -3.8 21.8 152 398 A A H X S+ 0 0 56 -4,-2.0 4,-1.8 -5,-0.2 -1,-0.2 0.911 114.2 45.3 -60.9 -42.5 14.3 -6.8 20.8 153 399 A S H X S+ 0 0 30 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.918 112.7 49.4 -67.0 -47.0 17.2 -4.4 21.4 154 400 A L H X S+ 0 0 0 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.943 109.7 52.1 -54.7 -51.2 15.7 -3.1 24.7 155 401 A E H X S+ 0 0 73 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.911 110.8 46.6 -54.1 -46.7 15.1 -6.7 25.9 156 402 A A H X S+ 0 0 59 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.857 111.9 51.7 -64.2 -38.6 18.7 -7.7 25.2 157 403 A Y H X S+ 0 0 40 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.939 111.2 47.3 -62.1 -47.7 20.0 -4.6 26.9 158 404 A C H X S+ 0 0 2 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.890 112.1 48.7 -61.0 -43.9 17.9 -5.3 30.1 159 405 A K H < S+ 0 0 124 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.795 115.9 44.4 -71.3 -29.2 19.0 -8.9 30.3 160 406 A H H < S+ 0 0 164 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.925 122.1 35.5 -75.4 -49.7 22.7 -8.0 29.9 161 407 A K H < S+ 0 0 106 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.791 131.6 28.8 -79.6 -27.4 22.7 -5.0 32.3 162 408 A Y >< + 0 0 35 -4,-2.7 3,-2.0 -5,-0.3 -1,-0.2 -0.522 68.6 162.9-130.1 64.7 20.2 -6.4 34.9 163 409 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.738 74.8 52.5 -64.8 -22.7 20.6 -10.2 34.7 164 410 A E T 3 S+ 0 0 170 1,-0.2 3,-0.1 2,-0.1 -5,-0.1 0.186 96.6 70.5 -98.6 16.6 18.9 -10.9 38.0 165 411 A Q X + 0 0 93 -3,-2.0 3,-1.7 -7,-0.2 4,-0.3 -0.687 54.6 166.0-126.3 76.4 15.8 -8.9 37.2 166 412 A P T 3 S+ 0 0 122 0, 0.0 3,-0.4 0, 0.0 4,-0.3 0.780 75.8 54.8 -68.8 -23.0 14.1 -11.1 34.5 167 413 A G T 3> S+ 0 0 47 1,-0.2 4,-2.2 2,-0.1 5,-0.1 0.396 80.7 96.1 -85.5 2.8 10.8 -9.1 34.8 168 414 A R H <> S+ 0 0 4 -3,-1.7 4,-2.0 -6,-0.2 -1,-0.2 0.876 80.1 51.3 -61.8 -43.3 12.5 -5.8 34.1 169 415 A F H > S+ 0 0 34 -3,-0.4 4,-1.9 -4,-0.3 -1,-0.2 0.924 112.9 45.6 -62.1 -47.8 11.7 -5.7 30.4 170 416 A A H > S+ 0 0 47 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.886 109.4 56.4 -60.9 -42.7 8.0 -6.4 31.0 171 417 A K H < S+ 0 0 128 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.861 106.3 50.4 -58.5 -40.7 7.9 -3.8 33.8 172 418 A L H >< S+ 0 0 0 -4,-2.0 3,-1.6 1,-0.2 4,-0.3 0.951 112.3 45.4 -61.8 -51.0 9.2 -1.1 31.4 173 419 A L H >< S+ 0 0 51 -4,-1.9 3,-1.5 1,-0.3 -2,-0.2 0.781 103.6 65.7 -65.0 -26.9 6.6 -1.9 28.8 174 420 A L T 3< S+ 0 0 110 -4,-1.9 4,-0.4 1,-0.3 -1,-0.3 0.483 88.8 66.4 -81.6 0.1 3.9 -2.0 31.4 175 421 A R T <> S+ 0 0 51 -3,-1.6 4,-2.0 -4,-0.2 -1,-0.3 0.587 83.6 80.1 -81.0 -15.1 4.4 1.7 32.1 176 422 A L H <> S+ 0 0 36 -3,-1.5 4,-2.3 -4,-0.3 -2,-0.2 0.820 86.0 52.4 -67.7 -35.7 3.0 2.4 28.6 177 423 A P H > S+ 0 0 82 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.910 111.0 48.7 -62.5 -40.7 -0.7 2.0 29.4 178 424 A A H > S+ 0 0 11 -4,-0.4 4,-2.9 2,-0.2 5,-0.2 0.919 112.2 49.1 -62.0 -43.4 -0.3 4.6 32.2 179 425 A L H X S+ 0 0 9 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.885 110.9 49.9 -63.4 -41.7 1.5 6.9 29.8 180 426 A R H X S+ 0 0 107 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.941 114.5 44.8 -57.4 -49.8 -1.2 6.5 27.2 181 427 A S H X S+ 0 0 49 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.905 114.6 47.1 -63.9 -45.7 -3.9 7.3 29.8 182 428 A I H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.884 110.2 54.1 -66.6 -38.6 -2.0 10.2 31.3 183 429 A G H X S+ 0 0 6 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.875 107.1 50.5 -62.1 -39.8 -1.3 11.6 27.8 184 430 A L H X S+ 0 0 108 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.876 112.1 46.7 -65.3 -40.4 -5.0 11.6 26.8 185 431 A K H X S+ 0 0 72 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.874 110.9 51.2 -73.0 -38.7 -6.0 13.4 30.0 186 432 A C H X S+ 0 0 36 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.878 111.2 49.3 -63.1 -38.2 -3.2 16.0 29.6 187 433 A L H X S+ 0 0 47 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.878 107.1 54.8 -68.1 -42.7 -4.4 16.6 26.0 188 434 A E H X S+ 0 0 117 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.896 110.0 46.6 -54.4 -45.5 -8.0 17.0 27.2 189 435 A H H X S+ 0 0 53 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.925 110.0 54.7 -62.4 -44.5 -6.9 19.7 29.7 190 436 A L H X S+ 0 0 15 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.912 105.9 50.6 -57.9 -47.6 -4.9 21.4 26.9 191 437 A F H X S+ 0 0 90 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.873 110.5 51.1 -57.9 -37.9 -7.9 21.6 24.6 192 438 A F H X S+ 0 0 116 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.904 107.2 51.8 -65.3 -41.6 -9.9 23.2 27.4 193 439 A F H X S+ 0 0 38 -4,-2.4 4,-1.8 1,-0.2 6,-0.6 0.878 112.3 47.9 -60.3 -38.0 -7.1 25.8 28.0 194 440 A K H < S+ 0 0 86 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.917 109.6 52.5 -67.3 -45.8 -7.4 26.5 24.3 195 441 A L H < S+ 0 0 138 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.890 110.5 46.6 -55.0 -47.1 -11.2 26.8 24.5 196 442 A I H < S- 0 0 90 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.887 94.0-153.1 -67.6 -39.7 -11.1 29.3 27.4 197 443 A G < + 0 0 51 -4,-1.8 -3,-0.1 -5,-0.2 -4,-0.1 0.659 62.8 108.3 78.2 18.1 -8.4 31.3 25.5 198 444 A D + 0 0 138 -5,-0.5 -4,-0.1 2,-0.1 -5,-0.1 0.351 62.9 76.8-105.3 3.3 -6.8 32.9 28.6 199 445 A T S S- 0 0 25 -6,-0.6 2,-0.2 -5,-0.1 -2,-0.1 -0.973 85.0-121.1-116.2 122.8 -3.6 30.8 28.4 200 446 A P - 0 0 88 0, 0.0 2,-0.5 0, 0.0 -177,-0.1 -0.423 28.5-172.2 -60.0 126.0 -0.9 31.7 25.8 201 447 A I - 0 0 24 -2,-0.2 -177,-0.1 -4,-0.1 -181,-0.0 -0.978 16.3-139.9-125.7 114.7 -0.3 28.7 23.4 202 448 A D > - 0 0 96 -2,-0.5 4,-3.1 -179,-0.1 5,-0.2 -0.160 28.0 -91.7 -79.6 174.2 2.6 29.2 21.1 203 449 A T H > S+ 0 0 80 1,-0.2 4,-2.3 2,-0.2 13,-0.1 0.740 117.7 45.4 -65.4 -37.9 2.7 28.2 17.5 204 450 A F H > S+ 0 0 1 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.938 117.8 45.2 -74.5 -42.3 4.2 24.7 17.5 205 451 A L H > S+ 0 0 2 2,-0.2 4,-1.2 1,-0.2 3,-0.2 0.953 113.8 50.8 -60.0 -49.0 1.9 23.6 20.3 206 452 A M H >X S+ 0 0 71 -4,-3.1 4,-0.7 1,-0.2 3,-0.6 0.901 107.1 53.9 -54.0 -44.8 -1.0 25.3 18.6 207 453 A E H >< S+ 0 0 9 -4,-2.3 3,-1.0 1,-0.2 -1,-0.2 0.877 104.1 55.3 -58.0 -41.1 -0.2 23.4 15.3 208 454 A M H 3< S+ 0 0 13 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.776 104.9 54.9 -62.8 -27.4 -0.3 20.1 17.2 209 455 A L H << S+ 0 0 6 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.622 84.2 110.9 -81.4 -14.1 -3.8 21.0 18.3 210 456 A E S << S- 0 0 84 -3,-1.0 -3,-0.0 -4,-0.7 0, 0.0 -0.279 76.1 -99.8 -68.2 149.9 -5.1 21.6 14.8 211 457 A A 0 0 90 1,-0.1 -1,-0.1 0, 0.0 -2,-0.1 -0.452 360.0 360.0 -76.8 136.9 -7.6 19.1 13.3 212 458 A P 0 0 162 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.897 360.0 360.0 -65.9 360.0 -6.6 16.3 10.9 213 !* 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 0.0 214 687 B H > 0 0 69 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 78.8 1.2 21.4 9.5 215 688 B K H > + 0 0 126 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.840 360.0 49.7 -65.3 -42.0 3.8 23.9 8.3 216 689 B I H > S+ 0 0 21 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.925 111.6 48.0 -67.1 -46.4 6.3 24.0 11.2 217 690 B L H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.934 112.9 47.6 -60.2 -51.7 6.6 20.2 11.5 218 691 B H H X S+ 0 0 60 -4,-1.8 4,-2.1 1,-0.2 5,-0.2 0.906 113.1 50.5 -52.7 -45.7 7.2 19.7 7.8 219 692 B R H X S+ 0 0 162 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.910 112.1 45.0 -62.6 -43.7 9.8 22.5 7.8 220 693 B L H < S+ 0 0 43 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.808 114.3 48.9 -72.1 -31.4 11.8 21.2 10.7 221 694 B L H < S+ 0 0 12 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.827 112.9 46.3 -77.2 -36.7 11.8 17.6 9.4 222 695 B Q H < 0 0 151 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.927 360.0 360.0 -65.1 -46.2 12.9 18.7 5.9 223 696 B D < 0 0 94 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.1 -0.896 360.0 360.0-150.9 360.0 15.6 20.9 7.5