==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-JAN-07 2OIV . COMPND 2 MOLECULE: XANTHOMONAS OUTER PROTEIN D; . SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOMONAS EUVESICATORIA; . AUTHOR R.CHOSED,D.R.TOMCHICK,C.A.BRAUTIGAM,M.MACHIUS,K.ORTH . 170 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9138.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 8.8 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 0.6 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 . 14 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 35.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 1 0 0 1 0 0 2 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 1 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 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 1 338 A W 0 0 181 0, 0.0 2,-0.4 0, 0.0 71,-0.0 0.000 360.0 360.0 360.0 163.6 2.4 11.0 -9.7 2 339 A L - 0 0 8 2,-0.0 2,-0.1 3,-0.0 126,-0.0 -0.679 360.0-144.6 -90.3 135.3 4.7 13.3 -7.7 3 340 A L >> - 0 0 92 -2,-0.4 4,-1.6 1,-0.1 3,-0.7 -0.387 34.8 -97.6 -86.1 167.8 7.1 12.0 -5.0 4 341 A D H 3> S+ 0 0 34 1,-0.2 4,-2.8 2,-0.2 28,-0.3 0.900 124.9 58.6 -48.8 -47.7 8.0 13.8 -1.8 5 342 A G H 3> S+ 0 0 49 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.803 102.0 53.5 -57.4 -32.8 11.2 15.0 -3.5 6 343 A H H <> S+ 0 0 70 -3,-0.7 4,-2.6 2,-0.2 -1,-0.2 0.924 109.7 46.3 -68.7 -42.2 9.2 16.7 -6.3 7 344 A L H X S+ 0 0 2 -4,-1.6 4,-3.2 1,-0.2 5,-0.2 0.945 114.0 48.9 -66.8 -44.1 7.1 18.7 -3.9 8 345 A R H X S+ 0 0 110 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.903 110.4 51.5 -57.1 -44.0 10.3 19.6 -1.9 9 346 A A H X S+ 0 0 47 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.960 113.8 44.6 -54.7 -49.7 12.0 20.6 -5.3 10 347 A Y H X S+ 0 0 5 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.939 115.0 45.7 -65.3 -48.4 9.1 22.8 -6.1 11 348 A T H X S+ 0 0 4 -4,-3.2 4,-2.4 2,-0.2 -1,-0.2 0.840 111.8 52.6 -67.0 -33.4 8.7 24.4 -2.6 12 349 A D H X S+ 0 0 54 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.923 112.0 46.2 -60.9 -47.3 12.5 25.0 -2.4 13 350 A D H X S+ 0 0 33 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.915 112.4 50.9 -64.2 -41.6 12.4 26.8 -5.8 14 351 A L H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.921 107.2 52.5 -59.7 -44.3 9.3 28.8 -4.7 15 352 A A H X S+ 0 0 45 -4,-2.4 4,-0.9 1,-0.2 3,-0.2 0.939 109.3 50.8 -61.0 -42.8 11.0 29.9 -1.5 16 353 A R H >< S+ 0 0 142 -4,-2.2 3,-0.7 1,-0.2 -1,-0.2 0.914 109.6 50.4 -51.3 -49.6 14.0 31.1 -3.7 17 354 A R H 3< S+ 0 0 83 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.814 112.5 46.3 -64.1 -30.6 11.6 33.0 -5.9 18 355 A L H >< S+ 0 0 9 -4,-2.1 3,-2.3 -3,-0.2 -1,-0.2 0.524 80.1 138.2 -92.5 -6.1 9.9 34.7 -2.9 19 356 A R T << S+ 0 0 187 -4,-0.9 -3,-0.1 -3,-0.7 -4,-0.0 -0.081 75.9 4.1 -42.7 125.6 13.1 35.7 -1.1 20 357 A G T 3 S+ 0 0 83 1,-0.3 -1,-0.3 0, 0.0 3,-0.1 0.527 94.6 135.9 75.2 4.2 13.0 39.2 0.4 21 358 A E S X S- 0 0 101 -3,-2.3 3,-2.4 1,-0.1 4,-0.4 -0.555 70.7 -78.0 -76.4 150.0 9.4 39.9 -0.5 22 359 A P T 3 S+ 0 0 79 0, 0.0 124,-0.2 0, 0.0 -1,-0.1 -0.245 116.8 0.5 -41.8 123.0 7.0 41.5 2.0 23 360 A N T > S+ 0 0 58 1,-0.1 3,-1.9 -3,-0.1 4,-0.3 0.436 89.8 126.6 73.4 1.5 5.9 38.9 4.5 24 361 A A G X + 0 0 21 -3,-2.4 3,-1.5 1,-0.3 -1,-0.1 0.820 68.4 63.5 -58.1 -32.1 8.0 36.0 2.9 25 362 A H G 3 S+ 0 0 143 -4,-0.4 -1,-0.3 1,-0.3 -6,-0.0 0.634 90.2 67.5 -67.5 -13.7 9.5 35.4 6.3 26 363 A L G < S+ 0 0 37 -3,-1.9 35,-2.4 33,-0.1 2,-0.3 0.625 89.2 85.6 -75.3 -11.4 6.0 34.5 7.7 27 364 A L E < -a 61 0A 17 -3,-1.5 2,-0.4 -4,-0.3 35,-0.2 -0.654 49.7-177.4-100.9 141.9 6.0 31.3 5.5 28 365 A H E -a 62 0A 49 33,-2.5 35,-2.7 -2,-0.3 2,-0.9 -0.968 12.8-157.4-132.6 125.7 7.3 27.8 6.1 29 366 A F E -a 63 0A 31 -2,-0.4 35,-0.1 33,-0.2 33,-0.1 -0.870 26.2-139.6 -99.8 102.3 6.9 25.2 3.4 30 367 A A - 0 0 2 33,-2.5 2,-0.4 -2,-0.9 -19,-0.1 -0.364 12.4-115.8 -65.1 142.6 7.2 22.0 5.3 31 368 A D > - 0 0 26 1,-0.1 4,-1.9 33,-0.1 3,-0.2 -0.666 24.1-135.9 -71.5 128.0 9.1 19.0 3.9 32 369 A S H > S+ 0 0 3 -2,-0.4 4,-2.0 -28,-0.3 35,-0.2 0.793 102.3 55.0 -64.0 -30.1 6.5 16.3 3.3 33 370 A Q H > S+ 0 0 116 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.907 107.7 51.0 -69.8 -36.8 8.6 13.5 4.8 34 371 A V H > S+ 0 0 19 -3,-0.2 4,-0.8 2,-0.2 -2,-0.2 0.887 106.8 53.3 -63.4 -39.7 8.9 15.6 8.0 35 372 A V H >< S+ 0 0 8 -4,-1.9 3,-1.2 1,-0.2 4,-0.4 0.947 108.8 50.1 -58.1 -46.7 5.1 16.0 8.1 36 373 A T H >< S+ 0 0 80 -4,-2.0 3,-1.8 1,-0.3 -2,-0.2 0.904 102.7 61.7 -57.6 -42.6 4.8 12.2 7.9 37 374 A M H >< S+ 0 0 49 -4,-2.1 3,-1.7 1,-0.3 -1,-0.3 0.697 84.1 77.3 -58.8 -23.7 7.3 11.9 10.7 38 375 A L T << S+ 0 0 0 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.835 101.6 41.2 -52.6 -31.0 4.9 13.8 13.1 39 376 A S T < S+ 0 0 54 -3,-1.8 -1,-0.3 -4,-0.4 -2,-0.2 0.214 87.1 133.4-107.8 15.7 3.0 10.5 13.3 40 377 A S < - 0 0 27 -3,-1.7 6,-0.1 1,-0.1 -3,-0.0 -0.297 57.2-139.5 -66.5 148.8 6.0 8.1 13.6 41 378 A A S S+ 0 0 105 4,-0.1 -1,-0.1 5,-0.0 3,-0.0 0.653 86.0 90.1 -81.4 -19.2 5.9 5.4 16.2 42 379 A D S > S- 0 0 65 1,-0.1 4,-2.2 -5,-0.1 3,-0.5 -0.734 74.6-149.0 -79.2 119.8 9.6 6.2 16.8 43 380 A P H > S+ 0 0 89 0, 0.0 4,-2.2 0, 0.0 -1,-0.1 0.798 94.8 52.6 -61.5 -33.0 9.7 8.9 19.5 44 381 A D H > S+ 0 0 122 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.776 108.6 50.3 -76.4 -29.9 12.8 10.6 18.2 45 382 A Q H > S+ 0 0 88 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.926 113.8 45.1 -67.6 -50.0 11.4 10.9 14.7 46 383 A Q H X S+ 0 0 45 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.931 113.9 49.2 -61.1 -44.1 8.2 12.4 16.0 47 384 A A H X S+ 0 0 35 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.900 111.2 48.1 -63.9 -46.2 10.1 14.8 18.3 48 385 A R H X S+ 0 0 117 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.880 111.0 52.5 -60.5 -39.0 12.5 16.0 15.6 49 386 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 5,-0.2 0.905 109.4 49.1 -62.5 -42.7 9.5 16.5 13.4 50 387 A Q H X S+ 0 0 68 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.892 111.5 48.8 -65.1 -43.1 7.8 18.6 16.1 51 388 A R H X S+ 0 0 137 -4,-2.4 4,-1.5 3,-0.2 -2,-0.2 0.941 114.5 45.9 -59.0 -49.8 11.0 20.7 16.5 52 389 A L H < S+ 0 0 57 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.794 126.7 28.0 -68.9 -27.5 11.3 21.2 12.7 53 390 A L H < S+ 0 0 1 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.655 136.3 22.7-109.1 -19.5 7.6 22.1 12.3 54 391 A A H < S+ 0 0 40 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.186 84.4 129.9-135.8 14.3 6.6 23.7 15.7 55 392 A G S >< S- 0 0 19 -4,-1.5 3,-1.5 -5,-0.2 -4,-0.1 -0.195 74.6-102.7 -60.5 165.0 9.9 24.8 17.2 56 393 A D T 3 S+ 0 0 177 1,-0.3 -1,-0.1 0, 0.0 -5,-0.0 0.570 121.8 50.8 -70.5 -13.1 10.0 28.4 18.6 57 394 A D T 3 S+ 0 0 134 -6,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.293 82.9 110.2-101.4 6.0 12.0 29.6 15.5 58 395 A I S < S- 0 0 30 -3,-1.5 -30,-0.1 -7,-0.1 4,-0.1 -0.770 77.6-109.4 -89.6 123.2 9.6 28.1 12.9 59 396 A P - 0 0 34 0, 0.0 -33,-0.1 0, 0.0 -32,-0.1 0.034 25.9-121.1 -47.3 150.9 7.5 30.8 10.9 60 397 A P S S+ 0 0 35 0, 0.0 20,-2.9 0, 0.0 2,-0.7 0.546 94.7 67.7 -82.9 -9.8 3.8 30.9 11.8 61 398 A I E S-aB 27 79A 1 -35,-2.4 -33,-2.5 18,-0.2 2,-0.4 -0.916 71.8-175.7-111.7 100.4 2.1 30.2 8.4 62 399 A V E -aB 28 78A 0 16,-3.2 16,-2.9 -2,-0.7 2,-0.7 -0.871 19.4-156.7-109.0 127.4 3.0 26.6 7.7 63 400 A F E -aB 29 77A 0 -35,-2.7 -33,-2.5 -2,-0.4 14,-0.2 -0.936 14.3-170.1-102.9 112.9 2.1 24.6 4.6 64 401 A L E - B 0 76A 0 12,-3.5 12,-3.2 -2,-0.7 2,-0.2 -0.902 12.5-148.9-109.7 104.5 2.0 20.9 5.3 65 402 A P E - B 0 75A 2 0, 0.0 2,-0.6 0, 0.0 10,-0.2 -0.564 15.9-147.8 -66.9 132.1 1.7 18.5 2.3 66 403 A I E - B 0 74A 7 8,-3.1 8,-2.0 -2,-0.2 2,-0.6 -0.956 11.1-157.5-111.8 117.1 -0.2 15.4 3.4 67 404 A N E - B 0 73A 26 -2,-0.6 6,-0.2 -35,-0.2 8,-0.0 -0.836 18.4-169.8-100.4 115.2 0.9 12.2 1.7 68 405 A Q E >> - B 0 72A 40 4,-2.8 3,-2.5 -2,-0.6 4,-2.1 -0.977 51.4-107.4 -92.0 114.1 -1.3 9.2 1.4 69 406 A P T 34 S- 0 0 98 0, 0.0 4,-0.0 0, 0.0 -2,-0.0 -0.258 88.5 -18.5 -57.6 116.7 1.6 6.9 0.1 70 407 A N T 34 S+ 0 0 112 -2,-0.1 3,-0.1 1,-0.1 -67,-0.0 0.674 135.5 74.8 56.2 23.1 1.1 6.1 -3.6 71 408 A A T <4 S- 0 0 59 -3,-2.5 2,-0.3 1,-0.2 -1,-0.1 0.739 97.2 -22.2-121.5 -57.1 -2.5 7.2 -3.1 72 409 A H E < -B 68 0A 24 -4,-2.1 -4,-2.8 56,-0.1 2,-0.4 -0.943 39.3-140.4-173.6 130.9 -3.2 10.9 -2.7 73 410 A W E +B 67 0A 10 -2,-0.3 20,-0.5 -6,-0.2 2,-0.3 -0.845 25.3 166.0-100.3 139.1 -1.9 14.4 -1.8 74 411 A S E -B 66 0A 2 -8,-2.0 -8,-3.1 -2,-0.4 2,-0.5 -0.884 28.6-121.7-139.2 174.6 -3.7 17.1 0.2 75 412 A L E -BC 65 91A 1 16,-2.6 16,-2.9 -2,-0.3 2,-0.6 -0.962 14.4-166.8-128.7 121.3 -2.6 20.3 1.9 76 413 A L E -BC 64 90A 0 -12,-3.2 -12,-3.5 -2,-0.5 2,-0.5 -0.932 10.8-165.1-101.0 130.8 -2.9 21.3 5.5 77 414 A V E -BC 63 89A 0 12,-3.4 12,-2.5 -2,-0.6 2,-0.5 -0.947 1.9-167.4-116.9 127.5 -2.3 25.0 6.3 78 415 A V E -BC 62 88A 0 -16,-2.9 -16,-3.2 -2,-0.5 2,-0.5 -0.959 6.1-172.5-116.6 127.5 -1.6 26.2 9.8 79 416 A D E +BC 61 87A 20 8,-3.1 8,-2.2 -2,-0.5 3,-0.3 -0.935 15.4 162.3-116.4 101.2 -1.7 29.9 10.7 80 417 A R + 0 0 46 -20,-2.9 -19,-0.1 -2,-0.5 6,-0.1 0.071 32.5 122.0-115.4 30.2 -0.5 30.3 14.3 81 418 A R S S+ 0 0 99 -21,-0.3 2,-0.7 1,-0.2 -1,-0.2 0.864 81.4 49.1 -52.7 -37.6 0.3 34.1 14.2 82 419 A N S > S- 0 0 85 3,-0.3 3,-2.2 -3,-0.3 -1,-0.2 -0.884 75.2-166.4-105.3 101.2 -2.2 34.3 17.1 83 420 A K T 3 S+ 0 0 167 -2,-0.7 3,-0.4 1,-0.3 -1,-0.1 0.715 90.6 51.0 -62.7 -20.5 -1.3 31.6 19.6 84 421 A D T 3 S+ 0 0 132 1,-0.2 -1,-0.3 -3,-0.1 -4,-0.0 0.481 121.3 33.5 -91.3 -6.0 -4.7 32.0 21.4 85 422 A A S < S+ 0 0 62 -3,-2.2 -3,-0.3 -6,-0.1 2,-0.3 -0.475 76.3 178.8-148.2 63.6 -6.6 31.6 18.0 86 423 A V - 0 0 48 -3,-0.4 2,-0.4 -6,-0.1 -6,-0.2 -0.559 13.7-154.7 -70.9 131.3 -4.7 29.2 15.7 87 424 A A E -C 79 0A 24 -8,-2.2 -8,-3.1 -2,-0.3 2,-0.4 -0.885 10.8-172.7-110.3 142.3 -6.5 28.7 12.4 88 425 A A E -C 78 0A 5 29,-0.4 31,-3.0 -2,-0.4 2,-0.4 -0.992 5.1-165.6-137.4 142.8 -6.1 25.5 10.3 89 426 A Y E -Cd 77 119A 17 -12,-2.5 -12,-3.4 -2,-0.4 2,-0.6 -0.993 5.5-160.6-132.9 126.7 -7.3 24.7 6.8 90 427 A H E -Cd 76 120A 0 29,-3.5 31,-3.7 -2,-0.4 2,-0.6 -0.941 7.7-169.8-110.9 113.0 -7.4 21.3 5.1 91 428 A Y E +Cd 75 121A 2 -16,-2.9 -16,-2.6 -2,-0.6 2,-0.4 -0.913 12.0 170.0-101.1 119.9 -7.7 21.3 1.3 92 429 A D - 0 0 3 29,-1.1 31,-0.4 -2,-0.6 -18,-0.1 -0.987 25.7-167.0-136.6 117.2 -8.4 18.0 -0.3 93 430 A S 0 0 40 -20,-0.5 -1,-0.1 -2,-0.4 -19,-0.1 0.764 360.0 360.0 -75.9 -25.0 -9.3 17.6 -4.0 94 431 A M 0 0 105 -21,-0.2 -1,-0.2 -3,-0.1 -21,-0.1 -0.641 360.0 360.0 82.6 360.0 -10.5 14.0 -3.1 95 ! 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 96 434 A K 0 0 170 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 103.5 -13.7 10.1 0.4 97 435 A D > - 0 0 99 0, 0.0 3,-0.6 0, 0.0 4,-0.4 -0.709 360.0-102.1 -93.7 168.8 -12.9 7.3 2.8 98 436 A P T 3> S+ 0 0 110 0, 0.0 4,-1.8 0, 0.0 0, 0.0 0.477 99.3 90.9 -78.6 1.4 -11.9 8.8 6.2 99 437 A Q H 3> S+ 0 0 79 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.889 80.4 52.0 -65.4 -47.1 -8.1 8.2 5.8 100 438 A Q H <> S+ 0 0 5 -3,-0.6 4,-1.9 1,-0.2 -1,-0.2 0.934 113.5 43.8 -59.7 -45.5 -7.0 11.5 4.3 101 439 A R H > S+ 0 0 49 -4,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.882 109.8 58.0 -68.2 -36.1 -8.7 13.7 6.9 102 440 A Y H X S+ 0 0 126 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.897 106.3 48.7 -55.2 -44.0 -7.4 11.4 9.6 103 441 A L H X S+ 0 0 44 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.903 112.4 48.1 -63.8 -40.6 -3.8 12.1 8.4 104 442 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.870 113.2 49.4 -66.2 -36.3 -4.5 15.8 8.4 105 443 A D H X S+ 0 0 22 -4,-2.7 4,-3.0 2,-0.2 -2,-0.2 0.887 109.0 50.4 -70.5 -39.8 -6.0 15.4 11.9 106 444 A M H X S+ 0 0 43 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.889 111.3 50.3 -63.5 -40.7 -3.0 13.5 13.2 107 445 A A H X S+ 0 0 2 -4,-2.1 4,-1.0 2,-0.2 -2,-0.2 0.950 112.7 45.5 -60.6 -51.6 -0.7 16.2 11.9 108 446 A A H ><>S+ 0 0 0 -4,-2.3 5,-2.2 1,-0.2 3,-0.8 0.931 113.7 50.0 -55.3 -50.2 -2.8 18.9 13.6 109 447 A Y H ><5S+ 0 0 149 -4,-3.0 3,-1.5 1,-0.2 -2,-0.2 0.900 110.7 49.8 -54.9 -44.8 -2.9 16.9 16.8 110 448 A H H 3<5S+ 0 0 25 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.634 102.6 60.2 -77.5 -12.5 0.9 16.4 16.8 111 449 A L T <<5S- 0 0 15 -4,-1.0 -1,-0.3 -3,-0.8 -2,-0.2 0.283 125.4-100.9 -90.3 9.8 1.6 20.1 16.2 112 450 A G T < 5S+ 0 0 71 -3,-1.5 -3,-0.2 1,-0.3 2,-0.2 0.649 82.2 129.8 80.9 17.2 -0.2 20.8 19.6 113 451 A L < - 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