==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-FEB-08 2ZJ4 . COMPND 2 MOLECULE: GLUCOSAMINE--FRUCTOSE-6-PHOSPHATE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.NAKAISHI,M.BANDO,K.KONDO,H.TSUGE . 365 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16192.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 268 73.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 12.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.8 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 . 24 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 37.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 2 3 1 0 1 0 1 1 1 1 1 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 2 2 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 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 316 A M 0 0 190 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 146.4 87.6 32.3 20.6 2 317 A K > - 0 0 59 3,-0.2 3,-2.0 4,-0.0 5,-0.2 0.265 360.0-179.8-105.9 3.9 85.5 29.3 21.5 3 318 A G T 3 + 0 0 67 1,-0.3 3,-0.1 3,-0.1 4,-0.0 0.296 69.3 28.5 -22.3 117.2 87.5 28.7 24.8 4 319 A N T 3 S+ 0 0 158 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 -0.144 116.0 71.2 108.3 -25.4 86.1 25.6 26.5 5 320 A F S < S- 0 0 52 -3,-2.0 -1,-0.2 1,-0.1 -3,-0.2 -0.921 70.5-144.3-118.8 146.1 84.9 24.0 23.2 6 321 A S S S+ 0 0 96 -2,-0.4 2,-0.3 -3,-0.1 -1,-0.1 0.563 88.5 33.2 -79.7 -11.8 86.9 22.5 20.4 7 322 A S > - 0 0 4 -5,-0.2 4,-1.6 1,-0.1 5,-0.1 -0.986 70.0-131.5-140.1 155.5 84.4 23.9 17.8 8 323 A F H > S+ 0 0 33 -2,-0.3 4,-2.8 2,-0.2 5,-0.2 0.904 108.6 56.7 -62.1 -44.1 82.1 26.9 17.3 9 324 A M H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.893 107.5 45.5 -59.9 -45.3 79.2 24.7 16.4 10 325 A Q H > S+ 0 0 30 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.930 113.9 50.4 -68.3 -39.1 79.3 22.7 19.7 11 326 A K H X S+ 0 0 58 -4,-1.6 4,-0.8 2,-0.2 -2,-0.2 0.924 110.9 49.8 -58.7 -41.8 79.7 25.9 21.6 12 327 A E H < S+ 0 0 2 -4,-2.8 3,-0.3 1,-0.2 -2,-0.2 0.880 110.4 49.6 -65.4 -41.3 76.6 27.3 19.7 13 328 A I H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.911 113.0 45.5 -60.0 -48.1 74.6 24.2 20.5 14 329 A F H 3< S+ 0 0 57 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.545 103.4 66.8 -77.1 -11.5 75.4 24.4 24.2 15 330 A E T >X S+ 0 0 44 -4,-0.8 4,-2.4 -3,-0.3 3,-0.7 0.487 72.0 99.3 -78.1 -6.7 74.7 28.1 24.2 16 331 A Q H <> S+ 0 0 0 -3,-1.2 4,-1.9 1,-0.3 5,-0.2 0.739 72.3 59.2 -66.3 -28.1 71.0 27.5 23.5 17 332 A P H 3> S+ 0 0 10 0, 0.0 4,-1.3 0, 0.0 -1,-0.3 0.944 117.1 36.4 -56.9 -43.5 69.7 27.9 27.2 18 333 A E H <> S+ 0 0 127 -3,-0.7 4,-2.9 -4,-0.2 -2,-0.2 0.829 113.8 54.3 -75.6 -38.9 71.2 31.4 27.0 19 334 A S H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -3,-0.2 0.891 108.8 50.4 -65.3 -37.8 70.4 32.3 23.4 20 335 A V H X S+ 0 0 0 -4,-1.9 4,-1.6 -5,-0.2 -1,-0.2 0.946 112.0 47.1 -63.0 -47.1 66.7 31.5 24.0 21 336 A V H X S+ 0 0 58 -4,-1.3 4,-1.0 1,-0.2 3,-0.4 0.946 112.4 51.3 -58.1 -47.2 66.8 33.8 27.1 22 337 A N H < S+ 0 0 40 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.826 106.8 53.1 -57.9 -35.9 68.5 36.5 25.0 23 338 A T H < S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.841 115.5 40.0 -66.3 -36.5 65.9 36.2 22.3 24 339 A M H >X S+ 0 0 11 -4,-1.6 4,-2.2 -3,-0.4 3,-1.7 0.496 87.9 123.6 -90.4 -8.0 63.1 36.8 24.9 25 340 A R T 3< S+ 0 0 150 -4,-1.0 4,-0.1 1,-0.3 -3,-0.0 -0.314 84.7 2.2 -63.8 133.1 64.9 39.5 26.9 26 341 A G T 34 S+ 0 0 78 2,-0.2 -1,-0.3 -2,-0.1 3,-0.1 0.637 128.6 71.0 66.8 14.7 63.1 42.8 27.3 27 342 A R T <4 S+ 0 0 55 -3,-1.7 9,-2.4 1,-0.3 2,-0.5 0.716 86.2 49.3-129.4 -50.5 60.2 41.2 25.3 28 343 A V E < -A 35 0A 18 -4,-2.2 2,-0.6 7,-0.2 -1,-0.3 -0.931 62.0-163.2-103.5 121.6 58.4 38.6 27.3 29 344 A N E > -A 34 0A 66 5,-2.9 5,-1.3 -2,-0.5 4,-0.5 -0.923 3.2-169.9-105.4 114.7 57.2 39.5 30.8 30 345 A F T 5S+ 0 0 58 -2,-0.6 3,-0.3 1,-0.2 -1,-0.1 0.815 79.1 66.8 -80.5 -25.9 56.4 36.4 32.8 31 346 A D T 5S+ 0 0 153 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.891 121.7 14.7 -59.9 -37.8 54.8 38.3 35.7 32 347 A D T 5S- 0 0 86 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.143 101.9-115.4-127.0 17.9 51.9 39.6 33.6 33 348 A Y T 5 + 0 0 68 -4,-0.5 2,-0.4 -3,-0.3 -3,-0.2 0.850 63.9 145.1 50.4 48.5 52.0 37.4 30.4 34 349 A T E < -A 29 0A 63 -5,-1.3 -5,-2.9 2,-0.0 2,-0.4 -0.876 31.4-166.8-115.2 145.7 52.7 40.3 28.1 35 350 A V E +A 28 0A 9 -2,-0.4 2,-0.4 -7,-0.2 -7,-0.2 -1.000 7.1 178.6-131.6 135.1 54.9 40.2 24.9 36 351 A N - 0 0 86 -9,-2.4 2,-1.0 -2,-0.4 3,-0.1 -0.930 15.4-167.7-140.4 110.8 56.1 43.2 23.1 37 352 A L > - 0 0 2 -2,-0.4 3,-2.4 1,-0.2 4,-0.5 -0.832 10.7-165.5 -97.1 98.4 58.3 43.2 20.1 38 353 A G G >> S+ 0 0 35 -2,-1.0 3,-1.3 1,-0.3 4,-0.5 0.829 84.9 64.1 -55.0 -38.3 59.3 46.9 20.0 39 354 A G G 34 S+ 0 0 50 1,-0.2 106,-0.9 2,-0.1 -1,-0.3 0.668 113.4 35.2 -56.3 -19.8 60.6 46.5 16.4 40 355 A L G <> S+ 0 0 0 -3,-2.4 4,-1.6 104,-0.2 -1,-0.2 0.334 88.6 103.9-112.4 0.3 57.0 45.7 15.4 41 356 A K T <4 S+ 0 0 127 -3,-1.3 3,-0.4 -4,-0.5 4,-0.3 0.912 85.8 40.8 -57.1 -50.1 55.2 48.1 17.9 42 357 A D T >< S+ 0 0 111 -4,-0.5 3,-0.8 1,-0.2 4,-0.3 0.994 121.9 39.3 -56.5 -65.2 54.3 50.7 15.3 43 358 A H T 3> S+ 0 0 65 1,-0.2 4,-2.0 -4,-0.2 -1,-0.2 0.420 86.0 95.2 -70.8 -6.9 53.3 48.3 12.5 44 359 A I H 3X S+ 0 0 15 -4,-1.6 4,-1.8 -3,-0.4 -1,-0.2 0.858 85.3 50.0 -56.5 -39.0 51.4 45.5 14.4 45 360 A K H <> S+ 0 0 146 -3,-0.8 4,-1.0 -4,-0.3 -1,-0.2 0.947 110.7 49.0 -69.1 -46.9 47.9 47.0 13.8 46 361 A E H > S+ 0 0 122 -4,-0.3 4,-0.6 1,-0.2 3,-0.5 0.876 109.0 55.2 -51.0 -42.1 48.6 47.4 10.0 47 362 A I H >< S+ 0 0 0 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.897 102.9 54.9 -62.7 -40.1 49.8 43.7 10.0 48 363 A Q H 3< S+ 0 0 84 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.764 102.4 58.2 -70.0 -20.8 46.5 42.6 11.6 49 364 A R H 3< S+ 0 0 183 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.673 87.6 99.8 -72.4 -22.9 44.6 44.3 8.7 50 365 A C << - 0 0 9 -3,-1.2 49,-0.2 -4,-0.6 3,-0.1 -0.232 66.6-143.9 -70.0 161.0 46.5 42.1 6.1 51 366 A R S S+ 0 0 162 47,-2.2 2,-0.3 1,-0.2 48,-0.2 0.525 74.4 22.1-103.4 -11.6 44.8 39.1 4.6 52 367 A R E -b 99 0B 49 46,-0.8 48,-2.3 26,-0.1 2,-0.5 -0.974 60.3-141.0-157.1 140.4 47.7 36.6 4.2 53 368 A L E -bc 100 80B 0 26,-2.4 28,-2.3 -2,-0.3 2,-0.5 -0.958 17.3-169.3-100.0 124.9 51.2 35.9 5.7 54 369 A I E -bc 101 81B 0 46,-2.4 48,-3.2 -2,-0.5 2,-0.6 -0.977 6.1-158.7-113.1 126.0 53.9 34.8 3.3 55 370 A L E -bc 102 82B 2 26,-3.1 28,-2.9 -2,-0.5 2,-0.5 -0.912 12.0-170.3-108.3 118.1 57.2 33.5 4.8 56 371 A I E +bc 103 83B 0 46,-3.2 48,-1.5 -2,-0.6 2,-0.3 -0.953 24.1 117.9-119.4 121.6 60.1 33.7 2.3 57 372 A A E - c 0 84B 1 26,-1.9 28,-1.9 -2,-0.5 2,-0.3 -0.980 47.3-109.2-167.0 174.8 63.5 32.1 3.0 58 373 A C >> - 0 0 38 46,-0.5 4,-1.3 -2,-0.3 3,-1.2 -0.855 66.9 -34.6-118.0 151.8 66.3 29.6 2.1 59 374 A G H 3> S+ 0 0 33 -2,-0.3 4,-2.1 1,-0.3 3,-0.1 -0.004 127.9 4.4 45.4-125.7 67.5 26.4 3.8 60 375 A T H 3> S+ 0 0 17 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.847 131.2 57.0 -64.1 -33.4 67.4 26.4 7.6 61 376 A S H <> S+ 0 0 17 -3,-1.2 4,-1.2 2,-0.2 -2,-0.2 0.928 106.6 52.2 -62.5 -39.2 65.7 29.8 7.7 62 377 A Y H X S+ 0 0 48 -4,-1.3 4,-1.9 1,-0.2 3,-0.5 0.917 105.4 54.3 -55.5 -48.9 63.0 28.2 5.5 63 378 A H H X S+ 0 0 18 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.827 98.9 61.1 -57.5 -34.9 62.7 25.3 8.0 64 379 A A H X S+ 0 0 0 -4,-1.6 4,-0.7 -3,-0.2 -1,-0.2 0.889 106.7 48.4 -61.7 -33.6 62.0 27.8 10.9 65 380 A G H >X S+ 0 0 0 -4,-1.2 4,-0.9 -3,-0.5 3,-0.8 0.915 109.8 49.3 -66.8 -46.1 58.9 28.9 8.9 66 381 A V H 3< S+ 0 0 28 -4,-1.9 4,-0.4 1,-0.2 3,-0.4 0.884 109.9 54.6 -61.0 -34.4 57.8 25.3 8.3 67 382 A A H 3< S+ 0 0 8 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.647 117.4 32.7 -74.4 -21.2 58.2 24.8 12.1 68 383 A T H S+ 0 0 84 -4,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.856 113.3 46.2 -62.8 -40.3 50.7 25.8 12.1 71 386 A V H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.833 111.2 53.3 -75.6 -28.3 50.9 28.0 15.2 72 387 A L H X>S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 5,-0.5 0.930 112.0 44.9 -66.3 -43.8 50.8 31.0 13.0 73 388 A E H X5S+ 0 0 74 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.948 114.5 51.0 -60.1 -45.0 47.7 29.7 11.3 74 389 A E H <5S+ 0 0 75 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.895 120.4 30.3 -59.4 -46.6 46.2 28.8 14.8 75 390 A L H <5S+ 0 0 2 -4,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.682 128.0 37.1 -96.0 -28.9 46.7 32.1 16.4 76 391 A T H <5S- 0 0 4 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.2 0.712 85.8-147.7 -90.4 -26.3 46.5 34.6 13.5 77 392 A E << + 0 0 133 -4,-2.0 -4,-0.1 -5,-0.5 -3,-0.1 0.540 57.9 126.7 62.2 9.6 43.7 32.6 11.7 78 393 A L S S- 0 0 29 -6,-0.5 -1,-0.3 1,-0.1 2,-0.2 -0.575 73.3 -98.5 -86.5 152.5 45.3 33.9 8.5 79 394 A P - 0 0 74 0, 0.0 -26,-2.4 0, 0.0 2,-0.4 -0.535 40.8-156.4 -63.2 139.0 46.4 31.8 5.6 80 395 A V E -c 53 0B 4 -2,-0.2 2,-0.4 -28,-0.2 -26,-0.2 -0.994 10.3-171.4-126.9 121.3 50.2 31.2 5.9 81 396 A M E -c 54 0B 48 -28,-2.3 -26,-3.1 -2,-0.4 2,-0.4 -0.924 6.6-159.5-112.1 134.4 52.3 30.3 2.8 82 397 A V E -c 55 0B 23 -2,-0.4 2,-0.4 -28,-0.2 -26,-0.2 -0.981 17.0-173.5-118.8 128.3 56.0 29.2 3.3 83 398 A E E -c 56 0B 23 -28,-2.9 -26,-1.9 -2,-0.4 2,-0.4 -0.982 30.2-128.0-133.9 130.0 58.2 29.6 0.2 84 399 A L E >> -c 57 0B 75 -2,-0.4 4,-2.2 -28,-0.2 3,-0.5 -0.660 32.2-134.0 -66.5 125.4 61.7 28.7 -0.8 85 400 A A H 3> S+ 0 0 0 -28,-1.9 4,-1.9 -2,-0.4 5,-0.2 0.839 98.8 55.1 -60.7 -40.0 63.0 32.0 -2.1 86 401 A S H 3> S+ 0 0 58 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.913 114.5 40.8 -59.8 -41.0 64.6 30.7 -5.4 87 402 A D H <> S+ 0 0 72 -3,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.838 107.4 61.3 -77.1 -37.2 61.3 29.1 -6.5 88 403 A F H <>S+ 0 0 0 -4,-2.2 5,-1.8 1,-0.2 4,-0.3 0.923 111.6 41.8 -50.4 -46.5 59.2 32.0 -5.3 89 404 A L H ><5S+ 0 0 39 -4,-1.9 3,-1.4 -5,-0.2 -2,-0.2 0.904 109.4 56.0 -72.1 -44.4 61.2 34.1 -7.8 90 405 A D H 3<5S+ 0 0 128 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.886 110.9 46.6 -57.2 -38.9 61.2 31.5 -10.7 91 406 A R T 3<5S- 0 0 110 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.476 102.2-127.5 -83.6 -2.9 57.4 31.4 -10.6 92 407 A N T < 5 - 0 0 116 -3,-1.4 -3,-0.2 -4,-0.3 -2,-0.1 0.961 36.8-146.1 51.5 52.4 56.7 35.1 -10.5 93 408 A T < - 0 0 2 -5,-1.8 2,-0.3 -6,-0.1 -1,-0.1 -0.226 12.8-109.5 -53.8 130.6 54.5 34.3 -7.5 94 409 A P + 0 0 80 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.508 41.8 179.1 -61.5 120.7 51.4 36.6 -7.3 95 410 A V - 0 0 12 -2,-0.3 2,-0.2 24,-0.1 30,-0.0 -0.983 9.2-154.3-128.6 145.9 51.7 39.0 -4.3 96 411 A F > - 0 0 115 -2,-0.4 3,-1.6 28,-0.1 27,-0.1 -0.643 30.5-106.4-118.2 164.1 49.2 41.7 -3.4 97 412 A R T 3 S+ 0 0 215 1,-0.3 29,-0.2 -2,-0.2 -1,-0.0 0.707 118.9 50.9 -60.2 -30.2 49.0 45.0 -1.6 98 413 A D T 3 S+ 0 0 73 27,-0.1 -47,-2.2 -48,-0.1 -46,-0.8 0.143 86.9 110.0-100.4 22.6 47.4 43.5 1.5 99 414 A D E < -b 52 0B 3 -3,-1.6 27,-1.7 -49,-0.2 2,-0.5 -0.778 57.0-150.7 -85.9 138.8 50.0 40.7 1.8 100 415 A V E -bd 53 126B 0 -48,-2.3 -46,-2.4 -2,-0.4 2,-0.5 -0.970 17.0-160.9-106.8 125.9 52.5 40.8 4.8 101 416 A C E -bd 54 127B 0 25,-3.0 27,-2.6 -2,-0.5 2,-0.4 -0.916 3.9-157.4-115.6 125.6 55.7 39.1 3.7 102 417 A F E -bd 55 128B 0 -48,-3.2 -46,-3.2 -2,-0.5 2,-0.6 -0.880 1.0-158.7-105.5 136.5 58.3 37.9 6.2 103 418 A F E -bd 56 129B 0 25,-2.8 27,-3.1 -2,-0.4 2,-0.5 -0.965 8.3-163.4-120.4 111.4 62.0 37.4 5.2 104 419 A L E + d 0 130B 1 -48,-1.5 -46,-0.5 -2,-0.6 2,-0.3 -0.856 24.1 148.0-102.6 123.5 63.8 35.0 7.5 105 420 A S E - 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0 0 82 -3,-1.6 3,-1.5 1,-0.2 4,-0.5 -0.846 53.5-164.2-105.2 112.6 41.2 37.6 22.0 181 496 A I G > S+ 0 0 159 -2,-0.7 3,-1.2 1,-0.3 4,-0.4 0.892 92.2 54.7 -55.2 -43.4 39.5 36.4 25.2 182 497 A S G 3 S+ 0 0 111 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.602 108.4 50.6 -68.3 -16.7 39.1 32.9 23.9 183 498 A M G <> S+ 0 0 21 -3,-1.5 4,-2.3 -6,-0.2 -1,-0.2 0.454 82.0 93.1-100.8 -1.1 42.9 32.6 23.2 184 499 A Q H <> S+ 0 0 68 -3,-1.2 4,-1.7 -4,-0.5 5,-0.1 0.858 84.8 49.1 -68.6 -39.8 44.2 33.8 26.6 185 500 A E H > S+ 0 0 138 -4,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.902 112.4 50.3 -63.2 -40.8 44.6 30.4 28.2 186 501 A R H > S+ 0 0 37 -4,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.914 110.1 49.6 -59.4 -44.1 46.4 29.1 25.1 187 502 A R H X S+ 0 0 15 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.859 111.2 49.1 -64.4 -36.0 48.8 32.1 25.2 188 503 A K H X S+ 0 0 76 -4,-1.7 4,-2.4 2,-0.2 5,-0.2 0.905 108.7 52.8 -74.7 -40.6 49.5 31.5 28.9 189 504 A E H X S+ 0 0 95 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.958 113.7 45.2 -51.5 -52.5 50.2 27.8 28.3 190 505 A I H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.893 112.2 49.2 -61.3 -45.5 52.7 28.9 25.6 191 506 A M H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.882 108.9 52.8 -66.8 -35.0 54.3 31.6 27.7 192 507 A L H X S+ 0 0 37 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.839 108.7 51.7 -67.6 -32.8 54.7 29.1 30.7 193 508 A G H X S+ 0 0 8 -4,-1.6 4,-0.9 -5,-0.2 -2,-0.2 0.897 108.8 49.9 -66.3 -42.7 56.5 26.7 28.2 194 509 A L H < S+ 0 0 0 -4,-2.0 3,-0.3 2,-0.2 -2,-0.2 0.858 108.2 53.6 -59.5 -41.8 58.8 29.4 27.1 195 510 A K H < S+ 0 0 99 -4,-2.0 4,-0.3 1,-0.2 -2,-0.2 0.927 115.1 40.9 -58.4 -45.7 59.6 30.3 30.7 196 511 A R H X S+ 0 0 133 -4,-1.7 4,-1.7 1,-0.2 3,-0.2 0.594 93.2 89.8 -75.4 -14.5 60.5 26.6 31.3 197 512 A L H X S+ 0 0 0 -4,-0.9 4,-2.3 -3,-0.3 5,-0.2 0.864 78.8 55.4 -62.8 -44.6 62.4 26.1 28.0 198 513 A P H > S+ 0 0 14 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.923 110.9 45.8 -54.2 -45.1 66.0 27.1 29.1 199 514 A D H > S+ 0 0 105 -4,-0.3 4,-1.5 -3,-0.2 -2,-0.2 0.840 112.2 51.8 -65.1 -35.7 66.0 24.5 31.9 200 515 A L H X S+ 0 0 31 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.855 107.2 52.0 -72.1 -31.7 64.6 21.9 29.6 201 516 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.892 105.8 55.1 -68.2 -39.8 67.3 22.6 26.9 202 517 A K H X S+ 0 0 126 -4,-1.9 4,-1.0 1,-0.2 -2,-0.2 0.895 107.6 51.3 -56.6 -39.7 70.0 22.1 29.7 203 518 A E H < S+ 0 0 78 -4,-1.5 3,-0.3 2,-0.2 4,-0.3 0.881 108.6 48.6 -67.6 -40.0 68.4 18.7 30.3 204 519 A V H >< S+ 0 0 0 -4,-1.8 3,-1.9 1,-0.2 -2,-0.2 0.913 107.0 57.7 -62.5 -42.8 68.5 17.7 26.6 205 520 A L H >< S+ 0 0 12 -4,-2.5 3,-1.6 1,-0.3 -1,-0.2 0.787 92.8 68.6 -61.3 -23.4 72.2 18.8 26.5 206 521 A S T 3< S+ 0 0 99 -4,-1.0 3,-0.4 -3,-0.3 -1,-0.3 0.618 88.2 66.9 -70.2 -12.4 73.0 16.4 29.4 207 522 A M T <> + 0 0 22 -3,-1.9 4,-1.6 -4,-0.3 3,-0.3 0.323 64.9 112.7 -89.7 11.3 72.3 13.5 26.9 208 523 A D H <> S+ 0 0 27 -3,-1.6 4,-2.5 1,-0.2 3,-0.3 0.883 75.0 52.0 -41.4 -49.9 75.4 14.5 24.8 209 524 A D H > S+ 0 0 118 -3,-0.4 4,-2.0 1,-0.3 -1,-0.2 0.907 108.5 50.8 -65.6 -39.9 77.3 11.2 25.7 210 525 A E H > S+ 0 0 71 -3,-0.3 4,-1.3 2,-0.2 -1,-0.3 0.807 110.8 48.0 -61.6 -35.4 74.3 9.1 24.7 211 526 A I H X S+ 0 0 2 -4,-1.6 4,-2.4 -3,-0.3 -2,-0.2 0.854 106.8 56.8 -75.8 -37.0 74.1 10.8 21.3 212 527 A Q H X S+ 0 0 67 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.933 106.4 51.8 -55.5 -44.1 77.9 10.4 20.8 213 528 A K H X S+ 0 0 126 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.858 109.4 47.6 -63.1 -40.3 77.2 6.6 21.3 214 529 A L H X S+ 0 0 14 -4,-1.3 4,-0.8 2,-0.2 -1,-0.2 0.871 108.6 54.4 -67.1 -36.1 74.5 6.6 18.6 215 530 A A H >X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 3,-1.0 0.903 103.5 57.8 -61.9 -38.8 76.7 8.5 16.3 216 531 A T H 3< S+ 0 0 67 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.882 106.4 48.5 -55.7 -38.8 79.2 5.7 16.9 217 532 A E H 3< S+ 0 0 109 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.617 119.2 37.6 -72.6 -16.7 76.5 3.2 15.6 218 533 A L H X< S+ 0 0 14 -3,-1.0 3,-2.3 -4,-0.8 -2,-0.2 0.588 82.1 93.4-114.4 -15.2 75.8 5.3 12.5 219 534 A Y T 3< S+ 0 0 73 -4,-1.9 -1,-0.1 1,-0.3 -3,-0.1 0.593 85.4 55.2 -72.6 -8.6 78.9 6.8 11.1 220 535 A H T 3 S+ 0 0 150 -4,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.548 88.9 101.6 -86.8 -9.7 79.7 3.9 8.7 221 536 A Q < - 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