==== 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 UNKNOWN FUNCTION 08-AUG-06 2HYX . COMPND 2 MOLECULE: PROTEIN DIPZ; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR D.GOLDSTONE,E.N.BAKER,P.METCALF,TB STRUCTURAL GENOMICS CONSO . 1323 6 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49193.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 856 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 84 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 306 23.1 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 . 5 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.5 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 . 113 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 118 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 0.9 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 4 0 0 0 0 1 3 0 0 0 4 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 12 4 4 0 0 0 4 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 . 4 8 10 2 18 4 2 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 0 0 4 0 0 0 4 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 -3 A G 0 0 73 0, 0.0 2,-0.3 0, 0.0 478,-0.2 0.000 360.0 360.0 360.0 145.1 18.8 63.5 33.4 2 -2 A A E -a 479 0A 31 476,-1.4 478,-1.8 479,-0.1 2,-0.2 -0.979 360.0 -97.9-154.7 160.7 16.5 64.6 30.6 3 -1 A M E -a 480 0A 18 -2,-0.3 2,-0.3 476,-0.2 539,-0.2 -0.515 44.0-177.6 -79.4 152.7 13.4 66.7 30.0 4 366 A E - 0 0 10 476,-1.8 495,-2.4 -2,-0.2 2,-0.5 -0.977 28.2-152.6-157.8 139.8 10.1 64.8 29.7 5 367 A I B > -b 499 0B 4 -2,-0.3 3,-1.9 493,-0.3 495,-0.1 -0.932 49.8 -98.7-105.4 131.3 6.4 65.3 29.0 6 368 A R T 3 S+ 0 0 35 493,-2.3 531,-0.2 -2,-0.5 3,-0.1 -0.271 111.4 24.1 -55.8 135.4 4.4 62.5 30.7 7 369 A E T 3 S+ 0 0 138 1,-0.3 20,-3.2 19,-0.1 -1,-0.3 0.468 91.5 139.6 85.5 7.8 3.4 59.8 28.1 8 370 A Q < - 0 0 37 -3,-1.9 2,-0.4 18,-0.2 -1,-0.3 -0.590 61.0-112.6 -80.8 139.2 6.4 60.8 26.0 9 371 A L - 0 0 15 528,-0.6 2,-1.3 16,-0.4 -1,-0.1 -0.619 20.3-148.8 -73.7 126.2 8.3 57.9 24.4 10 372 A N - 0 0 25 -2,-0.4 -1,-0.1 -6,-0.0 -6,-0.0 -0.619 27.5-170.7 -96.9 74.9 11.8 57.8 26.0 11 373 A L - 0 0 18 -2,-1.3 132,-0.2 1,-0.1 2,-0.2 -0.167 6.5-146.8 -63.5 156.9 13.5 56.5 22.9 12 374 A G + 0 0 8 130,-2.5 132,-0.1 2,-0.1 -1,-0.1 -0.613 52.5 28.9-118.3 179.4 17.1 55.3 22.9 13 375 A G S S- 0 0 45 -2,-0.2 2,-0.2 2,-0.0 127,-0.1 0.015 93.6 -52.9 62.4-174.5 20.0 55.3 20.5 14 376 A I - 0 0 109 1,-0.1 2,-0.4 538,-0.0 538,-0.2 -0.524 51.5-102.1 -98.9 166.5 20.5 57.9 17.8 15 377 A V + 0 0 21 536,-2.8 2,-0.3 -2,-0.2 558,-0.1 -0.708 43.3 170.0 -87.6 131.5 18.3 59.2 15.0 16 378 A N >> - 0 0 54 -2,-0.4 4,-1.0 124,-0.2 3,-0.9 -0.819 51.3 -88.7-131.5 174.1 18.9 57.9 11.5 17 379 A A T 34 S+ 0 0 94 -2,-0.3 557,-0.2 1,-0.2 4,-0.2 0.750 123.6 51.1 -57.0 -27.3 17.0 58.2 8.2 18 380 A Q T 34 S+ 0 0 65 1,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.748 120.8 28.7 -84.7 -23.7 15.0 55.1 9.0 19 381 A N T X4 S+ 0 0 2 -3,-0.9 3,-1.5 1,-0.1 4,-0.3 0.260 80.1 114.7-121.6 14.1 13.7 56.0 12.5 20 382 A A T 3< S+ 0 0 6 -4,-1.0 3,-0.4 1,-0.3 -1,-0.1 0.786 80.3 46.4 -56.4 -32.7 13.6 59.8 12.5 21 383 A Q T > S+ 0 0 75 1,-0.2 3,-2.3 -4,-0.2 -1,-0.3 0.445 79.4 97.8 -93.6 1.5 9.8 59.9 12.9 22 384 A L G X S+ 0 0 1 -3,-1.5 3,-1.8 1,-0.3 -1,-0.2 0.842 77.3 63.3 -56.2 -34.6 9.3 57.4 15.7 23 385 A S G 3 S+ 0 0 9 -3,-0.4 -1,-0.3 -4,-0.3 -14,-0.2 0.522 83.7 77.9 -69.1 -4.7 9.2 60.2 18.2 24 386 A N G < S+ 0 0 13 -3,-2.3 10,-0.3 11,-0.1 2,-0.3 0.601 86.5 72.3 -78.6 -11.4 6.0 61.5 16.4 25 387 A a S < S- 0 0 1 -3,-1.8 -16,-0.4 -4,-0.2 2,-0.2 -0.738 79.7-138.2 -99.7 151.7 4.2 58.7 18.3 26 388 A S - 0 0 14 -2,-0.3 2,-1.0 -18,-0.1 135,-0.6 -0.452 39.2 -76.2 -98.9 180.0 3.6 58.9 22.0 27 389 A D B S-c 161 0C 25 -20,-3.2 135,-0.2 1,-0.2 510,-0.0 -0.664 103.8 -25.7 -85.6 99.8 3.9 56.1 24.6 28 390 A G S S- 0 0 11 133,-3.6 -1,-0.2 -2,-1.0 134,-0.2 0.873 81.5-167.7 69.6 41.1 0.9 53.7 24.2 29 391 A A - 0 0 17 -3,-0.5 -1,-0.1 132,-0.4 4,-0.1 -0.258 22.9-137.7 -60.9 144.9 -1.6 56.2 22.8 30 392 A A S S+ 0 0 49 2,-0.1 2,-0.3 143,-0.0 -1,-0.1 0.648 87.4 56.3 -79.0 -16.7 -5.2 55.0 22.8 31 393 A Q S S- 0 0 138 1,-0.1 -2,-0.1 143,-0.0 143,-0.1 -0.834 101.0 -90.4-113.9 154.9 -5.8 56.5 19.3 32 394 A L - 0 0 38 -2,-0.3 2,-0.2 128,-0.1 128,-0.2 -0.335 45.7-175.6 -62.5 142.5 -3.9 55.7 16.1 33 395 A E - 0 0 40 126,-2.5 2,-0.4 -4,-0.1 -8,-0.1 -0.698 20.0-127.9-126.9 179.5 -0.9 57.9 15.5 34 396 A S + 0 0 76 -10,-0.3 125,-0.2 -2,-0.2 3,-0.1 -0.933 32.1 159.2-139.4 113.8 1.5 58.1 12.5 35 397 A a - 0 0 1 123,-2.6 -10,-0.1 -2,-0.4 -14,-0.1 -0.336 53.4 -77.4-135.5 60.0 5.2 58.0 13.0 36 398 A G - 0 0 9 -15,-0.1 122,-2.9 121,-0.1 -1,-0.4 0.238 66.0 -44.3 76.8 163.9 7.0 56.9 9.8 37 399 A T B S-I 157 0D 79 120,-0.2 120,-0.3 1,-0.1 -16,-0.2 -0.372 75.1 -92.5 -63.5 142.3 7.7 53.8 7.8 38 400 A A - 0 0 9 118,-2.8 -1,-0.1 1,-0.1 3,-0.1 -0.329 45.3-112.8 -59.7 133.6 8.8 50.9 10.1 39 401 A P - 0 0 0 0, 0.0 -1,-0.1 0, 0.0 19,-0.1 -0.289 40.8 -90.6 -65.3 157.4 12.6 50.7 10.4 40 402 A D - 0 0 53 1,-0.1 2,-1.3 100,-0.1 100,-0.1 -0.302 32.4-114.9 -65.5 150.8 14.3 47.7 8.9 41 403 A L - 0 0 29 15,-0.1 3,-0.4 -3,-0.1 2,-0.2 -0.776 51.3-165.7 -86.3 97.2 14.8 44.6 11.0 42 404 A K - 0 0 84 -2,-1.3 95,-0.5 1,-0.2 96,-0.1 -0.566 47.4 -1.0 -94.6 154.4 18.7 44.9 11.0 43 405 A G S S+ 0 0 46 -2,-0.2 91,-0.5 93,-0.2 2,-0.4 0.709 70.0 174.0 46.0 33.7 21.4 42.5 11.9 44 406 A I - 0 0 30 -3,-0.4 88,-0.2 1,-0.2 -1,-0.2 -0.574 18.1-160.6 -70.8 125.2 19.2 39.6 12.9 45 407 A T - 0 0 70 86,-2.1 2,-0.3 -2,-0.4 -1,-0.2 0.637 65.7 -4.2 -83.1 -16.5 21.5 36.7 13.6 46 408 A G E -D 131 0C 20 85,-0.8 85,-3.0 2,-0.0 2,-0.3 -0.974 59.0-139.0-170.4 158.3 18.9 34.0 13.4 47 409 A W E -D 130 0C 18 6,-0.4 2,-0.3 -2,-0.3 83,-0.2 -0.954 11.1-167.7-128.6 147.9 15.2 33.2 12.9 48 410 A L E +D 129 0C 7 81,-2.5 81,-2.6 -2,-0.3 801,-0.1 -0.922 68.5 24.7-129.2 155.7 12.8 30.8 14.5 49 411 A N S S+ 0 0 73 799,-0.4 -1,-0.1 -2,-0.3 800,-0.1 0.819 92.6 108.4 60.8 35.3 9.3 29.7 13.5 50 412 A T S > S- 0 0 15 -3,-0.1 3,-2.5 77,-0.1 -1,-0.2 -0.941 85.6 -78.4-133.3 154.6 9.7 30.7 9.8 51 413 A P G > S- 0 0 115 0, 0.0 3,-2.0 0, 0.0 799,-0.1 -0.354 117.3 -7.3 -57.3 125.8 9.9 28.2 6.9 52 414 A G G 3 S- 0 0 47 1,-0.3 798,-0.1 797,-0.2 797,-0.0 0.676 116.4 -82.3 60.9 17.9 13.4 26.9 6.7 53 415 A N G < S+ 0 0 31 -3,-2.5 -6,-0.4 1,-0.2 -1,-0.3 0.811 85.9 159.3 56.1 29.5 14.3 29.4 9.5 54 416 A K < - 0 0 146 -3,-2.0 -1,-0.2 1,-0.1 -6,-0.0 -0.477 43.0 -97.9 -81.0 155.0 14.7 32.0 6.7 55 417 A P - 0 0 94 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.206 26.7-135.2 -70.1 163.1 14.4 35.7 7.4 56 418 A I - 0 0 35 -15,-0.1 2,-0.5 -6,-0.0 -15,-0.1 -0.979 9.4-150.2-120.1 131.4 11.3 37.9 7.0 57 419 A D > - 0 0 89 -2,-0.4 3,-1.9 1,-0.1 4,-0.4 -0.907 15.8-136.4-101.9 127.3 11.6 41.3 5.3 58 420 A L G > S+ 0 0 11 -2,-0.5 3,-1.8 1,-0.3 -1,-0.1 0.817 103.6 65.2 -52.2 -32.3 8.9 43.7 6.6 59 421 A K G > S+ 0 0 114 1,-0.3 3,-1.4 2,-0.2 -1,-0.3 0.832 93.5 59.8 -61.6 -30.6 8.3 44.8 3.0 60 422 A S G < S+ 0 0 87 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.652 99.5 60.4 -71.6 -12.0 7.0 41.3 2.2 61 423 A L G X S+ 0 0 24 -3,-1.8 3,-2.2 -4,-0.4 -1,-0.3 0.328 70.4 130.5 -97.6 6.6 4.4 42.0 4.9 62 424 A R T < + 0 0 94 -3,-1.4 93,-0.2 1,-0.3 92,-0.1 -0.322 67.8 39.7 -57.9 143.9 2.8 45.0 3.3 63 425 A G T 3 S+ 0 0 49 91,-2.7 2,-0.3 1,-0.4 -1,-0.3 0.136 106.7 83.7 99.2 -20.2 -1.0 44.4 3.2 64 426 A K S < S- 0 0 97 -3,-2.2 2,-0.4 90,-0.2 -1,-0.4 -0.808 83.9-115.0-114.3 156.3 -0.9 42.9 6.6 65 427 A V E -e 97 0C 0 31,-2.5 33,-3.0 -2,-0.3 2,-0.4 -0.754 36.9-156.1 -86.3 136.7 -0.9 44.5 10.1 66 428 A V E -eF 98 152C 5 86,-2.7 86,-3.4 -2,-0.4 2,-0.6 -0.968 12.8-163.0-124.7 128.3 2.4 43.8 11.8 67 429 A L E -eF 99 151C 0 31,-2.4 33,-2.6 -2,-0.4 2,-0.6 -0.936 6.8-159.0-109.7 118.6 3.1 43.7 15.5 68 430 A I E -eF 100 150C 0 82,-2.9 82,-2.1 -2,-0.6 2,-0.5 -0.877 12.4-170.1 -95.7 121.4 6.8 43.9 16.5 69 431 A D E -eF 101 149C 1 31,-2.8 33,-1.7 -2,-0.6 2,-0.5 -0.949 9.4-153.5-118.8 113.9 7.2 42.6 20.0 70 432 A F E +eF 102 148C 0 78,-3.1 78,-1.0 -2,-0.5 2,-0.3 -0.737 32.2 149.2 -87.2 128.9 10.5 43.0 21.8 71 433 A W E -e 103 0C 0 31,-2.3 33,-1.7 -2,-0.5 2,-0.3 -0.915 39.7-148.1-150.2 173.9 11.2 40.3 24.4 72 434 A A > - 0 0 0 -2,-0.3 3,-1.4 31,-0.2 6,-0.2 -0.960 27.8-130.4-144.8 130.3 13.8 38.2 26.3 73 435 A Y T 3 S+ 0 0 5 -2,-0.3 230,-0.2 1,-0.3 -1,-0.0 0.772 105.3 47.3 -61.4 -27.8 12.8 34.7 27.4 74 436 A S T 3 S+ 0 0 2 228,-0.1 2,-0.5 33,-0.1 -1,-0.3 0.518 84.8 111.9 -90.1 -3.4 14.0 35.0 31.0 75 437 A C <> - 0 0 2 -3,-1.4 4,-2.4 1,-0.2 -3,-0.2 -0.577 56.4-157.3 -72.5 117.1 12.3 38.4 31.4 76 438 A I H > S+ 0 0 4 -2,-0.5 4,-1.9 2,-0.2 5,-0.2 0.880 93.0 54.1 -64.5 -38.0 9.4 38.0 33.9 77 439 A N H > S+ 0 0 6 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.930 111.3 46.6 -60.8 -44.1 7.5 41.1 32.5 78 440 A C H > S+ 0 0 1 1,-0.2 4,-3.1 2,-0.2 -2,-0.2 0.887 107.5 56.9 -64.6 -40.2 7.8 39.6 29.0 79 441 A Q H < S+ 0 0 49 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.870 110.6 44.1 -59.9 -36.1 6.6 36.2 30.3 80 442 A R H < S+ 0 0 38 -4,-1.9 4,-0.3 -5,-0.1 119,-0.2 0.831 117.2 46.0 -77.1 -31.6 3.5 37.9 31.7 81 443 A A H >X S+ 0 0 4 -4,-1.8 3,-1.4 -5,-0.2 4,-1.2 0.862 98.0 69.4 -79.4 -38.3 2.9 39.9 28.5 82 444 A I H 3X S+ 0 0 0 -4,-3.1 4,-3.2 1,-0.3 5,-0.3 0.823 87.0 63.8 -54.4 -37.6 3.5 37.2 25.9 83 445 A P H 3> S+ 0 0 58 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.859 104.0 51.5 -57.5 -30.0 0.3 35.2 26.6 84 446 A H H <> S+ 0 0 10 -3,-1.4 4,-1.8 -4,-0.3 -2,-0.2 0.903 111.1 46.2 -70.8 -40.3 -1.6 38.3 25.4 85 447 A V H X S+ 0 0 0 -4,-1.2 4,-2.7 2,-0.2 -1,-0.2 0.901 111.5 51.4 -67.9 -41.6 0.5 38.5 22.2 86 448 A V H X S+ 0 0 14 -4,-3.2 4,-2.6 1,-0.2 5,-0.2 0.885 108.8 52.9 -61.3 -39.2 -0.0 34.7 21.6 87 449 A G H X S+ 0 0 6 -4,-1.8 4,-2.2 -5,-0.3 -1,-0.2 0.899 109.8 47.3 -64.0 -40.9 -3.7 35.3 22.1 88 450 A W H X S+ 0 0 2 -4,-1.8 4,-2.9 2,-0.2 5,-0.3 0.918 111.6 50.6 -66.7 -43.1 -3.7 38.0 19.5 89 451 A Y H X S+ 0 0 40 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.945 113.1 45.1 -59.8 -49.2 -1.7 35.9 17.0 90 452 A Q H < S+ 0 0 122 -4,-2.6 4,-0.3 1,-0.2 -1,-0.2 0.889 118.2 44.3 -63.2 -38.7 -4.1 33.0 17.4 91 453 A A H < S+ 0 0 30 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.839 127.6 23.9 -75.8 -32.7 -7.2 35.2 17.1 92 454 A Y H >X>S+ 0 0 0 -4,-2.9 3,-2.6 -5,-0.2 5,-1.9 0.526 85.8 98.6-114.9 -7.7 -6.1 37.4 14.2 93 455 A K G ><5S+ 0 0 73 -4,-2.4 3,-1.0 -5,-0.3 -3,-0.1 0.901 92.9 46.0 -48.7 -44.1 -3.5 35.6 12.1 94 456 A D G 345S+ 0 0 145 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.443 108.8 57.2 -81.2 2.9 -6.2 34.6 9.6 95 457 A S G <45S- 0 0 17 -3,-2.6 -1,-0.2 2,-0.1 -2,-0.2 0.384 132.9 -76.7-109.8 -1.4 -7.6 38.1 9.6 96 458 A G T <<5S+ 0 0 15 -3,-1.0 -31,-2.5 -4,-0.7 2,-0.5 0.506 84.9 134.1 120.4 7.1 -4.4 39.8 8.5 97 459 A L E < -e 65 0C 2 -5,-1.9 2,-0.4 -33,-0.2 -1,-0.3 -0.773 27.9-174.8 -95.8 130.2 -2.2 40.0 11.6 98 460 A A E -e 66 0C 13 -33,-3.0 -31,-2.4 -2,-0.5 2,-0.4 -0.939 8.0-163.1-116.2 141.2 1.5 39.1 11.4 99 461 A V E -e 67 0C 2 -2,-0.4 2,-0.4 -33,-0.2 -31,-0.2 -0.987 8.2-171.7-127.8 137.5 3.6 39.1 14.6 100 462 A I E -e 68 0C 1 -33,-2.6 -31,-2.8 -2,-0.4 2,-0.9 -0.978 11.9-153.6-130.4 118.0 7.3 39.1 14.9 101 463 A G E -eg 69 129C 0 27,-2.8 29,-2.1 -2,-0.4 2,-0.9 -0.811 10.0-156.3 -92.9 103.2 8.9 38.6 18.3 102 464 A V E -eg 70 130C 0 -33,-1.7 -31,-2.3 -2,-0.9 2,-1.0 -0.730 8.1-154.3 -82.0 109.3 12.3 40.3 18.2 103 465 A H E -eg 71 131C 0 27,-2.5 29,-2.4 -2,-0.9 -31,-0.2 -0.758 15.3-179.4 -90.2 99.2 14.3 38.5 20.9 104 466 A T - 0 0 0 -33,-1.7 29,-0.1 -2,-1.0 7,-0.1 -0.902 27.1-129.8-100.9 111.5 16.9 41.0 22.1 105 467 A P - 0 0 1 0, 0.0 -33,-0.1 0, 0.0 3,-0.1 -0.312 22.3-169.6 -66.0 139.4 18.9 39.2 24.8 106 468 A E S S+ 0 0 23 1,-0.1 2,-0.3 -2,-0.1 -34,-0.0 0.724 79.1 36.1 -93.9 -31.3 19.6 40.8 28.2 107 469 A Y S > S- 0 0 11 1,-0.1 3,-1.3 0, 0.0 4,-0.2 -0.849 84.9-114.6-123.0 159.4 22.1 38.0 29.1 108 470 A A G > S+ 0 0 54 -2,-0.3 3,-2.0 1,-0.3 4,-0.3 0.873 114.6 59.0 -58.6 -39.8 24.8 36.0 27.2 109 471 A F G > S+ 0 0 21 1,-0.3 3,-0.8 2,-0.2 -1,-0.3 0.705 95.5 65.5 -64.8 -18.1 22.9 32.8 27.8 110 472 A E G < S+ 0 0 0 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.515 87.5 68.9 -81.3 -5.3 19.9 34.3 26.0 111 473 A K G < S+ 0 0 73 -3,-2.0 -1,-0.2 -4,-0.2 -2,-0.2 0.599 74.6 103.5 -85.8 -11.8 21.9 34.4 22.8 112 474 A V X> - 0 0 62 -3,-0.8 4,-2.0 -4,-0.3 3,-1.0 -0.616 68.4-145.7 -76.8 113.9 21.8 30.6 22.5 113 475 A P H 3> S+ 0 0 42 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.854 96.7 51.9 -43.8 -49.0 19.3 29.6 19.9 114 476 A G H 3> S+ 0 0 7 731,-0.4 4,-1.9 1,-0.2 5,-0.1 0.830 107.6 50.8 -62.0 -36.0 18.2 26.4 21.8 115 477 A N H <> S+ 0 0 21 -3,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.924 111.8 47.8 -68.4 -42.8 17.6 28.3 25.0 116 478 A V H X S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.2 5,-0.2 0.928 110.1 52.9 -61.9 -45.0 15.4 30.8 23.3 117 479 A A H X S+ 0 0 24 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.895 110.4 46.7 -58.2 -42.4 13.5 28.0 21.5 118 480 A K H X S+ 0 0 102 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.860 112.2 50.7 -69.0 -34.9 12.8 26.3 24.7 119 481 A G H X S+ 0 0 9 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.913 111.5 48.1 -68.1 -41.1 11.7 29.5 26.3 120 482 A A H X>S+ 0 0 4 -4,-2.9 5,-2.2 2,-0.2 4,-0.6 0.905 108.9 53.4 -65.0 -42.2 9.4 30.2 23.4 121 483 A A H ><5S+ 0 0 70 -4,-2.4 3,-1.3 1,-0.2 -1,-0.2 0.934 107.4 51.6 -59.2 -45.3 7.9 26.7 23.6 122 484 A N H 3<5S+ 0 0 145 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.823 111.8 47.5 -60.3 -31.8 7.1 27.2 27.3 123 485 A L H 3<5S- 0 0 32 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.453 112.9-117.8 -90.0 -2.5 5.3 30.4 26.4 124 486 A G T <<5 + 0 0 39 -3,-1.3 2,-0.5 -4,-0.6 -3,-0.2 0.763 53.5 164.2 72.5 25.8 3.4 28.9 23.5 125 487 A I < + 0 0 11 -5,-2.2 -1,-0.2 1,-0.2 -2,-0.1 -0.655 13.4 158.2 -80.2 121.1 4.9 31.2 20.9 126 488 A S + 0 0 59 -2,-0.5 -1,-0.2 2,-0.1 3,-0.1 0.357 45.9 97.5-121.1 0.6 4.4 29.9 17.4 127 489 A Y S S- 0 0 0 1,-0.2 -27,-0.1 -29,-0.0 -77,-0.1 -0.473 90.9 -69.3 -87.3 162.1 4.9 33.2 15.5 128 490 A P - 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