==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE/SIGNALING PROTEIN 13-AUG-04 1X75 . COMPND 2 MOLECULE: DNA GYRASE SUBUNIT A; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.H.DAO-THI,L.VAN MELDEREN,E.DE GENST,L.WYNS,R.LORIS . 450 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20549.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 321 71.3 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 . 64 14.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 22 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 36.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 1 0 0 0 4 0 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 2 2 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 . 2 9 4 3 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 . 0 3 0 1 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 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 1 363 A T > 0 0 145 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -30.4 16.9 30.6 6.3 2 364 A R H > + 0 0 84 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.908 360.0 50.4 -66.4 -41.7 17.9 33.0 8.9 3 365 A R H >> S+ 0 0 79 1,-0.2 4,-2.7 2,-0.2 3,-0.6 0.964 106.3 54.2 -60.7 -54.0 19.6 30.2 10.9 4 366 A T H 3> S+ 0 0 35 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.888 107.2 50.1 -45.7 -53.4 21.6 29.0 7.8 5 367 A I H 3X S+ 0 0 110 -4,-1.7 4,-1.9 2,-0.2 -1,-0.3 0.861 111.6 49.6 -55.8 -39.7 23.1 32.3 7.1 6 368 A F H X S+ 0 0 23 -4,-1.8 4,-2.3 2,-0.2 3,-1.0 0.985 102.8 52.2 -67.4 -57.7 43.4 28.7 9.3 20 382 A A H 3X S+ 0 0 0 -4,-1.5 4,-2.1 1,-0.3 -1,-0.2 0.805 111.0 48.3 -47.6 -35.6 46.0 31.0 10.8 21 383 A L H 3X S+ 0 0 0 -4,-1.1 4,-1.7 2,-0.2 -1,-0.3 0.819 108.9 52.3 -77.2 -30.6 46.9 28.3 13.3 22 384 A A H < S+ 0 0 5 -4,-2.1 3,-0.6 -5,-0.3 7,-0.2 0.875 111.0 44.0 -59.3 -37.3 51.4 28.9 12.0 25 387 A L H >< S+ 0 0 14 -4,-1.7 3,-0.6 1,-0.2 -1,-0.3 0.697 102.8 66.7 -81.0 -17.2 52.0 25.2 12.5 26 388 A A H 3< S+ 0 0 49 -4,-0.6 -1,-0.2 -3,-0.3 -2,-0.2 0.609 121.1 18.3 -76.9 -12.6 53.0 24.9 8.8 27 389 A N T + 0 0 28 -3,-0.6 4,-4.1 2,-0.2 5,-0.4 0.902 66.7 64.8 -63.3 -48.4 56.7 27.1 13.3 29 391 A D H > S+ 0 0 96 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.921 110.2 38.6 -42.1 -59.4 60.5 27.2 13.2 30 392 A P H > S+ 0 0 58 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.827 117.0 51.5 -63.8 -34.0 60.4 30.7 11.5 31 393 A I H X S+ 0 0 4 -4,-1.4 4,-3.0 -7,-0.2 5,-0.2 0.950 111.4 47.3 -66.5 -49.7 57.4 31.8 13.7 32 394 A I H X S+ 0 0 12 -4,-4.1 4,-3.4 1,-0.2 5,-0.3 0.959 112.6 49.4 -55.2 -50.5 59.2 30.8 16.8 33 395 A E H < S+ 0 0 59 -4,-2.5 4,-0.4 -5,-0.4 -1,-0.2 0.915 111.6 49.8 -55.8 -45.0 62.4 32.6 15.7 34 396 A L H >X S+ 0 0 38 -4,-2.3 3,-0.8 1,-0.2 4,-0.7 0.946 116.0 41.8 -60.3 -48.7 60.4 35.7 14.9 35 397 A I H >< S+ 0 0 0 -4,-3.0 3,-1.2 1,-0.2 199,-0.3 0.929 108.9 54.6 -67.0 -48.6 58.7 35.7 18.3 36 398 A R T 3< S+ 0 0 64 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.544 113.3 48.2 -68.1 1.9 61.6 34.8 20.5 37 399 A H T <4 S+ 0 0 132 -3,-0.8 -1,-0.3 -4,-0.4 -2,-0.2 0.545 87.5 96.1-111.3 -17.8 63.3 37.8 18.8 38 400 A A S << S- 0 0 10 -3,-1.2 196,-2.6 -4,-0.7 197,-0.1 -0.592 70.4-142.9 -75.3 134.1 60.5 40.3 19.2 39 401 A P S S+ 0 0 67 0, 0.0 196,-4.4 0, 0.0 197,-0.4 0.837 82.2 14.5 -66.3 -30.5 61.1 42.4 22.3 40 402 A T S > S- 0 0 40 194,-0.2 4,-2.7 195,-0.2 3,-0.4 -0.967 76.0-112.8-144.7 159.5 57.4 42.4 23.0 41 403 A P H > S+ 0 0 16 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.969 116.7 57.5 -52.4 -55.8 54.2 40.7 22.0 42 404 A A H > S+ 0 0 63 1,-0.3 4,-1.4 2,-0.2 5,-0.1 0.823 110.9 43.2 -45.3 -40.7 53.0 43.9 20.3 43 405 A E H > S+ 0 0 90 -3,-0.4 4,-2.8 2,-0.2 -1,-0.3 0.911 111.3 52.8 -73.0 -43.5 56.1 43.9 18.1 44 406 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.856 107.8 54.6 -59.9 -33.3 55.9 40.1 17.4 45 407 A K H X S+ 0 0 32 -4,-2.9 4,-1.7 -5,-0.2 -1,-0.2 0.909 108.7 46.5 -66.8 -43.3 52.3 40.7 16.4 46 408 A T H X S+ 0 0 92 -4,-1.4 4,-2.8 -5,-0.3 3,-0.3 0.961 110.6 52.2 -63.0 -51.9 53.3 43.4 13.8 47 409 A A H X S+ 0 0 37 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.893 107.0 56.4 -51.3 -41.4 56.1 41.3 12.5 48 410 A L H < S+ 0 0 0 -4,-2.0 37,-0.4 -5,-0.2 -1,-0.2 0.897 113.0 35.6 -61.0 -45.5 53.6 38.5 12.0 49 411 A V H < S+ 0 0 47 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.857 108.8 70.7 -77.0 -32.8 51.1 40.3 9.8 50 412 A A H < S+ 0 0 72 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.919 100.5 39.9 -47.5 -59.9 53.9 42.2 8.1 51 413 A N S < S- 0 0 32 -4,-1.6 34,-0.2 -5,-0.1 -1,-0.1 -0.846 83.5-125.7-106.3 134.6 55.3 39.3 6.1 52 414 A P - 0 0 66 0, 0.0 2,-0.3 0, 0.0 32,-0.2 -0.057 22.9-135.0 -64.2 165.2 53.3 36.5 4.3 53 415 A W E -A 83 0A 30 30,-1.5 30,-2.7 2,-0.0 2,-0.2 -0.943 14.5-110.7-131.9 150.9 53.7 32.8 4.8 54 416 A Q E A 82 0A 66 -2,-0.3 28,-0.2 28,-0.2 -28,-0.1 -0.539 360.0 360.0 -74.6 141.3 53.9 29.6 2.7 55 417 A L 0 0 43 26,-0.7 3,-1.4 -2,-0.2 4,-0.2 -0.174 360.0 360.0 -76.8 360.0 50.8 27.4 3.1 56 ! 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 57 420 A V > 0 0 48 0, 0.0 4,-3.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -3.9 47.9 23.2 4.2 58 421 A A T 4 + 0 0 54 -3,-1.4 23,-0.0 2,-0.2 -4,-0.0 0.905 360.0 49.2 -60.9 -47.3 47.4 24.5 0.7 59 422 A A T >4 S+ 0 0 92 1,-0.2 3,-1.2 -4,-0.2 -1,-0.2 0.975 117.1 41.7 -55.8 -57.7 45.8 21.3 -0.6 60 423 A M T 34 S+ 0 0 38 1,-0.3 2,-0.4 2,-0.0 -2,-0.2 0.905 99.9 74.8 -53.5 -47.6 43.4 21.2 2.3 61 424 A L T 3< 0 0 26 -4,-3.1 -1,-0.3 -6,-0.1 -2,-0.2 0.300 360.0 360.0 -53.5 9.8 42.9 25.0 2.1 62 425 A E < 0 0 131 -3,-1.2 3,-0.1 -2,-0.4 -3,-0.1 -0.317 360.0 360.0 -54.2 360.0 40.7 24.4 -1.0 63 ! 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 64 429 A D 0 0 140 0, 0.0 3,-0.2 0, 0.0 57,-0.0 0.000 360.0 360.0 360.0 109.9 36.4 26.9 -2.6 65 430 A D + 0 0 132 1,-0.1 -3,-0.1 -3,-0.1 0, 0.0 -0.363 360.0 93.4-116.3 47.7 36.7 30.6 -1.7 66 431 A A + 0 0 15 1,-0.1 -1,-0.1 51,-0.1 -54,-0.1 0.524 57.5 76.1-120.1 -8.0 33.9 30.5 0.8 67 432 A A S S+ 0 0 12 -3,-0.2 -51,-0.1 2,-0.1 -1,-0.1 0.472 78.5 98.5 -82.8 -1.1 35.5 29.8 4.2 68 433 A R S S- 0 0 63 1,-0.1 -55,-0.1 -53,-0.1 -56,-0.1 -0.743 84.0-104.2 -94.3 135.1 36.5 33.5 4.3 69 434 A P > - 0 0 4 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.162 18.4-128.2 -53.2 138.4 34.5 36.1 6.2 70 435 A E T 3 S+ 0 0 103 1,-0.3 -2,-0.0 -4,-0.1 -61,-0.0 0.747 114.7 51.4 -61.0 -20.8 32.4 38.5 4.2 71 436 A W T 3 S+ 0 0 127 2,-0.1 2,-0.4 0, 0.0 -1,-0.3 0.533 78.8 121.2 -92.6 -9.2 34.2 41.2 6.2 72 437 A L < - 0 0 17 -3,-1.7 -4,-0.0 1,-0.1 4,-0.0 -0.419 68.1-122.9 -61.5 114.4 37.7 39.9 5.4 73 438 A E > - 0 0 110 -2,-0.4 3,-1.1 1,-0.1 -1,-0.1 -0.110 17.1-118.0 -53.1 155.9 39.5 42.7 3.6 74 439 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.584 112.0 67.7 -74.1 -12.0 40.8 41.8 0.1 75 440 A E T 3 S+ 0 0 81 4,-0.0 2,-0.3 0, 0.0 4,-0.1 0.528 96.3 69.8 -84.5 -6.8 44.4 42.4 1.4 76 441 A F S < S+ 0 0 71 -3,-1.1 2,-0.2 2,-0.1 9,-0.2 -0.770 78.9 28.7-114.8 158.3 44.1 39.4 3.7 77 442 A G E S-B 84 0A 8 7,-2.2 7,-1.9 -2,-0.3 2,-0.8 -0.643 107.5 -8.1 99.9-159.7 44.0 35.7 3.2 78 443 A V E +B 83 0A 66 -2,-0.2 2,-0.3 5,-0.2 5,-0.2 -0.686 66.7 163.7 -79.7 111.4 45.5 33.5 0.5 79 444 A R S S- 0 0 55 3,-2.4 -1,-0.1 -2,-0.8 -2,-0.1 -0.690 71.4 -16.8-133.2 81.1 46.8 36.0 -2.1 80 445 A D S S- 0 0 161 -2,-0.3 3,-0.1 1,-0.1 -1,-0.1 0.853 122.5 -52.0 91.0 48.8 49.2 34.3 -4.5 81 446 A G S S+ 0 0 48 1,-0.2 -26,-0.7 -27,-0.0 2,-0.3 0.523 121.3 98.3 70.4 4.6 50.2 31.1 -2.8 82 447 A L E S-A 54 0A 74 -28,-0.2 -3,-2.4 -27,-0.1 2,-0.4 -0.926 70.1-129.5-123.4 150.2 51.1 33.1 0.3 83 448 A Y E -AB 53 78A 5 -30,-2.7 -30,-1.5 -2,-0.3 2,-0.7 -0.844 10.7-157.5-104.1 134.0 49.0 33.8 3.4 84 449 A Y E - B 0 77A 29 -7,-1.9 -7,-2.2 -2,-0.4 -35,-0.1 -0.906 17.4-145.5-113.0 106.1 48.4 37.2 4.8 85 450 A L - 0 0 3 -2,-0.7 2,-0.2 -37,-0.4 3,-0.0 -0.370 6.4-133.2 -70.8 144.5 47.5 37.2 8.5 86 451 A T > - 0 0 10 1,-0.1 4,-1.9 -2,-0.1 5,-0.2 -0.470 29.1-110.3 -87.1 166.6 45.0 39.6 10.1 87 452 A E H > S+ 0 0 137 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.891 120.8 55.5 -66.4 -35.3 46.1 41.3 13.3 88 453 A Q H > S+ 0 0 93 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.840 107.1 48.7 -65.5 -35.1 43.4 39.2 15.0 89 454 A Q H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.885 106.5 55.3 -72.3 -40.3 44.9 35.9 13.7 90 455 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.892 105.3 54.9 -58.9 -40.0 48.4 36.8 14.8 91 456 A Q H X S+ 0 0 4 -4,-1.8 4,-1.7 1,-0.2 3,-0.4 0.962 104.7 52.7 -57.4 -52.3 47.0 37.3 18.3 92 457 A A H < S+ 0 0 12 -4,-1.6 4,-0.4 1,-0.3 -1,-0.2 0.857 108.9 49.8 -51.6 -41.5 45.6 33.8 18.2 93 458 A I H >< S+ 0 0 2 -4,-1.9 3,-0.9 1,-0.2 136,-0.3 0.866 108.9 52.4 -67.1 -36.0 49.0 32.4 17.2 94 459 A L H 3< S+ 0 0 0 -4,-2.1 136,-2.6 -3,-0.4 137,-0.3 0.791 106.9 54.1 -69.7 -25.9 50.6 34.4 20.1 95 460 A D T 3< S+ 0 0 17 -4,-1.7 -1,-0.2 134,-0.2 -2,-0.2 0.482 82.1 123.1 -85.5 -7.0 48.1 32.8 22.5 96 461 A L < - 0 0 8 -3,-0.9 133,-2.4 -4,-0.4 2,-0.5 -0.290 59.6-131.7 -61.5 139.9 48.9 29.3 21.6 97 462 A R B > -C 228 0B 4 131,-0.2 3,-3.5 1,-0.1 131,-0.2 -0.800 17.0-124.1 -94.5 127.8 50.0 26.9 24.3 98 463 A L G > S+ 0 0 5 129,-2.4 3,-3.2 -2,-0.5 4,-0.2 0.802 108.6 67.0 -34.4 -47.0 53.2 24.9 23.6 99 464 A Q G > S+ 0 0 1 126,-2.3 3,-2.2 1,-0.3 -1,-0.3 0.803 86.4 70.8 -49.8 -30.4 51.3 21.6 24.2 100 465 A K G < S+ 0 0 13 -3,-3.5 -1,-0.3 1,-0.3 -2,-0.2 0.554 86.6 68.8 -65.5 -4.2 49.3 22.4 21.1 101 466 A L G < S+ 0 0 11 -3,-3.2 -1,-0.3 -4,-0.2 -2,-0.2 0.506 75.3 108.2 -90.6 -8.8 52.5 21.6 19.2 102 467 A T S <> S- 0 0 0 -3,-2.2 4,-1.9 -4,-0.2 5,-0.1 -0.243 82.5-109.7 -65.6 161.4 52.4 18.0 20.1 103 468 A G H > S+ 0 0 33 65,-2.8 4,-1.7 62,-0.3 3,-0.5 0.963 115.2 43.9 -57.6 -61.4 51.5 15.6 17.2 104 469 A L H > S+ 0 0 44 65,-4.1 4,-1.4 1,-0.2 -1,-0.2 0.834 115.5 52.4 -55.7 -33.1 48.0 14.5 18.3 105 470 A E H > S+ 0 0 25 64,-0.4 4,-1.0 -6,-0.2 -1,-0.2 0.839 103.1 55.8 -72.3 -35.3 47.2 18.1 19.0 106 471 A H H X S+ 0 0 55 -4,-1.9 4,-1.7 -3,-0.5 3,-0.4 0.896 108.7 49.6 -62.6 -40.4 48.4 19.4 15.6 107 472 A E H X S+ 0 0 61 -4,-1.7 4,-2.8 1,-0.2 -1,-0.2 0.846 99.8 62.3 -67.9 -38.3 45.9 17.0 14.0 108 473 A K H X S+ 0 0 86 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.811 106.4 48.5 -59.4 -30.3 42.9 18.0 16.1 109 474 A L H X S+ 0 0 11 -4,-1.0 4,-3.0 -3,-0.4 5,-0.3 0.965 110.9 47.3 -71.8 -56.0 43.3 21.5 14.6 110 475 A L H X S+ 0 0 38 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.863 113.5 52.2 -53.2 -37.0 43.5 20.3 11.0 111 476 A D H X S+ 0 0 86 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.944 110.6 43.2 -66.3 -51.3 40.5 18.1 11.7 112 477 A E H X S+ 0 0 57 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.928 113.4 54.1 -61.5 -43.4 38.2 20.7 13.1 113 478 A Y H X S+ 0 0 6 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.932 110.1 46.6 -53.7 -49.5 39.4 23.1 10.3 114 479 A K H X S+ 0 0 60 -4,-2.2 4,-1.4 -5,-0.3 -1,-0.2 0.852 110.2 53.4 -63.6 -35.9 38.4 20.5 7.7 115 480 A E H X S+ 0 0 105 -4,-2.1 4,-2.4 2,-0.2 3,-0.4 0.946 108.8 49.3 -65.0 -47.8 35.1 19.8 9.4 116 481 A L H X S+ 0 0 9 -4,-2.9 4,-3.1 1,-0.3 5,-0.3 0.919 108.2 53.1 -56.1 -45.4 34.3 23.5 9.3 117 482 A L H X S+ 0 0 27 -4,-2.3 4,-1.0 1,-0.2 -1,-0.3 0.830 109.3 51.5 -60.4 -30.0 35.2 23.7 5.6 118 483 A D H X S+ 0 0 109 -4,-1.4 4,-1.9 -3,-0.4 -2,-0.2 0.927 111.8 43.9 -70.4 -47.2 32.8 20.8 5.1 119 484 A Q H X S+ 0 0 90 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.927 110.1 55.1 -63.0 -48.2 29.9 22.5 6.9 120 485 A I H X S+ 0 0 3 -4,-3.1 4,-0.9 1,-0.2 -1,-0.2 0.834 107.2 54.9 -54.4 -32.6 30.6 25.8 5.1 121 486 A A H >X S+ 0 0 39 -4,-1.0 4,-1.9 -5,-0.3 3,-0.6 0.962 111.6 39.1 -66.2 -55.3 30.3 23.8 1.9 122 487 A E H 3X S+ 0 0 74 -4,-1.9 4,-2.9 1,-0.2 5,-0.2 0.823 108.4 62.5 -66.7 -33.3 26.8 22.3 2.6 123 488 A L H 3X S+ 0 0 28 -4,-3.0 4,-1.1 1,-0.2 -1,-0.2 0.831 108.1 46.0 -62.0 -28.2 25.6 25.6 4.1 124 489 A L H > 0 0 132 0, 0.0 4,-1.4 0, 0.0 3,-0.9 0.000 360.0 360.0 360.0 138.5 54.4 33.1 64.1 132 364 B R H 3> + 0 0 107 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.966 360.0 69.6 -53.8 -48.3 52.3 30.8 61.9 133 365 B R H 3> S+ 0 0 65 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.805 100.0 46.2 -34.6 -46.3 51.7 33.9 59.9 134 366 B T H <> S+ 0 0 13 -3,-0.9 4,-2.4 2,-0.2 -1,-0.2 0.944 111.4 47.7 -67.2 -52.9 55.3 33.9 58.8 135 367 B I H X S+ 0 0 66 -4,-1.4 4,-3.1 -3,-0.3 5,-0.3 0.894 108.7 56.2 -56.1 -42.3 55.6 30.2 57.9 136 368 B F H X S+ 0 0 126 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.914 109.1 47.4 -56.0 -44.4 52.4 30.6 55.9 137 369 B E H X S+ 0 0 72 -4,-1.5 4,-2.2 -5,-0.3 -2,-0.2 0.914 111.9 50.3 -63.4 -43.5 54.1 33.4 54.0 138 370 B L H X S+ 0 0 10 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.968 110.6 47.5 -58.8 -57.1 57.2 31.3 53.5 139 371 B R H X S+ 0 0 165 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.869 111.7 52.5 -51.7 -42.5 55.4 28.2 52.1 140 372 B K H X S+ 0 0 54 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.919 111.8 43.7 -62.1 -48.4 53.4 30.4 49.8 141 373 B A H X S+ 0 0 6 -4,-2.2 4,-3.2 2,-0.2 5,-0.2 0.904 113.5 52.0 -65.8 -41.7 56.4 32.1 48.3 142 374 B R H X S+ 0 0 33 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.942 111.2 46.5 -57.4 -54.2 58.3 28.8 47.9 143 375 B D H X S+ 0 0 53 -4,-2.4 4,-1.1 -5,-0.2 -1,-0.2 0.903 115.1 47.4 -52.8 -49.0 55.4 27.2 46.1 144 376 B R H >X S+ 0 0 27 -4,-2.0 4,-1.4 1,-0.2 3,-0.8 0.955 113.5 46.0 -60.5 -55.0 55.0 30.2 43.8 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392 B P H > S+ 0 0 64 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.869 116.8 51.3 -68.0 -33.4 65.5 21.5 22.8 161 393 B I H X S+ 0 0 4 -4,-1.6 4,-3.3 -7,-0.2 5,-0.2 0.965 111.1 48.3 -63.3 -51.8 62.2 21.8 24.8 162 394 B I H X S+ 0 0 12 -4,-3.9 4,-3.9 1,-0.2 5,-0.3 0.949 112.1 48.2 -51.5 -53.9 60.4 22.8 21.6 163 395 B E H < S+ 0 0 54 -4,-2.5 4,-0.5 -5,-0.3 -1,-0.2 0.898 111.7 50.7 -57.4 -40.9 61.9 20.0 19.7 164 396 B L H >X S+ 0 0 32 -4,-2.4 3,-0.8 2,-0.2 4,-0.6 0.956 116.7 40.4 -61.3 -50.4 61.0 17.6 22.5 165 397 B I H >< S+ 0 0 0 -4,-3.3 3,-1.8 1,-0.2 -62,-0.3 0.952 109.7 56.5 -64.6 -50.7 57.4 18.8 22.5 166 398 B R T 3< S+ 0 0 69 -4,-3.9 -1,-0.2 1,-0.3 -2,-0.2 0.556 113.0 44.9 -62.4 -3.0 56.9 19.1 18.7 167 399 B H T <4 S+ 0 0 136 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.472 88.3 98.5-115.5 -8.3 57.9 15.5 18.5 168 400 B A << - 0 0 9 -3,-1.8 -65,-2.8 -4,-0.6 -64,-0.1 -0.648 68.6-142.5 -80.9 136.4 55.8 14.0 21.3 169 401 B P S S+ 0 0 65 0, 0.0 -65,-4.1 0, 0.0 -64,-0.4 0.874 81.7 16.1 -65.5 -35.5 52.6 12.5 20.0 170 402 B T S > S- 0 0 44 -67,-0.2 4,-2.7 -66,-0.2 5,-0.2 -0.952 75.0-115.1-140.0 158.1 50.7 13.8 23.0 171 403 B P H > S+ 0 0 17 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.946 116.2 58.5 -54.7 -48.2 51.0 16.2 25.8 172 404 B A H > S+ 0 0 61 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.907 110.1 42.9 -47.6 -48.5 51.0 13.3 28.3 173 405 B E H > S+ 0 0 93 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.925 111.0 53.5 -66.3 -44.6 54.1 11.9 26.6 174 406 B A H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.897 108.1 53.1 -55.8 -39.4 55.7 15.3 26.2 175 407 B K H X S+ 0 0 27 -4,-3.1 4,-1.7 2,-0.2 -1,-0.2 0.893 108.9 47.7 -62.9 -43.8 55.2 15.7 30.0 176 408 B T H X S+ 0 0 88 -4,-1.7 4,-2.7 -5,-0.2 3,-0.3 0.964 111.0 51.6 -61.0 -53.3 56.9 12.4 30.7 177 409 B A H X S+ 0 0 31 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.900 107.4 55.3 -49.3 -47.6 59.8 13.3 28.4 178 410 B L H < S+ 0 0 0 -4,-2.4 38,-0.4 1,-0.2 -1,-0.2 0.874 113.3 36.7 -56.5 -46.7 60.2 16.6 30.3 179 411 B V H < S+ 0 0 42 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.846 109.1 68.6 -77.7 -32.1 60.6 15.2 33.8 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422 B A H 34 S+ 0 0 76 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.734 109.7 59.0 -59.7 -25.4 73.8 31.8 39.1 191 423 B M H 34 S+ 0 0 49 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.2 0.874 105.3 48.4 -73.7 -36.6 70.3 33.2 39.8 192 424 B L H << 0 0 36 -4,-2.1 -2,-0.2 -3,-0.7 -1,-0.1 0.966 360.0 360.0 -65.8 -53.3 69.3 30.0 41.6 193 425 B E < 0 0 204 -4,-1.9 3,-0.1 -5,-0.2 -3,-0.0 0.054 360.0 360.0 -41.8 360.0 72.4 29.9 43.8 194 ! 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 0.0 195 429 B D 0 0 136 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 30.3 72.4 27.4 50.9 196 430 B D + 0 0 104 1,-0.1 -3,-0.1 -3,-0.1 -4,-0.0 -0.815 360.0 157.2-103.0 143.1 69.1 27.2 49.1 197 431 B A + 0 0 30 -2,-0.4 -1,-0.1 51,-0.1 4,-0.1 0.217 55.6 90.5-144.8 6.5 65.8 27.9 50.8 198 432 B A + 0 0 18 -6,-0.1 -52,-0.1 2,-0.1 -53,-0.1 0.466 70.0 100.2 -85.0 -0.9 63.5 28.8 47.9 199 433 B R S S- 0 0 63 1,-0.1 -56,-0.1 -54,-0.1 -57,-0.1 -0.738 84.3-102.9 -93.0 135.9 62.6 25.1 47.7 200 434 B P > - 0 0 4 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.142 18.6-128.1 -52.3 137.1 59.3 23.8 49.2 201 435 B E T 3 S+ 0 0 78 1,-0.3 -2,-0.0 -4,-0.1 -62,-0.0 0.751 113.9 51.5 -59.5 -21.4 59.5 22.0 52.5 202 436 B W T 3 S+ 0 0 125 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.477 79.7 117.3 -94.5 -5.6 57.5 19.4 50.7 203 437 B L < - 0 0 16 -3,-1.9 -4,-0.0 1,-0.1 0, 0.0 -0.499 64.5-127.8 -69.4 127.1 59.8 19.0 47.6 204 438 B E > - 0 0 46 -2,-0.3 3,-1.8 1,-0.1 -1,-0.1 -0.385 18.1-115.1 -73.1 151.1 61.3 15.5 47.4 205 439 B P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.627 109.8 69.1 -60.6 -17.9 65.1 15.1 47.1 206 440 B E T 3 S+ 0 0 43 0, 0.0 2,-0.3 0, 0.0 4,-0.1 0.480 97.9 67.9 -82.5 1.3 64.9 13.6 43.6 207 441 B F S < S+ 0 0 67 -3,-1.8 2,-0.2 2,-0.1 9,-0.2 -0.824 80.3 26.3-122.0 158.3 63.8 17.0 42.3 208 442 B G E S-E 215 0C 4 7,-2.5 7,-2.4 -2,-0.3 2,-0.7 -0.613 106.8 -9.6 97.1-157.6 65.2 20.4 41.9 209 443 B V E +E 214 0C 64 5,-0.2 2,-0.3 -2,-0.2 5,-0.2 -0.693 67.9 158.8 -82.5 114.7 68.8 21.3 41.3 210 444 B R S S- 0 0 101 3,-2.8 -2,-0.1 -2,-0.7 -1,-0.0 -0.695 70.3 -8.4-142.7 90.9 70.9 18.3 41.9 211 445 B D S S- 0 0 145 -2,-0.3 3,-0.1 1,-0.1 -1,-0.1 0.820 123.7 -56.8 95.3 42.0 74.4 18.4 40.3 212 446 B G S S+ 0 0 44 1,-0.2 -27,-1.1 -28,-0.1 2,-0.4 0.580 121.1 98.4 69.5 8.4 74.2 21.5 38.2 213 447 B L E -D 184 0C 51 -29,-0.2 -3,-2.8 -5,-0.1 2,-0.5 -0.956 69.6-130.8-129.1 147.4 71.2 20.0 36.5 214 448 B Y E -DE 183 209C 2 -31,-2.4 -31,-1.5 -2,-0.4 2,-0.6 -0.840 10.5-158.9-103.6 129.7 67.5 20.6 37.1 215 449 B Y E - E 0 208C 52 -7,-2.4 -7,-2.5 -2,-0.5 2,-0.1 -0.924 17.4-145.0-109.0 117.2 65.0 17.8 37.6 216 450 B L - 0 0 2 -2,-0.6 2,-0.2 -38,-0.4 3,-0.0 -0.455 6.5-132.0 -80.2 148.5 61.5 19.0 36.9 217 451 B T > - 0 0 12 -2,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.543 30.6-107.7 -90.9 164.4 58.4 17.7 38.8 218 452 B E H > S+ 0 0 117 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.869 122.1 56.5 -58.5 -34.9 55.4 16.6 36.9 219 453 B Q H > S+ 0 0 86 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.872 107.2 45.9 -62.7 -45.4 53.7 19.8 38.1 220 454 B Q H > S+ 0 0 1 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.879 107.4 57.3 -68.5 -40.7 56.4 22.0 36.6 221 455 B A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.916 104.9 53.7 -55.5 -43.5 56.4 20.2 33.3 222 456 B Q H X S+ 0 0 2 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.941 105.1 52.5 -56.8 -50.7 52.7 21.0 33.1 223 457 B A H < S+ 0 0 15 -4,-1.6 4,-0.3 1,-0.3 -1,-0.2 0.864 109.2 50.0 -55.0 -39.6 53.3 24.7 33.6 224 458 B I H >< S+ 0 0 1 -4,-1.9 3,-0.9 1,-0.2 -1,-0.3 0.868 109.6 51.1 -68.2 -35.4 55.8 24.7 30.7 225 459 B L H 3< S+ 0 0 1 -4,-2.1 -126,-2.3 1,-0.2 -125,-0.3 0.828 107.3 54.4 -71.2 -27.1 53.3 22.9 28.5 226 460 B D T 3< S+ 0 0 9 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.461 82.1 123.4 -83.9 -3.7 50.7 25.5 29.3 227 461 B L < - 0 0 9 -3,-0.9 -129,-2.4 -4,-0.3 2,-0.4 -0.310 58.3-134.7 -62.1 138.5 53.0 28.4 28.3 228 462 B R B > -C 97 0B 2 -131,-0.2 3,-3.0 1,-0.1 -131,-0.2 -0.807 18.6-120.4 -97.1 134.9 51.7 30.7 25.6 229 463 B L G > S+ 0 0 7 -133,-2.4 3,-2.6 -2,-0.4 4,-0.2 0.769 108.3 65.9 -39.1 -44.6 54.1 31.6 22.8 230 464 B Q G > S+ 0 0 2 -136,-2.6 3,-1.6 1,-0.3 -1,-0.3 0.725 86.5 71.9 -57.2 -21.9 53.9 35.4 23.5 231 465 B K G < S+ 0 0 12 -3,-3.0 -1,-0.3 -137,-0.3 -2,-0.2 0.507 86.1 69.9 -72.5 0.4 55.6 34.6 26.8 232 466 B L G < S+ 0 0 11 -3,-2.6 -1,-0.3 -4,-0.2 -2,-0.2 0.584 74.5 106.9 -90.9 -14.5 58.7 33.9 24.6 233 467 B T S <> S- 0 0 0 -3,-1.6 4,-1.9 -4,-0.2 5,-0.1 -0.143 83.2-107.9 -61.6 163.9 59.2 37.6 23.7 234 468 B G H > S+ 0 0 37 -196,-2.6 4,-1.8 -199,-0.3 3,-0.4 0.961 115.7 43.3 -58.0 -61.0 62.1 39.5 25.2 235 469 B L H > S+ 0 0 42 -196,-4.4 4,-1.4 1,-0.2 -1,-0.2 0.817 115.1 52.4 -57.6 -32.0 60.2 41.8 27.6 236 470 B E H > S+ 0 0 33 -197,-0.4 4,-1.0 -6,-0.2 -1,-0.2 0.854 104.5 54.8 -72.9 -35.3 58.0 38.8 28.7 237 471 B H H X S+ 0 0 51 -4,-1.9 4,-1.7 -3,-0.4 3,-0.4 0.911 107.6 51.6 -63.5 -40.5 61.0 36.6 29.4 238 472 B E H X S+ 0 0 42 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.843 100.3 59.6 -66.9 -37.9 62.4 39.3 31.8 239 473 B K H X S+ 0 0 88 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.825 106.0 50.3 -63.1 -30.1 59.2 39.7 33.8 240 474 B L H X S+ 0 0 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