==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE/DNA 04-OCT-07 2RGR . COMPND 2 MOLECULE: DNA TOPOISOMERASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR K.C.DONG,J.M.BERGER . 721 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36497.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 504 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 44 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 246 34.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.8 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 3 1 1 0 0 1 6 1 3 1 0 1 0 1 0 1 0 0 0 1 0 1 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 1 1 0 1 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 PARALLEL BRIDGES PER LADDER . 4 2 2 6 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 ANTIPARALLEL BRIDGES PER LADDER . 2 5 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 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 1 419 A R 0 0 259 0, 0.0 2,-0.3 0, 0.0 19,-0.3 0.000 360.0 360.0 360.0 81.6 30.2 17.6 -100.3 2 420 A K - 0 0 50 17,-0.1 2,-0.4 18,-0.1 17,-0.2 -0.982 360.0-128.1-144.3 134.0 28.2 15.7 -97.7 3 421 A S - 0 0 58 15,-1.7 2,-0.5 -2,-0.3 16,-0.0 -0.661 26.0-158.0 -76.6 129.3 25.7 12.9 -97.9 4 422 A R - 0 0 183 -2,-0.4 2,-0.4 14,-0.0 14,-0.1 -0.944 7.0-144.1-112.6 127.0 22.5 13.7 -96.1 5 423 A I + 0 0 42 -2,-0.5 8,-0.1 1,-0.1 78,-0.0 -0.758 24.8 170.4 -93.9 135.9 20.3 10.9 -94.9 6 424 A T + 0 0 112 -2,-0.4 -1,-0.1 1,-0.1 -2,-0.0 0.340 57.4 67.9-135.5 5.5 16.6 11.9 -95.1 7 425 A N S S+ 0 0 120 1,-0.2 -1,-0.1 72,-0.1 -2,-0.0 0.227 89.3 73.3-111.2 10.6 14.2 9.0 -94.5 8 426 A Y > + 0 0 41 1,-0.1 3,-1.0 3,-0.1 -1,-0.2 -0.813 53.4 176.0-131.5 90.9 15.1 8.7 -90.9 9 427 A P T 3 S+ 0 0 123 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.840 76.3 62.2 -62.3 -39.9 13.7 11.5 -88.8 10 428 A K T 3 S+ 0 0 97 45,-0.1 2,-0.6 2,-0.1 43,-0.1 0.594 79.7 105.3 -67.4 -13.0 14.9 10.2 -85.4 11 429 A L < - 0 0 19 -3,-1.0 2,-0.9 43,-0.1 43,-0.2 -0.598 56.9-158.4 -77.3 116.7 18.5 10.4 -86.4 12 430 A E B -A 53 0A 71 41,-1.9 41,-2.4 -2,-0.6 2,-0.3 -0.879 30.6-144.7 -84.0 108.4 20.4 13.3 -84.8 13 431 A D - 0 0 41 -2,-0.9 2,-0.2 39,-0.2 38,-0.1 -0.624 10.3-112.9 -91.4 133.9 23.2 13.4 -87.5 14 432 A A > - 0 0 0 -2,-0.3 3,-1.8 1,-0.2 35,-0.2 -0.417 25.8-129.4 -60.3 124.9 26.8 14.2 -86.8 15 433 A N T 3 S+ 0 0 88 33,-3.3 34,-0.2 36,-0.3 -1,-0.2 0.815 108.0 39.9 -43.7 -37.3 27.6 17.5 -88.5 16 434 A K T > >S+ 0 0 71 33,-2.3 3,-1.4 32,-0.3 5,-0.6 0.494 87.6 117.3 -96.3 -6.6 30.7 15.9 -90.2 17 435 A A T < 5S+ 0 0 0 -3,-1.8 83,-0.2 32,-0.3 82,-0.1 -0.273 76.2 24.7 -61.4 149.5 29.2 12.5 -91.0 18 436 A G T 3 5S+ 0 0 15 81,-0.8 -15,-1.7 1,-0.3 -1,-0.2 0.584 107.9 98.0 71.5 7.6 29.0 11.6 -94.7 19 437 A T T X 5S- 0 0 45 -3,-1.4 3,-2.5 80,-0.3 -1,-0.3 -0.615 102.0 -81.5-114.7 179.6 31.9 14.0 -95.4 20 438 A K T 3 5S+ 0 0 159 -19,-0.3 3,-0.1 1,-0.3 -3,-0.1 0.454 131.0 56.5 -62.1 2.4 35.6 13.3 -95.8 21 439 A E T > < + 0 0 58 -5,-0.6 3,-2.1 1,-0.1 4,-0.3 0.251 66.9 109.5-118.1 8.7 35.6 13.3 -92.0 22 440 A G G X + 0 0 2 -3,-2.5 79,-1.6 1,-0.3 3,-1.3 0.754 70.0 69.3 -55.9 -24.8 33.0 10.5 -91.4 23 441 A Y G 3 S+ 0 0 77 1,-0.3 -1,-0.3 77,-0.3 77,-0.1 0.684 98.6 48.2 -72.4 -17.7 35.9 8.3 -90.3 24 442 A K G < S+ 0 0 104 -3,-2.1 2,-0.5 -8,-0.1 -1,-0.3 0.394 94.9 101.4 -95.4 -1.3 36.4 10.4 -87.1 25 443 A C < - 0 0 0 -3,-1.3 77,-2.1 -4,-0.3 76,-1.4 -0.750 58.3-156.1 -94.3 125.8 32.6 10.3 -86.5 26 444 A T E -bc 51 102A 8 24,-2.6 26,-1.4 -2,-0.5 2,-0.5 -0.774 7.0-146.2 -94.5 141.0 31.1 8.0 -83.9 27 445 A L E -bc 52 103A 0 75,-2.4 77,-3.2 -2,-0.4 2,-0.7 -0.939 9.6-148.4-108.3 122.7 27.5 6.9 -84.0 28 446 A V E -bc 53 104A 3 24,-3.1 26,-2.2 -2,-0.5 2,-0.6 -0.777 10.3-164.4 -94.5 113.1 25.7 6.4 -80.7 29 447 A L E -bc 54 105A 0 75,-3.1 77,-3.3 -2,-0.7 2,-0.3 -0.854 9.2-162.2 -97.8 123.7 23.0 3.6 -80.7 30 448 A T E -bc 55 106A 0 24,-1.7 26,-3.5 -2,-0.6 2,-1.3 -0.743 28.5-110.9-106.0 152.9 20.6 3.6 -77.8 31 449 A E E > S-b 56 0A 44 75,-1.7 4,-0.6 -2,-0.3 26,-0.1 -0.692 88.2 -26.7 -74.6 95.7 18.2 1.0 -76.5 32 450 A G H > S- 0 0 13 24,-2.9 4,-0.9 -2,-1.3 3,-0.5 0.266 80.6 -76.1 82.1 161.4 14.9 2.6 -77.5 33 451 A D H 4 S+ 0 0 69 1,-0.2 4,-0.4 2,-0.2 -1,-0.1 0.740 122.5 62.0 -67.8 -25.7 13.6 6.1 -78.1 34 452 A S H >4 S+ 0 0 110 1,-0.2 3,-0.9 2,-0.2 4,-0.2 0.903 106.2 44.7 -69.8 -39.0 13.4 7.0 -74.4 35 453 A A H >X S+ 0 0 7 -4,-0.6 3,-1.5 -3,-0.5 4,-1.3 0.672 93.4 82.0 -75.9 -20.5 17.2 6.6 -74.0 36 454 A L H 3X S+ 0 0 24 -4,-0.9 4,-1.8 1,-0.3 -1,-0.2 0.743 84.1 62.3 -57.2 -22.9 17.7 8.5 -77.2 37 455 A S H <> S+ 0 0 70 -3,-0.9 4,-2.0 -4,-0.4 -1,-0.3 0.812 98.6 54.3 -71.3 -32.2 17.3 11.6 -75.1 38 456 A L H <> S+ 0 0 26 -3,-1.5 4,-1.6 -4,-0.2 -2,-0.2 0.882 108.1 48.4 -71.2 -39.1 20.4 10.7 -73.0 39 457 A A H X S+ 0 0 0 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.928 111.7 48.9 -65.4 -46.5 22.5 10.5 -76.1 40 458 A V H X S+ 0 0 44 -4,-1.8 4,-0.8 1,-0.3 -2,-0.2 0.874 108.3 54.5 -62.4 -38.1 21.3 13.8 -77.4 41 459 A A H >X S+ 0 0 40 -4,-2.0 4,-0.7 1,-0.2 3,-0.5 0.882 110.0 48.3 -57.2 -39.8 22.0 15.2 -74.0 42 460 A G H >X S+ 0 0 0 -4,-1.6 4,-2.4 1,-0.2 3,-1.0 0.864 98.8 65.6 -68.9 -37.8 25.5 13.9 -74.5 43 461 A L H 3X S+ 0 0 1 -4,-2.4 4,-1.1 1,-0.3 -1,-0.2 0.744 96.2 60.3 -60.3 -20.5 25.8 15.3 -78.0 44 462 A A H << S+ 0 0 86 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.889 110.8 38.5 -68.5 -40.2 25.7 18.7 -76.2 45 463 A V H << S+ 0 0 60 -3,-1.0 -2,-0.2 -4,-0.7 -1,-0.1 0.917 125.1 33.9 -78.0 -49.1 28.8 17.9 -74.2 46 464 A V H < S- 0 0 42 -4,-2.4 4,-0.2 1,-0.1 -3,-0.2 0.767 117.9 -99.5 -82.1 -27.7 31.0 16.1 -76.7 47 465 A G < - 0 0 23 -4,-1.1 4,-0.5 -5,-0.4 -3,-0.2 0.122 6.8-115.9 112.8 133.4 29.8 18.0 -79.8 48 466 A R S S+ 0 0 107 1,-0.2 -33,-3.3 2,-0.1 -32,-0.3 0.583 103.1 77.1 -71.5 -10.1 27.4 17.6 -82.7 49 467 A D S S+ 0 0 69 -35,-0.2 -33,-2.3 -34,-0.2 -32,-0.3 0.989 109.2 14.3 -65.6 -64.3 30.4 17.6 -85.0 50 468 A Y S S+ 0 0 77 -4,-0.2 -24,-2.6 -3,-0.1 2,-0.3 0.252 121.3 67.9-102.5 15.3 31.9 14.2 -84.6 51 469 A Y E + b 0 26A 46 -4,-0.5 -36,-0.3 -26,-0.2 2,-0.3 -0.978 47.8 161.1-136.5 147.4 29.0 12.5 -82.9 52 470 A G E - b 0 27A 0 -26,-1.4 -24,-3.1 -2,-0.3 2,-0.3 -0.910 19.2-141.7-150.7 175.9 25.4 11.5 -83.7 53 471 A C E -Ab 12 28A 0 -41,-2.4 -41,-1.9 -2,-0.3 -24,-0.2 -0.999 12.2-178.2-152.9 145.7 22.7 9.1 -82.4 54 472 A Y E - b 0 29A 26 -26,-2.2 -24,-1.7 -2,-0.3 2,-0.4 -0.999 28.1-117.2-144.4 140.6 20.0 6.7 -83.5 55 473 A P E - b 0 30A 6 0, 0.0 2,-0.6 0, 0.0 -24,-0.2 -0.667 11.8-146.6 -89.1 127.6 17.5 4.6 -81.5 56 474 A L E - b 0 31A 1 -26,-3.5 -24,-2.9 -2,-0.4 3,-0.1 -0.781 17.2-140.1 -83.9 120.4 17.3 0.8 -81.6 57 475 A R - 0 0 191 -2,-0.6 2,-0.3 -26,-0.1 -24,-0.2 0.945 54.0 -80.8 -43.9 -67.6 13.7 -0.1 -81.2 58 476 A G S S+ 0 0 27 1,-0.2 -1,-0.1 -26,-0.1 -26,-0.1 -0.818 98.9 16.4-170.9-153.2 14.3 -3.1 -78.9 59 477 A K S S- 0 0 90 -2,-0.3 2,-0.3 1,-0.1 -1,-0.2 -0.022 81.3-145.9 -30.6 121.8 15.4 -6.6 -79.5 60 478 A M - 0 0 10 -3,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.685 22.9 -77.5-108.0 159.1 16.8 -6.5 -83.1 61 479 A L - 0 0 33 -2,-0.3 2,-0.6 1,-0.1 -1,-0.1 -0.282 35.4-137.8 -59.3 113.7 16.8 -9.0 -85.9 62 480 A N - 0 0 37 -2,-0.2 -1,-0.1 1,-0.1 58,-0.1 -0.631 18.6-164.5 -64.6 115.6 19.3 -11.8 -85.6 63 481 A V > + 0 0 10 -2,-0.6 3,-0.8 56,-0.3 2,-0.6 0.622 46.5 112.8 -87.7 -11.3 20.6 -12.0 -89.2 64 482 A R T 3 S+ 0 0 28 1,-0.4 162,-0.3 160,-0.1 -1,-0.1 -0.907 93.5 3.9-113.6 115.1 22.4 -15.4 -89.1 65 483 A E T 3 S+ 0 0 73 -2,-0.6 -1,-0.4 160,-0.2 2,-0.3 0.573 100.4 134.7-103.2 145.3 21.0 -17.2 -90.7 66 484 A A < - 0 0 35 -3,-0.8 -3,-0.1 -2,-0.1 5,-0.0 -0.999 50.4-103.2-151.6 145.2 18.3 -15.2 -92.4 67 485 A S > - 0 0 71 -2,-0.3 4,-2.0 1,-0.1 5,-0.3 -0.232 27.4-120.1 -70.5 152.4 16.8 -14.7 -95.8 68 486 A A H > S+ 0 0 68 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.945 116.0 52.1 -52.2 -52.7 17.5 -11.7 -98.0 69 487 A D H > S+ 0 0 87 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.894 107.2 53.7 -51.6 -45.6 13.8 -10.9 -98.1 70 488 A Q H > S+ 0 0 110 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.915 115.8 36.5 -56.9 -47.9 13.7 -11.0 -94.3 71 489 A I H < S+ 0 0 19 -4,-2.0 3,-0.2 2,-0.2 -2,-0.2 0.860 113.6 56.7 -78.0 -38.1 16.6 -8.5 -93.8 72 490 A L H < S+ 0 0 114 -4,-3.3 -2,-0.2 -5,-0.3 -1,-0.2 0.915 110.8 44.7 -56.7 -44.2 15.7 -6.3 -96.7 73 491 A K H < S+ 0 0 158 -4,-2.4 2,-1.1 -5,-0.3 -1,-0.2 0.643 89.2 99.4 -76.7 -17.0 12.2 -5.8 -95.3 74 492 A N X - 0 0 38 -4,-0.7 4,-1.3 -3,-0.2 3,-0.3 -0.614 58.7-166.5 -73.8 102.2 13.6 -5.2 -91.8 75 493 A A H > S+ 0 0 69 -2,-1.1 4,-0.9 1,-0.2 -1,-0.2 0.568 77.6 59.5 -73.0 -8.9 13.6 -1.4 -91.7 76 494 A E H > S+ 0 0 16 2,-0.2 4,-2.3 1,-0.1 -1,-0.2 0.913 107.6 41.1 -87.5 -45.0 15.8 -1.1 -88.6 77 495 A I H > S+ 0 0 0 -3,-0.3 4,-1.5 1,-0.2 -2,-0.2 0.735 113.8 57.8 -70.3 -20.2 18.9 -2.9 -89.9 78 496 A Q H X S+ 0 0 20 -4,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.872 105.6 50.4 -71.2 -36.9 18.1 -0.9 -93.1 79 497 A A H X S+ 0 0 0 -4,-0.9 4,-2.5 2,-0.2 5,-0.3 0.969 111.3 44.6 -65.1 -55.6 18.3 2.2 -91.0 80 498 A I H X S+ 0 0 4 -4,-2.3 4,-1.9 1,-0.2 5,-0.2 0.842 113.9 54.0 -59.9 -31.9 21.6 1.4 -89.4 81 499 A K H X S+ 0 0 24 -4,-1.5 4,-1.8 -5,-0.2 -2,-0.2 0.952 111.8 41.3 -62.8 -52.9 22.9 0.3 -92.9 82 500 A K H < S+ 0 0 114 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.871 117.7 46.3 -69.3 -36.2 22.0 3.6 -94.7 83 501 A I H < S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.898 117.0 41.7 -76.3 -40.3 23.1 5.9 -91.9 84 502 A M H < S- 0 0 1 -4,-1.9 15,-2.9 -5,-0.3 16,-1.0 0.836 107.7-136.9 -66.2 -30.9 26.5 4.1 -91.3 85 503 A G < + 0 0 32 -4,-1.8 -1,-0.2 13,-0.2 13,-0.1 -0.691 38.5 169.4 111.5 -67.5 26.6 4.0 -95.1 86 504 A L - 0 0 9 -2,-0.5 -1,-0.2 1,-0.1 2,-0.2 0.802 30.6-139.2 25.9 106.9 27.8 0.4 -95.3 87 505 A Q - 0 0 129 1,-0.1 3,-0.3 -5,-0.0 -1,-0.1 -0.589 14.6-141.2 -76.0 143.9 27.7 -1.2 -98.7 88 506 A H S S+ 0 0 93 -2,-0.2 2,-1.3 1,-0.2 -1,-0.1 0.995 78.3 59.4 -73.4 -65.8 26.5 -4.8 -98.3 89 507 A R S S+ 0 0 215 39,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.477 87.6 48.8 -80.7 73.9 28.6 -6.8 -100.8 90 508 A K S S- 0 0 148 -2,-1.3 2,-0.4 -3,-0.3 39,-0.3 -0.953 80.5 -77.4-171.9-179.2 32.4 -6.7 -100.4 91 509 A K - 0 0 164 -2,-0.3 2,-0.3 38,-0.1 -2,-0.0 -0.770 42.1-129.7 -96.0 133.2 35.3 -7.1 -97.9 92 510 A Y + 0 0 26 -2,-0.4 41,-0.1 1,-0.2 3,-0.1 -0.623 42.5 145.4 -91.3 134.5 36.1 -4.3 -95.4 93 511 A E S S+ 0 0 159 1,-0.4 2,-0.2 -2,-0.3 -1,-0.2 0.586 70.4 27.3-129.7 -40.2 39.6 -2.9 -94.8 94 512 A D - 0 0 96 40,-0.1 -1,-0.4 1,-0.0 40,-0.1 -0.663 56.9-144.6-114.8 172.9 39.1 0.8 -94.1 95 513 A T S > S+ 0 0 16 -2,-0.2 3,-1.2 -3,-0.1 5,-0.1 0.216 77.1 105.8-111.8 5.4 36.2 2.8 -92.6 96 514 A K T 3 S+ 0 0 133 1,-0.3 -73,-0.1 -73,-0.1 -74,-0.1 0.648 73.7 57.5 -58.9 -16.3 37.1 5.6 -95.0 97 515 A S T 3 S+ 0 0 90 -75,-0.1 -1,-0.3 3,-0.1 -2,-0.1 0.756 93.5 77.8 -86.0 -30.6 34.1 4.7 -97.1 98 516 A L S < S- 0 0 10 -3,-1.2 -13,-0.2 2,-0.1 -76,-0.2 -0.171 81.2-119.9 -81.3 173.6 31.3 5.1 -94.5 99 517 A R S S+ 0 0 13 -15,-2.9 -81,-0.8 1,-0.2 2,-0.4 0.741 103.1 36.1 -83.7 -26.5 29.5 8.1 -93.0 100 518 A Y - 0 0 0 -16,-1.0 -77,-0.3 -83,-0.2 -1,-0.2 -0.988 62.5-162.0-126.9 140.4 30.7 7.2 -89.5 101 519 A G S S+ 0 0 1 -79,-1.6 2,-0.3 -76,-1.4 -75,-0.2 0.601 79.0 35.2 -94.8 -14.8 34.1 5.6 -88.6 102 520 A H E -c 26 0A 58 -77,-2.1 -75,-2.4 -80,-0.3 2,-0.4 -0.996 64.5-156.7-141.2 144.9 33.1 4.4 -85.2 103 521 A L E -cd 27 138A 2 34,-3.4 36,-3.5 -2,-0.3 2,-0.4 -0.971 11.6-168.0-125.4 138.4 29.9 2.9 -83.7 104 522 A M E -cd 28 139A 2 -77,-3.2 -75,-3.1 -2,-0.4 2,-0.6 -0.976 11.6-139.3-133.3 139.1 29.1 3.0 -80.0 105 523 A I E -cd 29 140A 1 34,-1.1 36,-1.6 -2,-0.4 2,-0.9 -0.873 9.7-169.9-111.1 119.5 26.4 1.2 -78.0 106 524 A M E +c 30 0A 3 -77,-3.3 -75,-1.7 -2,-0.6 2,-0.2 -0.801 22.0 165.3-101.5 87.5 24.3 2.7 -75.2 107 525 A T - 0 0 0 -2,-0.9 36,-0.1 34,-0.5 6,-0.1 -0.538 48.8-109.0 -86.7 162.8 22.5 -0.2 -73.7 108 526 A D - 0 0 28 -2,-0.2 3,-0.1 79,-0.1 5,-0.1 0.065 48.3-108.8 -94.0 32.6 20.9 0.3 -70.3 109 527 A Q S S+ 0 0 36 1,-0.2 2,-0.2 77,-0.1 75,-0.1 0.713 81.8 106.9 65.8 24.5 23.3 -1.9 -68.3 110 528 A D S > S- 0 0 57 1,-0.0 4,-1.6 75,-0.0 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I - 0 0 16 63,-2.7 60,-0.1 -2,-0.5 -34,-0.1 -0.846 7.2-161.0-114.0 151.2 28.6 1.9 -69.9 143 561 A T - 0 0 7 -2,-0.3 41,-0.0 -36,-0.1 44,-0.0 -0.803 29.7 -91.1-124.4 154.8 26.5 3.2 -67.0 144 562 A P - 0 0 3 0, 0.0 17,-0.3 0, 0.0 3,-0.1 -0.317 20.5-160.3 -62.6 147.6 26.4 2.6 -63.2 145 563 A I S S+ 0 0 28 15,-3.0 39,-2.7 1,-0.3 2,-0.3 0.658 78.6 24.6 -99.0 -23.0 24.2 -0.1 -61.8 146 564 A I E -GH 160 183B 0 14,-1.8 14,-2.5 37,-0.2 2,-0.4 -0.999 60.6-163.5-143.5 140.6 24.1 1.3 -58.2 147 565 A K E -GH 159 182B 44 35,-2.3 35,-2.1 -2,-0.3 2,-0.4 -0.990 13.6-150.4-124.6 126.1 24.6 4.7 -56.7 148 566 A V E -GH 158 181B 0 10,-0.7 10,-1.6 -2,-0.4 2,-0.7 -0.845 2.8-152.9-102.3 135.6 25.3 5.1 -53.0 149 567 A S E -GH 157 180B 59 31,-3.3 31,-0.7 -2,-0.4 2,-0.4 -0.810 6.4-154.9-115.0 90.2 24.2 8.3 -51.2 150 568 A I E + H 0 179B 8 6,-0.8 29,-0.3 -2,-0.7 -2,-0.0 -0.495 25.2 163.3 -71.0 118.9 26.3 9.1 -48.0 151 569 A T + 0 0 63 27,-1.7 28,-0.2 -2,-0.4 -1,-0.1 0.889 29.9 78.0-113.1 -50.1 24.2 11.1 -45.6 152 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51.5 -85.6 40.7 30.9 -5.5 -46.0 172 590 A E H <45S- 0 0 97 -3,-0.8 -2,-0.2 -2,-0.4 -3,-0.2 0.506 132.5 -12.6-135.1 -62.2 33.9 -3.2 -46.1 173 591 A E H ><5S+ 0 0 52 -4,-3.3 3,-1.8 -5,-0.1 4,-0.5 0.380 97.7 101.0-137.0 -7.0 32.9 0.4 -45.3 174 592 A S G >< S- 0 0 18 -77,-0.1 3,-1.1 -3,-0.1 4,-0.3 -0.925 89.6 -75.9-178.5 159.7 17.7 1.1 -66.7 187 605 A L T 3 S+ 0 0 23 -2,-0.3 -79,-0.1 1,-0.2 -152,-0.0 -0.268 109.2 45.1 -59.7 151.7 18.7 4.2 -68.4 188 606 A G T 3 S+ 0 0 54 3,-0.1 -1,-0.2 -153,-0.1 4,-0.1 0.504 84.6 87.4 88.3 -0.8 16.6 7.2 -67.6 189 607 A T S < S+ 0 0 55 -3,-1.1 2,-0.4 2,-0.1 -2,-0.1 0.501 74.9 96.4 -89.5 -13.9 16.5 6.7 -63.9 190 608 A S S S- 0 0 10 -4,-0.3 -6,-0.0 1,-0.1 -2,-0.0 -0.596 83.0-124.5 -69.1 127.5 19.7 8.7 -64.3 191 609 A L > - 0 0 84 -2,-0.4 4,-1.9 1,-0.1 5,-0.1 -0.213 19.4-113.0 -64.1 160.6 19.2 12.4 -63.7 192 610 A A H > S+ 0 0 59 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.977 117.1 55.4 -57.7 -57.9 20.2 15.0 -66.3 193 611 A Q H > S+ 0 0 110 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.846 109.8 49.3 -39.7 -44.2 23.0 16.4 -64.2 194 612 A E H > S+ 0 0 21 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.906 106.3 52.8 -69.7 -44.3 24.4 12.9 -63.9 195 613 A V H X S+ 0 0 4 -4,-1.9 4,-2.1 -3,-0.3 -1,-0.2 0.883 106.4 54.6 -61.8 -37.3 24.3 12.1 -67.6 196 614 A R H X S+ 0 0 125 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.920 106.7 52.1 -61.8 -42.7 26.2 15.3 -68.3 197 615 A E H X S+ 0 0 104 -4,-1.5 4,-0.9 -5,-0.2 3,-0.3 0.957 106.8 52.5 -54.2 -56.0 28.9 14.1 -65.9 198 616 A Y H >X S+ 0 0 12 -4,-2.2 3,-1.4 1,-0.3 4,-1.3 0.925 112.8 44.3 -44.8 -54.9 29.3 10.8 -67.6 199 617 A F H 3< S+ 0 0 8 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.790 103.7 62.9 -68.0 -28.3 29.8 12.5 -71.0 200 618 A S H 3< S+ 0 0 82 -4,-2.0 -1,-0.3 -3,-0.3 -2,-0.2 0.688 121.3 26.1 -66.5 -15.8 32.2 15.0 -69.5 201 619 A N H << + 0 0 55 -3,-1.4 -2,-0.2 -4,-0.9 -3,-0.1 0.719 69.0 144.5-108.8 -87.1 34.3 12.0 -68.8 202 620 A L < + 0 0 22 -4,-1.3 4,-0.4 1,-0.2 -3,-0.1 0.517 57.0 88.1 61.2 1.0 33.6 9.1 -71.1 203 621 A D S S+ 0 0 134 2,-0.1 -1,-0.2 1,-0.0 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3,-2.7 -3,-0.2 4,-0.5 -0.786 45.1 -54.8-118.4 169.2 40.8 -12.6 -82.9 214 632 A G T 34 S+ 0 0 71 1,-0.3 -1,-0.1 -2,-0.3 41,-0.1 -0.086 125.9 13.1 -47.7 129.0 40.9 -16.3 -83.1 215 633 A N T 3> S+ 0 0 99 -3,-0.1 4,-2.0 1,-0.0 -1,-0.3 0.282 100.0 99.4 82.8 -7.2 37.8 -18.0 -81.7 216 634 A D H <> S+ 0 0 2 -3,-2.7 4,-2.1 2,-0.2 5,-0.2 0.979 84.7 46.9 -64.0 -58.1 35.9 -14.7 -81.7 217 635 A K H X S+ 0 0 96 -4,-0.5 4,-1.2 1,-0.2 -1,-0.2 0.817 112.6 52.3 -52.9 -35.9 34.2 -15.6 -85.0 218 636 A D H > S+ 0 0 94 2,-0.2 4,-3.1 1,-0.2 3,-0.3 0.953 107.0 48.9 -68.4 -51.9 33.4 -19.0 -83.6 219 637 A Y H < S+ 0 0 69 -4,-2.0 5,-0.2 1,-0.2 -2,-0.2 0.886 106.0 56.7 -56.0 -44.3 31.8 -17.9 -80.4 220 638 A I H >X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 3,-0.7 0.895 115.6 39.5 -54.3 -40.8 29.5 -15.4 -82.1 221 639 A D H 3X S+ 0 0 31 -4,-1.2 4,-1.9 -3,-0.3 -2,-0.2 0.876 108.1 60.1 -72.9 -40.4 28.3 -18.4 -84.2 222 640 A L H 3< S+ 0 0 49 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.116 118.5 33.8 -79.0 26.1 28.3 -20.8 -81.2 223 641 A A H 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1,-0.2 -1,-0.2 0.769 110.8 46.4 -68.3 -27.0 -18.6 -28.7 -58.6 717 1172 A R H < S+ 0 0 7 -4,-2.2 3,-0.6 -5,-0.2 -2,-0.2 0.929 112.5 43.5 -59.2 -48.5 -16.2 -25.2 -62.0 719 1174 A A H 3< S+ 0 0 65 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.896 110.1 55.6 -64.5 -41.3 -19.1 -27.1 -63.6 720 1175 A E H 3< S+ 0 0 157 -4,-1.4 2,-0.8 -5,-0.2 -1,-0.2 0.653 101.4 61.4 -68.9 -14.6 -21.7 -24.8 -62.0 721 1176 A A << 0 0 52 -4,-1.0 -1,-0.2 -3,-0.6 -4,-0.0 -0.886 360.0 360.0-108.8 93.0 -19.8 -21.9 -63.6 722 1177 A R 0 0 102 -2,-0.8 -3,-0.2 -200,-0.0 -4,-0.1 -0.194 360.0 360.0 53.5 360.0 -20.5 -23.1 -67.2