==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN/PEPTIDE 22-SEP-11 3TWX . COMPND 2 MOLECULE: TANKYRASE-2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.GUETTLER,F.SICHERI . 340 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15613.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 62.1 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 . 0 0.0 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 . 6 1.8 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 . 18 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 117 34.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 4.7 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 0 9 1 6 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 487 A M 0 0 236 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -54.9 -11.2 -21.8 -61.3 2 488 A G - 0 0 34 1,-0.2 3,-0.1 35,-0.0 33,-0.0 -0.651 360.0 -74.2-116.6 179.3 -10.4 -19.7 -58.2 3 489 A N - 0 0 34 -2,-0.2 -1,-0.2 1,-0.1 32,-0.1 -0.309 57.0 -93.8 -66.0 156.4 -8.5 -16.5 -57.7 4 490 A S > - 0 0 60 1,-0.1 4,-2.7 4,-0.0 5,-0.2 -0.290 38.7-109.5 -59.2 159.4 -4.7 -16.6 -57.8 5 491 A E H > S+ 0 0 103 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.904 119.8 54.2 -61.3 -39.5 -3.1 -17.0 -54.3 6 492 A A H > S+ 0 0 46 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.927 111.7 42.8 -60.2 -46.2 -1.9 -13.4 -54.5 7 493 A D H > S+ 0 0 40 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.890 112.7 52.7 -69.9 -40.2 -5.4 -12.0 -55.2 8 494 A R H X S+ 0 0 101 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.916 112.0 46.6 -58.7 -43.7 -7.0 -14.2 -52.6 9 495 A Q H X S+ 0 0 81 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.857 111.7 51.0 -67.6 -36.3 -4.6 -13.0 -50.0 10 496 A L H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.923 111.4 47.6 -65.7 -44.6 -5.1 -9.4 -51.1 11 497 A L H X S+ 0 0 9 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.919 113.3 47.8 -62.5 -45.7 -8.8 -9.7 -50.8 12 498 A E H X S+ 0 0 95 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.896 111.4 51.1 -63.3 -39.6 -8.6 -11.4 -47.4 13 499 A A H X>S+ 0 0 6 -4,-2.3 5,-2.1 2,-0.2 4,-1.2 0.891 108.6 51.1 -66.1 -41.2 -6.2 -8.7 -46.2 14 500 A A H <5S+ 0 0 0 -4,-2.5 3,-0.4 1,-0.2 -1,-0.2 0.929 112.6 47.1 -57.7 -47.1 -8.5 -5.9 -47.3 15 501 A K H <5S+ 0 0 79 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.859 115.1 45.7 -60.1 -39.4 -11.4 -7.7 -45.4 16 502 A A H <5S- 0 0 59 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.615 107.9-123.5 -83.8 -12.7 -9.2 -8.1 -42.3 17 503 A G T <5 + 0 0 29 -4,-1.2 2,-1.5 -3,-0.4 -3,-0.2 0.722 56.4 154.2 72.2 24.7 -7.8 -4.5 -42.4 18 504 A D >< + 0 0 68 -5,-2.1 4,-2.1 -6,-0.2 3,-0.2 -0.658 16.2 177.3 -83.9 87.2 -4.3 -5.8 -42.6 19 505 A V H > S+ 0 0 31 -2,-1.5 4,-2.6 1,-0.2 -1,-0.2 0.827 72.2 59.5 -68.0 -31.5 -2.8 -2.8 -44.3 20 506 A E H > S+ 0 0 103 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.913 109.3 44.0 -63.5 -40.8 0.8 -4.1 -44.3 21 507 A T H > S+ 0 0 43 -3,-0.2 4,-1.4 2,-0.2 3,-0.5 0.920 110.8 55.0 -69.8 -41.0 -0.2 -7.2 -46.3 22 508 A V H >X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 3,-0.7 0.937 106.9 51.6 -53.1 -45.2 -2.3 -5.0 -48.6 23 509 A K H 3< S+ 0 0 103 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.790 108.8 51.1 -64.5 -28.2 0.7 -2.9 -49.3 24 510 A K H 3< S+ 0 0 164 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.730 121.0 31.0 -82.8 -22.3 2.8 -6.0 -50.2 25 511 A L H << S+ 0 0 41 -4,-1.4 2,-0.3 -3,-0.7 -2,-0.2 0.698 91.7 102.9-107.9 -25.3 0.3 -7.4 -52.7 26 512 A C < + 0 0 14 -4,-2.8 2,-0.3 -5,-0.3 -19,-0.0 -0.441 39.8 152.9 -70.5 124.4 -1.4 -4.4 -54.2 27 513 A T > - 0 0 66 -2,-0.3 4,-2.1 1,-0.0 3,-0.1 -0.857 61.4 -94.4-135.7 174.8 -0.3 -3.4 -57.7 28 514 A V T 4 S+ 0 0 130 -2,-0.3 4,-0.3 1,-0.2 -2,-0.0 0.848 126.4 50.1 -61.5 -28.1 -2.0 -1.6 -60.5 29 515 A Q T 4 S+ 0 0 177 1,-0.2 -1,-0.2 2,-0.1 3,-0.2 0.854 120.2 32.7 -78.1 -32.2 -2.9 -5.0 -61.9 30 516 A S T >4 S+ 0 0 10 -5,-0.1 3,-2.2 -3,-0.1 -2,-0.2 0.604 89.2 92.7-100.7 -13.9 -4.4 -6.4 -58.7 31 517 A V T 3< S+ 0 0 2 -4,-2.1 13,-0.4 1,-0.3 -1,-0.1 0.823 98.5 34.3 -58.5 -32.3 -5.9 -3.4 -57.0 32 518 A N T 3 S+ 0 0 54 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 -0.038 86.3 143.9-111.0 32.7 -9.4 -4.0 -58.5 33 519 A C < - 0 0 14 -3,-2.2 2,-0.4 1,-0.1 -3,-0.1 -0.210 43.1-126.9 -66.6 164.1 -9.3 -7.8 -58.6 34 520 A R - 0 0 85 8,-0.2 2,-1.4 9,-0.1 8,-0.2 -0.944 8.7-123.4-125.3 138.8 -12.6 -9.6 -57.9 35 521 A D > > - 0 0 32 6,-2.2 5,-2.0 -2,-0.4 3,-1.5 -0.614 29.7-177.9 -76.6 91.3 -13.6 -12.3 -55.5 36 522 A I T 3 5S+ 0 0 84 -2,-1.4 -1,-0.2 1,-0.3 -34,-0.0 0.702 76.4 58.7 -68.0 -18.5 -14.9 -14.9 -57.9 37 523 A E T 3 5S+ 0 0 148 -3,-0.1 -1,-0.3 2,-0.0 -2,-0.1 0.415 117.0 25.2 -94.1 2.5 -15.9 -17.3 -55.2 38 524 A G T < 5S- 0 0 39 -3,-1.5 -2,-0.0 3,-0.1 -4,-0.0 0.112 126.7 -44.5-125.9-118.8 -18.3 -14.8 -53.5 39 525 A R T 5S- 0 0 25 -2,-0.0 32,-2.9 32,-0.0 33,-0.4 -0.014 81.8-100.1-112.9 29.1 -20.1 -11.9 -54.9 40 526 A Q < + 0 0 58 -5,-2.0 -4,-0.2 30,-0.2 2,-0.1 0.795 60.6 172.5 61.3 33.0 -17.2 -10.5 -56.9 41 527 A S - 0 0 0 -6,-0.3 -6,-2.2 -7,-0.1 -1,-0.2 -0.411 24.1-135.9 -65.0 147.9 -16.3 -7.8 -54.4 42 528 A T > - 0 0 0 -8,-0.2 4,-2.1 26,-0.1 5,-0.2 -0.471 32.8 -95.2 -90.8 172.6 -13.0 -5.9 -55.0 43 529 A P H > S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.910 128.0 52.5 -53.0 -42.9 -10.5 -5.1 -52.3 44 530 A L H > S+ 0 0 0 -13,-0.4 4,-2.7 1,-0.2 5,-0.2 0.852 105.5 54.0 -63.9 -36.3 -12.2 -1.7 -51.8 45 531 A H H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.943 112.6 44.2 -59.8 -48.4 -15.6 -3.3 -51.4 46 532 A F H X S+ 0 0 13 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.941 115.1 46.7 -63.2 -47.0 -14.2 -5.5 -48.6 47 533 A A H <>S+ 0 0 0 -4,-2.7 5,-3.0 1,-0.2 9,-0.2 0.901 115.9 46.3 -62.7 -41.4 -12.3 -2.7 -46.9 48 534 A A H ><5S+ 0 0 0 -4,-2.7 3,-1.0 -5,-0.2 -2,-0.2 0.918 114.2 46.7 -67.4 -43.6 -15.3 -0.3 -47.2 49 535 A G H 3<5S+ 0 0 0 -4,-2.8 277,-2.0 1,-0.2 -2,-0.2 0.826 115.5 44.9 -69.8 -32.0 -17.8 -2.9 -45.9 50 536 A Y T 3<5S- 0 0 32 -4,-2.3 -1,-0.2 275,-0.3 -2,-0.2 0.191 112.3-116.7-101.2 17.0 -15.6 -4.0 -43.0 51 537 A N T < 5 + 0 0 15 -3,-1.0 2,-1.1 1,-0.2 -3,-0.2 0.877 53.7 161.8 56.1 46.8 -14.7 -0.5 -42.0 52 538 A R >< + 0 0 63 -5,-3.0 4,-3.1 1,-0.2 -1,-0.2 -0.705 10.0 176.7 -98.5 83.7 -11.0 -0.8 -42.6 53 539 A V H > S+ 0 0 1 -2,-1.1 4,-3.0 1,-0.2 5,-0.2 0.896 75.0 49.4 -61.8 -48.2 -10.2 2.9 -42.8 54 540 A S H > S+ 0 0 71 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.915 115.1 46.6 -57.5 -43.1 -6.4 2.7 -43.3 55 541 A V H > S+ 0 0 1 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.938 110.7 51.5 -65.5 -45.9 -6.9 0.1 -46.1 56 542 A V H X S+ 0 0 0 -4,-3.1 4,-2.8 -9,-0.2 5,-0.2 0.943 111.7 47.8 -54.6 -48.4 -9.6 2.2 -47.7 57 543 A E H X S+ 0 0 41 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.944 113.7 46.5 -59.8 -48.8 -7.3 5.3 -47.7 58 544 A Y H X S+ 0 0 35 -4,-2.5 4,-0.6 -5,-0.2 3,-0.3 0.948 113.5 48.6 -58.2 -50.4 -4.4 3.3 -49.1 59 545 A L H ><>S+ 0 0 0 -4,-3.2 5,-2.3 1,-0.2 3,-1.4 0.926 109.7 51.5 -57.0 -46.9 -6.5 1.6 -51.8 60 546 A L H ><5S+ 0 0 17 -4,-2.8 3,-0.7 1,-0.3 -1,-0.2 0.838 110.7 49.1 -60.0 -33.0 -8.0 4.9 -52.9 61 547 A Q H 3<5S+ 0 0 118 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.542 110.9 52.6 -84.8 -5.5 -4.6 6.4 -53.3 62 548 A H T <<5S- 0 0 88 -3,-1.4 -1,-0.2 -4,-0.6 -2,-0.2 -0.144 128.0 -76.6-127.6 37.6 -3.3 3.5 -55.3 63 549 A G T < 5S+ 0 0 48 -3,-0.7 -3,-0.2 1,-0.2 -2,-0.1 0.491 70.1 158.0 91.4 5.3 -5.8 3.1 -58.1 64 550 A A < - 0 0 13 -5,-2.3 2,-0.7 -6,-0.2 -1,-0.2 -0.396 42.1-122.1 -64.3 143.2 -8.9 1.5 -56.5 65 551 A D > - 0 0 61 1,-0.1 3,-1.5 -34,-0.1 -1,-0.1 -0.779 21.3-170.2 -98.1 107.6 -12.1 2.1 -58.5 66 552 A V T 3 S+ 0 0 11 -2,-0.7 11,-0.4 1,-0.3 32,-0.2 0.646 92.3 55.3 -66.5 -13.8 -14.9 3.8 -56.6 67 553 A H T 3 S+ 0 0 112 8,-0.1 -1,-0.3 30,-0.1 2,-0.1 0.456 77.9 122.2 -95.6 -4.2 -17.1 2.9 -59.6 68 554 A A < - 0 0 13 -3,-1.5 2,-0.4 1,-0.1 -26,-0.1 -0.393 49.9-151.0 -65.1 132.1 -16.4 -0.8 -59.6 69 555 A K - 0 0 92 6,-0.1 6,-0.2 -2,-0.1 -2,-0.1 -0.863 2.0-142.0-108.1 136.7 -19.6 -2.9 -59.3 70 556 A D > - 0 0 7 4,-2.3 3,-2.3 -2,-0.4 -30,-0.2 -0.081 48.4 -72.8 -80.6-171.9 -19.8 -6.3 -57.7 71 557 A K T 3 S+ 0 0 130 -32,-2.9 -31,-0.1 1,-0.3 -1,-0.1 0.784 136.6 44.7 -56.5 -29.9 -22.0 -9.2 -58.9 72 558 A G T 3 S- 0 0 5 -33,-0.4 32,-2.3 2,-0.1 33,-0.4 0.367 121.8-103.5 -95.2 4.3 -25.1 -7.4 -57.7 73 559 A G S < S+ 0 0 5 -3,-2.3 2,-0.3 1,-0.3 -2,-0.1 0.585 71.4 147.7 84.6 10.1 -24.1 -4.0 -59.1 74 560 A L - 0 0 1 29,-0.1 -4,-2.3 3,-0.0 -1,-0.3 -0.598 35.1-152.2 -76.6 137.2 -23.1 -2.6 -55.7 75 561 A V >> - 0 0 5 -2,-0.3 3,-1.4 -6,-0.2 4,-1.2 -0.663 36.7 -98.9 -96.7 165.5 -20.3 -0.0 -55.6 76 562 A P H 3> S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.802 122.6 64.1 -59.2 -28.3 -18.1 0.3 -52.4 77 563 A L H 3> S+ 0 0 1 -11,-0.4 4,-2.5 1,-0.2 5,-0.2 0.881 98.1 55.8 -60.4 -37.2 -20.2 3.3 -51.3 78 564 A H H <> S+ 0 0 0 -3,-1.4 4,-2.7 2,-0.2 -1,-0.2 0.930 108.1 48.5 -55.4 -46.9 -23.2 0.9 -51.1 79 565 A N H X S+ 0 0 0 -4,-1.2 4,-1.5 1,-0.2 6,-0.2 0.939 112.4 47.8 -60.5 -46.8 -21.2 -1.3 -48.7 80 566 A A H <>S+ 0 0 0 -4,-2.3 5,-2.5 1,-0.2 4,-0.3 0.909 115.9 43.7 -58.4 -46.6 -20.1 1.6 -46.5 81 567 A C H ><5S+ 0 0 0 -4,-2.5 3,-0.9 1,-0.2 -2,-0.2 0.881 109.1 55.8 -70.5 -40.1 -23.6 3.0 -46.3 82 568 A S H 3<5S+ 0 0 1 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.834 115.1 39.6 -59.7 -33.6 -25.3 -0.3 -45.7 83 569 A Y T 3<5S- 0 0 22 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.320 113.2-113.7-107.2 8.7 -23.1 -0.9 -42.7 84 570 A G T < 5 + 0 0 24 -3,-0.9 2,-1.4 -4,-0.3 -3,-0.2 0.669 55.9 157.9 76.9 21.8 -23.1 2.6 -41.3 85 571 A H >< + 0 0 6 -5,-2.5 4,-2.4 -6,-0.2 -1,-0.2 -0.599 11.9 176.2 -88.1 93.3 -19.4 3.4 -41.9 86 572 A Y H > S+ 0 0 81 -2,-1.4 4,-2.7 2,-0.2 -1,-0.2 0.921 75.3 47.0 -66.1 -49.6 -19.4 7.2 -41.9 87 573 A E H > S+ 0 0 15 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.928 113.9 49.6 -61.5 -43.5 -15.7 7.9 -42.2 88 574 A V H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.928 110.0 50.4 -59.9 -44.0 -15.4 5.4 -45.0 89 575 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.920 110.5 51.1 -61.4 -41.8 -18.4 6.9 -46.8 90 576 A E H X S+ 0 0 35 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.925 108.8 49.8 -60.0 -48.2 -16.7 10.3 -46.5 91 577 A L H X S+ 0 0 8 -4,-2.6 4,-1.2 2,-0.2 -1,-0.2 0.874 111.3 49.8 -57.4 -40.9 -13.4 9.1 -48.0 92 578 A L H <>S+ 0 0 0 -4,-2.2 5,-2.5 2,-0.2 3,-0.5 0.950 111.6 47.2 -65.7 -48.6 -15.2 7.5 -50.9 93 579 A V H ><5S+ 0 0 18 -4,-2.4 3,-2.0 1,-0.2 -2,-0.2 0.911 108.9 54.9 -58.6 -42.2 -17.1 10.7 -51.7 94 580 A K H 3<5S+ 0 0 149 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.800 106.7 52.6 -62.5 -27.9 -14.0 12.7 -51.4 95 581 A H T 3<5S- 0 0 81 -4,-1.2 -1,-0.3 -3,-0.5 -29,-0.2 0.122 132.4 -90.2 -97.3 21.3 -12.4 10.5 -54.0 96 582 A G T < 5 + 0 0 42 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.565 62.7 168.0 91.1 11.3 -15.3 11.0 -56.4 97 583 A A < - 0 0 10 -5,-2.5 2,-0.5 -6,-0.1 -1,-0.2 -0.318 39.7-120.1 -52.8 134.3 -17.7 8.2 -55.5 98 584 A V > - 0 0 76 -32,-0.2 3,-0.9 1,-0.1 -1,-0.1 -0.706 18.3-156.8 -85.3 124.2 -21.1 9.0 -57.3 99 585 A V T 3 S+ 0 0 13 -2,-0.5 11,-0.4 29,-0.3 -1,-0.1 0.814 87.4 50.8 -72.5 -29.5 -23.8 9.3 -54.7 100 586 A N T 3 S+ 0 0 53 8,-0.1 -1,-0.2 9,-0.1 -2,-0.0 0.200 78.1 134.3 -97.5 16.8 -26.8 8.5 -57.0 101 587 A V < - 0 0 24 -3,-0.9 2,-0.4 1,-0.0 -26,-0.1 -0.243 41.1-150.4 -63.8 152.4 -25.3 5.3 -58.4 102 588 A A - 0 0 32 6,-0.2 6,-0.2 7,-0.1 -2,-0.1 -0.976 3.8-137.0-133.0 146.5 -27.7 2.3 -58.5 103 589 A D > - 0 0 8 4,-1.9 3,-2.0 -2,-0.4 -30,-0.3 -0.004 51.1 -74.1 -84.5-167.8 -27.3 -1.5 -58.3 104 590 A L T 3 S+ 0 0 98 -32,-2.3 -31,-0.1 1,-0.3 -1,-0.1 0.737 137.6 43.9 -65.4 -21.2 -29.0 -4.1 -60.5 105 591 A W T 3 S- 0 0 72 -33,-0.4 32,-2.7 2,-0.1 33,-0.4 0.229 121.0-108.3-103.9 11.7 -32.2 -3.5 -58.6 106 592 A K < + 0 0 87 -3,-2.0 2,-0.5 30,-0.3 -2,-0.1 0.699 65.6 153.2 65.1 23.8 -31.8 0.2 -58.7 107 593 A F - 0 0 24 29,-0.1 -4,-1.9 4,-0.1 -1,-0.2 -0.721 29.4-155.2 -76.2 128.6 -31.1 0.6 -55.0 108 594 A T > - 0 0 3 -2,-0.5 4,-1.8 -6,-0.2 3,-0.3 -0.520 34.2-100.0 -93.6 167.9 -28.9 3.7 -54.4 109 595 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.840 126.3 57.7 -55.8 -29.0 -26.6 4.2 -51.4 110 596 A L H > S+ 0 0 1 -11,-0.4 4,-2.8 2,-0.2 5,-0.3 0.889 101.6 53.3 -71.3 -38.0 -29.4 6.3 -49.9 111 597 A H H > S+ 0 0 0 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.919 111.8 47.3 -54.9 -47.4 -31.8 3.3 -50.1 112 598 A E H X S+ 0 0 11 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.944 114.1 45.1 -59.5 -51.1 -29.3 1.2 -48.2 113 599 A A H X>S+ 0 0 0 -4,-2.6 5,-2.5 1,-0.2 4,-0.7 0.921 115.2 47.7 -62.2 -45.2 -28.7 3.8 -45.5 114 600 A A H ><5S+ 0 0 0 -4,-2.8 3,-0.9 1,-0.2 33,-0.5 0.920 112.7 47.7 -61.9 -46.6 -32.4 4.6 -45.1 115 601 A A H 3<5S+ 0 0 42 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.842 113.8 48.7 -64.0 -31.8 -33.3 0.9 -44.9 116 602 A K H 3<5S- 0 0 72 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.476 114.3-115.4 -91.3 -4.8 -30.6 0.2 -42.4 117 603 A G T <<5 + 0 0 11 -3,-0.9 2,-1.0 -4,-0.7 -3,-0.2 0.790 59.1 152.2 79.9 31.3 -31.4 3.2 -40.1 118 604 A K >< + 0 0 46 -5,-2.5 4,-2.5 1,-0.2 -1,-0.2 -0.731 16.2 177.4 -97.7 89.3 -28.3 5.2 -40.6 119 605 A Y H > S+ 0 0 12 -2,-1.0 4,-2.6 1,-0.2 5,-0.2 0.938 78.3 44.9 -55.5 -55.3 -29.3 8.9 -40.0 120 606 A E H > S+ 0 0 39 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.862 113.6 51.2 -67.1 -32.2 -25.9 10.6 -40.4 121 607 A I H > S+ 0 0 5 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.946 110.1 50.4 -62.5 -48.5 -25.0 8.6 -43.5 122 608 A C H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.916 112.1 47.4 -54.2 -44.0 -28.4 9.6 -45.0 123 609 A K H X S+ 0 0 59 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.859 109.8 52.6 -67.9 -36.0 -27.6 13.2 -44.2 124 610 A L H X S+ 0 0 2 -4,-2.1 4,-1.1 -5,-0.2 -2,-0.2 0.931 110.3 48.3 -64.2 -48.1 -24.1 12.9 -45.7 125 611 A L H ><>S+ 0 0 2 -4,-2.6 5,-2.4 1,-0.2 3,-0.6 0.910 108.2 54.6 -59.0 -45.3 -25.6 11.5 -48.9 126 612 A L H ><5S+ 0 0 44 -4,-2.2 3,-1.7 1,-0.2 -1,-0.2 0.903 104.8 53.0 -57.6 -43.7 -28.2 14.2 -49.2 127 613 A Q H 3<5S+ 0 0 119 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.760 105.7 54.6 -65.7 -25.8 -25.7 17.1 -48.9 128 614 A H T <<5S- 0 0 85 -4,-1.1 -29,-0.3 -3,-0.6 -1,-0.3 0.268 132.9 -90.1 -94.4 13.3 -23.7 15.5 -51.8 129 615 A G T < 5 + 0 0 45 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.2 0.628 63.3 169.5 95.1 16.9 -26.8 15.6 -53.9 130 616 A A < - 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0 0 59 3,-0.0 -4,-2.4 4,-0.0 -1,-0.3 -0.750 41.0-150.8 -94.3 136.8 -39.8 2.3 -53.6 141 627 A T > - 0 0 19 -2,-0.4 4,-1.1 -6,-0.2 -6,-0.1 -0.414 36.9 -99.8 -89.4 170.7 -37.9 5.5 -52.6 142 628 A P T >4 S+ 0 0 0 0, 0.0 3,-0.7 0, 0.0 4,-0.4 0.911 126.7 55.9 -59.9 -35.5 -35.4 5.6 -49.8 143 629 A L G >4 S+ 0 0 37 -11,-0.6 3,-1.3 1,-0.2 -10,-0.1 0.881 101.2 57.9 -59.2 -38.2 -38.1 7.1 -47.7 144 630 A D G 34 S+ 0 0 90 1,-0.3 -1,-0.2 -3,-0.1 10,-0.0 0.813 103.7 52.8 -62.3 -31.4 -40.3 4.1 -48.4 145 631 A L G << S+ 0 0 44 -4,-1.1 -1,-0.3 -3,-0.7 2,-0.3 0.503 81.1 115.6 -84.9 -6.3 -37.7 1.7 -47.0 146 632 A V S < S- 0 0 11 -3,-1.3 -31,-0.2 -4,-0.4 2,-0.1 -0.481 70.4-118.9 -69.0 127.9 -37.3 3.6 -43.6 147 633 A K > - 0 0 102 -33,-0.5 3,-2.1 -2,-0.3 7,-0.2 -0.388 26.2-113.4 -64.7 143.0 -38.4 1.5 -40.6 148 634 A D T 3 S+ 0 0 139 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 0.806 112.4 60.5 -50.4 -39.2 -41.3 3.0 -38.6 149 635 A G T 3 S+ 0 0 71 1,-0.2 2,-1.9 2,-0.1 3,-0.3 0.788 87.5 79.2 -60.4 -27.4 -39.3 3.7 -35.5 150 636 A D <> + 0 0 15 -3,-2.1 4,-2.6 1,-0.2 -1,-0.2 -0.390 47.8 149.3 -85.0 63.1 -36.9 6.0 -37.5 151 637 A T H > S+ 0 0 79 -2,-1.9 4,-3.0 1,-0.2 -1,-0.2 0.778 71.5 58.9 -66.6 -25.4 -39.1 9.1 -37.6 152 638 A D H > S+ 0 0 28 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.925 108.4 43.4 -69.4 -41.8 -36.0 11.3 -37.6 153 639 A I H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.916 114.3 51.9 -66.6 -40.9 -34.8 9.6 -40.8 154 640 A Q H X S+ 0 0 31 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.943 110.4 48.4 -57.2 -47.9 -38.4 9.8 -42.1 155 641 A D H < S+ 0 0 107 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.899 111.5 50.6 -59.8 -40.9 -38.4 13.6 -41.3 156 642 A L H < S+ 0 0 50 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.936 114.9 40.0 -63.8 -51.7 -35.0 14.1 -43.0 157 643 A L H < 0 0 16 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.662 360.0 360.0 -70.7 -16.2 -35.9 12.4 -46.3 158 644 A R < 0 0 185 -4,-1.2 -3,-0.2 -5,-0.3 -2,-0.1 0.665 360.0 360.0-103.4 360.0 -39.3 14.1 -45.9 159 !* 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 0.0 160 487 B M 0 0 227 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 145.6 8.8 10.4 -12.3 161 488 B G - 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0 0 0 -6,-0.4 -6,-2.4 -7,-0.1 -1,-0.2 -0.396 25.0-136.6 -62.2 144.1 -5.7 8.3 -19.3 201 528 B T > - 0 0 0 -8,-0.2 4,-2.1 26,-0.1 5,-0.2 -0.462 33.1 -96.5 -88.9 170.4 -6.0 4.5 -18.8 202 529 B P H > S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.904 128.3 53.9 -54.2 -40.0 -5.4 2.1 -21.7 203 530 B L H > S+ 0 0 0 -13,-0.4 4,-2.5 1,-0.2 5,-0.2 0.877 104.5 54.2 -65.4 -37.1 -9.2 2.0 -22.1 204 531 B H H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.949 112.4 44.3 -55.7 -51.2 -9.4 5.8 -22.4 205 532 B F H X S+ 0 0 9 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.946 114.8 46.8 -61.6 -49.9 -6.8 5.7 -25.2 206 533 B A H <>S+ 0 0 0 -4,-2.8 5,-2.9 1,-0.2 9,-0.2 0.889 115.2 47.8 -60.7 -38.4 -8.4 2.8 -27.0 207 534 B A H ><5S+ 0 0 0 -4,-2.5 3,-1.0 -5,-0.2 -2,-0.2 0.931 113.1 46.5 -68.5 -46.6 -11.8 4.5 -26.7 208 535 B G H 3<5S+ 0 0 0 -4,-2.8 131,-2.1 1,-0.2 -2,-0.2 0.829 115.6 44.9 -65.7 -34.9 -10.7 7.9 -27.9 209 536 B Y T 3<5S- 0 0 32 -4,-2.2 -1,-0.2 129,-0.3 -2,-0.2 0.269 112.3-116.3 -97.7 11.3 -8.8 6.6 -30.9 210 537 B N T < 5 + 0 0 16 -3,-1.0 2,-1.1 -4,-0.2 -3,-0.2 0.879 54.3 161.0 61.1 44.5 -11.5 4.2 -31.9 211 538 B R >< + 0 0 63 -5,-2.9 4,-2.9 1,-0.2 -1,-0.2 -0.695 8.9 174.1 -97.1 81.9 -9.5 1.0 -31.4 212 539 B V H > S+ 0 0 2 -2,-1.1 4,-2.9 1,-0.2 5,-0.2 0.900 73.4 52.2 -61.9 -47.6 -12.3 -1.5 -31.2 213 540 B S H > S+ 0 0 62 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.898 115.4 43.8 -56.7 -41.1 -10.3 -4.7 -31.1 214 541 B V H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.913 111.2 53.2 -69.9 -44.1 -8.3 -3.2 -28.2 215 542 B V H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 5,-0.2 0.940 111.5 47.4 -52.4 -48.0 -11.4 -1.8 -26.4 216 543 B E H X S+ 0 0 50 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.928 113.4 47.1 -61.9 -46.5 -13.0 -5.3 -26.6 217 544 B Y H X S+ 0 0 42 -4,-2.0 4,-0.8 -5,-0.2 -2,-0.2 0.939 112.7 48.8 -62.0 -47.0 -9.8 -7.0 -25.3 218 545 B L H ><>S+ 0 0 0 -4,-3.1 5,-2.5 1,-0.2 3,-0.9 0.902 110.4 50.7 -61.8 -42.0 -9.4 -4.5 -22.4 219 546 B L H ><5S+ 0 0 15 -4,-2.5 3,-1.0 1,-0.3 -1,-0.2 0.867 108.8 52.3 -64.7 -35.5 -13.0 -4.9 -21.3 220 547 B Q H 3<5S+ 0 0 120 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.630 109.3 52.1 -74.0 -13.7 -12.7 -8.6 -21.3 221 548 B H T <<5S- 0 0 83 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 0.004 128.8 -84.8-115.6 28.7 -9.6 -8.3 -19.1 222 549 B G T < 5 + 0 0 52 -3,-1.0 -3,-0.2 1,-0.2 -2,-0.1 0.602 64.1 166.8 87.7 13.3 -11.0 -6.1 -16.3 223 550 B A < - 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0 0 1 29,-0.1 -4,-2.3 3,-0.0 -1,-0.3 -0.627 34.4-154.6 -80.0 137.5 -13.5 12.0 -17.8 234 561 B V >> - 0 0 6 -2,-0.3 4,-1.3 -6,-0.2 3,-1.1 -0.587 38.8 -97.4 -94.1 167.2 -14.5 8.3 -18.1 235 562 B P H 3> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.832 123.7 63.9 -57.5 -30.1 -13.8 6.4 -21.4 236 563 B L H 3> S+ 0 0 1 -11,-0.4 4,-2.4 1,-0.2 5,-0.2 0.875 98.3 56.0 -59.8 -36.8 -17.4 6.9 -22.4 237 564 B H H <> S+ 0 0 0 -3,-1.1 4,-2.8 1,-0.2 -1,-0.2 0.944 107.9 48.5 -57.1 -46.1 -16.6 10.7 -22.5 238 565 B N H X S+ 0 0 0 -4,-1.3 4,-1.5 1,-0.2 -2,-0.2 0.934 112.0 47.4 -63.1 -46.8 -13.7 10.0 -24.9 239 566 B A H <>S+ 0 0 0 -4,-2.4 5,-2.8 1,-0.2 4,-0.3 0.893 116.0 44.9 -59.0 -39.9 -15.9 7.8 -27.2 240 567 B C H ><5S+ 0 0 0 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.905 108.8 54.4 -76.8 -39.1 -18.7 10.4 -27.3 241 568 B S H 3<5S+ 0 0 2 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.820 115.5 40.7 -61.5 -31.9 -16.5 13.4 -27.8 242 569 B Y T 3<5S- 0 0 21 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.321 113.6-114.5-105.9 8.9 -14.9 11.8 -30.8 243 570 B G T < 5 + 0 0 27 -3,-1.1 2,-1.2 -4,-0.3 -3,-0.2 0.750 56.1 157.9 73.7 27.1 -18.1 10.3 -32.3 244 571 B H >< + 0 0 5 -5,-2.8 4,-2.1 -6,-0.2 -1,-0.2 -0.668 12.4 176.9 -90.4 91.5 -17.2 6.7 -31.9 245 572 B Y H > S+ 0 0 80 -2,-1.2 4,-2.4 1,-0.2 -1,-0.2 0.923 74.8 47.8 -66.0 -50.4 -20.6 4.9 -31.9 246 573 B E H > S+ 0 0 14 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.921 112.3 50.2 -58.2 -45.5 -19.5 1.3 -31.7 247 574 B V H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.920 110.2 51.1 -57.6 -43.7 -17.0 2.0 -28.8 248 575 B A H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.934 110.8 48.0 -61.3 -43.4 -19.8 3.8 -26.9 249 576 B E H X S+ 0 0 42 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.910 111.1 50.9 -63.4 -41.5 -22.1 0.9 -27.4 250 577 B L H X S+ 0 0 9 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.920 110.8 48.8 -62.3 -44.0 -19.4 -1.6 -26.2 251 578 B L H <>S+ 0 0 0 -4,-2.7 5,-2.9 1,-0.2 -2,-0.2 0.922 112.4 48.0 -60.8 -44.6 -18.7 0.6 -23.1 252 579 B V H ><5S+ 0 0 25 -4,-2.5 3,-1.6 1,-0.2 -2,-0.2 0.901 109.2 53.3 -63.7 -39.4 -22.5 0.7 -22.3 253 580 B K H 3<5S+ 0 0 144 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.798 108.1 52.0 -66.1 -26.6 -22.8 -3.0 -22.8 254 581 B H T 3<5S- 0 0 85 -4,-1.5 -1,-0.3 -3,-0.2 -29,-0.2 0.194 134.4 -82.9 -97.6 15.1 -20.0 -3.5 -20.3 255 582 B G T < 5 + 0 0 40 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.425 69.1 160.5 108.8 2.0 -21.6 -1.4 -17.6 256 583 B A < - 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