==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 21-MAR-12 4E9H . COMPND 2 MOLECULE: METHYL-CPG-BINDING DOMAIN PROTEIN 4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.MORERA,A.VIGOUROUX . 137 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7661.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 93 67.9 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 . 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 . 3 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 18.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 62 45.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 2 0 0 0 1 0 2 0 1 0 1 0 0 1 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 1 438 A W 0 0 110 0, 0.0 113,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 117.5 2.3 -12.5 38.7 2 439 A T - 0 0 103 111,-0.0 110,-0.1 112,-0.0 109,-0.1 -0.977 360.0-130.2-127.1 110.9 3.9 -9.5 36.9 3 440 A P - 0 0 7 0, 0.0 13,-0.1 0, 0.0 108,-0.1 -0.451 32.9-118.0 -63.6 129.2 5.6 -10.2 33.6 4 441 A P - 0 0 52 0, 0.0 2,-0.3 0, 0.0 129,-0.0 -0.355 23.1-104.5 -69.5 154.6 9.1 -8.6 33.6 5 442 A R - 0 0 143 -2,-0.1 9,-0.0 4,-0.0 0, 0.0 -0.585 44.0-157.7 -77.0 132.9 10.2 -5.9 31.3 6 443 A S > - 0 0 9 -2,-0.3 3,-1.6 4,-0.1 4,-0.1 -0.867 31.5-119.6-114.1 156.8 12.6 -7.3 28.6 7 444 A P T 3 S+ 0 0 105 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 0.580 109.6 70.2 -69.0 -3.8 15.3 -5.9 26.2 8 445 A F T 3 S- 0 0 52 117,-0.1 121,-0.1 2,-0.0 120,-0.0 0.595 92.6-142.6 -87.8 -16.5 13.0 -7.2 23.4 9 446 A N < - 0 0 122 -3,-1.6 2,-0.1 1,-0.2 -4,-0.0 0.831 22.7-174.6 53.5 51.5 10.2 -4.5 23.9 10 447 A L > - 0 0 6 1,-0.1 3,-1.3 115,-0.1 4,-0.3 -0.445 30.7-131.9 -68.9 142.7 7.1 -6.6 23.2 11 448 A V T >> S+ 0 0 13 1,-0.3 3,-1.6 2,-0.2 4,-1.3 0.801 106.1 71.7 -66.6 -22.9 3.9 -4.5 23.2 12 449 A Q H 3> S+ 0 0 5 1,-0.3 4,-0.8 2,-0.2 -1,-0.3 0.772 85.0 66.8 -58.9 -31.5 2.5 -7.2 25.4 13 450 A E H <4 S+ 0 0 5 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.680 107.1 38.9 -66.4 -23.1 4.8 -5.9 28.2 14 451 A T H <4 S+ 0 0 64 -3,-1.6 3,-0.3 -4,-0.3 -2,-0.2 0.729 118.1 45.2 -98.9 -27.5 2.8 -2.6 28.4 15 452 A L H >< S+ 0 0 15 -4,-1.3 3,-1.4 1,-0.2 7,-0.7 0.342 73.6 106.2-102.2 6.5 -0.8 -3.9 28.0 16 453 A F T 3< S+ 0 0 29 -4,-0.8 -1,-0.2 1,-0.2 -3,-0.1 0.752 71.1 67.7 -58.7 -26.3 -0.9 -7.0 30.3 17 454 A H T 3 S+ 0 0 152 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.786 105.6 42.5 -63.2 -30.8 -3.1 -5.1 32.9 18 455 A D S <> S- 0 0 44 -3,-1.4 4,-2.0 1,-0.2 3,-0.3 -0.923 73.0-164.4-117.7 101.7 -6.0 -4.9 30.4 19 456 A P H > S+ 0 0 34 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.912 87.5 57.3 -51.5 -49.0 -6.4 -8.3 28.6 20 457 A W H > S+ 0 0 3 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.869 108.9 45.9 -48.0 -49.8 -8.7 -6.8 25.9 21 458 A K H > S+ 0 0 67 -3,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.943 114.2 48.2 -60.7 -47.1 -6.0 -4.2 24.9 22 459 A L H X S+ 0 0 0 -4,-2.0 4,-1.8 -7,-0.7 -2,-0.2 0.873 113.9 46.7 -60.8 -41.3 -3.3 -6.9 25.0 23 460 A L H X S+ 0 0 0 -4,-3.0 4,-1.8 2,-0.2 -2,-0.2 0.937 111.2 50.6 -68.0 -44.0 -5.4 -9.3 22.8 24 461 A I H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.917 107.2 57.3 -57.7 -42.6 -6.3 -6.5 20.3 25 462 A A H X S+ 0 0 0 -4,-2.7 4,-1.2 1,-0.2 -1,-0.2 0.924 105.3 48.6 -54.5 -47.4 -2.5 -5.8 20.2 26 463 A T H < S+ 0 0 2 -4,-1.8 3,-0.3 2,-0.2 -1,-0.2 0.873 109.7 53.3 -59.6 -38.8 -1.9 -9.4 19.1 27 464 A I H >< S+ 0 0 1 -4,-1.8 3,-1.7 1,-0.2 -2,-0.2 0.925 106.2 52.1 -62.2 -44.0 -4.7 -9.0 16.4 28 465 A F H 3< S+ 0 0 2 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.782 108.7 54.5 -60.1 -26.8 -2.9 -5.9 15.0 29 466 A L T >< S+ 0 0 34 -4,-1.2 2,-0.9 -3,-0.3 3,-0.5 0.204 70.9 125.8 -97.5 14.9 0.2 -8.1 14.8 30 467 A N T < S- 0 0 70 -3,-1.7 3,-0.1 1,-0.2 45,-0.1 -0.653 102.7 -32.3 -75.5 103.5 -1.3 -11.0 12.7 31 468 A R T 3 S+ 0 0 239 -2,-0.9 2,-0.4 1,-0.2 -1,-0.2 0.824 117.1 116.2 51.5 39.0 1.3 -11.1 9.7 32 469 A T S < S- 0 0 21 -3,-0.5 -1,-0.2 39,-0.0 38,-0.1 -0.994 73.0-106.4-139.2 127.8 1.8 -7.3 10.0 33 470 A S >> - 0 0 77 -2,-0.4 4,-2.3 1,-0.1 3,-0.7 -0.294 20.6-128.5 -57.5 139.0 5.2 -5.7 11.0 34 471 A G H 3> S+ 0 0 33 1,-0.2 4,-2.3 2,-0.2 -1,-0.1 0.865 105.1 67.5 -55.0 -41.9 5.4 -4.2 14.5 35 472 A K H 34 S+ 0 0 179 1,-0.2 -1,-0.2 2,-0.2 -2,-0.0 0.830 112.9 28.4 -45.4 -49.4 6.7 -0.9 13.0 36 473 A M H <> S+ 0 0 96 -3,-0.7 4,-1.6 2,-0.1 -1,-0.2 0.914 120.4 53.9 -82.7 -48.9 3.3 -0.2 11.3 37 474 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.906 103.1 51.5 -54.5 -58.1 1.0 -2.0 13.7 38 475 A I H >X S+ 0 0 34 -4,-2.3 4,-1.9 2,-0.2 3,-0.7 0.938 109.8 47.8 -53.1 -58.6 1.9 -0.5 17.1 39 476 A P H 3> S+ 0 0 74 0, 0.0 4,-1.4 0, 0.0 3,-0.4 0.926 117.0 44.6 -43.6 -58.2 1.6 3.3 16.1 40 477 A V H 3X S+ 0 0 20 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.714 106.2 63.0 -58.5 -27.0 -1.8 2.4 14.5 41 478 A L H X S+ 0 0 95 -4,-1.4 4,-1.4 -5,-0.2 3,-1.0 0.917 110.1 46.2 -60.4 -43.5 -4.6 5.4 17.2 44 481 A F H 3X S+ 0 0 0 -4,-2.0 4,-3.6 -3,-0.3 -2,-0.2 0.914 107.8 56.3 -62.0 -49.6 -7.3 2.7 17.5 45 482 A L H 3< S+ 0 0 22 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.467 105.6 52.3 -67.9 -2.7 -7.2 2.7 21.4 46 483 A E H <4 S+ 0 0 152 -3,-1.0 -1,-0.2 -4,-0.4 -2,-0.2 0.806 117.4 35.8 -96.8 -42.4 -8.0 6.5 21.4 47 484 A K H < S+ 0 0 118 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.1 0.897 135.5 27.2 -73.5 -41.5 -11.1 6.2 19.2 48 485 A Y < + 0 0 16 -4,-3.6 -1,-0.2 -5,-0.2 -2,-0.1 -0.733 69.2 168.7-124.5 76.4 -12.0 2.8 20.8 49 486 A P + 0 0 69 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.588 62.7 25.8 -70.4 -11.3 -10.6 2.7 24.4 50 487 A S S >> S- 0 0 35 1,-0.1 4,-2.4 -30,-0.1 3,-0.6 -0.951 74.8-112.8-145.9 165.5 -12.6 -0.5 25.5 51 488 A A H 3> S+ 0 0 4 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.868 116.8 63.8 -63.5 -34.7 -14.3 -3.8 24.5 52 489 A E H 34 S+ 0 0 122 2,-0.2 -1,-0.2 1,-0.2 4,-0.2 0.781 111.7 33.9 -57.5 -34.7 -17.5 -2.0 25.6 53 490 A V H X4 S+ 0 0 49 -3,-0.6 3,-2.4 2,-0.1 4,-0.4 0.922 115.1 53.6 -89.1 -50.4 -17.1 0.6 22.8 54 491 A A H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.3 -2,-0.2 0.788 101.1 64.8 -51.1 -34.3 -15.4 -1.5 20.0 55 492 A R T 3< S+ 0 0 102 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.1 0.733 107.2 40.5 -62.1 -26.0 -18.4 -4.0 20.4 56 493 A T T < S+ 0 0 99 -3,-2.4 -1,-0.3 -4,-0.2 -2,-0.2 0.297 93.8 120.6-103.8 2.7 -20.8 -1.2 19.2 57 494 A A S < S- 0 0 16 -3,-1.2 2,-0.7 -4,-0.4 3,-0.1 -0.368 71.0-117.2 -68.5 147.3 -18.3 0.0 16.5 58 495 A D >> - 0 0 78 1,-0.2 4,-1.8 -2,-0.1 3,-1.2 -0.764 20.7-144.7 -82.6 117.1 -19.2 0.0 12.8 59 496 A W H 3> S+ 0 0 82 -2,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.852 98.3 61.7 -50.1 -35.3 -16.6 -2.5 11.3 60 497 A R H 3> S+ 0 0 169 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.817 105.2 45.2 -62.1 -34.7 -16.5 -0.2 8.1 61 498 A D H X> S+ 0 0 78 -3,-1.2 4,-1.3 2,-0.2 3,-0.9 0.965 111.7 52.2 -71.7 -49.5 -15.2 2.8 10.2 62 499 A V H 3X S+ 0 0 0 -4,-1.8 4,-0.9 1,-0.3 -2,-0.2 0.804 106.7 56.6 -51.3 -38.5 -12.7 0.4 12.0 63 500 A S H 3X S+ 0 0 1 -4,-2.3 4,-1.1 2,-0.2 3,-0.3 0.846 99.7 56.0 -65.4 -40.2 -11.5 -0.7 8.5 64 501 A E H << S+ 0 0 129 -4,-1.1 3,-0.3 -3,-0.9 -1,-0.2 0.859 107.4 51.2 -60.9 -34.7 -10.7 2.9 7.3 65 502 A L H < S+ 0 0 34 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.778 111.9 46.8 -68.0 -33.5 -8.3 3.2 10.4 66 503 A L H >X S+ 0 0 3 -4,-0.9 3,-3.3 -3,-0.3 4,-0.6 0.613 77.0 107.2 -89.3 -17.3 -6.6 -0.1 9.4 67 504 A K G >< S+ 0 0 80 -4,-1.1 3,-1.7 1,-0.3 5,-0.2 0.788 79.2 50.9 -30.0 -60.5 -6.1 0.5 5.7 68 505 A P G 34 S+ 0 0 85 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.619 107.1 58.2 -55.3 -18.0 -2.2 1.1 6.0 69 506 A L G <4 S- 0 0 13 -3,-3.3 -2,-0.2 1,-0.1 -32,-0.1 0.616 100.1-133.3 -86.8 -20.4 -1.9 -2.2 7.9 70 507 A G S << S+ 0 0 28 -3,-1.7 -1,-0.1 -4,-0.6 5,-0.1 -0.013 86.3 62.8 79.7 163.4 -3.3 -4.7 5.4 71 508 A L S > S+ 0 0 86 1,-0.1 4,-2.8 3,-0.1 5,-0.2 0.759 70.1 151.2 51.9 28.3 -5.9 -7.4 6.2 72 509 A Y H > + 0 0 91 -5,-0.2 4,-0.8 2,-0.2 -6,-0.2 0.691 64.2 37.9 -60.3 -37.0 -8.1 -4.2 7.1 73 510 A D H > S+ 0 0 56 2,-0.2 4,-2.4 3,-0.1 5,-0.2 0.880 118.1 49.7 -86.3 -41.6 -11.6 -5.6 6.4 74 511 A L H > S+ 0 0 110 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.935 117.2 40.3 -57.3 -54.9 -10.9 -9.1 7.7 75 512 A R H X S+ 0 0 8 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.803 112.7 55.8 -68.4 -33.1 -9.4 -7.7 11.0 76 513 A A H X S+ 0 0 0 -4,-0.8 4,-2.0 2,-0.2 -2,-0.2 0.935 109.8 44.8 -63.9 -50.9 -12.1 -4.9 11.3 77 514 A K H X S+ 0 0 109 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.940 115.1 52.3 -56.0 -45.0 -14.9 -7.5 11.2 78 515 A T H X S+ 0 0 18 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.860 105.6 51.9 -57.8 -47.0 -12.7 -9.5 13.7 79 516 A I H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.889 112.2 46.4 -63.7 -38.0 -12.3 -6.5 16.1 80 517 A V H X S+ 0 0 26 -4,-2.0 4,-0.9 2,-0.1 -1,-0.2 0.859 117.5 44.0 -73.6 -29.1 -16.1 -6.0 16.3 81 518 A K H X S+ 0 0 103 -4,-1.9 4,-2.1 -5,-0.2 3,-0.4 0.978 114.6 44.7 -76.8 -54.7 -16.8 -9.7 16.7 82 519 A F H X S+ 0 0 0 -4,-2.8 4,-3.4 1,-0.2 5,-0.2 0.913 111.1 53.3 -52.5 -54.3 -14.1 -10.6 19.3 83 520 A S H X S+ 0 0 0 -4,-1.4 4,-1.0 -5,-0.3 -1,-0.2 0.826 109.5 51.6 -51.3 -39.7 -14.8 -7.5 21.6 84 521 A D H >X S+ 0 0 61 -4,-0.9 4,-1.2 -3,-0.4 3,-0.9 0.981 114.9 39.6 -62.3 -58.1 -18.6 -8.6 21.6 85 522 A E H 3X S+ 0 0 20 -4,-2.1 4,-3.4 1,-0.2 3,-0.3 0.863 106.2 67.4 -56.9 -43.9 -17.8 -12.3 22.7 86 523 A Y H 3< S+ 0 0 37 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.801 115.8 26.5 -45.0 -42.0 -15.1 -11.0 25.1 87 524 A L H << S+ 0 0 68 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.540 128.9 43.6 -99.8 -16.0 -17.8 -9.4 27.2 88 525 A T H < S+ 0 0 85 -4,-1.2 2,-0.2 -3,-0.3 -3,-0.2 0.787 101.9 61.8-104.1 -33.3 -20.7 -11.7 26.3 89 526 A K S < S- 0 0 105 -4,-3.4 2,-0.4 -5,-0.1 8,-0.0 -0.597 81.5-119.4 -90.3 155.5 -19.4 -15.3 26.4 90 527 A Q + 0 0 192 -2,-0.2 2,-0.3 -3,-0.0 -3,-0.1 -0.824 47.2 165.8 -91.0 131.3 -18.0 -17.0 29.5 91 528 A W - 0 0 58 -2,-0.4 0, 0.0 -5,-0.1 0, 0.0 -0.987 37.3-170.1-149.2 150.3 -14.4 -17.9 28.7 92 529 A K S S+ 0 0 124 1,-0.4 -1,-0.1 -2,-0.3 -2,-0.0 0.736 87.8 29.6-105.8 -43.8 -11.2 -19.0 30.6 93 530 A Y S > S- 0 0 54 1,-0.1 3,-1.7 15,-0.0 -1,-0.4 -0.955 79.4-129.4-117.9 134.2 -8.7 -18.7 27.8 94 531 A P G > S+ 0 0 0 0, 0.0 3,-2.0 0, 0.0 6,-0.3 0.683 98.7 83.6 -58.5 -16.2 -9.2 -16.1 25.0 95 532 A I G 3 S+ 0 0 84 1,-0.3 5,-0.2 7,-0.1 4,-0.1 0.816 81.5 64.0 -53.0 -33.2 -8.6 -18.9 22.4 96 533 A E G < S+ 0 0 97 -3,-1.7 -1,-0.3 2,-0.1 2,-0.1 0.811 93.4 87.3 -60.4 -29.4 -12.3 -19.7 22.9 97 534 A L S X S- 0 0 4 -3,-2.0 3,-1.7 -4,-0.3 2,-0.2 -0.387 92.0 -98.5 -82.3 147.0 -13.0 -16.2 21.4 98 535 A H T 3 S+ 0 0 68 1,-0.2 -12,-0.1 -17,-0.1 -1,-0.1 -0.444 108.2 19.6 -63.2 122.4 -13.3 -15.3 17.7 99 536 A G T 3 S+ 0 0 33 -2,-0.2 2,-0.5 1,-0.2 -1,-0.2 0.293 101.1 101.4 100.7 -9.0 -10.1 -13.9 16.3 100 537 A I < + 0 0 11 -3,-1.7 -1,-0.2 -6,-0.3 2,-0.1 -0.944 41.4 155.0-113.8 124.7 -7.8 -15.3 18.9 101 538 A G > - 0 0 37 -2,-0.5 4,-2.3 -3,-0.1 5,-0.2 -0.352 62.6 -45.8-122.8-154.0 -5.8 -18.5 18.2 102 539 A K H >> S+ 0 0 93 1,-0.2 4,-3.3 2,-0.2 3,-0.5 0.922 132.3 50.4 -45.6 -62.9 -2.5 -20.1 19.4 103 540 A Y H 3> S+ 0 0 55 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.817 114.2 42.6 -43.3 -51.1 -0.5 -16.8 19.3 104 541 A G H 3> S+ 0 0 3 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.811 115.9 49.6 -70.4 -32.0 -3.1 -14.7 21.3 105 542 A N H S+ 0 0 27 -4,-2.1 4,-2.2 1,-0.2 5,-1.1 0.940 110.7 53.2 -61.1 -47.9 -2.4 -14.1 27.4 109 546 A R H <5S+ 0 0 42 -4,-3.2 6,-0.9 3,-0.2 -1,-0.2 0.767 118.5 37.3 -59.9 -24.4 -1.0 -17.3 29.1 110 547 A I H <5S+ 0 0 0 -4,-1.2 6,-0.3 -3,-0.4 -2,-0.2 0.906 130.1 24.8 -89.9 -54.1 2.4 -15.5 29.5 111 548 A F H <5S+ 0 0 1 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.787 128.6 37.5 -86.8 -34.9 1.5 -11.9 30.3 112 549 A C T <5S+ 0 0 31 -4,-2.2 2,-0.3 -5,-0.4 -3,-0.2 0.592 123.0 29.3 -96.7 -11.3 -2.0 -12.0 31.8 113 550 A V S + 0 0 30 -2,-1.4 3,-0.9 -6,-0.9 4,-0.5 0.215 31.6 116.5-147.6 11.4 1.5 -20.0 32.9 116 553 A W G > S+ 0 0 17 -6,-0.3 3,-1.0 -3,-0.3 -6,-0.1 0.827 76.3 57.6 -57.4 -35.9 4.6 -19.1 30.9 117 554 A K G 3 S+ 0 0 105 1,-0.2 -1,-0.2 -7,-0.1 -7,-0.1 0.827 107.5 48.5 -60.5 -37.2 6.3 -22.4 31.9 118 555 A Q G < S+ 0 0 121 -3,-0.9 2,-0.3 -9,-0.1 -1,-0.2 0.452 97.4 93.5 -80.4 -11.1 3.4 -24.3 30.3 119 556 A V < - 0 0 0 -3,-1.0 -13,-0.0 -4,-0.5 -3,-0.0 -0.684 47.9-174.5 -93.8 144.4 3.5 -22.2 27.0 120 557 A H - 0 0 135 -2,-0.3 2,-0.1 0, 0.0 -14,-0.1 -0.887 23.4-165.2-131.8 89.0 5.5 -23.2 23.8 121 558 A P - 0 0 17 0, 0.0 -18,-0.0 0, 0.0 -19,-0.0 -0.424 21.6-168.6 -81.6 163.1 5.0 -20.1 21.5 122 559 A E + 0 0 150 -2,-0.1 5,-0.2 5,-0.0 -20,-0.0 0.794 55.1 100.8-112.1 -44.3 5.7 -20.0 17.8 123 560 A A S > S- 0 0 36 3,-0.1 4,-1.7 1,-0.1 3,-0.2 0.013 75.7-123.0 -42.9 134.6 5.6 -16.2 16.9 124 561 A H H >> S+ 0 0 121 1,-0.2 4,-1.7 2,-0.2 3,-0.6 0.942 104.9 41.9 -56.7 -64.6 9.1 -14.7 16.6 125 562 A K H 3> S+ 0 0 113 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.771 114.7 58.2 -57.0 -20.3 9.3 -11.8 19.0 126 563 A L H 3> S+ 0 0 2 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.883 103.0 48.0 -75.7 -40.8 7.4 -14.1 21.5 127 564 A N H < S+ 0 0 109 -4,-1.9 3,-1.4 1,-0.2 -2,-0.2 0.883 116.2 52.9 -59.4 -41.6 13.7 -19.6 31.1 135 572 A E H 3< S+ 0 0 159 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.932 108.8 47.3 -60.5 -48.3 17.3 -18.3 30.6 136 573 A N T 3< 0 0 131 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.043 360.0 360.0 -80.5 22.9 17.0 -15.6 33.3 137 574 A H < 0 0 141 -3,-1.4 -3,-0.1 0, 0.0 -4,-0.0 -0.430 360.0 360.0-136.1 360.0 15.4 -18.3 35.6