==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 26-APR-12 4EW0 . COMPND 2 MOLECULE: METHYL-CPG-BINDING DOMAIN PROTEIN 4; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR H.HASHIMOTO,X.ZHANG,X.CHENG . 143 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7525.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 92 64.3 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 . 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 . 6 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 44.1 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 1 0 0 0 1 0 2 0 0 0 1 0 1 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 1 412 A W 0 0 88 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 112.8 -5.9 -7.5 -12.6 2 413 A T - 0 0 95 112,-0.0 110,-0.1 15,-0.0 109,-0.1 -0.971 360.0-121.3-121.7 118.4 -7.4 -5.3 -9.9 3 414 A P - 0 0 10 0, 0.0 13,-0.1 0, 0.0 108,-0.1 -0.238 27.1-124.7 -57.3 136.5 -9.7 -6.9 -7.3 4 415 A P - 0 0 23 0, 0.0 2,-0.7 0, 0.0 129,-0.0 -0.160 28.4 -97.1 -73.2 174.3 -13.3 -5.5 -7.0 5 416 A R - 0 0 135 4,-0.0 9,-0.0 9,-0.0 0, 0.0 -0.861 43.5-164.9-102.3 111.4 -14.8 -4.1 -3.8 6 417 A S > - 0 0 8 -2,-0.7 3,-0.8 4,-0.1 123,-0.1 -0.522 30.7-122.4 -95.5 159.3 -17.0 -6.7 -2.0 7 418 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 122,-0.0 0.778 109.4 70.1 -66.7 -27.3 -19.6 -6.3 0.8 8 419 A F T 3 S- 0 0 54 1,-0.1 121,-0.0 117,-0.1 -3,-0.0 0.788 94.1-149.0 -59.2 -28.8 -17.5 -8.7 2.9 9 420 A N < - 0 0 95 -3,-0.8 2,-0.1 1,-0.2 -1,-0.1 0.913 18.2-169.6 59.7 49.9 -15.0 -5.9 3.1 10 421 A L > - 0 0 5 1,-0.1 3,-1.6 115,-0.1 4,-0.3 -0.430 28.5-128.3 -68.2 144.2 -11.9 -8.1 3.4 11 422 A V G > S+ 0 0 15 1,-0.3 3,-1.2 2,-0.2 4,-0.4 0.734 106.3 70.8 -68.1 -20.1 -8.7 -6.2 4.3 12 423 A Q G > S+ 0 0 7 1,-0.2 3,-0.5 2,-0.2 4,-0.3 0.721 83.5 72.1 -65.4 -21.2 -7.0 -7.9 1.3 13 424 A E G < S+ 0 0 7 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.740 105.9 35.0 -68.6 -23.6 -9.2 -5.7 -0.9 14 425 A I G < S+ 0 0 70 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.395 117.6 53.5-108.3 0.5 -7.2 -2.6 -0.0 15 426 A L S X S+ 0 0 7 -3,-0.5 3,-1.1 -4,-0.4 7,-0.5 0.126 70.9 106.0-121.6 17.2 -3.8 -4.4 0.2 16 427 A F T 3 S+ 0 0 54 -4,-0.3 -1,-0.1 1,-0.2 -3,-0.1 0.843 76.0 59.1 -65.6 -33.1 -3.7 -6.0 -3.2 17 428 A H T 3 S+ 0 0 133 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.443 105.5 51.7 -80.4 -0.3 -1.1 -3.6 -4.5 18 429 A D <> - 0 0 46 -3,-1.1 4,-2.8 1,-0.1 5,-0.2 -0.730 63.0-173.8-139.5 88.7 1.4 -4.5 -1.8 19 430 A P H > S+ 0 0 32 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.841 87.9 52.9 -48.7 -43.4 2.0 -8.3 -1.5 20 431 A W H > S+ 0 0 5 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.973 112.2 43.4 -58.9 -55.6 4.1 -7.9 1.6 21 432 A K H > S+ 0 0 53 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.879 112.8 52.9 -57.7 -42.7 1.4 -5.9 3.4 22 433 A L H X S+ 0 0 0 -4,-2.8 4,-1.6 -7,-0.5 -1,-0.2 0.913 112.1 45.3 -59.0 -43.5 -1.3 -8.2 2.3 23 434 A L H X S+ 0 0 0 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.839 109.3 54.9 -72.5 -33.5 0.6 -11.2 3.6 24 435 A I H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.901 107.3 52.8 -59.9 -39.9 1.4 -9.4 6.8 25 436 A A H X S+ 0 0 2 -4,-2.2 4,-1.1 1,-0.2 -2,-0.2 0.865 104.8 53.6 -64.8 -39.4 -2.4 -8.9 7.2 26 437 A T H < S+ 0 0 2 -4,-1.6 3,-0.4 2,-0.2 -1,-0.2 0.915 108.4 49.9 -60.6 -44.1 -3.0 -12.6 6.7 27 438 A I H >< S+ 0 0 2 -4,-1.8 3,-1.5 1,-0.3 -2,-0.2 0.896 107.7 53.2 -62.6 -41.1 -0.6 -13.3 9.6 28 439 A F H 3< S+ 0 0 3 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.765 107.7 53.8 -62.2 -25.2 -2.4 -10.8 11.8 29 440 A L T >< S+ 0 0 42 -4,-1.1 3,-1.2 -3,-0.4 2,-0.8 0.393 74.5 125.6 -92.0 0.6 -5.6 -12.7 10.9 30 441 A N T < S- 0 0 68 -3,-1.5 3,-0.1 1,-0.3 -3,-0.1 -0.513 102.4 -30.6 -64.2 105.4 -4.2 -16.0 12.1 31 442 A R T 3 S+ 0 0 240 -2,-0.8 2,-0.3 1,-0.2 -1,-0.3 0.865 121.7 110.4 48.2 42.2 -6.8 -17.2 14.6 32 443 A T S < S- 0 0 20 -3,-1.2 -1,-0.2 4,-0.0 2,-0.1 -0.974 73.7-114.2-147.7 128.0 -7.4 -13.5 15.4 33 444 A S >> - 0 0 59 -2,-0.3 4,-2.6 1,-0.2 3,-1.1 -0.375 17.0-134.8 -64.4 136.9 -10.5 -11.4 14.6 34 445 A G H 3> S+ 0 0 17 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.643 101.5 75.5 -65.8 -13.4 -9.9 -8.6 12.1 35 446 A K H 34 S+ 0 0 154 1,-0.2 -1,-0.3 2,-0.2 -2,-0.0 0.897 113.6 19.9 -63.6 -42.2 -11.9 -6.5 14.5 36 447 A M H <> S+ 0 0 114 -3,-1.1 4,-1.1 2,-0.1 -2,-0.2 0.751 126.6 55.6 -94.4 -31.3 -8.9 -6.3 16.9 37 448 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 3,-0.2 0.952 98.9 55.9 -70.9 -54.3 -6.2 -7.3 14.3 38 449 A I H X S+ 0 0 39 -4,-1.5 4,-1.6 1,-0.2 -1,-0.2 0.858 105.9 51.1 -50.9 -45.7 -6.8 -4.6 11.6 39 450 A P H > S+ 0 0 71 0, 0.0 4,-1.5 0, 0.0 3,-0.3 0.936 112.8 45.7 -59.5 -44.3 -6.3 -1.6 13.9 40 451 A V H X S+ 0 0 22 -4,-1.1 4,-2.3 1,-0.2 -2,-0.2 0.815 106.1 62.7 -66.1 -30.0 -3.0 -3.0 15.3 41 452 A L H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.899 103.1 47.8 -60.5 -41.5 -2.1 -3.7 11.7 42 453 A W H X S+ 0 0 101 -4,-1.6 4,-1.6 -3,-0.3 -1,-0.2 0.866 110.8 50.6 -70.1 -36.5 -2.2 -0.0 10.9 43 454 A E H X S+ 0 0 45 -4,-1.5 4,-1.1 2,-0.2 -1,-0.2 0.877 113.6 47.7 -64.1 -37.6 -0.1 0.8 14.0 44 455 A F H X S+ 0 0 1 -4,-2.3 4,-3.5 2,-0.2 3,-0.4 0.941 111.2 47.4 -67.7 -50.7 2.3 -1.8 12.8 45 456 A L H < S+ 0 0 11 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.767 107.9 57.5 -66.0 -26.6 2.6 -0.7 9.2 46 457 A E H < S+ 0 0 166 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.850 115.0 37.8 -69.7 -34.2 3.0 2.9 10.4 47 458 A K H < S+ 0 0 54 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.1 0.891 132.6 26.5 -81.2 -43.7 6.1 1.7 12.3 48 459 A Y < + 0 0 32 -4,-3.5 -1,-0.2 1,-0.1 -2,-0.1 -0.743 66.9 167.3-124.5 83.3 7.3 -0.7 9.7 49 460 A P + 0 0 69 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.474 65.2 33.1 -76.8 -5.0 6.1 0.5 6.3 50 461 A S S > S- 0 0 29 1,-0.1 4,-1.8 -30,-0.1 5,-0.1 -0.934 76.9-116.6-145.3 169.2 8.4 -1.9 4.3 51 462 A A H > S+ 0 0 5 -2,-0.3 4,-2.1 2,-0.2 5,-0.2 0.739 114.3 61.3 -76.8 -24.8 10.0 -5.3 4.4 52 463 A E H 4 S+ 0 0 114 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.831 112.0 38.2 -67.9 -32.7 13.4 -3.7 4.5 53 464 A V H 4 S+ 0 0 64 2,-0.2 -2,-0.2 1,-0.1 -1,-0.2 0.828 114.4 55.0 -84.1 -36.1 12.4 -2.0 7.8 54 465 A A H >< S+ 0 0 2 -4,-1.8 3,-1.2 1,-0.2 -2,-0.2 0.875 104.7 51.9 -67.3 -39.1 10.6 -5.1 9.1 55 466 A R T 3< S+ 0 0 110 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.791 109.8 50.4 -68.9 -27.3 13.5 -7.5 8.7 56 467 A A T 3 S+ 0 0 87 -4,-0.5 -1,-0.3 -5,-0.2 -2,-0.2 0.289 91.6 112.7 -93.4 9.6 15.8 -5.1 10.6 57 468 A A S < S- 0 0 22 -3,-1.2 2,-0.5 1,-0.1 -3,-0.1 -0.405 71.5-117.6 -84.0 157.7 13.4 -4.8 13.5 58 469 A D >> - 0 0 95 1,-0.1 3,-1.3 -2,-0.1 4,-1.1 -0.865 19.2-144.2 -95.0 124.8 13.8 -6.0 17.0 59 470 A W H 3> S+ 0 0 102 -2,-0.5 4,-2.9 1,-0.3 5,-0.3 0.757 94.7 65.4 -64.9 -28.3 11.1 -8.6 17.8 60 471 A R H 3> S+ 0 0 46 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.812 102.4 51.4 -63.2 -29.7 10.6 -7.6 21.4 61 472 A D H <> S+ 0 0 103 -3,-1.3 4,-0.8 2,-0.2 -1,-0.2 0.910 112.2 44.6 -69.8 -45.6 9.3 -4.3 20.1 62 473 A V H >X S+ 0 0 2 -4,-1.1 4,-2.2 1,-0.2 3,-0.9 0.912 109.2 54.1 -68.2 -45.7 6.8 -6.0 17.8 63 474 A S H 3X S+ 0 0 10 -4,-2.9 4,-1.1 1,-0.3 -1,-0.2 0.846 103.9 59.1 -56.9 -33.7 5.6 -8.5 20.3 64 475 A E H 3< S+ 0 0 40 -4,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.831 109.9 42.1 -62.0 -34.0 4.9 -5.5 22.5 65 476 A L H << S+ 0 0 54 -3,-0.9 -2,-0.2 -4,-0.8 -1,-0.2 0.780 115.6 49.4 -82.2 -30.3 2.6 -4.2 19.8 66 477 A L H >X S+ 0 0 1 -4,-2.2 3,-1.5 1,-0.2 4,-1.0 0.533 82.6 103.1 -86.5 -8.6 1.1 -7.6 19.2 67 478 A K G >< S+ 0 0 128 -4,-1.1 3,-0.9 1,-0.3 5,-0.2 0.847 78.1 47.2 -43.5 -53.6 0.4 -8.2 22.9 68 479 A P G 34 S+ 0 0 100 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.733 110.2 55.6 -68.8 -16.8 -3.3 -7.6 23.0 69 480 A L G <4 S- 0 0 18 -3,-1.5 -2,-0.2 1,-0.2 -36,-0.1 0.715 104.5-133.5 -83.4 -23.1 -3.8 -9.8 19.9 70 481 A G S << S+ 0 0 24 -4,-1.0 -1,-0.2 -3,-0.9 -38,-0.0 -0.128 83.1 69.6 84.9 168.9 -2.2 -12.9 21.4 71 482 A L > + 0 0 81 1,-0.1 4,-1.7 -4,-0.1 5,-0.2 0.806 65.5 147.2 54.3 32.2 0.4 -15.1 19.7 72 483 A Y H > + 0 0 101 -5,-0.2 4,-1.7 1,-0.2 5,-0.1 0.866 58.0 47.3 -71.0 -41.2 2.7 -12.0 20.1 73 484 A D H > S+ 0 0 72 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.924 116.8 39.9 -70.8 -45.7 6.1 -13.7 20.5 74 485 A L H > S+ 0 0 103 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.893 115.4 51.6 -72.9 -39.7 6.0 -16.2 17.7 75 486 A R H X S+ 0 0 5 -4,-1.7 4,-4.1 2,-0.2 5,-0.2 0.907 105.8 55.6 -61.7 -43.7 4.3 -13.8 15.2 76 487 A A H X S+ 0 0 0 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.896 112.7 41.5 -57.1 -43.2 6.9 -11.1 15.9 77 488 A K H X S+ 0 0 109 -4,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.841 115.9 51.3 -73.4 -34.1 9.7 -13.6 15.0 78 489 A T H X S+ 0 0 17 -4,-2.3 4,-4.1 2,-0.2 5,-0.3 0.947 108.7 50.3 -64.7 -50.0 7.6 -14.9 12.1 79 490 A I H X S+ 0 0 2 -4,-4.1 4,-2.2 1,-0.2 -2,-0.2 0.900 114.2 44.9 -55.4 -45.0 7.0 -11.3 10.7 80 491 A I H X S+ 0 0 31 -4,-1.8 4,-2.1 -5,-0.2 -1,-0.2 0.929 117.2 44.1 -65.3 -46.9 10.7 -10.6 10.9 81 492 A K H X S+ 0 0 101 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.929 114.8 49.1 -64.3 -46.0 11.7 -13.9 9.3 82 493 A F H X S+ 0 0 0 -4,-4.1 4,-2.3 1,-0.2 -1,-0.2 0.888 110.1 52.0 -59.3 -41.6 8.9 -13.6 6.7 83 494 A S H X S+ 0 0 0 -4,-2.2 4,-1.1 -5,-0.3 -1,-0.2 0.899 110.6 47.5 -65.0 -42.1 10.0 -10.1 5.8 84 495 A D H >X S+ 0 0 56 -4,-2.1 4,-3.6 1,-0.2 3,-0.8 0.959 115.1 44.6 -62.4 -52.0 13.6 -11.2 5.4 85 496 A E H 3< S+ 0 0 29 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.823 105.5 62.7 -62.9 -32.2 12.7 -14.1 3.2 86 497 A Y H 3< S+ 0 0 45 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.828 120.2 25.0 -62.1 -31.6 10.2 -12.0 1.3 87 498 A L H << S+ 0 0 54 -4,-1.1 -2,-0.2 -3,-0.8 -3,-0.1 0.884 132.1 34.1 -94.7 -56.8 13.2 -9.9 0.2 88 499 A T S < S+ 0 0 73 -4,-3.6 -3,-0.2 -5,-0.2 -2,-0.1 0.988 103.4 70.1 -67.0 -65.3 16.2 -12.2 0.3 89 500 A K S S- 0 0 90 -5,-0.3 2,-0.9 1,-0.1 8,-0.0 -0.201 82.5-122.7 -60.0 143.6 14.9 -15.6 -0.6 90 501 A Q + 0 0 98 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.790 45.1 163.2 -92.0 102.0 13.9 -16.2 -4.2 91 502 A W - 0 0 59 -2,-0.9 0, 0.0 -5,-0.2 0, 0.0 -0.722 36.9-166.7-111.9 162.5 10.2 -17.3 -4.2 92 503 A R S S+ 0 0 193 1,-0.4 -1,-0.1 -2,-0.3 -2,-0.0 0.487 88.4 29.3-115.6 -21.2 7.5 -17.5 -6.8 93 504 A Y S > S- 0 0 51 1,-0.0 3,-1.4 16,-0.0 -1,-0.4 -0.999 77.5-128.5-140.1 140.6 4.8 -18.0 -4.2 94 505 A P G > S+ 0 0 0 0, 0.0 3,-1.4 0, 0.0 6,-0.3 0.647 98.1 78.0 -62.4 -19.2 4.6 -16.8 -0.6 95 506 A I G 3 S+ 0 0 82 1,-0.3 5,-0.3 4,-0.1 4,-0.1 0.860 88.4 59.5 -59.2 -35.0 3.8 -20.2 0.8 96 507 A E G < S+ 0 0 85 -3,-1.4 -1,-0.3 2,-0.1 2,-0.2 0.706 92.2 85.9 -63.6 -24.6 7.5 -21.1 0.5 97 508 A L S X S- 0 0 1 -3,-1.4 3,-1.4 -4,-0.3 -15,-0.1 -0.570 97.6 -94.7 -78.5 146.3 8.2 -18.1 2.8 98 509 A H T 3 S+ 0 0 69 1,-0.2 -1,-0.1 -2,-0.2 -12,-0.1 -0.360 106.0 21.4 -64.5 134.5 8.1 -18.9 6.5 99 510 A G T 3 S+ 0 0 30 1,-0.1 2,-0.6 -4,-0.1 -1,-0.2 0.322 96.6 105.8 94.8 -7.0 4.8 -18.2 8.3 100 511 A I < + 0 0 8 -3,-1.4 -1,-0.1 -5,-0.3 -3,-0.1 -0.910 42.1 169.2-111.9 110.3 2.6 -18.3 5.2 101 512 A G > - 0 0 42 -2,-0.6 4,-1.7 -3,-0.1 5,-0.1 0.057 57.4 -62.3 -94.6-150.7 0.5 -21.4 4.7 102 513 A K H > S+ 0 0 84 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.878 130.0 54.9 -68.0 -39.5 -2.3 -22.1 2.2 103 514 A Y H > S+ 0 0 49 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.956 112.3 41.3 -59.8 -54.0 -4.6 -19.3 3.5 104 515 A G H > S+ 0 0 3 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.862 116.8 50.5 -60.7 -36.9 -2.0 -16.6 3.1 105 516 A N H X S+ 0 0 11 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.791 108.8 50.8 -74.4 -28.9 -1.0 -18.1 -0.2 106 517 A D H X S+ 0 0 3 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.789 108.0 54.1 -75.5 -29.1 -4.5 -18.2 -1.5 107 518 A S H >X S+ 0 0 0 -4,-1.7 4,-2.3 -5,-0.2 3,-0.7 0.918 107.8 49.7 -67.9 -44.0 -5.0 -14.6 -0.6 108 519 A Y H 3X>S+ 0 0 29 -4,-1.8 4,-1.3 1,-0.2 5,-1.2 0.840 111.3 49.6 -61.3 -35.5 -1.9 -13.6 -2.6 109 520 A R H 3<5S+ 0 0 49 -4,-1.2 6,-1.7 3,-0.2 -1,-0.2 0.581 115.3 42.1 -86.7 -10.6 -3.2 -15.6 -5.6 110 521 A I H <<5S+ 0 0 0 -4,-0.7 6,-0.2 -3,-0.7 -2,-0.2 0.750 131.1 20.8 -98.3 -33.1 -6.7 -14.0 -5.5 111 522 A F H <5S+ 0 0 2 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.821 125.5 41.3-108.0 -40.7 -5.7 -10.5 -4.8 112 523 A C T <5S+ 0 0 28 -4,-1.3 2,-0.3 -5,-0.5 -3,-0.2 0.781 124.3 16.8 -87.1 -27.7 -2.0 -9.9 -5.8 113 524 A V S + 0 0 33 -6,-1.7 3,-1.6 -2,-1.1 4,-0.3 0.111 39.7 118.7-131.2 13.4 -4.9 -16.9 -10.5 116 527 A W T 3 S+ 0 0 0 1,-0.3 3,-0.3 -3,-0.3 -6,-0.1 0.690 73.2 53.5 -63.4 -21.4 -8.2 -16.5 -8.6 117 528 A K T 3 S+ 0 0 51 1,-0.2 -1,-0.3 26,-0.1 -7,-0.1 0.732 108.7 50.5 -81.1 -23.3 -10.0 -18.9 -10.9 118 529 A Q S < S+ 0 0 131 -3,-1.6 2,-0.5 -9,-0.2 -2,-0.2 0.342 96.5 96.1 -91.0 4.4 -7.3 -21.5 -10.2 119 530 A V + 0 0 0 -3,-0.3 -13,-0.0 -4,-0.3 -3,-0.0 -0.846 46.8 180.0-104.0 128.9 -7.7 -20.9 -6.5 120 531 A H - 0 0 139 -2,-0.5 7,-0.1 10,-0.0 -3,-0.1 -0.838 20.2-158.1-125.8 93.4 -9.8 -23.2 -4.3 121 532 A P - 0 0 13 0, 0.0 -18,-0.1 0, 0.0 -2,-0.0 -0.246 22.3-162.8 -71.9 154.9 -9.6 -21.9 -0.7 122 533 A E + 0 0 158 5,-0.0 2,-0.1 4,-0.0 -19,-0.1 0.378 64.8 104.0-109.7 -5.4 -10.3 -23.9 2.4 123 534 A N S > S- 0 0 55 1,-0.1 4,-1.0 -21,-0.1 5,-0.1 -0.439 72.1-133.1 -75.0 150.7 -10.6 -20.7 4.5 124 535 A H H >> S+ 0 0 138 2,-0.2 4,-1.5 1,-0.2 3,-0.8 0.993 101.3 35.9 -68.5 -63.9 -14.1 -19.5 5.5 125 536 A K H 3> S+ 0 0 79 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.706 115.6 57.0 -68.4 -20.9 -14.0 -15.8 4.6 126 537 A L H 3> S+ 0 0 1 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.763 104.6 52.3 -79.2 -27.3 -11.9 -16.4 1.5 127 538 A N H X S+ 0 0 29 -4,-2.8 4,-1.3 1,-0.2 3,-0.7 0.858 88.0 47.1 -61.8 -39.1 -17.5 -11.4 -12.2 138 549 A E H 34 S+ 0 0 76 -4,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.797 105.7 59.8 -73.5 -28.4 -19.2 -11.3 -15.6 139 550 A K H 34 S+ 0 0 90 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.2 0.609 113.4 41.0 -73.3 -12.1 -21.2 -8.2 -14.5 140 551 A L H << S- 0 0 84 -3,-0.7 -2,-0.2 -4,-0.6 -3,-0.1 0.813 114.8 -96.1 -95.1 -86.1 -17.8 -6.5 -14.1 141 552 A S S < S+ 0 0 99 -4,-1.3 -3,-0.1 1,-0.0 -4,-0.1 0.246 79.6 109.7-168.4 -33.2 -15.4 -7.3 -16.8 142 553 A L 0 0 33 -5,-0.3 -2,-0.2 1,-0.1 -1,-0.0 0.009 360.0 360.0 -64.3 164.0 -13.1 -10.2 -15.7 143 554 A S 0 0 119 -5,-0.0 -26,-0.1 0, 0.0 -1,-0.1 -0.858 360.0 360.0-164.2 360.0 -13.1 -13.8 -16.9