==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 01-FEB-08 3C5W . COMPND 2 MOLECULE: PP2A A SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.XING,Z.LI,Y.CHEN,J.STOCK,P.D.JEFFREY,Y.SHI . 816 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32977.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 600 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 57 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 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 . 40 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 103 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 300 36.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 2.1 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 1 4 6 8 2 2 3 1 1 3 2 1 0 1 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 3 4 2 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 . 1 2 4 4 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 ANTIPARALLEL BRIDGES PER LADDER . 1 3 0 1 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 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 9 A S 0 0 153 0, 0.0 32,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 5.9 -46.0 0.8 50.3 2 10 A L + 0 0 114 2,-0.1 4,-0.1 3,-0.0 3,-0.1 0.369 360.0 54.7-116.9 -1.9 -46.0 4.3 48.9 3 11 A Y S >> S+ 0 0 168 2,-0.1 3,-1.7 1,-0.1 4,-0.9 0.694 80.7 80.2-104.0 -27.0 -42.6 5.5 50.4 4 12 A P H 3> S+ 0 0 57 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.513 82.4 72.3 -67.2 -0.3 -40.1 2.8 49.3 5 13 A I H 3> S+ 0 0 27 2,-0.2 4,-2.9 3,-0.2 5,-0.2 0.841 93.4 52.7 -75.8 -37.6 -39.9 4.7 46.0 6 14 A A H <> S+ 0 0 69 -3,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.861 112.8 45.1 -62.4 -38.4 -38.0 7.6 47.7 7 15 A V H X S+ 0 0 62 -4,-0.9 4,-1.6 2,-0.2 -2,-0.2 0.949 113.7 48.4 -70.1 -51.9 -35.6 4.9 48.9 8 16 A L H X S+ 0 0 6 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.885 113.5 49.0 -53.6 -43.9 -35.3 3.2 45.5 9 17 A I H >X S+ 0 0 48 -4,-2.9 4,-1.1 2,-0.2 3,-1.0 0.957 104.0 57.5 -63.0 -52.8 -34.8 6.6 43.9 10 18 A D H >< S+ 0 0 105 -4,-2.2 3,-0.7 1,-0.3 -1,-0.2 0.871 110.9 44.2 -44.4 -46.9 -32.1 7.8 46.2 11 19 A E H >< S+ 0 0 45 -4,-1.6 3,-0.6 1,-0.2 -1,-0.3 0.741 104.7 62.5 -73.8 -27.2 -30.0 4.8 45.3 12 20 A L H << S+ 0 0 3 -4,-1.2 -1,-0.2 -3,-1.0 -2,-0.2 0.657 112.3 37.5 -73.7 -16.8 -30.7 5.1 41.6 13 21 A R T << S+ 0 0 176 -4,-1.1 -1,-0.2 -3,-0.7 -2,-0.2 0.291 92.2 126.8-114.4 7.4 -28.9 8.5 41.6 14 22 A N < - 0 0 37 -3,-0.6 6,-0.1 -5,-0.2 -3,-0.1 -0.057 67.3-119.2 -62.4 163.8 -26.1 7.6 44.1 15 23 A E S S+ 0 0 156 4,-0.0 2,-0.2 5,-0.0 -1,-0.1 0.940 90.7 82.0 -69.8 -50.5 -22.4 8.1 43.5 16 24 A D S > S- 0 0 106 1,-0.1 4,-1.4 2,-0.0 3,-0.5 -0.419 70.4-148.2 -66.0 123.4 -21.4 4.4 43.8 17 25 A V H > S+ 0 0 42 -2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.816 93.2 65.3 -56.5 -34.9 -22.0 2.4 40.6 18 26 A Q H > S+ 0 0 121 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.873 101.4 45.0 -62.9 -43.5 -22.7 -0.7 42.7 19 27 A L H > S+ 0 0 71 -3,-0.5 4,-2.2 2,-0.2 5,-0.2 0.949 113.4 52.0 -64.4 -49.2 -25.9 0.6 44.4 20 28 A R H X S+ 0 0 50 -4,-1.4 4,-1.2 1,-0.2 -2,-0.2 0.916 110.4 46.5 -48.7 -55.3 -27.2 1.9 41.1 21 29 A L H X S+ 0 0 26 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.892 115.7 41.9 -62.7 -46.8 -26.8 -1.4 39.1 22 30 A N H < S+ 0 0 100 -4,-1.6 -1,-0.2 1,-0.2 3,-0.2 0.889 111.5 53.7 -73.2 -40.6 -28.3 -3.8 41.7 23 31 A S H < S+ 0 0 5 -4,-2.2 3,-0.4 -5,-0.2 -1,-0.2 0.748 103.2 60.7 -63.9 -24.4 -31.2 -1.6 42.6 24 32 A I H >< S+ 0 0 1 -4,-1.2 2,-1.9 1,-0.3 3,-1.9 0.910 96.6 58.4 -65.3 -44.6 -32.0 -1.4 38.9 25 33 A K T 3< S+ 0 0 145 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.1 -0.335 102.5 58.1 -80.1 54.8 -32.5 -5.2 38.9 26 34 A K T 3> S+ 0 0 107 -2,-1.9 4,-1.1 -3,-0.4 -1,-0.3 0.216 78.2 88.7-159.5 -14.5 -35.2 -4.6 41.5 27 35 A L H <> S+ 0 0 1 -3,-1.9 4,-2.0 1,-0.2 5,-0.2 0.782 77.2 65.3 -68.0 -32.4 -37.4 -2.3 39.4 28 36 A S H > S+ 0 0 47 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.926 105.2 42.9 -58.0 -48.3 -39.5 -5.1 37.9 29 37 A T H 4 S+ 0 0 103 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.815 114.8 51.0 -68.1 -32.4 -40.9 -6.2 41.3 30 38 A I H X S+ 0 0 44 -4,-1.1 4,-0.9 2,-0.2 -1,-0.2 0.738 106.4 55.1 -78.4 -24.7 -41.5 -2.5 42.2 31 39 A A H X S+ 0 0 4 -4,-2.0 4,-0.7 1,-0.2 3,-0.3 0.919 108.7 47.3 -68.4 -45.3 -43.3 -2.0 38.9 32 40 A L H < S+ 0 0 138 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.546 96.6 77.3 -72.8 -8.8 -45.7 -4.8 39.7 33 41 A A H 4 S- 0 0 69 -4,-0.3 -1,-0.2 1,-0.1 -2,-0.2 0.980 130.9 -38.8 -62.8 -58.7 -46.1 -3.3 43.2 34 42 A L H < S+ 0 0 138 -4,-0.9 2,-0.4 -3,-0.3 4,-0.3 -0.355 83.2 153.1-168.3 80.9 -48.5 -0.6 41.9 35 43 A G < + 0 0 20 -4,-0.7 -4,-0.0 3,-0.2 -5,-0.0 -0.626 33.0 100.1-125.0 73.6 -47.4 0.8 38.4 36 44 A V S S+ 0 0 139 -2,-0.4 -1,-0.1 -4,-0.0 4,-0.0 0.686 111.7 0.6-110.8 -50.4 -50.1 2.2 36.2 37 45 A E S > S+ 0 0 171 -3,-0.2 4,-1.0 2,-0.1 5,-0.5 0.538 126.1 70.5-108.8 -18.6 -49.6 5.9 36.9 38 46 A R H >>S+ 0 0 101 -4,-0.3 4,-1.5 1,-0.2 5,-0.6 0.943 98.7 46.5 -67.5 -49.9 -46.7 5.6 39.3 39 400 A L H 4>S+ 0 0 5 1,-0.2 5,-1.5 3,-0.2 4,-0.4 0.796 102.0 73.2 -60.0 -28.7 -44.2 4.4 36.6 40 401 A S H 45S- 0 0 73 3,-0.1 -1,-0.2 1,-0.1 -2,-0.2 0.906 126.9 -16.9 -53.6 -53.8 -45.4 7.3 34.4 41 402 A Q H <5S+ 0 0 143 -4,-1.0 -2,-0.2 -3,-0.4 -3,-0.1 0.583 129.2 65.9-130.9 -26.2 -43.9 10.2 36.3 42 403 A S T <5S+ 0 0 46 -4,-1.5 -3,-0.2 -5,-0.5 -2,-0.1 0.607 126.1 2.7 -77.9 -10.4 -42.8 9.0 39.8 43 404 A L T > S+ 0 0 53 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.898 105.1 49.4 -49.7 -43.2 -37.9 10.1 34.7 46 407 A A H > S+ 0 0 24 -3,-0.3 4,-1.8 1,-0.2 -2,-0.2 0.856 111.6 49.2 -63.9 -35.7 -35.2 8.4 36.8 47 408 A I H X S+ 0 0 1 -4,-1.3 4,-1.1 -3,-0.3 -1,-0.2 0.913 107.1 56.3 -67.2 -43.8 -35.1 5.5 34.3 48 409 A V H < S+ 0 0 55 -4,-3.0 4,-0.3 1,-0.2 3,-0.3 0.873 110.1 43.2 -56.9 -44.6 -34.8 8.0 31.3 49 410 A E H >< S+ 0 0 147 -4,-1.8 3,-2.2 1,-0.2 -1,-0.2 0.911 108.9 57.8 -69.7 -42.2 -31.7 9.6 32.8 50 411 A L H >< S+ 0 0 10 -4,-1.8 3,-0.9 1,-0.3 -1,-0.2 0.700 92.3 71.8 -60.2 -20.6 -30.1 6.3 33.7 51 412 A A T 3< S+ 0 0 5 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.763 107.7 34.2 -63.9 -26.2 -30.5 5.4 30.0 52 413 A E T < S+ 0 0 153 -3,-2.2 -1,-0.2 -4,-0.3 -2,-0.2 0.057 82.7 145.2-121.3 24.4 -27.6 7.9 29.4 53 414 A D < - 0 0 19 -3,-0.9 6,-0.2 1,-0.1 -3,-0.1 -0.339 57.1-123.8 -53.6 141.2 -25.5 7.3 32.6 54 415 A A S S+ 0 0 87 1,-0.1 2,-0.9 4,-0.1 -1,-0.1 0.714 94.2 82.6 -68.1 -22.1 -21.8 7.7 31.7 55 416 A K S >> S- 0 0 71 1,-0.2 3,-2.6 458,-0.0 4,-1.0 -0.754 73.7-151.9 -88.9 103.6 -21.0 4.2 33.1 56 417 A W H 3> S+ 0 0 26 -2,-0.9 4,-2.5 1,-0.3 -1,-0.2 0.734 91.4 63.4 -51.8 -33.3 -21.9 1.8 30.2 57 418 A R H 3> S+ 0 0 68 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.811 102.1 52.2 -58.9 -32.8 -22.7 -1.1 32.6 58 419 A V H <> S+ 0 0 0 -3,-2.6 4,-1.0 2,-0.2 -1,-0.2 0.826 107.0 51.3 -73.3 -34.4 -25.6 1.0 34.0 59 420 A R H >X S+ 0 0 24 -4,-1.0 4,-2.6 2,-0.2 3,-0.5 0.914 108.3 53.2 -65.9 -41.3 -26.8 1.6 30.4 60 421 A L H 3X S+ 0 0 39 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.919 104.0 55.8 -54.5 -47.1 -26.7 -2.2 30.0 61 422 A A H 3< S+ 0 0 4 -4,-1.8 4,-0.5 1,-0.2 -1,-0.2 0.764 111.4 44.2 -60.2 -29.0 -28.8 -2.6 33.1 62 423 A I H XX S+ 0 0 0 -4,-1.0 4,-1.5 -3,-0.5 3,-0.7 0.917 110.2 53.3 -78.9 -49.1 -31.5 -0.3 31.6 63 424 A I H 3< S+ 0 0 2 -4,-2.6 3,-0.5 1,-0.3 -2,-0.2 0.901 110.6 47.7 -51.5 -46.0 -31.4 -1.9 28.1 64 425 A E T 3< S+ 0 0 100 -4,-2.5 4,-0.3 1,-0.2 -1,-0.3 0.735 112.7 49.5 -70.3 -23.4 -32.0 -5.4 29.6 65 426 A Y T <> S+ 0 0 14 -3,-0.7 4,-1.6 -4,-0.5 3,-0.3 0.666 91.2 84.9 -86.1 -19.5 -34.8 -4.1 31.8 66 427 A M H X S+ 0 0 1 -4,-1.5 4,-3.8 -3,-0.5 5,-0.4 0.886 81.5 54.5 -54.3 -52.1 -36.6 -2.3 28.8 67 428 A P H > S+ 0 0 8 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.896 110.4 47.0 -55.4 -42.1 -38.6 -5.2 27.4 68 429 A L H > S+ 0 0 85 -4,-0.3 4,-1.5 -3,-0.3 -2,-0.2 0.848 118.0 44.0 -64.7 -35.5 -40.3 -5.9 30.8 69 430 A L H X S+ 0 0 1 -4,-1.6 4,-1.5 -3,-0.3 5,-0.2 0.948 110.9 51.2 -71.5 -53.4 -41.0 -2.2 31.1 70 431 A A H X S+ 0 0 0 -4,-3.8 4,-2.0 1,-0.2 -2,-0.2 0.805 107.7 59.2 -54.2 -31.2 -42.1 -1.7 27.5 71 432 A G H < S+ 0 0 30 -4,-1.8 -1,-0.2 -5,-0.4 -2,-0.2 0.980 105.6 44.0 -57.4 -59.3 -44.5 -4.6 28.3 72 433 A Q H < S+ 0 0 77 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.640 116.3 47.3 -70.0 -17.6 -46.3 -2.9 31.2 73 434 A L H < S- 0 0 43 -4,-1.5 -1,-0.2 -34,-0.0 -2,-0.2 0.844 105.2-142.5 -84.1 -40.5 -46.6 0.4 29.4 74 435 A G >< - 0 0 22 -4,-2.0 3,-1.6 -5,-0.2 4,-0.2 0.013 27.4 -68.7 93.7 159.4 -47.9 -1.2 26.1 75 436 A V G >> S+ 0 0 50 1,-0.3 3,-1.5 2,-0.2 4,-1.0 0.827 124.8 60.1 -48.2 -43.3 -47.4 -0.5 22.4 76 437 A E G 34 S+ 0 0 149 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.622 109.6 41.7 -70.2 -15.3 -49.3 2.9 22.4 77 438 A F G <> S+ 0 0 109 -3,-1.6 4,-0.7 -7,-0.2 5,-0.5 0.184 102.2 72.3-114.2 11.8 -47.0 4.5 25.0 78 439 A F T <4>S+ 0 0 1 -3,-1.5 5,-1.8 -4,-0.2 4,-0.5 0.868 89.8 53.1 -93.3 -46.8 -43.7 3.1 23.5 79 440 A D T <5S+ 0 0 68 -4,-1.0 5,-0.1 3,-0.2 -1,-0.1 0.712 110.0 62.5 -61.0 -19.4 -43.5 5.2 20.3 80 441 A E T 45S- 0 0 101 3,-0.1 4,-0.4 2,-0.0 -2,-0.2 0.932 123.8 -9.1 -65.8 -98.4 -43.8 8.1 22.8 81 442 A K T X5S+ 0 0 113 -4,-0.7 4,-0.6 1,-0.2 3,-0.2 0.856 133.8 44.8 -78.2 -38.0 -41.0 8.3 25.4 82 443 A L H >5S+ 0 0 1 -4,-0.5 4,-2.7 -5,-0.5 -3,-0.2 0.651 90.1 76.0 -95.0 -21.0 -39.0 5.0 24.8 83 444 A N H > S+ 0 0 70 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.907 111.3 52.0 -65.4 -42.3 -35.9 7.4 20.9 85 446 A L H X S+ 0 0 28 -4,-0.6 4,-1.3 1,-0.2 -2,-0.2 0.926 111.3 47.3 -56.3 -48.1 -34.1 5.8 23.9 86 447 A C H X S+ 0 0 0 -4,-2.7 4,-0.6 1,-0.2 -2,-0.2 0.905 115.5 44.5 -62.9 -42.6 -34.2 2.4 22.1 87 448 A M H >< S+ 0 0 28 -4,-2.4 3,-0.7 1,-0.2 4,-0.3 0.867 108.3 56.9 -69.5 -38.1 -32.9 3.8 18.8 88 449 A A H >< S+ 0 0 58 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.770 98.9 60.6 -68.7 -28.5 -30.2 6.0 20.4 89 450 A W H >< S+ 0 0 9 -4,-1.3 3,-1.3 1,-0.2 -1,-0.2 0.790 92.9 66.2 -65.7 -30.7 -28.5 3.1 22.1 90 451 A L T << S+ 0 0 2 -3,-0.7 -1,-0.2 -4,-0.6 -2,-0.2 0.728 107.9 40.4 -61.0 -21.1 -28.0 1.5 18.6 91 452 A V T < S+ 0 0 63 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.2 0.225 86.9 135.1-119.0 8.4 -25.6 4.4 18.0 92 453 A D < - 0 0 24 -3,-1.3 6,-0.1 2,-0.1 -3,-0.1 -0.123 65.2-118.4 -51.1 151.6 -23.9 4.5 21.4 93 454 A H S S+ 0 0 120 1,-0.1 2,-0.6 4,-0.1 -1,-0.1 0.806 95.9 75.4 -68.2 -30.6 -20.1 4.8 21.6 94 455 A V S >> S- 0 0 13 1,-0.1 3,-1.7 2,-0.0 4,-1.7 -0.768 72.9-147.7 -91.0 119.3 -19.7 1.5 23.4 95 456 A Y H 3> S+ 0 0 25 200,-3.0 4,-3.0 -2,-0.6 5,-0.2 0.838 96.9 60.8 -49.6 -44.3 -20.2 -1.6 21.2 96 457 A A H 3> S+ 0 0 10 198,-2.5 4,-1.4 1,-0.2 -1,-0.3 0.753 106.5 48.4 -60.5 -24.7 -21.6 -3.7 24.1 97 458 A I H <> S+ 0 0 0 -3,-1.7 4,-2.9 197,-0.2 5,-0.2 0.930 111.4 47.5 -76.2 -51.0 -24.4 -1.2 24.3 98 459 A R H X S+ 0 0 7 -4,-1.7 4,-1.1 1,-0.2 -2,-0.2 0.862 115.0 49.0 -54.2 -38.5 -25.1 -1.2 20.5 99 460 A E H X S+ 0 0 89 -4,-3.0 4,-1.8 2,-0.2 -1,-0.2 0.872 112.2 45.1 -72.0 -41.5 -25.0 -5.0 20.7 100 461 A A H X S+ 0 0 13 -4,-1.4 4,-1.0 -5,-0.2 -2,-0.2 0.871 111.7 54.1 -68.6 -37.0 -27.4 -5.2 23.7 101 462 A A H X S+ 0 0 0 -4,-2.9 4,-1.2 2,-0.2 -2,-0.2 0.787 105.4 55.4 -65.6 -31.2 -29.7 -2.7 22.0 102 463 A T H >X S+ 0 0 7 -4,-1.1 4,-0.9 -5,-0.2 3,-0.8 0.979 110.4 41.5 -64.8 -56.8 -29.7 -4.9 19.0 103 464 A S H 3X S+ 0 0 41 -4,-1.8 4,-1.3 1,-0.2 -2,-0.2 0.651 107.6 66.8 -67.6 -14.4 -30.9 -8.0 20.9 104 465 A N H 3X S+ 0 0 2 -4,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.871 93.8 55.9 -71.3 -39.3 -33.3 -5.6 22.7 105 466 A L H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 3,-0.5 0.923 108.2 48.1 -67.5 -45.7 -39.5 -5.9 21.7 109 470 A V H 3X S+ 0 0 6 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.828 106.3 60.7 -63.3 -31.2 -40.8 -7.5 18.5 110 471 A E H 3< S+ 0 0 114 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.843 114.1 34.7 -63.4 -33.5 -41.5 -10.6 20.6 111 472 A K H << S+ 0 0 109 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.896 126.6 33.8 -87.0 -46.2 -44.0 -8.5 22.7 112 473 A F H < S- 0 0 39 -4,-2.8 4,-0.4 1,-0.1 -3,-0.2 0.645 107.5-110.8 -93.4 -17.1 -45.5 -6.1 20.2 113 474 A G X - 0 0 19 -4,-1.8 4,-1.4 -5,-0.3 -1,-0.1 0.052 24.2 -86.0 102.0 152.1 -45.7 -8.1 17.0 114 475 A K H > S+ 0 0 93 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.760 123.5 58.5 -64.8 -28.2 -44.0 -8.2 13.5 115 476 A E H > S+ 0 0 135 2,-0.2 4,-1.4 1,-0.2 3,-0.3 0.959 104.1 50.3 -64.5 -53.2 -46.5 -5.7 12.2 116 477 A W H >>S+ 0 0 23 -4,-0.4 4,-2.3 1,-0.2 5,-0.5 0.832 109.3 53.7 -51.8 -38.9 -45.5 -3.1 14.8 117 478 A A H <>S+ 0 0 0 -4,-1.4 5,-2.5 1,-0.2 4,-0.3 0.887 102.5 55.4 -66.0 -43.3 -41.9 -3.7 13.8 118 479 A H H <5S+ 0 0 77 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.818 117.0 38.1 -61.5 -32.4 -42.5 -3.0 10.1 119 480 A A H <5S+ 0 0 68 -4,-1.4 -2,-0.2 -5,-0.1 -3,-0.1 0.970 131.4 17.3 -77.8 -68.4 -43.9 0.3 11.0 120 481 A T T X5S+ 0 0 23 -4,-2.3 4,-0.7 -5,-0.1 -3,-0.2 0.958 128.1 30.1 -75.5 -57.7 -41.8 1.7 13.9 121 482 A I H >> S+ 0 0 64 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.937 109.0 49.8 -60.3 -44.8 -37.1 2.0 9.0 124 485 A K H < S+ 0 0 44 -4,-2.0 3,-1.0 -5,-0.2 4,-0.3 0.754 96.9 68.0 -71.1 -24.0 -32.5 0.9 7.8 127 488 A A H >< S+ 0 0 69 -4,-1.4 3,-2.1 1,-0.2 4,-0.4 0.928 89.0 61.1 -58.2 -49.3 -31.2 4.4 8.3 128 489 A M G >< S+ 0 0 16 -4,-0.7 3,-0.6 1,-0.3 -1,-0.2 0.607 85.5 79.6 -60.5 -11.0 -27.9 3.3 9.8 129 490 A S G < S+ 0 0 15 -3,-1.0 -1,-0.3 1,-0.2 -2,-0.2 0.811 96.9 43.2 -64.8 -31.0 -27.1 1.5 6.5 130 491 A G G < S+ 0 0 60 -3,-2.1 -1,-0.2 -4,-0.3 -2,-0.2 0.473 85.1 131.1 -92.1 -3.8 -26.0 4.9 5.0 131 492 A D < - 0 0 36 -3,-0.6 6,-0.3 -4,-0.4 5,-0.1 -0.284 60.1-135.9 -55.3 126.0 -24.1 6.0 8.1 132 493 A P S S+ 0 0 98 0, 0.0 2,-0.5 0, 0.0 372,-0.3 0.815 87.1 78.6 -49.8 -38.9 -20.6 7.3 7.3 133 494 A N S >> S- 0 0 27 1,-0.1 4,-1.8 370,-0.1 3,-1.3 -0.657 73.2-149.0 -82.2 124.9 -19.1 5.3 10.2 134 495 A Y H 3> S+ 0 0 4 -2,-0.5 4,-2.0 1,-0.3 5,-0.2 0.744 95.0 66.5 -64.8 -26.1 -18.6 1.6 9.5 135 496 A L H 3> S+ 0 0 8 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.810 109.0 40.2 -63.5 -28.2 -19.2 0.6 13.1 136 497 A H H <> S+ 0 0 30 -3,-1.3 4,-1.5 2,-0.2 3,-0.4 0.876 108.0 58.6 -85.3 -44.4 -22.7 1.9 12.6 137 498 A R H X S+ 0 0 16 -4,-1.8 4,-0.8 -6,-0.3 -2,-0.2 0.861 108.2 49.5 -50.6 -38.8 -23.2 0.4 9.1 138 499 A M H X S+ 0 0 4 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.809 99.5 64.0 -73.2 -31.7 -22.5 -3.0 10.7 139 500 A T H X S+ 0 0 2 -4,-0.6 4,-2.0 -3,-0.4 -1,-0.2 0.869 98.5 57.2 -57.6 -38.1 -25.0 -2.4 13.5 140 501 A T H X S+ 0 0 0 -4,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.917 107.3 47.0 -55.5 -44.9 -27.6 -2.4 10.7 141 502 A L H X S+ 0 0 0 -4,-0.8 4,-1.7 1,-0.2 -2,-0.2 0.780 109.7 52.8 -72.6 -27.2 -26.5 -5.9 9.7 142 503 A F H X S+ 0 0 31 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.826 109.8 49.2 -75.7 -32.4 -26.5 -7.1 13.3 143 504 A C H X S+ 0 0 0 -4,-2.0 4,-3.7 2,-0.2 5,-0.2 0.908 109.7 49.8 -71.1 -44.1 -30.1 -5.9 13.7 144 505 A I H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.881 108.9 54.7 -61.4 -39.5 -31.2 -7.6 10.5 145 506 A N H < S+ 0 0 26 -4,-1.7 4,-0.3 1,-0.2 -1,-0.2 0.912 116.1 37.6 -54.9 -45.9 -29.5 -10.7 11.8 146 507 A V H >< S+ 0 0 21 -4,-1.7 3,-0.9 2,-0.1 4,-0.4 0.890 117.0 50.1 -74.3 -42.4 -31.6 -10.4 15.0 147 508 A L H >X S+ 0 0 0 -4,-3.7 3,-1.4 1,-0.2 4,-1.2 0.856 97.3 66.7 -71.3 -36.0 -34.9 -9.2 13.4 148 509 A S H 3X S+ 0 0 0 -4,-2.3 4,-0.7 1,-0.3 -1,-0.2 0.732 94.6 63.2 -52.4 -25.8 -35.0 -11.9 10.7 149 510 A E H <4 S+ 0 0 86 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.2 0.812 116.3 23.8 -72.6 -32.3 -35.6 -14.4 13.5 150 511 A V H <4 S+ 0 0 34 -3,-1.4 -2,-0.2 -4,-0.4 -1,-0.2 0.316 112.0 67.5-121.0 6.9 -38.9 -13.0 14.7 151 512 A C H X S- 0 0 4 -4,-1.2 4,-0.5 1,-0.1 -3,-0.1 0.686 89.1-143.2 -98.5 -22.9 -40.2 -11.2 11.6 152 513 A G H X - 0 0 33 -4,-0.7 4,-1.3 -5,-0.2 5,-0.2 -0.183 33.7 -56.0 85.6-179.5 -40.8 -14.3 9.4 153 514 A Q H > S+ 0 0 99 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.936 125.4 46.3 -63.8 -54.9 -40.4 -14.9 5.7 154 515 A D H > S+ 0 0 110 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.900 114.6 43.2 -61.5 -49.1 -42.5 -12.2 4.0 155 516 A I H X S+ 0 0 23 -4,-0.5 4,-2.2 2,-0.2 5,-0.4 0.869 114.2 50.3 -69.6 -39.3 -41.4 -9.1 6.1 156 517 A T H X>S+ 0 0 0 -4,-1.3 5,-2.8 2,-0.2 4,-1.4 0.924 113.6 45.5 -62.4 -48.7 -37.6 -10.0 6.0 157 518 A T H <5S+ 0 0 30 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.1 0.972 118.7 41.9 -57.9 -58.7 -37.7 -10.5 2.2 158 519 A K H <5S+ 0 0 132 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.954 129.9 16.2 -53.1 -64.4 -39.7 -7.3 1.5 159 520 A H H <5S+ 0 0 58 -4,-2.2 -1,-0.2 -5,-0.2 -3,-0.2 0.452 131.4 32.7-105.8 -4.1 -38.2 -4.7 3.8 160 521 A M T >X5S+ 0 0 1 -4,-1.4 4,-1.5 -5,-0.4 3,-0.8 0.759 102.5 63.0-118.1 -49.8 -34.8 -6.0 5.0 161 522 A L H 3> S+ 0 0 67 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.891 106.1 51.5 -54.6 -40.3 -32.7 -5.4 -0.3 163 524 A T H <> S+ 0 0 16 -3,-0.8 4,-0.8 2,-0.2 -2,-0.2 0.901 111.3 47.3 -62.6 -43.1 -30.7 -3.3 2.2 164 525 A V H >< S+ 0 0 0 -4,-1.5 3,-0.9 1,-0.2 4,-0.3 0.944 113.4 46.8 -61.2 -50.7 -28.4 -6.3 2.9 165 526 A L H >< S+ 0 0 31 -4,-2.7 3,-0.8 1,-0.3 -2,-0.2 0.799 108.8 55.5 -65.8 -30.3 -27.9 -7.1 -0.8 166 527 A R H >< S+ 0 0 148 -4,-2.0 3,-0.8 -5,-0.3 -1,-0.3 0.707 99.5 62.1 -72.7 -21.3 -27.2 -3.5 -1.6 167 528 A M G X< S+ 0 0 5 -3,-0.9 3,-1.0 -4,-0.8 -1,-0.2 0.497 75.2 91.2 -84.3 -3.5 -24.5 -3.4 1.1 168 529 A A G < S+ 0 0 5 -3,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.739 85.5 54.8 -60.1 -23.7 -22.5 -6.1 -0.9 169 530 A G G < S+ 0 0 60 -3,-0.8 -1,-0.3 -4,-0.1 -2,-0.1 -0.325 76.8 142.9-105.6 47.4 -20.8 -3.1 -2.6 170 531 A D < - 0 0 15 -3,-1.0 6,-0.2 2,-0.2 -3,-0.0 -0.708 54.6-133.2 -85.4 138.5 -19.6 -1.3 0.6 171 532 A P S S+ 0 0 115 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.730 89.3 75.1 -64.1 -19.5 -16.2 0.3 0.3 172 533 A V S >> S- 0 0 16 1,-0.1 4,-1.6 -38,-0.0 3,-1.0 -0.841 73.0-148.0-103.0 125.9 -15.1 -1.2 3.7 173 534 A A H 3> S+ 0 0 9 -2,-0.5 4,-2.2 1,-0.3 5,-0.2 0.787 95.7 63.4 -61.5 -32.6 -14.3 -4.9 3.7 174 535 A N H 3> S+ 0 0 4 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.834 106.4 45.2 -62.5 -33.6 -15.6 -5.4 7.3 175 536 A V H <> S+ 0 0 0 -3,-1.0 4,-1.3 2,-0.2 3,-0.3 0.911 109.6 56.2 -72.0 -43.9 -19.1 -4.4 6.1 176 537 A R H X S+ 0 0 32 -4,-1.6 4,-1.4 1,-0.2 -2,-0.2 0.852 108.7 44.7 -59.6 -40.7 -18.8 -6.7 3.0 177 538 A F H X S+ 0 0 0 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.714 107.6 58.2 -81.6 -18.2 -18.0 -9.9 5.0 178 539 A N H X S+ 0 0 5 -4,-0.7 4,-1.8 -3,-0.3 -1,-0.2 0.741 102.0 57.4 -74.2 -22.9 -20.8 -9.1 7.5 179 540 A V H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.954 108.3 44.4 -65.4 -50.8 -23.0 -9.2 4.4 180 541 A A H X S+ 0 0 0 -4,-1.4 4,-1.4 1,-0.2 -2,-0.2 0.832 113.9 51.2 -61.3 -34.9 -21.9 -12.7 3.6 181 542 A K H X S+ 0 0 65 -4,-1.5 4,-1.2 2,-0.2 -1,-0.2 0.838 109.4 51.5 -70.1 -34.8 -22.3 -13.6 7.4 182 543 A S H X S+ 0 0 0 -4,-1.8 4,-3.2 2,-0.2 3,-0.5 0.957 107.1 49.8 -65.1 -54.0 -25.9 -12.1 7.3 183 544 A L H X S+ 0 0 1 -4,-2.3 4,-2.7 1,-0.3 -1,-0.2 0.858 108.5 54.9 -56.6 -38.6 -27.2 -14.1 4.3 184 545 A Q H < S+ 0 0 44 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.892 114.7 40.6 -56.5 -41.3 -25.8 -17.2 6.0 185 546 A K H < S+ 0 0 95 -4,-1.2 -2,-0.2 -3,-0.5 -1,-0.2 0.905 124.6 34.5 -76.2 -43.8 -27.9 -16.3 9.1 186 547 A I H >< S+ 0 0 0 -4,-3.2 3,-2.4 1,-0.2 -3,-0.2 0.727 93.8 89.3 -88.4 -24.1 -31.1 -15.1 7.3 187 548 A G G >< S+ 0 0 0 -4,-2.7 3,-1.5 -5,-0.3 -1,-0.2 0.797 81.4 58.1 -40.6 -51.5 -31.0 -17.5 4.3 188 549 A P G 3 S+ 0 0 100 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.696 99.3 61.2 -52.7 -24.3 -33.1 -20.3 6.1 189 550 A I G < S+ 0 0 43 -3,-2.4 2,-0.4 -4,-0.1 -32,-0.2 0.081 95.0 82.6 -94.6 22.4 -35.9 -17.7 6.6 190 551 A L S < S- 0 0 11 -3,-1.5 5,-0.1 -34,-0.1 -36,-0.1 -0.988 83.7-112.6-130.5 136.3 -36.3 -17.3 2.8 191 552 A D >> - 0 0 57 -2,-0.4 4,-1.3 1,-0.1 3,-0.9 -0.205 37.9-107.7 -57.5 156.9 -38.1 -19.3 0.2 192 553 A N H 3> S+ 0 0 108 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.728 116.1 63.3 -66.9 -21.5 -35.9 -21.1 -2.3 193 554 A S H 3> S+ 0 0 78 1,-0.2 4,-1.3 2,-0.2 5,-0.3 0.841 104.4 47.0 -68.6 -35.2 -36.9 -18.8 -5.1 194 555 A T H <>>S+ 0 0 6 -3,-0.9 5,-1.8 1,-0.2 4,-1.1 0.851 108.8 54.7 -74.8 -36.3 -35.3 -15.8 -3.3 195 556 A L H <>S+ 0 0 15 -4,-1.3 5,-2.5 3,-0.2 -1,-0.2 0.744 112.6 42.2 -67.7 -25.1 -32.1 -17.7 -2.4 196 557 A Q H <5S+ 0 0 94 -4,-0.9 -2,-0.2 3,-0.2 -1,-0.2 0.846 124.9 23.8 -97.3 -40.4 -31.4 -18.6 -6.0 197 558 A S H <5S+ 0 0 80 -4,-1.3 -3,-0.1 3,-0.1 -2,-0.1 0.665 134.8 29.2-101.8 -22.7 -32.1 -15.6 -8.2 198 559 A E T <5S+ 0 0 78 -4,-1.1 4,-0.4 -5,-0.3 -3,-0.2 0.803 130.2 26.4-106.5 -44.9 -31.7 -12.8 -5.7 199 560 A V T >> S+ 0 0 56 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.872 108.6 50.5 -52.6 -38.6 -25.6 -14.3 -7.6 202 563 A I H <> S+ 0 0 41 -3,-1.4 4,-2.1 -4,-0.4 -2,-0.2 0.920 110.0 47.9 -66.0 -45.9 -24.5 -11.7 -4.9 203 564 A L H X S+ 0 0 0 -4,-1.5 4,-1.5 1,-0.2 -1,-0.2 0.835 108.5 56.7 -62.2 -34.8 -22.6 -14.4 -2.8 204 565 A E H X S+ 0 0 87 -4,-2.4 4,-0.5 -5,-0.2 -1,-0.2 0.899 107.1 48.5 -61.7 -42.8 -21.0 -15.5 -6.1 205 566 A K H >< S+ 0 0 129 -4,-1.8 3,-1.4 1,-0.2 -2,-0.2 0.921 106.9 56.5 -62.0 -44.9 -19.7 -12.0 -6.7 206 567 A L H >< S+ 0 0 2 -4,-2.1 3,-2.2 1,-0.3 -1,-0.2 0.815 95.7 62.9 -60.5 -35.8 -18.3 -11.8 -3.1 207 568 A T H 3< S+ 0 0 23 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.763 101.4 54.9 -60.0 -23.6 -16.1 -14.9 -3.5 208 569 A Q T << S+ 0 0 160 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.188 85.1 131.9 -93.9 16.0 -14.3 -12.9 -6.2 209 570 A D < - 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