==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 06-FEB-13 4J41 . COMPND 2 MOLECULE: SECRETED PROTEIN ESXB; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS; . AUTHOR Y.FAN,K.TAN,G.CHHOR,R.JEDRZEJCZAK,A.JOACHIMIAK,MIDWEST CENTE . 501 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24913.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 439 87.6 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 409 81.6 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+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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 12 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 -2 A S 0 0 28 0, 0.0 6,-0.1 0, 0.0 86,-0.1 0.000 360.0 360.0 360.0 -79.2 7.9 45.3 72.4 2 -1 A N + 0 0 155 87,-0.4 5,-0.1 84,-0.2 84,-0.0 0.939 360.0 53.5 -72.0 -45.7 5.3 47.3 74.3 3 0 A A S S+ 0 0 102 86,-0.4 2,-0.3 3,-0.1 -1,-0.1 0.848 87.4 85.3 -62.1 -42.1 7.5 48.1 77.4 4 1 A M S > S- 0 0 106 1,-0.1 3,-1.1 2,-0.1 0, 0.0 -0.498 79.0-137.2 -65.3 127.2 10.5 49.6 75.5 5 2 A A T 3 S+ 0 0 80 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.850 98.2 46.3 -57.0 -42.2 9.7 53.3 75.0 6 3 A E T 3 S+ 0 0 99 1,-0.1 2,-1.0 2,-0.1 -1,-0.3 0.561 90.9 86.7 -86.1 -8.1 10.9 53.5 71.4 7 4 A I < + 0 0 14 -3,-1.1 122,-0.2 1,-0.2 -1,-0.1 -0.818 44.8 143.6 -89.7 103.4 9.2 50.4 70.2 8 5 A K + 0 0 96 120,-2.5 -1,-0.2 -2,-1.0 121,-0.2 0.651 38.1 95.9-110.3 -25.5 5.8 51.7 69.2 9 6 A I - 0 0 11 119,-2.0 116,-0.0 -3,-0.2 3,-0.0 -0.411 69.0-131.8 -75.1 139.1 5.0 49.6 66.2 10 7 A T > - 0 0 60 -2,-0.1 4,-1.9 1,-0.1 5,-0.2 -0.544 19.0-118.3 -84.7 156.8 2.9 46.4 66.6 11 8 A P H > S+ 0 0 13 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.878 116.4 56.6 -58.5 -39.1 3.9 43.1 65.1 12 9 A E H > S+ 0 0 111 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.859 105.1 50.8 -63.1 -36.3 0.7 43.2 63.0 13 10 A E H > S+ 0 0 74 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.911 109.9 49.5 -66.6 -43.0 1.7 46.5 61.5 14 11 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.898 111.7 49.4 -60.9 -39.5 5.2 45.2 60.6 15 12 A E H X S+ 0 0 62 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.853 108.0 54.0 -69.1 -35.1 3.5 42.2 58.9 16 13 A R H X S+ 0 0 108 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.957 112.4 43.2 -61.4 -49.0 1.1 44.4 57.0 17 14 A I H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.897 110.1 56.7 -66.3 -37.9 4.0 46.4 55.6 18 15 A A H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.885 104.1 54.5 -58.8 -38.9 6.0 43.2 54.9 19 16 A G H X S+ 0 0 28 -4,-1.9 4,-2.8 1,-0.2 -1,-0.2 0.861 104.0 54.5 -63.1 -37.5 3.0 42.0 52.8 20 17 A N H X S+ 0 0 57 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.910 109.8 46.6 -63.2 -40.9 3.2 45.2 50.7 21 18 A F H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.906 112.8 49.4 -68.4 -40.2 6.9 44.5 49.9 22 19 A K H X S+ 0 0 101 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.930 112.8 46.8 -63.3 -45.5 6.2 40.8 49.1 23 20 A N H X S+ 0 0 106 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.890 110.4 53.0 -65.9 -37.7 3.3 41.8 46.8 24 21 A A H X S+ 0 0 4 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.895 106.1 53.7 -63.1 -40.7 5.3 44.5 45.1 25 22 A A H X S+ 0 0 2 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.903 110.7 46.9 -60.2 -42.1 8.1 41.9 44.4 26 23 A G H X S+ 0 0 40 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.901 112.1 48.8 -66.7 -43.4 5.6 39.6 42.7 27 24 A E H X S+ 0 0 100 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.889 111.0 51.9 -62.4 -40.8 4.1 42.5 40.7 28 25 A A H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.911 109.2 48.9 -64.1 -43.2 7.5 43.6 39.6 29 26 A Q H X S+ 0 0 77 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.906 111.1 50.2 -63.6 -40.7 8.5 40.1 38.5 30 27 A S H X S+ 0 0 61 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.891 109.9 52.4 -64.8 -38.0 5.3 39.7 36.5 31 28 A Q H X S+ 0 0 8 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.946 108.5 47.2 -63.4 -49.6 5.9 43.1 34.8 32 29 A I H X S+ 0 0 5 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.874 111.1 54.1 -63.9 -33.6 9.5 42.3 33.7 33 30 A N H X S+ 0 0 85 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.909 108.5 48.0 -65.0 -41.6 8.1 38.9 32.3 34 31 A R H X S+ 0 0 136 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.929 113.1 47.7 -62.4 -46.6 5.4 40.7 30.2 35 32 A L H X S+ 0 0 5 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.883 109.5 53.1 -65.2 -37.3 7.9 43.2 28.8 36 33 A E H X S+ 0 0 40 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.909 105.9 54.2 -63.6 -40.9 10.4 40.4 28.0 37 34 A G H X S+ 0 0 34 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.864 106.3 53.6 -58.1 -36.4 7.6 38.6 26.1 38 35 A D H X S+ 0 0 22 -4,-1.6 4,-0.6 2,-0.2 -2,-0.2 0.933 110.6 43.8 -66.5 -47.3 7.1 41.8 24.1 39 36 A I H >X S+ 0 0 0 -4,-2.1 3,-1.3 1,-0.2 4,-0.5 0.926 112.4 54.9 -63.5 -40.6 10.8 42.0 23.1 40 37 A N H >< S+ 0 0 78 -4,-2.9 3,-1.3 1,-0.3 -1,-0.2 0.851 98.7 62.1 -57.1 -35.3 10.7 38.3 22.4 41 38 A S H 3< S+ 0 0 61 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.696 100.5 54.4 -69.4 -17.4 7.7 38.8 20.0 42 39 A L H XX S+ 0 0 3 -3,-1.3 3,-2.4 -4,-0.6 4,-0.5 0.599 78.6 124.2 -88.1 -13.3 9.9 41.0 17.8 43 40 A E T << S- 0 0 101 -3,-1.3 4,-0.1 -4,-0.5 5,-0.1 -0.262 86.5 -1.6 -57.4 122.3 12.6 38.3 17.4 44 41 A G T 34 S+ 0 0 60 2,-0.3 -1,-0.3 3,-0.1 4,-0.1 0.424 109.9 96.1 80.4 0.3 13.3 37.6 13.7 45 42 A Q T <4 S+ 0 0 111 -3,-2.4 2,-0.3 2,-0.1 -2,-0.2 0.481 91.3 21.0-100.9 -7.7 10.6 40.0 12.6 46 43 A W S < S- 0 0 28 -4,-0.5 -2,-0.3 1,-0.1 5,-0.1 -0.886 108.5 -46.9-146.5 179.9 13.0 42.9 12.0 47 44 A A > - 0 0 59 -2,-0.3 4,-2.5 1,-0.1 3,-0.4 -0.164 45.9-129.3 -56.1 139.5 16.7 43.4 11.4 48 45 A G H > S+ 0 0 55 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.840 109.1 55.1 -56.7 -36.8 19.1 41.6 13.7 49 46 A A H > S+ 0 0 84 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.872 109.1 48.0 -65.5 -36.2 21.0 44.8 14.5 50 47 A T H > S+ 0 0 40 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.938 112.6 47.5 -68.7 -46.7 17.7 46.4 15.6 51 48 A Q H X S+ 0 0 5 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.895 109.2 55.4 -59.8 -39.4 16.8 43.4 17.7 52 49 A A H X S+ 0 0 61 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.882 105.3 52.3 -62.9 -40.2 20.2 43.4 19.3 53 50 A K H X S+ 0 0 77 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.952 114.8 40.6 -58.3 -51.9 19.9 47.0 20.3 54 51 A F H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.877 113.0 53.9 -69.1 -37.0 16.6 46.4 22.1 55 52 A R H X S+ 0 0 54 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.925 109.9 48.4 -62.2 -44.2 17.7 43.1 23.6 56 53 A G H X S+ 0 0 32 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.921 113.6 45.2 -63.4 -46.4 20.8 44.7 25.1 57 54 A E H X S+ 0 0 44 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.901 113.0 51.9 -62.8 -41.2 18.8 47.6 26.6 58 55 A F H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.911 105.8 53.5 -62.5 -41.6 16.2 45.2 27.9 59 56 A I H X S+ 0 0 78 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.874 105.9 54.4 -63.7 -35.1 18.7 43.0 29.6 60 57 A Q H X S+ 0 0 123 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.928 110.8 45.4 -59.8 -44.8 20.1 46.1 31.4 61 58 A S H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.881 110.4 55.3 -65.5 -37.2 16.5 46.8 32.6 62 59 A K H X S+ 0 0 58 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.878 107.0 48.9 -64.7 -38.9 16.1 43.2 33.6 63 60 A Q H X S+ 0 0 88 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.899 109.8 51.6 -70.8 -38.7 19.2 43.2 35.8 64 61 A A H X S+ 0 0 1 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.903 111.6 48.3 -60.0 -40.6 18.1 46.4 37.5 65 62 A M H X S+ 0 0 3 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.885 107.2 54.6 -69.1 -39.2 14.8 44.7 38.2 66 63 A Q H X S+ 0 0 96 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.921 110.3 47.5 -58.8 -44.8 16.4 41.5 39.5 67 64 A Q H X S+ 0 0 102 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.934 112.9 48.5 -60.4 -48.3 18.4 43.6 42.0 68 65 A Y H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.924 110.7 49.8 -57.6 -50.3 15.2 45.5 43.0 69 66 A I H X S+ 0 0 9 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.915 109.0 52.4 -58.0 -44.2 13.2 42.3 43.5 70 67 A A H X S+ 0 0 59 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.885 110.8 48.1 -59.6 -41.1 15.9 40.8 45.7 71 68 A I H X S+ 0 0 38 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.925 111.1 49.8 -66.8 -44.8 16.0 43.8 47.9 72 69 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.909 110.7 49.7 -61.0 -42.9 12.2 43.9 48.3 73 70 A E H X S+ 0 0 79 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.895 110.1 51.3 -65.8 -36.8 12.1 40.2 49.2 74 71 A G H X S+ 0 0 27 -4,-1.9 4,-2.6 -5,-0.2 -1,-0.2 0.893 109.0 50.9 -63.7 -40.8 14.8 40.8 51.8 75 72 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.921 110.9 48.4 -63.0 -43.6 12.9 43.7 53.3 76 73 A S H X S+ 0 0 2 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.941 113.2 47.3 -61.8 -48.0 9.7 41.5 53.6 77 74 A T H X S+ 0 0 83 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.915 113.8 47.6 -58.4 -46.8 11.6 38.7 55.2 78 75 A D H X S+ 0 0 24 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.867 108.8 53.2 -67.8 -38.2 13.4 41.0 57.6 79 76 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.906 110.7 48.0 -61.6 -40.9 10.2 42.8 58.6 80 77 A K H X S+ 0 0 97 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.885 109.4 52.6 -69.6 -37.8 8.5 39.4 59.4 81 78 A R H X S+ 0 0 139 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.926 112.5 45.0 -60.9 -44.3 11.5 38.3 61.4 82 79 A I H X S+ 0 0 21 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.863 109.1 55.9 -70.1 -35.0 11.4 41.5 63.5 83 80 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.911 108.5 48.3 -60.7 -42.3 7.6 41.2 63.9 84 81 A D H X S+ 0 0 85 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.892 110.2 52.4 -62.0 -41.8 8.2 37.7 65.4 85 82 A K H < S+ 0 0 145 -4,-1.8 4,-0.2 1,-0.2 -2,-0.2 0.901 112.8 43.3 -62.8 -43.3 10.8 39.1 67.7 86 83 A F H >< S+ 0 0 23 -4,-2.5 3,-1.4 1,-0.2 -1,-0.2 0.852 107.5 59.9 -72.1 -35.6 8.5 41.8 69.0 87 84 A R H 3< S+ 0 0 104 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.837 101.0 56.3 -62.9 -29.9 5.5 39.4 69.3 88 85 A N T 3< 0 0 142 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.574 360.0 360.0 -78.1 -8.4 7.6 37.3 71.8 89 86 A T < 0 0 114 -3,-1.4 -86,-0.4 -4,-0.2 -87,-0.4 0.289 360.0 360.0-127.2 360.0 8.2 40.3 74.1 90 !* 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 91 5 B K 0 0 201 0, 0.0 2,-0.6 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 139.7 3.1 40.9 12.2 92 6 B I + 0 0 19 -47,-0.2 3,-0.0 4,-0.1 -50,-0.0 -0.653 360.0 157.0 -79.8 116.5 5.3 43.9 13.0 93 7 B T > - 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0 0 18 117,-1.8 114,-0.0 114,-0.1 3,-0.0 -0.456 360.0-136.2 -69.4 137.5 8.3 90.2 84.4 347 7 E T > - 0 0 66 -2,-0.2 4,-1.9 1,-0.1 3,-0.2 -0.596 19.1-117.5 -89.0 157.6 11.7 88.7 85.2 348 8 E P H > S+ 0 0 21 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.871 116.2 56.5 -59.8 -35.1 14.9 90.0 83.6 349 9 E E H > S+ 0 0 107 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.845 104.6 50.0 -66.7 -36.4 15.4 86.5 82.0 350 10 E E H > S+ 0 0 57 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.910 110.9 49.8 -69.3 -39.6 12.0 86.7 80.3 351 11 E L H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.907 111.9 48.5 -61.6 -41.5 12.9 90.2 78.9 352 12 E E H X S+ 0 0 65 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.851 109.0 53.7 -67.8 -35.0 16.2 88.8 77.7 353 13 E R H X S+ 0 0 108 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.949 112.1 43.3 -63.4 -47.2 14.5 85.8 76.1 354 14 E I H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.904 110.3 56.3 -66.5 -39.1 12.2 88.1 74.1 355 15 E A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.903 106.1 52.7 -56.0 -40.4 15.1 90.4 73.3 356 16 E G H X S+ 0 0 25 -4,-2.0 4,-3.1 1,-0.2 5,-0.2 0.886 104.7 54.0 -63.1 -42.1 16.8 87.4 71.8 357 17 E N H X S+ 0 0 48 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.899 110.2 47.7 -60.2 -40.3 13.7 86.6 69.6 358 18 E F H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.923 113.5 46.6 -65.4 -44.4 13.9 90.1 68.3 359 19 E K H X S+ 0 0 95 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.917 113.9 48.4 -63.4 -43.9 17.6 89.9 67.6 360 20 E N H X S+ 0 0 95 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.886 108.7 53.9 -63.9 -40.7 17.2 86.5 65.9 361 21 E A H X S+ 0 0 6 -4,-2.2 4,-2.7 -5,-0.2 -1,-0.2 0.908 106.3 52.7 -59.1 -42.5 14.3 87.8 63.8 362 22 E A H X S+ 0 0 5 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.898 110.4 48.0 -62.8 -39.2 16.5 90.6 62.5 363 23 E G H X S+ 0 0 45 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.888 111.8 48.5 -68.5 -41.1 19.2 88.1 61.5 364 24 E E H X S+ 0 0 98 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.894 111.1 51.5 -65.0 -39.5 16.8 85.8 59.7 365 25 E A H X S+ 0 0 3 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.890 109.3 49.3 -66.5 -39.8 15.2 88.8 57.9 366 26 E Q H X S+ 0 0 79 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.913 110.3 51.4 -64.7 -40.3 18.7 90.0 56.7 367 27 E S H X S+ 0 0 59 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.885 108.6 52.6 -63.1 -40.0 19.5 86.4 55.5 368 28 E Q H X S+ 0 0 10 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.929 110.5 44.7 -61.8 -49.6 16.2 86.3 53.6 369 29 E I H X S+ 0 0 5 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.845 108.9 56.3 -69.6 -32.5 16.8 89.6 51.7 370 30 E N H X S+ 0 0 96 -4,-2.0 4,-0.7 1,-0.2 -1,-0.2 0.862 109.9 48.4 -61.0 -35.7 20.4 88.7 50.9 371 31 E R H >X S+ 0 0 138 -4,-1.4 3,-0.8 1,-0.2 4,-0.8 0.906 107.9 52.2 -71.1 -46.0 19.0 85.5 49.3 372 32 E L H 3X S+ 0 0 5 -4,-2.1 4,-1.6 1,-0.2 3,-0.5 0.795 97.6 67.2 -64.1 -28.8 16.3 87.3 47.3 373 33 E E H 3X S+ 0 0 62 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.880 95.1 58.1 -60.9 -34.2 18.9 89.7 45.8 374 34 E G H < S+ 0 0 6 -4,-1.6 3,-1.0 1,-0.2 4,-0.5 0.906 109.7 53.1 -59.0 -40.3 17.0 89.6 41.0 377 37 E N H >< S+ 0 0 98 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.859 99.6 61.1 -62.4 -37.4 20.6 89.1 39.7 378 38 E S H 3< S+ 0 0 52 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.673 100.9 55.2 -67.1 -16.7 19.7 86.0 37.8 379 39 E L T X< S+ 0 0 0 -3,-1.0 3,-2.2 -4,-0.6 4,-0.4 0.620 79.3 118.7 -88.9 -15.2 17.3 88.0 35.7 380 40 E E T < S- 0 0 87 -3,-1.3 4,-0.1 -4,-0.5 5,-0.1 -0.318 89.5 -1.6 -56.8 125.0 20.0 90.5 34.6 381 41 E G T 3 S+ 0 0 73 2,-0.3 -1,-0.3 1,-0.1 4,-0.1 0.542 103.8 104.0 71.6 8.7 20.5 90.5 30.9 382 42 E Q S < S+ 0 0 92 -3,-2.2 2,-0.3 2,-0.1 -2,-0.2 0.444 94.2 5.4 -96.8 -3.2 17.9 87.8 30.4 383 43 E W S S- 0 0 38 -4,-0.4 -2,-0.3 1,-0.0 5,-0.1 -0.914 108.4 -39.9-159.7-175.4 15.5 90.5 29.2 384 44 E A > - 0 0 61 -2,-0.3 4,-2.1 1,-0.1 3,-0.4 -0.176 49.1-124.7 -59.1 146.0 15.3 94.2 28.3 385 45 E G H > S+ 0 0 53 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.833 110.0 55.1 -59.1 -38.3 17.2 96.7 30.5 386 46 E A H > S+ 0 0 82 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.864 108.6 49.1 -64.2 -37.1 14.1 98.8 31.2 387 47 E T H > S+ 0 0 50 -3,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.914 111.8 47.7 -67.7 -45.2 12.3 95.7 32.5 388 48 E Q H X S+ 0 0 1 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.899 107.8 56.9 -63.0 -38.0 15.2 94.7 34.7 389 49 E A H X S+ 0 0 45 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.865 103.1 54.0 -62.9 -36.8 15.4 98.3 36.0 390 50 E K H X S+ 0 0 76 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.919 111.5 45.0 -61.6 -44.2 11.7 98.1 37.1 391 51 E F H X S+ 0 0 2 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.894 112.1 51.4 -68.1 -39.7 12.5 95.0 39.1 392 52 E R H X S+ 0 0 93 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.906 110.0 50.7 -60.1 -44.3 15.7 96.5 40.6 393 53 E G H X S+ 0 0 34 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.906 111.6 46.2 -63.0 -43.8 13.8 99.6 41.6 394 54 E E H X S+ 0 0 41 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.905 112.5 51.0 -63.7 -40.4 11.1 97.5 43.4 395 55 E F H X S+ 0 0 5 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.903 106.9 53.5 -66.6 -39.3 13.7 95.3 45.0 396 56 E I H X S+ 0 0 83 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.885 105.8 54.5 -61.9 -37.8 15.5 98.4 46.3 397 57 E Q H X S+ 0 0 108 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.904 107.9 49.5 -60.4 -41.1 12.2 99.6 47.8 398 58 E S H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.875 108.4 53.3 -66.5 -35.7 11.9 96.3 49.7 399 59 E K H X S+ 0 0 58 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.882 107.4 51.3 -65.7 -38.8 15.5 96.6 50.9 400 60 E Q H X S+ 0 0 103 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.904 111.1 47.1 -67.3 -40.1 14.8 100.0 52.4 401 61 E A H X S+ 0 0 4 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.912 112.8 50.0 -65.5 -41.1 11.7 98.8 54.2 402 62 E M H X S+ 0 0 2 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.885 108.1 52.8 -64.4 -39.2 13.7 95.8 55.5 403 63 E Q H X S+ 0 0 116 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.909 110.6 47.6 -62.4 -43.3 16.5 98.1 56.7 404 64 E Q H X S+ 0 0 112 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.928 112.3 50.1 -61.2 -46.8 14.0 100.2 58.6 405 65 E Y H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.927 110.1 48.8 -57.1 -50.9 12.5 97.0 60.1 406 66 E I H X S+ 0 0 14 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.905 108.8 53.5 -60.7 -42.3 15.8 95.6 61.2 407 67 E A H X S+ 0 0 57 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.886 110.4 47.8 -60.9 -38.3 16.8 98.9 62.9 408 68 E I H X S+ 0 0 33 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.923 110.9 50.1 -68.6 -43.8 13.6 98.9 64.9 409 69 E L H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.905 110.8 49.4 -61.4 -42.6 13.9 95.2 66.0 410 70 E E H X S+ 0 0 82 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.890 110.6 51.0 -62.6 -40.4 17.5 95.8 67.2 411 71 E G H X S+ 0 0 30 -4,-1.8 4,-2.5 -5,-0.2 -2,-0.2 0.905 110.1 49.1 -63.8 -42.3 16.3 98.9 69.1 412 72 E I H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.935 109.6 52.3 -62.2 -45.8 13.6 96.9 70.7 413 73 E S H X S+ 0 0 2 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.936 113.0 44.2 -55.4 -48.8 16.0 94.1 71.7 414 74 E T H X S+ 0 0 68 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.899 111.8 52.3 -66.1 -39.8 18.4 96.6 73.3 415 75 E D H X S+ 0 0 26 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.885 109.3 50.2 -64.9 -37.3 15.6 98.5 75.1 416 76 E L H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.913 111.4 48.2 -64.8 -42.4 14.3 95.2 76.6 417 77 E K H X S+ 0 0 85 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.837 106.3 57.9 -67.8 -31.9 17.8 94.3 77.8 418 78 E R H X S+ 0 0 126 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.896 109.8 43.8 -64.0 -40.1 18.2 97.8 79.3 419 79 E I H X S+ 0 0 29 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.885 110.8 55.0 -73.2 -37.2 15.1 97.2 81.4 420 80 E A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.923 106.8 51.6 -57.7 -45.0 16.3 93.7 82.3 421 81 E D H X S+ 0 0 94 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.894 110.4 48.6 -58.1 -41.7 19.5 95.2 83.6 422 82 E K H < S+ 0 0 148 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.903 111.9 48.0 -67.3 -42.1 17.6 97.6 85.7 423 83 E F H < S+ 0 0 93 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.822 110.5 50.9 -68.4 -33.1 15.4 94.9 87.2 424 84 E R H < 0 0 111 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.735 360.0 360.0 -76.1 -24.0 18.4 92.7 87.9 425 85 E N < 0 0 183 -4,-1.2 -3,-0.1 -5,-0.2 -4,-0.1 -0.097 360.0 360.0 93.8 360.0 19.8 95.8 89.6 426 !* 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 0.0 427 6 F I 0 0 49 0, 0.0 -48,-0.0 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 153.2 14.4 82.5 30.8 428 7 F T > - 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0 0 57 -2,-0.3 4,-2.3 1,-0.1 3,-0.3 -0.144 47.5-132.1 -55.3 142.3 3.8 99.5 83.8 466 45 F G H > S+ 0 0 58 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.863 107.4 56.9 -63.5 -37.4 1.3 100.5 81.2 467 46 F A H > S+ 0 0 84 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.848 108.8 47.2 -62.6 -36.0 3.4 103.4 80.1 468 47 F T H > S+ 0 0 44 -3,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.920 112.1 48.8 -70.7 -46.0 6.3 101.0 79.5 469 48 F Q H X S+ 0 0 6 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.899 107.8 55.8 -60.1 -40.2 4.1 98.6 77.5 470 49 F A H X S+ 0 0 63 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.865 104.0 53.6 -63.2 -37.4 2.7 101.4 75.4 471 50 F K H X S+ 0 0 82 -4,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.939 112.7 43.5 -60.5 -46.1 6.2 102.5 74.4 472 51 F F H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.854 111.8 52.8 -70.8 -35.2 7.0 98.9 73.2 473 52 F R H X S+ 0 0 50 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.939 110.7 49.1 -62.9 -44.8 3.6 98.5 71.5 474 53 F G H X S+ 0 0 34 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.906 113.0 45.6 -61.1 -45.5 4.2 101.7 69.6 475 54 F E H X S+ 0 0 44 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.909 112.5 51.5 -65.2 -41.3 7.7 100.7 68.5 476 55 F F H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.901 104.8 56.1 -62.8 -39.8 6.5 97.3 67.5 477 56 F I H X S+ 0 0 88 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.860 103.5 55.4 -62.3 -34.1 3.7 98.8 65.4 478 57 F Q H X S+ 0 0 113 -4,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.901 109.0 46.9 -61.4 -41.3 6.4 100.8 63.5 479 58 F S H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.884 109.7 54.3 -67.0 -38.0 8.1 97.5 62.7 480 59 F K H X S+ 0 0 55 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.909 107.4 50.2 -62.5 -42.1 4.8 95.9 61.7 481 60 F Q H X S+ 0 0 116 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.894 107.8 52.6 -66.3 -39.4 4.2 98.8 59.2 482 61 F A H X S+ 0 0 2 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.916 112.0 46.7 -61.5 -40.9 7.6 98.4 57.7 483 62 F M H X S+ 0 0 1 -4,-2.1 4,-3.1 2,-0.2 -2,-0.2 0.848 107.2 55.9 -71.1 -33.1 6.9 94.7 57.2 484 63 F Q H X S+ 0 0 109 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.887 111.2 45.7 -64.6 -36.8 3.5 95.4 55.7 485 64 F Q H X S+ 0 0 81 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.918 113.5 49.0 -67.8 -46.1 5.2 97.6 53.1 486 65 F Y H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.937 111.2 49.6 -58.4 -50.1 7.9 94.9 52.5 487 66 F I H X S+ 0 0 23 -4,-3.1 4,-2.6 1,-0.2 5,-0.2 0.913 109.8 51.0 -58.3 -44.8 5.3 92.2 52.1 488 67 F A H X S+ 0 0 62 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.892 110.4 49.5 -61.9 -39.6 3.2 94.2 49.6 489 68 F I H X S+ 0 0 37 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.929 111.2 49.0 -63.9 -44.7 6.3 94.9 47.5 490 69 F L H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.898 110.0 51.4 -61.9 -40.7 7.3 91.2 47.5 491 70 F E H X S+ 0 0 55 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.877 109.0 51.5 -64.5 -37.8 3.7 90.3 46.4 492 71 F G H X S+ 0 0 27 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.892 110.2 48.4 -64.1 -41.3 4.0 92.8 43.6 493 72 F I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.946 112.4 49.3 -63.1 -46.6 7.2 91.3 42.4 494 73 F S H X S+ 0 0 2 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.934 113.7 44.2 -58.8 -49.6 5.8 87.8 42.5 495 74 F T H X S+ 0 0 68 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.871 112.0 53.1 -68.7 -33.6 2.7 88.7 40.6 496 75 F D H X S+ 0 0 51 -4,-2.2 4,-1.8 -5,-0.2 -1,-0.2 0.913 109.9 48.9 -63.5 -43.4 4.6 90.7 38.0 497 76 F L H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.897 110.4 50.1 -65.0 -38.9 7.0 87.8 37.4 498 77 F K H X S+ 0 0 95 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.862 106.6 56.0 -68.7 -33.4 4.0 85.4 37.0 499 78 F R H X S+ 0 0 196 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.914 109.9 45.3 -60.9 -42.8 2.4 87.8 34.5 500 79 F I H X S+ 0 0 35 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.908 111.1 53.1 -68.2 -41.1 5.6 87.7 32.4 501 80 F A H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.914 109.9 48.0 -59.0 -44.6 5.8 83.9 32.7 502 81 F D H X S+ 0 0 88 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.880 111.0 51.7 -64.1 -37.9 2.2 83.5 31.5 503 82 F K H < S+ 0 0 153 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.914 106.8 52.5 -64.0 -44.1 3.0 85.9 28.6 504 83 F F H < S+ 0 0 97 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.792 106.5 55.5 -64.4 -29.1 6.0 83.9 27.5 505 84 F R H < 0 0 114 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.922 360.0 360.0 -65.7 -47.3 3.8 80.8 27.5 506 85 F N < 0 0 150 -4,-1.6 -3,-0.0 -3,-0.0 0, 0.0 -0.079 360.0 360.0 -73.4 360.0 1.3 82.3 25.1