==== 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 TOXIN/ANTITOXIN 28-APR-09 3H87 . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR A.MIN,M.R.SAWAYA,D.CASCIO,D.EISENBERG,INTEGRATED CENTER FOR . 418 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20371.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 299 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 6.7 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 . 16 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 190 45.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.9 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 2 0 6 4 0 0 4 1 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 4 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 . 2 0 2 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 T 0 0 152 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 161.7 21.2 27.7 27.9 2 3 A D + 0 0 152 2,-0.0 2,-0.2 0, 0.0 0, 0.0 0.548 360.0 122.6 -78.5 -4.2 22.5 29.3 31.1 3 4 A Q + 0 0 50 107,-0.1 2,-0.3 1,-0.0 107,-0.1 -0.389 33.5 174.6 -70.5 131.3 23.7 26.0 32.7 4 5 A R - 0 0 88 105,-0.3 107,-2.6 -2,-0.2 2,-0.3 -0.934 15.2-144.2-126.7 154.2 27.3 25.7 33.7 5 6 A W E -ab 33 111A 9 27,-2.7 29,-3.3 -2,-0.3 2,-0.5 -0.842 10.2-147.7-122.6 155.1 29.1 22.8 35.5 6 7 A L E -ab 34 112A 0 105,-2.6 107,-2.6 -2,-0.3 2,-0.5 -0.984 28.6-140.3-117.8 113.9 31.9 22.3 38.1 7 8 A I E - b 0 113A 1 27,-2.7 29,-0.4 -2,-0.5 2,-0.2 -0.659 9.9-151.0 -88.9 124.7 33.7 19.0 37.4 8 9 A D >> - 0 0 0 105,-2.8 4,-2.5 -2,-0.5 3,-1.1 -0.525 30.4-108.5 -79.6 159.8 34.8 16.8 40.3 9 10 A K H 3> S+ 0 0 10 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.837 117.4 63.4 -53.0 -34.8 37.8 14.5 40.2 10 11 A S H 34 S+ 0 0 10 1,-0.2 -1,-0.3 2,-0.2 104,-0.1 0.817 111.1 35.5 -65.6 -31.4 35.4 11.5 40.1 11 12 A A H X> S+ 0 0 0 -3,-1.1 3,-1.2 102,-0.4 4,-0.8 0.842 110.6 62.7 -85.8 -40.1 33.9 12.7 36.8 12 13 A L H >< S+ 0 0 5 -4,-2.5 3,-0.7 1,-0.3 4,-0.3 0.902 106.5 44.1 -50.7 -46.6 37.2 14.0 35.3 13 14 A V T 3< S+ 0 0 10 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.1 0.586 115.9 49.4 -79.7 -9.1 38.9 10.6 35.4 14 15 A R T X4 S+ 0 0 73 -3,-1.2 3,-1.0 -5,-0.2 -1,-0.2 0.368 78.6 94.6-110.4 1.5 35.8 8.9 34.0 15 16 A L G X< S+ 0 0 2 -4,-0.8 3,-2.1 -3,-0.7 -2,-0.1 0.886 78.8 62.1 -59.9 -39.9 35.0 11.1 31.0 16 17 A T G 3 S+ 0 0 16 384,-0.3 -1,-0.2 -4,-0.3 385,-0.1 0.735 107.6 46.8 -60.2 -24.0 36.9 8.8 28.6 17 18 A D G < S+ 0 0 58 -3,-1.0 119,-2.9 119,-0.1 -1,-0.3 0.207 88.3 108.8-104.9 16.0 34.5 6.1 29.5 18 19 A S X - 0 0 3 -3,-2.1 3,-1.8 117,-0.3 117,-0.2 -0.760 63.0-143.8 -93.7 136.5 31.2 8.0 29.2 19 20 A P T 3 S+ 0 0 80 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.683 107.7 57.0 -64.4 -15.0 28.6 7.4 26.4 20 21 A D T 3> S+ 0 0 67 114,-0.3 4,-2.3 1,-0.2 3,-0.3 0.168 71.8 120.3 -98.0 17.6 28.1 11.2 26.6 21 22 A M H <> S+ 0 0 49 -3,-1.8 4,-2.8 1,-0.2 5,-0.2 0.860 70.7 51.6 -48.1 -47.2 31.8 11.8 25.9 22 23 A E H > S+ 0 0 160 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.918 110.2 47.2 -63.2 -44.4 31.2 13.8 22.7 23 24 A I H > S+ 0 0 65 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.914 113.8 48.2 -65.2 -41.3 28.7 16.2 24.3 24 25 A W H X S+ 0 0 6 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.907 108.8 53.8 -67.1 -38.9 30.9 16.8 27.3 25 26 A S H X S+ 0 0 10 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.911 109.1 49.1 -57.4 -43.1 33.9 17.4 25.0 26 27 A N H X S+ 0 0 57 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.918 110.6 49.9 -64.2 -41.3 31.9 20.1 23.1 27 28 A R H <>S+ 0 0 59 -4,-2.1 5,-2.3 1,-0.2 6,-0.4 0.895 109.9 51.2 -64.4 -38.7 30.8 21.8 26.4 28 29 A I H ><5S+ 0 0 1 -4,-2.3 3,-1.5 1,-0.2 -1,-0.2 0.926 106.5 54.1 -64.1 -45.4 34.4 21.9 27.6 29 30 A E H 3<5S+ 0 0 42 -4,-2.1 364,-0.4 1,-0.3 -1,-0.2 0.826 108.5 50.8 -54.3 -35.3 35.6 23.5 24.4 30 31 A R T 3<5S- 0 0 134 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.465 117.8-109.7 -86.7 -2.1 33.0 26.2 24.9 31 32 A G T < 5S+ 0 0 22 -3,-1.5 -3,-0.2 -4,-0.4 -2,-0.1 0.637 81.9 124.5 84.9 15.3 34.0 27.0 28.5 32 33 A L < + 0 0 18 -5,-2.3 -27,-2.7 -6,-0.2 2,-0.6 0.556 58.3 68.8 -86.1 -6.0 30.9 25.6 30.2 33 34 A V E -a 5 0A 0 -6,-0.4 -27,-0.2 31,-0.2 2,-0.2 -0.947 68.0-172.6-119.7 108.1 32.8 23.2 32.5 34 35 A H E -a 6 0A 29 -29,-3.3 -27,-2.7 -2,-0.6 2,-0.3 -0.529 6.3-154.4 -96.1 166.2 34.8 24.9 35.2 35 36 A I E -d 67 0B 0 31,-2.4 33,-2.7 -29,-0.2 2,-0.2 -0.981 14.9-119.6-140.2 147.1 37.3 23.3 37.7 36 37 A T E > -d 68 0B 6 -29,-0.4 4,-1.7 -2,-0.3 33,-0.2 -0.516 20.5-120.3 -83.6 160.3 38.4 24.3 41.3 37 38 A G H > S+ 0 0 6 31,-1.0 4,-1.8 1,-0.2 5,-0.1 0.867 115.6 55.9 -60.5 -39.4 41.9 25.1 42.5 38 39 A V H > S+ 0 0 2 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.923 105.0 50.8 -61.4 -42.2 41.6 22.2 45.0 39 40 A T H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.884 106.5 55.5 -65.2 -34.4 40.8 19.7 42.2 40 41 A R H X S+ 0 0 42 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.911 105.8 51.6 -62.8 -40.3 43.9 21.0 40.3 41 42 A L H X S+ 0 0 1 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.842 107.8 52.6 -63.7 -31.7 46.0 20.2 43.4 42 43 A E H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.904 108.1 50.8 -68.0 -43.1 44.5 16.6 43.4 43 44 A V H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.943 112.2 47.6 -55.7 -48.5 45.5 16.2 39.7 44 45 A G H < S+ 0 0 11 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.887 107.5 54.9 -63.9 -37.1 49.0 17.3 40.6 45 46 A F H < S+ 0 0 8 -4,-2.0 184,-0.5 1,-0.2 -1,-0.2 0.896 111.4 45.9 -62.7 -38.4 49.2 14.9 43.6 46 47 A S H < S+ 0 0 2 -4,-1.8 -1,-0.2 -5,-0.1 363,-0.2 0.777 88.0 102.8 -78.5 -28.6 48.3 12.0 41.3 47 48 A A S < S- 0 0 9 -4,-1.7 182,-0.3 -5,-0.1 360,-0.1 -0.263 73.5-132.4 -57.7 143.6 50.8 12.8 38.5 48 49 A E S S- 0 0 103 358,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.808 79.9 -5.8 -70.6 -29.4 53.9 10.7 38.5 49 50 A C S > S- 0 0 47 1,-0.1 4,-1.9 179,-0.1 175,-0.1 -0.957 76.0 -94.1-155.9 174.8 56.3 13.6 38.1 50 51 A G H > S+ 0 0 2 173,-0.4 4,-2.4 -2,-0.3 5,-0.2 0.811 118.1 57.0 -65.8 -34.9 56.5 17.4 37.5 51 52 A E H > S+ 0 0 128 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.919 108.8 45.9 -60.7 -47.1 56.8 17.0 33.7 52 53 A I H > S+ 0 0 47 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.897 111.5 52.1 -66.2 -41.0 53.6 15.1 33.4 53 54 A A H X S+ 0 0 4 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.946 109.2 49.3 -59.8 -46.1 51.7 17.6 35.7 54 55 A R H X S+ 0 0 84 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.915 111.4 51.1 -60.0 -40.2 52.8 20.6 33.6 55 56 A R H X S+ 0 0 79 -4,-2.0 4,-1.4 1,-0.2 3,-0.4 0.932 107.1 52.2 -64.5 -45.7 51.7 18.8 30.5 56 57 A E H < S+ 0 0 0 -4,-2.5 3,-0.4 1,-0.2 6,-0.3 0.917 109.5 49.3 -59.9 -40.7 48.3 18.0 31.9 57 58 A F H < S+ 0 0 30 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.805 114.8 43.8 -71.0 -23.4 47.6 21.6 32.9 58 59 A R H < S+ 0 0 158 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.599 106.6 67.2 -98.2 -9.3 48.6 23.0 29.4 59 60 A E S X S- 0 0 80 -4,-1.4 4,-1.9 -3,-0.4 3,-0.3 -0.693 92.1 -56.2-104.9 159.0 46.8 20.4 27.2 60 61 A P T 4 S+ 0 0 14 0, 0.0 343,-0.1 0, 0.0 336,-0.1 -0.490 111.0 30.2 -67.7 148.8 43.1 19.8 26.7 61 62 A P T >4 S+ 0 0 0 0, 0.0 3,-1.8 0, 0.0 4,-0.2 -0.973 126.4 40.2 -88.6 -18.6 40.9 19.2 28.5 62 63 A L G >4 S+ 0 0 2 -3,-0.3 3,-1.6 -6,-0.3 -5,-0.1 0.848 109.2 61.3 -61.6 -31.8 42.3 21.1 31.6 63 64 A S G 3< S+ 0 0 56 -4,-1.9 -1,-0.3 -7,-0.3 -6,-0.1 0.688 105.3 49.8 -64.7 -18.5 43.6 24.0 29.5 64 65 A A G < S+ 0 0 16 -3,-1.8 -1,-0.3 -5,-0.2 -31,-0.2 0.337 90.1 94.0-101.9 3.0 40.0 24.7 28.5 65 66 A M S < S- 0 0 8 -3,-1.6 -31,-0.2 -4,-0.2 -30,-0.1 -0.855 72.7-133.4-103.6 112.0 38.4 24.7 32.0 66 67 A P - 0 0 53 0, 0.0 -31,-2.4 0, 0.0 2,-0.4 -0.306 26.9-118.5 -60.4 143.3 38.1 28.1 33.7 67 68 A V E -d 35 0B 42 -33,-0.2 2,-0.6 -31,-0.0 -31,-0.2 -0.709 18.3-156.0 -92.3 130.2 39.3 27.9 37.3 68 69 A E E -d 36 0B 42 -33,-2.7 -31,-1.0 -2,-0.4 2,-0.2 -0.922 17.1-158.9-105.0 114.3 36.9 28.7 40.2 69 70 A Y - 0 0 61 -2,-0.6 2,-0.0 -33,-0.2 -33,-0.0 -0.471 19.9 -99.6 -92.7 157.8 38.7 29.9 43.3 70 71 A L - 0 0 6 -2,-0.2 -1,-0.1 138,-0.1 142,-0.1 -0.309 32.0-168.2 -72.4 155.1 37.6 29.9 47.0 71 72 A T > - 0 0 50 137,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.926 39.0-103.0-132.2 164.8 36.2 32.9 48.8 72 73 A P H > S+ 0 0 28 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.908 122.4 53.6 -54.7 -40.5 35.6 33.4 52.6 73 74 A R H > S+ 0 0 166 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.900 110.4 47.2 -63.4 -40.5 31.8 32.8 52.0 74 75 A I H > S+ 0 0 2 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.929 112.0 48.7 -66.8 -45.9 32.5 29.5 50.3 75 76 A E H X S+ 0 0 4 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.907 113.7 47.4 -62.4 -40.5 35.0 28.2 53.0 76 77 A D H X S+ 0 0 70 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.862 110.2 52.5 -66.2 -40.2 32.5 29.2 55.7 77 78 A R H X S+ 0 0 49 -4,-1.9 4,-2.8 -5,-0.2 5,-0.2 0.921 106.5 53.6 -63.1 -41.4 29.6 27.4 53.8 78 79 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.909 110.0 47.6 -56.4 -44.1 31.6 24.2 53.5 79 80 A L H X S+ 0 0 15 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.892 110.8 51.4 -65.5 -43.0 32.1 24.3 57.3 80 81 A E H X S+ 0 0 105 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.943 112.0 46.6 -58.0 -46.5 28.4 24.9 57.9 81 82 A V H X S+ 0 0 5 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.912 109.4 54.3 -64.1 -40.1 27.4 22.0 55.7 82 83 A Q H X S+ 0 0 1 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.911 107.5 50.7 -58.0 -44.2 30.0 19.7 57.3 83 84 A T H X S+ 0 0 11 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.895 108.5 51.9 -65.4 -36.7 28.5 20.5 60.8 84 85 A L H X S+ 0 0 41 -4,-1.9 4,-0.8 1,-0.2 -2,-0.2 0.907 110.6 48.5 -64.2 -42.7 24.9 19.7 59.5 85 86 A L H ><>S+ 0 0 4 -4,-2.5 5,-2.8 1,-0.2 3,-0.8 0.902 108.7 54.2 -60.3 -43.0 26.3 16.3 58.2 86 87 A A H ><5S+ 0 0 6 -4,-2.3 3,-0.8 4,-0.3 101,-0.4 0.851 100.2 59.7 -63.7 -30.6 27.9 15.7 61.6 87 88 A D H 3<5S+ 0 0 67 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.819 110.6 43.5 -60.8 -31.4 24.6 16.3 63.4 88 89 A R T <<5S- 0 0 136 -4,-0.8 -1,-0.2 -3,-0.8 -2,-0.2 0.421 119.4-108.2 -97.9 0.1 23.2 13.3 61.3 89 90 A G T < 5S+ 0 0 61 -3,-0.8 -3,-0.2 -4,-0.4 3,-0.1 0.692 92.8 104.0 82.2 24.5 26.3 11.1 61.8 90 91 A H > < + 0 0 114 -5,-2.8 3,-1.4 -6,-0.1 -4,-0.3 0.292 35.5 104.6-122.9 7.3 27.4 11.5 58.2 91 92 A H T 3 S+ 0 0 7 -6,-0.4 -5,-0.2 1,-0.3 -1,-0.1 0.528 74.8 60.3 -79.6 -1.9 30.3 13.8 58.1 92 93 A R T 3 S+ 0 0 69 -3,-0.1 -1,-0.3 -7,-0.1 -2,-0.1 0.373 95.8 68.3-101.0 9.9 33.1 11.3 57.6 93 94 A G S < S+ 0 0 38 -3,-1.4 -2,-0.2 1,-0.1 2,-0.1 0.929 94.3 51.4 -79.2 -82.4 31.4 10.3 54.3 94 95 A P S S- 0 0 3 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 -0.381 86.0-135.6 -59.4 130.2 32.0 13.5 52.3 95 96 A S > - 0 0 4 253,-0.1 4,-2.3 -2,-0.1 252,-0.2 -0.230 25.8-100.3 -77.6 171.1 35.7 14.6 52.3 96 97 A I H > S+ 0 0 0 250,-2.9 4,-2.4 1,-0.2 5,-0.2 0.940 125.5 50.4 -59.4 -48.0 37.0 18.1 52.7 97 98 A P H > S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.926 107.9 53.7 -55.5 -41.9 37.5 18.5 48.9 98 99 A D H > S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.933 111.4 46.2 -58.6 -45.1 33.8 17.2 48.3 99 100 A L H X S+ 0 0 3 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.892 113.1 48.0 -62.3 -43.4 32.6 20.0 50.7 100 101 A L H X S+ 0 0 2 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.894 113.7 47.0 -67.3 -42.4 34.7 22.7 49.1 101 102 A I H X S+ 0 0 0 -4,-2.8 4,-2.5 -5,-0.2 5,-0.2 0.932 113.6 48.5 -64.0 -46.2 33.6 21.7 45.5 102 103 A A H X S+ 0 0 3 -4,-2.6 4,-2.5 -5,-0.3 -2,-0.2 0.925 113.0 46.2 -61.6 -44.6 30.0 21.5 46.5 103 104 A A H X S+ 0 0 3 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.872 111.0 53.5 -68.0 -35.0 30.0 24.9 48.3 104 105 A T H X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.949 112.2 44.7 -60.7 -47.7 31.9 26.5 45.4 105 106 A A H X>S+ 0 0 1 -4,-2.5 5,-2.3 1,-0.2 4,-0.9 0.923 112.3 52.3 -60.9 -44.4 29.2 25.3 43.0 106 107 A E H <5S+ 0 0 52 -4,-2.5 3,-0.3 -5,-0.2 -1,-0.2 0.923 118.0 35.1 -59.2 -46.1 26.4 26.3 45.2 107 108 A L H <5S+ 0 0 53 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.694 118.6 49.8 -88.3 -16.4 27.6 29.9 45.7 108 109 A S H <5S- 0 0 50 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.350 113.0-108.3-105.8 4.4 29.0 30.5 42.2 109 110 A G T <5S+ 0 0 62 -4,-0.9 -105,-0.3 -3,-0.3 2,-0.3 0.887 71.1 130.6 77.5 42.3 26.0 29.2 40.2 110 111 A L < - 0 0 15 -5,-2.3 2,-0.5 -6,-0.2 -105,-0.3 -0.905 56.2-123.1-126.0 154.7 27.2 25.9 38.8 111 112 A T E -b 5 0A 8 -107,-2.6 -105,-2.6 -2,-0.3 2,-0.4 -0.820 32.7-123.3 -91.5 124.7 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H < S+ 0 0 1 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.905 110.8 48.8 -61.7 -41.7 36.1 16.4 60.5 183 47 B S H < S+ 0 0 3 -4,-2.2 153,-0.4 -5,-0.1 -1,-0.2 0.775 90.2 97.4 -70.7 -28.6 37.9 15.2 63.6 184 48 B A S < S- 0 0 3 -4,-1.6 150,-0.1 -5,-0.2 149,-0.1 -0.355 74.6-135.0 -64.3 144.3 35.0 16.2 66.0 185 49 B E S S+ 0 0 134 148,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.775 81.9 3.6 -75.1 -27.4 32.7 13.2 66.9 186 50 B C S > S- 0 0 46 1,-0.1 4,-1.7 -95,-0.0 -99,-0.2 -0.955 77.2-102.5-153.9 167.2 29.5 15.2 66.3 187 51 B G H > S+ 0 0 0 -101,-0.4 4,-2.7 -2,-0.3 5,-0.2 0.853 115.4 54.8 -64.7 -36.1 28.3 18.6 65.1 188 52 B E H > S+ 0 0 103 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.859 105.6 53.1 -66.7 -32.8 27.5 20.1 68.6 189 53 B I H > S+ 0 0 48 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.928 111.1 47.7 -67.1 -43.9 31.1 19.3 69.8 190 54 B A H X S+ 0 0 2 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.946 109.1 52.1 -58.7 -50.0 32.4 21.2 66.7 191 55 B R H X S+ 0 0 74 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.897 109.5 51.8 -55.6 -41.8 30.1 24.2 67.3 192 56 B R H X S+ 0 0 81 -4,-2.1 4,-1.0 1,-0.2 3,-0.4 0.946 108.2 49.5 -59.4 -49.5 31.3 24.4 70.9 193 57 B E H >< S+ 0 0 1 -4,-2.3 3,-0.8 1,-0.2 7,-0.4 0.925 109.5 51.4 -59.4 -41.4 35.0 24.4 69.9 194 58 B F H 3< S+ 0 0 33 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.818 111.8 46.8 -70.3 -24.0 34.5 27.2 67.4 195 59 B R H 3< S+ 0 0 146 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.552 109.7 62.4 -92.2 -3.7 32.6 29.4 69.9 196 60 B E S 4 S+ 0 0 0 0, 0.0 3,-1.5 0, 0.0 4,-0.3 -0.955 127.0 38.0 -80.3 -22.5 41.3 28.8 72.0 199 63 B L G >4 S+ 0 0 2 -6,-0.3 3,-1.7 1,-0.3 -5,-0.1 0.858 112.0 57.7 -63.3 -36.5 39.8 28.7 68.5 200 64 B S G 3< S+ 0 0 22 -4,-2.3 118,-2.6 -7,-0.4 -1,-0.3 0.744 104.4 54.2 -65.2 -18.7 37.6 31.7 69.0 201 65 B A G < S+ 0 0 1 -3,-1.5 -1,-0.3 116,-0.2 -31,-0.2 0.421 87.8 95.5 -91.0 -1.3 40.7 33.8 69.7 202 66 B M S < S- 0 0 4 -3,-1.7 -31,-0.2 -4,-0.3 -30,-0.1 -0.825 77.7-126.0 -99.5 115.9 42.6 32.8 66.5 203 67 B P - 0 0 8 0, 0.0 -31,-2.3 0, 0.0 2,-0.4 -0.314 30.2-123.7 -54.9 134.5 42.3 35.3 63.6 204 68 B V E -h 172 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C A H > S+ 0 0 57 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.873 104.2 53.8 -66.0 -34.7 42.0 23.8 80.7 326 51 C D H > S+ 0 0 25 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.923 109.1 48.2 -63.1 -44.4 40.7 25.2 77.3 327 52 C L H X S+ 0 0 5 -4,-1.9 4,-2.0 1,-0.2 -174,-0.3 0.859 112.1 48.9 -64.1 -37.2 43.7 23.7 75.5 328 53 C R H X S+ 0 0 135 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.892 110.3 51.6 -69.4 -40.1 43.1 20.3 77.2 329 54 C R H X S+ 0 0 62 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.943 110.1 49.8 -60.1 -45.6 39.3 20.4 76.3 330 55 C L H X S+ 0 0 2 -4,-2.4 4,-2.2 1,-0.2 3,-0.3 0.942 106.9 54.3 -59.9 -45.0 40.2 21.1 72.7 331 56 C R H < S+ 0 0 83 -4,-2.0 4,-0.4 1,-0.3 -1,-0.2 0.887 107.5 50.7 -59.3 -39.3 42.6 18.2 72.6 332 57 C G H < S+ 0 0 57 -4,-2.0 3,-0.4 1,-0.2 -1,-0.3 0.868 113.3 45.5 -66.3 -33.3 39.9 15.8 73.7 333 58 C A H < S+ 0 0 14 -4,-1.7 -148,-0.3 -3,-0.3 -2,-0.2 0.807 122.8 33.4 -76.9 -32.3 37.5 17.0 71.1 334 59 C V S >< S+ 0 0 1 -4,-2.2 3,-2.7 -5,-0.2 4,-0.3 0.051 72.3 128.3-114.4 24.4 40.0 17.0 68.1 335 60 C A G > + 0 0 57 -3,-0.4 3,-2.3 -4,-0.4 -1,-0.1 0.831 64.8 71.3 -52.8 -32.1 42.2 14.0 69.1 336 61 C G G > S+ 0 0 16 -153,-0.4 3,-1.9 1,-0.3 -1,-0.3 0.683 76.3 77.8 -63.0 -15.3 41.6 12.6 65.6 337 62 C L G < S+ 0 0 8 -3,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.755 93.4 54.5 -60.5 -22.3 43.8 15.3 64.1 338 63 C G G < S+ 0 0 36 -3,-2.3 -1,-0.3 -4,-0.3 -2,-0.2 0.257 86.1 92.4 -95.1 12.0 46.6 13.1 65.3 339 64 C D <> - 0 0 79 -3,-1.9 4,-2.3 1,-0.1 5,-0.2 -0.909 61.6-162.2-105.1 104.4 45.4 10.0 63.5 340 65 C P H > S+ 0 0 77 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.829 88.3 52.1 -60.9 -32.7 47.1 9.9 60.1 341 66 C E H > S+ 0 0 90 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.908 109.1 49.3 -67.9 -42.8 44.6 7.5 58.6 342 67 C L H > S+ 0 0 17 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.922 112.5 49.3 -61.2 -43.1 41.6 9.6 59.6 343 68 C M H X S+ 0 0 2 -4,-2.3 4,-0.6 78,-0.3 -1,-0.2 0.865 107.4 53.0 -67.9 -32.2 43.4 12.7 58.1 344 69 C R H >< S+ 0 0 72 -4,-1.9 3,-1.2 77,-1.1 76,-0.6 0.931 108.5 51.7 -64.6 -41.3 44.1 10.9 54.9 345 70 C Q H >< S+ 0 0 79 -4,-2.2 3,-1.5 1,-0.3 -2,-0.2 0.903 101.9 60.1 -58.6 -39.8 40.4 10.0 54.7 346 71 C A H 3< S+ 0 0 0 -4,-2.0 -250,-2.9 1,-0.3 -1,-0.3 0.727 107.9 47.1 -59.5 -25.4 39.5 13.7 55.2 347 72 C W T << 0 0 0 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.190 360.0 360.0-111.9 14.6 41.5 14.5 51.9 348 73 C R < 0 0 26 -3,-1.5 69,-0.2 72,-0.2 -1,-0.2 -0.081 360.0 360.0 -91.7 360.0 40.2 11.9 49.5 349 !* 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 0.0 350 2 D S 0 0 162 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 177.0 25.2 40.6 26.8 351 3 D D - 0 0 165 2,-0.0 2,-0.4 0, 0.0 0, 0.0 -0.759 360.0-163.1-102.0 141.7 26.5 44.2 26.4 352 4 D V - 0 0 117 -2,-0.3 2,-0.6 2,-0.0 0, 0.0 -0.977 6.3-153.4-127.2 120.5 30.1 45.3 26.9 353 5 D L - 0 0 135 -2,-0.4 2,-0.6 2,-0.0 -2,-0.0 -0.821 6.5-164.9 -94.1 122.1 31.1 49.0 27.4 354 6 D I - 0 0 108 -2,-0.6 3,-0.3 3,-0.0 2,-0.2 -0.938 13.9-153.7-106.0 116.9 34.6 49.9 26.3 355 7 D R + 0 0 189 -2,-0.6 -2,-0.0 1,-0.2 0, 0.0 -0.567 61.1 12.4 -91.9 150.5 35.7 53.3 27.7 356 8 D D + 0 0 159 -2,-0.2 -1,-0.2 1,-0.2 3,-0.0 0.890 65.1 171.8 59.0 49.4 38.3 55.7 26.3 357 9 D I - 0 0 57 -3,-0.3 -1,-0.2 1,-0.1 5,-0.0 -0.807 41.1-110.4 -82.0 125.3 39.0 54.3 22.9 358 10 D P > - 0 0 69 0, 0.0 4,-2.3 0, 0.0 3,-0.5 -0.245 16.5-123.7 -58.5 144.8 41.2 56.9 21.1 359 11 D D H > S+ 0 0 138 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.828 110.9 55.9 -60.0 -33.2 39.6 58.9 18.2 360 12 D D H > S+ 0 0 122 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.873 107.3 49.0 -69.3 -32.8 42.4 57.8 15.8 361 13 D V H > S+ 0 0 64 -3,-0.5 4,-2.5 2,-0.2 -2,-0.2 0.949 112.7 48.0 -66.5 -49.1 41.7 54.1 16.6 362 14 D L H X S+ 0 0 29 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.897 109.6 52.4 -57.7 -43.4 37.9 54.6 16.0 363 15 D A H X S+ 0 0 59 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.906 111.2 47.3 -63.9 -39.8 38.5 56.5 12.7 364 16 D S H X S+ 0 0 65 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.939 112.1 49.1 -66.5 -44.5 40.7 53.6 11.4 365 17 D L H X S+ 0 0 42 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.880 108.9 53.6 -60.2 -41.9 38.1 51.0 12.4 366 18 D D H X S+ 0 0 63 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.893 111.4 45.7 -58.9 -41.3 35.3 53.0 10.7 367 19 D A H X S+ 0 0 35 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.890 112.9 49.6 -71.4 -40.4 37.3 53.1 7.5 368 20 D I H X S+ 0 0 52 -4,-2.4 4,-0.8 2,-0.2 -2,-0.2 0.924 112.0 49.3 -59.4 -45.8 38.2 49.4 7.7 369 21 D A H ><>S+ 0 0 1 -4,-2.6 5,-2.4 1,-0.2 3,-1.0 0.918 106.9 53.9 -63.9 -44.1 34.5 48.5 8.3 370 22 D A H ><5S+ 0 0 70 -4,-2.1 3,-1.4 1,-0.3 -1,-0.2 0.875 102.9 57.2 -59.3 -38.2 33.1 50.6 5.4 371 23 D R H 3<5S+ 0 0 195 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.791 109.1 47.4 -62.9 -25.6 35.4 48.8 3.0 372 24 D L T <<5S- 0 0 107 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.355 118.9-110.2 -96.0 2.4 33.8 45.5 4.1 373 25 D G T < 5S+ 0 0 72 -3,-1.4 2,-0.3 -4,-0.4 -3,-0.2 0.726 79.5 121.6 74.5 25.8 30.2 46.8 3.8 374 26 D L < - 0 0 33 -5,-2.4 -1,-0.3 -6,-0.1 -2,-0.2 -0.833 63.7-117.8-122.3 149.2 29.8 46.8 7.6 375 27 D S > - 0 0 68 -2,-0.3 4,-2.6 -3,-0.1 5,-0.2 -0.404 40.4-104.1 -69.9 163.3 29.0 49.3 10.4 376 28 D R H > S+ 0 0 98 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.924 121.9 45.3 -53.0 -50.1 31.6 50.0 13.1 377 29 D T H > S+ 0 0 85 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.880 112.3 50.3 -71.2 -33.6 29.7 47.9 15.7 378 30 D E H > S+ 0 0 54 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.923 111.2 50.2 -67.1 -41.0 29.0 45.0 13.2 379 31 D Y H X S+ 0 0 40 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.938 111.2 47.8 -59.7 -47.6 32.7 44.9 12.3 380 32 D I H X S+ 0 0 58 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.935 110.9 51.6 -61.5 -42.6 33.8 44.8 16.0 381 33 D R H X S+ 0 0 147 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.940 113.7 44.2 -58.9 -47.8 31.2 42.0 16.8 382 34 D R H X S+ 0 0 138 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.869 110.9 54.1 -66.8 -37.0 32.5 39.9 13.9 383 35 D R H X S+ 0 0 83 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.917 110.8 45.3 -63.2 -45.5 36.2 40.6 14.7 384 36 D L H X S+ 0 0 108 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.892 112.5 51.3 -66.2 -39.1 35.7 39.4 18.3 385 37 D A H X S+ 0 0 63 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.916 110.5 49.3 -61.8 -40.4 33.7 36.3 17.2 386 38 D Q H X S+ 0 0 106 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.893 108.9 52.6 -67.0 -39.7 36.5 35.4 14.7 387 39 D D H X S+ 0 0 72 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.918 109.0 50.1 -58.9 -44.4 39.1 35.8 17.4 388 40 D A H X S+ 0 0 63 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.869 109.4 50.6 -65.1 -39.1 37.2 33.4 19.6 389 41 D Q H >< S+ 0 0 129 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.929 110.4 49.6 -63.8 -45.0 36.9 30.8 16.9 390 42 D T H 3< S+ 0 0 115 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.884 113.2 47.5 -60.7 -37.7 40.7 31.1 16.2 391 43 D A H 3< S+ 0 0 77 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.694 84.5 120.5 -76.5 -18.4 41.4 30.6 20.0 392 44 D R << - 0 0 90 -4,-1.1 2,-0.2 -3,-0.5 -362,-0.1 -0.201 56.5-136.9 -60.4 136.3 39.0 27.7 20.5 393 45 D V - 0 0 47 -364,-0.4 2,-0.5 -365,-0.1 -1,-0.1 -0.504 8.7-134.6 -86.2 152.4 40.6 24.5 21.8 394 46 D T - 0 0 95 -2,-0.2 2,-0.6 -366,-0.0 -368,-0.1 -0.956 12.2-157.0-107.5 129.4 39.7 21.1 20.4 395 47 D V - 0 0 8 -2,-0.5 2,-0.2 -370,-0.1 -366,-0.1 -0.950 18.1-171.7-106.1 114.4 39.1 18.3 23.0 396 48 D T > - 0 0 56 -2,-0.6 4,-1.7 -336,-0.1 3,-0.2 -0.616 38.3-112.2-102.8 163.6 39.6 14.8 21.5 397 49 D A H > S+ 0 0 32 1,-0.2 4,-2.0 -2,-0.2 5,-0.2 0.890 120.6 55.7 -55.5 -39.7 38.9 11.3 22.7 398 50 D A H > S+ 0 0 50 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.864 102.9 54.6 -63.9 -37.3 42.7 10.8 22.8 399 51 D D H > S+ 0 0 24 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.901 109.6 47.4 -59.8 -43.2 43.1 13.9 25.1 400 52 D L H X S+ 0 0 7 -4,-1.7 4,-2.0 2,-0.2 -384,-0.3 0.881 112.5 48.4 -69.9 -37.1 40.6 12.4 27.6 401 53 D R H X S+ 0 0 144 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.895 110.1 52.8 -65.7 -43.8 42.3 9.0 27.5 402 54 D R H X S+ 0 0 52 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.923 109.5 48.5 -59.7 -46.2 45.7 10.6 28.0 403 55 D L H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.946 109.5 52.1 -59.3 -47.0 44.4 12.5 31.1 404 56 D R H < S+ 0 0 108 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.911 111.8 47.2 -57.1 -43.6 42.9 9.3 32.6 405 57 D G H >< S+ 0 0 56 -4,-2.3 3,-0.6 1,-0.2 -1,-0.2 0.879 112.2 49.2 -64.9 -37.6 46.2 7.5 32.2 406 58 D A H 3< S+ 0 0 14 -4,-2.1 -358,-0.4 1,-0.2 -1,-0.2 0.799 125.3 27.3 -74.1 -32.1 48.2 10.4 33.7 407 59 D V T >< S+ 0 0 0 -4,-2.2 3,-2.7 -5,-0.2 4,-0.3 -0.120 70.5 135.8-125.9 35.5 45.9 10.7 36.8 408 60 D A G X + 0 0 44 -3,-0.6 3,-1.8 1,-0.3 -1,-0.1 0.791 66.3 73.9 -48.9 -28.7 44.5 7.2 37.2 409 61 D G G > S+ 0 0 15 1,-0.3 3,-1.6 -363,-0.2 7,-0.3 0.650 76.5 74.2 -65.9 -15.8 45.3 7.8 40.9 410 62 D L G < S+ 0 0 8 -3,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.758 95.0 53.7 -66.2 -24.0 42.3 10.2 41.2 411 63 D G G < S+ 0 0 36 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.153 90.5 91.1 -93.3 17.0 40.2 7.0 41.0 412 64 D D <> - 0 0 60 -3,-1.6 4,-2.6 1,-0.1 3,-0.3 -0.917 59.5-165.0-114.4 101.9 42.2 5.5 43.9 413 65 D P H > S+ 0 0 85 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 0.816 88.9 57.6 -52.3 -33.8 40.5 6.3 47.2 414 66 D E H > S+ 0 0 124 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.922 109.7 41.4 -66.4 -45.9 43.7 5.2 49.0 415 67 D L H > S+ 0 0 15 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.917 113.9 51.8 -68.6 -43.2 45.9 7.7 47.2 416 68 D M H X S+ 0 0 2 -4,-2.6 4,-0.7 -7,-0.3 -1,-0.2 0.784 105.0 61.2 -63.4 -22.4 43.3 10.4 47.5 417 69 D R H >< S+ 0 0 84 -4,-1.1 3,-2.9 -5,-0.3 -70,-0.3 0.985 106.0 42.9 -61.1 -73.5 43.4 9.4 51.3 418 70 D Q H >< S+ 0 0 77 -4,-1.8 3,-2.2 1,-0.3 -2,-0.2 0.786 105.0 66.9 -33.4 -47.4 47.0 10.4 51.6 419 71 D A H 3< S+ 0 0 0 -4,-2.3 -186,-2.6 1,-0.3 -1,-0.3 0.753 102.3 45.7 -56.7 -26.6 46.4 13.6 49.6 420 72 D W T << 0 0 0 -3,-2.9 -1,-0.3 -4,-0.7 -2,-0.2 0.059 360.0 360.0-112.7 26.4 44.1 15.1 52.3 421 73 D R < 0 0 50 -3,-2.2 -77,-1.1 -74,-0.2 -78,-0.3 0.593 360.0 360.0 75.4 360.0 46.5 14.2 55.3