==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN/DNA 25-MAY-11 3AZN . COMPND 2 MOLECULE: HISTONE H3.1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.IWASAKI,H.TACHIWANA,K.KAWAGUCHI,T.SHIBATA,W.KAGAWA,H.KURUM . 758 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36068.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 551 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 4.0 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 . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 22 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 410 54.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.4 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 2 2 0 1 0 7 6 2 2 0 0 0 0 0 1 1 0 0 0 0 0 3 1 4 0 0 RESIDUES PER ALPHA HELIX . 0 10 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 . 10 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 38 A P 0 0 189 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-179.6 -59.3 -28.2 80.4 2 39 A H + 0 0 139 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.917 360.0 179.3-144.2 113.8 -56.5 -30.1 78.5 3 40 A R - 0 0 221 -2,-0.4 2,-0.3 3,-0.0 0, 0.0 -0.854 22.4-131.7-115.7 149.3 -53.1 -28.7 77.7 4 41 A Y - 0 0 122 -2,-0.3 3,-0.1 1,-0.1 5,-0.1 -0.730 36.2-101.2 -95.9 146.0 -50.1 -30.2 75.9 5 42 A R >> - 0 0 189 -2,-0.3 3,-1.9 1,-0.1 4,-0.6 -0.216 53.1 -82.3 -60.1 155.2 -46.6 -29.9 77.5 6 43 A P T 34 S+ 0 0 125 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.385 118.6 21.5 -61.7 136.5 -44.4 -27.2 76.0 7 44 A G T 3> S+ 0 0 22 -3,-0.1 4,-2.4 111,-0.1 5,-0.2 0.179 96.1 98.2 93.5 -17.7 -42.7 -28.5 72.8 8 45 A T H <> S+ 0 0 51 -3,-1.9 4,-1.4 2,-0.2 -3,-0.0 0.880 92.0 37.2 -70.3 -40.1 -45.3 -31.3 72.2 9 46 A V H X S+ 0 0 55 -4,-0.6 4,-3.4 2,-0.2 5,-0.2 0.865 112.7 60.4 -77.5 -37.3 -47.1 -29.2 69.7 10 47 A A H > S+ 0 0 8 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.949 106.7 45.0 -53.4 -52.9 -43.9 -27.7 68.4 11 48 A L H X S+ 0 0 4 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.910 112.8 52.6 -56.5 -43.1 -42.7 -31.2 67.5 12 49 A R H X S+ 0 0 101 -4,-1.4 4,-2.4 1,-0.2 -2,-0.2 0.921 108.6 48.9 -58.7 -46.7 -46.1 -31.8 65.9 13 50 A E H X S+ 0 0 40 -4,-3.4 4,-2.9 2,-0.2 -1,-0.2 0.888 111.1 52.2 -61.6 -38.8 -45.8 -28.6 63.9 14 51 A I H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 5,-0.3 0.979 109.4 47.0 -60.2 -58.1 -42.3 -29.8 62.8 15 52 A R H X S+ 0 0 113 -4,-3.0 4,-0.9 1,-0.2 -1,-0.2 0.891 115.4 48.2 -52.6 -40.5 -43.5 -33.2 61.6 16 53 A R H X S+ 0 0 131 -4,-2.4 4,-1.6 -5,-0.2 3,-0.5 0.955 114.2 42.5 -66.7 -51.5 -46.4 -31.5 59.8 17 54 A Y H < S+ 0 0 27 -4,-2.9 643,-0.2 1,-0.2 -1,-0.2 0.740 109.4 56.2 -69.8 -24.7 -44.4 -28.8 58.0 18 55 A Q H < S+ 0 0 11 -4,-2.5 642,-0.6 -5,-0.2 -1,-0.2 0.762 108.6 52.6 -76.3 -21.3 -41.5 -31.1 57.0 19 56 A K H < S+ 0 0 137 -4,-0.9 -2,-0.2 -3,-0.5 -1,-0.2 0.907 106.4 55.2 -78.3 -45.4 -44.2 -33.2 55.4 20 57 A S < - 0 0 30 -4,-1.6 640,-0.5 1,-0.1 638,-0.0 -0.128 60.7-155.6 -82.0-179.2 -45.8 -30.5 53.2 21 58 A T + 0 0 29 638,-0.1 638,-0.3 2,-0.1 636,-0.2 0.357 44.2 130.4-139.2 0.5 -44.4 -28.1 50.7 22 59 A E S S- 0 0 80 1,-0.1 -2,-0.0 636,-0.1 636,-0.0 -0.203 70.0 -96.1 -57.3 150.0 -46.8 -25.1 50.5 23 60 A L - 0 0 37 1,-0.1 -1,-0.1 2,-0.0 4,-0.1 -0.382 32.7-157.8 -63.9 150.7 -45.2 -21.7 50.8 24 61 A L + 0 0 6 -3,-0.1 2,-0.5 2,-0.1 86,-0.2 0.473 67.0 81.4-113.0 -6.3 -45.3 -20.5 54.5 25 62 A I S S- 0 0 6 31,-0.1 2,-0.3 85,-0.1 78,-0.1 -0.867 94.1-105.1 -98.5 134.1 -45.0 -16.8 54.1 26 63 A R > - 0 0 129 -2,-0.5 4,-1.8 76,-0.2 5,-0.2 -0.454 28.3-132.0 -66.4 126.7 -48.4 -15.2 53.2 27 64 A K H > S+ 0 0 107 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.826 95.6 48.4 -41.3 -61.3 -48.4 -14.2 49.5 28 65 A L H > S+ 0 0 109 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.951 110.8 49.9 -54.0 -57.1 -49.7 -10.6 49.5 29 66 A P H > S+ 0 0 10 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.925 114.6 46.4 -46.5 -51.8 -47.4 -9.3 52.2 30 67 A F H X S+ 0 0 0 -4,-1.8 4,-3.0 2,-0.2 5,-0.2 0.943 109.1 53.8 -55.2 -55.1 -44.5 -10.8 50.3 31 68 A Q H X S+ 0 0 55 -4,-3.1 4,-2.5 1,-0.3 -1,-0.2 0.933 111.8 46.6 -42.6 -56.1 -45.7 -9.4 47.0 32 69 A R H X S+ 0 0 110 -4,-2.9 4,-2.1 1,-0.2 -1,-0.3 0.888 111.6 50.6 -55.7 -46.5 -45.7 -6.0 48.7 33 70 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.896 110.7 48.3 -61.5 -45.5 -42.3 -6.5 50.2 34 71 A V H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.981 112.0 48.7 -57.8 -59.1 -40.6 -7.5 47.0 35 72 A R H X S+ 0 0 87 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.817 109.0 54.5 -51.6 -39.4 -42.1 -4.6 45.1 36 73 A E H X S+ 0 0 64 -4,-2.1 4,-0.8 2,-0.2 -1,-0.2 0.974 111.1 42.3 -61.2 -56.9 -41.0 -2.1 47.7 37 74 A I H >< S+ 0 0 6 -4,-2.0 3,-1.1 1,-0.2 -2,-0.2 0.887 113.6 54.4 -56.4 -42.2 -37.4 -3.1 47.7 38 75 A A H >X S+ 0 0 0 -4,-2.6 3,-2.4 1,-0.3 4,-1.8 0.875 98.0 63.3 -60.1 -39.6 -37.5 -3.3 43.9 39 76 A Q H 3< S+ 0 0 84 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.767 94.5 62.3 -58.3 -25.0 -38.8 0.3 43.8 40 77 A D T << S+ 0 0 124 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.482 110.2 38.9 -80.6 -1.6 -35.5 1.4 45.3 41 78 A F T <4 S+ 0 0 62 -3,-2.4 2,-0.3 1,-0.5 -2,-0.2 0.640 133.6 0.9-115.9 -30.0 -33.6 0.1 42.3 42 79 A K S < S- 0 0 59 -4,-1.8 -1,-0.5 111,-0.0 3,-0.4 -0.930 75.1-125.9-161.1 136.0 -35.9 1.1 39.4 43 80 A T S S+ 0 0 91 -2,-0.3 -3,-0.1 1,-0.2 -4,-0.1 -0.568 80.9 12.8 -92.8 155.1 -39.3 2.9 39.5 44 81 A D S S+ 0 0 99 -2,-0.2 -1,-0.2 1,-0.1 2,-0.2 0.906 82.9 166.2 50.8 50.2 -42.6 1.8 38.0 45 82 A L - 0 0 19 -3,-0.4 2,-0.4 -10,-0.1 109,-0.2 -0.485 28.7-140.2 -88.1 162.9 -41.5 -1.7 37.4 46 83 A R E -a 154 0A 157 107,-2.4 109,-3.5 -2,-0.2 2,-0.6 -0.973 10.4-143.0-124.3 141.4 -43.9 -4.5 36.6 47 84 A F E -a 155 0A 21 -2,-0.4 109,-0.2 107,-0.2 2,-0.1 -0.923 14.8-127.6-112.2 120.8 -43.5 -8.0 38.1 48 85 A Q > - 0 0 82 107,-2.6 4,-1.7 -2,-0.6 3,-0.3 -0.387 26.7-121.4 -59.6 133.8 -44.3 -11.1 36.0 49 86 A S H > S+ 0 0 98 1,-0.2 4,-1.3 2,-0.2 3,-0.2 0.899 113.7 45.8 -43.5 -49.6 -46.7 -13.3 38.1 50 87 A S H > S+ 0 0 45 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.842 102.9 62.8 -65.1 -39.2 -44.2 -16.1 38.0 51 88 A A H > S+ 0 0 0 -3,-0.3 4,-2.0 104,-0.2 -1,-0.2 0.881 104.3 48.8 -56.7 -40.3 -41.2 -14.0 38.8 52 89 A V H X S+ 0 0 0 -4,-1.7 4,-2.4 -3,-0.2 -1,-0.2 0.927 110.8 49.5 -66.4 -44.7 -42.6 -13.2 42.2 53 90 A M H X S+ 0 0 43 -4,-1.3 4,-2.7 -5,-0.2 -2,-0.2 0.900 107.5 55.5 -60.2 -41.5 -43.4 -16.8 42.9 54 91 A A H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.948 108.6 48.1 -55.8 -51.3 -39.9 -17.7 42.0 55 92 A L H X S+ 0 0 0 -4,-2.0 4,-3.7 1,-0.2 5,-0.3 0.921 111.2 49.0 -56.6 -47.8 -38.5 -15.3 44.5 56 93 A Q H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.904 113.5 48.1 -61.3 -38.2 -40.8 -16.5 47.3 57 94 A E H X S+ 0 0 22 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.973 116.2 42.1 -63.0 -54.6 -39.8 -20.1 46.5 58 95 A A H X S+ 0 0 1 -4,-3.1 4,-2.6 1,-0.2 -2,-0.2 0.922 117.8 48.5 -56.0 -49.2 -36.0 -19.2 46.4 59 96 A C H X S+ 0 0 0 -4,-3.7 4,-2.4 -5,-0.3 -2,-0.2 0.940 111.7 45.3 -60.5 -52.9 -36.5 -17.1 49.5 60 97 A E H X S+ 0 0 5 -4,-2.9 4,-2.0 -5,-0.3 -1,-0.2 0.806 113.3 52.3 -65.2 -27.4 -38.4 -19.5 51.7 61 98 A A H X S+ 0 0 33 -4,-1.9 4,-2.6 -5,-0.3 5,-0.2 0.973 108.0 51.4 -69.1 -53.5 -36.0 -22.3 50.7 62 99 A Y H X S+ 0 0 9 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.910 112.6 45.1 -46.4 -54.7 -33.1 -20.1 51.7 63 100 A L H X S+ 0 0 3 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.941 111.1 51.3 -60.0 -49.8 -34.5 -19.4 55.1 64 101 A V H X S+ 0 0 6 -4,-2.0 4,-1.0 1,-0.2 -1,-0.2 0.869 112.4 49.0 -55.0 -36.6 -35.6 -23.0 55.8 65 102 A G H X S+ 0 0 19 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.912 111.5 48.0 -68.8 -42.4 -32.0 -24.0 54.9 66 103 A L H X S+ 0 0 6 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.830 106.3 56.8 -68.0 -33.8 -30.6 -21.3 57.2 67 104 A F H X S+ 0 0 5 -4,-3.0 4,-2.2 2,-0.2 -1,-0.2 0.817 105.3 55.6 -68.4 -25.3 -32.9 -22.4 60.1 68 105 A E H X S+ 0 0 83 -4,-1.0 4,-2.2 -5,-0.3 -2,-0.2 0.988 109.7 40.5 -68.1 -59.8 -31.4 -25.8 59.7 69 106 A D H X S+ 0 0 24 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.810 114.8 56.3 -58.6 -29.9 -27.7 -24.8 60.1 70 107 A T H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 3,-0.5 0.954 105.8 48.6 -66.3 -49.7 -28.8 -22.5 62.9 71 108 A N H X S+ 0 0 5 -4,-2.2 4,-2.3 1,-0.3 5,-0.2 0.889 108.0 56.2 -58.0 -39.1 -30.5 -25.3 64.8 72 109 A L H X S+ 0 0 21 -4,-2.2 4,-1.9 1,-0.2 -1,-0.3 0.864 109.4 46.6 -60.1 -37.2 -27.3 -27.3 64.3 73 110 A C H X S+ 0 0 0 -4,-1.4 4,-1.2 -3,-0.5 -2,-0.2 0.921 109.4 52.0 -69.5 -48.5 -25.3 -24.5 66.0 74 111 A A H ><>S+ 0 0 0 -4,-2.6 5,-2.3 1,-0.2 3,-0.5 0.906 112.7 46.7 -55.6 -43.6 -27.7 -24.0 68.9 75 112 A I H ><5S+ 0 0 30 -4,-2.3 3,-2.5 1,-0.3 -1,-0.2 0.927 104.2 59.9 -66.1 -43.8 -27.5 -27.7 69.6 76 113 A H H 3<5S+ 0 0 29 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.793 102.4 55.8 -54.0 -26.1 -23.7 -27.6 69.3 77 114 A A T <<5S- 0 0 19 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 -0.008 125.3-106.2 -95.9 26.9 -23.9 -25.1 72.2 78 115 A K T < 5S+ 0 0 189 -3,-2.5 -3,-0.2 1,-0.2 2,-0.2 0.767 84.3 123.7 54.9 27.1 -25.8 -27.7 74.2 79 116 A R < - 0 0 52 -5,-2.3 -1,-0.2 -6,-0.2 3,-0.1 -0.595 53.1-163.2-110.2 176.3 -29.0 -25.7 73.6 80 117 A V S S+ 0 0 48 -2,-0.2 39,-1.0 1,-0.1 2,-0.6 0.302 74.9 79.2-135.3 -3.7 -32.4 -26.5 72.2 81 118 A T E S-b 119 0B 15 -7,-0.2 39,-0.2 37,-0.1 -1,-0.1 -0.936 76.8-135.4-113.1 112.9 -33.4 -22.8 71.6 82 119 A I E -b 120 0B 0 37,-1.9 39,-2.0 -2,-0.6 42,-0.2 -0.413 26.7-173.0 -67.3 144.6 -32.0 -21.1 68.5 83 120 A M >> - 0 0 51 -13,-0.2 3,-1.9 37,-0.1 4,-1.3 -0.910 40.7 -99.1-133.6 160.8 -30.8 -17.5 69.2 84 121 A P H 3> S+ 0 0 18 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.867 121.5 61.9 -49.2 -39.2 -29.6 -14.7 67.0 85 122 A K H 3> S+ 0 0 90 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.848 101.3 54.5 -56.8 -33.2 -26.0 -15.6 67.8 86 123 A D H <> S+ 0 0 0 -3,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.908 108.1 46.7 -68.1 -42.6 -26.7 -19.0 66.2 87 124 A I H X S+ 0 0 2 -4,-1.3 4,-2.9 2,-0.2 5,-0.3 0.961 112.4 51.7 -63.4 -47.4 -27.9 -17.4 62.9 88 125 A Q H X S+ 0 0 68 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.927 111.3 46.4 -52.5 -51.1 -24.9 -15.1 63.0 89 126 A L H X S+ 0 0 14 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.927 113.2 49.4 -57.8 -50.2 -22.5 -18.0 63.4 90 127 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 5,-0.2 0.978 111.8 47.3 -53.8 -60.6 -24.1 -20.1 60.7 91 128 A R H X>S+ 0 0 32 -4,-2.9 5,-2.3 1,-0.2 6,-1.6 0.768 111.8 53.1 -54.8 -27.3 -24.1 -17.2 58.2 92 129 A R H ><5S+ 0 0 121 -4,-1.7 3,-1.4 -5,-0.3 -1,-0.2 0.956 108.5 45.8 -74.3 -50.1 -20.5 -16.6 59.0 93 130 A I H 3<5S+ 0 0 7 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.800 111.0 57.5 -61.6 -25.3 -19.3 -20.1 58.5 94 131 A R H 3<5S- 0 0 58 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.701 113.2-123.0 -77.2 -20.9 -21.3 -20.0 55.3 95 132 A G T <<5S+ 0 0 61 -3,-1.4 -3,-0.2 -4,-0.5 -2,-0.1 0.681 84.6 109.4 87.0 18.4 -19.3 -16.9 54.1 96 133 A E < 0 0 77 -5,-2.3 -4,-0.2 1,-0.1 -5,-0.1 0.787 360.0 360.0 -91.4 -32.8 -22.3 -14.6 53.7 97 134 A R 0 0 135 -6,-1.6 -5,-0.2 -9,-0.2 -1,-0.1 0.003 360.0 360.0-111.5 360.0 -21.4 -12.5 56.7 98 !* 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 99 25 B N > 0 0 87 0, 0.0 3,-2.6 0, 0.0 4,-0.4 0.000 360.0 360.0 360.0 -50.3 -43.6 -3.9 55.0 100 26 B I G > + 0 0 31 1,-0.3 3,-1.6 2,-0.2 -67,-0.0 0.816 360.0 64.3 -59.1 -29.0 -40.9 -6.2 56.1 101 27 B Q G 3 S+ 0 0 101 1,-0.3 -1,-0.3 -72,-0.0 28,-0.0 0.611 82.8 79.1 -69.0 -11.0 -43.0 -6.3 59.2 102 28 B G G < S+ 0 0 18 -3,-2.6 2,-1.1 -73,-0.1 -1,-0.3 0.804 72.7 82.4 -65.9 -31.3 -45.5 -8.0 56.9 103 29 B I S < S- 0 0 4 -3,-1.6 2,-0.1 -4,-0.4 26,-0.1 -0.683 85.4-149.7 -76.6 105.8 -43.5 -11.2 57.4 104 30 B T > - 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0 0 7 -4,-3.1 3,-2.2 -5,-0.2 -1,-0.2 -0.729 65.1-179.4-135.8 84.2 3.7 4.9 43.7 307 50 D P T 3 S+ 0 0 93 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.747 86.9 50.6 -52.2 -27.6 6.5 6.2 41.4 308 51 D D T 3 S+ 0 0 82 -3,-0.1 2,-0.3 -5,-0.1 -5,-0.1 0.483 95.2 92.5 -91.6 -9.1 8.9 5.1 44.1 309 52 D T < - 0 0 3 -3,-2.2 -65,-0.2 -7,-0.2 2,-0.1 -0.720 51.4-162.7-103.7 143.2 7.7 1.6 44.6 310 53 D G E -e 244 0E 17 -67,-3.2 -65,-3.2 -2,-0.3 2,-0.3 -0.430 10.7-138.0-104.2-177.7 8.7 -1.8 43.1 311 54 D I E -e 245 0E 23 -67,-0.3 -65,-0.2 -2,-0.1 -67,-0.1 -0.959 15.5-126.1-148.5 124.4 7.0 -5.2 42.9 312 55 D S > - 0 0 22 -67,-2.9 4,-2.0 -2,-0.3 3,-0.2 -0.244 29.6-113.4 -64.0 157.2 8.5 -8.7 43.3 313 56 D S H > S+ 0 0 110 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.816 118.7 55.8 -64.0 -28.0 8.0 -11.2 40.5 314 57 D K H > S+ 0 0 118 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.882 106.7 49.8 -71.1 -37.3 5.9 -13.3 42.8 315 58 D A H > S+ 0 0 0 -70,-0.3 4,-2.7 1,-0.2 -2,-0.2 0.886 109.7 50.0 -68.0 -38.5 3.6 -10.3 43.4 316 59 D M H X S+ 0 0 20 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.821 104.5 61.3 -68.0 -29.2 3.4 -9.7 39.6 317 60 D G H X S+ 0 0 23 -4,-1.4 4,-1.6 -5,-0.2 246,-0.6 0.946 108.8 41.4 -59.1 -46.8 2.5 -13.4 39.5 318 61 D I H X S+ 0 0 2 -4,-1.7 4,-2.3 244,-0.2 -2,-0.2 0.942 111.1 55.4 -64.4 -50.8 -0.5 -12.7 41.6 319 62 D M H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.835 106.6 52.2 -54.4 -34.7 -1.4 -9.5 39.8 320 63 D N H X S+ 0 0 23 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.931 107.8 50.5 -68.7 -42.4 -1.5 -11.4 36.5 321 64 D S H X S+ 0 0 14 -4,-1.6 4,-2.5 1,-0.2 -2,-0.2 0.870 108.6 54.9 -59.9 -38.2 -3.9 -13.9 38.0 322 65 D F H X S+ 0 0 5 -4,-2.3 4,-2.6 2,-0.2 5,-0.3 0.958 109.0 44.7 -60.9 -54.3 -6.1 -11.1 39.1 323 66 D V H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.934 115.1 47.8 -57.2 -49.7 -6.4 -9.5 35.7 324 67 D N H X S+ 0 0 77 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.910 112.0 53.0 -59.1 -41.0 -7.0 -12.8 34.0 325 68 D D H X S+ 0 0 25 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.987 113.5 38.6 -57.3 -65.6 -9.6 -13.6 36.7 326 69 D I H X S+ 0 0 3 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.861 112.5 58.3 -56.8 -37.8 -11.7 -10.5 36.4 327 70 D F H X S+ 0 0 9 -4,-2.8 4,-3.1 -5,-0.3 5,-0.3 0.978 110.8 43.4 -55.2 -53.5 -11.3 -10.4 32.6 328 71 D E H X S+ 0 0 96 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.883 112.0 52.1 -59.5 -43.4 -12.9 -13.9 32.5 329 72 D R H X S+ 0 0 78 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.956 116.9 39.4 -57.8 -51.3 -15.6 -13.1 35.1 330 73 D I H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.942 115.5 48.8 -64.6 -52.7 -16.7 -10.0 33.1 331 74 D A H X S+ 0 0 0 -4,-3.1 4,-2.7 -5,-0.3 -1,-0.2 0.883 113.1 52.9 -56.6 -36.9 -16.3 -11.4 29.6 332 75 D G H X S+ 0 0 9 -4,-2.1 4,-2.5 -5,-0.3 -2,-0.2 0.957 109.6 42.5 -64.3 -55.4 -18.3 -14.4 30.9 333 76 D E H X S+ 0 0 3 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.862 116.3 52.3 -61.8 -32.8 -21.3 -12.5 32.3 334 77 D A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 5,-0.2 0.930 108.2 49.7 -66.1 -45.9 -21.2 -10.4 29.2 335 78 D S H X S+ 0 0 23 -4,-2.7 4,-1.8 -5,-0.2 -2,-0.2 0.922 115.5 44.1 -55.9 -46.2 -21.2 -13.5 27.0 336 79 D R H X S+ 0 0 96 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.886 110.2 54.6 -65.0 -46.8 -24.2 -14.8 29.0 337 80 D L H X S+ 0 0 1 -4,-2.9 4,-1.3 1,-0.2 -1,-0.2 0.855 109.0 48.2 -59.0 -39.9 -26.0 -11.5 29.0 338 81 D A H <>S+ 0 0 2 -4,-2.3 5,-2.6 2,-0.2 3,-0.3 0.935 108.8 53.5 -69.1 -44.3 -25.9 -11.2 25.2 339 82 D H H ><5S+ 0 0 111 -4,-1.8 3,-2.0 1,-0.2 -2,-0.2 0.955 106.2 53.3 -54.4 -51.6 -27.1 -14.8 24.8 340 83 D Y H 3<5S+ 0 0 44 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.823 110.0 47.9 -53.2 -37.2 -30.1 -14.0 27.0 341 84 D N T 3<5S- 0 0 45 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 -0.024 112.7-116.9 -97.6 32.4 -31.1 -11.1 24.9 342 85 D K T < 5 + 0 0 197 -3,-2.0 2,-0.4 1,-0.2 -3,-0.2 0.771 68.3 146.0 38.6 34.6 -30.7 -13.0 21.6 343 86 D R < - 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