==== 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 TRANSFERASE/DNA 03-JAN-05 1YFL . COMPND 2 MOLECULE: 5'-D(P*TP*CP*AP*CP*AP*GP*GP*AP*TP*CP*CP*TP*GP*TP* . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.R.HORTON,K.LIEBERT,S.HATTMAN,A.JELTSCH,X.CHENG . 993 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44647.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 695 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 6.6 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 . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 74 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 163 16.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 280 28.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 4 4 2 0 2 8 0 2 2 4 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 12 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 PARALLEL BRIDGES PER LADDER . 8 4 0 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 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 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 1 A M 0 0 100 0, 0.0 14,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 29.6 110.3 67.9 36.6 2 2 A L - 0 0 44 38,-0.1 2,-0.3 136,-0.1 38,-0.0 -0.381 360.0-127.2 -77.8 153.6 107.4 66.4 34.7 3 3 A G - 0 0 0 -2,-0.1 33,-0.2 1,-0.1 34,-0.1 -0.672 24.5-115.6 -96.7 157.6 107.0 62.8 33.7 4 4 A A S S+ 0 0 2 31,-1.5 2,-0.3 -2,-0.3 139,-0.1 0.832 99.6 8.1 -61.4 -32.1 106.3 61.9 30.0 5 5 A I S S- 0 0 1 30,-0.8 -1,-0.2 134,-0.1 32,-0.1 -0.995 94.3 -90.1-146.8 146.9 102.9 60.6 31.0 6 6 A A - 0 0 21 -2,-0.3 2,-0.4 -3,-0.1 -4,-0.0 -0.347 58.1-177.8 -54.8 138.3 100.9 60.7 34.2 7 7 A Y > - 0 0 19 107,-0.1 3,-2.0 27,-0.0 2,-0.3 -0.978 32.2-113.6-154.5 135.6 101.9 57.5 36.0 8 8 A T T 3 S+ 0 0 78 -2,-0.4 27,-0.2 1,-0.3 3,-0.1 -0.463 105.8 16.0 -67.5 121.3 101.1 55.7 39.2 9 9 A G T 3 S+ 0 0 34 -2,-0.3 -1,-0.3 1,-0.2 170,-0.0 0.224 89.0 157.3 100.0 -11.8 104.0 55.7 41.5 10 10 A N < - 0 0 52 -3,-2.0 -1,-0.2 988,-0.4 3,-0.1 0.147 35.8-148.1 -40.5 163.2 105.7 58.5 39.7 11 11 A K >> + 0 0 8 1,-0.1 4,-1.6 2,-0.1 3,-0.7 0.345 47.7 134.9-123.2 6.0 108.2 60.5 41.6 12 12 A Q T 34 S+ 0 0 45 1,-0.3 3,-0.3 2,-0.2 -1,-0.1 0.735 81.1 42.6 -21.9 -54.6 108.1 64.0 40.2 13 13 A S T 34 S+ 0 0 84 1,-0.2 4,-0.5 2,-0.1 -1,-0.3 0.927 113.6 46.4 -67.8 -49.6 108.1 65.5 43.7 14 14 A L T <> S+ 0 0 37 -3,-0.7 4,-2.5 1,-0.2 5,-0.2 0.634 85.6 90.4 -72.8 -12.2 110.7 63.4 45.5 15 15 A L H X S+ 0 0 7 -4,-1.6 4,-2.5 -3,-0.3 5,-0.3 0.939 85.9 53.8 -49.1 -50.7 113.3 63.6 42.7 16 16 A P H >> S+ 0 0 69 0, 0.0 4,-1.6 0, 0.0 3,-1.1 0.960 114.1 38.3 -47.3 -65.3 114.7 66.8 44.3 17 17 A E H 34 S+ 0 0 96 -4,-0.5 -2,-0.2 1,-0.3 -3,-0.1 0.781 117.3 56.3 -57.9 -23.5 115.2 65.2 47.7 18 18 A L H >< S+ 0 0 2 -4,-2.5 3,-0.8 1,-0.2 4,-0.3 0.767 101.7 52.3 -80.6 -27.3 116.3 62.1 45.8 19 19 A K H X< S+ 0 0 76 -4,-2.5 3,-1.8 -3,-1.1 -2,-0.2 0.848 90.4 76.8 -76.2 -33.7 119.1 63.7 43.8 20 20 A S T 3< S+ 0 0 74 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.1 0.593 104.2 39.8 -52.0 -8.4 120.6 65.1 46.9 21 21 A H T < S+ 0 0 60 -3,-0.8 -1,-0.3 2,-0.1 -2,-0.2 0.507 84.3 121.0-118.5 -11.3 121.9 61.5 47.4 22 22 A F < - 0 0 39 -3,-1.8 3,-0.1 -4,-0.3 -3,-0.0 -0.313 50.3-147.8 -59.8 133.9 122.8 60.5 43.9 23 23 A P - 0 0 25 0, 0.0 2,-0.4 0, 0.0 144,-0.1 -0.055 34.5 -75.1 -83.6-170.6 126.5 59.4 43.5 24 24 A K + 0 0 151 142,-0.1 2,-0.3 -2,-0.0 182,-0.2 -0.783 55.5 176.3 -94.6 141.9 128.6 60.0 40.4 25 25 A Y - 0 0 22 -2,-0.4 141,-0.3 1,-0.1 3,-0.1 -0.969 41.7-148.8-143.4 157.5 128.0 57.7 37.4 26 26 A N S S+ 0 0 130 139,-3.0 2,-0.3 1,-0.4 140,-0.2 0.606 101.1 20.2 -94.7 -17.1 129.1 57.1 33.8 27 27 A R S S- 0 0 55 138,-0.5 140,-2.8 136,-0.1 2,-0.6 -0.973 74.2-140.9-150.5 136.6 125.6 55.8 33.1 28 28 A F E -ab 46 167A 0 17,-3.1 19,-3.2 -2,-0.3 2,-0.6 -0.895 18.8-156.8-100.3 124.3 122.3 56.4 35.1 29 29 A V E -ab 47 168A 0 138,-3.6 140,-3.3 -2,-0.6 2,-0.8 -0.901 12.6-169.6-107.7 122.9 120.2 53.2 35.2 30 30 A D E -ab 48 169A 0 17,-3.0 19,-2.9 -2,-0.6 3,-0.2 -0.746 11.4-178.4-107.4 79.8 116.5 53.6 35.8 31 31 A L S S+ 0 0 5 -2,-0.8 2,-0.5 138,-0.6 -1,-0.2 0.820 77.5 25.5 -45.8 -50.4 115.7 49.9 36.4 32 32 A F S S+ 0 0 5 137,-0.7 -1,-0.2 -3,-0.1 18,-0.2 -0.946 78.4 155.8-121.0 103.4 112.0 50.4 36.9 33 33 A C > + 0 0 0 16,-2.1 3,-2.7 -2,-0.5 4,-0.4 0.711 4.8 149.0-112.5 -18.6 111.1 53.5 35.0 34 34 A G T 3 S+ 0 0 0 1,-0.3 -1,-0.1 15,-0.2 -25,-0.1 0.155 80.5 29.8 25.3-101.9 107.4 53.6 33.9 35 35 A G T 3 S- 0 0 0 963,-0.8 -31,-1.5 -27,-0.2 -30,-0.8 0.664 93.4-132.6 -56.6 -24.8 106.5 57.3 34.0 36 36 A L <> + 0 0 0 -3,-2.7 4,-1.2 962,-0.3 5,-0.1 0.731 61.1 140.3 71.3 23.7 110.1 58.6 33.1 37 37 A S T 4 S+ 0 0 2 961,-0.8 -3,-0.1 -4,-0.4 -4,-0.0 0.841 80.4 30.2 -62.5 -35.8 109.6 61.1 36.0 38 38 A V T >4 S+ 0 0 5 -5,-0.3 3,-4.5 2,-0.1 -1,-0.1 0.932 117.3 51.7 -88.0 -71.5 113.3 60.3 36.8 39 39 A S G >4 S+ 0 0 0 1,-0.3 3,-1.5 2,-0.2 -2,-0.1 0.836 106.4 54.4 -33.6 -61.4 115.0 59.5 33.4 40 40 A L G 3< S+ 0 0 0 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.1 0.693 116.5 42.9 -52.1 -11.9 113.7 62.6 31.7 41 41 A N G < S+ 0 0 21 -3,-4.5 -1,-0.3 -5,-0.1 2,-0.2 -0.022 95.5 77.1-132.3 36.9 115.4 64.5 34.6 42 42 A V S < S- 0 0 8 -3,-1.5 2,-0.5 -14,-0.1 4,-0.1 -0.706 89.2 -79.0-126.7-179.5 118.8 63.1 35.4 43 43 A N - 0 0 107 -2,-0.2 -15,-0.2 2,-0.1 -2,-0.1 -0.762 66.8 -80.1 -91.0 128.7 122.1 63.5 33.7 44 44 A G S S+ 0 0 35 -2,-0.5 2,-0.1 -17,-0.1 106,-0.1 -0.101 95.6 68.0 -58.8 160.9 122.7 61.4 30.6 45 45 A P - 0 0 66 0, 0.0 -17,-3.1 0, 0.0 2,-0.4 0.552 68.9-179.9 -77.4 153.4 123.4 58.7 29.6 46 46 A V E -ac 28 150A 3 103,-1.6 105,-3.2 -19,-0.2 2,-0.9 -0.977 25.0-161.0-128.1 127.8 120.3 57.0 30.9 47 47 A L E -ac 29 151A 16 -19,-3.2 -17,-3.0 -2,-0.4 2,-0.8 -0.869 18.3-167.5-103.5 98.2 119.3 53.4 30.6 48 48 A A E -ac 30 152A 0 103,-2.2 105,-3.6 -2,-0.9 2,-0.4 -0.787 11.0-178.9 -90.2 111.7 115.5 53.5 31.2 49 49 A N E + c 0 153A 2 -19,-2.9 -16,-2.1 -2,-0.8 2,-0.3 -0.888 13.8 158.0-116.6 143.2 114.2 50.0 31.8 50 50 A D - 0 0 0 103,-2.2 -18,-0.1 -2,-0.4 6,-0.1 -0.959 39.8-131.8-154.8 147.4 110.7 48.8 32.4 51 51 A I S S+ 0 0 51 -2,-0.3 2,-1.5 103,-0.2 105,-0.1 0.826 84.7 90.6 -73.2 -30.4 109.2 45.4 31.9 52 52 A Q > - 0 0 10 1,-0.2 4,-2.0 103,-0.1 3,-0.4 -0.488 55.9-171.8 -73.3 87.4 106.1 46.6 30.1 53 53 A E H > S+ 0 0 110 -2,-1.5 4,-3.5 1,-0.2 5,-0.4 0.817 80.7 63.5 -46.9 -38.8 107.2 46.6 26.4 54 54 A P H > S+ 0 0 31 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.988 107.8 39.3 -54.4 -57.2 104.0 48.4 25.5 55 55 A I H > S+ 0 0 1 -3,-0.4 4,-0.8 1,-0.2 -2,-0.2 0.819 118.2 51.2 -61.8 -28.9 104.9 51.5 27.4 56 56 A I H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.871 111.0 45.4 -76.6 -36.1 108.5 51.1 26.3 57 57 A E H X S+ 0 0 65 -4,-3.5 4,-2.9 1,-0.2 -2,-0.2 0.857 106.3 61.9 -72.4 -33.9 107.6 50.8 22.6 58 58 A M H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.4 -1,-0.2 0.843 108.2 43.4 -58.7 -33.2 105.3 53.7 23.1 59 59 A Y H X S+ 0 0 0 -4,-0.8 4,-1.6 2,-0.2 -2,-0.2 0.943 109.1 53.7 -76.9 -51.0 108.4 55.7 24.0 60 60 A K H < S+ 0 0 87 -4,-2.2 3,-0.3 2,-0.2 4,-0.2 0.914 116.2 44.5 -48.8 -42.7 110.6 54.4 21.3 61 61 A R H >< S+ 0 0 90 -4,-2.9 3,-2.7 1,-0.2 4,-0.5 0.998 102.6 60.1 -62.9 -74.9 107.7 55.5 19.0 62 62 A L H >< S+ 0 0 1 -4,-2.4 3,-0.7 1,-0.3 -1,-0.2 0.636 84.7 84.9 -25.9 -32.9 106.9 58.9 20.5 63 63 A I T 3< S+ 0 0 65 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.790 103.0 28.0 -46.4 -34.7 110.5 59.9 19.6 64 64 A N T < S+ 0 0 125 -3,-2.7 -1,-0.3 -4,-0.2 -2,-0.2 0.531 99.2 96.9-109.2 -7.8 109.4 60.8 16.1 65 65 A V < - 0 0 2 -3,-0.7 2,-0.3 -4,-0.5 3,-0.0 -0.273 62.0-142.6 -74.5 169.9 105.8 61.8 16.5 66 66 A S > - 0 0 29 1,-0.1 4,-2.5 749,-0.0 5,-0.1 -0.909 28.6-104.3-130.0 159.3 104.9 65.5 16.9 67 67 A W H > S+ 0 0 26 -2,-0.3 4,-3.2 1,-0.3 5,-0.1 0.843 126.6 51.1 -52.9 -32.9 102.3 67.2 19.0 68 68 A D H > S+ 0 0 104 2,-0.2 4,-3.8 1,-0.2 -1,-0.3 0.954 102.8 56.9 -69.0 -49.2 100.3 67.5 15.8 69 69 A D H > S+ 0 0 50 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.930 113.4 43.8 -41.9 -51.2 100.7 63.9 15.0 70 70 A V H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.973 112.6 47.8 -57.8 -63.5 99.1 63.4 18.4 71 71 A L H X S+ 0 0 64 -4,-3.2 4,-2.7 1,-0.2 3,-0.4 0.863 108.4 59.4 -48.4 -42.3 96.4 66.0 18.0 72 72 A K H X S+ 0 0 116 -4,-3.8 4,-3.0 1,-0.2 5,-0.3 0.974 101.5 49.8 -50.6 -69.3 95.6 64.5 14.6 73 73 A V H < S+ 0 0 21 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.757 112.2 51.7 -42.7 -30.9 94.8 61.0 15.9 74 74 A I H >X>S+ 0 0 14 -4,-1.4 3,-1.9 -3,-0.4 4,-1.6 0.979 110.8 44.1 -72.4 -57.5 92.5 62.7 18.4 75 75 A K H ><5S+ 0 0 76 -4,-2.7 3,-1.6 1,-0.3 -2,-0.2 0.961 110.5 58.0 -48.7 -54.3 90.6 64.8 15.9 76 76 A Q T 3<5S+ 0 0 142 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.696 115.1 36.0 -51.2 -21.8 90.4 61.6 13.7 77 77 A Y T <45S- 0 0 34 -3,-1.9 -1,-0.3 -4,-0.5 -2,-0.2 0.519 102.4-133.3-108.7 -8.0 88.7 59.8 16.6 78 78 A K T <<5 - 0 0 73 -3,-1.6 -3,-0.2 -4,-1.6 2,-0.1 0.885 41.9-179.5 56.3 43.8 86.7 62.8 17.7 79 79 A L < + 0 0 13 -5,-1.3 2,-0.3 7,-0.1 -1,-0.2 -0.446 9.5 146.5 -78.8 144.9 87.7 62.1 21.3 80 80 A S > - 0 0 60 3,-0.2 3,-5.3 -2,-0.1 50,-0.1 -0.952 61.1 -70.1-173.6 159.1 86.7 64.0 24.4 81 81 A K T 3 S+ 0 0 41 1,-0.3 -2,-0.0 -2,-0.3 50,-0.0 0.547 132.6 27.8 -19.9 -33.0 85.7 64.1 28.1 82 82 A T T 3 S+ 0 0 128 47,-0.1 2,-1.9 1,-0.1 -1,-0.3 0.329 85.9 115.6-120.7 6.9 82.4 62.4 27.3 83 83 A S <> + 0 0 8 -3,-5.3 4,-1.4 1,-0.2 -3,-0.2 -0.479 29.4 158.2 -79.7 76.1 83.3 60.4 24.1 84 84 A K H > S+ 0 0 109 -2,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.881 73.0 39.7 -67.6 -42.3 82.9 56.8 25.6 85 85 A E H > S+ 0 0 123 2,-0.2 4,-1.6 -3,-0.2 -1,-0.2 0.865 110.8 56.8 -76.5 -37.9 82.4 54.9 22.3 86 86 A E H > S+ 0 0 76 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.879 111.3 48.7 -57.9 -38.3 85.0 56.9 20.3 87 87 A F H X S+ 0 0 0 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.996 105.3 53.3 -62.4 -68.8 87.3 55.7 23.1 88 88 A L H X S+ 0 0 54 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.743 110.0 51.9 -40.1 -31.1 86.3 52.0 23.0 89 89 A K H X S+ 0 0 40 -4,-1.6 4,-2.9 2,-0.2 5,-0.3 0.985 105.8 50.8 -71.3 -59.8 87.1 52.1 19.3 90 90 A L H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.781 110.6 54.4 -46.2 -32.6 90.5 53.6 19.7 91 91 A R H X S+ 0 0 61 -4,-2.2 4,-2.9 2,-0.2 3,-0.5 0.994 107.3 46.1 -65.9 -63.2 91.0 50.8 22.2 92 92 A E H X S+ 0 0 110 -4,-2.1 4,-2.0 1,-0.3 -2,-0.2 0.910 111.6 53.9 -43.8 -53.6 90.0 48.0 19.8 93 93 A D H X>S+ 0 0 54 -4,-2.9 4,-2.9 2,-0.2 5,-0.5 0.909 110.7 45.5 -50.0 -48.1 92.3 49.6 17.1 94 94 A Y H X5S+ 0 0 8 -4,-1.9 4,-3.7 -3,-0.5 5,-0.3 0.989 109.9 54.4 -59.5 -56.6 95.2 49.6 19.5 95 95 A N H <5S+ 0 0 33 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.769 117.6 37.6 -46.0 -32.3 94.5 46.1 20.5 96 96 A K H <5S+ 0 0 136 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.945 127.0 30.1 -86.5 -59.6 94.5 45.0 16.9 97 97 A T H <5S- 0 0 87 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.819 84.6-147.2 -70.8 -32.1 97.3 47.1 15.3 98 98 A R << + 0 0 102 -4,-3.7 -4,-0.1 -5,-0.5 -3,-0.1 0.813 35.0 170.2 63.0 30.7 99.4 47.3 18.5 99 99 A D >> - 0 0 52 -6,-0.3 3,-2.0 -5,-0.3 4,-1.0 -0.665 31.1-146.9 -80.0 104.2 100.4 50.7 17.1 100 100 A P H >> S+ 0 0 27 0, 0.0 4,-2.1 0, 0.0 3,-0.6 0.800 93.3 61.9 -36.2 -52.9 102.3 52.5 20.0 101 101 A L H 3> S+ 0 0 7 1,-0.3 4,-1.1 2,-0.2 5,-0.1 0.837 102.9 52.9 -50.5 -35.7 101.1 56.0 19.0 102 102 A L H <> S+ 0 0 13 -3,-2.0 4,-2.7 2,-0.2 3,-0.4 0.883 103.5 54.5 -69.1 -40.0 97.5 54.8 19.7 103 103 A L H < S+ 0 0 0 -4,-1.1 3,-2.2 -3,-0.4 4,-0.4 0.941 111.2 54.1 -74.7 -49.5 96.3 58.6 23.1 106 106 A L H >X S+ 0 0 0 -4,-2.7 3,-3.7 1,-0.3 4,-1.2 0.921 97.5 63.2 -46.1 -54.5 94.4 56.0 25.0 107 107 A H T 3< S+ 0 0 4 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.694 98.6 59.8 -46.1 -21.4 96.4 56.6 28.2 108 108 A F T <4 S+ 0 0 10 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.636 112.4 35.4 -83.2 -17.9 94.9 60.1 28.0 109 109 A H T <4 S+ 0 0 0 -3,-3.7 19,-2.7 -4,-0.4 21,-0.3 0.375 90.6 118.1-116.7 -1.1 91.3 58.8 28.2 110 110 A G B >< S-F 127 0B 0 -4,-1.2 3,-2.7 17,-0.2 2,-0.5 -0.279 82.2 -84.5 -70.7 154.7 91.7 55.9 30.6 111 111 A F G > S- 0 0 114 15,-2.3 3,-1.3 1,-0.3 17,-0.2 -0.428 117.1 -13.2 -59.0 109.9 90.1 55.6 34.0 112 112 A S G 3 S- 0 0 61 -2,-0.5 -1,-0.3 16,-0.3 3,-0.1 0.814 118.0 -75.8 60.7 34.7 92.6 57.5 36.1 113 113 A N G < S+ 0 0 43 -3,-2.7 -1,-0.3 1,-0.2 2,-0.2 0.779 82.9 166.5 50.0 31.2 95.1 57.4 33.2 114 114 A M < - 0 0 41 -3,-1.3 2,-0.6 12,-0.1 -1,-0.2 -0.546 30.1-156.3 -76.6 139.6 95.7 53.8 34.1 115 115 A I + 0 0 15 -2,-0.2 2,-0.4 -3,-0.1 -60,-0.1 -0.736 26.3 169.8-114.7 79.9 97.7 51.9 31.5 116 116 A R - 0 0 77 -2,-0.6 8,-2.1 64,-0.0 9,-0.6 -0.799 8.9-176.2 -95.4 132.4 96.6 48.4 32.3 117 117 A I B -G 123 0C 11 -2,-0.4 6,-0.2 6,-0.2 -2,-0.0 -0.976 11.2-139.8-129.9 142.5 97.5 45.5 29.9 118 118 A N > - 0 0 68 4,-1.9 3,-2.1 -2,-0.4 5,-0.0 -0.161 35.7 -84.7 -96.0-175.0 96.5 41.8 30.1 119 119 A D T 3 S+ 0 0 110 1,-0.3 -1,-0.0 2,-0.2 -2,-0.0 0.955 130.7 48.4 -48.1 -57.6 97.9 38.4 29.4 120 120 A K T 3 S- 0 0 167 1,-0.1 -1,-0.3 2,-0.1 -2,-0.0 0.455 123.7-110.1 -65.2 0.2 97.1 38.7 25.7 121 121 A G < + 0 0 15 -3,-2.1 2,-0.4 1,-0.2 -2,-0.2 0.825 66.8 150.8 75.5 32.6 98.7 42.1 25.9 122 122 A N - 0 0 40 2,-0.0 -4,-1.9 -24,-0.0 2,-0.5 -0.807 52.3-119.2-106.3 144.2 95.6 44.2 25.5 123 123 A F B +G 117 0C 2 -2,-0.4 -6,-0.2 -6,-0.2 -28,-0.1 -0.629 40.7 165.3 -72.5 120.4 94.8 47.6 26.8 124 124 A T + 0 0 34 -8,-2.1 -1,-0.1 -2,-0.5 -7,-0.1 0.284 18.8 133.8-125.0 9.2 91.8 47.0 29.0 125 125 A T - 0 0 0 -9,-0.6 3,-0.1 -11,-0.1 -13,-0.1 -0.397 56.2-120.6 -63.2 137.5 91.5 50.2 31.1 126 126 A P - 0 0 54 0, 0.0 -15,-2.3 0, 0.0 -12,-0.1 -0.214 43.6 -74.5 -69.7 166.2 87.8 51.4 31.2 127 127 A F B -F 110 0B 27 -17,-0.2 -17,-0.2 1,-0.1 -43,-0.1 -0.304 39.1-158.0 -63.3 150.4 86.9 54.8 29.9 128 128 A G - 0 0 8 -19,-2.7 -16,-0.3 2,-0.3 -18,-0.2 0.251 31.9-119.4-117.6 13.9 88.0 57.6 32.3 129 129 A K S S+ 0 0 171 -20,-0.3 2,-0.3 1,-0.2 -48,-0.1 0.910 81.8 93.5 48.6 50.5 85.7 60.5 31.3 130 130 A R - 0 0 93 -21,-0.3 -2,-0.3 -50,-0.1 2,-0.2 -0.974 46.3-178.5-160.1 166.1 88.7 62.6 30.3 131 131 A T - 0 0 30 -2,-0.3 5,-0.1 1,-0.3 -51,-0.1 -0.729 50.9 -36.3-149.3-162.8 90.9 63.6 27.5 132 132 A I + 0 0 48 -2,-0.2 2,-0.3 3,-0.0 -1,-0.3 -0.116 56.8 170.4 -66.3 166.1 93.9 65.8 27.0 133 133 A N >> - 0 0 103 1,-0.1 3,-1.8 -3,-0.1 4,-0.7 -0.898 51.8 -57.4-158.5-178.8 94.5 69.1 28.9 134 134 A K H >> S+ 0 0 178 1,-0.3 3,-1.1 -2,-0.3 4,-1.0 0.881 130.4 47.5 -34.2 -71.9 97.1 71.8 29.5 135 135 A N H 3> S+ 0 0 66 1,-0.2 4,-4.0 2,-0.2 5,-0.4 0.710 93.9 82.6 -47.0 -26.6 99.8 69.4 31.0 136 136 A S H <> S+ 0 0 4 -3,-1.8 4,-3.0 1,-0.2 -1,-0.2 0.931 100.1 32.7 -46.2 -58.3 99.2 67.0 28.1 137 137 A E H X S+ 0 0 2 -4,-2.0 4,-3.0 -5,-0.3 3,-1.5 0.989 110.1 46.9 -61.3 -59.0 109.7 64.1 26.9 144 144 A K H 3< S+ 0 0 23 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.675 110.1 53.1 -56.3 -24.6 110.8 65.1 23.4 145 145 A Q H 3< S+ 0 0 24 -4,-1.8 747,-0.3 1,-0.1 -1,-0.3 0.640 122.8 26.4 -89.5 -11.8 113.3 67.6 24.7 146 146 A N H X< S+ 0 0 14 -3,-1.5 3,-2.1 -4,-0.8 -2,-0.2 0.651 93.4 87.8-122.8 -18.4 115.1 65.2 27.0 147 147 A C G >< S+ 0 0 8 -4,-3.0 3,-1.6 1,-0.3 -3,-0.1 0.631 74.1 76.4 -58.9 -16.6 114.6 61.6 25.6 148 148 A D G 3 S+ 0 0 92 1,-0.3 -1,-0.3 -5,-0.2 -2,-0.1 0.644 89.1 57.8 -72.6 -11.3 117.6 61.8 23.4 149 149 A K G < S+ 0 0 40 -3,-2.1 -103,-1.6 -104,-0.1 2,-0.3 0.251 100.0 83.2 -98.9 16.0 119.8 61.3 26.5 150 150 A I E < -c 46 0A 13 -3,-1.6 2,-0.5 -105,-0.2 -103,-0.2 -0.884 58.2-159.4-122.7 147.7 118.0 58.0 27.1 151 151 A I E -c 47 0A 117 -105,-3.2 -103,-2.2 -2,-0.3 2,-0.4 -0.997 27.1-135.7-121.8 125.6 118.2 54.4 25.9 152 152 A F E -c 48 0A 27 -2,-0.5 2,-0.4 -105,-0.2 -103,-0.2 -0.669 22.8-178.3 -90.8 134.4 115.1 52.4 26.4 153 153 A S E -c 49 0A 18 -105,-3.6 -103,-2.2 -2,-0.4 2,-0.2 -0.982 17.0-168.1-131.3 141.2 115.0 48.9 27.8 154 154 A S + 0 0 21 -2,-0.4 2,-0.3 -105,-0.2 -101,-0.2 -0.514 43.7 122.9-128.3 66.9 112.2 46.5 28.4 155 155 A L S S- 0 0 82 -2,-0.2 2,-0.2 -124,-0.2 -103,-0.1 -0.845 71.2 -91.9-124.4 160.3 113.6 43.6 30.4 156 156 A H >> - 0 0 39 -2,-0.3 3,-2.3 1,-0.2 4,-1.1 -0.522 46.6-117.2 -64.1 133.1 113.0 42.0 33.8 157 157 A F T 34 S+ 0 0 10 1,-0.3 3,-0.3 -2,-0.2 -1,-0.2 0.857 112.5 71.0 -42.7 -41.0 115.2 43.9 36.2 158 158 A K T 34 S+ 0 0 118 1,-0.2 -1,-0.3 3,-0.1 -2,-0.1 0.351 105.0 38.9 -61.0 7.2 117.1 40.6 36.8 159 159 A D T <4 S+ 0 0 86 -3,-2.3 2,-0.9 2,-0.0 -1,-0.2 0.619 77.8 110.5-125.8 -34.1 118.5 40.8 33.3 160 160 A V S < S- 0 0 6 -4,-1.1 2,-0.2 -3,-0.3 -129,-0.0 -0.198 72.9-133.5 -46.0 89.1 119.3 44.5 32.8 161 161 A K - 0 0 78 -2,-0.9 2,-0.4 1,-0.1 -1,-0.1 -0.308 16.0-146.9 -58.3 119.9 123.0 44.0 32.8 162 162 A I - 0 0 20 -2,-0.2 2,-0.2 -133,-0.0 -1,-0.1 -0.733 9.0-147.2 -88.0 129.4 124.6 46.6 35.1 163 163 A L > - 0 0 110 -2,-0.4 3,-1.1 1,-0.1 2,-0.5 -0.586 29.1 -98.5 -90.3 159.0 128.1 47.8 34.0 164 164 A D T 3 S+ 0 0 112 1,-0.2 3,-0.1 -2,-0.2 41,-0.1 -0.673 109.9 36.1 -76.0 126.6 130.7 48.8 36.6 165 165 A G T 3 S+ 0 0 34 1,-0.5 -139,-3.0 -2,-0.5 -138,-0.5 0.363 91.4 100.8 115.0 -7.1 130.6 52.5 36.8 166 166 A D < - 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