==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RECOMBINATION/DNA 28-JUN-03 1PVP . COMPND 2 MOLECULE: 34-MER; . SOURCE 2 SYNTHETIC: YES; . AUTHOR E.P.BALDWIN,S.S.MARTIN,J.ABEL,K.A.GELATO,H.KIM,P.G.SCHULTZ, . 641 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35178.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 435 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 4.2 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 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 . 18 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 282 44.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.3 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 3 3 0 0 0 2 2 3 4 1 6 0 0 0 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 3 1 0 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 . 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 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 19 A T > 0 0 108 0, 0.0 4,-3.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 37.2 33.4 48.8 105.4 2 20 A S H > + 0 0 94 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.832 360.0 47.0 -59.5 -37.4 33.5 46.8 108.6 3 21 A D H > S+ 0 0 133 2,-0.2 4,-2.5 3,-0.2 -1,-0.2 0.877 112.8 50.5 -73.1 -36.5 33.3 43.5 106.7 4 22 A E H > S+ 0 0 126 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.965 113.6 45.0 -61.4 -53.6 36.0 44.7 104.3 5 23 A V H X S+ 0 0 19 -4,-3.3 4,-2.6 2,-0.2 5,-0.2 0.869 110.5 54.0 -59.9 -39.8 38.2 45.7 107.3 6 24 A R H X S+ 0 0 152 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.962 110.2 47.1 -60.1 -49.5 37.5 42.4 109.0 7 25 A K H X S+ 0 0 87 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.908 110.6 54.6 -56.1 -45.0 38.6 40.5 105.9 8 26 A N H X S+ 0 0 30 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.932 108.5 45.3 -56.6 -50.8 41.7 42.8 105.8 9 27 A L H X S+ 0 0 63 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.784 110.2 54.9 -67.2 -26.5 42.9 42.1 109.3 10 28 A M H X S+ 0 0 92 -4,-1.7 4,-2.9 -5,-0.2 -1,-0.2 0.862 107.8 50.4 -70.9 -35.6 42.3 38.3 108.8 11 29 A D H X S+ 0 0 6 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.950 110.0 50.9 -61.0 -50.7 44.6 38.7 105.8 12 30 A M H < S+ 0 0 17 -4,-2.5 6,-0.2 71,-0.3 -2,-0.2 0.873 114.8 42.2 -55.0 -42.3 47.1 40.4 108.1 13 31 A F H >< S+ 0 0 130 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.887 111.1 54.5 -75.9 -37.9 46.9 37.6 110.6 14 32 A R H 3< S+ 0 0 73 -4,-2.9 3,-0.2 1,-0.3 2,-0.2 0.907 120.5 30.5 -61.0 -47.0 46.9 34.8 108.1 15 33 A D T >< S+ 0 0 0 -4,-2.3 3,-1.0 -5,-0.2 -1,-0.3 -0.425 77.6 134.7-109.9 53.1 50.2 36.0 106.4 16 34 A R G X + 0 0 106 -3,-1.0 3,-1.7 1,-0.3 -1,-0.2 0.733 60.1 73.3 -76.7 -21.8 51.8 37.6 109.4 17 35 A Q G 3 S+ 0 0 115 1,-0.3 -1,-0.3 -3,-0.2 4,-0.1 0.303 72.6 91.5 -70.4 10.1 55.1 36.0 108.7 18 36 A A G < S+ 0 0 0 -3,-1.0 2,-0.3 -6,-0.2 -1,-0.3 0.625 91.4 43.2 -77.1 -14.9 55.1 38.6 105.9 19 37 A F S < S- 0 0 32 -3,-1.7 2,-0.1 -4,-0.0 402,-0.0 -0.909 95.8 -98.6-130.8 156.4 56.9 40.8 108.5 20 38 A S >> - 0 0 41 -2,-0.3 4,-1.9 1,-0.1 3,-0.8 -0.374 34.1-115.3 -71.7 150.4 59.7 40.3 111.0 21 39 A E H 3> S+ 0 0 137 1,-0.3 4,-2.7 2,-0.2 5,-0.1 0.868 117.8 56.4 -54.2 -35.7 58.8 39.7 114.7 22 40 A H H 3> S+ 0 0 129 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.832 103.7 53.2 -64.9 -35.6 60.5 43.0 115.5 23 41 A T H <> S+ 0 0 49 -3,-0.8 4,-2.7 2,-0.2 -1,-0.2 0.944 110.0 46.4 -64.3 -47.8 58.2 44.8 113.1 24 42 A W H X S+ 0 0 43 -4,-1.9 4,-3.1 1,-0.2 5,-0.3 0.912 109.9 56.0 -59.7 -43.5 55.1 43.3 114.7 25 43 A K H X S+ 0 0 103 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.949 110.5 43.2 -54.5 -51.4 56.5 44.2 118.2 26 44 A M H X S+ 0 0 79 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.912 112.8 53.0 -64.3 -39.2 56.9 47.8 117.2 27 45 A L H X S+ 0 0 5 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.980 112.6 44.3 -54.7 -58.4 53.4 47.8 115.6 28 46 A L H X S+ 0 0 73 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.890 113.0 53.0 -51.9 -46.4 51.9 46.4 118.8 29 47 A S H X S+ 0 0 47 -4,-2.8 4,-1.7 -5,-0.3 -1,-0.2 0.921 110.1 45.7 -58.9 -47.1 53.9 48.9 120.8 30 48 A V H X S+ 0 0 1 -4,-2.9 4,-3.4 1,-0.2 5,-0.2 0.898 112.3 51.6 -63.8 -40.9 52.7 52.0 118.8 31 49 A C H X S+ 0 0 19 -4,-2.4 4,-3.2 2,-0.2 5,-0.3 0.891 107.9 51.7 -64.3 -41.6 49.1 50.8 118.9 32 50 A R H X S+ 0 0 162 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.906 114.9 43.3 -61.9 -41.6 49.2 50.3 122.7 33 51 A S H X S+ 0 0 36 -4,-1.7 4,-1.7 -5,-0.2 -2,-0.2 0.940 116.8 44.7 -69.8 -49.3 50.6 53.8 123.1 34 52 A W H X S+ 0 0 0 -4,-3.4 4,-2.0 2,-0.2 -2,-0.2 0.915 116.1 48.3 -59.9 -44.9 48.2 55.4 120.6 35 53 A A H X S+ 0 0 28 -4,-3.2 4,-2.6 1,-0.2 -2,-0.2 0.914 109.6 51.1 -63.4 -46.0 45.3 53.5 122.1 36 54 A A H X S+ 0 0 62 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.833 112.5 47.6 -61.8 -32.9 46.1 54.4 125.6 37 55 A W H X S+ 0 0 17 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.818 109.8 51.4 -77.0 -34.3 46.3 58.1 124.6 38 56 A C H <>S+ 0 0 2 -4,-2.0 5,-2.0 2,-0.2 -2,-0.2 0.898 110.8 50.0 -69.2 -39.2 43.0 58.0 122.7 39 57 A K H ><5S+ 0 0 173 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.973 113.0 44.7 -61.4 -54.3 41.4 56.5 125.8 40 58 A L H 3<5S+ 0 0 131 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.820 121.3 40.9 -59.6 -30.4 42.9 59.2 128.0 41 59 A N T 3<5S- 0 0 47 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.188 112.3-115.9-106.0 19.3 41.8 61.8 125.5 42 60 A N T < 5 + 0 0 145 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.954 66.7 135.6 46.3 71.2 38.4 60.4 124.6 43 61 A R < - 0 0 78 -5,-2.0 2,-0.5 -8,-0.2 -1,-0.2 -0.964 61.2-108.0-141.6 156.3 39.2 59.6 121.0 44 62 A K - 0 0 133 -2,-0.3 5,-0.5 1,-0.1 8,-0.1 -0.763 23.5-160.3 -86.4 127.0 38.5 56.6 118.7 45 63 A W + 0 0 91 -2,-0.5 -1,-0.1 1,-0.2 3,-0.1 0.707 65.3 76.9 -79.6 -19.0 41.7 54.8 118.1 46 64 A F S S+ 0 0 43 1,-0.3 -1,-0.2 2,-0.1 2,-0.2 -0.937 100.7 17.8-149.1 122.0 40.5 52.9 114.9 47 65 A P S S- 0 0 72 0, 0.0 2,-0.4 0, 0.0 -1,-0.3 0.629 99.7-132.2 -70.8 165.3 40.2 54.2 112.4 48 66 A A - 0 0 10 39,-0.2 -3,-0.1 -2,-0.2 -2,-0.1 -0.723 13.3-136.2 -88.8 131.2 42.4 57.1 113.3 49 67 A E >> - 0 0 82 -5,-0.5 4,-2.6 -2,-0.4 3,-1.6 -0.735 15.3-125.3 -90.3 130.3 41.2 60.6 112.6 50 68 A P H 3> S+ 0 0 48 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.844 111.2 49.5 -32.6 -59.9 43.6 63.1 111.1 51 69 A E H 3> S+ 0 0 95 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.828 113.3 45.9 -56.8 -34.2 43.0 65.6 113.8 52 70 A D H <> S+ 0 0 23 -3,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.914 112.1 49.8 -75.0 -44.7 43.5 63.0 116.6 53 71 A V H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.892 110.7 52.6 -60.1 -38.6 46.6 61.6 115.0 54 72 A R H X S+ 0 0 66 -4,-2.6 4,-1.9 -5,-0.4 -1,-0.2 0.933 107.5 49.1 -63.6 -46.8 47.9 65.2 114.7 55 73 A D H X S+ 0 0 53 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.877 112.2 51.8 -57.9 -40.5 47.3 66.0 118.4 56 74 A Y H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.940 104.7 53.2 -60.8 -54.4 49.1 62.7 119.2 57 75 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.872 111.8 47.2 -51.7 -38.9 52.2 63.5 117.1 58 76 A L H X S+ 0 0 31 -4,-1.9 4,-3.3 2,-0.2 5,-0.3 0.910 109.7 52.5 -71.2 -38.5 52.4 66.8 119.0 59 77 A Y H X S+ 0 0 93 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.869 108.1 53.0 -62.6 -35.1 51.9 65.0 122.3 60 78 A L H <>S+ 0 0 0 -4,-2.8 5,-1.9 2,-0.2 3,-0.3 0.939 111.3 45.1 -65.0 -45.6 54.8 62.7 121.2 61 79 A Q H ><5S+ 0 0 34 -4,-2.1 3,-2.9 1,-0.2 -2,-0.2 0.937 110.5 52.2 -64.3 -47.9 57.0 65.8 120.6 62 80 A A H 3<5S+ 0 0 86 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.712 99.3 64.6 -61.8 -18.2 56.0 67.4 123.9 63 81 A R T 3<5S- 0 0 136 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.2 0.501 120.4-119.6 -78.5 -2.8 57.0 64.1 125.4 64 82 A G T < 5 + 0 0 64 -3,-2.9 -3,-0.2 1,-0.2 -2,-0.2 0.767 59.1 158.0 71.9 25.2 60.4 65.3 124.1 65 83 A L < - 0 0 31 -5,-1.9 -1,-0.2 1,-0.1 2,-0.1 -0.351 45.0 -97.9 -76.1 163.2 60.6 62.2 121.8 66 84 A A >> - 0 0 42 1,-0.1 4,-2.0 -2,-0.1 3,-1.1 -0.461 25.4-114.6 -83.1 157.1 62.9 62.3 118.8 67 85 A V H 3> S+ 0 0 4 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.917 117.3 54.5 -51.1 -51.1 61.7 63.0 115.2 68 86 A K H 3> S+ 0 0 92 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.740 107.9 51.6 -57.1 -26.3 62.7 59.5 114.1 69 87 A T H <> S+ 0 0 58 -3,-1.1 4,-1.8 2,-0.2 -1,-0.2 0.901 107.8 49.4 -77.8 -43.9 60.5 58.1 116.9 70 88 A I H X S+ 0 0 1 -4,-2.0 4,-2.4 1,-0.2 5,-0.3 0.912 109.3 54.7 -62.4 -37.2 57.5 60.1 116.0 71 89 A Q H X S+ 0 0 60 -4,-2.7 4,-4.0 1,-0.2 5,-0.2 0.953 103.6 54.4 -59.2 -50.6 58.0 58.9 112.4 72 90 A Q H X S+ 0 0 76 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.884 110.2 48.1 -53.5 -37.7 58.0 55.3 113.7 73 91 A H H >X S+ 0 0 19 -4,-1.8 4,-2.5 2,-0.2 3,-0.8 1.000 115.2 41.1 -65.0 -65.8 54.6 56.0 115.3 74 92 A L H 3X S+ 0 0 8 -4,-2.4 4,-2.9 1,-0.3 5,-0.3 0.936 115.1 55.8 -43.0 -54.1 53.0 57.6 112.2 75 93 A G H 3X S+ 0 0 33 -4,-4.0 4,-1.8 -5,-0.3 -1,-0.3 0.871 109.2 44.0 -47.2 -47.5 54.7 54.9 110.2 76 94 A Q H <>S+ 0 0 0 -4,-2.0 5,-2.0 1,-0.2 3,-1.1 0.843 115.1 52.3 -64.0 -38.4 45.3 51.6 108.1 82 100 A R H ><5S+ 0 0 122 -4,-2.5 3,-0.8 1,-0.2 -1,-0.2 0.902 112.3 48.6 -66.3 -35.7 47.0 50.7 104.8 83 101 A R T 3<5S+ 0 0 36 -4,-3.0 -71,-0.3 1,-0.2 -1,-0.2 0.357 114.0 44.3 -89.4 10.7 46.7 47.1 105.8 84 102 A S T < 5S- 0 0 0 -3,-1.1 -1,-0.2 2,-0.2 -2,-0.2 0.150 117.8-103.7-133.8 16.9 43.1 47.3 106.8 85 103 A G T < 5S+ 0 0 54 -3,-0.8 -3,-0.2 1,-0.3 -4,-0.1 0.503 79.6 127.4 75.9 5.7 41.8 49.3 103.8 86 104 A L < - 0 0 20 -5,-2.0 -1,-0.3 -6,-0.2 -2,-0.2 -0.643 69.5 -88.5 -96.3 155.3 41.5 52.6 105.6 87 105 A P - 0 0 102 0, 0.0 -39,-0.2 0, 0.0 -1,-0.1 -0.218 46.6-113.6 -54.9 144.8 43.0 55.9 104.6 88 106 A R > - 0 0 60 1,-0.1 3,-0.6 -7,-0.1 -10,-0.1 -0.634 12.5-131.9 -84.0 142.0 46.6 56.5 105.9 89 107 A P G > S+ 0 0 5 0, 0.0 3,-1.3 0, 0.0 6,-0.3 0.824 106.0 64.1 -59.8 -34.3 47.0 59.3 108.3 90 108 A S G 3 S+ 0 0 27 1,-0.3 6,-0.1 -16,-0.2 5,-0.1 0.908 89.5 65.0 -57.6 -44.0 50.0 60.5 106.3 91 109 A D G < S+ 0 0 116 -3,-0.6 2,-0.5 4,-0.1 -1,-0.3 0.276 84.7 98.6 -69.6 20.3 47.7 61.2 103.3 92 110 A S S X> S- 0 0 22 -3,-1.3 4,-2.2 1,-0.1 3,-1.0 -0.916 74.8-136.9-111.6 130.6 46.0 63.9 105.3 93 111 A N H 3> S+ 0 0 126 -2,-0.5 4,-1.8 1,-0.3 5,-0.1 0.743 103.4 53.4 -54.8 -29.6 47.1 67.6 105.0 94 112 A A H 3> S+ 0 0 23 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.764 113.0 41.4 -79.3 -27.8 47.0 68.2 108.7 95 113 A V H <> S+ 0 0 1 -3,-1.0 4,-1.5 -6,-0.3 -2,-0.2 0.729 114.6 51.7 -90.6 -24.0 49.4 65.3 109.5 96 114 A S H X S+ 0 0 65 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.948 114.2 44.0 -74.0 -46.3 51.6 66.0 106.6 97 115 A L H X S+ 0 0 100 -4,-1.8 4,-2.7 -5,-0.2 -2,-0.2 0.923 114.5 47.9 -63.3 -48.8 51.9 69.7 107.7 98 116 A V H X S+ 0 0 3 -4,-1.4 4,-3.0 2,-0.2 5,-0.3 0.859 110.1 50.8 -65.3 -36.3 52.4 68.9 111.4 99 117 A M H X S+ 0 0 29 -4,-1.5 4,-3.2 2,-0.2 5,-0.2 0.981 112.4 48.6 -63.9 -51.4 55.1 66.2 110.8 100 118 A R H X S+ 0 0 195 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.932 114.4 45.8 -49.0 -53.9 57.0 68.7 108.6 101 119 A R H X S+ 0 0 111 -4,-2.7 4,-3.4 1,-0.2 -1,-0.2 0.941 113.4 46.9 -58.0 -52.2 56.6 71.4 111.2 102 120 A I H X S+ 0 0 2 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.895 111.0 54.4 -59.3 -39.4 57.7 69.2 114.1 103 121 A R H X S+ 0 0 100 -4,-3.2 4,-2.4 -5,-0.3 3,-0.3 0.990 113.4 40.7 -56.6 -60.8 60.6 67.9 112.1 104 122 A K H X S+ 0 0 137 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.915 114.3 53.2 -54.0 -47.9 61.8 71.5 111.4 105 123 A E H < S+ 0 0 79 -4,-3.4 -1,-0.2 -5,-0.2 -2,-0.2 0.881 112.0 44.8 -56.0 -42.2 61.1 72.6 114.9 106 124 A N H ><>S+ 0 0 24 -4,-2.6 5,-1.2 -3,-0.3 3,-1.1 0.902 108.4 53.3 -72.2 -42.3 63.1 69.8 116.5 107 125 A V H ><5S+ 0 0 80 -4,-2.4 3,-0.6 1,-0.3 -1,-0.2 0.748 106.8 59.1 -62.5 -23.1 66.2 70.0 114.2 108 126 A D T 3<5S+ 0 0 122 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.1 -0.219 100.6 51.6 -99.4 38.1 66.2 73.7 115.2 109 127 A A T < 5S- 0 0 89 -3,-1.1 -1,-0.2 -2,-0.0 -2,-0.2 0.095 132.7 -85.6-150.3 3.6 66.5 73.0 119.0 110 128 A G T < 5 - 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0 0 37 -5,-1.2 -1,-0.3 -6,-0.3 3,-0.2 -0.291 24.2-175.3 -58.1 140.0 78.0 47.7 104.7 298 316 A T + 0 0 102 1,-0.2 2,-0.5 -3,-0.1 -1,-0.1 0.759 68.8 47.1-109.5 -35.5 76.5 48.1 101.3 299 317 A N S > S- 0 0 119 1,-0.1 2,-0.8 -7,-0.1 3,-0.7 -0.626 74.6-149.7-119.1 78.7 75.4 51.8 101.0 300 318 A V T 3> S+ 0 0 42 -2,-0.5 4,-2.0 1,-0.3 5,-0.3 0.287 73.3 95.6 -10.1 -35.3 78.3 54.1 102.2 301 319 A N H 3> S+ 0 0 137 -2,-0.8 4,-0.6 1,-0.2 -1,-0.3 0.702 91.8 48.3 -46.8 -17.4 76.4 57.1 103.6 302 320 A I H <> S+ 0 0 77 -3,-0.7 4,-1.3 2,-0.2 3,-0.4 0.898 103.6 53.3 -90.3 -50.2 76.7 55.4 107.0 303 321 A V H >> S+ 0 0 0 1,-0.3 4,-1.8 2,-0.2 3,-1.3 0.945 109.5 54.0 -50.6 -46.3 80.4 54.5 107.1 304 322 A M H 3X S+ 0 0 74 -4,-2.0 4,-0.6 1,-0.3 -1,-0.3 0.863 99.7 58.7 -56.0 -40.4 81.0 58.2 106.3 305 323 A N H 3< S+ 0 0 71 -4,-0.6 3,-0.3 -3,-0.4 -1,-0.3 0.817 108.2 50.4 -60.8 -25.4 78.9 59.2 109.2 306 324 A Y H << S+ 0 0 27 -3,-1.3 3,-0.4 -4,-1.3 -2,-0.2 0.905 113.3 40.1 -79.4 -44.7 81.4 57.2 111.3 307 325 A I H >< S+ 0 0 1 -4,-1.8 3,-1.1 1,-0.2 6,-0.4 0.263 86.7 106.4 -90.1 15.8 84.7 58.7 109.9 308 326 A R T 3< S+ 0 0 162 -4,-0.6 -1,-0.2 -3,-0.3 -2,-0.1 0.708 71.5 52.4 -69.8 -25.8 83.4 62.3 109.8 309 327 A N T 3 S+ 0 0 115 -3,-0.4 -1,-0.2 -4,-0.2 2,-0.2 0.300 90.2 110.9 -92.3 10.5 85.2 63.9 112.8 310 328 A L S < S- 0 0 7 -3,-1.1 3,-0.3 1,-0.1 4,-0.1 -0.552 73.5-131.4 -85.8 148.3 88.5 62.6 111.4 311 329 A D S > S+ 0 0 135 1,-0.2 3,-1.3 -2,-0.2 4,-0.1 0.810 105.3 64.6 -69.9 -27.4 91.2 64.9 109.9 312 330 A S T 3 S+ 0 0 72 1,-0.3 3,-0.4 2,-0.1 -1,-0.2 0.913 105.3 45.9 -59.8 -41.0 91.5 62.6 106.8 313 331 A E T 3 S+ 0 0 81 -6,-0.4 -1,-0.3 -3,-0.3 -2,-0.2 0.324 75.8 121.9 -87.0 8.9 88.0 63.6 105.9 314 332 A T S < S- 0 0 78 -3,-1.3 4,-0.2 1,-0.1 -1,-0.2 0.640 70.8-111.9 -46.4 -29.6 88.3 67.3 106.5 315 333 A G >> - 0 0 36 -3,-0.4 4,-1.5 -4,-0.1 3,-0.8 0.045 22.5 -81.7 107.0 146.8 87.3 68.4 103.0 316 334 A A H 3> S+ 0 0 51 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.771 120.8 62.5 -51.5 -33.5 88.8 70.1 99.9 317 335 A M H 3> S+ 0 0 135 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.900 103.2 45.7 -65.2 -43.3 88.3 73.5 101.4 318 336 A V H <> S+ 0 0 52 -3,-0.8 4,-1.3 -4,-0.2 -1,-0.2 0.843 112.2 54.0 -68.6 -32.1 90.7 72.9 104.3 319 337 A R H >< S+ 0 0 167 -4,-1.5 3,-1.0 2,-0.2 -2,-0.2 0.991 111.2 44.4 -62.7 -58.4 93.1 71.4 101.9 320 338 A L H >< S+ 0 0 107 -4,-2.9 3,-2.5 1,-0.3 -2,-0.2 0.934 111.2 53.1 -49.3 -56.6 93.0 74.5 99.7 321 339 A L H 3< S+ 0 0 136 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.746 109.7 49.1 -53.2 -28.7 93.3 76.9 102.7 322 340 A E T << 0 0 152 -4,-1.3 -1,-0.3 -3,-1.0 -2,-0.2 0.261 360.0 360.0 -97.3 14.7 96.4 75.1 103.9 323 341 A D < 0 0 181 -3,-2.5 -3,-0.1 -4,-0.2 -2,-0.1 0.410 360.0 360.0 1.2 360.0 98.0 75.2 100.4 324 !* 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 0.0 325 19 B T >> 0 0 121 0, 0.0 4,-1.8 0, 0.0 3,-0.7 0.000 360.0 360.0 360.0 152.3 33.3 47.1 81.7 326 20 B S H 3> + 0 0 97 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.785 360.0 65.3 -57.1 -21.4 34.2 43.7 80.2 327 21 B D H 3> S+ 0 0 98 2,-0.2 4,-1.7 3,-0.1 -1,-0.3 0.925 99.2 44.1 -71.8 -43.1 34.0 45.7 77.1 328 22 B E H X> S+ 0 0 117 -3,-0.7 4,-3.7 1,-0.2 3,-1.1 0.996 113.6 53.8 -62.5 -51.5 36.9 48.0 77.8 329 23 B V H 3X S+ 0 0 19 -4,-1.8 4,-2.0 1,-0.3 5,-0.3 0.815 104.9 52.0 -46.4 -42.0 38.9 44.9 79.0 330 24 B R H 3X S+ 0 0 149 -4,-1.9 4,-1.4 -5,-0.2 -1,-0.3 0.908 118.8 40.1 -63.3 -36.2 38.2 43.1 75.7 331 25 B K H < S+ 0 0 117 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.802 105.3 61.4 -61.7 -30.7 48.0 42.4 71.3 338 32 B R H 3< S+ 0 0 168 -4,-1.9 3,-0.3 1,-0.3 -1,-0.2 0.934 116.2 29.7 -62.6 -45.9 47.7 44.9 68.4 339 33 B D T >< S+ 0 0 102 -4,-1.2 3,-1.9 -3,-0.2 -1,-0.3 -0.407 74.9 143.3-109.8 51.7 51.0 46.6 69.4 340 34 B R G X + 0 0 100 -3,-1.1 3,-2.3 1,-0.3 -1,-0.2 0.826 63.9 74.6 -53.9 -37.8 52.6 43.5 71.0 341 35 B Q G 3 S+ 0 0 163 1,-0.3 -1,-0.3 -3,-0.3 4,-0.1 0.482 71.8 78.3 -57.7 -8.7 55.8 44.9 69.4 342 36 B A G < S+ 0 0 80 -3,-1.9 2,-0.3 -6,-0.2 -1,-0.3 0.689 96.5 59.1 -74.8 -15.0 56.0 47.6 72.1 343 37 B F S < S- 0 0 44 -3,-2.3 5,-0.1 -4,-0.2 0, 0.0 -0.858 98.6 -91.2-117.9 154.4 57.4 44.8 74.3 344 38 B S >> - 0 0 47 -2,-0.3 3,-1.4 1,-0.2 4,-1.4 -0.190 34.0-124.3 -53.5 145.4 60.3 42.4 74.2 345 39 B E H 3> S+ 0 0 127 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.819 116.5 58.6 -59.9 -31.8 59.5 39.1 72.5 346 40 B H H 3> S+ 0 0 69 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.663 97.0 59.5 -74.0 -16.7 60.6 37.6 75.8 347 41 B T H <> S+ 0 0 44 -3,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.909 109.1 43.8 -77.0 -40.3 58.0 39.6 77.6 348 42 B W H X S+ 0 0 35 -4,-1.4 4,-3.0 2,-0.2 5,-0.4 0.901 109.4 56.2 -68.0 -42.4 55.3 37.9 75.5 349 43 B K H X S+ 0 0 111 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.907 114.0 40.4 -56.4 -43.6 56.9 34.5 75.9 350 44 B M H X S+ 0 0 56 -4,-1.4 4,-3.1 2,-0.2 5,-0.2 0.891 112.0 54.5 -74.9 -40.1 56.8 34.9 79.7 351 45 B L H X S+ 0 0 3 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.969 116.6 39.0 -55.9 -52.2 53.3 36.4 79.8 352 46 B L H X S+ 0 0 79 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.870 113.9 54.8 -68.0 -35.0 52.0 33.5 77.8 353 47 B S H X S+ 0 0 43 -4,-1.8 4,-2.1 -5,-0.4 -1,-0.2 0.928 113.7 42.6 -64.1 -39.1 54.1 31.0 79.7 354 48 B V H X S+ 0 0 0 -4,-3.1 4,-3.0 2,-0.2 5,-0.2 0.975 111.7 51.2 -69.5 -54.5 52.6 32.4 82.9 355 49 B C H X S+ 0 0 17 -4,-3.1 4,-3.2 1,-0.2 5,-0.3 0.867 110.7 52.7 -51.3 -36.2 49.0 32.5 81.8 356 50 B R H X S+ 0 0 173 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.977 111.2 44.1 -61.3 -56.9 49.5 28.9 80.6 357 51 B S H X S+ 0 0 34 -4,-2.1 4,-1.0 2,-0.2 -2,-0.2 0.847 118.9 44.3 -55.3 -41.7 50.8 27.8 84.0 358 52 B W H >X S+ 0 0 0 -4,-3.0 4,-2.5 2,-0.2 3,-0.8 0.961 111.8 49.9 -70.2 -54.3 48.0 29.8 85.8 359 53 B A H 3X S+ 0 0 34 -4,-3.2 4,-2.7 1,-0.3 -2,-0.2 0.795 110.3 53.4 -56.8 -28.5 45.1 28.8 83.5 360 54 B A H 3X S+ 0 0 61 -4,-2.0 4,-1.6 -5,-0.3 -1,-0.3 0.831 109.5 46.8 -76.7 -32.6 46.2 25.2 84.0 361 55 B W H X>S+ 0 0 1 -4,-2.5 5,-2.0 2,-0.2 3,-0.8 0.961 108.8 50.9 -71.6 -50.9 42.8 27.2 87.5 363 57 B K H ><5S+ 0 0 183 -4,-2.7 3,-0.9 1,-0.2 -2,-0.2 0.908 110.9 51.5 -52.6 -41.2 41.3 24.5 85.2 364 58 B L H 3<5S+ 0 0 140 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.773 116.7 36.7 -68.7 -28.6 42.5 21.9 87.7 365 59 B N H <<5S- 0 0 77 -4,-1.1 -1,-0.2 -3,-0.8 -2,-0.2 0.211 113.8-109.8-108.9 11.9 40.9 23.5 90.8 366 60 B N T <<5 + 0 0 150 -3,-0.9 2,-0.3 -4,-0.6 -3,-0.2 0.973 69.4 144.7 56.0 60.6 37.8 24.7 89.0 367 61 B R < - 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0 0 35 -5,-3.1 2,-0.4 -6,-0.2 -1,-0.2 -0.221 41.4 -99.0 -60.5 154.2 88.8 51.2 87.7 611 305 B S >> - 0 0 48 1,-0.1 4,-3.0 4,-0.0 3,-1.9 -0.647 22.6-127.7 -81.2 127.4 86.4 54.0 88.8 612 306 B I H 3> S+ 0 0 69 -2,-0.4 4,-1.8 1,-0.3 -1,-0.1 0.802 114.8 55.2 -40.8 -35.9 82.8 52.8 89.4 613 307 B P H 3> S+ 0 0 81 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.924 113.6 41.2 -64.4 -42.5 81.7 55.5 87.0 614 308 B E H <> S+ 0 0 114 -3,-1.9 4,-1.6 2,-0.2 -2,-0.3 0.903 111.1 53.6 -70.4 -46.4 84.1 53.9 84.5 615 309 B I H X S+ 0 0 8 -4,-3.0 4,-1.6 1,-0.2 6,-0.2 0.841 110.5 53.1 -56.3 -29.9 83.1 50.4 85.4 616 310 B M H <>S+ 0 0 39 -4,-1.8 5,-0.6 -5,-0.5 -2,-0.2 0.889 104.2 49.8 -73.3 -44.1 79.6 51.7 84.8 617 311 B Q H ><5S+ 0 0 165 -4,-1.7 3,-0.6 1,-0.2 -1,-0.2 0.775 108.2 60.2 -66.1 -22.0 80.2 53.0 81.3 618 312 B A H 3<5S+ 0 0 16 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.981 112.5 32.1 -66.7 -59.4 81.8 49.6 80.6 619 313 B G T 3<5S- 0 0 2 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 -0.019 107.7-119.7 -90.0 27.3 78.7 47.5 81.3 620 314 B G T < 5 + 0 0 39 -3,-0.6 -3,-0.2 1,-0.1 -4,-0.1 0.467 60.5 155.3 49.3 3.4 76.3 50.3 80.1 621 315 B W < - 0 0 25 -5,-0.6 -1,-0.1 -6,-0.2 -2,-0.0 -0.197 32.6-165.5 -57.9 150.1 74.7 50.3 83.5 622 316 B T S S+ 0 0 110 -3,-0.1 -1,-0.1 -5,-0.0 -2,-0.1 0.623 74.3 41.0-112.7 -20.0 73.0 53.6 84.6 623 317 B N S S- 0 0 107 -7,-0.1 -7,-0.0 0, 0.0 -2,-0.0 0.093 84.6-122.1 -97.7-140.7 72.6 53.0 88.4 624 318 B V S S+ 0 0 56 -2,-0.1 4,-0.2 3,-0.0 -12,-0.0 0.002 77.9 93.1-160.0 35.3 75.4 51.4 90.5 625 319 B N S > S+ 0 0 100 2,-0.1 4,-0.6 3,-0.1 -4,-0.0 0.839 79.8 44.1-108.4 -38.3 73.8 48.3 92.1 626 320 B I H >> S+ 0 0 73 1,-0.2 3,-1.9 2,-0.2 4,-1.8 0.971 108.3 63.0 -70.2 -49.9 74.4 45.1 90.2 627 321 B V H 34 S+ 0 0 6 1,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.868 99.2 62.0 -34.3 -46.8 78.0 46.2 89.7 628 322 B M H 34 S+ 0 0 73 1,-0.2 3,-0.3 -4,-0.2 -1,-0.3 0.749 105.5 35.7 -57.8 -37.0 78.0 45.9 93.5 629 323 B N H X< S+ 0 0 29 -3,-1.9 3,-1.4 -4,-0.6 -1,-0.2 0.704 95.1 84.0 -92.2 -20.4 77.3 42.2 94.1 630 324 B Y T 3< S+ 0 0 30 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.721 107.1 25.7 -53.3 -19.2 79.2 40.9 91.1 631 325 B I T 3 0 0 50 -4,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.089 360.0 360.0-138.5 30.5 82.3 41.1 93.3 632 326 B R < 0 0 119 -3,-1.4 -3,-0.1 -445,-0.1 -441,-0.0 0.374 360.0 360.0 -60.9 360.0 81.6 40.9 97.0 633 ! 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 0.0 634 332 B T 0 0 122 0, 0.0 -344,-0.0 0, 0.0 -340,-0.0 0.000 360.0 360.0 360.0 -57.2 91.6 41.7 102.0 635 333 B G > + 0 0 37 -441,-0.0 4,-1.7 3,-0.0 5,-0.2 0.689 360.0 147.3 81.3 20.7 93.1 41.2 105.4 636 334 B A H > S+ 0 0 3 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.860 71.1 43.7 -55.3 -42.2 92.9 44.9 106.3 637 335 B M H > S+ 0 0 10 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.914 109.5 52.0 -74.6 -43.4 92.3 44.2 110.0 638 336 B V H > S+ 0 0 18 1,-0.2 4,-2.0 2,-0.2 -441,-0.2 0.830 112.6 51.1 -61.6 -27.6 94.9 41.5 110.6 639 337 B R H < S+ 0 0 134 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.922 109.3 47.7 -74.1 -44.8 97.3 43.9 109.0 640 338 B L H >< S+ 0 0 43 -4,-1.8 3,-0.6 1,-0.2 -2,-0.2 0.873 117.0 44.5 -63.8 -37.1 96.3 46.8 111.3 641 339 B L H 3< S+ 0 0 16 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.861 103.8 60.1 -76.1 -39.7 96.6 44.6 114.3 642 340 B E T 3< 0 0 66 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.361 360.0 360.0 -72.3 5.4 99.9 42.8 113.5 643 341 B D < 0 0 173 -3,-0.6 -1,-0.1 -4,-0.1 -3,-0.1 0.241 360.0 360.0 67.8 360.0 101.4 46.3 113.5