==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/RNA 25-FEB-05 1YYW . COMPND 2 MOLECULE: 5'-R(*AP*AP*AP*UP*AP*UP*AP*UP*AP*UP*UP*U)-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.GAN,J.E.TROPEA,B.P.AUSTIN,D.L.COURT,D.S.WAUGH,X.JI . 875 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45268.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 630 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 7.5 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 . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 30 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 111 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 390 44.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.7 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 1 2 5 5 0 1 4 2 4 1 1 1 2 3 2 0 1 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 1 1 6 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 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 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 K 0 0 152 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-119.1 17.5 -11.1 38.7 2 3 A M >> + 0 0 85 1,-0.1 3,-1.1 2,-0.1 4,-0.5 0.495 360.0 78.4-100.4 -11.4 13.7 -11.0 38.3 3 4 A L H >> S+ 0 0 12 1,-0.3 4,-3.1 2,-0.2 3,-1.2 0.804 73.0 76.3 -67.6 -31.0 14.1 -9.1 35.0 4 5 A E H 3> S+ 0 0 125 1,-0.3 4,-0.8 2,-0.2 -1,-0.3 0.813 93.9 54.5 -50.2 -29.4 15.0 -12.3 33.2 5 6 A Q H <> S+ 0 0 109 -3,-1.1 4,-0.9 2,-0.2 -1,-0.3 0.839 109.2 45.4 -73.4 -35.0 11.2 -13.0 33.4 6 7 A L H XX S+ 0 0 0 -3,-1.2 4,-2.7 -4,-0.5 3,-0.7 0.914 109.6 54.6 -72.7 -44.1 10.4 -9.6 31.8 7 8 A E H 3X>S+ 0 0 10 -4,-3.1 4,-2.3 1,-0.3 5,-0.9 0.758 103.1 58.5 -59.9 -25.4 13.0 -10.1 29.1 8 9 A K H 3<5S+ 0 0 160 -4,-0.8 -1,-0.3 -5,-0.4 -2,-0.2 0.861 109.4 43.3 -72.3 -34.8 11.3 -13.4 28.4 9 10 A K H <<5S+ 0 0 80 -4,-0.9 -2,-0.2 -3,-0.7 -1,-0.1 0.936 116.5 45.2 -73.9 -50.0 8.1 -11.5 27.7 10 11 A L H <5S- 0 0 1 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.932 101.7-133.6 -58.7 -47.3 9.7 -8.7 25.7 11 12 A G T <5S+ 0 0 53 -4,-2.3 2,-0.4 1,-0.3 -3,-0.2 0.630 72.5 103.4 96.2 20.1 11.8 -11.3 23.7 12 13 A Y < - 0 0 27 -5,-0.9 2,-0.6 -6,-0.2 -1,-0.3 -0.994 57.4-153.5-139.1 129.5 14.9 -9.2 24.2 13 14 A T - 0 0 88 -2,-0.4 -9,-0.0 -3,-0.1 4,-0.0 -0.905 24.8-127.8-106.6 116.9 17.8 -9.7 26.6 14 15 A F - 0 0 5 -2,-0.6 3,-0.3 1,-0.1 101,-0.1 -0.197 10.4-155.4 -63.2 148.1 19.7 -6.5 27.6 15 16 A K S S+ 0 0 183 1,-0.3 2,-0.8 103,-0.0 -1,-0.1 0.836 100.1 42.7 -85.7 -40.5 23.4 -6.2 27.4 16 17 A D S >> S- 0 0 71 1,-0.1 3,-1.5 -3,-0.0 4,-0.7 -0.811 72.9-172.4-107.2 87.9 23.3 -3.5 30.1 17 18 A K H 3> S+ 0 0 90 -2,-0.8 4,-1.0 -3,-0.3 -1,-0.1 0.611 79.6 72.4 -56.8 -10.5 20.8 -5.0 32.6 18 19 A S H 3> S+ 0 0 75 2,-0.2 4,-2.7 1,-0.1 -1,-0.3 0.900 88.3 58.5 -72.5 -42.1 21.0 -1.7 34.4 19 20 A L H X> S+ 0 0 25 -3,-1.5 4,-2.5 2,-0.2 3,-0.6 0.965 102.3 51.4 -50.1 -63.2 19.0 0.1 31.7 20 21 A L H 3X S+ 0 0 0 -4,-0.7 4,-1.3 1,-0.3 -1,-0.2 0.863 115.1 45.6 -42.9 -42.4 15.9 -2.1 32.1 21 22 A E H 3X S+ 0 0 52 -4,-1.0 4,-0.7 2,-0.2 -1,-0.3 0.848 108.2 54.8 -72.3 -35.4 16.2 -1.4 35.8 22 23 A K H << S+ 0 0 70 -4,-2.7 -2,-0.2 -3,-0.6 3,-0.2 0.838 111.1 46.8 -66.3 -31.9 16.7 2.4 35.3 23 24 A A H < S+ 0 0 0 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.801 113.2 48.7 -78.0 -30.5 13.5 2.4 33.3 24 25 A L H < S+ 0 0 4 -4,-1.3 69,-2.8 -5,-0.3 2,-0.7 0.481 90.7 97.6 -88.1 -3.3 11.7 0.4 35.9 25 26 A T B < -a 93 0A 1 -4,-0.7 10,-2.2 -3,-0.2 2,-0.2 -0.784 63.1-152.1 -93.1 116.2 12.8 2.6 38.8 26 27 A H >> - 0 0 31 67,-1.7 4,-1.8 -2,-0.7 3,-0.6 -0.535 28.2-108.9 -83.7 151.8 10.3 5.2 39.9 27 28 A V G >4 S+ 0 0 49 1,-0.3 3,-0.5 2,-0.2 4,-0.3 0.896 119.1 53.0 -42.7 -56.7 11.5 8.5 41.5 28 29 A S G 34 S+ 0 0 44 1,-0.3 3,-0.3 2,-0.2 -1,-0.3 0.885 107.6 52.5 -49.5 -45.3 10.2 7.5 44.9 29 30 A Y G <4 S- 0 0 90 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.869 139.6 -13.2 -59.4 -40.5 12.2 4.2 44.7 30 31 A S X< - 0 0 16 -4,-1.8 3,-1.5 -3,-0.5 -1,-0.2 -0.401 54.1-177.2-170.1 86.2 15.3 6.1 43.9 31 32 A K T 3 S+ 0 0 143 -4,-0.3 3,-0.3 -3,-0.3 -3,-0.1 0.647 78.9 84.0 -62.1 -13.4 15.3 9.7 42.9 32 33 A K T 3 S- 0 0 185 1,-0.3 -1,-0.3 -5,-0.2 2,-0.2 0.924 118.1 -13.2 -52.5 -49.3 19.1 9.2 42.4 33 34 A E S < S+ 0 0 90 -3,-1.5 -1,-0.3 -7,-0.1 2,-0.2 -0.793 83.8 157.3-160.6 110.2 18.4 7.9 38.9 34 35 A H - 0 0 24 -3,-0.3 3,-0.5 -2,-0.2 2,-0.4 -0.538 57.2 -75.5-123.6-170.4 14.9 6.9 37.7 35 36 A Y S > S+ 0 0 11 -10,-2.2 4,-0.8 -12,-0.2 -12,-0.1 -0.002 90.0 109.6 -75.5 28.7 12.9 6.4 34.4 36 37 A E T 4 S+ 0 0 36 -2,-0.4 4,-0.5 2,-0.2 -1,-0.2 0.806 82.6 27.0 -85.0 -28.5 12.5 10.2 33.8 37 38 A T T > S+ 0 0 19 -3,-0.5 4,-1.3 2,-0.2 -1,-0.2 0.656 120.1 57.3-100.6 -24.5 14.6 11.2 30.8 38 39 A L H > S+ 0 0 6 -4,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.770 106.9 48.4 -76.2 -32.4 14.4 7.8 29.4 39 40 A E H X S+ 0 0 10 -4,-0.8 4,-1.9 2,-0.2 -1,-0.2 0.841 106.1 58.7 -76.3 -34.3 10.7 8.1 29.4 40 41 A F H > S+ 0 0 13 -4,-0.5 4,-1.0 2,-0.2 -2,-0.2 0.873 109.9 43.7 -61.4 -38.4 11.0 11.4 27.7 41 42 A L H >X S+ 0 0 0 -4,-1.3 4,-2.6 2,-0.2 3,-0.8 0.970 113.3 47.9 -71.7 -56.2 12.9 9.7 24.9 42 43 A G H 3X>S+ 0 0 0 -4,-2.1 4,-3.6 1,-0.3 5,-0.5 0.793 101.2 70.8 -55.1 -27.2 10.6 6.8 24.5 43 44 A D H 3X5S+ 0 0 59 -4,-1.9 4,-1.3 1,-0.2 -1,-0.3 0.959 109.0 31.1 -53.1 -54.5 7.8 9.4 24.6 44 45 A A H < S+ 0 0 0 -4,-4.2 3,-0.7 1,-0.2 4,-0.3 0.939 106.5 50.3 -56.1 -55.6 -1.4 4.1 12.2 55 56 A V H >< S+ 0 0 21 -4,-2.0 3,-0.6 1,-0.2 -1,-0.2 0.864 115.5 41.5 -54.1 -43.7 -0.7 5.9 8.8 56 57 A Q H 3< S+ 0 0 72 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.618 123.0 39.8 -83.3 -12.4 -0.0 2.7 6.9 57 58 A Y T << S+ 0 0 69 -4,-1.2 -1,-0.2 -3,-0.7 -2,-0.2 0.083 87.2 110.3-123.9 24.5 -2.9 0.8 8.5 58 59 A S < - 0 0 16 -3,-0.6 3,-0.1 -4,-0.3 8,-0.1 -0.830 62.5-140.6-102.3 137.3 -5.7 3.4 8.7 59 60 A P S S+ 0 0 67 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.919 98.2 34.9 -59.4 -42.2 -8.8 3.1 6.5 60 61 A N - 0 0 22 2,-0.1 158,-0.1 -3,-0.1 -3,-0.1 -0.965 67.2-165.4-116.6 121.4 -8.7 6.8 6.0 61 62 A K + 0 0 93 -2,-0.5 2,-0.4 156,-0.3 -1,-0.1 -0.051 48.1 126.7 -95.3 33.0 -5.4 8.5 5.8 62 63 A R >> - 0 0 55 1,-0.1 4,-2.9 194,-0.0 3,-1.3 -0.740 66.9-128.2 -93.4 138.8 -6.9 12.0 6.2 63 64 A E H 3> S+ 0 0 68 -2,-0.4 4,-2.4 1,-0.3 -1,-0.1 0.857 109.1 58.4 -50.8 -41.2 -5.5 14.3 9.0 64 65 A G H 34 S+ 0 0 23 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.833 115.5 34.9 -60.3 -33.0 -9.0 14.8 10.3 65 66 A F H <> S+ 0 0 34 -3,-1.3 4,-1.1 2,-0.1 -2,-0.2 0.825 118.0 49.4 -90.2 -38.0 -9.5 11.1 10.8 66 67 A L H X S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 5,-0.4 0.923 100.7 65.8 -68.2 -44.3 -6.0 10.2 11.9 67 68 A S H X S+ 0 0 51 -4,-2.4 4,-0.9 -5,-0.3 -1,-0.2 0.887 104.1 42.9 -44.4 -54.8 -5.7 12.9 14.4 68 69 A P H > S+ 0 0 67 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.864 116.1 47.9 -64.5 -36.8 -8.4 11.5 16.8 69 70 A L H >X S+ 0 0 28 -4,-1.1 4,-2.7 -3,-0.2 3,-0.9 0.952 111.3 48.8 -67.7 -50.0 -7.2 7.9 16.5 70 71 A K H 3< S+ 0 0 47 -4,-3.0 4,-0.3 1,-0.3 -1,-0.2 0.702 103.1 67.6 -62.6 -18.0 -3.5 8.8 17.1 71 72 A A H 3< S+ 0 0 57 -4,-0.9 -1,-0.3 -5,-0.4 3,-0.2 0.898 110.9 29.6 -68.9 -42.4 -4.9 10.8 20.1 72 73 A Y H X< S+ 0 0 47 -4,-1.0 3,-2.6 -3,-0.9 6,-0.3 0.876 108.1 69.4 -84.1 -42.4 -6.0 7.6 21.9 73 74 A L T 3< S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.579 111.7 35.6 -54.0 -9.2 -3.4 5.3 20.5 74 75 A I T 3 S+ 0 0 44 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.2 0.273 88.7 127.1-127.4 7.6 -0.8 7.2 22.6 75 76 A S S X> S- 0 0 23 -3,-2.6 4,-1.3 1,-0.1 3,-1.1 -0.308 73.0-114.2 -67.4 151.4 -2.9 8.1 25.7 76 77 A E T 34 S+ 0 0 57 1,-0.3 29,-0.3 2,-0.2 28,-0.1 0.319 117.4 54.1 -69.0 11.2 -1.6 7.2 29.1 77 78 A E T 3> S+ 0 0 86 -5,-0.2 4,-0.8 2,-0.1 -1,-0.3 0.603 100.5 54.3-115.5 -24.8 -4.4 4.7 29.4 78 79 A F H <> S+ 0 0 0 -3,-1.1 4,-1.2 -6,-0.3 -2,-0.2 0.751 102.3 61.1 -79.9 -25.4 -3.9 2.8 26.2 79 80 A F H X S+ 0 0 5 -4,-1.3 4,-4.0 2,-0.2 5,-0.3 0.889 99.5 53.3 -67.5 -39.9 -0.3 2.1 27.3 80 81 A N H > S+ 0 0 10 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.883 105.3 56.2 -61.3 -36.2 -1.6 0.3 30.4 81 82 A L H < S+ 0 0 60 -4,-0.8 -1,-0.3 2,-0.2 -2,-0.2 0.854 117.2 35.2 -61.6 -35.6 -3.6 -1.9 28.0 82 83 A L H >< S+ 0 0 0 -4,-1.2 3,-1.7 -3,-0.2 -2,-0.2 0.954 118.8 47.8 -80.9 -59.6 -0.3 -2.7 26.2 83 84 A A H ><>S+ 0 0 0 -4,-4.0 3,-2.0 1,-0.3 5,-1.6 0.802 101.6 63.7 -53.0 -38.6 2.1 -2.8 29.2 84 85 A Q G ><5S+ 0 0 114 -4,-2.5 3,-1.6 -5,-0.3 -1,-0.3 0.763 87.2 72.4 -62.1 -22.3 -0.2 -5.0 31.3 85 86 A K G < 5S+ 0 0 123 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.430 107.4 37.0 -71.7 4.7 0.2 -7.7 28.7 86 87 A L G < 5S- 0 0 12 -3,-2.0 -1,-0.3 -4,-0.0 -2,-0.2 0.195 111.8-118.1-135.8 7.5 3.7 -7.9 30.2 87 88 A E T X>5 + 0 0 74 -3,-1.6 3,-1.2 1,-0.1 4,-1.1 0.837 48.9 168.3 53.1 35.0 2.8 -7.4 33.8 88 89 A L H 3>< + 0 0 2 -5,-1.6 4,-1.8 1,-0.3 -1,-0.1 0.696 68.4 67.7 -50.8 -17.4 5.0 -4.3 33.7 89 90 A H H 34 S+ 0 0 65 2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.927 97.7 45.3 -71.1 -47.3 3.3 -3.5 37.0 90 91 A K H <4 S+ 0 0 90 -3,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.701 115.7 50.6 -70.5 -18.9 4.9 -6.4 39.0 91 92 A F H < S+ 0 0 16 -4,-1.1 -2,-0.2 -5,-0.1 -1,-0.2 0.851 90.6 83.9 -88.7 -38.0 8.3 -5.5 37.5 92 93 A I < - 0 0 22 -4,-1.8 2,-0.4 -67,-0.1 -67,-0.2 -0.251 69.7-145.0 -62.9 157.0 8.5 -1.8 38.1 93 94 A R B +a 25 0A 47 -69,-2.8 -67,-1.7 -72,-0.2 2,-0.3 -0.930 23.7 167.0-135.5 112.2 9.8 -0.8 41.5 94 95 A I - 0 0 45 -2,-0.4 3,-0.1 1,-0.2 -67,-0.1 -0.915 22.0-152.7-120.5 147.5 8.6 2.2 43.5 95 96 A K S S+ 0 0 148 -2,-0.3 2,-0.6 1,-0.3 -1,-0.2 0.960 79.2 28.2 -81.7 -78.0 9.2 3.0 47.2 96 97 A R S S+ 0 0 216 2,-0.0 2,-0.3 0, 0.0 -1,-0.3 -0.789 114.6 12.2 -93.6 117.7 6.4 5.1 48.6 97 98 A G S S- 0 0 65 -2,-0.6 2,-0.3 -3,-0.1 -3,-0.1 -0.856 80.8 -80.4 125.0-160.2 3.0 4.6 47.0 98 99 A K - 0 0 178 -2,-0.3 2,-0.7 0, 0.0 -3,-0.1 -0.962 54.6 -69.8-146.2 160.0 1.4 2.2 44.5 99 100 A I - 0 0 85 -2,-0.3 -10,-0.0 -5,-0.1 -2,-0.0 -0.328 55.1-152.9 -56.2 100.1 1.3 1.6 40.8 100 101 A N > - 0 0 76 -2,-0.7 4,-0.8 1,-0.1 3,-0.2 -0.302 20.9-113.8 -71.8 160.9 -0.7 4.6 39.5 101 102 A E T >4 S+ 0 0 108 1,-0.2 3,-0.7 2,-0.2 4,-0.4 0.964 114.2 35.5 -60.3 -57.1 -2.7 4.3 36.2 102 103 A T T 3> S+ 0 0 61 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.478 105.5 72.0 -79.3 -2.6 -0.6 6.8 34.1 103 104 A I H 3> S+ 0 0 32 -3,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.768 89.1 60.1 -82.1 -26.6 2.7 5.8 35.8 104 105 A I H S+ 0 0 0 -4,-0.4 4,-1.9 -29,-0.3 -1,-0.2 0.804 106.2 51.9 -80.2 -30.7 2.6 4.6 30.8 106 107 A D H X S+ 0 0 31 -4,-0.9 4,-0.9 2,-0.2 -2,-0.2 0.801 114.2 43.1 -75.2 -29.9 5.6 6.7 31.8 107 108 A V H X S+ 0 0 1 -4,-1.6 4,-1.1 2,-0.2 -2,-0.2 0.763 110.0 59.0 -83.3 -27.7 7.7 3.7 32.6 108 109 A F H X S+ 0 0 0 -4,-1.0 4,-1.3 2,-0.2 3,-0.4 0.930 104.5 48.9 -64.2 -47.8 6.4 2.1 29.4 109 110 A E H X S+ 0 0 8 -4,-1.9 4,-0.9 1,-0.3 -1,-0.2 0.877 114.7 46.3 -58.5 -39.5 7.8 5.0 27.3 110 111 A A H X S+ 0 0 0 -4,-0.9 4,-0.9 1,-0.2 -1,-0.3 0.662 101.3 68.9 -77.9 -18.1 11.0 4.5 29.1 111 112 A L H X S+ 0 0 0 -4,-1.1 4,-1.4 -3,-0.4 -1,-0.2 0.881 107.0 35.9 -68.7 -39.9 10.9 0.7 28.6 112 113 A W H X S+ 0 0 0 -4,-1.3 4,-3.5 2,-0.2 -1,-0.2 0.710 108.1 63.1 -86.8 -21.7 11.5 1.0 24.9 113 114 A A H X S+ 0 0 0 -4,-0.9 4,-2.0 -5,-0.2 -1,-0.2 0.795 107.3 49.5 -68.8 -25.0 13.8 3.9 25.1 114 115 A A H X S+ 0 0 0 -4,-0.9 4,-2.8 2,-0.2 5,-0.4 0.933 112.0 44.2 -76.0 -50.4 15.8 1.3 27.0 115 116 A V H X S+ 0 0 0 -4,-1.4 4,-3.2 2,-0.2 6,-0.2 0.973 114.2 52.1 -57.3 -54.1 15.4 -1.4 24.3 116 117 A Y H <>S+ 0 0 0 -4,-3.5 5,-1.8 2,-0.2 6,-0.8 0.940 115.8 38.4 -45.6 -64.7 16.2 1.2 21.7 117 118 A I H ><5S+ 0 0 43 -4,-2.0 3,-2.9 1,-0.2 4,-0.5 0.942 118.3 46.7 -54.6 -56.5 19.4 2.4 23.3 118 119 A D H 3<5S+ 0 0 14 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.852 104.4 64.2 -56.1 -33.8 20.7 -1.0 24.5 119 120 A S T 3<5S- 0 0 26 -4,-3.2 -1,-0.3 -5,-0.4 -2,-0.2 0.537 130.5-100.6 -66.5 -4.2 19.8 -2.2 21.0 120 121 A G T < 5 - 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0 0 21 -5,-1.1 2,-0.6 -6,-0.2 -1,-0.4 -0.993 62.9-144.2-140.6 144.4 19.1 11.3 -1.5 233 14 B T - 0 0 98 -2,-0.3 -9,-0.0 -3,-0.1 -5,-0.0 -0.900 24.1-133.3-115.6 105.0 17.8 10.2 -4.9 234 15 B F - 0 0 3 -2,-0.6 3,-0.2 1,-0.1 101,-0.1 -0.107 11.4-161.3 -53.5 146.4 14.2 9.1 -4.9 235 16 B K S S+ 0 0 35 1,-0.3 2,-0.6 544,-0.1 333,-0.2 0.661 89.2 49.1 -99.4 -26.7 13.3 5.9 -6.7 236 17 B D S > S- 0 0 10 1,-0.2 4,-1.1 545,-0.0 3,-0.4 -0.912 70.3-174.2-116.4 100.2 9.6 6.9 -6.8 237 18 B K H >> S+ 0 0 49 -2,-0.6 4,-2.2 1,-0.2 3,-0.5 0.936 78.4 60.8 -61.4 -53.8 9.3 10.5 -8.1 238 19 B S H 3> S+ 0 0 15 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.842 102.2 59.3 -43.8 -36.1 5.6 11.1 -7.7 239 20 B L H 3> S+ 0 0 20 -3,-0.4 4,-1.8 2,-0.2 -1,-0.3 0.963 105.3 44.9 -58.2 -56.3 6.3 10.4 -4.0 240 21 B L H X S+ 0 0 45 -4,-2.2 4,-4.0 1,-0.2 3,-0.6 0.897 104.5 59.1 -61.9 -41.0 6.5 15.6 -5.6 242 23 B K H 3< S+ 0 0 30 -4,-2.7 13,-0.2 -5,-0.3 -1,-0.2 0.934 104.2 48.3 -53.7 -51.8 3.5 14.7 -3.3 243 24 B A H 3< S+ 0 0 0 -4,-1.8 88,-0.3 1,-0.2 -1,-0.3 0.757 119.1 42.7 -61.5 -23.8 5.3 15.9 -0.2 244 25 B L H << S+ 0 0 4 -4,-1.0 69,-1.6 -3,-0.6 -2,-0.2 0.866 98.3 82.1 -88.2 -44.5 6.1 19.1 -2.1 245 26 B T B < S-d 313 0C 1 -4,-4.0 10,-1.3 67,-0.2 2,-0.2 -0.437 71.2-143.4 -69.2 132.9 2.8 19.7 -3.8 246 27 B H >> - 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0 0 25 -5,-1.2 2,-0.6 -6,-0.2 -1,-0.2 -0.951 56.8-157.7-141.6 118.0 14.7 10.7 -23.7 453 14 C T - 0 0 93 -2,-0.4 -9,-0.1 -3,-0.1 4,-0.0 -0.855 23.3-128.4-100.4 119.4 17.4 10.9 -26.4 454 15 C F - 0 0 7 -2,-0.6 3,-0.2 1,-0.1 101,-0.1 -0.121 10.1-156.1 -62.2 158.0 19.1 7.7 -27.2 455 16 C K S S+ 0 0 170 1,-0.3 2,-1.2 2,-0.0 -1,-0.1 0.836 92.6 44.2 -96.4 -57.1 22.9 7.2 -27.3 456 17 C D S >> S- 0 0 78 1,-0.2 3,-2.2 102,-0.0 4,-0.7 -0.741 71.0-172.8 -91.6 90.1 23.0 4.3 -29.6 457 18 C K H 3> S+ 0 0 74 -2,-1.2 4,-1.8 1,-0.3 -1,-0.2 0.776 76.4 78.3 -54.2 -27.5 20.6 5.4 -32.3 458 19 C S H 3> S+ 0 0 62 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.810 91.8 53.2 -52.4 -32.6 20.9 2.0 -33.8 459 20 C L H <> S+ 0 0 32 -3,-2.2 4,-1.5 2,-0.2 5,-0.2 0.994 104.4 48.6 -68.2 -64.5 18.6 0.7 -31.1 460 21 C L H < S+ 0 0 0 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.804 117.3 47.9 -46.9 -30.2 15.6 3.1 -31.5 461 22 C E H >X S+ 0 0 62 -4,-1.8 3,-3.8 2,-0.2 4,-1.4 0.974 107.3 51.0 -74.1 -58.1 15.9 2.2 -35.2 462 23 C K H 3< S+ 0 0 28 -4,-2.8 16,-0.2 1,-0.3 -2,-0.2 0.617 110.9 54.5 -54.6 -11.0 16.2 -1.6 -34.8 463 24 C A T 3< S+ 0 0 0 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.428 109.7 44.7-102.4 -3.2 13.0 -1.1 -32.7 464 25 C L T <4 S+ 0 0 4 -3,-3.8 69,-3.4 -5,-0.2 2,-0.3 0.489 92.3 95.0-116.3 -9.1 11.2 0.7 -35.4 465 26 C T B < -g 533 0E 0 -4,-1.4 10,-1.2 67,-0.2 2,-0.3 -0.680 64.0-142.2 -90.1 137.7 12.0 -1.5 -38.4 466 27 C H >> - 0 0 34 67,-2.3 4,-2.0 -2,-0.3 3,-0.8 -0.683 28.9-109.7 -95.2 150.0 9.6 -4.3 -39.5 467 28 C V T 34 S+ 0 0 62 -2,-0.3 -1,-0.1 1,-0.3 6,-0.1 0.776 122.4 55.9 -48.3 -27.7 10.9 -7.7 -40.7 468 29 C S T 34 S+ 0 0 27 1,-0.2 -1,-0.3 3,-0.1 3,-0.2 0.914 103.1 51.7 -72.0 -44.3 9.7 -6.5 -44.1 469 30 C Y T <4 S+ 0 0 93 -3,-0.8 2,-0.3 64,-0.4 -2,-0.2 0.895 132.8 3.4 -58.9 -40.7 11.7 -3.4 -44.1 470 31 C S >< - 0 0 37 -4,-2.0 3,-0.6 63,-0.1 -1,-0.3 -0.989 55.5-154.0-149.9 138.3 14.8 -5.5 -43.2 471 32 C K T 3 S+ 0 0 184 -2,-0.3 3,-0.1 1,-0.2 -4,-0.1 0.685 101.1 36.9 -84.3 -20.4 15.4 -9.2 -42.9 472 33 C K T 3 S+ 0 0 187 1,-0.2 -1,-0.2 -5,-0.0 2,-0.1 -0.204 117.1 49.3-124.7 41.8 18.3 -8.8 -40.5 473 34 C E S < S+ 0 0 85 -3,-0.6 2,-0.2 -6,-0.1 -1,-0.2 -0.373 71.3 108.7-179.8 91.3 17.2 -5.8 -38.5 474 35 C H S S- 0 0 33 -3,-0.1 3,-0.4 -5,-0.1 4,-0.3 -0.805 71.6 -89.6-150.9-168.3 13.8 -5.5 -36.8 475 36 C Y S > S+ 0 0 15 -10,-1.2 4,-2.1 -2,-0.2 5,-0.3 0.170 79.7 115.7-101.2 18.2 12.0 -5.5 -33.5 476 37 C E T 4 S+ 0 0 50 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.823 90.1 31.2 -55.2 -32.1 11.2 -9.2 -33.3 477 38 C T T >> S+ 0 0 13 -3,-0.4 4,-1.5 2,-0.1 3,-0.9 0.864 115.1 56.8 -93.6 -43.6 13.4 -9.4 -30.2 478 39 C L H 3> S+ 0 0 4 -4,-0.3 4,-2.1 1,-0.3 5,-0.2 0.889 101.9 54.2 -57.8 -45.9 13.0 -6.0 -28.6 479 40 C E H 3X S+ 0 0 30 -4,-2.1 4,-1.2 1,-0.2 -1,-0.3 0.747 105.4 59.5 -62.6 -20.0 9.2 -6.2 -28.3 480 41 C F H X> S+ 0 0 14 -3,-0.9 4,-1.1 -5,-0.3 3,-0.5 0.971 109.4 37.6 -70.8 -56.1 9.8 -9.5 -26.4 481 42 C L H 3X S+ 0 0 1 -4,-1.5 4,-1.6 1,-0.2 -2,-0.2 0.778 116.7 56.9 -65.3 -25.2 12.0 -8.0 -23.7 482 43 C G H 3X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.3 5,-0.4 0.785 93.8 66.9 -76.2 -27.7 9.6 -5.0 -23.8 483 44 C D H - 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