==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 28-DEC-04 1YEQ . COMPND 2 MOLECULE: HEMOGLOBIN ALPHA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.S.KAVANAUGH,P.H.ROGERS,A.ARNONE . 574 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26198.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 470 81.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 15 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 18.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 334 58.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.4 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 2 0 2 0 0 2 0 2 0 0 4 5 0 4 2 5 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 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 . 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 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 V 0 0 133 0, 0.0 2,-0.6 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-179.2 5.9 22.3 -1.6 2 2 A L - 0 0 25 71,-0.1 122,-0.0 125,-0.1 3,-0.0 -0.800 360.0-162.8 -89.6 117.3 4.8 25.0 0.9 3 3 A S > - 0 0 44 -2,-0.6 4,-2.2 1,-0.1 5,-0.2 -0.417 36.2 -98.8 -89.9 171.8 4.1 23.5 4.3 4 4 A P H > S+ 0 0 105 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.928 126.1 48.4 -55.5 -47.6 2.1 25.3 7.1 5 5 A A H > S+ 0 0 57 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.940 106.6 56.2 -60.8 -46.5 5.3 26.4 8.7 6 6 A D H > S+ 0 0 13 1,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.940 109.7 46.8 -46.4 -53.3 6.6 27.7 5.5 7 7 A K H X S+ 0 0 64 -4,-2.2 4,-2.5 1,-0.3 -1,-0.3 0.832 110.9 50.6 -60.6 -39.3 3.5 29.8 5.1 8 8 A T H X S+ 0 0 96 -4,-2.1 4,-2.0 2,-0.2 -1,-0.3 0.914 111.2 49.8 -66.0 -39.9 3.8 31.1 8.7 9 9 A N H X S+ 0 0 40 -4,-3.2 4,-1.9 2,-0.2 5,-0.2 0.936 111.3 48.4 -65.5 -45.5 7.4 32.0 8.1 10 10 A V H X S+ 0 0 3 -4,-2.8 4,-2.8 -5,-0.2 5,-0.4 0.975 110.1 50.4 -58.3 -56.3 6.6 33.9 4.9 11 11 A K H X S+ 0 0 112 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.854 111.4 49.5 -50.7 -43.3 3.7 35.9 6.4 12 12 A A H X S+ 0 0 62 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.897 113.5 42.8 -66.9 -43.2 5.8 37.0 9.4 13 13 A A H X S+ 0 0 6 -4,-1.9 4,-1.4 -3,-0.3 -2,-0.2 0.871 115.1 49.6 -74.6 -33.3 8.8 38.2 7.4 14 14 A W H X S+ 0 0 23 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.832 108.0 55.4 -72.7 -28.8 6.7 39.9 4.8 15 15 A G H < S+ 0 0 55 -4,-1.7 -2,-0.2 -5,-0.4 -1,-0.2 0.902 105.3 52.0 -65.8 -39.3 4.8 41.6 7.6 16 16 A K H < S+ 0 0 106 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.824 106.7 54.2 -66.7 -31.2 8.1 42.9 8.9 17 17 A V H >< S+ 0 0 3 -4,-1.4 3,-1.6 1,-0.2 2,-0.3 0.998 81.1 137.4 -63.9 -63.3 8.8 44.3 5.5 18 18 A G G >< S+ 0 0 42 -4,-2.1 3,-1.0 1,-0.3 4,-0.2 -0.378 71.7 7.2 65.0-119.2 5.6 46.2 5.3 19 19 A A G > S+ 0 0 101 -2,-0.3 3,-0.5 1,-0.2 4,-0.3 0.645 123.0 65.9 -76.2 -15.3 5.7 49.7 4.0 20 20 A H G <> S+ 0 0 93 -3,-1.6 4,-2.4 1,-0.2 3,-0.4 0.578 70.9 102.3 -81.5 -9.1 9.4 49.4 2.9 21 21 A A H <> S+ 0 0 7 -3,-1.0 4,-3.7 1,-0.2 5,-0.2 0.846 76.1 55.9 -38.5 -52.1 8.4 46.8 0.3 22 22 A G H <> S+ 0 0 21 -3,-0.5 4,-3.3 2,-0.2 -1,-0.2 0.946 108.5 44.6 -49.2 -57.8 8.6 49.3 -2.4 23 23 A E H > S+ 0 0 91 -3,-0.4 4,-3.7 -4,-0.3 5,-0.3 0.924 114.5 51.2 -57.7 -42.0 12.2 50.2 -1.6 24 24 A Y H X S+ 0 0 13 -4,-2.4 4,-3.4 2,-0.2 -2,-0.2 0.961 110.9 47.3 -58.0 -52.1 13.0 46.5 -1.3 25 25 A G H X S+ 0 0 1 -4,-3.7 4,-2.2 -5,-0.2 -2,-0.2 0.963 115.4 46.5 -52.9 -52.4 11.5 45.8 -4.6 26 26 A A H X S+ 0 0 7 -4,-3.3 4,-2.1 -5,-0.2 5,-0.2 0.968 114.2 46.2 -54.4 -59.2 13.4 48.7 -6.1 27 27 A E H X S+ 0 0 41 -4,-3.7 4,-3.1 1,-0.2 5,-0.2 0.910 108.7 56.9 -50.7 -49.5 16.7 47.8 -4.5 28 28 A A H X S+ 0 0 2 -4,-3.4 4,-2.4 -5,-0.3 -1,-0.2 0.940 107.5 47.1 -48.1 -56.6 16.3 44.1 -5.5 29 29 A L H X S+ 0 0 5 -4,-2.2 4,-3.4 1,-0.2 -1,-0.2 0.917 113.7 48.1 -52.9 -47.0 15.9 45.0 -9.2 30 30 A E H X S+ 0 0 44 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.859 108.3 54.6 -62.9 -36.1 19.0 47.3 -9.0 31 31 A R H X S+ 0 0 2 -4,-3.1 4,-2.3 -5,-0.2 -1,-0.2 0.898 114.7 42.3 -61.6 -40.3 20.9 44.5 -7.2 32 32 A M H X S+ 0 0 11 -4,-2.4 4,-3.0 -5,-0.2 -2,-0.2 0.992 108.2 55.2 -67.3 -66.3 20.0 42.4 -10.2 33 33 A F H < S+ 0 0 14 -4,-3.4 7,-0.2 1,-0.2 -2,-0.2 0.795 117.4 40.5 -38.5 -38.8 20.6 44.8 -13.0 34 34 A L H < S+ 0 0 74 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.960 118.7 40.5 -77.9 -53.8 24.1 45.2 -11.6 35 35 A S H < S+ 0 0 13 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.2 0.699 127.9 29.9 -73.9 -19.6 25.1 41.7 -10.6 36 36 A F >< - 0 0 34 -4,-3.0 3,-1.3 -5,-0.1 -1,-0.3 -0.697 67.4-179.2-141.4 84.5 23.6 40.0 -13.7 37 37 A P G > S+ 0 0 46 0, 0.0 3,-2.5 0, 0.0 4,-0.4 0.774 72.7 73.2 -57.6 -34.6 23.6 42.4 -16.7 38 38 A T G > S+ 0 0 41 1,-0.3 3,-2.4 2,-0.2 4,-0.3 0.881 84.6 69.9 -51.8 -36.7 22.0 40.1 -19.2 39 39 A T G X S+ 0 0 2 -3,-1.3 3,-1.5 1,-0.3 -1,-0.3 0.757 82.9 73.1 -52.9 -23.7 18.7 40.7 -17.4 40 40 A K G X S+ 0 0 62 -3,-2.5 3,-2.9 1,-0.3 -1,-0.3 0.761 76.0 79.0 -62.2 -26.5 18.8 44.3 -18.7 41 41 A T G < S+ 0 0 13 -3,-2.4 -1,-0.3 -4,-0.4 -2,-0.2 0.774 87.7 56.9 -56.8 -25.2 17.9 43.0 -22.2 42 42 A Y G < S+ 0 0 35 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.553 110.0 47.7 -82.7 -4.7 14.3 42.7 -21.0 43 43 A F X + 0 0 32 -3,-2.9 3,-1.4 -4,-0.2 -1,-0.2 -0.313 59.7 139.0-130.6 50.8 14.3 46.4 -20.2 44 44 A P T 3 S+ 0 0 72 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.731 77.3 53.7 -71.1 -20.6 15.8 48.3 -23.1 45 45 A H T 3 S+ 0 0 129 -3,-0.1 2,-0.3 2,-0.1 -2,-0.0 0.318 91.1 101.3 -91.7 4.6 13.3 51.2 -22.7 46 46 A F S < S- 0 0 39 -3,-1.4 2,-1.1 -6,-0.2 -3,-0.1 -0.695 76.5-126.4 -95.7 142.2 14.1 51.7 -19.1 47 47 A D - 0 0 82 -2,-0.3 8,-0.5 1,-0.1 7,-0.2 -0.761 31.6-175.1 -81.1 104.5 16.2 54.4 -17.6 48 48 A L + 0 0 64 -2,-1.1 -1,-0.1 -4,-0.1 3,-0.1 0.139 33.3 126.6 -93.4 22.3 18.5 52.2 -15.7 49 49 A S S > S- 0 0 65 1,-0.1 3,-2.2 2,-0.1 2,-0.2 -0.344 75.1 -81.2 -76.2 158.9 20.6 54.8 -13.9 50 50 A H T 3 S+ 0 0 157 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 -0.418 119.2 13.2 -62.2 124.9 21.0 54.8 -10.1 51 51 A G T 3 S+ 0 0 54 1,-0.2 -1,-0.3 -2,-0.2 -2,-0.1 0.429 89.8 171.2 90.6 0.2 18.0 56.4 -8.5 52 52 A S <> - 0 0 7 -3,-2.2 4,-2.0 1,-0.1 -1,-0.2 -0.128 38.1-134.8 -48.2 130.4 16.0 56.2 -11.7 53 53 A A H > S+ 0 0 88 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.851 104.4 54.0 -55.1 -39.5 12.3 57.0 -11.4 54 54 A Q H > S+ 0 0 83 -7,-0.2 4,-2.8 2,-0.2 5,-0.3 0.943 107.3 49.1 -64.4 -46.5 11.3 54.0 -13.6 55 55 A V H > S+ 0 0 15 -8,-0.5 4,-3.3 1,-0.2 -2,-0.2 0.947 110.9 50.3 -55.8 -52.5 13.2 51.5 -11.4 56 56 A K H X S+ 0 0 124 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.878 114.0 45.9 -51.5 -44.2 11.6 52.9 -8.2 57 57 A G H X S+ 0 0 38 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.909 113.6 46.0 -70.4 -45.5 8.2 52.6 -9.7 58 58 A H H X S+ 0 0 51 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.906 107.1 61.7 -62.8 -41.1 8.6 49.2 -11.2 59 59 A G H X S+ 0 0 0 -4,-3.3 4,-3.2 -5,-0.3 5,-0.2 0.933 105.2 46.1 -48.4 -51.6 10.1 48.2 -7.8 60 60 A K H X S+ 0 0 118 -4,-1.7 4,-3.8 1,-0.2 5,-0.3 0.943 110.5 52.8 -57.6 -49.4 6.8 49.0 -6.1 61 61 A K H X S+ 0 0 150 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.881 112.0 46.8 -55.2 -39.6 4.8 47.2 -8.8 62 62 A V H X S+ 0 0 27 -4,-2.9 4,-2.0 2,-0.2 3,-0.4 0.976 114.9 44.7 -67.8 -53.5 7.0 44.1 -8.2 63 63 A A H X S+ 0 0 2 -4,-3.2 4,-2.1 1,-0.2 -2,-0.2 0.878 110.3 55.5 -58.5 -38.2 6.7 44.3 -4.4 64 64 A D H X S+ 0 0 81 -4,-3.8 4,-1.9 -5,-0.2 -1,-0.2 0.886 106.6 51.8 -64.1 -33.8 3.0 44.9 -4.7 65 65 A A H X S+ 0 0 24 -4,-1.5 4,-1.3 -3,-0.4 -2,-0.2 0.941 108.8 48.5 -65.7 -47.6 2.6 41.7 -6.7 66 66 A L H X S+ 0 0 14 -4,-2.0 4,-1.8 1,-0.2 3,-0.2 0.891 109.3 54.5 -59.9 -40.1 4.5 39.6 -4.2 67 67 A T H X S+ 0 0 52 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.929 105.5 51.7 -59.8 -46.4 2.4 41.0 -1.4 68 68 A N H X S+ 0 0 74 -4,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.800 107.1 54.5 -62.0 -28.7 -0.8 40.0 -3.1 69 69 A A H < S+ 0 0 0 -4,-1.3 6,-0.3 -3,-0.2 -1,-0.2 0.863 106.1 50.6 -75.3 -35.4 0.5 36.5 -3.5 70 70 A V H >< S+ 0 0 12 -4,-1.8 3,-2.2 1,-0.2 -2,-0.2 0.969 105.2 57.4 -61.6 -50.0 1.2 36.2 0.2 71 71 A A H 3< S+ 0 0 62 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.845 120.0 30.3 -49.7 -35.3 -2.3 37.4 0.9 72 72 A H T >< S+ 0 0 91 -4,-1.1 3,-2.3 -5,-0.2 -1,-0.3 -0.321 74.0 147.6-117.7 48.4 -3.5 34.4 -1.3 73 73 A V G X S+ 0 0 14 -3,-2.2 3,-0.5 1,-0.3 -1,-0.1 0.718 71.0 58.7 -60.2 -18.0 -0.7 31.9 -0.6 74 74 A D G 3 S+ 0 0 122 1,-0.2 -1,-0.3 -4,-0.2 -4,-0.1 0.409 117.3 29.0 -89.7 3.0 -3.2 29.0 -0.9 75 75 A D G X> S+ 0 0 79 -3,-2.3 4,-2.5 -6,-0.3 3,-1.3 -0.071 70.7 142.7-153.5 40.0 -4.2 29.9 -4.5 76 76 A M H <> + 0 0 15 -3,-0.5 4,-3.2 1,-0.3 5,-0.2 0.825 69.0 61.4 -55.7 -38.9 -1.2 31.6 -6.0 77 77 A P H 34 S+ 0 0 83 0, 0.0 -1,-0.3 0, 0.0 7,-0.1 0.730 115.4 34.1 -62.3 -25.1 -1.7 30.1 -9.5 78 78 A N H X4 S+ 0 0 107 -3,-1.3 3,-0.5 2,-0.1 4,-0.3 0.748 116.4 54.7 -97.6 -32.2 -5.0 31.8 -9.8 79 79 A A H 3< S+ 0 0 30 -4,-2.5 3,-0.3 1,-0.2 -3,-0.2 0.942 115.6 38.0 -66.1 -43.0 -4.1 34.9 -7.9 80 80 A L T >X S+ 0 0 8 -4,-3.2 4,-2.3 1,-0.2 3,-0.5 0.334 81.4 122.3 -92.1 6.9 -1.1 35.6 -10.1 81 81 A S H <> S+ 0 0 52 -3,-0.5 4,-1.7 1,-0.2 3,-0.5 0.840 73.3 47.2 -27.1 -69.2 -2.9 34.5 -13.2 82 82 A A H 3> S+ 0 0 77 -3,-0.3 4,-2.5 -4,-0.3 -1,-0.2 0.855 109.9 50.2 -50.3 -49.9 -2.5 37.8 -15.0 83 83 A L H <> S+ 0 0 49 -3,-0.5 4,-3.0 1,-0.2 -1,-0.3 0.889 106.5 59.0 -59.4 -37.7 1.3 38.2 -14.3 84 84 A S H X S+ 0 0 3 -4,-2.3 4,-1.9 -3,-0.5 5,-0.2 0.974 107.9 42.9 -54.5 -59.8 1.7 34.7 -15.6 85 85 A D H >X>S+ 0 0 65 -4,-1.7 4,-2.8 1,-0.2 5,-0.9 0.947 113.6 53.3 -51.8 -54.0 0.3 35.5 -19.0 86 86 A L H 3X>S+ 0 0 69 -4,-2.5 5,-2.4 1,-0.2 4,-0.8 0.910 112.8 42.5 -47.6 -52.2 2.2 38.8 -19.2 87 87 A H H 3<5S+ 0 0 47 -4,-3.0 6,-1.9 1,-0.2 -1,-0.2 0.742 123.3 36.5 -72.8 -21.4 5.5 37.2 -18.5 88 88 A A H <<5S+ 0 0 6 -4,-1.9 -2,-0.2 -3,-0.6 -1,-0.2 0.652 126.4 26.9-108.0 -17.2 5.0 34.1 -20.8 89 89 A H H <5S+ 0 0 116 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.1 0.741 130.6 26.1-112.9 -39.8 3.1 35.4 -23.8 90 90 A K T < - 0 0 16 -2,-0.5 3,-1.9 1,-0.1 4,-0.4 -0.348 23.3-121.9 -61.6 131.5 13.4 33.0 -20.0 95 95 A P T >> S+ 0 0 43 0, 0.0 3,-1.0 0, 0.0 4,-0.9 0.683 103.1 72.1 -47.6 -31.0 13.1 31.1 -16.7 96 96 A V H 3> S+ 0 0 36 1,-0.3 4,-1.0 2,-0.2 3,-0.3 0.806 91.8 62.1 -57.5 -29.9 16.8 31.4 -15.6 97 97 A N H <> S+ 0 0 11 -3,-1.9 4,-2.1 1,-0.2 3,-0.3 0.851 94.0 59.3 -64.5 -36.0 16.1 35.0 -15.0 98 98 A F H <> S+ 0 0 21 -3,-1.0 4,-2.2 -4,-0.4 -1,-0.2 0.862 102.0 54.5 -62.9 -34.8 13.5 34.3 -12.3 99 99 A K H X S+ 0 0 148 -4,-0.9 4,-1.9 -3,-0.3 -1,-0.3 0.846 107.9 51.6 -64.5 -34.2 16.1 32.5 -10.3 100 100 A L H X S+ 0 0 38 -4,-1.0 4,-2.4 -3,-0.3 -2,-0.2 0.917 109.4 46.5 -72.1 -44.5 18.3 35.6 -10.5 101 101 A L H X S+ 0 0 37 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.940 111.4 52.7 -62.8 -43.7 15.6 38.0 -9.2 102 102 A S H X S+ 0 0 16 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.926 107.9 50.7 -58.8 -45.2 14.7 35.6 -6.4 103 103 A H H X S+ 0 0 15 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.960 111.2 50.3 -54.0 -50.4 18.4 35.5 -5.4 104 104 A C H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.828 107.2 51.4 -61.0 -35.6 18.4 39.3 -5.4 105 105 A L H X S+ 0 0 8 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.968 110.8 51.4 -63.1 -48.2 15.2 39.6 -3.3 106 106 A L H X S+ 0 0 3 -4,-2.7 4,-2.5 2,-0.2 3,-0.3 0.919 111.7 44.2 -52.0 -53.2 16.9 37.3 -0.8 107 107 A V H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.953 112.8 53.7 -57.3 -48.2 20.1 39.3 -0.6 108 108 A T H < S+ 0 0 0 -4,-2.5 4,-0.2 1,-0.2 -1,-0.2 0.780 113.1 42.2 -58.0 -31.4 18.1 42.5 -0.4 109 109 A L H >X S+ 0 0 5 -4,-1.9 4,-3.1 -3,-0.3 3,-1.4 0.884 108.6 55.9 -86.1 -41.0 16.1 41.3 2.6 110 110 A A H 3< S+ 0 0 0 -4,-2.5 151,-0.3 1,-0.3 -2,-0.2 0.720 105.7 56.3 -62.4 -20.8 19.0 39.7 4.5 111 111 A A T 3< S+ 0 0 8 -4,-1.4 -1,-0.3 -5,-0.2 151,-0.3 0.682 119.0 30.3 -82.7 -18.2 20.6 43.1 4.3 112 112 A H T <4 S+ 0 0 63 -3,-1.4 -2,-0.2 -4,-0.2 -3,-0.1 0.642 115.5 55.0-113.4 -20.7 17.5 44.7 5.9 113 113 A L >X + 0 0 8 -4,-3.1 4,-1.7 1,-0.2 3,-1.3 -0.421 56.3 161.9-113.6 60.4 16.1 42.0 8.3 114 114 A P T 34 S+ 0 0 82 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.800 75.7 40.1 -50.1 -40.8 19.0 40.9 10.5 115 115 A A T 34 S+ 0 0 85 1,-0.2 3,-0.1 3,-0.0 -2,-0.1 0.539 118.0 41.3 -94.2 -10.2 16.9 39.3 13.2 116 116 A E T <4 S+ 0 0 51 -3,-1.3 2,-1.7 1,-0.1 -1,-0.2 0.503 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4,-0.6 0.736 97.2 80.2 -51.2 -23.3 29.7 20.9 -9.8 243 101 B E H >> S+ 0 0 48 1,-0.3 3,-1.0 2,-0.2 4,-0.7 0.832 81.7 65.5 -54.0 -33.3 26.3 22.5 -10.0 244 102 B N H X> S+ 0 0 19 -3,-2.9 4,-2.1 1,-0.2 3,-0.7 0.797 85.5 69.9 -62.0 -30.4 26.4 22.5 -6.2 245 103 B F H <> S+ 0 0 24 -3,-1.8 4,-2.3 -4,-0.3 -1,-0.2 0.853 97.3 52.2 -56.6 -34.1 29.3 25.0 -6.1 246 104 B R H < S- 0 0 31 -4,-2.5 3,-2.0 -5,-0.3 4,-0.4 0.408 77.7-178.9-110.6 5.6 27.0 43.6 6.6 261 119 B G G >< S+ 0 0 13 -4,-1.1 3,-2.5 -151,-0.3 -1,-0.2 0.072 73.9 7.3 34.3-129.9 23.6 45.1 6.0 262 120 B K G 3 S+ 0 0 178 1,-0.3 -1,-0.3 -151,-0.3 3,-0.1 0.757 123.2 68.9 -50.1 -29.4 23.7 48.5 4.2 263 121 B E G < S+ 0 0 95 -3,-2.0 2,-1.8 1,-0.2 -1,-0.3 0.747 81.0 77.2 -65.9 -22.8 27.4 48.1 3.7 264 122 B F S < S- 0 0 0 -3,-2.5 -1,-0.2 -4,-0.4 5,-0.1 -0.396 77.1-178.7 -84.3 60.9 26.8 45.3 1.2 265 123 B T >> - 0 0 56 -2,-1.8 4,-1.9 1,-0.1 3,-1.2 -0.131 42.0-101.2 -62.8 156.9 25.8 47.7 -1.5 266 124 B P H 3> S+ 0 0 14 0, 0.0 4,-2.2 0, 0.0 3,-0.4 0.891 122.8 52.2 -41.7 -54.5 24.8 46.5 -5.0 267 125 B P H 3> S+ 0 0 73 0, 0.0 4,-1.1 0, 0.0 5,-0.1 0.807 108.9 51.2 -58.4 -30.0 28.2 47.4 -6.5 268 126 B V H <> S+ 0 0 23 -3,-1.2 4,-1.9 2,-0.2 5,-0.1 0.835 108.4 53.8 -74.8 -31.7 29.9 45.3 -3.8 269 127 B Q H X S+ 0 0 0 -4,-1.9 4,-3.4 -3,-0.4 5,-0.3 0.955 103.3 52.6 -66.0 -51.2 27.5 42.4 -4.6 270 128 B A H X S+ 0 0 12 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.869 107.9 54.2 -54.7 -37.5 28.3 42.2 -8.3 271 129 B A H >X S+ 0 0 0 -4,-1.1 4,-1.9 -5,-0.2 3,-1.0 0.990 113.0 41.1 -58.6 -57.9 32.0 42.0 -7.4 272 130 B Y H 3X S+ 0 0 0 -4,-1.9 4,-3.5 1,-0.3 5,-0.3 0.830 107.7 61.6 -59.7 -34.4 31.3 39.1 -5.1 273 131 B Q H 3X S+ 0 0 13 -4,-3.4 4,-1.4 1,-0.2 -1,-0.3 0.849 108.3 45.8 -58.2 -34.3 28.9 37.5 -7.6 274 132 B K H X S+ 0 0 4 -4,-2.5 4,-1.1 1,-0.2 3,-0.5 0.935 110.1 43.6 -42.2 -61.1 32.7 27.7 -8.8 281 139 B N H >X S+ 0 0 78 -4,-2.1 3,-1.7 1,-0.3 4,-1.4 0.944 112.3 53.2 -49.5 -54.0 34.1 27.4 -12.3 282 140 B A H 3< S+ 0 0 0 -4,-2.5 4,-0.4 1,-0.3 -1,-0.3 0.834 107.0 52.1 -53.8 -34.4 37.6 26.8 -11.0 283 141 B L H << S+ 0 0 25 -4,-2.9 -1,-0.3 -3,-0.5 -2,-0.2 0.728 112.5 46.0 -75.8 -17.0 36.3 24.0 -8.8 284 142 B A H X< S+ 0 0 26 -3,-1.7 3,-1.9 -4,-1.1 -2,-0.2 0.589 88.0 93.9 -96.1 -13.8 34.7 22.4 -11.8 285 143 B H T 3< S+ 0 0 83 -4,-1.4 -1,-0.1 1,-0.3 -2,-0.1 0.818 84.3 45.6 -49.1 -43.6 37.8 22.8 -14.0 286 144 B K T 3 S+ 0 0 87 -4,-0.4 -1,-0.3 -3,-0.2 2,-0.1 0.300 80.8 123.2 -92.0 12.2 39.3 19.4 -13.4 287 145 B Y < 0 0 25 -3,-1.9 40,-0.1 -52,-0.0 -55,-0.1 -0.462 360.0 360.0 -72.2 144.1 36.1 17.3 -13.9 288 146 B H 0 0 123 38,-0.2 -2,-0.0 -2,-0.1 37,-0.0 -0.983 360.0 360.0-156.7 360.0 36.4 14.6 -16.5 289 !* 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 0.0 290 1 C V 0 0 154 0, 0.0 2,-0.3 0, 0.0 126,-0.0 0.000 360.0 360.0 360.0 133.7 1.5 21.1 -21.0 291 2 C L - 0 0 30 71,-0.1 122,-0.0 126,-0.1 126,-0.0 -0.682 360.0-148.6 -89.0 135.7 0.9 18.5 -23.7 292 3 C S > - 0 0 38 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.533 30.0-107.7 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-33.0 303 14 C W H 3X S+ 0 0 25 -4,-2.2 4,-1.5 1,-0.3 -1,-0.2 0.810 107.5 61.9 -57.2 -29.2 8.1 6.1 -30.1 304 15 C G H 3< S+ 0 0 55 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.858 103.7 48.5 -64.0 -35.2 6.0 3.5 -32.0 305 16 C K H << S+ 0 0 124 -3,-1.5 -1,-0.2 -4,-1.4 -2,-0.2 0.868 99.5 64.9 -73.2 -36.2 8.7 3.5 -34.7 306 17 C V H >< S+ 0 0 1 -4,-1.7 3,-2.4 1,-0.2 -1,-0.2 0.932 78.0 150.8 -49.8 -45.2 11.5 3.1 -32.2 307 18 C G G >< S- 0 0 46 -4,-1.5 3,-0.8 1,-0.3 -1,-0.2 -0.268 70.9 -4.5 53.5-120.8 9.8 -0.2 -31.5 308 19 C A G 3 S+ 0 0 95 1,-0.2 -1,-0.3 -3,-0.2 4,-0.3 0.274 120.7 77.9 -90.3 11.4 12.4 -2.8 -30.4 309 20 C H G <> + 0 0 94 -3,-2.4 4,-1.9 -4,-0.1 -1,-0.2 0.319 66.9 107.5 -94.5 8.6 15.3 -0.4 -30.8 310 21 C A H X> S+ 0 0 10 -3,-0.8 4,-2.4 1,-0.2 3,-0.6 0.933 79.5 35.7 -49.7 -67.3 14.2 1.2 -27.5 311 22 C G H 3> S+ 0 0 15 1,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.861 113.6 58.4 -59.8 -40.5 16.9 0.0 -25.1 312 23 C E H 3> S+ 0 0 132 -4,-0.3 4,-1.7 1,-0.2 -1,-0.3 0.857 110.7 44.3 -57.5 -34.6 19.6 0.2 -27.8 313 24 C Y H < - 0 0 37 -4,-2.3 3,-2.4 -5,-0.2 -1,-0.3 -0.702 68.4-176.1-135.8 80.0 28.7 16.2 -20.3 326 37 C P G > S+ 0 0 45 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.664 73.3 74.8 -54.6 -21.6 31.2 14.6 -18.0 327 38 C T G > S+ 0 0 42 1,-0.3 3,-1.0 2,-0.2 4,-0.1 0.691 82.1 69.8 -70.3 -14.1 29.7 16.0 -14.9 328 39 C T G X S+ 0 0 3 -3,-2.4 3,-1.3 -7,-0.3 4,-0.3 0.675 80.2 76.1 -78.9 -9.7 26.9 13.6 -15.1 329 40 C K G X S+ 0 0 62 -3,-1.6 3,-1.3 1,-0.3 -1,-0.2 0.700 75.2 79.0 -67.4 -20.8 29.2 10.7 -14.2 330 41 C T G < S+ 0 0 10 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.1 0.682 89.5 54.9 -65.3 -14.3 29.2 11.8 -10.6 331 42 C Y G < S+ 0 0 34 -3,-1.3 -1,-0.3 1,-0.2 3,-0.2 0.694 108.8 48.3 -90.7 -16.2 25.8 10.2 -10.2 332 43 C F X + 0 0 38 -3,-1.3 3,-1.8 -4,-0.3 -1,-0.2 -0.320 62.5 143.0-115.8 51.7 27.1 6.8 -11.5 333 44 C P T 3 S+ 0 0 68 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.699 74.6 53.9 -63.9 -19.5 30.3 6.4 -9.4 334 45 C H T 3 S+ 0 0 132 -3,-0.2 2,-0.4 2,-0.1 -2,-0.1 0.279 90.5 99.3 -96.4 8.1 29.6 2.6 -9.2 335 46 C F S < S- 0 0 38 -3,-1.8 2,-0.9 -6,-0.2 -3,-0.1 -0.764 75.2-127.4-102.0 140.4 29.2 2.0 -13.0 336 47 C D - 0 0 87 -2,-0.4 8,-0.6 1,-0.2 7,-0.2 -0.768 32.8-176.5 -76.0 110.0 31.8 0.6 -15.4 337 48 C L + 0 0 49 -2,-0.9 -1,-0.2 6,-0.1 3,-0.1 0.369 34.7 124.1 -97.0 5.6 31.4 3.6 -17.8 338 49 C S S S- 0 0 69 1,-0.1 3,-0.4 2,-0.1 6,-0.2 -0.092 76.3 -61.0 -59.5 164.8 33.8 2.2 -20.5 339 50 C H S S- 0 0 147 1,-0.2 -1,-0.1 5,-0.0 5,-0.0 -0.058 113.2 -6.9 -52.3 146.7 32.5 1.8 -24.0 340 51 C G S S+ 0 0 50 1,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.852 92.3 170.0 29.9 72.8 29.6 -0.6 -24.7 341 52 C S > - 0 0 10 -3,-0.4 4,-2.7 -5,-0.1 5,-0.2 -0.806 45.0-115.6-116.3 157.9 29.5 -1.9 -21.2 342 53 C A H > S+ 0 0 82 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.889 109.9 49.4 -55.6 -51.2 27.0 -4.2 -19.4 343 54 C Q H > S+ 0 0 76 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.969 116.1 42.2 -55.1 -57.6 25.8 -1.7 -16.7 344 55 C V H > S+ 0 0 12 -8,-0.6 4,-4.0 2,-0.2 3,-0.3 0.954 114.5 51.2 -55.6 -55.7 25.1 1.1 -19.2 345 56 C K H X S+ 0 0 134 -4,-2.7 4,-1.9 1,-0.3 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103.1 48.3 -62.1 -39.6 28.2 31.3 -42.2 501 70 D A H X S+ 0 0 26 -4,-1.5 4,-1.5 -3,-0.3 -1,-0.2 0.848 105.2 58.4 -71.2 -31.2 29.4 33.0 -39.0 502 71 D F H >X S+ 0 0 22 -4,-1.4 4,-1.4 1,-0.2 3,-0.9 0.979 102.6 55.4 -58.2 -52.5 29.7 29.7 -37.3 503 72 D S H 3X S+ 0 0 44 -4,-2.1 4,-1.0 1,-0.3 -1,-0.2 0.803 102.1 55.7 -47.3 -41.4 32.2 28.6 -40.0 504 73 D D H 3X S+ 0 0 93 -4,-1.2 4,-0.7 1,-0.2 3,-0.5 0.905 107.4 49.3 -64.0 -39.1 34.4 31.6 -39.4 505 74 D G H << S+ 0 0 0 -4,-1.5 -1,-0.2 -3,-0.9 -2,-0.2 0.757 103.7 59.7 -70.7 -25.4 34.8 30.7 -35.7 506 75 D L H < S+ 0 0 23 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.759 110.6 42.4 -73.6 -22.9 35.6 27.1 -36.7 507 76 D A H < S+ 0 0 82 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.565 120.4 41.9 -94.3 -12.7 38.6 28.5 -38.6 508 77 D H S >< S+ 0 0 91 -4,-0.7 3,-3.8 -5,-0.1 -2,-0.2 0.122 74.0 142.3-114.9 14.0 39.4 31.0 -35.8 509 78 D L T 3 + 0 0 13 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.498 65.8 60.2 -40.8 -8.0 38.8 28.4 -33.0 510 79 D D T 3 S+ 0 0 136 1,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.592 113.7 32.3 -99.2 -11.9 41.7 29.7 -31.0 511 80 D N <> + 0 0 97 -3,-3.8 4,-1.6 -6,-0.2 -1,-0.2 -0.386 66.3 149.8-139.6 53.9 40.3 33.2 -30.6 512 81 D L H > S+ 0 0 14 -3,-0.3 4,-2.0 1,-0.2 3,-0.2 0.900 74.6 56.9 -56.0 -42.9 36.5 32.7 -30.5 513 82 D K H > S+ 0 0 103 1,-0.2 4,-0.8 2,-0.2 3,-0.3 0.957 109.9 41.7 -49.9 -61.3 36.2 35.8 -28.3 514 83 D G H 4 S+ 0 0 47 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.681 113.0 54.9 -64.7 -23.0 37.9 38.2 -30.7 515 84 D T H < S+ 0 0 33 -4,-1.6 4,-0.3 -3,-0.2 -1,-0.2 0.889 116.1 34.9 -75.1 -40.9 36.1 36.7 -33.7 516 85 D F H X S+ 0 0 7 -4,-2.0 4,-3.1 -3,-0.3 -2,-0.2 0.366 84.5 105.4 -99.9 3.5 32.6 37.2 -32.3 517 86 D A H X S+ 0 0 23 -4,-0.8 4,-2.6 2,-0.2 5,-0.2 0.925 85.5 42.6 -51.0 -57.2 33.1 40.5 -30.4 518 87 D T H > S+ 0 0 105 -4,-0.3 4,-2.8 1,-0.2 5,-0.2 0.981 114.2 51.4 -52.8 -58.1 31.2 42.6 -32.9 519 88 D L H > S+ 0 0 53 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.896 109.9 53.5 -45.7 -41.7 28.5 40.0 -33.3 520 89 D S H X S+ 0 0 0 -4,-3.1 4,-1.3 1,-0.2 -1,-0.2 0.955 108.1 45.3 -61.2 -54.2 28.4 40.1 -29.5 521 90 D E H X>S+ 0 0 93 -4,-2.6 4,-2.9 1,-0.2 5,-0.7 0.885 112.6 55.2 -57.3 -35.7 27.8 43.8 -29.2 522 91 D L H X>S+ 0 0 79 -4,-2.8 5,-2.1 -5,-0.2 4,-1.2 0.919 107.6 46.2 -65.4 -43.8 25.3 43.6 -32.0 523 92 D H H <5S+ 0 0 46 -4,-2.2 6,-2.2 -5,-0.2 5,-0.4 0.655 124.6 34.3 -72.9 -17.1 23.1 40.9 -30.2 524 93 D C H <5S+ 0 0 8 -4,-1.3 -2,-0.2 -3,-0.3 -3,-0.2 0.863 123.5 35.6-100.9 -56.3 23.3 42.8 -27.0 525 94 D D H <5S+ 0 0 58 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.808 134.0 17.9 -73.9 -31.2 23.2 46.5 -27.7 526 95 D K T < - 0 0 4 -2,-0.5 3,-2.5 1,-0.2 4,-0.3 -0.535 23.4-128.1 -65.9 120.1 19.1 37.3 -23.8 531 100 D P T >> S+ 0 0 8 0, 0.0 3,-1.0 0, 0.0 4,-0.7 0.590 98.5 80.9 -53.0 -12.3 22.2 35.1 -24.1 532 101 D E H 3> S+ 0 0 60 1,-0.3 4,-1.0 2,-0.2 3,-0.4 0.843 82.3 63.0 -66.6 -29.4 20.3 32.1 -22.9 533 102 D N H <> S+ 0 0 19 -3,-2.5 4,-2.0 1,-0.2 -1,-0.3 0.804 88.3 73.1 -64.4 -23.3 18.8 31.6 -26.3 534 103 D F H <> S+ 0 0 23 -3,-1.0 4,-2.1 -4,-0.3 -1,-0.2 0.948 94.1 49.8 -56.2 -53.7 22.3 31.0 -27.6 535 104 D R H X S+ 0 0 90 -4,-0.7 4,-2.7 -3,-0.4 5,-0.3 0.900 106.4 58.4 -51.1 -42.0 22.6 27.6 -26.0 536 105 D L H X S+ 0 0 27 -4,-1.0 4,-2.4 1,-0.2 5,-0.2 0.933 107.2 45.5 -56.3 -47.6 19.2 26.7 -27.6 537 106 D L H X S+ 0 0 42 -4,-2.0 4,-2.6 -3,-0.2 -1,-0.2 0.891 110.6 55.1 -64.1 -37.1 20.5 27.4 -31.1 538 107 D G H X S+ 0 0 7 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.941 112.2 41.3 -60.1 -49.9 23.6 25.4 -30.3 539 108 D N H X S+ 0 0 40 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.871 113.9 51.6 -67.4 -39.3 21.7 22.3 -29.3 540 109 D V H X S+ 0 0 2 -4,-2.4 4,-2.8 -5,-0.3 -1,-0.2 0.917 110.6 51.0 -60.3 -41.5 19.1 22.6 -32.1 541 110 D L H X S+ 0 0 5 -4,-2.6 4,-2.8 -5,-0.2 -2,-0.2 0.941 109.0 49.9 -62.6 -46.6 22.1 22.8 -34.4 542 111 D V H X S+ 0 0 1 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.878 109.2 52.0 -57.0 -40.2 23.6 19.7 -32.9 543 112 D C H X S+ 0 0 1 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.972 110.0 50.2 -61.4 -47.8 20.3 17.9 -33.3 544 113 D V H >X S+ 0 0 1 -4,-2.8 4,-1.6 1,-0.2 3,-1.0 0.951 108.0 50.5 -53.3 -56.4 20.3 19.0 -37.0 545 114 D L H 3X S+ 0 0 1 -4,-2.8 4,-1.5 1,-0.3 -1,-0.2 0.863 111.8 49.1 -53.5 -35.4 23.8 17.7 -37.6 546 115 D A H 3X S+ 0 0 0 -4,-1.9 4,-1.2 1,-0.2 -1,-0.3 0.807 107.6 55.7 -75.3 -24.8 22.9 14.4 -36.1 547 116 D H H << S+ 0 0 37 -4,-1.7 -1,-0.2 -3,-1.0 -2,-0.2 0.760 113.3 39.4 -78.6 -26.0 19.8 14.3 -38.3 548 117 D H H < S+ 0 0 65 -4,-1.6 -2,-0.2 -3,-0.2 -1,-0.2 0.648 125.4 33.8 -94.4 -20.5 21.8 14.7 -41.5 549 118 D F H >< S+ 0 0 32 -4,-1.5 3,-1.7 -5,-0.2 4,-0.4 0.474 76.8 169.9-115.6 -4.3 24.8 12.5 -40.7 550 119 D G G >< S+ 0 0 16 -4,-1.2 3,-3.5 1,-0.3 -1,-0.1 0.089 73.0 19.9 31.9-121.3 23.3 9.7 -38.6 551 120 D K G 3 S+ 0 0 167 1,-0.3 -1,-0.3 -151,-0.2 -2,-0.1 0.829 123.0 59.8 -38.5 -49.1 25.8 6.9 -38.1 552 121 D E G < S+ 0 0 89 -3,-1.7 2,-1.2 1,-0.2 -1,-0.3 0.655 90.4 74.1 -58.7 -18.9 28.7 9.2 -38.9 553 122 D F S < S+ 0 0 0 -3,-3.5 -1,-0.2 -4,-0.4 -3,-0.1 -0.610 75.7 173.6 -96.8 70.8 27.6 11.5 -36.0 554 123 D T >> - 0 0 59 -2,-1.2 4,-2.9 1,-0.1 3,-0.6 -0.280 46.6 -96.9 -77.9 163.6 29.0 9.1 -33.3 555 124 D P H 3> S+ 0 0 18 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.898 122.3 52.7 -49.9 -51.6 29.1 10.0 -29.6 556 125 D P H 3> S+ 0 0 75 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.877 113.1 46.2 -54.0 -38.8 32.8 11.1 -29.6 557 126 D V H X> S+ 0 0 21 -3,-0.6 4,-2.2 2,-0.2 3,-0.7 0.966 109.0 54.3 -67.8 -52.0 32.0 13.4 -32.4 558 127 D Q H 3X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.3 3,-0.3 0.945 106.9 51.4 -43.4 -58.5 28.9 14.7 -30.7 559 128 D A H 3X S+ 0 0 6 -4,-2.7 4,-1.5 1,-0.2 -1,-0.3 0.839 107.1 54.1 -51.7 -36.2 30.9 15.6 -27.6 560 129 D A H X S+ 0 0 81 -4,-2.2 3,-1.6 -3,-0.4 4,-0.6 0.913 106.2 55.2 -71.8 -40.7 30.2 32.1 -24.6 571 140 D A H >< S+ 0 0 3 -4,-2.2 3,-0.6 1,-0.3 4,-0.4 0.841 106.6 53.3 -60.0 -31.7 32.0 34.2 -27.2 572 141 D L T 3< S+ 0 0 23 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.571 112.4 44.4 -79.4 -7.8 28.7 35.7 -28.1 573 142 D A T X4 S+ 0 0 26 -3,-1.6 3,-0.9 -4,-0.3 -1,-0.2 0.360 88.6 88.2-115.7 2.9 27.9 36.6 -24.5 574 143 D H T << S+ 0 0 99 -4,-0.6 -2,-0.1 -3,-0.6 -3,-0.1 0.918 87.3 48.2 -70.1 -44.4 31.3 38.1 -23.5 575 144 D K T 3 S+ 0 0 96 -4,-0.4 2,-0.3 -62,-0.1 -1,-0.2 0.165 82.0 126.2 -86.4 19.6 30.7 41.7 -24.5 576 145 D Y < 0 0 23 -3,-0.9 -538,-0.1 -52,-0.1 -55,-0.1 -0.596 360.0 360.0 -77.9 139.4 27.3 41.9 -22.9 577 146 D H 0 0 117 -2,-0.3 -537,-0.0 -540,-0.1 -2,-0.0 -0.852 360.0 360.0-152.3 360.0 27.0 44.8 -20.4