==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 27-JUL-08 3DYH . COMPND 2 MOLECULE: FARNESYL PYROPHOSPHATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA BRUCEI; . AUTHOR R.CAO,Y.GAO,H.ROBINSON,A.GODDARD,E.OLDFIELD . 717 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27613.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 548 76.4 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 . 6 0.8 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 . 2 0.3 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 . 10 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 443 61.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.5 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 4 0 0 0 1 2 3 2 4 2 0 2 0 0 0 0 0 0 1 5 1 2 1 0 0 0 2 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 153 0, 0.0 4,-1.8 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -52.8 51.8 -12.2 -3.3 2 2 A P H > + 0 0 55 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.915 360.0 52.0 -60.8 -36.0 50.2 -13.3 0.0 3 3 A M H > S+ 0 0 78 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.849 106.0 53.5 -62.2 -40.4 47.2 -14.6 -1.9 4 4 A Q H > S+ 0 0 130 -3,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.935 113.6 40.5 -64.9 -47.7 49.2 -16.7 -4.3 5 5 A M H X S+ 0 0 38 -4,-1.8 4,-2.0 1,-0.2 3,-0.3 0.880 109.9 59.6 -70.0 -37.9 51.1 -18.6 -1.6 6 6 A F H X S+ 0 0 0 -4,-2.2 4,-1.5 -5,-0.3 -1,-0.2 0.863 107.3 47.4 -54.4 -38.6 48.0 -18.9 0.6 7 7 A M H X S+ 0 0 51 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.747 107.2 56.7 -78.4 -23.0 46.4 -20.8 -2.3 8 8 A Q H X S+ 0 0 119 -4,-1.0 4,-1.4 -3,-0.3 -2,-0.2 0.835 107.6 47.6 -70.1 -37.5 49.5 -23.0 -2.6 9 9 A V H X S+ 0 0 6 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.844 105.2 61.1 -76.4 -30.8 49.1 -24.0 1.0 10 10 A Y H X S+ 0 0 2 -4,-1.5 4,-3.1 2,-0.2 -2,-0.2 0.950 105.6 45.6 -54.4 -53.1 45.4 -24.7 0.4 11 11 A D H X S+ 0 0 90 -4,-1.5 4,-3.0 1,-0.2 -1,-0.2 0.868 113.0 52.0 -59.0 -38.9 46.2 -27.4 -2.2 12 12 A E H X S+ 0 0 85 -4,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.928 112.7 43.8 -61.9 -47.1 48.9 -28.8 0.1 13 13 A I H X S+ 0 0 0 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.924 114.6 50.0 -63.8 -45.2 46.4 -29.1 3.0 14 14 A Q H X S+ 0 0 19 -4,-3.1 4,-2.8 1,-0.2 5,-0.4 0.938 111.7 47.8 -59.8 -49.8 43.7 -30.5 0.7 15 15 A M H X S+ 0 0 107 -4,-3.0 4,-1.8 1,-0.2 5,-0.3 0.897 111.9 50.3 -58.1 -44.1 46.1 -33.1 -0.7 16 16 A F H X S+ 0 0 36 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.969 115.7 42.2 -59.4 -47.4 47.2 -34.1 2.8 17 17 A L H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.920 117.8 41.9 -68.2 -46.1 43.5 -34.5 4.0 18 18 A L H X S+ 0 0 4 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.905 115.3 50.2 -73.6 -37.1 42.0 -36.3 1.1 19 19 A E H X S+ 0 0 102 -4,-1.8 4,-2.5 -5,-0.4 -1,-0.2 0.878 108.8 53.1 -65.3 -38.8 45.0 -38.6 0.6 20 20 A E H X>S+ 0 0 18 -4,-1.9 4,-2.9 -5,-0.3 5,-0.6 0.898 106.4 53.8 -61.7 -41.8 44.9 -39.5 4.3 21 21 A L H X5S+ 0 0 0 -4,-1.9 6,-2.1 2,-0.2 4,-0.9 0.872 112.4 42.6 -58.4 -43.4 41.2 -40.4 4.0 22 22 A E H <5S+ 0 0 92 -4,-1.7 4,-0.3 4,-0.2 -2,-0.2 0.908 122.4 39.2 -68.9 -42.9 41.9 -42.8 1.1 23 23 A L H <5S+ 0 0 141 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.812 131.9 18.5 -79.1 -34.4 45.0 -44.3 2.7 24 24 A K H <5S+ 0 0 142 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.507 125.1 46.9-119.8 -9.6 44.0 -44.5 6.4 25 25 A F S < - 0 0 27 -2,-0.2 4,-2.0 1,-0.1 3,-0.1 -0.466 25.1-108.7 -86.8 157.7 36.4 -44.7 -1.8 29 29 A P H > S+ 0 0 91 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.808 115.1 59.6 -53.6 -36.5 37.0 -42.4 -4.7 30 30 A N H > S+ 0 0 29 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.941 109.5 40.0 -64.2 -49.4 33.4 -41.3 -4.8 31 31 A R H > S+ 0 0 8 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.862 112.1 56.9 -67.9 -34.6 33.3 -40.0 -1.3 32 32 A V H X S+ 0 0 6 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.963 108.4 48.5 -58.3 -47.3 36.8 -38.4 -1.7 33 33 A R H X S+ 0 0 84 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.861 110.9 49.5 -58.4 -42.5 35.3 -36.5 -4.7 34 34 A Y H X S+ 0 0 2 -4,-1.8 4,-2.8 1,-0.2 -1,-0.2 0.939 112.7 48.1 -62.4 -49.7 32.3 -35.4 -2.6 35 35 A L H X S+ 0 0 0 -4,-3.2 4,-2.8 2,-0.2 -2,-0.2 0.832 108.6 53.4 -60.0 -35.7 34.6 -34.2 0.2 36 36 A R H X S+ 0 0 102 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.930 112.9 44.2 -64.4 -46.1 36.8 -32.3 -2.3 37 37 A K H X S+ 0 0 75 -4,-2.0 4,-3.1 2,-0.2 5,-0.2 0.914 112.9 51.0 -62.3 -48.4 33.8 -30.5 -3.6 38 38 A M H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.946 111.9 47.3 -53.2 -54.2 32.4 -29.9 -0.2 39 39 A M H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 5,-0.3 0.885 115.3 45.6 -55.5 -46.2 35.8 -28.4 1.0 40 40 A D H X S+ 0 0 56 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.957 115.2 46.6 -60.7 -52.2 36.1 -26.2 -2.1 41 41 A T H < S+ 0 0 31 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.912 120.8 36.8 -60.2 -45.0 32.5 -25.0 -1.9 42 42 A T H < S+ 0 0 11 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.811 124.0 37.4 -81.1 -32.3 32.5 -24.2 1.8 43 43 A C H < S+ 0 0 2 -4,-2.1 2,-0.3 -5,-0.3 3,-0.3 0.655 108.8 60.8 -96.7 -18.9 36.1 -22.9 2.3 44 44 A L S < S+ 0 0 36 -4,-1.9 3,-0.1 -5,-0.3 0, 0.0 -0.776 75.1 53.0-114.8 157.7 36.7 -20.9 -1.0 45 45 A G S S+ 0 0 58 1,-0.4 -1,-0.1 -2,-0.3 2,-0.1 0.319 81.3 105.0 105.8 -5.7 35.2 -17.9 -2.7 46 46 A G S S- 0 0 25 -3,-0.3 -1,-0.4 1,-0.0 -3,-0.0 -0.244 86.2-100.0 -88.7-172.4 35.3 -15.4 0.2 47 47 A K - 0 0 99 -3,-0.1 5,-0.1 -2,-0.1 -1,-0.0 0.629 41.4-141.3 -78.4 -21.5 37.7 -12.5 0.8 48 48 A Y > + 0 0 25 3,-0.1 4,-3.1 1,-0.1 5,-0.3 0.748 47.3 149.5 57.3 30.8 39.9 -14.5 3.2 49 49 A N H > S+ 0 0 31 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.882 71.3 50.7 -57.0 -39.1 40.5 -11.5 5.5 50 50 A R H > S+ 0 0 21 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.971 116.4 39.8 -62.2 -54.2 40.8 -13.9 8.5 51 51 A G H > S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 3,-0.3 0.914 115.2 50.2 -59.6 -50.4 43.4 -16.1 6.8 52 52 A L H X S+ 0 0 23 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.804 102.5 63.1 -62.8 -31.4 45.3 -13.3 5.1 53 53 A T H X S+ 0 0 6 -4,-1.7 4,-3.0 -5,-0.3 5,-0.3 0.932 98.9 54.4 -57.4 -49.2 45.6 -11.4 8.4 54 54 A V H X S+ 0 0 0 -4,-1.3 4,-2.8 -3,-0.3 -1,-0.2 0.924 109.7 47.1 -50.8 -52.6 47.7 -14.2 10.0 55 55 A I H X S+ 0 0 3 -4,-1.2 4,-3.0 22,-0.2 -1,-0.2 0.937 113.7 48.3 -53.8 -48.9 50.2 -14.0 7.1 56 56 A D H X S+ 0 0 46 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.890 112.3 47.1 -64.5 -41.9 50.4 -10.2 7.4 57 57 A V H X S+ 0 0 0 -4,-3.0 4,-1.0 2,-0.2 -1,-0.2 0.949 113.0 51.2 -61.0 -47.8 50.9 -10.2 11.2 58 58 A A H >< S+ 0 0 0 -4,-2.8 3,-1.2 -5,-0.3 4,-0.4 0.946 112.4 44.7 -54.6 -52.9 53.5 -13.0 10.8 59 59 A E H >< S+ 0 0 78 -4,-3.0 3,-0.8 1,-0.3 -1,-0.2 0.843 108.6 57.6 -62.2 -34.8 55.4 -11.0 8.1 60 60 A S H 3< S+ 0 0 36 -4,-2.1 4,-0.3 -5,-0.2 -1,-0.3 0.697 110.9 44.3 -67.5 -17.4 55.1 -7.7 10.1 61 61 A L T << S+ 0 0 8 -3,-1.2 -1,-0.2 -4,-1.0 -2,-0.2 0.367 70.5 110.6-112.7 3.7 56.9 -9.4 13.1 62 62 A L S < S+ 0 0 62 -3,-0.8 -1,-0.1 -4,-0.4 -2,-0.1 0.469 90.1 36.1 -69.6 1.9 59.9 -11.3 11.8 63 63 A S 0 0 117 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.739 360.0 360.0-106.8 -63.1 62.4 -8.9 13.3 64 64 A L 0 0 106 -4,-0.3 -1,-0.1 159,-0.0 162,-0.1 -0.408 360.0 360.0 -75.7 360.0 60.9 -7.8 16.7 65 ! 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 66 74 A D 0 0 193 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -64.9 68.2 -16.8 8.1 67 75 A G > + 0 0 42 0, 0.0 4,-1.3 0, 0.0 5,-0.0 0.058 360.0 71.3 162.0 -23.5 65.6 -17.0 5.3 68 76 A A H > S+ 0 0 66 2,-0.2 4,-2.0 3,-0.1 5,-0.1 0.713 97.2 55.7 -76.1 -28.0 64.5 -20.6 6.0 69 77 A R H > S+ 0 0 69 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.869 106.2 48.8 -69.8 -39.9 62.9 -19.1 9.1 70 78 A R H > S+ 0 0 113 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.915 112.1 49.1 -65.3 -43.2 61.0 -16.6 7.0 71 79 A K H X S+ 0 0 169 -4,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.891 116.3 43.0 -62.3 -40.4 59.9 -19.5 4.7 72 80 A R H X S+ 0 0 77 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.920 113.9 48.3 -74.3 -46.0 58.8 -21.6 7.8 73 81 A V H X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.897 114.6 47.0 -61.7 -40.4 57.1 -18.8 9.7 74 82 A L H X S+ 0 0 7 -4,-2.2 4,-1.8 -5,-0.2 -1,-0.2 0.849 112.3 48.9 -74.1 -33.7 55.1 -17.7 6.6 75 83 A H H X S+ 0 0 55 -4,-1.6 4,-2.0 -5,-0.2 -2,-0.2 0.927 112.0 49.3 -66.0 -45.8 54.2 -21.3 5.8 76 84 A D H X S+ 0 0 1 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.823 109.6 53.3 -57.7 -37.2 53.1 -21.8 9.4 77 85 A A H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -22,-0.2 0.872 106.6 51.6 -69.5 -38.0 51.1 -18.5 9.1 78 86 A C H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.903 109.7 49.5 -62.2 -43.9 49.3 -19.9 5.9 79 87 A V H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.922 111.5 48.6 -62.5 -45.1 48.3 -23.1 7.8 80 88 A C H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.898 108.9 54.9 -58.6 -41.9 47.0 -21.1 10.7 81 89 A G H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.923 109.0 46.3 -55.7 -48.6 45.1 -18.9 8.2 82 90 A W H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.797 106.1 60.7 -67.9 -29.8 43.4 -22.0 6.7 83 91 A M H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.968 110.5 39.9 -59.2 -52.0 42.6 -23.2 10.2 84 92 A I H X S+ 0 0 0 -4,-2.2 4,-3.1 2,-0.2 -2,-0.2 0.878 115.8 52.2 -65.4 -39.8 40.5 -20.0 10.9 85 93 A E H X S+ 0 0 4 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.890 112.5 44.4 -61.5 -42.7 39.1 -20.2 7.3 86 94 A F H X S+ 0 0 0 -4,-3.0 4,-2.5 2,-0.2 -2,-0.2 0.853 112.7 52.4 -66.8 -37.3 38.1 -23.9 7.8 87 95 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.959 111.2 47.4 -61.6 -49.0 36.7 -22.9 11.3 88 96 A Q H X S+ 0 0 22 -4,-3.1 4,-2.8 2,-0.2 5,-0.2 0.929 109.4 52.5 -54.0 -48.8 34.7 -20.1 9.5 89 97 A A H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.906 109.4 50.7 -53.9 -47.1 33.5 -22.6 6.8 90 98 A H H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 5,-0.3 0.948 111.2 47.9 -52.9 -52.6 32.3 -24.9 9.6 91 99 A Y H X S+ 0 0 25 -4,-2.6 4,-3.5 1,-0.2 -2,-0.2 0.914 112.2 48.1 -59.1 -45.0 30.4 -22.0 11.2 92 100 A L H X S+ 0 0 21 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.833 107.9 55.1 -70.8 -34.5 28.8 -20.8 8.0 93 101 A V H X S+ 0 0 6 -4,-2.4 4,-1.2 -5,-0.2 18,-0.2 0.971 117.9 34.3 -59.2 -52.1 27.7 -24.3 7.1 94 102 A E H X S+ 0 0 2 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.893 117.0 55.5 -71.1 -37.6 25.9 -24.7 10.5 95 103 A D H X S+ 0 0 27 -4,-3.5 4,-2.3 -5,-0.3 5,-0.2 0.943 103.4 54.5 -62.5 -47.7 24.8 -21.0 10.6 96 104 A D H X>S+ 0 0 4 -4,-2.7 5,-2.2 2,-0.2 4,-0.7 0.889 111.8 45.5 -51.4 -41.0 23.1 -21.2 7.2 97 105 A I H ><5S+ 0 0 22 -4,-1.2 3,-1.1 -5,-0.2 -2,-0.2 0.975 114.2 46.7 -65.8 -54.6 21.0 -24.1 8.5 98 106 A M H 3<5S+ 0 0 13 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.756 117.9 44.3 -53.1 -32.0 20.2 -22.4 11.9 99 107 A D H 3<5S- 0 0 12 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.479 104.6-125.8 -98.2 -7.3 19.3 -19.2 10.0 100 108 A N T <<5 + 0 0 99 -3,-1.1 -3,-0.2 -4,-0.7 2,-0.1 0.898 48.0 173.7 63.6 42.6 17.2 -20.8 7.2 101 109 A S < - 0 0 10 -5,-2.2 -1,-0.2 -6,-0.2 3,-0.1 -0.477 28.3-161.9 -86.2 159.2 19.4 -19.1 4.6 102 110 A V + 0 0 69 1,-0.3 7,-2.1 160,-0.3 2,-0.3 0.817 68.6 21.9-110.4 -49.7 19.1 -19.7 0.8 103 111 A T E -A 108 0A 36 5,-0.3 159,-0.5 159,-0.1 2,-0.3 -0.838 51.4-176.7-123.2 162.6 22.3 -18.4 -0.7 104 112 A R E > S-A 107 0A 45 3,-2.9 3,-1.6 -2,-0.3 157,-0.2 -0.920 78.5 -2.5-154.9 128.1 25.9 -17.7 0.4 105 113 A R T 3 S- 0 0 63 -2,-0.3 155,-0.2 154,-0.3 156,-0.2 0.950 129.9 -56.9 50.4 52.9 28.6 -16.2 -1.8 106 114 A G T 3 S+ 0 0 64 154,-2.0 -1,-0.3 150,-0.2 155,-0.1 0.466 124.6 86.1 62.4 3.0 26.2 -16.1 -4.9 107 115 A K E < S-A 104 0A 100 -3,-1.6 -3,-2.9 153,-0.2 -1,-0.1 -0.830 92.4 -79.6-124.9 165.1 25.6 -19.9 -4.7 108 116 A P E -A 103 0A 58 0, 0.0 -5,-0.3 0, 0.0 5,-0.1 -0.366 57.2 -98.0 -61.6 144.4 23.1 -22.0 -2.7 109 117 A C >> - 0 0 1 -7,-2.1 3,-1.7 1,-0.1 4,-0.7 -0.247 42.6-102.2 -51.2 155.5 24.0 -22.5 1.0 110 118 A W G >4 S+ 0 0 9 1,-0.3 3,-1.6 2,-0.2 6,-0.1 0.915 123.1 50.0 -52.9 -50.7 25.7 -25.9 1.4 111 119 A Y G 34 S+ 0 0 23 1,-0.3 -1,-0.3 -18,-0.2 10,-0.1 0.556 106.5 57.7 -68.0 -11.1 22.6 -27.6 2.9 112 120 A R G <4 S+ 0 0 103 -3,-1.7 -1,-0.3 -10,-0.1 -2,-0.2 0.499 75.4 118.2 -94.2 -10.0 20.4 -26.2 -0.0 113 121 A H S X< S- 0 0 9 -3,-1.6 3,-2.4 -4,-0.7 428,-0.1 -0.389 75.9-122.4 -55.0 131.0 22.6 -27.9 -2.7 114 122 A P T 3 S+ 0 0 70 0, 0.0 430,-0.3 0, 0.0 427,-0.2 0.829 110.3 41.9 -48.3 -39.0 20.3 -30.4 -4.5 115 123 A D 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2,-0.2 5,-2.7 1,-0.2 4,-0.1 0.908 88.3 39.9 -56.7 -50.6 17.6 -10.9 9.8 266 274 A I T >45S+ 0 0 7 3,-0.2 3,-1.9 1,-0.2 29,-1.1 0.973 118.6 48.4 -61.1 -53.6 14.2 -9.4 9.6 267 275 A Q T 345S+ 0 0 64 1,-0.3 -2,-0.2 28,-0.2 -1,-0.2 0.871 112.4 48.5 -51.9 -43.9 12.6 -12.8 8.7 268 276 A D T 3<5S- 0 0 32 -4,-3.4 -1,-0.3 28,-0.1 -2,-0.2 0.316 109.5-122.6 -83.7 7.9 14.4 -14.6 11.6 269 277 A A T < 5 - 0 0 4 -3,-1.9 -3,-0.2 -5,-0.2 -83,-0.1 0.845 48.6-176.9 52.6 38.6 13.4 -11.8 14.1 270 278 A K < - 0 0 9 -5,-2.7 2,-1.8 -6,-0.2 -1,-0.2 -0.302 37.6-118.3 -70.7 148.2 17.1 -11.3 14.8 271 279 A C + 0 0 9 -104,-0.3 -1,-0.1 4,-0.1 2,-0.1 -0.599 53.5 171.7 -83.1 74.9 18.4 -8.9 17.4 272 280 A S > - 0 0 5 -2,-1.8 4,-2.4 1,-0.1 5,-0.3 -0.405 49.7-109.6 -83.4 163.1 20.3 -6.8 14.7 273 281 A W H > S+ 0 0 12 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.876 121.7 53.2 -56.8 -37.8 22.0 -3.5 15.3 274 282 A L H > S+ 0 0 4 2,-0.2 4,-2.5 3,-0.2 -1,-0.2 0.910 108.6 48.8 -65.5 -45.1 19.2 -1.9 13.2 275 283 A A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.951 115.5 41.2 -58.9 -55.3 16.4 -3.5 15.4 276 284 A V H X S+ 0 0 1 -4,-2.4 4,-2.0 2,-0.2 -82,-0.2 0.889 117.1 49.1 -63.9 -38.6 17.9 -2.4 18.8 277 285 A T H X S+ 0 0 23 -4,-2.2 4,-0.8 -5,-0.3 -1,-0.2 0.892 114.5 45.3 -69.3 -40.7 18.9 1.0 17.5 278 286 A F H >X S+ 0 0 0 -4,-2.5 4,-1.8 -5,-0.2 3,-1.1 0.952 113.1 48.8 -61.6 -55.2 15.5 1.7 16.0 279 287 A L H 3< S+ 0 0 30 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.851 106.0 58.2 -59.8 -35.7 13.6 0.4 19.1 280 288 A A H 3< S+ 0 0 90 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.759 119.2 28.9 -65.9 -25.6 15.7 2.5 21.4 281 289 A K H << S+ 0 0 94 -3,-1.1 -2,-0.2 -4,-0.8 -1,-0.2 0.536 96.4 113.5-111.2 -11.7 14.7 5.8 19.6 282 290 A A < - 0 0 21 -4,-1.8 2,-0.1 -5,-0.1 -3,-0.0 -0.293 63.7-121.2 -70.2 145.9 11.2 4.9 18.3 283 291 A S > - 0 0 50 1,-0.1 4,-2.5 -2,-0.0 5,-0.2 -0.316 35.5-104.3 -69.6 163.8 7.9 6.5 19.3 284 292 A S H > S+ 0 0 108 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.836 123.4 55.2 -61.2 -34.9 5.2 4.1 20.6 285 293 A A H > S+ 0 0 76 2,-0.2 4,-1.8 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110.0 53.3 -53.2 -42.1 10.3 -2.7 8.6 306 314 A R H X S+ 0 0 94 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.870 110.0 46.3 -62.8 -40.5 12.8 -1.3 6.1 307 315 A R H X S+ 0 0 79 -4,-1.1 4,-2.8 -3,-0.3 -2,-0.2 0.872 109.1 55.4 -70.1 -38.8 10.8 1.9 5.7 308 316 A L H X S+ 0 0 3 -4,-2.4 4,-1.1 2,-0.2 -2,-0.2 0.908 111.1 45.9 -60.0 -42.5 10.6 2.2 9.5 309 317 A Y H ><>S+ 0 0 1 -4,-2.1 5,-1.4 2,-0.2 3,-0.6 0.950 113.1 47.7 -63.1 -53.4 14.4 2.0 9.6 310 318 A E H ><5S+ 0 0 134 -4,-2.5 3,-1.0 1,-0.2 -2,-0.2 0.879 112.6 50.7 -56.6 -39.3 14.9 4.5 6.7 311 319 A E H 3<5S+ 0 0 132 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.726 103.2 58.4 -70.9 -25.8 12.5 6.9 8.4 312 320 A A T <<5S- 0 0 16 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.288 113.4-114.8 -89.8 11.5 14.1 6.8 11.8 313 321 A D T <>5 + 0 0 91 -3,-1.0 4,-1.7 -4,-0.1 3,-0.4 0.896 56.4 159.7 51.8 50.3 17.5 8.0 10.4 314 322 A L H > S+ 0 0 155 2,-0.2 4,-1.9 -6,-0.2 -1,-0.2 0.818 103.4 46.9 -71.4 -30.1 21.8 5.9 8.5 316 324 A G H > S+ 0 0 24 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.881 111.1 51.0 -73.6 -43.5 22.8 8.9 10.6 317 325 A D H X S+ 0 0 48 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.923 111.4 50.6 -54.7 -43.2 23.0 6.8 13.7 318 326 A Y H X S+ 0 0 39 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.920 108.8 48.5 -65.6 -46.1 25.3 4.5 11.6 319 327 A V H X S+ 0 0 83 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.910 113.3 48.9 -58.7 -43.6 27.6 7.3 10.4 320 328 A A H X S+ 0 0 61 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.859 112.5 47.0 -65.8 -39.1 28.0 8.6 13.9 321 329 A Y H X S+ 0 0 39 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.954 111.3 51.4 -67.1 -47.2 28.7 5.1 15.3 322 330 A E H X S+ 0 0 18 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.878 110.8 49.2 -56.0 -43.8 31.3 4.5 12.6 323 331 A A H X S+ 0 0 56 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.902 110.2 49.5 -61.2 -45.9 33.0 7.8 13.4 324 332 A A H X S+ 0 0 36 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.908 112.7 49.1 -63.4 -39.0 33.1 7.1 17.1 325 333 A V H X S+ 0 0 0 -4,-2.8 4,-3.2 2,-0.2 -2,-0.2 0.939 108.8 50.1 -63.8 -50.2 34.6 3.6 16.3 326 334 A A H X S+ 0 0 6 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.867 111.8 52.0 -58.1 -35.1 37.3 5.0 13.9 327 335 A E H X S+ 0 0 112 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.955 112.4 42.0 -63.6 -52.8 38.1 7.5 16.7 328 336 A Q H X S+ 0 0 89 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.882 114.3 54.1 -64.0 -39.2 38.5 4.8 19.4 329 337 A V H X S+ 0 0 0 -4,-3.2 4,-2.4 2,-0.2 5,-0.2 0.940 105.1 52.1 -58.0 -54.4 40.4 2.5 17.0 330 338 A K H X S+ 0 0 107 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.923 109.8 49.4 -47.5 -53.3 43.0 5.2 16.1 331 339 A E H X S+ 0 0 122 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.870 111.1 48.4 -57.6 -43.6 43.8 5.8 19.7 332 340 A L H X S+ 0 0 16 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.901 108.5 53.9 -67.0 -39.8 44.3 2.2 20.6 333 341 A I H X S+ 0 0 4 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.891 108.1 50.9 -60.2 -40.9 46.5 1.6 17.6 334 342 A E H X S+ 0 0 91 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.933 108.1 51.1 -62.6 -48.0 48.8 4.4 18.7 335 343 A K H X S+ 0 0 116 -4,-2.0 4,-0.6 1,-0.2 -1,-0.2 0.833 113.5 46.8 -53.8 -36.5 49.0 3.0 22.2 336 344 A L H X S+ 0 0 3 -4,-1.8 4,-2.1 1,-0.2 8,-0.3 0.835 104.4 61.3 -74.3 -34.1 50.0 -0.3 20.5 337 345 A R H < S+ 0 0 72 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.735 91.1 70.5 -66.2 -26.7 52.5 1.4 18.2 338 346 A L H < S+ 0 0 137 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.964 119.9 10.1 -56.0 -62.1 54.6 2.6 21.2 339 347 A C H < S+ 0 0 103 -4,-0.6 -2,-0.2 1,-0.2 -1,-0.2 0.705 139.1 41.2 -92.9 -24.4 56.0 -0.8 22.3 340 348 A S X + 0 0 5 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 -0.679 62.8 162.6-128.9 75.6 54.9 -2.9 19.3 341 349 A P H > S+ 0 0 61 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.896 76.7 45.0 -62.3 -45.8 55.4 -0.8 16.1 342 350 A G H > S+ 0 0 25 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.817 113.3 49.9 -71.3 -33.2 55.2 -3.6 13.5 343 351 A F H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.931 107.0 54.4 -70.3 -46.9 52.1 -5.2 15.1 344 352 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 -8,-0.3 -2,-0.2 0.870 106.0 54.3 -52.0 -40.5 50.3 -1.9 15.2 345 353 A A H X S+ 0 0 38 -4,-1.4 4,-1.9 2,-0.2 -1,-0.2 0.919 108.0 47.7 -62.1 -45.0 51.0 -1.6 11.4 346 354 A S H X S+ 0 0 2 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.834 111.9 51.0 -65.4 -34.3 49.4 -5.0 10.7 347 355 A V H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.892 108.2 52.0 -66.8 -42.1 46.4 -4.0 12.9 348 356 A E H X S+ 0 0 88 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.860 108.8 50.7 -61.4 -36.3 46.1 -0.8 10.9 349 357 A T H X S+ 0 0 71 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.882 110.1 50.0 -68.2 -38.8 46.1 -2.8 7.7 350 358 A L H >< S+ 0 0 7 -4,-1.8 3,-0.6 2,-0.2 -2,-0.2 0.943 109.3 50.7 -61.8 -48.4 43.3 -5.0 9.2 351 359 A W H >X S+ 0 0 14 -4,-2.9 4,-3.2 1,-0.2 3,-1.9 0.898 105.5 57.9 -55.5 -41.2 41.3 -1.9 10.1 352 360 A G H 3< S+ 0 0 54 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.832 103.5 51.8 -57.1 -37.0 41.8 -0.7 6.5 353 361 A K T << S+ 0 0 63 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.358 120.1 36.6 -77.0 1.3 40.1 -3.9 5.3 354 362 A T T X4 S+ 0 0 0 -3,-1.9 3,-2.0 -4,-0.2 -2,-0.2 0.727 88.1 93.3-121.7 -52.8 37.2 -3.2 7.6 355 363 A Y T 3< S- 0 0 84 -4,-3.2 -1,-0.0 1,-0.3 -116,-0.0 -0.326 111.9 -11.5 -54.4 121.5 36.5 0.6 7.8 356 364 A K T 3 S+ 0 0 110 1,-0.2 -1,-0.3 -2,-0.1 -4,-0.0 0.731 89.4 177.9 54.9 28.8 33.8 1.5 5.3 357 365 A R < - 0 0 27 -3,-2.0 -1,-0.2 1,-0.2 -4,-0.1 -0.324 25.9-166.6 -58.5 140.0 34.0 -1.9 3.6 358 366 A Q 0 0 149 1,-0.1 -1,-0.2 -100,-0.0 -2,-0.0 0.324 360.0 360.0-103.4 2.2 31.5 -2.2 0.8 359 367 A K 0 0 64 -5,-0.1 -1,-0.1 -312,-0.0 -5,-0.0 0.269 360.0 360.0 -2.3 360.0 32.4 -5.9 0.9 360 !* 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 0.0 361 1 B M > 0 0 142 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -54.2 31.7 -46.9 44.2 362 2 B P H > + 0 0 75 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.937 360.0 45.6 -57.4 -42.0 32.9 -46.3 40.6 363 3 B M H > S+ 0 0 80 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.863 107.5 59.5 -63.6 -39.6 29.6 -44.5 40.0 364 4 B Q H > S+ 0 0 127 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.933 111.1 38.3 -54.1 -55.1 29.9 -42.6 43.3 365 5 B M H >X S+ 0 0 38 -4,-2.0 4,-2.1 1,-0.2 3,-1.3 0.937 112.4 57.1 -63.4 -51.4 33.2 -40.9 42.3 366 6 B F H 3X S+ 0 0 0 -4,-2.0 4,-1.4 1,-0.3 -1,-0.2 0.823 107.9 48.8 -52.3 -37.6 32.2 -40.4 38.6 367 7 B M H 3X S+ 0 0 56 -4,-2.0 4,-1.2 2,-0.2 -1,-0.3 0.664 106.7 55.3 -81.6 -18.0 29.1 -38.4 39.7 368 8 B Q H S+ 0 0 23 -4,-1.8 4,-3.0 -5,-0.3 5,-0.5 0.914 108.4 52.4 -56.3 -43.4 33.1 -19.7 34.0 381 21 B L H X5S+ 0 0 0 -4,-2.0 6,-1.9 1,-0.2 4,-1.0 0.870 113.1 42.9 -55.8 -41.7 30.2 -18.9 31.7 382 22 B E H <5S+ 0 0 83 -4,-1.5 4,-0.2 4,-0.2 -2,-0.2 0.900 122.4 38.2 -74.0 -40.4 28.7 -16.5 34.3 383 23 B L H <5S+ 0 0 138 -4,-3.2 -2,-0.2 1,-0.1 -3,-0.2 0.785 132.1 19.2 -82.1 -34.7 32.1 -14.9 35.3 384 24 B K H <5S+ 0 0 142 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.1 0.453 124.5 46.9-122.5 -6.1 33.9 -14.7 31.9 385 25 B F S < - 0 0 28 -2,-0.3 4,-1.8 1,-0.1 3,-0.3 -0.363 26.8-106.9 -76.4 157.0 22.7 -14.3 32.5 389 29 B P H > S+ 0 0 92 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.822 116.0 58.9 -52.6 -39.4 21.1 -16.8 35.1 390 30 B N H > S+ 0 0 25 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.911 108.9 41.3 -61.1 -46.0 18.4 -17.9 32.6 391 31 B R H > S+ 0 0 7 -3,-0.3 4,-3.0 2,-0.2 -1,-0.2 0.845 113.2 53.1 -72.9 -33.4 20.8 -19.2 30.0 392 32 B V H X S+ 0 0 7 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.926 110.8 49.7 -63.1 -41.6 23.1 -20.8 32.6 393 33 B R H X S+ 0 0 106 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.925 110.5 49.0 -59.1 -48.4 19.9 -22.4 33.8 394 34 B Y H X S+ 0 0 3 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.932 112.7 47.5 -55.6 -50.9 19.1 -23.5 30.2 395 35 B L H X S+ 0 0 0 -4,-3.0 4,-2.9 2,-0.2 -1,-0.2 0.813 107.8 55.0 -64.8 -32.2 22.6 -24.9 29.7 396 36 B R H X S+ 0 0 109 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.909 112.4 43.8 -66.3 -42.0 22.6 -26.8 33.1 397 37 B K H X S+ 0 0 87 -4,-1.8 4,-3.2 2,-0.2 5,-0.3 0.930 113.5 50.9 -66.4 -48.3 19.4 -28.6 32.0 398 38 B M H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.3 0.957 111.8 47.8 -50.9 -54.4 20.8 -29.2 28.5 399 39 B M H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 5,-0.4 0.893 115.1 44.6 -55.3 -48.3 24.0 -30.7 30.0 400 40 B D H X S+ 0 0 54 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.961 116.5 46.0 -61.4 -52.1 22.0 -33.0 32.5 401 41 B T H < S+ 0 0 16 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.904 121.2 37.1 -57.7 -46.9 19.5 -34.1 29.8 402 42 B T H < S+ 0 0 9 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.821 125.1 35.2 -80.3 -32.9 22.1 -34.8 27.1 403 43 B C H < S+ 0 0 0 -4,-2.3 3,-0.3 -5,-0.3 2,-0.3 0.722 109.8 62.9 -94.3 -25.6 25.0 -36.3 29.3 404 44 B L S < S+ 0 0 33 -4,-2.1 3,-0.1 -5,-0.4 0, 0.0 -0.711 76.0 51.6-108.9 156.0 23.1 -38.2 31.9 405 45 B G S S+ 0 0 51 1,-0.4 -1,-0.2 -2,-0.3 2,-0.1 0.314 80.2 107.8 105.7 -5.6 20.8 -41.2 32.0 406 46 B G S S- 0 0 25 -3,-0.3 -1,-0.4 1,-0.1 -3,-0.0 -0.304 85.1-104.8 -88.0-179.3 22.9 -43.6 29.9 407 47 B K - 0 0 96 -2,-0.1 5,-0.1 -3,-0.1 -1,-0.1 0.635 42.4-137.6 -79.0 -13.4 24.8 -46.6 31.4 408 48 B Y > + 0 0 25 3,-0.1 4,-2.7 1,-0.1 5,-0.3 0.776 47.6 153.7 57.2 31.4 28.1 -44.6 31.1 409 49 B N H > S+ 0 0 31 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.901 72.6 47.4 -50.0 -46.7 30.0 -47.7 29.8 410 50 B R H > S+ 0 0 18 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.933 115.3 43.2 -61.8 -49.7 32.5 -45.4 28.0 411 51 B G H > S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 3,-0.4 0.941 115.0 48.5 -63.1 -47.1 33.1 -43.1 31.0 412 52 B L H X S+ 0 0 31 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.776 102.6 62.8 -71.3 -26.7 33.4 -45.9 33.5 413 53 B T H X S+ 0 0 6 -4,-1.7 4,-2.8 -5,-0.3 5,-0.3 0.899 98.7 55.8 -62.3 -43.7 35.8 -47.9 31.4 414 54 B V H X S+ 0 0 0 -4,-1.4 4,-2.4 -3,-0.4 -2,-0.2 0.944 110.0 46.1 -52.6 -50.0 38.4 -45.1 31.6 415 55 B I H X S+ 0 0 6 -4,-1.2 4,-2.5 23,-0.2 5,-0.2 0.949 113.7 48.5 -58.0 -49.6 38.2 -45.3 35.5 416 56 B D H X S+ 0 0 45 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.880 112.7 46.3 -61.2 -42.6 38.4 -49.1 35.4 417 57 B V H X S+ 0 0 0 -4,-2.8 4,-1.3 2,-0.2 -1,-0.2 0.935 112.0 52.4 -65.2 -45.8 41.4 -49.3 33.1 418 58 B A H >< S+ 0 0 0 -4,-2.4 3,-1.9 -5,-0.3 4,-0.5 0.976 110.8 46.2 -53.2 -63.0 43.2 -46.6 35.0 419 59 B E H >< S+ 0 0 81 -4,-2.5 3,-1.2 1,-0.3 4,-0.3 0.856 110.8 54.2 -44.9 -45.4 42.8 -48.4 38.3 420 60 B S H 3< S+ 0 0 33 -4,-2.0 -1,-0.3 1,-0.2 3,-0.2 0.711 111.7 44.4 -65.0 -22.4 43.9 -51.7 36.7 421 61 B L T X< S+ 0 0 5 -3,-1.9 3,-0.9 -4,-1.3 -1,-0.2 0.323 86.2 97.1-104.9 6.6 47.1 -50.1 35.4 422 62 B L T < S+ 0 0 29 -3,-1.2 -1,-0.1 -4,-0.5 -2,-0.1 0.810 71.4 64.5 -67.7 -34.5 47.9 -48.3 38.7 423 63 B S T 3 0 0 117 -4,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.675 360.0 360.0 -68.4 -19.4 50.3 -51.0 40.0 424 64 B L < 0 0 134 -3,-0.9 -1,-0.3 158,-0.1 -2,-0.2 0.782 360.0 360.0 -73.5 360.0 52.8 -50.3 37.2 425 ! 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 0.0 426 73 B D 0 0 155 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 144.6 52.8 -44.4 48.1 427 74 B D - 0 0 139 1,-0.0 0, 0.0 0, 0.0 0, 0.0 0.381 360.0-106.0 -83.8 2.2 50.7 -42.0 50.2 428 75 B G S > S+ 0 0 31 3,-0.0 4,-2.7 4,-0.0 5,-0.2 0.348 92.3 120.0 87.4 -5.0 47.9 -42.7 47.8 429 76 B A H > S+ 0 0 50 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.865 74.4 52.0 -58.3 -40.5 48.3 -39.3 46.2 430 77 B R H > S+ 0 0 54 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.939 109.5 49.3 -56.4 -49.9 49.0 -41.0 42.9 431 78 B R H > S+ 0 0 112 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.913 111.1 49.0 -60.0 -45.8 45.8 -43.0 43.2 432 79 B K H X S+ 0 0 171 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.953 117.0 43.0 -54.7 -50.8 43.8 -39.9 44.0 433 80 B R H X S+ 0 0 86 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.927 114.9 46.0 -64.9 -52.9 45.3 -38.0 41.0 434 81 B V H X S+ 0 0 0 -4,-3.4 4,-2.2 1,-0.2 -1,-0.2 0.906 114.9 47.1 -59.0 -45.1 45.1 -40.8 38.4 435 82 B L H X S+ 0 0 11 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.837 112.3 49.6 -70.9 -34.4 41.5 -41.8 39.3 436 83 B H H X S+ 0 0 54 -4,-1.8 4,-2.0 -5,-0.3 -2,-0.2 0.917 112.5 47.1 -68.6 -43.1 40.4 -38.2 39.2 437 84 B D H X S+ 0 0 1 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.864 111.1 53.9 -60.5 -37.7 42.0 -37.6 35.8 438 85 B A H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.900 107.0 50.6 -65.4 -40.5 40.4 -40.9 34.7 439 86 B C H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.889 110.7 48.8 -61.4 -42.4 37.0 -39.5 35.8 440 87 B V H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.919 112.0 47.7 -64.9 -42.4 37.5 -36.3 33.8 441 88 B C H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.897 108.6 57.5 -64.8 -38.8 38.6 -38.2 30.7 442 89 B G H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.944 108.2 44.8 -52.2 -52.7 35.5 -40.4 31.3 443 90 B W H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 5,-0.3 0.802 106.1 61.2 -65.7 -28.5 33.3 -37.3 31.1 444 91 B M H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.967 110.5 40.9 -60.8 -54.4 35.2 -36.0 28.0 445 92 B I H X S+ 0 0 0 -4,-2.3 4,-3.4 2,-0.2 -2,-0.2 0.897 115.6 50.5 -58.8 -44.6 34.1 -39.2 26.2 446 93 B E H X S+ 0 0 1 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.876 114.1 44.4 -61.0 -39.7 30.5 -39.0 27.7 447 94 B F H X S+ 0 0 0 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.826 112.8 52.0 -70.9 -35.0 30.2 -35.3 26.7 448 95 B L H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.3 -2,-0.2 0.976 111.3 47.6 -62.8 -51.9 31.7 -36.3 23.2 449 96 B Q H X S+ 0 0 20 -4,-3.4 4,-2.5 1,-0.2 -2,-0.2 0.906 108.9 53.7 -48.7 -48.9 29.0 -39.0 23.1 450 97 B A H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.893 107.8 51.2 -58.2 -44.0 26.3 -36.5 24.1 451 98 B H H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 5,-0.2 0.942 110.6 48.3 -51.7 -52.3 27.4 -34.2 21.3 452 99 B Y H X S+ 0 0 24 -4,-2.2 4,-3.3 1,-0.2 -2,-0.2 0.911 112.5 48.0 -61.5 -42.0 27.2 -37.1 18.8 453 100 B L H X S+ 0 0 17 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19.7 -47.6 6.9 632 279 B C + 0 0 8 -104,-0.3 -1,-0.1 -3,-0.1 2,-0.1 -0.622 55.2 169.3 -81.2 73.4 22.5 -50.0 5.9 633 280 B S > - 0 0 5 -2,-1.6 4,-2.3 -7,-0.1 5,-0.2 -0.380 51.3-108.4 -85.3 166.4 22.0 -52.1 9.1 634 281 B W H > S+ 0 0 11 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.892 120.6 54.3 -57.9 -38.9 23.5 -55.5 9.9 635 282 B L H > S+ 0 0 3 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.940 109.0 45.6 -63.0 -48.4 20.0 -57.0 9.4 636 283 B A H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.910 115.9 44.5 -62.4 -47.4 19.6 -55.6 5.9 637 284 B V H X S+ 0 0 2 -4,-2.3 4,-1.6 2,-0.2 -82,-0.2 0.881 115.1 48.3 -66.7 -36.9 23.1 -56.6 4.6 638 285 B T H X S+ 0 0 21 -4,-2.3 4,-0.9 -5,-0.2 -2,-0.2 0.826 114.0 47.9 -72.2 -31.5 22.8 -60.1 6.2 639 286 B F H X S+ 0 0 0 -4,-2.0 4,-1.7 -5,-0.2 3,-0.4 0.932 111.1 49.0 -70.9 -48.6 19.4 -60.6 4.7 640 287 B L H < S+ 0 0 31 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.829 105.8 57.7 -65.4 -32.2 20.3 -59.4 1.2 641 288 B A H < S+ 0 0 89 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.861 120.4 26.4 -67.5 -35.6 23.4 -61.6 1.0 642 289 B K H < S+ 0 0 93 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.510 97.2 112.5-105.0 -10.7 21.5 -64.9 1.6 643 290 B A < - 0 0 18 -4,-1.7 2,-0.1 1,-0.1 -4,-0.0 -0.299 64.0-119.2 -72.1 149.9 18.0 -64.0 0.3 644 291 B S > - 0 0 59 1,-0.1 4,-2.6 -2,-0.0 5,-0.2 -0.301 34.3-101.7 -71.9 165.5 16.3 -65.4 -2.8 645 292 B S H > S+ 0 0 110 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.877 125.6 52.9 -54.1 -42.9 15.3 -63.2 -5.7 646 293 B A H > S+ 0 0 72 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.953 110.1 46.7 -59.0 -52.1 11.7 -63.4 -4.4 647 294 B Q H > S+ 0 0 47 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.859 111.0 52.7 -58.2 -40.4 12.8 -62.2 -0.9 648 295 B V H X S+ 0 0 33 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.904 108.6 50.7 -61.2 -45.7 14.9 -59.5 -2.5 649 296 B A H X S+ 0 0 59 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.961 111.4 46.1 -55.9 -54.3 11.9 -58.2 -4.5 650 297 B E H X S+ 0 0 71 -4,-2.2 4,-0.7 1,-0.2 -2,-0.2 0.865 113.0 51.0 -62.4 -38.4 9.6 -58.1 -1.4 651 298 B F H >X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 3,-1.5 0.954 110.3 48.8 -56.9 -53.1 12.4 -56.3 0.6 652 299 B K H 3< S+ 0 0 92 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.784 108.6 54.8 -61.6 -30.8 12.9 -53.7 -2.1 653 300 B A H 3< S+ 0 0 64 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.683 121.5 28.3 -72.1 -19.8 9.1 -53.2 -2.2 654 301 B N H X< S+ 0 0 18 -3,-1.5 3,-0.6 -4,-0.7 -2,-0.2 0.604 91.3 100.9-122.8 -17.4 9.0 -52.4 1.5 655 302 B Y T 3< S+ 0 0 17 -4,-2.5 -27,-0.1 1,-0.2 3,-0.1 -0.412 79.1 23.6 -78.0 149.0 12.3 -50.9 2.8 656 303 B G T 3 S+ 0 0 31 -29,-1.2 2,-0.4 1,-0.2 -1,-0.2 0.727 91.1 115.6 77.4 24.0 12.8 -47.2 3.5 657 304 B S < - 0 0 37 -3,-0.6 -1,-0.2 2,-0.2 -28,-0.1 -0.986 64.2-139.9-126.0 139.0 9.2 -46.2 4.0 658 305 B G + 0 0 61 -2,-0.4 -30,-0.1 -30,-0.2 -1,-0.1 0.618 65.8 124.1 -65.4 -15.7 7.5 -44.9 7.2 659 306 B D > - 0 0 74 1,-0.1 4,-1.7 -31,-0.1 -2,-0.2 -0.224 61.0-139.6 -51.0 133.2 4.5 -47.1 6.3 660 307 B S H > S+ 0 0 98 2,-0.2 4,-1.1 1,-0.2 -1,-0.1 0.801 96.8 42.7 -73.4 -36.5 3.6 -49.4 9.2 661 308 B E H > S+ 0 0 123 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.836 111.3 56.3 -80.6 -33.8 2.7 -52.6 7.4 662 309 B K H > S+ 0 0 78 2,-0.2 4,-1.8 1,-0.2 3,-0.3 0.912 109.1 47.4 -57.5 -43.2 5.7 -52.2 5.0 663 310 B V H X S+ 0 0 6 -4,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.834 110.0 53.0 -68.2 -31.4 8.0 -52.0 8.1 664 311 B A H X S+ 0 0 32 -4,-1.1 4,-1.4 2,-0.2 -1,-0.2 0.706 105.6 54.6 -75.0 -22.0 6.2 -55.1 9.5 665 312 B T H X S+ 0 0 11 -4,-1.4 4,-3.2 -3,-0.3 -2,-0.2 0.920 105.8 51.3 -73.0 -47.6 6.9 -57.0 6.2 666 313 B V H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.887 110.2 51.2 -53.3 -41.7 10.6 -56.2 6.5 667 314 B R H X S+ 0 0 90 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.869 111.4 45.9 -65.9 -39.7 10.4 -57.7 10.1 668 315 B R H X S+ 0 0 90 -4,-1.4 4,-3.3 2,-0.2 5,-0.3 0.952 110.3 53.6 -66.6 -49.5 8.7 -60.8 8.9 669 316 B L H X S+ 0 0 0 -4,-3.2 4,-1.7 1,-0.2 -2,-0.2 0.881 109.0 50.5 -50.4 -42.7 11.2 -61.2 6.0 670 317 B Y H <>S+ 0 0 1 -4,-2.1 5,-1.9 -5,-0.2 6,-0.3 0.893 113.2 44.7 -62.9 -42.1 14.0 -61.0 8.6 671 318 B E H ><5S+ 0 0 128 -4,-1.7 3,-1.4 1,-0.2 -2,-0.2 0.915 112.2 51.6 -69.2 -42.9 12.4 -63.7 10.8 672 319 B E H 3<5S+ 0 0 116 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.803 107.7 52.9 -62.9 -32.8 11.6 -65.9 7.8 673 320 B A T 3<5S- 0 0 11 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.406 113.8-119.9 -84.8 1.4 15.3 -65.7 6.7 674 321 B D T <>5 + 0 0 94 -3,-1.4 4,-1.5 -4,-0.1 -3,-0.2 0.934 54.6 157.9 59.5 53.2 16.5 -66.8 10.2 675 322 B L H > S+ 0 0 81 -6,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.819 106.0 50.9 -59.6 -31.1 18.3 -64.3 14.7 677 324 B G H > S+ 0 0 25 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.902 109.6 48.4 -71.5 -43.6 20.0 -67.6 13.9 678 325 B D H X S+ 0 0 41 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.867 109.7 53.9 -61.1 -37.4 22.7 -65.8 11.9 679 326 B Y H X S+ 0 0 24 -4,-2.5 4,-3.2 2,-0.2 5,-0.2 0.928 106.2 51.0 -65.3 -46.7 23.1 -63.4 14.9 680 327 B V H X S+ 0 0 87 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.924 112.6 46.4 -54.5 -50.4 23.7 -66.2 17.4 681 328 B A H X S+ 0 0 63 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.870 112.8 51.0 -60.3 -40.7 26.4 -67.7 15.1 682 329 B Y H X S+ 0 0 36 -4,-2.4 4,-2.6 1,-0.2 3,-0.3 0.966 108.4 50.6 -59.2 -53.7 27.9 -64.2 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41.7 -65.5 22.1 693 340 B L H X S+ 0 0 21 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.860 108.5 56.6 -68.0 -36.6 42.8 -61.8 21.9 694 341 B I H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.901 107.0 49.1 -62.1 -41.5 42.2 -61.2 25.6 695 342 B E H X S+ 0 0 98 -4,-1.9 4,-1.2 2,-0.2 -1,-0.2 0.896 107.8 54.3 -64.0 -40.4 44.6 -64.1 26.5 696 343 B K H < S+ 0 0 116 -4,-1.6 4,-0.5 1,-0.2 3,-0.3 0.875 111.5 45.9 -57.5 -40.3 47.2 -62.7 24.1 697 344 B L H >X S+ 0 0 3 -4,-2.0 4,-2.0 1,-0.2 3,-0.6 0.859 105.0 61.9 -65.8 -38.2 46.9 -59.4 26.1 698 345 B R H 3< S+ 0 0 72 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.756 87.7 74.1 -64.2 -26.7 47.0 -61.2 29.4 699 346 B L T 3< S+ 0 0 142 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.1 0.895 121.6 4.4 -56.7 -49.8 50.6 -62.6 28.7 700 347 B C T <4 S+ 0 0 115 -3,-0.6 -1,-0.2 -4,-0.5 -2,-0.2 0.433 137.9 46.8-116.5 -5.3 52.4 -59.2 29.3 701 348 B S X + 0 0 8 -4,-2.0 4,-2.6 -5,-0.1 5,-0.2 -0.444 57.8 157.5-133.4 65.9 49.4 -57.1 30.4 702 349 B P H > S+ 0 0 85 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.869 77.0 48.9 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