==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 24-JUL-04 1WN0 . COMPND 2 MOLECULE: HISTIDINE-CONTAINING PHOSPHOTRANSFER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ZEA MAYS; . AUTHOR H.SUGAWARA,Y.KAWANO,T.HATAKEYAMA,T.YAMAYA,N.KAMIYA,H.SAKAKIB . 531 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26716.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 461 86.8 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 . 2 0.4 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 . 14 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 377 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.4 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 0 0 2 0 3 1 2 0 2 0 2 2 0 3 1 0 0 0 0 4 0 0 0 0 1 1 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 . 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 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 9 A Q > 0 0 178 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-103.5 67.0 29.1 11.8 2 10 A L H > + 0 0 26 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.876 360.0 59.8 -61.3 -43.0 69.4 27.1 14.1 3 11 A N H > S+ 0 0 68 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.850 107.5 43.5 -52.8 -38.9 67.5 24.1 12.8 4 12 A A H > S+ 0 0 61 2,-0.2 4,-1.9 3,-0.2 -1,-0.2 0.823 111.8 52.4 -82.0 -36.1 68.5 25.0 9.2 5 13 A L H X S+ 0 0 26 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.932 112.4 47.6 -55.9 -51.7 72.2 25.8 10.2 6 14 A L H X S+ 0 0 11 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.926 111.0 49.0 -58.4 -47.4 72.4 22.4 11.8 7 15 A S H X S+ 0 0 71 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.874 110.6 52.0 -62.2 -38.8 70.8 20.5 8.9 8 16 A S H X S+ 0 0 55 -4,-1.9 4,-2.4 1,-0.2 6,-0.3 0.880 105.9 55.1 -59.9 -39.7 73.3 22.3 6.6 9 17 A M H <>S+ 0 0 0 -4,-1.9 5,-1.6 1,-0.2 6,-1.0 0.931 116.4 35.8 -64.4 -42.3 76.1 21.2 8.8 10 18 A F H ><5S+ 0 0 56 -4,-1.8 3,-0.8 3,-0.2 -2,-0.2 0.859 115.3 54.3 -76.5 -37.7 75.1 17.4 8.5 11 19 A A H 3<5S+ 0 0 89 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.898 112.3 43.8 -70.3 -39.2 74.0 17.6 4.9 12 20 A S T 3<5S- 0 0 60 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.466 114.7-122.0 -77.0 -3.1 77.3 19.0 3.9 13 21 A G T < 5S+ 0 0 20 -3,-0.8 72,-0.3 2,-0.2 -3,-0.2 0.623 72.6 130.5 71.1 15.4 79.1 16.5 6.1 14 22 A L S > - 0 0 48 66,-1.6 4,-1.0 -2,-0.4 3,-0.5 -0.290 46.7 -67.4 -99.8-169.8 78.5 13.3 11.3 17 25 A E H 3> S+ 0 0 117 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.760 124.7 65.0 -52.9 -33.8 76.0 11.3 13.7 18 26 A Q H >> S+ 0 0 4 1,-0.2 4,-1.8 2,-0.2 3,-0.8 0.986 100.2 53.0 -57.2 -46.5 78.1 11.5 16.8 19 27 A F H <> S+ 0 0 0 -3,-0.5 4,-1.8 1,-0.3 5,-0.2 0.864 103.5 57.8 -52.5 -38.1 77.5 15.3 16.6 20 28 A Q H 3X S+ 0 0 81 -4,-1.0 4,-1.7 1,-0.2 -1,-0.3 0.879 103.7 51.9 -53.0 -45.4 73.7 14.6 16.5 21 29 A Q H < S+ 0 0 26 -4,-1.1 3,-0.8 -3,-0.3 6,-0.4 0.908 107.1 47.3 -64.5 -45.3 71.9 16.6 24.9 26 34 A Q H 3< S+ 0 0 63 -4,-0.8 -2,-0.2 1,-0.2 -1,-0.2 0.870 107.1 57.7 -67.6 -34.4 71.7 20.5 24.5 27 35 A E T 3< S+ 0 0 78 -4,-2.1 2,-0.4 3,-0.1 -1,-0.2 0.584 96.8 73.4 -75.9 -11.7 68.1 20.3 23.3 28 36 A D S X S- 0 0 68 -3,-0.8 3,-0.8 -4,-0.5 0, 0.0 -0.846 88.3-127.8 -99.8 132.9 67.1 18.5 26.6 29 37 A G T 3 S+ 0 0 79 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.871 88.9 76.5 -36.7 -46.1 67.1 20.7 29.7 30 38 A G T 3 S+ 0 0 56 1,-0.2 -1,-0.2 2,-0.1 -4,-0.1 0.111 82.8 53.1 -89.4 13.6 69.3 18.7 31.9 31 39 A T S X S- 0 0 14 -3,-0.8 3,-1.6 -2,-0.4 4,-0.5 -0.430 72.6-168.7-132.0 61.1 73.0 19.1 30.9 32 40 A P T 3 - 0 0 111 0, 0.0 -2,-0.1 0, 0.0 -6,-0.0 -0.320 67.2 -0.1 -72.8 135.2 73.6 22.8 30.8 33 41 A G T 3> S+ 0 0 39 -7,-0.1 4,-2.1 -2,-0.1 5,-0.2 0.285 99.0 109.8 84.3 -3.9 76.8 24.2 29.3 34 42 A F H <> S+ 0 0 1 -3,-1.6 4,-2.6 2,-0.2 5,-0.2 0.961 78.5 42.4 -68.0 -59.5 78.1 20.7 28.3 35 43 A V H > S+ 0 0 0 -4,-0.5 4,-2.6 1,-0.2 5,-0.2 0.933 116.5 49.7 -48.2 -51.3 77.7 20.9 24.6 36 44 A A H > S+ 0 0 31 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.813 111.1 48.8 -60.9 -41.3 79.1 24.5 24.6 37 45 A E H X S+ 0 0 54 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.894 112.3 47.8 -66.4 -42.4 82.1 23.6 26.7 38 46 A V H X S+ 0 0 3 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.925 115.5 46.1 -65.0 -45.5 83.0 20.5 24.6 39 47 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.2 -1,-0.2 0.896 112.6 47.4 -64.4 -46.2 82.6 22.5 21.4 40 48 A T H X S+ 0 0 62 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.917 109.0 55.7 -59.5 -44.8 84.6 25.5 22.6 41 49 A L H X S+ 0 0 9 -4,-2.5 4,-3.5 2,-0.2 5,-0.4 0.921 108.1 49.7 -59.5 -37.3 87.3 23.1 23.8 42 50 A F H X S+ 0 0 1 -4,-2.0 4,-3.6 2,-0.2 5,-0.4 0.982 110.5 48.7 -66.0 -49.7 87.4 21.7 20.2 43 51 A C H X S+ 0 0 15 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.929 117.6 42.0 -56.2 -42.2 87.7 25.2 18.8 44 52 A D H X S+ 0 0 100 -4,-3.1 4,-2.1 1,-0.2 5,-0.2 0.948 118.8 43.4 -73.1 -44.7 90.6 26.1 21.3 45 53 A D H X S+ 0 0 14 -4,-3.5 4,-3.1 -5,-0.2 5,-0.3 0.943 114.7 48.1 -62.0 -54.2 92.4 22.8 21.0 46 54 A A H X S+ 0 0 0 -4,-3.6 4,-2.7 -5,-0.4 5,-0.2 0.942 113.7 49.7 -53.2 -43.2 92.2 22.5 17.2 47 55 A D H X S+ 0 0 58 -4,-1.7 4,-1.9 -5,-0.4 -1,-0.2 0.928 113.4 43.4 -64.0 -42.6 93.4 26.1 16.9 48 56 A R H X S+ 0 0 104 -4,-2.1 4,-2.9 2,-0.2 5,-0.3 0.951 114.2 51.0 -75.2 -41.1 96.4 25.7 19.2 49 57 A I H X S+ 0 0 2 -4,-3.1 4,-3.0 -5,-0.2 -2,-0.2 0.946 108.4 51.7 -64.0 -40.0 97.4 22.3 17.7 50 58 A I H X S+ 0 0 2 -4,-2.7 4,-2.1 -5,-0.3 -1,-0.2 0.917 110.8 48.7 -59.3 -45.0 97.3 23.7 14.1 51 59 A S H X S+ 0 0 68 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.898 111.9 47.9 -62.0 -46.1 99.5 26.6 15.1 52 60 A E H X S+ 0 0 59 -4,-2.9 4,-3.1 1,-0.2 -2,-0.2 0.923 111.3 50.9 -59.6 -43.2 101.9 24.3 16.7 53 61 A L H X S+ 0 0 0 -4,-3.0 4,-2.4 -5,-0.3 -2,-0.2 0.876 108.2 53.3 -57.5 -39.5 101.9 22.0 13.7 54 62 A A H < S+ 0 0 37 -4,-2.1 4,-0.4 2,-0.2 -1,-0.2 0.908 111.2 45.5 -63.8 -45.3 102.6 25.0 11.4 55 63 A A H >< S+ 0 0 55 -4,-1.9 3,-1.5 1,-0.2 4,-0.3 0.946 112.7 50.5 -66.1 -44.0 105.7 26.1 13.4 56 64 A L H >< S+ 0 0 31 -4,-3.1 3,-1.5 1,-0.2 7,-0.2 0.946 107.7 53.7 -60.7 -42.6 107.0 22.5 13.6 57 65 A L T 3< S+ 0 0 3 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.559 105.9 54.6 -70.4 -2.8 106.7 22.1 9.8 58 66 A D T < S+ 0 0 130 -3,-1.5 -1,-0.2 -4,-0.4 -2,-0.2 0.317 82.4 107.5-108.1 9.7 108.7 25.2 9.1 59 67 A Q S < S- 0 0 92 -3,-1.5 3,-0.1 -4,-0.3 -3,-0.0 -0.501 81.2-112.9 -87.2 158.3 111.9 24.3 11.1 60 68 A P S S+ 0 0 108 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.903 109.7 29.6 -52.9 -56.2 115.0 23.3 9.4 61 69 A I S S- 0 0 154 2,-0.0 2,-0.5 -5,-0.0 -3,-0.1 -0.970 90.4-138.9-106.0 120.2 114.9 19.7 10.7 62 70 A V - 0 0 14 -2,-0.5 2,-1.2 -5,-0.1 3,-0.1 -0.713 3.6-139.4 -83.9 126.2 111.3 18.6 11.2 63 71 A D > - 0 0 77 -2,-0.5 4,-1.9 -7,-0.2 3,-0.3 -0.706 24.7-178.8 -80.0 93.9 110.5 16.5 14.3 64 72 A F H > S+ 0 0 24 -2,-1.2 4,-2.2 1,-0.2 -1,-0.2 0.778 75.7 57.6 -73.4 -26.4 108.1 14.1 12.6 65 73 A D H > S+ 0 0 126 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.877 108.7 47.8 -65.7 -45.1 107.2 12.1 15.7 66 74 A K H > S+ 0 0 95 -3,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.868 109.3 51.5 -62.3 -41.7 106.0 15.3 17.4 67 75 A V H X S+ 0 0 0 -4,-1.9 4,-3.3 2,-0.2 5,-0.2 0.942 112.5 49.2 -58.6 -47.8 103.9 16.3 14.3 68 76 A D H X S+ 0 0 50 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.958 110.0 47.6 -56.5 -51.5 102.4 12.9 14.5 69 77 A A H X S+ 0 0 53 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.955 113.3 50.4 -58.1 -39.2 101.7 13.1 18.2 70 78 A Y H X S+ 0 0 50 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.961 111.8 47.8 -64.8 -42.5 100.1 16.7 17.6 71 79 A V H X S+ 0 0 0 -4,-3.3 4,-2.9 2,-0.2 -1,-0.2 0.892 105.8 57.3 -61.4 -44.7 98.0 15.3 14.8 72 80 A H H X S+ 0 0 85 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.942 108.6 47.2 -53.2 -41.9 96.9 12.4 17.0 73 81 A Q H X S+ 0 0 74 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.843 110.6 51.7 -61.6 -40.2 95.6 15.0 19.5 74 82 A L H X S+ 0 0 1 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.878 107.8 53.3 -67.1 -37.1 93.9 16.9 16.7 75 83 A K H X S+ 0 0 64 -4,-2.9 4,-3.2 2,-0.2 -2,-0.2 0.950 109.8 46.4 -58.1 -51.5 92.3 13.6 15.7 76 84 A G H X S+ 0 0 19 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.913 114.6 49.1 -60.4 -38.4 90.9 12.9 19.2 77 85 A S H X S+ 0 0 1 -4,-2.1 4,-0.7 2,-0.2 -1,-0.2 0.950 113.0 44.8 -66.6 -40.8 89.6 16.5 19.4 78 86 A S H ><>S+ 0 0 0 -4,-2.6 5,-2.7 1,-0.2 3,-1.0 0.930 111.5 55.1 -75.0 -34.7 87.9 16.4 16.1 79 87 A A H ><5S+ 0 0 10 -4,-3.2 3,-1.6 1,-0.2 -1,-0.2 0.896 97.7 64.9 -65.2 -35.2 86.5 12.9 17.0 80 88 A S H 3<5S+ 0 0 2 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.735 112.9 31.2 -57.8 -30.4 84.9 14.3 20.2 81 89 A V T <<5S- 0 0 0 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.175 114.5-109.7-110.3 15.2 82.5 16.6 18.3 82 90 A G T < 5 + 0 0 3 -3,-1.6 2,-2.3 1,-0.2 -66,-1.6 0.760 56.4 163.0 62.8 27.8 82.1 14.4 15.2 83 91 A A >< + 0 0 0 -5,-2.7 4,-2.9 -6,-0.2 -68,-0.2 -0.469 13.2 174.3 -73.9 74.1 84.2 16.8 12.9 84 92 A Q H > + 0 0 78 -2,-2.3 4,-2.4 -70,-0.3 -1,-0.2 0.783 65.9 53.0 -63.6 -34.0 84.5 13.9 10.5 85 93 A K H > S+ 0 0 86 -71,-0.5 4,-2.5 -72,-0.3 -1,-0.2 0.956 113.6 45.2 -73.8 -41.5 86.3 15.7 7.6 86 94 A V H > S+ 0 0 3 -72,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.962 113.3 50.2 -57.5 -49.6 89.0 17.1 10.0 87 95 A K H X S+ 0 0 66 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.949 109.4 51.7 -57.2 -46.4 89.4 13.6 11.6 88 96 A F H X S+ 0 0 108 -4,-2.4 4,-0.6 1,-0.2 -1,-0.2 0.914 109.6 49.7 -59.8 -44.5 89.7 12.0 8.2 89 97 A T H >< S+ 0 0 11 -4,-2.5 3,-1.4 1,-0.2 4,-0.3 0.894 104.7 57.3 -51.4 -45.4 92.4 14.5 7.3 90 98 A C H >< S+ 0 0 0 -4,-2.3 3,-1.6 1,-0.3 4,-0.2 0.896 100.1 60.7 -57.0 -38.7 94.3 13.8 10.5 91 99 A M H >< S+ 0 0 92 -4,-2.0 3,-0.7 1,-0.3 4,-0.3 0.693 93.3 62.6 -66.2 -20.0 94.4 10.2 9.5 92 100 A Q T S+ 0 0 0 -3,-1.6 4,-3.4 -4,-0.3 5,-0.3 0.660 78.0 74.6 -75.1 -18.8 99.4 12.2 8.2 94 102 A R H <> S+ 0 0 71 -3,-0.7 4,-3.0 -4,-0.2 5,-0.2 0.972 99.3 38.3 -65.7 -50.1 100.5 8.8 9.1 95 103 A Q H > S+ 0 0 119 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.922 117.1 55.6 -65.5 -34.9 101.9 7.8 5.9 96 104 A L H <>S+ 0 0 32 -4,-0.9 5,-2.5 2,-0.2 -2,-0.2 0.891 111.3 41.5 -63.3 -43.1 103.2 11.4 5.5 97 105 A C H ><5S+ 0 0 9 -4,-3.4 3,-1.2 2,-0.2 -1,-0.2 0.880 110.4 58.5 -71.3 -39.3 105.1 11.3 8.8 98 106 A Q H 3<5S+ 0 0 142 -4,-3.0 -2,-0.2 -5,-0.3 -1,-0.2 0.942 113.6 40.1 -50.5 -46.4 106.3 7.7 8.1 99 107 A D T 3<5S- 0 0 98 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.530 105.5-129.1 -82.5 -6.4 107.8 9.1 5.0 100 108 A K T < 5 + 0 0 131 -3,-1.2 2,-1.0 1,-0.2 -3,-0.2 0.900 46.5 167.7 56.3 44.9 109.1 12.3 6.5 101 109 A N >< + 0 0 59 -5,-2.5 4,-2.1 1,-0.2 -1,-0.2 -0.759 17.5 179.1-100.8 89.3 107.3 14.1 3.7 102 110 A R H > S+ 0 0 76 -2,-1.0 4,-2.4 1,-0.2 5,-0.3 0.929 80.1 57.3 -57.1 -41.5 107.3 17.8 4.7 103 111 A D H > S+ 0 0 126 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.946 109.8 44.1 -55.9 -48.1 105.6 18.7 1.4 104 112 A G H > S+ 0 0 9 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.851 110.6 52.8 -71.6 -35.0 102.8 16.5 2.1 105 113 A C H X S+ 0 0 0 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.869 109.2 51.3 -65.2 -36.1 102.4 17.4 5.8 106 114 A I H X S+ 0 0 78 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.864 112.5 46.0 -71.0 -37.0 102.2 21.1 4.8 107 115 A M H X S+ 0 0 130 -4,-1.9 4,-1.9 -5,-0.3 -2,-0.2 0.932 113.8 47.0 -71.0 -47.7 99.5 20.4 2.3 108 116 A A H X S+ 0 0 12 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.928 109.6 55.4 -66.2 -34.3 97.6 18.2 4.6 109 117 A L H X S+ 0 0 6 -4,-3.0 4,-2.9 1,-0.2 -1,-0.2 0.909 107.8 48.4 -56.7 -43.0 97.9 20.9 7.3 110 118 A A H X S+ 0 0 40 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.820 110.6 51.2 -65.0 -35.6 96.4 23.5 4.9 111 119 A V H X S+ 0 0 65 -4,-1.9 4,-2.2 2,-0.2 5,-0.2 0.932 112.8 46.1 -63.0 -45.9 93.6 21.1 4.1 112 120 A V H X S+ 0 0 0 -4,-2.9 4,-3.1 2,-0.2 -2,-0.2 0.931 110.4 53.7 -63.4 -38.9 92.9 20.6 7.8 113 121 A R H X S+ 0 0 67 -4,-2.9 4,-2.9 -5,-0.2 5,-0.2 0.937 110.6 46.5 -57.4 -47.4 93.2 24.4 8.5 114 122 A N H X S+ 0 0 108 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.925 114.2 46.0 -62.7 -44.4 90.5 25.1 5.8 115 123 A E H X S+ 0 0 53 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.846 115.0 49.3 -69.7 -37.3 88.1 22.4 7.0 116 124 A F H X S+ 0 0 0 -4,-3.1 4,-3.9 -5,-0.2 5,-0.3 0.990 108.7 49.5 -61.9 -54.1 88.7 23.5 10.6 117 125 A Y H X S+ 0 0 85 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.909 112.8 50.8 -54.3 -41.2 88.1 27.3 9.9 118 126 A D H X S+ 0 0 68 -4,-2.2 4,-1.7 -5,-0.2 -1,-0.2 0.937 114.8 40.8 -63.0 -46.2 84.8 26.3 8.1 119 127 A L H X S+ 0 0 2 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.950 111.9 55.6 -73.3 -43.8 83.5 24.1 10.9 120 128 A R H X S+ 0 0 55 -4,-3.9 4,-2.0 -5,-0.2 -1,-0.2 0.914 106.2 51.3 -47.0 -49.6 84.6 26.5 13.5 121 129 A N H X S+ 0 0 81 -4,-2.1 4,-1.8 -5,-0.3 5,-0.2 0.856 111.0 48.3 -59.7 -40.8 82.6 29.4 11.9 122 130 A K H X S+ 0 0 50 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.908 111.5 49.2 -60.9 -47.1 79.5 27.2 11.8 123 131 A F H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.809 108.0 55.6 -63.3 -32.8 79.9 26.2 15.4 124 132 A Q H X S+ 0 0 83 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.948 110.9 41.4 -74.0 -47.2 80.4 29.8 16.5 125 133 A T H X S+ 0 0 62 -4,-1.8 4,-2.9 1,-0.2 5,-0.3 0.890 110.8 61.3 -61.6 -37.5 77.1 31.0 14.9 126 134 A M H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.964 109.9 39.3 -46.4 -54.4 75.6 27.8 16.3 127 135 A L H X S+ 0 0 39 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.782 114.0 53.5 -72.6 -30.4 76.4 28.9 19.8 128 136 A Q H < S+ 0 0 134 -4,-1.9 3,-0.3 2,-0.2 -1,-0.2 0.970 106.7 51.0 -73.0 -51.6 75.6 32.5 19.3 129 137 A L H < S+ 0 0 99 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.954 109.4 53.3 -46.3 -49.6 72.1 31.7 18.0 130 138 A E H < 0 0 58 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.889 360.0 360.0 -57.1 -42.5 71.6 29.5 21.1 131 139 A Q < 0 0 211 -4,-1.8 -3,-0.0 -3,-0.3 0, 0.0 0.148 360.0 360.0 -57.4 360.0 72.6 32.5 23.6 132 !* 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 0.0 133 11 B N > 0 0 126 0, 0.0 4,-1.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 135.6 67.5 -24.0 8.8 134 12 B A H > + 0 0 72 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.593 360.0 68.0-104.5 -18.8 70.2 -23.9 6.1 135 13 B L H > S+ 0 0 40 2,-0.2 4,-1.7 3,-0.1 -1,-0.2 0.865 106.1 46.5 -59.6 -42.4 68.0 -24.7 3.0 136 14 B L H > S+ 0 0 33 2,-0.2 4,-1.9 1,-0.2 3,-0.5 0.987 108.2 53.1 -63.8 -67.3 66.5 -21.2 3.7 137 15 B S H X S+ 0 0 78 -4,-1.3 4,-2.5 1,-0.2 -2,-0.2 0.838 112.4 47.1 -24.1 -61.5 69.9 -19.4 4.1 138 16 B S H X S+ 0 0 50 -4,-1.6 4,-3.1 2,-0.2 6,-0.3 0.835 105.1 57.2 -57.1 -47.1 71.0 -20.9 0.7 139 17 B M H <>S+ 0 0 0 -4,-1.7 5,-1.6 -3,-0.5 6,-1.0 0.949 116.4 37.0 -52.1 -48.6 67.8 -19.9 -1.2 140 18 B F H ><5S+ 0 0 42 -4,-1.9 3,-0.7 2,-0.2 -2,-0.2 0.910 115.3 55.3 -69.7 -47.3 68.3 -16.2 -0.3 141 19 B A H 3<5S+ 0 0 83 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.938 112.8 40.4 -45.8 -57.3 72.0 -16.5 -0.6 142 20 B S T 3<5S- 0 0 65 -4,-3.1 -1,-0.2 -5,-0.1 -2,-0.2 0.470 113.6-119.2 -83.4 -5.1 71.9 -17.8 -4.2 143 21 B G T < 5S+ 0 0 18 -3,-0.7 69,-0.3 -4,-0.4 -3,-0.2 0.607 74.7 127.6 85.6 12.0 69.1 -15.4 -5.0 144 22 B L S - 0 0 49 63,-1.3 4,-0.9 -2,-0.4 3,-0.5 -0.296 50.6 -53.8-115.9-157.9 64.8 -12.2 -2.3 147 25 B E H > S+ 0 0 109 1,-0.2 4,-1.7 2,-0.2 3,-0.2 0.817 124.1 63.4 -66.2 -38.6 63.3 -10.2 0.6 148 26 B Q H > S+ 0 0 5 1,-0.2 4,-1.3 2,-0.2 3,-0.3 0.965 102.1 57.4 -44.6 -44.8 59.6 -10.5 0.0 149 27 B F H >> S+ 0 0 0 -3,-0.5 4,-2.2 1,-0.3 3,-0.9 0.872 100.0 52.7 -63.2 -38.7 60.2 -14.2 0.6 150 28 B Q H 3X S+ 0 0 103 -4,-0.9 4,-2.8 1,-0.3 -1,-0.3 0.922 106.4 57.4 -58.8 -44.0 61.7 -13.7 4.2 151 29 B Q H 3X S+ 0 0 31 -4,-1.7 4,-0.9 -3,-0.3 -1,-0.3 0.834 106.8 47.4 -51.4 -37.9 58.6 -11.8 5.0 152 30 B L H < S+ 0 0 25 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.870 99.8 64.1 -66.8 -37.8 58.5 -17.2 6.1 154 32 B M H 3< S+ 0 0 167 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.938 97.2 58.9 -46.0 -49.4 58.4 -15.1 9.2 155 33 B L H 3< 0 0 52 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.2 0.769 360.0 360.0 -49.9 -39.7 54.6 -15.7 9.1 156 34 B Q << 0 0 107 -3,-1.0 -2,-0.2 -4,-0.7 -1,-0.2 0.815 360.0 360.0 -80.4 360.0 55.3 -19.5 9.4 157 ! 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 0.0 158 39 B T > 0 0 56 0, 0.0 3,-1.3 0, 0.0 4,-0.5 0.000 360.0 360.0 360.0 60.4 48.6 -18.1 10.4 159 40 B P T 3 - 0 0 123 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 -0.393 360.0 -2.0 -57.6 125.8 48.7 -21.9 9.9 160 41 B G T 3> S+ 0 0 35 -2,-0.1 4,-2.0 1,-0.1 5,-0.1 0.362 95.6 114.1 85.3 -1.4 49.1 -23.1 6.3 161 42 B F H <> S+ 0 0 1 -3,-1.3 4,-2.9 2,-0.2 5,-0.3 0.984 80.1 43.7 -66.2 -60.3 49.1 -19.6 4.7 162 43 B V H > S+ 0 0 0 -4,-0.5 4,-2.6 1,-0.3 5,-0.3 0.935 115.7 48.3 -53.4 -54.3 52.7 -19.8 3.5 163 44 B A H > S+ 0 0 34 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.858 112.4 48.4 -41.6 -53.3 52.4 -23.4 2.3 164 45 B E H X S+ 0 0 54 -4,-2.0 4,-2.2 -3,-0.3 -1,-0.2 0.865 113.1 47.4 -67.7 -39.9 49.2 -22.7 0.4 165 46 B V H X S+ 0 0 3 -4,-2.9 4,-1.7 2,-0.2 -2,-0.2 0.855 115.2 46.1 -63.8 -35.4 50.8 -19.5 -1.2 166 47 B V H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.3 -2,-0.2 0.869 112.9 48.0 -80.5 -34.7 53.9 -21.4 -2.2 167 48 B T H X S+ 0 0 57 -4,-2.1 4,-2.7 -5,-0.3 5,-0.2 0.873 107.4 56.2 -73.3 -42.0 52.0 -24.4 -3.5 168 49 B L H X S+ 0 0 12 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.903 107.4 51.3 -53.2 -43.3 49.7 -22.0 -5.5 169 50 B F H X S+ 0 0 0 -4,-1.7 4,-2.9 2,-0.2 5,-0.4 0.953 110.8 47.5 -57.3 -51.0 53.0 -20.6 -7.1 170 51 B C H X S+ 0 0 13 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.915 117.1 41.9 -60.3 -43.9 54.2 -24.1 -8.1 171 52 B D H X S+ 0 0 96 -4,-2.7 4,-2.1 2,-0.2 5,-0.3 0.919 117.8 45.5 -69.0 -41.5 50.9 -25.1 -9.5 172 53 B D H X S+ 0 0 9 -4,-2.6 4,-2.9 -5,-0.2 5,-0.2 0.948 115.2 46.3 -70.4 -47.9 50.2 -21.8 -11.3 173 54 B A H X S+ 0 0 0 -4,-2.9 4,-2.7 -5,-0.3 5,-0.2 0.926 112.3 50.9 -62.4 -43.7 53.7 -21.5 -12.8 174 55 B D H X S+ 0 0 55 -4,-1.7 4,-2.0 -5,-0.4 -2,-0.2 0.944 114.0 43.9 -58.9 -45.4 53.7 -25.2 -13.9 175 56 B R H X S+ 0 0 110 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.963 115.7 47.8 -68.4 -45.5 50.4 -24.8 -15.7 176 57 B I H X S+ 0 0 2 -4,-2.9 4,-2.3 -5,-0.3 -1,-0.2 0.887 109.4 52.0 -64.2 -40.1 51.2 -21.4 -17.2 177 58 B I H X S+ 0 0 3 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.927 110.6 48.8 -66.1 -43.2 54.6 -22.6 -18.5 178 59 B S H X S+ 0 0 69 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.898 111.4 49.8 -59.0 -41.7 53.0 -25.7 -20.2 179 60 B E H X S+ 0 0 59 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.922 109.4 51.9 -65.5 -33.5 50.4 -23.4 -21.8 180 61 B L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.908 109.0 51.5 -63.7 -40.4 53.3 -21.0 -23.0 181 62 B A H < S+ 0 0 33 -4,-2.4 4,-0.4 2,-0.2 -1,-0.2 0.912 110.6 46.6 -68.2 -44.2 55.1 -24.0 -24.6 182 63 B A H >< S+ 0 0 57 -4,-2.0 3,-1.2 1,-0.2 4,-0.4 0.931 113.6 50.1 -61.4 -41.9 51.9 -25.1 -26.5 183 64 B L H >< S+ 0 0 31 -4,-2.5 3,-1.5 1,-0.3 7,-0.2 0.925 108.1 51.7 -64.0 -46.2 51.3 -21.6 -27.6 184 65 B L T 3< S+ 0 0 2 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.471 106.2 55.3 -69.9 -5.3 54.9 -21.0 -28.9 185 66 B D T < S+ 0 0 128 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.321 83.2 109.8-108.4 5.0 54.8 -24.2 -31.0 186 67 B Q S < S- 0 0 95 -3,-1.5 3,-0.1 -4,-0.4 -3,-0.0 -0.505 79.6-114.2 -71.7 154.2 51.6 -23.3 -33.0 187 68 B P S S+ 0 0 110 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.902 109.9 27.0 -51.6 -52.8 51.8 -22.4 -36.7 188 69 B I S S- 0 0 154 -5,-0.0 2,-0.4 2,-0.0 -3,-0.1 -0.990 91.1-139.2-114.7 122.0 50.8 -18.8 -36.1 189 70 B V - 0 0 15 -2,-0.5 2,-1.2 -5,-0.1 -5,-0.1 -0.733 2.9-141.5 -85.9 126.1 51.7 -17.6 -32.6 190 71 B D > - 0 0 78 -2,-0.4 4,-1.7 -7,-0.2 5,-0.1 -0.756 22.8-178.2 -84.6 90.6 49.2 -15.5 -30.7 191 72 B F H > S+ 0 0 24 -2,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.725 76.4 58.4 -69.5 -23.4 51.7 -13.1 -29.1 192 73 B D H > S+ 0 0 124 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.896 109.3 47.5 -62.3 -43.7 49.0 -11.1 -27.1 193 74 B K H > S+ 0 0 98 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.884 110.3 50.4 -70.4 -35.8 48.1 -14.4 -25.5 194 75 B V H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.921 113.0 47.9 -63.9 -43.2 51.7 -15.3 -24.7 195 76 B D H X S+ 0 0 46 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.901 108.9 51.4 -69.1 -42.5 52.2 -11.9 -23.2 196 77 B A H X S+ 0 0 50 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.943 112.7 47.1 -60.7 -39.2 49.0 -12.1 -21.1 197 78 B Y H X S+ 0 0 49 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.874 111.5 50.4 -65.6 -40.7 50.2 -15.7 -19.7 198 79 B V H X S+ 0 0 0 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.902 106.2 55.7 -65.7 -40.7 53.7 -14.3 -19.0 199 80 B H H X S+ 0 0 80 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.961 108.9 48.0 -54.6 -44.6 52.1 -11.4 -17.2 200 81 B Q H X S+ 0 0 72 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.880 109.8 51.6 -59.9 -41.0 50.3 -14.0 -15.0 201 82 B L H X S+ 0 0 1 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.850 108.6 52.4 -66.6 -37.8 53.6 -15.9 -14.4 202 83 B K H X S+ 0 0 66 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.950 109.4 47.9 -57.7 -50.9 55.1 -12.6 -13.3 203 84 B G H X S+ 0 0 20 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.920 114.6 46.7 -59.5 -45.3 52.4 -11.9 -10.8 204 85 B S H X S+ 0 0 1 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.898 113.7 47.3 -65.4 -41.1 52.6 -15.5 -9.4 205 86 B S H ><>S+ 0 0 0 -4,-2.2 5,-2.7 -5,-0.2 3,-1.3 0.948 108.4 55.4 -71.1 -40.5 56.4 -15.3 -9.2 206 87 B A H ><5S+ 0 0 8 -4,-3.0 3,-1.6 1,-0.2 -2,-0.2 0.868 98.4 65.9 -53.9 -35.0 56.2 -11.9 -7.5 207 88 B S H 3<5S+ 0 0 2 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.686 110.8 32.4 -61.0 -30.4 53.9 -13.4 -4.8 208 89 B V T <<5S- 0 0 0 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.204 114.5-112.2-110.9 16.1 56.6 -15.6 -3.4 209 90 B G T < 5 + 0 0 2 -3,-1.6 2,-2.2 1,-0.2 -63,-1.3 0.805 54.5 164.6 59.7 32.8 59.5 -13.2 -4.2 210 91 B A >< + 0 0 0 -5,-2.7 4,-2.3 1,-0.2 3,-0.4 -0.469 11.3 178.6 -81.4 72.7 60.9 -15.5 -6.9 211 92 B Q H > + 0 0 80 -2,-2.2 4,-1.9 1,-0.2 5,-0.2 0.723 68.4 51.9 -49.3 -37.5 63.1 -12.8 -8.3 212 93 B K H > S+ 0 0 78 -68,-0.5 4,-2.2 -69,-0.3 -1,-0.2 0.957 112.9 44.5 -76.9 -37.5 64.9 -14.7 -11.1 213 94 B V H > S+ 0 0 4 -3,-0.4 4,-2.4 -69,-0.3 -2,-0.2 0.966 113.8 52.5 -63.3 -47.6 61.7 -16.0 -12.6 214 95 B K H X S+ 0 0 67 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.882 109.2 48.5 -57.2 -40.3 60.1 -12.6 -12.3 215 96 B F H X S+ 0 0 111 -4,-1.9 4,-0.9 1,-0.2 -1,-0.2 0.899 108.7 53.0 -70.5 -44.6 63.0 -11.0 -14.1 216 97 B T H >< S+ 0 0 11 -4,-2.2 3,-1.1 -5,-0.2 4,-0.4 0.938 103.1 57.7 -52.9 -40.9 62.9 -13.4 -16.9 217 98 B C H >< S+ 0 0 0 -4,-2.4 3,-1.6 1,-0.3 4,-0.3 0.900 101.1 59.4 -62.7 -32.7 59.2 -12.8 -17.4 218 99 B M H >< S+ 0 0 95 -4,-1.5 3,-1.1 1,-0.3 4,-0.5 0.813 93.5 63.2 -66.5 -19.8 60.1 -9.1 -17.9 219 100 B Q T S+ 0 0 1 -3,-1.6 4,-3.3 -4,-0.4 5,-0.4 0.675 79.3 73.5 -74.8 -19.2 59.3 -11.2 -22.8 221 102 B R H <> S+ 0 0 74 -3,-1.1 4,-2.5 -4,-0.3 5,-0.2 0.979 100.7 40.0 -65.0 -50.4 57.9 -7.7 -23.5 222 103 B Q H > S+ 0 0 121 -4,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.880 117.4 52.2 -60.7 -31.3 60.4 -6.8 -26.0 223 104 B L H <>S+ 0 0 32 -4,-0.8 5,-2.3 2,-0.2 -2,-0.2 0.918 112.5 43.1 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H > S+ 0 0 30 -2,-1.1 4,-2.6 1,-0.2 -1,-0.2 0.772 76.2 58.1 -59.7 -30.3 93.8 13.7 35.7 466 73 D D H > S+ 0 0 122 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.852 108.3 46.1 -68.4 -43.7 96.1 10.9 34.3 467 74 D K H > S+ 0 0 101 -3,-0.2 4,-1.9 2,-0.2 5,-0.2 0.905 111.9 50.6 -68.2 -34.8 94.4 8.3 36.4 468 75 D V H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.964 110.4 52.6 -62.3 -42.9 90.9 9.7 35.4 469 76 D D H X S+ 0 0 48 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.917 107.4 49.2 -57.6 -43.5 92.2 9.5 31.7 470 77 D A H X S+ 0 0 48 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.924 112.3 49.7 -66.0 -35.5 93.3 5.7 32.0 471 78 D Y H X S+ 0 0 44 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.933 109.7 49.8 -72.8 -37.6 89.9 4.9 33.5 472 79 D V H X S+ 0 0 3 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.941 109.5 51.8 -66.0 -42.8 88.0 6.7 30.8 473 80 D H H X S+ 0 0 111 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.942 110.3 49.4 -56.9 -44.4 90.1 4.8 28.2 474 81 D Q H X S+ 0 0 94 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.902 108.5 51.5 -62.3 -43.5 89.2 1.5 29.9 475 82 D L H X S+ 0 0 0 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.899 108.2 56.5 -61.6 -26.0 85.4 2.5 29.9 476 83 D K H X S+ 0 0 70 -4,-1.9 4,-2.4 -5,-0.3 -2,-0.2 0.967 109.8 41.2 -73.0 -42.1 85.9 3.1 26.2 477 84 D G H X S+ 0 0 45 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.922 114.6 52.1 -66.7 -49.0 87.2 -0.4 25.5 478 85 D S H X S+ 0 0 12 -4,-2.6 4,-0.7 1,-0.2 -2,-0.2 0.981 113.5 44.2 -51.4 -49.2 84.5 -1.9 27.8 479 86 D S H ><>S+ 0 0 0 -4,-2.6 5,-2.9 -5,-0.2 3,-0.5 0.866 112.3 51.7 -70.1 -35.9 81.7 0.0 25.9 480 87 D A H ><5S+ 0 0 40 -4,-2.4 3,-1.2 -5,-0.2 -1,-0.2 0.902 97.2 68.0 -63.9 -38.7 83.1 -0.8 22.4 481 88 D S H 3<5S+ 0 0 52 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.751 115.3 26.8 -58.2 -28.9 83.3 -4.5 23.2 482 89 D V T <<5S- 0 0 0 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.336 111.7-111.4-114.8 8.7 79.5 -4.6 23.2 483 90 D G T < 5 + 0 0 2 -3,-1.2 2,-1.7 -4,-0.5 -66,-1.7 0.823 50.5 167.6 64.9 36.5 78.7 -1.7 20.9 484 91 D A B >< -A 416 0A 1 -5,-2.9 4,-1.9 -68,-0.2 -68,-0.3 -0.651 15.7-175.7 -78.6 88.9 77.2 0.5 23.7 485 92 D Q H > + 0 0 29 -2,-1.7 4,-2.0 -70,-0.8 -1,-0.2 0.893 68.2 46.7 -68.9 -43.3 77.3 3.4 21.3 486 93 D K H > S+ 0 0 49 -72,-0.5 4,-2.2 -71,-0.4 -1,-0.2 0.924 113.6 51.0 -64.9 -38.4 76.2 6.5 23.4 487 94 D V H > S+ 0 0 4 -72,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.906 109.4 50.7 -64.5 -42.5 78.5 5.5 26.3 488 95 D K H X S+ 0 0 61 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.939 111.2 47.0 -67.6 -41.7 81.5 5.2 23.9 489 96 D F H >X S+ 0 0 25 -4,-2.0 3,-1.5 1,-0.2 4,-1.3 0.968 108.3 54.3 -62.3 -47.6 80.9 8.6 22.3 490 97 D T H 3X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.3 -1,-0.2 0.879 102.9 60.9 -59.9 -31.8 80.5 10.4 25.7 491 98 D C H 3X S+ 0 0 2 -4,-1.9 4,-2.6 1,-0.2 -1,-0.3 0.830 98.8 55.5 -64.9 -29.6 84.0 8.8 26.6 492 99 D M H S+ 0 0 0 -4,-2.9 5,-2.2 1,-0.2 9,-0.3 0.797 113.1 51.1 -67.1 -27.1 87.7 17.5 29.0 498 105 D C H ><5S+ 0 0 2 -4,-1.9 3,-1.0 -5,-0.3 -1,-0.2 0.869 107.5 50.6 -82.1 -36.8 90.1 15.4 31.2 499 106 D Q H 3<5S+ 0 0 81 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.837 107.3 56.4 -64.8 -29.0 93.1 16.4 29.1 500 107 D D T 3<5S- 0 0 79 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.472 111.3-127.9 -82.9 -4.8 91.9 19.9 29.6 501 108 D K T < 5 + 0 0 126 -3,-1.0 2,-0.8 1,-0.2 -3,-0.2 0.855 56.0 150.5 61.7 44.2 92.1 19.4 33.4 502 109 D N >< - 0 0 34 -5,-2.2 4,-2.6 1,-0.2 -1,-0.2 -0.833 27.8-176.0-112.6 98.5 88.6 20.5 33.8 503 110 D R H > S+ 0 0 77 -2,-0.8 4,-2.6 2,-0.2 5,-0.2 0.851 83.8 55.0 -57.4 -47.7 87.0 18.8 36.8 504 111 D D H > S+ 0 0 125 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.966 112.0 45.1 -58.9 -44.1 83.5 20.5 36.2 505 112 D G H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.935 110.8 52.7 -62.3 -41.3 83.5 19.1 32.7 506 113 D C H X S+ 0 0 0 -4,-2.6 4,-3.1 -9,-0.3 5,-0.2 0.946 110.1 49.0 -62.2 -43.1 84.7 15.7 33.7 507 114 D I H X S+ 0 0 75 -4,-2.6 4,-1.7 1,-0.3 -1,-0.2 0.838 111.8 47.2 -70.2 -34.4 81.9 15.5 36.3 508 115 D M H X S+ 0 0 42 -4,-1.7 4,-2.2 2,-0.2 -1,-0.3 0.900 112.2 50.2 -71.6 -40.4 79.2 16.5 33.9 509 116 D A H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.972 109.9 51.5 -62.4 -41.4 80.5 14.0 31.3 510 117 D L H X S+ 0 0 5 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.887 105.9 53.8 -62.9 -43.1 80.5 11.3 34.0 511 118 D A H X S+ 0 0 27 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.913 111.7 47.7 -59.4 -30.8 76.8 12.2 34.8 512 119 D V H X S+ 0 0 5 -4,-2.2 4,-2.2 -3,-0.2 -2,-0.2 0.942 112.1 47.2 -73.3 -48.0 76.1 11.7 31.0 513 120 D V H X S+ 0 0 0 -4,-3.1 4,-3.5 1,-0.2 5,-0.2 0.903 111.4 52.7 -55.4 -46.3 77.9 8.4 30.8 514 121 D R H X S+ 0 0 72 -4,-2.3 4,-3.4 -5,-0.3 5,-0.3 0.936 109.6 46.5 -63.6 -44.1 76.2 7.2 34.0 515 122 D N H X S+ 0 0 110 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.923 114.9 48.8 -62.9 -34.1 72.7 7.9 32.7 516 123 D E H X S+ 0 0 20 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.939 112.9 46.8 -77.0 -41.8 73.6 6.3 29.4 517 124 D F H X S+ 0 0 0 -4,-3.5 4,-2.7 2,-0.2 5,-0.3 0.935 110.8 50.1 -62.1 -52.2 75.0 3.2 31.2 518 125 D Y H X S+ 0 0 84 -4,-3.4 4,-2.5 -5,-0.2 5,-0.2 0.953 111.5 50.4 -54.4 -40.8 72.1 2.8 33.6 519 126 D D H X S+ 0 0 55 -4,-1.9 4,-1.7 -5,-0.3 -2,-0.2 0.952 115.7 41.0 -62.9 -51.6 69.7 3.0 30.6 520 127 D L H X S+ 0 0 3 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.921 113.2 53.8 -63.6 -44.4 71.6 0.4 28.5 521 128 D R H X S+ 0 0 54 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.913 106.3 52.2 -58.2 -46.7 72.2 -1.9 31.5 522 129 D N H X S+ 0 0 81 -4,-2.5 4,-1.8 -5,-0.3 -1,-0.2 0.941 112.6 46.7 -57.2 -40.2 68.4 -2.0 32.4 523 130 D K H X S+ 0 0 61 -4,-1.7 4,-3.8 -5,-0.2 -1,-0.2 0.911 111.5 48.5 -61.9 -52.0 67.7 -3.0 28.9 524 131 D F H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.854 109.4 53.8 -63.0 -38.3 70.4 -5.7 28.7 525 132 D Q H X S+ 0 0 92 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.862 111.6 44.5 -63.0 -39.2 69.3 -7.1 32.0 526 133 D T H X S+ 0 0 61 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.915 113.3 53.9 -69.8 -37.0 65.7 -7.4 30.6 527 134 D M H X S+ 0 0 0 -4,-3.8 4,-2.4 1,-0.2 3,-0.5 0.978 109.7 44.1 -63.0 -55.6 67.3 -8.8 27.4 528 135 D L H X S+ 0 0 23 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.901 113.7 51.9 -55.5 -42.2 69.2 -11.6 29.3 529 136 D Q H X S+ 0 0 97 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.856 111.6 47.5 -62.6 -38.1 66.1 -12.5 31.5 530 137 D L H X S+ 0 0 10 -4,-2.2 4,-2.2 -3,-0.5 -2,-0.2 0.842 113.2 46.9 -69.7 -36.8 63.9 -12.8 28.3 531 138 D E H X S+ 0 0 61 -4,-2.4 4,-1.6 -5,-0.2 -2,-0.2 0.941 109.7 54.1 -69.2 -46.2 66.5 -15.0 26.5 532 139 D Q H < S+ 0 0 136 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.785 112.2 44.7 -48.7 -41.6 66.9 -17.2 29.7 533 140 D Q H < S+ 0 0 108 -4,-1.0 -2,-0.2 -5,-0.2 -1,-0.2 0.895 102.3 64.4 -83.4 -39.1 63.1 -17.8 29.7 534 141 D I H < 0 0 79 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.880 360.0 360.0 -46.9 -39.0 62.9 -18.4 25.9 535 142 D Q < 0 0 204 -4,-1.6 -1,-0.0 -5,-0.1 -4,-0.0 -0.488 360.0 360.0 -61.7 360.0 65.1 -21.5 26.7