==== 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 METAL BINDING PROTEIN 04-AUG-08 3E1J . COMPND 2 MOLECULE: BACTERIOFERRITIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K12; . AUTHOR A.CROW,T.LAWSON,A.LEWIN,G.R.MOORE,N.LE BRUN . 1884 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 78134.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1524 80.9 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 . 48 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1344 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 36 1.9 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 12 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 12 12 0 24 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 M 0 0 27 0, 0.0 2,-0.5 0, 0.0 1553,-0.0 0.000 360.0 360.0 360.0 126.0 -97.8 -32.0 -19.9 2 2 A K - 0 0 165 64,-0.1 64,-0.2 1,-0.0 63,-0.1 -0.530 360.0-157.8 -70.2 113.8 -101.6 -32.7 -20.2 3 3 A G - 0 0 12 62,-2.5 2,-0.3 -2,-0.5 -1,-0.0 -0.248 29.7 -77.9 -84.1 175.1 -101.9 -36.4 -21.0 4 4 A D > - 0 0 57 1,-0.1 4,-1.8 107,-0.1 -1,-0.1 -0.585 39.7-136.4 -71.2 131.0 -104.7 -38.4 -22.7 5 5 A T H > S+ 0 0 89 -2,-0.3 4,-2.3 1,-0.2 -1,-0.1 0.874 102.8 50.3 -56.3 -44.3 -107.4 -39.0 -20.0 6 6 A K H > S+ 0 0 100 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.865 107.1 55.4 -70.0 -33.8 -108.0 -42.6 -20.9 7 7 A V H > S+ 0 0 3 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.923 108.1 49.4 -59.6 -43.8 -104.2 -43.3 -20.7 8 8 A I H X S+ 0 0 22 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.915 108.3 52.8 -62.1 -42.3 -104.3 -41.9 -17.2 9 9 A N H X S+ 0 0 97 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.911 111.6 46.9 -57.8 -43.1 -107.3 -44.2 -16.4 10 10 A Y H X S+ 0 0 41 -4,-2.4 4,-3.2 2,-0.2 5,-0.2 0.947 109.9 52.4 -63.5 -48.0 -105.3 -47.1 -17.6 11 11 A L H X S+ 0 0 0 -4,-3.1 4,-3.1 1,-0.2 -2,-0.2 0.909 111.5 47.2 -53.8 -44.0 -102.3 -46.0 -15.6 12 12 A N H X S+ 0 0 28 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.888 111.9 50.5 -67.7 -36.0 -104.4 -45.8 -12.5 13 13 A K H X S+ 0 0 107 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.951 112.5 45.3 -67.0 -45.9 -105.9 -49.2 -13.2 14 14 A L H X S+ 0 0 2 -4,-3.2 4,-2.2 2,-0.2 5,-0.2 0.931 111.4 53.6 -59.6 -44.8 -102.5 -50.8 -13.7 15 15 A L H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.900 106.0 54.5 -54.1 -42.0 -101.4 -48.9 -10.5 16 16 A G H X S+ 0 0 18 -4,-2.4 4,-1.8 1,-0.2 59,-0.4 0.875 106.5 50.9 -59.5 -40.8 -104.3 -50.6 -8.8 17 17 A N H X S+ 0 0 41 -4,-1.8 4,-2.4 -3,-0.2 -1,-0.2 0.916 110.4 48.7 -63.1 -44.8 -103.1 -54.0 -9.9 18 18 A E H X S+ 0 0 7 -4,-2.2 4,-3.1 1,-0.2 -2,-0.2 0.866 107.3 56.2 -68.5 -35.8 -99.6 -53.4 -8.6 19 19 A L H X S+ 0 0 9 -4,-2.4 4,-1.4 -5,-0.2 -1,-0.2 0.912 107.8 45.3 -73.8 -25.9 -100.9 -52.3 -5.3 20 20 A V H X S+ 0 0 9 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.957 114.0 51.5 -68.1 -43.0 -102.9 -55.4 -4.7 21 21 A A H X S+ 0 0 5 -4,-2.4 4,-3.2 1,-0.2 5,-0.3 0.893 104.4 57.6 -57.2 -43.0 -99.8 -57.4 -5.8 22 22 A I H X S+ 0 0 22 -4,-3.1 4,-2.0 1,-0.2 -1,-0.2 0.932 113.8 37.9 -51.3 -53.2 -97.5 -55.5 -3.4 23 23 A N H X S+ 0 0 28 -4,-1.4 4,-2.5 2,-0.2 5,-0.3 0.896 115.9 51.1 -67.7 -42.1 -99.6 -56.5 -0.4 24 24 A Q H X S+ 0 0 2 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.959 113.1 45.9 -67.9 -41.8 -100.4 -60.0 -1.6 25 25 A Y H X S+ 0 0 1 -4,-3.2 4,-3.0 -5,-0.2 -1,-0.2 0.898 112.9 50.2 -63.6 -41.0 -96.7 -60.7 -2.2 26 26 A F H X S+ 0 0 27 -4,-2.0 4,-2.3 -5,-0.3 5,-0.2 0.925 111.8 45.9 -64.5 -47.8 -95.6 -59.2 1.1 27 27 A L H X S+ 0 0 5 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.951 114.1 50.2 -59.5 -46.6 -98.1 -61.2 3.2 28 28 A H H X S+ 0 0 0 -4,-2.5 4,-3.0 -5,-0.3 3,-0.3 0.958 109.1 52.9 -56.3 -50.1 -97.2 -64.3 1.3 29 29 A A H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.894 112.2 42.2 -47.0 -53.0 -93.5 -63.6 1.9 30 30 A R H X S+ 0 0 22 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.750 111.0 56.6 -78.0 -21.0 -93.9 -63.3 5.7 31 31 A M H X S+ 0 0 24 -4,-2.3 4,-2.5 -3,-0.3 6,-0.2 0.965 109.9 45.5 -66.8 -52.7 -96.3 -66.3 5.8 32 32 A F H <>S+ 0 0 0 -4,-3.0 5,-2.5 1,-0.2 4,-0.4 0.898 112.7 52.5 -52.2 -42.3 -93.5 -68.4 4.2 33 33 A K H ><5S+ 0 0 99 -4,-2.1 3,-1.4 -5,-0.3 -1,-0.2 0.937 107.8 49.7 -63.0 -46.5 -91.0 -66.8 6.6 34 34 A N H 3<5S+ 0 0 41 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.910 109.7 51.7 -57.3 -44.9 -93.1 -67.7 9.6 35 35 A W T 3<5S- 0 0 53 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.490 118.9-113.1 -69.9 -7.5 -93.4 -71.3 8.3 36 36 A G T < 5S+ 0 0 11 -3,-1.4 2,-2.0 -4,-0.4 -3,-0.2 0.537 74.1 138.5 87.7 6.8 -89.6 -71.4 7.9 37 37 A L >>< + 0 0 2 -5,-2.5 4,-1.7 -6,-0.2 3,-1.2 -0.416 27.0 174.2 -81.8 61.8 -89.8 -71.6 4.1 38 38 A K H 3> + 0 0 61 -2,-2.0 4,-2.1 116,-0.4 -1,-0.2 0.747 67.9 52.9 -44.2 -36.6 -86.8 -69.1 4.0 39 39 A R H 3> S+ 0 0 48 114,-2.4 4,-2.1 1,-0.2 -1,-0.3 0.832 107.1 48.8 -79.3 -37.0 -86.4 -69.2 0.2 40 40 A L H <> S+ 0 0 0 -3,-1.2 4,-2.4 113,-0.4 5,-0.3 0.811 110.3 54.2 -71.8 -32.3 -89.9 -68.5 -0.7 41 41 A N H X S+ 0 0 10 -4,-1.7 4,-2.2 112,-0.2 5,-0.2 0.930 108.4 49.3 -65.7 -46.3 -89.8 -65.6 1.7 42 42 A D H X S+ 0 0 40 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.954 115.7 41.9 -57.6 -49.7 -86.7 -64.2 -0.1 43 43 A V H X S+ 0 0 38 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.962 116.9 45.3 -66.9 -48.2 -88.2 -64.5 -3.5 44 44 A E H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.856 110.8 54.2 -67.6 -33.4 -91.7 -63.2 -2.7 45 45 A Y H X S+ 0 0 75 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.955 107.3 50.8 -59.9 -48.4 -90.3 -60.4 -0.7 46 46 A H H X S+ 0 0 117 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.782 108.7 53.2 -63.2 -24.4 -88.2 -59.4 -3.7 47 47 A E H X S+ 0 0 14 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.864 104.2 54.0 -78.1 -34.6 -91.3 -59.5 -5.8 48 48 A S H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.921 109.0 49.2 -56.2 -46.8 -93.1 -57.2 -3.5 49 49 A I H X S+ 0 0 52 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.889 109.3 55.4 -59.6 -38.4 -90.2 -54.7 -3.9 50 50 A D H X S+ 0 0 39 -4,-1.5 4,-1.7 1,-0.2 -2,-0.2 0.942 106.2 47.1 -60.2 -48.3 -90.6 -55.2 -7.6 51 51 A E H X S+ 0 0 3 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.817 108.1 57.8 -67.1 -28.7 -94.2 -54.3 -7.7 52 52 A M H X S+ 0 0 45 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.913 103.6 52.4 -64.4 -43.1 -93.5 -51.2 -5.6 53 53 A K H X S+ 0 0 129 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.888 110.3 49.0 -58.2 -39.7 -91.0 -50.1 -8.2 54 54 A H H X S+ 0 0 3 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.937 109.6 50.1 -65.6 -46.8 -93.8 -50.4 -10.8 55 55 A A H X S+ 0 0 6 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.920 109.1 53.6 -57.6 -45.1 -96.3 -48.5 -8.7 56 56 A D H X S+ 0 0 33 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.938 107.9 50.0 -54.8 -47.7 -93.7 -45.7 -8.2 57 57 A R H X S+ 0 0 71 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.913 112.4 46.7 -63.3 -41.6 -93.3 -45.5 -12.0 58 58 A Y H X S+ 0 0 0 -4,-2.4 4,-3.5 2,-0.2 5,-0.3 0.931 111.7 51.5 -59.4 -47.2 -97.1 -45.3 -12.6 59 59 A I H X S+ 0 0 3 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.921 112.1 46.0 -60.6 -44.9 -97.5 -42.7 -9.9 60 60 A E H X S+ 0 0 63 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.851 114.3 47.8 -68.0 -33.2 -94.8 -40.5 -11.3 61 61 A R H X S+ 0 0 18 -4,-1.8 4,-2.7 -5,-0.2 -2,-0.2 0.936 110.2 50.5 -75.3 -46.6 -96.1 -40.8 -14.8 62 62 A I H <>S+ 0 0 0 -4,-3.5 5,-3.1 1,-0.2 -2,-0.2 0.911 113.3 48.4 -53.1 -43.1 -99.7 -40.1 -13.9 63 63 A L H ><5S+ 0 0 19 -4,-2.1 3,-1.6 -5,-0.3 -1,-0.2 0.928 110.6 49.4 -66.9 -42.4 -98.4 -37.0 -12.0 64 64 A F H 3<5S+ 0 0 14 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.915 110.0 51.1 -62.2 -42.1 -96.3 -35.9 -15.0 65 65 A L T 3<5S- 0 0 2 -4,-2.7 -62,-2.5 -63,-0.1 -1,-0.3 0.362 121.4-112.7 -76.7 2.7 -99.3 -36.4 -17.3 66 66 A E T < 5S+ 0 0 116 -3,-1.6 -3,-0.2 1,-0.2 2,-0.2 0.727 72.9 127.6 69.7 31.4 -101.2 -34.2 -14.8 67 67 A G < - 0 0 13 -5,-3.1 -1,-0.2 -6,-0.2 -62,-0.0 -0.490 64.1-102.5-104.2-179.7 -103.7 -36.8 -13.5 68 68 A L - 0 0 149 -2,-0.2 2,-0.1 2,-0.0 -5,-0.0 -0.898 30.6-135.8-108.8 107.0 -104.5 -37.9 -9.9 69 69 A P - 0 0 14 0, 0.0 2,-0.8 0, 0.0 3,-0.1 -0.394 17.6-139.7 -63.0 138.4 -102.9 -41.2 -8.9 70 70 A N + 0 0 58 1,-0.1 -11,-0.0 -2,-0.1 -2,-0.0 -0.885 41.7 150.5-107.4 104.3 -105.4 -43.3 -7.1 71 71 A L + 0 0 5 -2,-0.8 -1,-0.1 1,-0.1 110,-0.1 0.193 61.0 80.3-108.1 10.1 -104.0 -45.2 -4.0 72 72 A Q S S+ 0 0 52 109,-0.1 2,-0.4 -3,-0.1 160,-0.1 0.908 78.7 67.7 -86.5 -42.9 -107.3 -45.2 -2.2 73 73 A D - 0 0 109 1,-0.0 2,-0.5 0, 0.0 -1,-0.0 -0.649 62.5-171.2 -88.1 130.7 -109.1 -48.1 -3.9 74 74 A L - 0 0 33 -2,-0.4 3,-0.1 156,-0.1 158,-0.1 -0.983 14.0-139.2-124.9 119.8 -107.7 -51.6 -3.3 75 75 A G - 0 0 37 -2,-0.5 2,-0.3 -59,-0.4 -58,-0.0 0.052 44.6 -58.4 -66.3 178.1 -108.9 -54.6 -5.3 76 76 A K - 0 0 183 1,-0.0 2,-0.3 2,-0.0 -1,-0.2 -0.466 46.2-154.5 -67.9 119.9 -109.5 -58.1 -3.9 77 77 A L - 0 0 11 -2,-0.3 2,-0.4 -3,-0.1 -56,-0.0 -0.688 3.4-162.6 -76.9 142.2 -106.6 -59.9 -2.3 78 78 A N + 0 0 97 -2,-0.3 15,-0.1 1,-0.1 -2,-0.0 -0.921 13.9 173.9-129.7 105.9 -106.8 -63.7 -2.4 79 79 A I - 0 0 41 -2,-0.4 10,-0.2 10,-0.1 -1,-0.1 0.960 16.9-159.5 -85.6 -55.0 -104.4 -65.0 0.3 80 80 A G - 0 0 15 1,-0.1 3,-0.1 9,-0.1 -1,-0.0 -0.051 22.1-115.0 90.4 162.9 -104.9 -68.8 0.5 81 81 A E S S+ 0 0 158 1,-0.1 2,-0.3 -2,-0.0 -1,-0.1 0.617 86.8 40.6-116.7 -15.6 -103.9 -71.0 3.3 82 82 A D S > S- 0 0 77 1,-0.1 4,-2.9 0, 0.0 5,-0.2 -0.896 88.0 -98.8-130.9 166.3 -101.2 -73.3 1.8 83 83 A V H > S+ 0 0 9 -2,-0.3 4,-3.2 1,-0.2 5,-0.2 0.877 119.3 44.4 -49.3 -56.9 -98.2 -72.9 -0.5 84 84 A E H > S+ 0 0 59 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.946 114.4 49.1 -54.1 -54.1 -99.8 -74.2 -3.7 85 85 A E H > S+ 0 0 86 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.905 115.0 46.0 -54.9 -41.1 -103.0 -72.2 -3.1 86 86 A M H X S+ 0 0 0 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.924 113.6 46.5 -75.6 -36.7 -100.9 -69.1 -2.4 87 87 A L H X S+ 0 0 0 -4,-3.2 4,-2.4 -5,-0.2 -2,-0.2 0.933 112.3 51.6 -65.0 -42.8 -98.6 -69.5 -5.4 88 88 A R H X S+ 0 0 117 -4,-3.2 4,-2.6 1,-0.2 -1,-0.2 0.859 107.6 53.7 -62.5 -35.5 -101.6 -70.2 -7.6 89 89 A S H X S+ 0 0 12 -4,-1.9 4,-1.9 -5,-0.3 -1,-0.2 0.911 107.2 49.0 -70.9 -40.2 -103.2 -67.0 -6.4 90 90 A D H X S+ 0 0 1 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.906 111.3 52.4 -61.4 -42.3 -100.2 -64.8 -7.2 91 91 A L H X S+ 0 0 21 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.930 107.2 49.8 -59.5 -47.8 -100.2 -66.4 -10.7 92 92 A A H X S+ 0 0 53 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.907 111.6 51.4 -58.4 -37.3 -103.9 -65.7 -11.3 93 93 A L H X S+ 0 0 38 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.911 109.4 47.6 -66.4 -43.8 -103.1 -62.1 -10.3 94 94 A E H X S+ 0 0 9 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.901 110.2 54.5 -62.7 -43.1 -100.2 -61.7 -12.6 95 95 A L H X S+ 0 0 71 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.907 109.0 46.7 -59.9 -43.3 -102.3 -63.1 -15.4 96 96 A D H X S+ 0 0 88 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.867 113.5 48.8 -68.3 -35.4 -105.0 -60.6 -14.9 97 97 A G H X S+ 0 0 10 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.861 107.6 54.0 -70.2 -35.6 -102.6 -57.7 -14.7 98 98 A A H X S+ 0 0 2 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.918 107.4 52.6 -63.0 -39.1 -100.8 -58.9 -17.9 99 99 A K H X S+ 0 0 123 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.954 110.8 45.9 -59.4 -53.3 -104.2 -58.8 -19.6 100 100 A N H X S+ 0 0 22 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.865 112.0 52.4 -56.1 -40.4 -104.8 -55.2 -18.5 101 101 A L H X S+ 0 0 3 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.910 106.3 52.3 -65.2 -42.3 -101.2 -54.3 -19.5 102 102 A R H X S+ 0 0 128 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.918 112.5 47.4 -58.1 -40.9 -101.7 -55.7 -23.0 103 103 A E H X S+ 0 0 99 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.922 113.2 46.2 -65.2 -52.6 -104.9 -53.6 -23.3 104 104 A A H X S+ 0 0 1 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.865 109.5 54.9 -61.1 -41.5 -103.3 -50.4 -22.1 105 105 A I H X S+ 0 0 16 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.906 108.2 48.6 -59.6 -45.6 -100.2 -50.8 -24.3 106 106 A G H X S+ 0 0 39 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.885 113.5 47.4 -64.2 -39.0 -102.3 -51.1 -27.5 107 107 A Y H X S+ 0 0 56 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.905 106.9 54.9 -72.9 -42.0 -104.3 -48.0 -26.5 108 108 A A H <>S+ 0 0 1 -4,-2.7 5,-2.5 1,-0.2 -1,-0.2 0.886 108.0 52.6 -55.0 -39.5 -101.3 -45.9 -25.6 109 109 A D H ><5S+ 0 0 37 -4,-1.8 3,-1.1 1,-0.2 -1,-0.2 0.870 105.7 53.4 -63.0 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9,-0.1 -1,-0.0 -0.055 22.1-114.9 89.7 162.7 -104.9 -32.3 -0.3 239 81 B E S S+ 0 0 158 1,-0.1 2,-0.3 -2,-0.0 -1,-0.1 0.606 86.7 40.6-116.9 -15.5 -103.9 -30.0 -3.2 240 82 B D S > S- 0 0 76 1,-0.1 4,-2.8 0, 0.0 5,-0.2 -0.903 88.0 -98.6-131.0 166.2 -101.2 -27.7 -1.7 241 83 B V H > S+ 0 0 9 -2,-0.3 4,-3.2 1,-0.2 5,-0.2 0.877 119.4 44.2 -48.6 -57.5 -98.1 -28.1 0.6 242 84 B E H > S+ 0 0 59 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.950 114.3 49.3 -54.0 -54.5 -99.8 -26.9 3.8 243 85 B E H > S+ 0 0 86 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.903 115.0 46.0 -54.5 -41.0 -103.0 -28.9 3.2 244 86 B M H X S+ 0 0 0 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.921 113.4 46.5 -75.8 -36.3 -100.9 -32.0 2.6 245 87 B L H X S+ 0 0 0 -4,-3.2 4,-2.4 -5,-0.2 -2,-0.2 0.935 112.2 51.8 -65.4 -42.6 -98.6 -31.6 5.5 246 88 B R H X S+ 0 0 117 -4,-3.3 4,-2.5 1,-0.2 -1,-0.2 0.854 107.5 53.6 -63.0 -35.4 -101.6 -30.9 7.8 247 89 B S H X S+ 0 0 12 -4,-1.8 4,-1.8 -5,-0.3 -1,-0.2 0.904 107.2 49.2 -70.4 -40.5 -103.2 -34.0 6.5 248 90 B D H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.908 111.4 52.3 -61.6 -42.3 -100.2 -36.2 7.3 249 91 B L H X S+ 0 0 21 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.931 107.3 49.7 -58.7 -48.2 -100.2 -34.6 10.8 250 92 B A H X S+ 0 0 53 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.908 111.7 51.2 -58.3 -38.0 -103.9 -35.4 11.5 251 93 B L H X S+ 0 0 39 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.901 109.4 47.8 -66.4 -43.6 -103.1 -39.0 10.4 252 94 B E H X S+ 0 0 9 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.901 110.2 54.4 -62.9 -42.9 -100.2 -39.4 12.8 253 95 B L H X S+ 0 0 60 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.906 109.0 46.8 -59.9 -42.6 -102.2 -37.9 15.6 254 96 B D H X S+ 0 0 87 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.861 113.5 48.7 -68.7 -34.7 -105.0 -40.5 15.1 255 97 B G H X S+ 0 0 10 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.860 107.5 54.2 -71.7 -35.5 -102.6 -43.3 14.9 256 98 B A H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.912 107.4 52.5 -62.4 -38.5 -100.8 -42.1 18.0 257 99 B K H X S+ 0 0 134 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.955 110.8 46.0 -60.1 -53.2 -104.2 -42.2 19.8 258 100 B N H X S+ 0 0 25 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.860 111.9 52.4 -56.1 -40.2 -104.7 -45.8 18.7 259 101 B L H X S+ 0 0 3 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.913 107.1 51.3 -65.4 -42.2 -101.2 -46.8 19.7 260 102 B R H X S+ 0 0 48 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.925 112.4 47.7 -59.9 -43.8 -101.7 -45.3 23.2 261 103 B E H X S+ 0 0 99 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.943 113.8 46.0 -62.2 -49.9 -104.9 -47.4 23.5 262 104 B A H X S+ 0 0 1 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.856 109.4 54.9 -61.6 -41.5 -103.3 -50.6 22.2 263 105 B I H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.898 107.9 48.8 -60.0 -44.6 -100.2 -50.2 24.5 264 106 B G H X S+ 0 0 19 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.883 113.5 47.2 -64.6 -39.4 -102.3 -49.9 27.6 265 107 B Y H X S+ 0 0 56 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.905 107.0 54.9 -72.6 -42.4 -104.3 -53.0 26.7 266 108 B A H <>S+ 0 0 1 -4,-2.7 5,-2.5 1,-0.2 -1,-0.2 0.886 108.1 52.4 -55.5 -39.7 -101.3 -55.2 25.8 267 109 B D H ><5S+ 0 0 30 -4,-1.8 3,-1.1 3,-0.2 -1,-0.2 0.870 105.7 53.4 -62.1 -39.0 -99.9 -54.4 29.3 268 110 B S H 3<5S+ 0 0 73 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.816 112.5 42.3 -78.2 -23.1 -103.1 -55.5 30.9 269 111 B V T 3<5S- 0 0 47 -4,-1.7 -1,-0.3 -3,-0.1 -2,-0.2 0.246 116.2-113.9 -96.7 9.9 -103.1 -58.9 29.2 270 112 B H T < 5 + 0 0 79 -3,-1.1 2,-1.9 1,-0.2 3,-0.2 0.660 67.8 144.0 71.6 18.1 -99.3 -59.3 29.8 271 113 B D >< + 0 0 10 -5,-2.5 4,-2.3 -6,-0.2 -1,-0.2 -0.505 17.3 163.1 -84.5 70.3 -98.3 -59.2 26.1 272 114 B Y H > + 0 0 5 -2,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.794 65.8 53.1 -65.4 -30.5 -95.2 -57.3 27.1 273 115 B V H > S+ 0 0 10 -3,-0.2 4,-2.7 2,-0.2 5,-0.2 0.946 108.6 48.0 -75.9 -42.3 -93.4 -57.9 23.8 274 116 B S H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.930 113.6 51.0 -53.1 -42.8 -96.2 -56.6 21.6 275 117 B R H X S+ 0 0 8 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.940 108.8 50.0 -59.6 -46.2 -96.2 -53.6 24.0 276 118 B D H X S+ 0 0 18 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.915 110.8 48.8 -62.9 -45.5 -92.5 -53.1 23.6 277 119 B M H X S+ 0 0 25 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.915 111.8 50.3 -59.8 -42.0 -92.7 -53.2 19.9 278 120 B M H X S+ 0 0 2 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.861 105.9 55.0 -66.2 -35.5 -95.6 -50.7 19.9 279 121 B I H X S+ 0 0 15 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.908 107.7 49.7 -66.6 -40.1 -93.7 -48.3 22.2 280 122 B E H X S+ 0 0 57 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.927 111.7 48.9 -62.1 -41.0 -90.8 -48.2 19.8 281 123 B I H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 3,-0.4 0.944 109.0 52.4 -62.5 -45.4 -93.2 -47.5 16.9 282 124 B L H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.3 -1,-0.2 0.874 105.9 55.4 -59.4 -39.0 -95.0 -44.7 18.9 283 125 B R H X S+ 0 0 118 -4,-2.1 4,-1.5 1,-0.2 -1,-0.3 0.882 107.9 48.3 -61.0 -38.5 -91.5 -43.1 19.4 284 126 B D H X S+ 0 0 58 -4,-1.6 4,-1.7 -3,-0.4 -2,-0.2 0.876 113.5 47.7 -68.5 -34.4 -91.0 -43.1 15.6 285 127 B E H X S+ 0 0 7 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.928 106.4 54.7 -71.9 -45.7 -94.4 -41.5 15.1 286 128 B E H X S+ 0 0 6 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.874 107.4 54.4 -53.5 -39.1 -93.9 -39.0 17.8 287 129 B G H X S+ 0 0 38 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.915 108.3 46.6 -61.0 -46.9 -90.7 -38.1 15.7 288 130 B H H X S+ 0 0 14 -4,-1.7 4,-2.9 2,-0.2 5,-0.3 0.920 110.0 54.4 -61.7 -43.1 -92.8 -37.7 12.5 289 131 B I H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 5,-0.3 0.946 107.3 51.4 -54.2 -47.4 -95.2 -35.5 14.5 290 132 B D H X S+ 0 0 54 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.948 111.7 46.3 -55.4 -48.5 -92.3 -33.4 15.6 291 133 B W H X S+ 0 0 49 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.940 113.3 47.3 -63.2 -49.2 -91.1 -32.9 12.0 292 134 B L H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.905 112.0 50.5 -59.0 -46.1 -94.6 -32.1 10.5 293 135 B E H X S+ 0 0 38 -4,-2.7 4,-2.3 -5,-0.3 -1,-0.2 0.931 111.3 49.0 -58.6 -44.1 -95.4 -29.6 13.3 294 136 B T H X S+ 0 0 15 -4,-2.2 4,-2.5 -5,-0.3 -2,-0.2 0.931 110.6 49.3 -63.6 -46.7 -92.1 -27.8 12.7 295 137 B E H X S+ 0 0 7 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.944 110.4 50.9 -57.4 -48.9 -92.5 -27.6 9.0 296 138 B L H X S+ 0 0 6 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.886 111.9 47.1 -58.7 -38.6 -96.0 -26.2 9.4 297 139 B D H X S+ 0 0 86 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.861 108.1 55.9 -70.9 -35.4 -94.7 -23.6 11.8 298 140 B L H X S+ 0 0 1 -4,-2.5 4,-2.8 1,-0.2 5,-0.4 0.899 101.7 57.9 -62.5 -38.0 -91.8 -22.7 9.5 299 141 B I H X S+ 0 0 5 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.903 111.8 40.8 -58.7 -43.5 -94.3 -22.0 6.7 300 142 B Q H < S+ 0 0 124 -4,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.883 116.6 49.3 -70.1 -38.7 -96.0 -19.4 8.9 301 143 B K H < S+ 0 0 72 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.909 125.7 23.8 -74.1 -39.7 -92.8 -17.9 10.2 302 144 B M H < S- 0 0 1 -4,-2.8 4,-0.4 -5,-0.2 -1,-0.2 0.574 112.6-114.5-101.7 -9.4 -90.9 -17.4 7.0 303 145 B G X - 0 0 18 -4,-1.3 4,-2.0 -5,-0.4 5,-0.2 0.121 28.8 -84.1 87.1 155.5 -93.9 -17.3 4.6 304 146 B L H > S+ 0 0 95 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.922 123.2 52.3 -64.2 -45.7 -95.0 -19.7 1.9 305 147 B Q H > S+ 0 0 100 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.940 113.8 43.2 -55.7 -52.2 -92.7 -18.3 -0.9 306 148 B N H > S+ 0 0 11 -4,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.853 112.4 54.6 -61.6 -35.4 -89.6 -18.5 1.2 307 149 B Y H < S+ 0 0 0 -4,-2.0 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52.0 -64.1 -42.9 -60.0 -87.9 38.4 576 102 D R H X S+ 0 0 125 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.920 112.3 46.2 -60.0 -46.1 -57.1 -89.9 39.8 577 103 D E H X S+ 0 0 106 -4,-2.1 4,-2.0 1,-0.2 3,-0.2 0.973 113.9 47.6 -60.4 -51.2 -59.4 -92.8 40.6 578 104 D A H X S+ 0 0 2 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.866 109.2 54.2 -58.4 -40.9 -61.2 -92.7 37.2 579 105 D I H X S+ 0 0 14 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.902 108.3 48.4 -61.4 -44.3 -57.9 -92.5 35.3 580 106 D G H X S+ 0 0 39 -4,-1.7 4,-1.3 -3,-0.2 -1,-0.2 0.889 113.4 47.7 -65.6 -39.2 -56.5 -95.7 36.9 581 107 D Y H X S+ 0 0 56 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.907 107.1 54.6 -71.2 -42.4 -59.7 -97.6 36.2 582 108 D A H <>S+ 0 0 1 -4,-2.7 5,-2.4 1,-0.2 -1,-0.2 0.884 108.1 52.5 -55.1 -40.3 -59.9 -96.5 32.6 583 109 D D H ><5S+ 0 0 60 -4,-1.7 3,-1.0 3,-0.2 -1,-0.2 0.870 105.8 53.4 -62.1 -38.5 -56.4 -97.9 32.1 584 110 D S H 3<5S+ 0 0 73 -4,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.821 112.6 42.2 -78.5 -23.8 -57.4 -101.2 33.6 585 111 D V T 3<5S- 0 0 49 -4,-1.8 -1,-0.3 2,-0.1 -2,-0.2 0.273 116.2-113.9 -95.9 9.8 -60.3 -101.7 31.2 586 112 D H T < 5 + 0 0 129 -3,-1.0 2,-1.9 1,-0.2 3,-0.2 0.651 67.9 143.9 72.5 17.1 -58.2 -100.4 28.3 587 113 D D >< + 0 0 20 -5,-2.4 4,-2.2 1,-0.2 -1,-0.2 -0.495 17.5 163.1 -84.2 70.4 -60.2 -97.2 27.6 588 114 D Y H > + 0 0 114 -2,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.788 65.9 53.0 -65.2 -30.6 -57.1 -95.4 26.8 589 115 D V H > S+ 0 0 87 -3,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.943 108.6 48.1 -76.8 -40.6 -58.8 -92.5 25.0 590 116 D S H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.923 113.5 51.1 -53.4 -42.4 -61.1 -91.7 27.9 591 117 D R H X S+ 0 0 78 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.940 108.7 49.9 -59.7 -45.9 -57.9 -91.9 30.0 592 118 D D H X S+ 0 0 103 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.915 110.8 49.0 -63.2 -45.7 -56.1 -89.5 27.8 593 119 D M H X S+ 0 0 25 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.915 111.6 50.3 -59.2 -42.5 -58.9 -87.0 27.9 594 120 D M H X S+ 0 0 2 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.855 106.0 54.8 -66.0 -35.6 -59.0 -87.3 31.7 595 121 D I H X S+ 0 0 60 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D I H X S+ 0 0 16 -4,-3.0 4,-2.7 1,-0.2 5,-0.3 0.940 107.4 51.5 -53.9 -46.7 -55.1 -75.6 42.1 606 132 D D H X S+ 0 0 99 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.948 111.8 45.9 -56.4 -48.3 -51.8 -73.8 41.6 607 133 D W H X S+ 0 0 51 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.940 113.4 47.5 -64.3 -48.2 -53.5 -70.5 41.1 608 134 D L H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.912 111.9 50.4 -59.6 -46.6 -55.9 -70.8 44.1 609 135 D E H X S+ 0 0 88 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.2 0.928 111.3 49.3 -58.4 -43.6 -53.0 -71.9 46.4 610 136 D T H X S+ 0 0 62 -4,-2.2 4,-2.5 -5,-0.3 -2,-0.2 0.939 110.6 49.1 -63.8 -47.1 -50.9 -69.0 45.3 611 137 D E H X S+ 0 0 8 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.948 110.3 51.2 -56.1 -50.6 -53.7 -66.4 45.8 612 138 D L H X S+ 0 0 5 -4,-2.7 4,-1.2 1,-0.2 -1,-0.2 0.878 111.9 46.9 -57.6 -38.3 -54.4 -67.7 49.3 613 139 D D H X S+ 0 0 92 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.865 108.1 56.0 -71.0 -35.2 -50.8 -67.5 50.2 614 140 D L H X S+ 0 0 50 -4,-2.5 4,-2.8 1,-0.2 5,-0.4 0.905 101.6 57.8 -62.1 -39.0 -50.6 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M H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.922 113.5 46.4 -75.7 -36.3 -32.0 -0.1 2.5 1825 87 L L H X S+ 0 0 0 -4,-3.1 4,-2.4 -5,-0.2 -2,-0.2 0.934 112.1 51.8 -65.7 -42.7 -31.6 -2.4 5.4 1826 88 L R H X S+ 0 0 120 -4,-3.3 4,-2.5 -5,-0.2 -1,-0.2 0.858 107.6 53.6 -63.1 -35.0 -30.9 0.5 7.7 1827 89 L S H X S+ 0 0 12 -4,-1.8 4,-1.9 -5,-0.3 -1,-0.2 0.909 107.2 49.1 -70.6 -40.3 -34.0 2.2 6.5 1828 90 L D H X S+ 0 0 1 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.907 111.4 52.3 -61.3 -42.8 -36.2 -0.8 7.3 1829 91 L L H X S+ 0 0 21 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.930 107.5 49.7 -58.7 -48.2 -34.6 -0.9 10.8 1830 92 L A H X S+ 0 0 53 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.914 111.7 51.2 -58.1 -38.0 -35.4 2.8 11.4 1831 93 L L H X S+ 0 0 38 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.899 109.5 47.6 -66.6 -43.2 -39.0 2.1 10.4 1832 94 L E H X S+ 0 0 9 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.901 110.2 54.4 -63.4 -42.5 -39.3 -0.9 12.7 1833 95 L L H X S+ 0 0 71 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.906 108.9 46.9 -60.2 -43.0 -37.9 1.2 15.5 1834 96 L D H X S+ 0 0 88 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.861 113.4 48.7 -68.1 -34.3 -40.4 4.0 15.0 1835 97 L G H X S+ 0 0 12 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.858 107.5 54.3 -72.1 -35.4 -43.3 1.5 14.9 1836 98 L A H X S+ 0 0 2 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.913 107.3 52.7 -62.2 -38.6 -42.1 -0.2 18.0 1837 99 L K H X S+ 0 0 132 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.954 110.8 45.9 -59.9 -53.2 -42.2 3.1 19.8 1838 100 L N H X S+ 0 0 24 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.860 111.9 52.6 -56.2 -40.0 -45.8 3.7 18.6 1839 101 L L H X S+ 0 0 3 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.915 107.2 51.3 -64.9 -42.8 -46.7 0.2 19.7 1840 102 L R H X S+ 0 0 125 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.931 112.4 47.0 -60.5 -46.2 -45.3 0.7 23.2 1841 103 L E H X S+ 0 0 105 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.953 113.9 46.7 -60.2 -49.8 -47.3 3.9 23.5 1842 104 L A H X S+ 0 0 1 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.863 109.3 54.6 -60.5 -41.1 -50.6 2.3 22.2 1843 105 L I H X S+ 0 0 15 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.893 107.9 48.9 -60.6 -44.2 -50.2 -0.8 24.4 1844 106 L G H X S+ 0 0 38 -4,-1.7 4,-1.3 -5,-0.2 -1,-0.2 0.882 113.3 47.4 -65.5 -38.9 -49.9 1.3 27.6 1845 107 L Y H X S+ 0 0 55 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.908 107.0 54.9 -72.2 -41.9 -52.9 3.3 26.7 1846 108 L A H <>S+ 0 0 1 -4,-2.7 5,-2.4 1,-0.2 -1,-0.2 0.887 108.1 52.3 -55.6 -40.2 -55.1 0.2 25.8 1847 109 L D H ><5S+ 0 0 36 -4,-1.7 3,-1.1 1,-0.2 -1,-0.2 0.874 105.6 53.4 -62.4 -39.0 -54.4 -1.1 29.3 1848 110 L S H 3<5S+ 0 0 75 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.815 112.7 42.3 -78.2 -22.8 -55.4 2.1 30.9 1849 111 L V T 3<5S- 0 0 48 -4,-1.7 -1,-0.3 -3,-0.1 -2,-0.2 0.260 116.3-113.9 -96.8 10.3 -58.9 2.1 29.2 1850 112 L H T < 5 + 0 0 79 -3,-1.1 2,-1.9 1,-0.2 3,-0.2 0.647 67.8 144.0 71.5 17.9 -59.2 -1.7 29.8 1851 113 L D >< + 0 0 12 -5,-2.4 4,-2.3 -6,-0.2 -1,-0.2 -0.501 17.3 163.1 -84.1 69.8 -59.1 -2.7 26.1 1852 114 L Y H > + 0 0 5 -2,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.790 65.9 53.0 -64.5 -30.5 -57.2 -5.8 27.1 1853 115 L V H > S+ 0 0 10 -3,-0.2 4,-2.6 2,-0.2 5,-0.2 0.943 108.6 48.1 -76.7 -41.3 -57.9 -7.7 23.8 1854 116 L S H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.927 113.6 51.0 -53.6 -42.1 -56.6 -4.9 21.6 1855 117 L R H X S+ 0 0 60 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.934 108.7 50.2 -59.7 -46.1 -53.6 -4.8 24.0 1856 118 L D H X S+ 0 0 24 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.905 110.8 48.7 -63.0 -45.1 -53.1 -8.5 23.6 1857 119 L M H X S+ 0 0 25 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.916 111.6 50.5 -60.5 -42.0 -53.2 -8.3 19.9 1858 120 L M H X S+ 0 0 1 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.865 105.9 54.9 -66.0 -36.0 -50.7 -5.5 19.9 1859 121 L I H X S+ 0 0 60 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.912 107.6 49.8 -65.8 -40.4 -48.2 -7.3 22.2 1860 122 L E H X S+ 0 0 73 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.926 111.6 49.0 -62.2 -40.8 -48.1 -10.2 19.7 1861 123 L I H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 3,-0.4 0.947 108.9 52.2 -62.3 -46.0 -47.5 -7.8 16.9 1862 124 L L H X S+ 0 0 20 -4,-2.6 4,-3.0 1,-0.3 -1,-0.2 0.871 105.8 55.5 -59.4 -39.0 -44.7 -6.1 18.8 1863 125 L R H X S+ 0 0 174 -4,-2.1 4,-1.5 1,-0.2 -1,-0.3 0.877 108.0 48.3 -60.8 -38.6 -43.1 -9.5 19.4 1864 126 L D H X S+ 0 0 62 -4,-1.6 4,-1.7 -3,-0.4 -2,-0.2 0.873 113.5 47.8 -68.4 -33.9 -43.1 -10.0 15.6 1865 127 L E H X S+ 0 0 6 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.924 106.4 54.5 -72.1 -45.7 -41.5 -6.6 15.1 1866 128 L E H X S+ 0 0 90 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.874 107.6 54.3 -53.6 -39.2 -38.9 -7.1 17.7 1867 129 L G H X S+ 0 0 38 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.912 108.2 46.7 -60.8 -46.9 -38.1 -10.3 15.7 1868 130 L H H X S+ 0 0 14 -4,-1.7 4,-2.9 2,-0.2 5,-0.3 0.918 110.1 54.2 -61.5 -43.3 -37.6 -8.3 12.5 1869 131 L I H X S+ 0 0 16 -4,-2.9 4,-2.7 1,-0.2 5,-0.3 0.946 107.4 51.6 -54.3 -47.0 -35.5 -5.8 14.4 1870 132 L D H X S+ 0 0 100 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.949 111.8 46.0 -55.7 -48.8 -33.3 -8.7 15.5 1871 133 L W H X S+ 0 0 50 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.936 113.3 47.6 -63.4 -48.8 -32.9 -9.9 12.0 1872 134 L L H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.907 111.9 50.3 -58.6 -45.9 -32.1 -6.5 10.5 1873 135 L E H X S+ 0 0 90 -4,-2.7 4,-2.3 -5,-0.3 -1,-0.2 0.932 111.2 49.2 -59.2 -44.3 -29.6 -5.7 13.2 1874 136 L T H X S+ 0 0 61 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.934 110.6 49.3 -63.3 -46.8 -27.8 -9.0 12.7 1875 137 L E H X S+ 0 0 9 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.945 110.4 50.9 -57.0 -49.3 -27.6 -8.5 8.9 1876 138 L L H X S+ 0 0 6 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.881 111.9 47.1 -59.0 -37.9 -26.2 -5.0 9.3 1877 139 L D H X S+ 0 0 93 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.862 108.0 55.9 -71.1 -34.7 -23.5 -6.3 11.7 1878 140 L L H X S+ 0 0 51 -4,-2.4 4,-2.8 1,-0.2 5,-0.4 0.898 101.7 57.9 -62.9 -38.1 -22.7 -9.2 9.4 1879 141 L I H X S+ 0 0 5 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.907 111.8 40.6 -58.5 -43.9 -22.0 -6.7 6.6 1880 142 L Q H < S+ 0 0 130 -4,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.882 116.5 49.6 -69.9 -38.6 -19.4 -5.0 8.8 1881 143 L K H < S+ 0 0 162 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.911 125.6 23.7 -74.0 -39.6 -17.9 -8.2 10.2 1882 144 L M H < S- 0 0 73 -4,-2.8 4,-0.4 -5,-0.2 -1,-0.2 0.575 112.6-114.6-102.2 -8.9 -17.4 -10.1 6.9 1883 145 L G X - 0 0 30 -4,-1.3 4,-1.9 -5,-0.4 5,-0.2 0.110 28.8 -83.8 87.1 156.4 -17.3 -7.1 4.5 1884 146 L L H > S+ 0 0 92 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.927 123.1 52.7 -65.1 -46.0 -19.7 -6.1 1.8 1885 147 L Q H > S+ 0 0 102 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.942 113.7 43.1 -54.4 -52.9 -18.3 -8.3 -1.0 1886 148 L N H > S+ 0 0 71 -4,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.852 112.2 54.9 -61.3 -35.3 -18.5 -11.5 1.1 1887 149 L Y H < S+ 0 0 1 -4,-1.9 4,-0.2 -8,-0.2 -1,-0.2 0.936 108.8 47.0 -65.2 -44.5 -21.9 -10.5 2.4 1888 150 L L H >< S+ 0 0 8 -4,-2.7 3,-2.5 1,-0.2 4,-0.4 0.939 108.2 54.8 -62.7 -46.1 -23.3 -10.1 -1.1 1889 151 L Q H >< S+ 0 0 36 -4,-2.3 3,-1.3 1,-0.3 4,-0.3 0.887 103.0 58.4 -56.5 -34.9 -21.8 -13.4 -2.2 1890 152 L A T 3< S+ 0 0 52 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.567 102.1 55.3 -72.0 -5.7 -23.6 -15.0 0.7 1891 153 L Q T < S+ 0 0 2 -3,-2.5 -114,-2.4 -4,-0.2 -113,-0.4 0.439 81.9 88.0-102.3 -3.9 -27.0 -13.7 -0.6 1892 154 L I S < S+ 0 0 3 -3,-1.3 -116,-0.4 -4,-0.4 2,-0.4 0.800 85.5 50.8 -70.3 -32.0 -26.8 -15.3 -4.1 1893 155 L R S S- 0 0 74 -4,-0.3 -116,-0.1 -3,-0.1 2,-0.1 -0.869 88.3-115.7-110.6 139.6 -28.4 -18.6 -3.2 1894 156 L E 0 0 106 -2,-0.4 -117,-0.1 -118,-0.1 -118,-0.1 -0.446 360.0 360.0 -73.3 147.4 -31.7 -19.1 -1.3 1895 157 L E 0 0 220 -2,-0.1 -1,-0.1 -118,-0.1 -4,-0.0 -0.710 360.0 360.0 -83.6 360.0 -31.5 -20.8 2.1