==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 18-MAR-10 3M8J . COMPND 2 MOLECULE: FOCB PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR U.W.HULTDIN,S.HUANG,A.E.SAUER-ERIKSSON . 178 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10028.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 70.2 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 57.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.2 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 0 2 0 0 3 3 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 10 A G > 0 0 105 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 30.5 1.2 60.1 20.0 2 11 A G H > + 0 0 49 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.825 360.0 55.1 -55.1 -38.7 0.2 58.9 16.6 3 12 A D H > S+ 0 0 126 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.963 111.0 43.4 -66.1 -47.6 2.0 61.6 14.7 4 13 A A H > S+ 0 0 64 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.864 108.7 60.1 -60.9 -36.9 5.4 60.8 16.3 5 14 A F H X S+ 0 0 96 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.941 105.7 48.2 -56.3 -46.6 4.7 57.1 15.8 6 15 A L H X S+ 0 0 110 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.902 110.3 50.5 -64.0 -42.6 4.5 57.7 12.0 7 16 A L H X S+ 0 0 100 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.919 110.3 50.7 -59.9 -41.8 7.7 59.7 12.0 8 17 A K H X S+ 0 0 83 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.889 107.4 53.6 -64.0 -42.1 9.4 56.9 13.9 9 18 A L H X S+ 0 0 25 -4,-2.2 4,-0.6 2,-0.2 -1,-0.2 0.896 106.4 52.8 -60.4 -39.3 8.2 54.3 11.4 10 19 A R H >< S+ 0 0 204 -4,-1.9 3,-1.0 1,-0.2 -2,-0.2 0.947 111.0 46.0 -60.5 -46.6 9.7 56.3 8.5 11 20 A E H 3< S+ 0 0 146 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.848 120.0 40.4 -63.4 -36.2 13.1 56.5 10.2 12 21 A S H 3< S+ 0 0 34 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.354 81.3 146.5 -94.2 0.8 12.9 52.8 11.0 13 22 A A << - 0 0 50 -3,-1.0 2,-0.2 -4,-0.6 58,-0.1 -0.103 50.7-116.3 -55.9 135.8 11.4 51.4 7.7 14 23 A L - 0 0 16 56,-0.3 2,-0.2 1,-0.1 -1,-0.1 -0.432 29.6-133.3 -70.2 140.6 12.6 48.0 6.7 15 24 A S > - 0 0 79 -2,-0.2 3,-0.9 1,-0.1 4,-0.1 -0.559 24.3 -93.4 -91.7 156.6 14.4 47.7 3.4 16 25 A S T 3 S+ 0 0 45 1,-0.2 30,-0.3 -2,-0.2 -1,-0.1 -0.387 109.5 13.5 -63.3 137.5 14.0 45.3 0.4 17 26 A G T 3 S+ 0 0 44 28,-2.3 -1,-0.2 33,-0.1 30,-0.2 0.826 90.5 126.0 68.5 35.5 16.4 42.3 0.7 18 27 A S < + 0 0 59 28,-1.0 2,-0.3 -3,-0.9 29,-0.2 0.573 57.2 44.3-107.3 -7.5 17.3 43.0 4.3 19 28 A M S S- 0 0 16 27,-2.0 -2,-0.1 -4,-0.1 -1,-0.1 -0.961 73.2-110.8-141.3 157.8 16.6 39.7 6.1 20 29 A S > - 0 0 50 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.304 38.5-109.6 -70.5 162.2 16.9 36.0 6.0 21 30 A E H > S+ 0 0 98 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.887 119.7 54.1 -58.3 -41.7 13.9 33.8 5.5 22 31 A E H > S+ 0 0 91 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.948 110.0 45.1 -62.4 -48.7 14.2 32.6 9.1 23 32 A Q H > S+ 0 0 22 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.931 113.7 52.0 -58.6 -45.0 14.2 36.2 10.5 24 33 A F H X S+ 0 0 1 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.937 110.3 46.2 -56.7 -51.4 11.2 37.1 8.2 25 34 A F H X S+ 0 0 86 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.838 109.2 55.0 -69.8 -28.7 9.1 34.2 9.2 26 35 A L H X S+ 0 0 7 -4,-2.2 4,-1.7 -5,-0.2 -1,-0.2 0.921 109.9 46.6 -63.8 -43.6 9.8 34.8 12.9 27 36 A L H X S+ 0 0 1 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.917 113.2 49.2 -64.3 -43.5 8.5 38.4 12.5 28 37 A I H < S+ 0 0 16 -4,-2.7 5,-0.4 1,-0.2 -2,-0.2 0.926 107.1 57.6 -56.3 -42.6 5.5 37.1 10.5 29 38 A G H < S+ 0 0 17 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.877 108.3 44.0 -56.8 -42.1 4.9 34.6 13.3 30 39 A I H < S+ 0 0 6 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.850 104.9 84.4 -73.2 -29.6 4.7 37.3 15.9 31 40 A S S < S- 0 0 17 -4,-1.8 92,-0.1 -5,-0.2 42,-0.0 -0.109 79.3-130.2 -71.8 168.1 2.5 39.4 13.7 32 41 A S + 0 0 44 90,-0.1 2,-0.4 40,-0.0 -1,-0.1 0.022 60.9 136.1 -98.9 21.7 -1.2 39.3 13.2 33 42 A I + 0 0 12 -5,-0.4 -2,-0.0 1,-0.2 36,-0.0 -0.644 22.2 168.5 -74.0 123.3 -0.8 39.3 9.4 34 43 A H + 0 0 157 -2,-0.4 2,-0.3 5,-0.0 -1,-0.2 0.708 36.5 103.2-108.6 -32.4 -3.2 36.6 8.1 35 44 A S > - 0 0 29 1,-0.2 4,-2.5 2,-0.1 5,-0.2 -0.411 56.1-153.4 -67.3 120.6 -3.4 37.0 4.3 36 45 A D H > S+ 0 0 131 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.908 97.7 48.7 -58.5 -43.8 -1.3 34.3 2.5 37 46 A R H > S+ 0 0 92 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.877 110.1 51.9 -66.3 -35.6 -0.8 36.6 -0.5 38 47 A V H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.918 108.5 50.3 -66.3 -41.8 0.3 39.4 1.8 39 48 A I H X S+ 0 0 25 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.940 112.1 48.2 -61.3 -44.2 2.9 37.2 3.6 40 49 A L H X S+ 0 0 78 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.902 110.4 51.5 -63.4 -38.9 4.2 36.1 0.2 41 50 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.924 111.3 47.0 -63.1 -42.5 4.4 39.7 -1.0 42 51 A M H X S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 5,-0.3 0.861 111.7 51.6 -68.1 -33.8 6.3 40.8 2.1 43 52 A K H X>S+ 0 0 38 -4,-2.4 4,-2.6 2,-0.2 5,-1.9 0.943 108.0 51.7 -64.2 -45.7 8.7 37.8 1.7 44 53 A D H <5S+ 0 0 17 -4,-2.7 6,-2.5 -5,-0.2 -2,-0.2 0.891 118.3 38.3 -61.2 -37.4 9.3 38.7 -1.9 45 54 A Y H X5S+ 0 0 38 -4,-2.0 -28,-2.3 4,-0.2 4,-0.7 0.976 124.5 34.3 -74.8 -56.1 10.2 42.3 -0.8 46 55 A L H <5S+ 0 0 0 -4,-3.1 -27,-2.0 -30,-0.3 -28,-1.0 0.770 134.2 21.3 -74.8 -34.6 12.1 41.7 2.5 47 56 A V T <5S+ 0 0 36 -4,-2.6 -3,-0.2 -5,-0.3 -1,-0.1 0.845 129.4 38.1 -98.0 -52.5 13.8 38.5 1.7 48 57 A S T 4 - 0 0 52 1,-0.1 4,-2.2 -35,-0.1 5,-0.2 -0.331 23.5-113.8 -76.3 160.9 10.5 46.0 -5.7 52 61 A R H > S+ 0 0 92 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.921 120.2 53.3 -54.5 -47.4 7.3 47.4 -4.2 53 62 A K H > S+ 0 0 133 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.927 108.3 50.7 -56.8 -44.4 5.9 47.8 -7.7 54 63 A D H > S+ 0 0 83 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.929 113.1 43.0 -60.8 -47.0 6.7 44.1 -8.4 55 64 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.889 110.8 54.3 -71.2 -34.8 5.1 42.7 -5.3 56 65 A C H <>S+ 0 0 18 -4,-2.5 5,-2.1 2,-0.2 4,-0.3 0.885 113.2 44.4 -66.2 -34.9 2.0 44.9 -5.5 57 66 A E H ><5S+ 0 0 147 -4,-1.8 3,-0.8 -5,-0.2 -2,-0.2 0.935 115.2 47.1 -71.3 -46.5 1.4 43.7 -9.1 58 67 A K H 3<5S+ 0 0 120 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.863 122.7 32.5 -65.2 -38.4 2.1 40.1 -8.4 59 68 A Y T 3<5S- 0 0 28 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.197 105.9-116.2-112.5 17.9 -0.1 39.8 -5.3 60 69 A Q T < 5 + 0 0 133 -3,-0.8 2,-0.4 -4,-0.3 -3,-0.2 0.913 60.4 149.5 53.1 54.4 -2.8 42.3 -6.2 61 70 A M < - 0 0 12 -5,-2.1 -1,-0.2 -6,-0.1 -2,-0.1 -0.959 39.6-136.6-117.2 138.7 -2.2 44.8 -3.4 62 71 A N > - 0 0 113 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.319 35.5 -98.5 -82.0 172.3 -2.8 48.5 -3.5 63 72 A N H > S+ 0 0 94 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.892 122.1 53.5 -63.5 -38.1 -0.3 51.0 -2.2 64 73 A G H > S+ 0 0 41 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.881 108.7 49.9 -64.1 -39.6 -2.0 51.5 1.1 65 74 A Y H > S+ 0 0 84 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.940 114.5 44.4 -65.5 -44.1 -2.1 47.7 1.7 66 75 A F H X S+ 0 0 4 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.956 115.9 45.8 -61.8 -49.8 1.6 47.4 1.0 67 76 A S H X S+ 0 0 67 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.916 114.4 48.2 -64.9 -41.9 2.6 50.5 3.0 68 77 A T H X S+ 0 0 87 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.916 112.6 48.7 -63.2 -43.5 0.5 49.5 6.0 69 78 A T H X S+ 0 0 1 -4,-2.3 4,-2.1 -5,-0.2 5,-0.2 0.946 111.9 47.8 -66.1 -44.7 1.8 46.0 6.0 70 79 A L H X S+ 0 0 20 -4,-2.9 4,-2.6 1,-0.2 -56,-0.3 0.912 111.1 53.1 -61.0 -38.5 5.4 47.1 5.8 71 80 A G H X S+ 0 0 18 -4,-2.3 4,-2.6 -5,-0.3 -2,-0.2 0.901 105.9 53.2 -62.1 -40.6 4.6 49.6 8.6 72 81 A R H X S+ 0 0 102 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.921 113.1 43.0 -61.7 -42.4 3.2 46.7 10.7 73 82 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.848 110.9 55.0 -73.5 -35.9 6.4 44.7 10.3 74 83 A T H X S+ 0 0 2 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.944 108.2 49.9 -61.6 -43.7 8.6 47.8 10.8 75 84 A R H X S+ 0 0 84 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.934 111.6 48.3 -59.8 -46.1 6.8 48.4 14.2 76 85 A L H X S+ 0 0 6 -4,-1.9 4,-2.9 1,-0.2 5,-0.2 0.904 108.9 53.7 -64.0 -38.3 7.4 44.7 15.2 77 86 A N H X S+ 0 0 30 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.921 109.4 47.6 -60.9 -43.1 11.1 45.0 14.2 78 87 A V H X S+ 0 0 20 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.923 114.4 47.2 -61.8 -47.1 11.6 48.0 16.4 79 88 A L H X S+ 0 0 25 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.905 110.7 50.6 -65.0 -39.2 9.8 46.3 19.4 80 89 A V H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.901 107.3 54.3 -66.1 -37.3 11.7 43.1 19.0 81 90 A A H < S+ 0 0 41 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.874 108.5 49.8 -63.2 -36.1 15.0 45.1 18.9 82 91 A R H < S+ 0 0 132 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.792 112.9 47.6 -71.6 -25.6 13.9 46.6 22.3 83 92 A L H >< S+ 0 0 0 -4,-1.6 3,-1.9 1,-0.2 4,-0.3 0.787 91.4 82.4 -79.6 -29.5 13.2 43.1 23.6 84 93 A A G >< S+ 0 0 2 -4,-2.0 3,-2.3 1,-0.3 -1,-0.2 0.790 79.4 62.6 -53.2 -39.2 16.4 41.6 22.5 85 94 A P G > S+ 0 0 77 0, 0.0 3,-1.5 0, 0.0 -1,-0.3 0.803 95.1 63.5 -57.7 -24.8 18.6 42.7 25.4 86 95 A Y G < S+ 0 0 99 -3,-1.9 -2,-0.2 1,-0.3 -3,-0.1 0.598 98.1 56.2 -75.6 -5.8 16.4 40.7 27.8 87 96 A Y G < S+ 0 0 57 -3,-2.3 -1,-0.3 -4,-0.3 2,-0.1 0.201 91.8 102.3-107.2 11.9 17.5 37.5 26.0 88 97 A T S < S- 0 0 65 -3,-1.5 87,-0.0 -4,-0.1 0, 0.0 -0.463 85.6-105.0 -94.3 170.8 21.3 38.2 26.6 89 98 A D 0 0 181 -2,-0.1 -1,-0.1 1,-0.0 -3,-0.1 0.640 360.0 360.0 -62.8 -23.1 23.8 36.8 29.1 90 99 A S 0 0 150 -5,-0.2 -2,-0.1 0, 0.0 -1,-0.0 0.034 360.0 360.0 -44.7 360.0 23.8 39.9 31.3 91 !* 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 92 10 B G > 0 0 101 0, 0.0 4,-2.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0-138.2 1.9 20.4 12.7 93 11 B G H > + 0 0 53 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.764 360.0 54.4 -68.8 -32.9 -0.3 21.0 15.7 94 12 B D H > S+ 0 0 124 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.959 111.5 45.0 -67.7 -44.9 0.8 18.1 17.9 95 13 B A H > S+ 0 0 61 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.872 109.3 58.2 -66.7 -35.0 4.5 19.1 17.6 96 14 B F H X S+ 0 0 94 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.925 105.9 47.7 -56.8 -47.7 3.5 22.7 18.3 97 15 B L H X S+ 0 0 111 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.900 109.9 52.9 -64.1 -38.3 1.9 21.8 21.6 98 16 B L H X S+ 0 0 67 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.894 107.9 51.8 -62.3 -40.1 5.0 19.7 22.6 99 17 B K H X S+ 0 0 97 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.913 108.4 50.9 -63.8 -39.2 7.2 22.7 21.9 100 18 B L H < S+ 0 0 25 -4,-2.2 4,-0.5 2,-0.2 -1,-0.2 0.904 109.3 50.8 -66.2 -36.8 5.1 24.9 24.0 101 19 B R H >< S+ 0 0 174 -4,-2.1 3,-1.1 1,-0.2 -2,-0.2 0.960 112.3 47.0 -59.7 -47.6 5.3 22.4 26.9 102 20 B E H 3< S+ 0 0 135 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.770 120.1 37.9 -69.8 -22.7 9.1 22.3 26.5 103 21 B S T 3< S+ 0 0 32 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.247 83.0 154.1-109.7 9.4 9.4 26.1 26.4 104 22 B A < - 0 0 57 -3,-1.1 2,-0.2 -4,-0.5 58,-0.1 -0.055 44.9-123.1 -51.8 130.4 6.8 27.1 29.0 105 23 B L - 0 0 13 56,-0.3 2,-0.2 -5,-0.1 -1,-0.1 -0.537 32.3-149.5 -66.1 139.9 7.2 30.4 30.7 106 24 B S > - 0 0 67 -2,-0.2 3,-1.3 1,-0.1 4,-0.1 -0.615 28.3 -71.6-108.6 172.9 7.2 29.9 34.5 107 25 B S T 3 S+ 0 0 46 1,-0.3 30,-0.3 -2,-0.2 -1,-0.1 -0.354 117.6 8.3 -60.8 133.0 6.2 32.0 37.5 108 26 B G T 3 S+ 0 0 42 28,-2.6 -1,-0.3 33,-0.1 30,-0.2 0.759 85.7 138.2 69.6 24.7 8.5 35.0 38.1 109 27 B S < + 0 0 50 -3,-1.3 2,-0.3 28,-0.2 29,-0.2 0.549 60.1 28.0 -83.2 -6.8 10.4 34.4 34.9 110 28 B M S S- 0 0 17 27,-2.2 2,-0.1 -4,-0.1 30,-0.1 -0.984 73.1-104.0-155.1 163.3 10.6 38.1 33.8 111 29 B S > - 0 0 44 -2,-0.3 4,-2.4 1,-0.1 5,-0.1 -0.365 41.7-108.3 -78.3 162.9 10.8 41.8 34.6 112 30 B E H > S+ 0 0 92 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.886 115.9 49.9 -59.0 -44.5 7.8 44.1 34.2 113 31 B E H > S+ 0 0 116 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.886 110.3 49.3 -70.8 -38.0 9.2 46.0 31.2 114 32 B Q H > S+ 0 0 19 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.943 111.6 51.3 -59.9 -46.3 10.0 42.8 29.3 115 33 B F H X S+ 0 0 1 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.931 108.9 50.0 -56.4 -45.9 6.5 41.6 30.1 116 34 B F H X S+ 0 0 89 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.843 108.0 52.4 -65.5 -32.8 4.9 44.8 28.8 117 35 B L H X S+ 0 0 36 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.901 109.3 50.2 -66.1 -41.2 6.9 44.6 25.6 118 36 B L H X S+ 0 0 0 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.915 110.9 49.0 -62.8 -42.0 5.7 41.0 25.0 119 37 B I H < S+ 0 0 20 -4,-2.6 5,-0.4 1,-0.2 3,-0.3 0.922 107.6 56.6 -58.8 -41.9 2.1 42.2 25.7 120 38 B G H < S+ 0 0 33 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.873 110.3 43.0 -58.3 -39.5 2.7 45.0 23.2 121 39 B I H < S+ 0 0 6 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.733 106.3 82.1 -79.0 -20.4 3.7 42.6 20.4 122 40 B S S < S- 0 0 18 -4,-1.4 -90,-0.1 -3,-0.3 -92,-0.0 -0.172 80.5-128.3 -78.2 171.0 0.8 40.3 21.3 123 41 B S + 0 0 67 -92,-0.1 2,-0.5 2,-0.0 -1,-0.1 0.039 69.5 122.9-103.0 26.3 -2.8 40.4 20.3 124 42 B I + 0 0 13 -5,-0.4 -2,-0.1 1,-0.1 36,-0.0 -0.748 24.2 158.8 -85.7 125.2 -3.9 40.0 24.0 125 43 B H + 0 0 163 -2,-0.5 2,-0.5 5,-0.0 -1,-0.1 0.509 30.0 113.1-127.9 -5.1 -6.1 42.9 24.9 126 44 B S > - 0 0 41 1,-0.2 4,-2.3 2,-0.0 5,-0.2 -0.589 53.4-152.8 -69.8 119.9 -8.1 41.8 28.0 127 45 B D H > S+ 0 0 128 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 0.891 94.4 56.4 -60.1 -40.9 -7.0 43.9 31.0 128 46 B R H > S+ 0 0 102 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.943 109.8 41.9 -56.8 -50.2 -8.0 41.1 33.3 129 47 B V H > S+ 0 0 2 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.883 113.0 55.2 -75.2 -28.7 -5.8 38.5 31.6 130 48 B I H X S+ 0 0 22 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.937 110.7 45.0 -58.5 -48.8 -2.9 41.0 31.3 131 49 B L H X S+ 0 0 84 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.901 112.9 51.5 -67.1 -36.2 -3.0 41.6 35.1 132 50 B A H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.945 111.5 46.2 -64.8 -45.7 -3.2 37.9 35.8 133 51 B M H X S+ 0 0 1 -4,-2.7 4,-3.1 1,-0.2 5,-0.5 0.845 110.3 54.0 -68.9 -29.0 -0.2 37.2 33.6 134 52 B K H X>S+ 0 0 43 -4,-2.2 4,-2.2 2,-0.2 5,-2.2 0.943 108.0 50.0 -68.3 -44.0 1.8 40.0 35.2 135 53 B D H <5S+ 0 0 16 -4,-2.4 6,-2.6 3,-0.2 5,-0.2 0.901 119.9 37.4 -61.6 -39.0 1.1 38.6 38.6 136 54 B Y H X5S+ 0 0 23 -4,-2.0 -28,-2.6 4,-0.2 4,-0.6 0.976 126.1 32.8 -73.4 -59.2 2.3 35.1 37.5 137 55 B L H <5S+ 0 0 1 -4,-3.1 -27,-2.2 -30,-0.3 -28,-0.2 0.809 133.9 23.1 -74.5 -36.7 5.2 36.0 35.1 138 56 B V T <5S+ 0 0 31 -4,-2.2 -3,-0.2 -5,-0.5 -4,-0.1 0.876 128.2 38.4 -96.6 -54.9 6.5 39.1 36.8 139 57 B S T 4 - 0 0 49 -2,-0.1 4,-2.8 1,-0.1 5,-0.2 -0.395 21.9-116.0 -75.2 155.8 1.5 30.9 41.8 143 61 B R H > S+ 0 0 87 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.909 117.7 54.9 -52.4 -44.0 -1.0 29.8 39.2 144 62 B K H > S+ 0 0 159 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.930 110.7 43.7 -56.4 -50.4 -3.4 28.8 42.0 145 63 B D H > S+ 0 0 85 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.922 114.2 49.8 -66.2 -41.5 -3.2 32.3 43.6 146 64 B V H X S+ 0 0 1 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.936 109.1 51.3 -65.9 -43.2 -3.6 34.1 40.3 147 65 B C H <>S+ 0 0 21 -4,-2.9 5,-2.1 -5,-0.2 4,-0.5 0.884 112.0 47.8 -62.7 -33.8 -6.6 32.0 39.2 148 66 B E H ><5S+ 0 0 125 -4,-1.7 3,-0.5 -5,-0.2 -1,-0.2 0.932 111.4 49.7 -69.4 -43.9 -8.3 32.8 42.5 149 67 B K H 3<5S+ 0 0 142 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.857 122.7 31.1 -65.8 -37.4 -7.6 36.5 42.4 150 68 B Y T 3<5S- 0 0 42 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.316 105.1-123.3-103.8 5.5 -8.9 36.9 38.8 151 69 B Q T < 5 + 0 0 148 -3,-0.5 2,-0.3 -4,-0.5 -3,-0.2 0.943 56.8 159.2 51.2 54.8 -11.5 34.2 39.1 152 70 B M < - 0 0 14 -5,-2.1 -1,-0.2 -6,-0.2 2,-0.2 -0.828 35.9-133.6-111.7 143.5 -9.9 32.4 36.1 153 71 B N > - 0 0 109 -2,-0.3 4,-2.4 1,-0.1 3,-0.3 -0.552 28.4-107.6 -93.8 167.0 -10.2 28.8 35.0 154 72 B N H > S+ 0 0 94 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.864 114.8 57.1 -66.5 -34.1 -7.3 26.6 34.0 155 73 B G H > S+ 0 0 42 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.921 112.0 41.3 -58.9 -46.2 -8.3 26.5 30.3 156 74 B Y H > S+ 0 0 73 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.919 117.1 47.8 -70.3 -42.3 -8.1 30.3 30.1 157 75 B F H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.953 115.6 44.3 -61.4 -49.0 -5.0 30.6 32.2 158 76 B S H X S+ 0 0 41 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.897 112.9 51.0 -67.9 -42.3 -3.1 27.8 30.3 159 77 B T H X S+ 0 0 86 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.921 113.1 45.8 -58.3 -46.4 -4.2 29.1 26.8 160 78 B T H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.930 111.6 50.5 -65.6 -43.5 -3.0 32.6 27.7 161 79 B L H X S+ 0 0 10 -4,-2.7 4,-2.8 1,-0.2 -56,-0.3 0.903 109.6 53.0 -60.1 -39.0 0.2 31.4 29.1 162 80 B G H X S+ 0 0 16 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.879 105.5 53.6 -64.8 -38.1 0.7 29.4 25.9 163 81 B R H X S+ 0 0 95 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.920 113.0 43.1 -62.6 -39.8 0.2 32.5 23.8 164 82 B L H X S+ 0 0 1 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.870 111.6 53.8 -71.9 -36.1 2.9 34.3 25.7 165 83 B T H X S+ 0 0 3 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.930 108.5 51.3 -61.2 -45.0 5.2 31.2 25.7 166 84 B R H X S+ 0 0 86 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.929 111.7 45.8 -57.3 -49.0 4.8 31.1 21.9 167 85 B L H X S+ 0 0 10 -4,-1.9 4,-2.9 1,-0.2 -1,-0.2 0.922 110.9 53.2 -62.9 -40.0 5.7 34.8 21.5 168 86 B N H X S+ 0 0 27 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.899 107.6 50.9 -62.0 -38.8 8.7 34.4 23.9 169 87 B V H X S+ 0 0 20 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.926 112.5 47.2 -64.8 -42.8 10.1 31.5 21.9 170 88 B L H X S+ 0 0 22 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.927 112.9 48.0 -66.4 -42.1 9.8 33.6 18.7 171 89 B V H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.909 110.1 52.0 -64.5 -40.1 11.4 36.6 20.3 172 90 B A H < S+ 0 0 40 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.893 110.5 49.0 -62.9 -40.3 14.3 34.5 21.7 173 91 B R H < S+ 0 0 121 -4,-2.2 -1,-0.2 1,-0.2 4,-0.2 0.819 113.2 47.7 -67.4 -30.2 14.9 33.1 18.2 174 92 B L H >< S+ 0 0 0 -4,-1.8 3,-2.1 -5,-0.2 4,-0.3 0.818 90.9 84.0 -76.1 -29.0 14.9 36.6 16.8 175 93 B A G >X S+ 0 0 5 -4,-2.1 3,-2.4 1,-0.3 4,-0.9 0.786 80.1 60.1 -49.9 -40.4 17.2 38.0 19.5 176 94 B P G 34 S+ 0 0 92 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.744 97.4 62.2 -65.6 -18.4 20.5 37.0 17.8 177 95 B Y G <4 S+ 0 0 87 -3,-2.1 -2,-0.2 -4,-0.2 -3,-0.1 0.571 112.8 36.3 -74.5 -6.9 19.6 39.1 14.8 178 96 B Y T <4 0 0 58 -3,-2.4 -1,-0.2 -4,-0.3 -3,-0.1 0.506 360.0 360.0-120.8 -9.2 19.6 42.3 17.0 179 97 B T < 0 0 116 -4,-0.9 -2,-0.1 -3,-0.2 -1,-0.1 -0.101 360.0 360.0-100.4 360.0 22.4 41.7 19.5