==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 23-OCT-08 2K9Q . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR T.A.RAMELOT,J.R.CORT,L.ZHAO,M.JIANG,E.L.FOOTE,R.XIAO,R.NAIR, . 154 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12112.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 95 61.7 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 . 8 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 48.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.9 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 0 0 6 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 196 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 70.9 8.4 15.5 6.8 2 2 A E > - 0 0 153 1,-0.1 4,-2.3 38,-0.0 5,-0.3 -0.092 360.0 -85.3 -79.8-173.2 8.5 11.7 7.3 3 3 A L H > S+ 0 0 52 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.924 132.5 39.6 -62.4 -43.1 6.0 9.2 5.9 4 4 A S H > S+ 0 0 44 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.858 111.9 58.0 -75.7 -33.5 3.6 9.7 8.8 5 5 A N H > S+ 0 0 70 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.948 110.2 42.0 -63.4 -45.6 4.2 13.5 8.9 6 6 A E H X S+ 0 0 26 -4,-2.3 4,-2.2 1,-0.2 5,-0.3 0.886 108.9 60.1 -69.3 -34.5 3.2 14.1 5.3 7 7 A L H X S+ 0 0 23 -4,-1.4 4,-1.5 -5,-0.3 -1,-0.2 0.878 106.7 47.7 -60.7 -33.5 0.2 11.7 5.8 8 8 A K H X S+ 0 0 105 -4,-1.6 4,-3.1 2,-0.2 5,-0.3 0.881 106.7 57.5 -74.5 -36.5 -1.0 14.1 8.5 9 9 A V H X S+ 0 0 77 -4,-1.6 4,-3.5 2,-0.2 5,-0.3 0.941 107.9 45.5 -61.5 -46.6 -0.5 17.1 6.3 10 10 A E H X S+ 0 0 20 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.942 115.1 47.8 -65.2 -42.3 -2.8 15.8 3.5 11 11 A R H X>S+ 0 0 46 -4,-1.5 5,-1.1 -5,-0.3 4,-0.9 0.959 118.7 40.3 -62.6 -47.2 -5.4 14.8 6.1 12 12 A I H <5S+ 0 0 116 -4,-3.1 -2,-0.2 3,-0.2 -1,-0.2 0.924 114.1 53.2 -67.6 -43.3 -5.2 18.2 7.9 13 13 A R H <5S+ 0 0 154 -4,-3.5 -2,-0.2 -5,-0.3 -1,-0.2 0.939 124.7 27.1 -59.6 -43.6 -4.9 20.1 4.5 14 14 A L H <5S- 0 0 56 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.504 104.1-138.5 -95.0 -4.2 -8.1 18.5 3.3 15 15 A S T <5 - 0 0 93 -4,-0.9 2,-0.4 -5,-0.3 -3,-0.2 0.949 31.7-179.7 45.1 78.7 -9.4 18.0 6.9 16 16 A L < - 0 0 39 -5,-1.1 -1,-0.2 4,-0.0 2,-0.1 -0.913 18.8-138.1-112.3 133.2 -10.8 14.4 6.5 17 17 A T > - 0 0 79 -2,-0.4 4,-2.1 1,-0.1 5,-0.2 -0.493 16.2-125.3 -85.6 159.4 -12.5 12.6 9.5 18 18 A A H > S+ 0 0 33 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.896 110.9 51.1 -70.2 -38.6 -11.9 9.0 10.2 19 19 A K H > S+ 0 0 114 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.956 113.1 43.6 -65.6 -48.2 -15.6 8.2 10.2 20 20 A S H > S+ 0 0 62 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.946 118.9 44.4 -63.3 -44.9 -16.1 9.9 6.8 21 21 A V H X S+ 0 0 4 -4,-2.1 4,-3.5 2,-0.2 5,-0.3 0.927 112.6 51.4 -66.2 -43.8 -13.0 8.2 5.4 22 22 A A H X>S+ 0 0 6 -4,-3.1 4,-2.7 -5,-0.2 5,-1.4 0.928 112.6 45.5 -62.6 -41.8 -13.8 4.8 6.9 23 23 A E H <5S+ 0 0 145 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.944 118.5 42.3 -67.9 -43.2 -17.3 4.8 5.4 24 24 A E H <5S+ 0 0 136 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.937 118.2 45.9 -68.1 -43.5 -16.1 6.0 2.0 25 25 A M H <5S- 0 0 38 -4,-3.5 -2,-0.2 -5,-0.3 -1,-0.2 0.907 105.8-131.4 -66.1 -39.3 -13.0 3.6 2.1 26 26 A G T <5 + 0 0 64 -4,-2.7 2,-0.3 -5,-0.3 -3,-0.2 0.754 66.6 112.7 93.1 27.0 -15.2 0.7 3.3 27 27 A I S - 0 0 73 -2,-0.3 4,-1.5 1,-0.1 3,-0.2 -0.384 31.9-120.6 -73.7 155.3 -13.4 -0.2 10.0 29 29 A R H > S+ 0 0 123 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.889 114.3 60.6 -63.9 -34.9 -12.1 2.9 11.9 30 30 A Q H > S+ 0 0 152 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.921 102.0 52.1 -59.3 -41.0 -9.8 0.6 13.8 31 31 A Q H > S+ 0 0 89 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.912 106.2 54.3 -63.1 -38.8 -8.1 -0.4 10.5 32 32 A L H X S+ 0 0 3 -4,-1.5 4,-1.6 1,-0.2 3,-0.3 0.931 105.4 52.6 -61.9 -42.0 -7.6 3.3 9.7 33 33 A C H X S+ 0 0 47 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.879 102.5 60.4 -62.1 -33.8 -5.9 3.8 13.1 34 34 A N H < S+ 0 0 106 -4,-1.6 4,-0.2 1,-0.2 -1,-0.2 0.909 101.0 53.5 -61.5 -38.8 -3.5 1.0 12.1 35 35 A I H >< S+ 0 0 6 -4,-1.4 3,-1.3 -3,-0.3 -1,-0.2 0.936 108.0 49.6 -62.8 -43.3 -2.4 2.9 9.1 36 36 A E H 3< S+ 0 0 80 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.886 114.8 44.5 -63.8 -35.3 -1.5 5.9 11.2 37 37 A Q T 3< S+ 0 0 150 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.377 90.5 121.8 -89.5 6.8 0.5 3.7 13.6 38 38 A S < - 0 0 32 -3,-1.3 2,-0.6 -4,-0.2 3,-0.1 -0.241 65.6-121.0 -65.0 159.4 2.1 1.9 10.6 39 39 A E - 0 0 144 1,-0.1 -1,-0.1 -36,-0.0 -2,-0.1 -0.903 60.2 -49.7-108.5 118.9 5.9 1.9 10.4 40 40 A T S S- 0 0 96 -2,-0.6 -1,-0.1 2,-0.0 -38,-0.0 0.131 95.5 -46.1 46.2-173.6 7.5 3.5 7.3 41 41 A A - 0 0 23 1,-0.1 2,-0.0 -3,-0.1 -38,-0.0 -0.645 64.1-113.9 -88.4 146.3 6.2 2.4 3.9 42 42 A P > - 0 0 42 0, 0.0 4,-1.9 0, 0.0 3,-0.3 -0.313 23.5-112.6 -74.5 159.4 5.7 -1.4 3.2 43 43 A V H > S+ 0 0 50 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.828 115.1 65.5 -62.9 -28.3 7.8 -3.3 0.7 44 44 A V H > S+ 0 0 21 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.954 104.7 42.7 -60.7 -46.9 4.6 -3.7 -1.4 45 45 A V H > S+ 0 0 12 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.931 114.0 51.4 -65.7 -43.0 4.4 0.1 -2.0 46 46 A K H X S+ 0 0 95 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.925 108.5 51.9 -61.4 -41.1 8.1 0.3 -2.6 47 47 A Y H X S+ 0 0 3 -4,-2.9 4,-1.4 1,-0.2 3,-0.2 0.945 110.0 49.0 -61.2 -44.3 7.9 -2.5 -5.2 48 48 A I H X S+ 0 0 25 -4,-2.0 4,-1.9 1,-0.2 3,-0.3 0.933 105.5 56.9 -62.4 -42.7 5.1 -0.7 -7.0 49 49 A A H X S+ 0 0 35 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.884 101.3 59.4 -57.1 -33.6 7.1 2.6 -7.0 50 50 A F H X S+ 0 0 23 -4,-1.6 4,-0.7 -3,-0.2 -1,-0.2 0.937 102.4 51.0 -61.9 -43.9 9.8 0.6 -8.8 51 51 A L H ><>S+ 0 0 5 -4,-1.4 5,-1.6 -3,-0.3 3,-1.2 0.924 108.5 52.3 -61.3 -40.3 7.4 -0.2 -11.7 52 52 A R H ><5S+ 0 0 66 -4,-1.9 3,-3.0 1,-0.3 -1,-0.2 0.918 99.5 62.6 -62.8 -38.8 6.5 3.5 -12.0 53 53 A S H 3<5S+ 0 0 98 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.766 99.1 57.6 -58.4 -19.1 10.3 4.3 -12.2 54 54 A K T <<5S- 0 0 105 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.393 125.0-105.6 -91.7 5.3 10.1 2.2 -15.4 55 55 A G T < 5 + 0 0 68 -3,-3.0 2,-0.2 1,-0.2 -3,-0.2 0.712 62.6 164.8 80.8 18.2 7.4 4.6 -16.9 56 56 A V < - 0 0 15 -5,-1.6 2,-3.1 1,-0.1 3,-0.3 -0.490 48.3-117.7 -70.8 134.6 4.6 2.0 -16.3 57 57 A D > + 0 0 84 1,-0.2 4,-1.6 -2,-0.2 -1,-0.1 -0.342 52.6 157.8 -70.9 70.9 1.2 3.6 -16.5 58 58 A L H > S+ 0 0 20 -2,-3.1 4,-1.8 1,-0.2 5,-0.3 0.920 70.1 54.9 -63.5 -42.0 0.4 2.7 -12.8 59 59 A N H > S+ 0 0 66 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.928 106.8 50.1 -59.7 -42.8 -2.3 5.5 -12.7 60 60 A A H > S+ 0 0 39 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.875 104.9 60.0 -64.2 -33.7 -4.1 4.0 -15.7 61 61 A L H X S+ 0 0 22 -4,-1.6 4,-1.2 1,-0.2 -2,-0.2 0.960 110.3 38.9 -61.1 -49.0 -4.0 0.6 -14.0 62 62 A F H X S+ 0 0 57 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.882 110.7 60.0 -69.7 -35.0 -6.0 1.8 -11.0 63 63 A D H < S+ 0 0 75 -4,-2.2 -1,-0.2 -5,-0.3 7,-0.2 0.891 102.8 54.1 -60.0 -35.1 -8.3 3.9 -13.2 64 64 A R H < S+ 0 0 106 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.898 105.0 52.9 -66.0 -40.6 -9.3 0.7 -15.0 65 65 A I H < S+ 0 0 101 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.930 102.0 66.9 -63.8 -44.5 -10.3 -1.0 -11.7 66 66 A I S < S+ 0 0 94 -4,-1.9 0, 0.0 2,-0.0 0, 0.0 -0.479 104.6 2.2 -78.5 150.1 -12.6 1.8 -10.6 67 67 A V S S- 0 0 118 -2,-0.1 3,-0.2 2,-0.1 0, 0.0 0.319 113.9 -40.9 56.9 160.7 -15.8 2.5 -12.6 68 68 A N S S- 0 0 144 1,-0.2 2,-0.9 0, 0.0 -2,-0.0 0.015 86.8 -74.7 -46.4 162.2 -16.8 0.3 -15.6 69 69 A K - 0 0 130 -4,-0.0 2,-0.5 1,-0.0 -1,-0.2 -0.474 56.8-156.9 -65.7 104.6 -13.8 -0.6 -17.9 70 70 A L + 0 0 90 -2,-0.9 -1,-0.0 -3,-0.2 -7,-0.0 -0.722 45.0 116.7 -87.9 127.6 -13.2 2.7 -19.7 71 71 A E + 0 0 108 -2,-0.5 -1,-0.2 -7,-0.0 3,-0.1 0.305 17.3 164.2-151.5 -61.3 -11.4 2.4 -23.0 72 72 A H + 0 0 157 1,-0.2 2,-0.5 2,-0.1 -2,-0.1 0.782 36.2 153.4 37.3 26.9 -13.5 3.5 -26.1 73 73 A H + 0 0 118 1,-0.1 -1,-0.2 2,-0.0 3,-0.0 -0.745 12.9 136.2 -90.2 127.3 -10.1 3.5 -27.8 74 74 A H + 0 0 176 -2,-0.5 -1,-0.1 -3,-0.1 3,-0.1 0.255 44.2 102.2-146.8 2.2 -10.1 2.9 -31.6 75 75 A H S S- 0 0 122 1,-0.1 2,-0.1 0, 0.0 -2,-0.0 -0.282 85.8 -75.0 -84.5 175.3 -7.6 5.6 -32.8 76 76 A H 0 0 149 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.1 -0.407 360.0 360.0 -70.6 147.5 -4.0 4.8 -33.8 77 77 A H 0 0 246 -3,-0.1 -1,-0.2 -2,-0.1 0, 0.0 -0.248 360.0 360.0 -45.8 360.0 -1.6 4.1 -30.9 78 !* 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 79 1 B M 0 0 130 0, 0.0 5,-0.3 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 -17.2 -8.2 -8.5 -14.1 80 2 B E > - 0 0 154 3,-0.1 4,-1.7 2,-0.1 5,-0.2 0.744 360.0-123.7 57.0 121.7 -6.7 -9.3 -10.7 81 3 B L H > S+ 0 0 65 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.920 110.9 55.4 -62.6 -42.0 -3.9 -6.9 -9.5 82 4 B S H > S+ 0 0 46 35,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.916 105.2 52.8 -59.5 -41.1 -1.4 -9.7 -9.1 83 5 B N H > S+ 0 0 68 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.923 109.6 48.2 -62.7 -41.2 -1.9 -10.9 -12.7 84 6 B E H X S+ 0 0 39 -4,-1.7 4,-2.3 -5,-0.3 5,-0.3 0.879 105.8 58.8 -67.6 -35.4 -1.2 -7.4 -14.0 85 7 B L H X S+ 0 0 33 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.941 107.7 45.3 -61.0 -44.4 1.9 -7.1 -11.8 86 8 B K H X S+ 0 0 100 -4,-1.8 4,-2.8 2,-0.2 5,-0.3 0.905 109.5 56.1 -66.2 -39.4 3.5 -10.2 -13.5 87 9 B V H X S+ 0 0 39 -4,-1.8 4,-2.9 1,-0.2 5,-0.2 0.951 109.4 45.3 -60.0 -46.4 2.5 -9.0 -17.0 88 10 B E H X S+ 0 0 24 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.917 112.6 52.1 -64.1 -39.2 4.4 -5.7 -16.5 89 11 B R H X>S+ 0 0 46 -4,-1.9 5,-1.3 -5,-0.3 4,-0.8 0.942 113.0 44.3 -61.6 -45.3 7.3 -7.6 -15.0 90 12 B I H <5S+ 0 0 122 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.922 112.7 51.2 -66.3 -43.7 7.4 -9.9 -18.1 91 13 B R H <5S+ 0 0 185 -4,-2.9 -2,-0.2 -5,-0.3 -1,-0.2 0.929 119.2 36.5 -61.8 -41.4 6.9 -6.9 -20.5 92 14 B L H <5S- 0 0 61 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.591 96.5-150.5 -86.0 -8.3 9.8 -5.1 -18.9 93 15 B S T <5 + 0 0 94 -4,-0.8 -3,-0.2 -5,-0.2 -4,-0.1 0.900 30.9 177.4 40.3 48.1 11.6 -8.5 -18.4 94 16 B L < - 0 0 30 -5,-1.3 2,-0.4 1,-0.1 -1,-0.1 -0.404 26.8-121.6 -79.6 159.8 13.2 -7.0 -15.3 95 17 B T > - 0 0 83 1,-0.1 4,-1.8 -2,-0.1 3,-0.5 -0.862 1.6-144.8-105.5 134.4 15.6 -9.0 -13.0 96 18 B A H > S+ 0 0 41 -2,-0.4 4,-2.8 1,-0.2 5,-0.3 0.775 97.8 70.5 -65.5 -23.2 14.8 -9.5 -9.3 97 19 B K H > S+ 0 0 132 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.947 104.7 37.7 -60.9 -46.2 18.6 -9.4 -8.7 98 20 B S H > S+ 0 0 51 -3,-0.5 4,-2.6 2,-0.2 5,-0.3 0.909 116.7 52.1 -72.6 -41.4 18.7 -5.7 -9.5 99 21 B V H X S+ 0 0 1 -4,-1.8 4,-3.5 1,-0.2 5,-0.3 0.944 111.0 46.1 -62.6 -46.6 15.4 -4.9 -7.8 100 22 B A H X>S+ 0 0 3 -4,-2.8 4,-2.6 2,-0.2 5,-1.1 0.911 113.5 49.7 -65.4 -38.1 16.3 -6.6 -4.5 101 23 B E H <5S+ 0 0 148 -4,-1.5 -2,-0.2 -5,-0.3 -1,-0.2 0.951 119.4 37.2 -66.1 -44.9 19.7 -4.9 -4.5 102 24 B E H <5S+ 0 0 122 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.911 118.8 49.3 -73.2 -40.8 18.2 -1.5 -5.1 103 25 B M H <5S- 0 0 35 -4,-3.5 -3,-0.2 -5,-0.3 -2,-0.2 0.913 102.2-135.1 -65.5 -39.9 15.1 -2.2 -2.9 104 26 B G T <5 + 0 0 65 -4,-2.6 2,-0.3 -5,-0.3 -3,-0.2 0.789 63.2 114.1 89.9 29.1 17.4 -3.4 -0.1 105 27 B I S - 0 0 66 -2,-0.3 4,-1.5 1,-0.1 3,-0.1 -0.388 33.5-126.3 -69.2 149.3 15.9 -10.3 0.5 107 29 B R H > S+ 0 0 120 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.898 111.2 59.4 -64.5 -36.0 15.1 -11.8 -2.9 108 30 B Q H > S+ 0 0 125 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.925 103.9 50.4 -59.0 -42.2 12.8 -14.3 -1.2 109 31 B Q H > S+ 0 0 96 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.879 103.2 60.6 -65.1 -34.0 10.7 -11.4 0.2 110 32 B L H X S+ 0 0 9 -4,-1.5 4,-1.3 1,-0.2 -1,-0.2 0.942 103.9 49.3 -59.7 -43.2 10.5 -10.0 -3.4 111 33 B C H X S+ 0 0 56 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.897 109.2 53.2 -62.6 -37.5 8.8 -13.2 -4.5 112 34 B N H < S+ 0 0 89 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.835 99.0 63.7 -68.5 -29.8 6.4 -12.9 -1.5 113 35 B I H >< S+ 0 0 9 -4,-1.9 3,-1.0 -3,-0.2 -1,-0.2 0.951 107.1 41.7 -61.7 -44.8 5.5 -9.3 -2.6 114 36 B E H 3< S+ 0 0 34 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.900 120.6 43.3 -69.8 -35.6 4.0 -10.5 -5.8 115 37 B Q T 3< S+ 0 0 145 -4,-1.7 2,-1.8 -5,-0.2 -1,-0.3 0.275 77.8 119.1 -90.5 13.5 2.3 -13.5 -4.0 116 38 B S S < S- 0 0 29 -3,-1.0 2,-1.6 1,-0.2 -1,-0.2 0.091 77.6-130.1 -68.5 34.7 1.3 -11.1 -1.2 117 39 B E S S- 0 0 170 -2,-1.8 2,-0.3 -5,-0.1 -35,-0.2 -0.246 74.2 -5.1 53.2 -86.5 -2.3 -12.1 -2.0 118 40 B T S S- 0 0 97 -2,-1.6 -3,-0.0 -3,-0.1 0, 0.0 -0.856 83.7 -92.1-131.9 168.1 -3.6 -8.5 -2.2 119 41 B A - 0 0 15 -2,-0.3 -38,-0.0 1,-0.1 5,-0.0 -0.454 48.4-100.9 -79.0 155.9 -2.2 -5.0 -1.5 120 42 B P >> - 0 0 44 0, 0.0 3,-1.2 0, 0.0 4,-1.1 -0.263 32.6-104.6 -71.9 160.7 -2.6 -3.4 2.0 121 43 B V H 3> S+ 0 0 39 1,-0.3 4,-3.1 2,-0.2 5,-0.2 0.745 115.6 76.6 -59.5 -18.4 -5.2 -0.8 2.8 122 44 B V H 3> S+ 0 0 34 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.944 93.2 48.5 -59.5 -44.6 -2.3 1.7 2.7 123 45 B V H <> S+ 0 0 15 -3,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.945 113.0 47.6 -61.6 -44.6 -2.3 1.6 -1.1 124 46 B K H X S+ 0 0 120 -4,-1.1 4,-1.9 1,-0.2 -2,-0.2 0.918 108.2 55.6 -63.2 -40.3 -6.1 2.1 -1.2 125 47 B Y H X S+ 0 0 3 -4,-3.1 4,-1.8 1,-0.2 5,-0.2 0.924 105.9 51.7 -59.4 -41.2 -5.7 5.0 1.3 126 48 B I H X S+ 0 0 31 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.935 106.1 53.8 -62.3 -43.2 -3.3 6.7 -1.1 127 49 B A H X S+ 0 0 43 -4,-1.9 4,-3.1 1,-0.2 -1,-0.2 0.889 104.1 57.5 -59.7 -35.5 -5.7 6.3 -4.0 128 50 B F H X S+ 0 0 41 -4,-1.9 4,-0.6 2,-0.2 -1,-0.2 0.967 111.8 39.3 -61.1 -49.8 -8.3 8.1 -1.8 129 51 B L H ><>S+ 0 0 3 -4,-1.8 5,-1.5 1,-0.2 3,-1.0 0.911 116.5 52.0 -66.5 -39.8 -6.1 11.2 -1.3 130 52 B R H ><5S+ 0 0 74 -4,-2.9 3,-3.0 1,-0.3 -2,-0.2 0.921 99.8 62.4 -63.3 -41.1 -5.0 10.9 -5.0 131 53 B S H 3<5S+ 0 0 104 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.764 97.9 59.3 -57.2 -20.2 -8.6 10.8 -6.2 132 54 B K T <<5S- 0 0 82 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.356 127.8-101.1 -90.3 8.4 -8.9 14.3 -4.6 133 55 B G T < 5 + 0 0 56 -3,-3.0 -3,-0.2 1,-0.2 2,-0.2 0.723 64.0 167.8 81.8 19.7 -6.1 15.5 -7.0 134 56 B V < - 0 0 20 -5,-1.5 2,-3.5 -4,-0.2 3,-0.3 -0.470 50.2-108.5 -69.4 134.4 -3.5 15.3 -4.2 135 57 B D > + 0 0 97 1,-0.2 4,-1.9 -2,-0.2 -1,-0.1 -0.251 56.9 158.7 -61.4 70.3 0.1 15.7 -5.6 136 58 B L H > S+ 0 0 14 -2,-3.5 4,-2.4 1,-0.2 5,-0.3 0.929 70.6 54.0 -63.6 -42.6 0.8 12.0 -5.0 137 59 B N H > S+ 0 0 98 -3,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.929 108.7 48.7 -59.6 -42.0 3.6 12.0 -7.6 138 60 B A H > S+ 0 0 35 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.901 108.7 54.7 -65.4 -37.0 5.3 15.0 -5.8 139 61 B L H X S+ 0 0 39 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.955 113.5 40.1 -62.4 -47.0 5.0 13.2 -2.5 140 62 B F H X S+ 0 0 45 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.870 110.1 61.0 -70.4 -33.6 6.8 10.1 -3.8 141 63 B D H < S+ 0 0 45 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.923 102.7 51.3 -60.1 -41.1 9.3 12.3 -5.7 142 64 B R H < S+ 0 0 145 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.884 105.2 56.1 -64.6 -37.4 10.4 13.9 -2.4 143 65 B I H < S+ 0 0 105 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.939 97.9 71.0 -63.1 -43.7 11.0 10.4 -0.8 144 66 B I S < S- 0 0 99 -4,-1.8 0, 0.0 1,-0.1 0, 0.0 -0.503 98.5-102.8 -75.2 141.0 13.4 9.4 -3.6 145 67 B V S S+ 0 0 126 -2,-0.2 -1,-0.1 1,-0.2 -2,-0.0 0.222 100.3 62.5 -48.1-177.0 16.8 11.2 -3.6 146 68 B N S S- 0 0 139 1,-0.1 -1,-0.2 2,-0.0 3,-0.1 0.941 78.8-164.8 60.1 44.2 17.5 14.0 -6.1 147 69 B K - 0 0 128 -5,-0.1 -5,-0.1 1,-0.1 -1,-0.1 -0.178 31.0 -87.6 -58.3 155.9 14.6 16.1 -4.5 148 70 B L - 0 0 113 1,-0.1 -1,-0.1 3,-0.0 2,-0.1 -0.402 47.1-151.9 -66.9 141.1 13.4 19.0 -6.7 149 71 B E - 0 0 169 1,-0.1 2,-0.6 -3,-0.1 -1,-0.1 -0.126 40.9 -54.4 -98.2-161.3 15.4 22.2 -6.1 150 72 B H - 0 0 157 1,-0.2 -1,-0.1 2,-0.1 0, 0.0 -0.669 41.5-172.9 -81.4 120.8 14.4 25.9 -6.4 151 73 B H - 0 0 137 -2,-0.6 -1,-0.2 2,-0.2 3,-0.1 0.476 40.9-123.4 -90.1 -0.6 13.0 26.6 -9.9 152 74 B H S S+ 0 0 163 1,-0.2 2,-0.4 2,-0.1 -2,-0.1 0.656 76.9 118.5 69.1 12.8 12.8 30.3 -9.1 153 75 B H - 0 0 138 1,-0.2 -2,-0.2 2,-0.0 -1,-0.2 -0.922 57.2-149.7-113.6 133.8 9.1 30.1 -9.9 154 76 B H 0 0 172 -2,-0.4 -1,-0.2 -3,-0.1 -3,-0.1 0.969 360.0 360.0 -63.4 -85.4 6.4 30.9 -7.3 155 77 B H 0 0 240 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.245 360.0 360.0 175.6 360.0 3.4 28.8 -8.3