==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 11-APR-11 3RH3 . COMPND 2 MOLECULE: UNCHARACTERIZED DUF3829-LIKE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 476 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25389.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 384 80.7 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 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 336 70.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 0 0 0 0 0 2 2 0 0 0 0 0 0 2 0 2 0 2 0 2 0 0 0 0 4 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 34 A T > 0 0 122 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 145.0 0.1 27.1 62.4 2 35 A E H > + 0 0 88 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.881 360.0 52.1 -70.5 -44.2 -2.2 25.4 59.8 3 36 A E H > S+ 0 0 61 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.824 107.2 54.0 -62.9 -36.3 -3.3 22.5 62.1 4 37 A L H > S+ 0 0 44 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.909 110.5 45.0 -66.0 -46.0 -4.3 25.0 64.9 5 38 A D H X S+ 0 0 45 -4,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.926 114.8 49.2 -62.9 -45.8 -6.6 27.0 62.5 6 39 A D H X S+ 0 0 35 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.895 110.9 50.8 -58.9 -42.7 -8.0 23.7 61.2 7 40 A A H X S+ 0 0 4 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.878 110.0 49.0 -63.9 -37.8 -8.6 22.5 64.8 8 41 A S H X S+ 0 0 33 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.793 108.1 54.1 -75.3 -23.7 -10.4 25.8 65.6 9 42 A K H X S+ 0 0 80 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.845 107.4 51.3 -76.3 -31.5 -12.6 25.4 62.5 10 43 A V H X S+ 0 0 12 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.916 112.1 46.6 -66.3 -45.4 -13.6 21.9 63.7 11 44 A I H X S+ 0 0 20 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.935 113.2 48.3 -63.2 -48.8 -14.5 23.4 67.2 12 45 A N H X S+ 0 0 32 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.864 110.2 52.2 -60.8 -39.6 -16.5 26.3 65.5 13 46 A Y H X S+ 0 0 3 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.936 109.9 49.0 -61.9 -45.9 -18.3 23.7 63.3 14 47 A Y H X S+ 0 0 18 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.910 111.1 49.9 -57.2 -46.0 -19.3 21.7 66.4 15 48 A H H X S+ 0 0 68 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.892 112.0 47.4 -61.6 -40.4 -20.6 24.9 68.2 16 49 A X H X S+ 0 0 23 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.869 113.3 49.1 -67.6 -38.9 -22.7 25.8 65.1 17 50 A S H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.926 110.6 49.4 -64.0 -50.0 -24.0 22.2 64.9 18 51 A L H X S+ 0 0 23 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.913 113.5 47.7 -56.4 -44.4 -24.9 22.2 68.6 19 52 A A H X S+ 0 0 50 -4,-2.3 4,-1.0 2,-0.2 -2,-0.2 0.898 116.2 42.1 -65.4 -45.8 -26.7 25.6 68.1 20 53 A V H >X S+ 0 0 36 -4,-2.4 4,-2.6 2,-0.2 3,-0.5 0.937 116.1 48.2 -68.1 -47.4 -28.7 24.5 65.0 21 54 A L H 3X S+ 0 0 2 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.845 108.9 53.9 -62.7 -35.4 -29.6 21.0 66.5 22 55 A R H 3< S+ 0 0 63 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.784 115.7 41.6 -69.3 -26.1 -30.7 22.6 69.8 23 56 A H H << S+ 0 0 108 -4,-1.0 3,-0.2 -3,-0.5 -2,-0.2 0.860 126.6 27.2 -88.7 -40.7 -33.1 24.9 67.8 24 57 A V H < S+ 0 0 19 -4,-2.6 -3,-0.2 1,-0.2 -2,-0.2 0.712 128.3 36.4 -98.2 -25.7 -34.5 22.5 65.1 25 58 A A S < S+ 0 0 4 -4,-2.0 2,-0.5 -5,-0.3 -1,-0.2 -0.195 74.3 151.1-122.4 41.1 -34.3 19.0 66.9 26 59 A N >> - 0 0 49 -3,-0.2 4,-2.0 1,-0.1 3,-0.5 -0.638 40.8-146.4 -77.6 121.9 -35.1 19.9 70.5 27 60 A A H 3> S+ 0 0 7 -2,-0.5 4,-3.3 1,-0.2 5,-0.2 0.839 97.0 59.4 -55.5 -39.3 -36.8 16.9 72.2 28 61 A K H 3> S+ 0 0 34 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.872 109.4 43.6 -60.5 -38.8 -39.0 19.3 74.4 29 62 A D H <> S+ 0 0 82 -3,-0.5 4,-1.5 2,-0.2 -2,-0.2 0.916 117.6 44.7 -72.1 -44.9 -40.6 20.8 71.2 30 63 A I H X S+ 0 0 7 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.930 115.6 46.9 -64.4 -46.8 -41.0 17.4 69.4 31 64 A N H X S+ 0 0 4 -4,-3.3 4,-2.5 1,-0.2 -1,-0.2 0.833 108.5 56.0 -68.1 -31.8 -42.4 15.7 72.6 32 65 A A H X S+ 0 0 63 -4,-1.6 4,-2.2 -5,-0.2 -1,-0.2 0.887 109.2 47.0 -64.3 -40.5 -44.8 18.7 73.2 33 66 A V H X S+ 0 0 17 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.928 112.8 48.2 -66.4 -46.9 -46.2 18.2 69.7 34 67 A L H X S+ 0 0 2 -4,-2.2 4,-0.6 1,-0.2 -2,-0.2 0.888 111.0 52.8 -59.4 -40.4 -46.5 14.3 70.3 35 68 A G H >X S+ 0 0 14 -4,-2.5 4,-1.0 1,-0.2 3,-1.0 0.905 107.9 49.8 -60.3 -44.9 -48.2 15.2 73.6 36 69 A Y H >< S+ 0 0 136 -4,-2.2 3,-0.7 1,-0.2 -2,-0.2 0.901 108.5 53.0 -60.8 -43.9 -50.7 17.4 71.8 37 70 A X H 3< S+ 0 0 12 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.549 106.0 54.6 -70.5 -11.6 -51.5 14.6 69.3 38 71 A E H << S+ 0 0 64 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 0.720 78.5 113.8 -89.6 -29.4 -52.2 12.2 72.1 39 72 A Q << - 0 0 129 -4,-1.0 2,-1.6 -3,-0.7 -3,-0.0 -0.293 62.3-146.4 -54.3 112.1 -54.8 14.5 73.8 40 73 A T 0 0 151 -2,-0.1 -1,-0.1 0, 0.0 -3,-0.1 -0.616 360.0 360.0 -82.8 71.6 -58.2 12.7 73.5 41 74 A G 0 0 114 -2,-1.6 -2,-0.1 0, 0.0 45,-0.0 -0.958 360.0 360.0 117.1 360.0 -60.2 15.9 73.1 42 ! 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 43 92 A T > 0 0 181 0, 0.0 3,-0.6 0, 0.0 221,-0.1 0.000 360.0 360.0 360.0 -29.5 -30.9 28.2 54.6 44 93 A A G > + 0 0 43 1,-0.2 3,-1.5 2,-0.1 -24,-0.0 0.165 360.0 111.4 -75.0 18.5 -29.0 25.4 56.5 45 94 A E G > + 0 0 83 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.499 58.0 78.0 -71.5 -6.0 -26.1 25.9 54.0 46 95 A L G < S+ 0 0 48 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.650 87.2 59.5 -74.1 -19.7 -24.1 27.4 57.0 47 96 A L G < + 0 0 9 -3,-1.5 -1,-0.2 2,-0.1 -2,-0.2 0.196 69.4 130.4 -94.5 10.8 -23.5 23.7 58.1 48 97 A D < - 0 0 113 -3,-1.0 2,-0.3 1,-0.1 10,-0.0 -0.546 62.3-127.8 -65.2 112.8 -21.8 22.8 54.8 49 98 A P - 0 0 5 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.611 22.1-144.5 -77.0 132.9 -18.6 21.0 56.2 50 99 A G > - 0 0 19 -2,-0.3 3,-1.6 -41,-0.1 8,-0.1 -0.134 34.9 -84.6 -83.2-177.3 -15.3 22.3 54.9 51 100 A D T 3 S+ 0 0 138 1,-0.3 -1,-0.1 -2,-0.0 -45,-0.0 0.382 110.1 89.2 -79.7 8.6 -12.0 20.4 54.2 52 101 A Y T 3 S+ 0 0 70 2,-0.1 2,-0.3 -46,-0.1 -1,-0.3 0.619 93.4 56.9 -70.3 -14.5 -10.9 20.7 57.8 53 102 A F S < S- 0 0 7 -3,-1.6 -47,-0.0 1,-0.0 0, 0.0 -0.865 101.5-110.6-108.0 150.2 -13.0 17.3 57.8 54 103 A N > - 0 0 87 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.310 35.3-100.2 -78.3 165.9 -12.1 14.5 55.4 55 104 A P H > S+ 0 0 102 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.829 122.0 51.4 -57.5 -37.7 -14.5 13.6 52.5 56 105 A E H > S+ 0 0 142 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.953 112.4 46.8 -63.1 -46.6 -16.2 10.6 54.3 57 106 A V H > S+ 0 0 19 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.912 112.5 49.8 -62.0 -44.2 -16.9 12.9 57.3 58 107 A R H X S+ 0 0 89 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.918 113.1 46.2 -61.6 -46.0 -18.2 15.7 55.1 59 108 A Q H X S+ 0 0 99 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.902 112.1 51.1 -63.4 -43.6 -20.5 13.3 53.2 60 109 A N H X S+ 0 0 55 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.909 112.0 47.2 -59.9 -42.5 -21.8 11.7 56.5 61 110 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.930 113.4 48.0 -65.0 -44.7 -22.5 15.1 58.0 62 111 A K H X S+ 0 0 124 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.864 113.9 46.5 -63.7 -42.3 -24.4 16.2 54.8 63 112 A Q H X S+ 0 0 118 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.886 114.5 46.7 -69.5 -40.3 -26.4 13.0 54.5 64 113 A N H X S+ 0 0 18 -4,-2.1 4,-2.9 -5,-0.2 -2,-0.2 0.874 113.1 48.1 -73.5 -35.8 -27.4 13.0 58.2 65 114 A Y H X S+ 0 0 13 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.856 112.3 50.5 -70.1 -35.2 -28.4 16.7 58.2 66 115 A A H X S+ 0 0 60 -4,-1.7 4,-2.2 -5,-0.2 -2,-0.2 0.944 113.4 45.3 -66.5 -45.0 -30.4 16.1 55.0 67 116 A G H X S+ 0 0 8 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.950 111.4 53.2 -61.4 -49.0 -32.1 13.2 56.7 68 117 A L H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.933 113.0 41.8 -51.0 -57.0 -32.7 15.2 59.9 69 118 A F H X S+ 0 0 51 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.815 114.0 53.9 -62.6 -34.2 -34.4 18.1 58.0 70 119 A N H X S+ 0 0 93 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.940 112.4 41.6 -65.7 -50.4 -36.4 15.7 55.8 71 120 A V H X S+ 0 0 2 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.879 113.9 54.8 -69.5 -30.1 -37.9 13.8 58.8 72 121 A R H X S+ 0 0 73 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.909 108.9 47.1 -65.6 -43.9 -38.4 17.1 60.7 73 122 A T H X S+ 0 0 94 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.925 112.8 49.2 -62.7 -47.4 -40.5 18.5 57.7 74 123 A Q H X S+ 0 0 83 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.883 111.0 52.0 -56.8 -44.0 -42.5 15.2 57.5 75 124 A F H X S+ 0 0 1 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.941 114.7 38.9 -59.3 -54.1 -43.1 15.5 61.3 76 125 A Y H X S+ 0 0 59 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.782 115.1 54.0 -72.5 -26.5 -44.4 19.1 61.3 77 126 A D H X S+ 0 0 53 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.902 109.6 48.3 -67.9 -44.4 -46.4 18.5 58.0 78 127 A N H X S+ 0 0 35 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.852 110.2 52.8 -62.6 -37.6 -48.1 15.5 59.7 79 128 A F H X S+ 0 0 36 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.901 110.6 45.3 -65.7 -44.8 -48.9 17.7 62.7 80 129 A N H X S+ 0 0 106 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.853 114.6 49.3 -67.5 -33.8 -50.5 20.4 60.6 81 130 A K H X S+ 0 0 33 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.895 108.4 54.9 -67.1 -40.4 -52.4 17.6 58.7 82 131 A F H X S+ 0 0 17 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.863 104.0 53.3 -58.1 -45.7 -53.5 16.2 62.1 83 132 A L H X S+ 0 0 62 -4,-1.7 4,-1.0 2,-0.2 -1,-0.2 0.829 111.9 45.6 -61.6 -37.0 -55.0 19.6 63.2 84 133 A A H X S+ 0 0 59 -4,-1.1 4,-1.1 -3,-0.2 -2,-0.2 0.879 115.2 46.5 -72.7 -42.0 -57.2 19.7 60.0 85 134 A Y H <>S+ 0 0 93 -4,-2.2 5,-2.0 2,-0.2 -2,-0.2 0.832 107.3 57.2 -69.8 -36.4 -58.2 15.9 60.4 86 135 A K H ><5S+ 0 0 55 -4,-2.7 3,-0.6 1,-0.2 -1,-0.2 0.835 109.0 46.4 -63.2 -35.8 -59.0 16.4 64.2 87 136 A K H 3<5S+ 0 0 91 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.805 109.5 54.7 -73.3 -32.6 -61.5 19.2 63.2 88 137 A S T 3<5S- 0 0 89 -4,-1.1 -1,-0.2 2,-0.1 -2,-0.2 0.378 111.3-123.8 -81.0 -1.7 -62.9 16.9 60.5 89 138 A K T < 5 + 0 0 80 -3,-0.6 2,-1.3 -4,-0.2 -3,-0.2 0.655 56.4 155.1 61.3 25.0 -63.6 14.1 63.2 90 139 A D >< + 0 0 61 -5,-2.0 4,-1.8 1,-0.2 -1,-0.2 -0.677 13.4 173.1 -84.1 90.5 -61.4 11.6 61.1 91 140 A T H > S+ 0 0 116 -2,-1.3 4,-1.4 2,-0.2 -1,-0.2 0.779 74.3 55.2 -68.1 -33.0 -60.3 9.3 64.0 92 141 A A H > S+ 0 0 71 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.900 111.4 41.9 -68.5 -45.8 -58.7 6.8 61.6 93 142 A K H > S+ 0 0 36 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.871 112.3 53.2 -72.1 -41.0 -56.3 9.4 59.9 94 143 A T H X S+ 0 0 24 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.882 109.7 49.8 -61.7 -39.3 -55.4 11.2 63.2 95 144 A A H X S+ 0 0 61 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.839 111.0 49.4 -65.8 -38.0 -54.3 7.8 64.7 96 145 A Q H X S+ 0 0 60 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.889 110.9 49.5 -67.9 -42.8 -52.2 7.0 61.6 97 146 A L H X S+ 0 0 24 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.876 111.5 48.1 -66.1 -39.8 -50.5 10.5 61.7 98 147 A L H X S+ 0 0 15 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.924 111.9 50.5 -65.4 -43.4 -49.7 10.0 65.5 99 148 A D H X S+ 0 0 116 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.896 113.9 45.1 -59.9 -42.6 -48.3 6.5 64.7 100 149 A E H X S+ 0 0 38 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.919 111.2 52.2 -65.6 -46.3 -46.2 8.1 61.9 101 150 A N H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.784 104.3 57.1 -67.1 -26.3 -45.0 11.0 64.1 102 151 A Y H X S+ 0 0 40 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.934 111.4 42.7 -64.9 -48.1 -43.8 8.6 66.8 103 152 A K H X S+ 0 0 54 -4,-1.4 4,-2.1 1,-0.2 3,-0.3 0.908 114.6 50.8 -63.3 -42.9 -41.6 6.8 64.3 104 153 A L H X S+ 0 0 9 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.861 104.6 56.9 -66.0 -36.0 -40.4 10.2 62.8 105 154 A S H X S+ 0 0 9 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.849 109.0 46.5 -63.9 -34.9 -39.5 11.6 66.3 106 155 A V H X S+ 0 0 28 -4,-1.2 4,-2.7 -3,-0.3 -2,-0.2 0.932 111.6 51.1 -71.7 -45.4 -37.1 8.6 66.9 107 156 A E H X S+ 0 0 78 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.921 110.3 49.7 -55.7 -45.9 -35.6 9.1 63.4 108 157 A L H X S+ 0 0 3 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.878 112.3 47.8 -60.6 -41.8 -35.0 12.8 64.1 109 158 A S H X S+ 0 0 11 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.879 111.5 50.4 -66.5 -42.1 -33.4 11.9 67.5 110 159 A E H X S+ 0 0 92 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.902 109.0 51.0 -63.6 -45.4 -31.2 9.2 65.8 111 160 A Y H X S+ 0 0 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133.1 54.4 73.5 7.4 -32.9 52.8 41.0 401 211 B A < + 0 0 43 -3,-2.4 -2,-0.2 -5,-0.2 -3,-0.1 0.044 64.4 175.4-161.5 38.5 -30.5 54.4 43.6 402 212 B X - 0 0 23 1,-0.1 2,-1.3 56,-0.1 -6,-0.2 -0.278 31.3-135.2 -52.6 119.7 -26.8 54.0 42.6 403 213 B D > + 0 0 40 -8,-1.5 4,-2.7 1,-0.2 -1,-0.1 -0.672 30.8 173.8 -92.0 86.9 -24.9 56.0 45.2 404 214 B G H > S+ 0 0 10 -2,-1.3 4,-3.2 2,-0.2 -1,-0.2 0.875 74.8 49.7 -56.0 -53.3 -22.3 57.9 43.2 405 215 B V H > S+ 0 0 95 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.899 115.2 44.2 -60.3 -44.8 -20.9 60.2 45.9 406 216 B R H > S+ 0 0 144 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.920 112.4 52.8 -71.2 -38.0 -20.4 57.2 48.3 407 217 B I H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.954 110.6 48.8 -57.0 -48.0 -19.0 55.1 45.5 408 218 B D H X S+ 0 0 72 -4,-3.2 4,-2.1 1,-0.2 -2,-0.2 0.893 110.5 49.8 -58.7 -45.0 -16.5 58.0 44.8 409 219 B L H X S+ 0 0 101 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.908 113.8 45.8 -60.4 -42.0 -15.5 58.3 48.5 410 220 B K H X S+ 0 0 59 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.829 109.4 54.8 -72.6 -28.3 -14.9 54.5 48.6 411 221 B X H X S+ 0 0 21 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.905 108.1 49.1 -69.6 -37.5 -12.9 54.6 45.3 412 222 B A H X S+ 0 0 62 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.887 111.5 49.9 -65.4 -41.6 -10.6 57.3 46.9 413 223 B E H X S+ 0 0 44 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.956 112.6 47.1 -59.4 -49.5 -10.3 55.0 50.0 414 224 B L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.857 110.3 52.1 -59.6 -41.6 -9.4 52.0 47.6 415 225 B E H X S+ 0 0 98 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.878 110.6 48.6 -64.7 -39.5 -6.9 54.2 45.7 416 226 B K H X S+ 0 0 157 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.909 112.7 47.8 -66.2 -43.7 -5.2 55.1 48.9 417 227 B E H X S+ 0 0 24 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.867 111.2 51.1 -64.0 -40.6 -5.1 51.4 50.0 418 228 B L H X S+ 0 0 4 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.913 110.1 48.6 -65.5 -42.9 -3.7 50.4 46.6 419 229 B K H X S+ 0 0 61 -4,-2.0 4,-0.6 2,-0.2 -2,-0.2 0.867 113.2 47.7 -65.2 -39.3 -0.9 53.0 46.7 420 230 B A H >< S+ 0 0 62 -4,-2.0 3,-1.0 2,-0.2 4,-0.3 0.924 111.5 51.1 -68.0 -40.6 0.1 51.9 50.3 421 231 B A H >< S+ 0 0 2 -4,-2.5 3,-1.6 1,-0.3 -2,-0.2 0.875 103.9 57.7 -63.0 -40.2 0.0 48.2 49.2 422 232 B E H 3< S+ 0 0 89 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.703 105.1 52.9 -62.3 -21.9 2.3 48.9 46.2 423 233 B K T << S+ 0 0 148 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.454 77.9 120.7 -92.8 -5.6 4.9 50.3 48.8 424 234 B I S < S- 0 0 35 -3,-1.6 2,-0.1 -4,-0.3 -3,-0.0 -0.421 72.1-114.2 -61.3 125.4 4.8 47.1 51.0 425 235 B P - 0 0 92 0, 0.0 -1,-0.1 0, 0.0 -48,-0.1 -0.445 29.3-112.7 -68.5 138.3 8.5 45.8 51.0 426 236 B A - 0 0 93 -2,-0.1 2,-0.4 1,-0.0 5,-0.1 -0.323 25.3-135.5 -65.4 148.3 9.0 42.4 49.3 427 237 B V > - 0 0 51 3,-0.1 3,-1.0 -2,-0.0 7,-0.1 -0.948 20.0-117.1-112.4 129.6 10.0 39.4 51.5 428 238 B T T 3 S+ 0 0 138 -2,-0.4 0, 0.0 1,-0.2 0, 0.0 -0.425 96.8 26.4 -66.6 135.5 12.8 37.0 50.5 429 239 B G T 3 S+ 0 0 61 -2,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.583 100.9 86.5 88.0 15.5 11.8 33.4 49.8 430 240 B Y <> + 0 0 75 -3,-1.0 4,-2.1 2,-0.1 -3,-0.1 -0.178 39.3 133.0-136.6 41.1 8.1 34.2 48.9 431 241 B D H > S+ 0 0 132 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.823 74.9 52.8 -64.4 -34.3 8.3 35.0 45.1 432 242 B E H > S+ 0 0 150 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.942 112.9 42.7 -67.7 -47.6 5.3 32.7 44.3 433 243 B E H > S+ 0 0 87 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.826 113.2 54.5 -67.6 -32.6 3.1 34.5 46.9 434 244 B L H X S+ 0 0 37 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.879 105.3 52.1 -68.3 -40.6 4.5 37.9 45.7 435 245 B K H X S+ 0 0 103 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.917 112.0 46.2 -61.4 -41.6 3.5 37.2 42.1 436 246 B N H X S+ 0 0 104 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.845 111.4 52.3 -73.6 -27.5 -0.1 36.4 43.2 437 247 B F H X S+ 0 0 10 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.940 109.6 49.1 -68.6 -44.9 -0.1 39.6 45.4 438 248 B Q H X S+ 0 0 113 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.881 109.6 52.1 -60.5 -39.4 1.0 41.6 42.4 439 249 B S H X S+ 0 0 61 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.882 106.8 53.8 -64.0 -38.8 -1.9 39.9 40.3 440 250 B F H X S+ 0 0 18 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.923 108.6 48.7 -58.1 -47.9 -4.3 41.0 43.1 441 251 B L H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.903 110.9 50.0 -59.9 -44.5 -3.1 44.6 42.8 442 252 B S H X S+ 0 0 63 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.880 110.1 51.1 -60.4 -41.6 -3.6 44.5 39.0 443 253 B T H X S+ 0 0 39 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.804 107.3 53.8 -65.8 -35.4 -7.2 43.1 39.5 444 254 B V H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.957 109.2 47.3 -65.4 -47.4 -8.0 45.9 41.9 445 255 B K H X S+ 0 0 82 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.886 113.0 50.0 -60.8 -38.0 -6.9 48.5 39.2 446 256 B S H X S+ 0 0 49 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.901 110.8 49.0 -65.4 -42.2 -9.0 46.6 36.6 447 257 B F H X S+ 0 0 1 -4,-2.2 4,-3.2 1,-0.2 5,-0.2 0.915 110.1 51.6 -60.7 -46.4 -12.0 46.7 39.0 448 258 B X H X S+ 0 0 17 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.861 110.0 48.2 -61.5 -37.3 -11.4 50.4 39.5 449 259 B N H X S+ 0 0 100 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.904 115.1 45.5 -69.5 -41.9 -11.4 51.1 35.7 450 260 B D H X S+ 0 0 62 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.910 115.7 46.0 -67.4 -43.1 -14.6 49.0 35.2 451 261 B X H X S+ 0 0 0 -4,-3.2 4,-3.1 2,-0.2 5,-0.3 0.910 108.5 55.7 -70.6 -41.2 -16.3 50.6 38.2 452 262 B Q H X S+ 0 0 124 -4,-2.6 4,-1.6 -5,-0.2 -1,-0.2 0.920 112.9 43.1 -54.0 -46.2 -15.3 54.1 37.2 453 263 B K H < S+ 0 0 122 -4,-1.7 4,-0.4 2,-0.2 -2,-0.2 0.877 115.7 47.7 -65.1 -46.5 -17.0 53.5 33.8 454 264 B A H >< S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.2 5,-0.4 0.930 113.9 47.0 -61.6 -46.2 -20.1 51.8 35.3 455 265 B R H >< S+ 0 0 62 -4,-3.1 3,-1.8 1,-0.2 -2,-0.2 0.793 99.5 68.7 -67.1 -32.1 -20.5 54.6 37.9 456 266 B S T 3< S+ 0 0 89 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.665 86.3 69.7 -61.8 -18.7 -20.1 57.4 35.2 457 267 B K T < S- 0 0 101 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.613 101.5-134.2 -77.0 -13.4 -23.5 56.3 33.7 458 268 B G S < S+ 0 0 49 -3,-1.8 2,-0.3 -4,-0.1 -54,-0.1 0.448 74.5 68.3 74.1 4.7 -25.2 57.8 36.8 459 269 B A S S- 0 0 54 -5,-0.4 -2,-0.2 -58,-0.1 2,-0.1 -0.994 87.6 -96.0-153.3 151.6 -27.4 54.7 37.2 460 270 B Y - 0 0 27 -62,-0.3 2,-0.4 -2,-0.3 -60,-0.2 -0.405 35.4-162.8 -65.6 137.5 -27.3 51.0 38.1 461 271 B S > - 0 0 41 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.992 19.6-150.3-123.2 129.4 -27.2 48.7 35.1 462 272 B D H > S+ 0 0 84 -2,-0.4 4,-2.9 1,-0.2 5,-0.2 0.916 103.4 53.4 -62.7 -37.1 -28.0 44.9 35.4 463 273 B K H > S+ 0 0 75 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.869 112.0 43.3 -62.7 -43.5 -25.5 44.3 32.5 464 274 B E H > S+ 0 0 27 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.898 115.9 47.9 -70.7 -42.9 -22.7 46.2 34.3 465 275 B Y H X S+ 0 0 30 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.920 112.7 47.2 -65.7 -46.0 -23.4 44.6 37.7 466 276 B Q H X S+ 0 0 40 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.953 115.1 47.8 -60.5 -47.7 -23.6 41.0 36.3 467 277 B A H X S+ 0 0 52 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.905 116.7 41.4 -57.7 -52.1 -20.3 41.6 34.3 468 278 B X H X S+ 0 0 2 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.841 113.3 52.5 -69.4 -36.0 -18.4 43.1 37.2 469 279 B S H X S+ 0 0 37 -4,-2.6 4,-1.6 -5,-0.2 -2,-0.2 0.922 114.5 43.4 -69.5 -35.3 -19.8 40.5 39.8 470 280 B E H < S+ 0 0 142 -4,-2.4 4,-0.4 -5,-0.2 -2,-0.2 0.908 114.6 50.0 -71.4 -42.2 -18.7 37.7 37.5 471 281 B A H < S+ 0 0 59 -4,-2.4 4,-0.2 -5,-0.2 -1,-0.2 0.719 123.5 27.6 -68.6 -28.7 -15.3 39.2 36.7 472 282 B Y H X S+ 0 0 24 -4,-1.5 4,-2.9 -5,-0.1 -1,-0.2 0.554 89.3 97.9-118.2 -7.1 -14.2 40.0 40.3 473 283 B E T < S+ 0 0 108 -4,-1.6 -2,-0.1 1,-0.2 -3,-0.1 0.867 100.4 24.7 -43.9 -56.4 -16.1 37.3 42.4 474 284 B Y T 4 S+ 0 0 189 -4,-0.4 3,-0.5 2,-0.2 -1,-0.2 0.824 123.6 50.9 -88.7 -33.8 -13.0 35.0 42.7 475 285 B G T 4 S+ 0 0 39 -4,-0.2 -2,-0.2 1,-0.2 -1,-0.1 0.842 123.9 28.1 -72.3 -37.9 -10.2 37.4 42.2 476 286 B L S < S+ 0 0 8 -4,-2.9 -1,-0.2 -33,-0.1 -2,-0.2 0.063 85.9 163.7-115.8 30.7 -11.3 39.9 44.8 477 287 B S - 0 0 67 -3,-0.5 -91,-0.1 1,-0.1 -90,-0.1 -0.147 32.4-149.7 -53.8 135.2 -13.2 37.5 47.2 478 288 B V 0 0 20 -92,-0.1 -1,-0.1 -5,-0.1 -219,-0.1 -0.053 360.0 360.0 -98.5 26.4 -13.9 38.8 50.7 479 289 B I 0 0 78 -220,-0.0 -223,-0.1 -93,-0.0 -93,-0.0 -0.641 360.0 360.0 -79.5 360.0 -13.8 35.4 52.5