==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 22-NOV-11 3URZ . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES OVATUS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 408 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24713.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 337 82.6 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 . 11 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 294 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.9 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 0 0 0 3 0 3 8 0 2 4 0 0 0 0 0 0 0 0 1 1 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 22 A S > 0 0 114 0, 0.0 4,-1.3 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 152.4 -6.0 21.2 103.3 2 23 A V H > + 0 0 17 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.840 360.0 61.2 -70.0 -35.6 -8.0 21.8 106.5 3 24 A D H > S+ 0 0 72 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.793 106.7 46.2 -62.7 -29.9 -9.5 25.1 105.3 4 25 A E H > S+ 0 0 129 -3,-0.3 4,-1.1 2,-0.2 3,-0.5 0.858 109.4 54.4 -77.7 -41.5 -11.1 23.3 102.3 5 26 A X H X S+ 0 0 35 -4,-1.3 4,-1.4 1,-0.2 3,-0.3 0.873 103.9 56.5 -57.2 -42.5 -12.4 20.5 104.6 6 27 A L H X S+ 0 0 5 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.747 99.9 57.8 -64.6 -28.9 -14.1 23.1 106.8 7 28 A Q H X S+ 0 0 126 -4,-0.6 4,-2.6 -3,-0.5 -1,-0.2 0.858 104.2 52.6 -67.8 -36.9 -16.1 24.6 103.8 8 29 A K H X S+ 0 0 35 -4,-1.1 4,-2.9 -3,-0.3 -2,-0.2 0.887 108.4 50.5 -63.7 -40.2 -17.6 21.1 103.2 9 30 A V H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.952 112.4 47.0 -60.3 -50.7 -18.7 21.1 106.9 10 31 A S H X S+ 0 0 33 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.861 114.7 46.8 -58.4 -41.2 -20.3 24.5 106.4 11 32 A A H X S+ 0 0 57 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.909 110.8 51.0 -68.2 -44.8 -22.0 23.3 103.2 12 33 A A H <>S+ 0 0 4 -4,-2.9 5,-1.8 1,-0.2 -2,-0.2 0.834 109.0 52.6 -61.9 -35.0 -23.3 20.1 104.8 13 34 A I H ><5S+ 0 0 48 -4,-2.0 3,-1.0 1,-0.2 -1,-0.2 0.911 111.4 45.0 -66.0 -46.0 -24.8 22.1 107.7 14 35 A E H 3<5S+ 0 0 174 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.723 109.8 55.7 -71.6 -24.5 -26.7 24.4 105.4 15 36 A A T 3<5S- 0 0 68 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.417 115.2-114.5 -85.7 -1.2 -27.9 21.5 103.2 16 37 A G T < 5S+ 0 0 57 -3,-1.0 2,-1.2 -4,-0.2 3,-0.2 0.493 79.4 127.1 79.2 7.7 -29.5 19.8 106.3 17 38 A Q >< + 0 0 103 -5,-1.8 4,-1.3 -6,-0.2 3,-0.2 -0.596 21.9 160.4 -98.4 69.8 -27.0 16.8 106.1 18 39 A N H > + 0 0 66 -2,-1.2 4,-2.1 1,-0.2 5,-0.2 0.805 65.6 66.5 -59.4 -33.7 -25.8 17.0 109.7 19 40 A G H > S+ 0 0 56 1,-0.2 4,-1.3 -3,-0.2 -1,-0.2 0.929 107.4 36.4 -54.9 -55.0 -24.5 13.4 109.5 20 41 A Q H > S+ 0 0 87 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.724 111.1 63.6 -73.7 -23.1 -21.8 14.1 106.9 21 42 A A H X S+ 0 0 0 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.921 107.1 42.7 -63.4 -45.5 -21.1 17.5 108.5 22 43 A V H X S+ 0 0 14 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.823 111.8 56.4 -69.0 -33.8 -19.9 15.8 111.7 23 44 A S H X S+ 0 0 50 -4,-1.3 4,-1.2 2,-0.2 -2,-0.2 0.895 110.8 41.6 -66.2 -44.7 -18.0 13.2 109.6 24 45 A Y H X S+ 0 0 92 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.805 112.0 57.2 -70.8 -31.6 -15.9 15.8 107.8 25 46 A F H X S+ 0 0 0 -4,-1.5 4,-1.3 2,-0.2 -2,-0.2 0.916 105.1 50.7 -64.7 -44.4 -15.5 17.7 111.2 26 47 A R H X S+ 0 0 122 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.849 109.2 51.5 -60.1 -37.8 -13.9 14.5 112.8 27 48 A Q H X S+ 0 0 105 -4,-1.2 4,-1.7 1,-0.2 -1,-0.2 0.841 106.0 54.4 -68.9 -34.6 -11.5 14.3 109.8 28 49 A T H X S+ 0 0 0 -4,-1.6 4,-3.2 1,-0.2 8,-0.2 0.792 102.8 57.5 -68.0 -31.1 -10.4 18.0 110.3 29 50 A I H < S+ 0 0 21 -4,-1.3 4,-0.4 2,-0.2 -1,-0.2 0.869 106.5 49.4 -64.9 -39.1 -9.6 17.3 114.0 30 51 A A H < S+ 0 0 90 -4,-1.1 3,-0.2 2,-0.2 -2,-0.2 0.907 117.2 40.4 -65.3 -44.7 -7.1 14.5 112.8 31 52 A L H < S- 0 0 111 -4,-1.7 2,-0.2 1,-0.2 -2,-0.2 0.937 140.7 -8.8 -70.3 -51.0 -5.5 16.9 110.3 32 53 A N X + 0 0 64 -4,-3.2 4,-1.5 -5,-0.1 -1,-0.2 -0.733 53.9 179.7-157.1 100.7 -5.4 20.1 112.5 33 54 A I H > S+ 0 0 32 -4,-0.4 4,-2.0 -2,-0.2 5,-0.1 0.810 85.4 57.4 -69.8 -33.7 -7.2 20.4 115.8 34 55 A D H > S+ 0 0 99 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.907 110.8 41.6 -64.9 -45.5 -6.0 24.0 116.4 35 56 A R H > S+ 0 0 72 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.826 113.9 52.8 -70.4 -36.8 -7.6 25.3 113.2 36 57 A T H X S+ 0 0 0 -4,-1.5 4,-1.7 -8,-0.2 -2,-0.2 0.871 107.1 52.9 -64.7 -41.2 -10.8 23.2 113.7 37 58 A E H X S+ 0 0 9 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.909 108.1 50.8 -58.7 -45.9 -11.2 24.7 117.2 38 59 A X H X S+ 0 0 104 -4,-1.5 4,-2.4 1,-0.2 5,-0.3 0.876 106.3 55.0 -60.9 -41.3 -11.0 28.2 115.7 39 60 A Y H X>S+ 0 0 8 -4,-1.7 4,-2.2 1,-0.2 5,-1.2 0.864 105.6 53.4 -58.8 -41.6 -13.7 27.3 113.2 40 61 A Y H X5S+ 0 0 2 -4,-1.7 4,-0.6 3,-0.2 -2,-0.2 0.932 113.8 41.2 -60.2 -48.9 -16.0 26.3 116.0 41 62 A W H <5S+ 0 0 107 -4,-1.7 -2,-0.2 2,-0.1 -1,-0.2 0.866 125.2 33.9 -68.5 -39.9 -15.6 29.6 117.9 42 63 A T H <5S+ 0 0 94 -4,-2.4 -3,-0.2 -5,-0.1 -2,-0.2 0.920 131.3 19.5 -84.0 -48.4 -15.8 31.9 114.8 43 64 A N H <5S+ 0 0 104 -4,-2.2 -3,-0.2 -5,-0.3 2,-0.2 0.760 93.7 95.4 -99.2 -31.2 -18.2 30.2 112.3 44 65 A V S < - 0 0 102 -2,-0.2 3,-1.2 1,-0.1 6,-0.3 -0.730 17.0-157.9 -78.4 114.9 -24.0 28.8 115.3 46 67 A K T 3 S+ 0 0 62 -2,-0.7 -1,-0.1 1,-0.2 6,-0.1 0.666 86.5 63.2 -70.8 -19.1 -24.0 28.0 119.1 47 68 A N T 3 S+ 0 0 158 4,-0.1 -1,-0.2 3,-0.0 2,-0.1 0.414 87.4 93.3 -84.8 -0.2 -27.9 28.0 119.2 48 69 A S S <> S- 0 0 38 -3,-1.2 4,-0.5 1,-0.1 3,-0.2 -0.486 81.9-121.8 -92.1 163.4 -28.1 25.0 116.7 49 70 A E H >> S+ 0 0 85 1,-0.2 4,-0.7 2,-0.2 3,-0.7 0.856 112.0 60.2 -69.2 -37.4 -28.4 21.2 117.5 50 71 A I H 3> S+ 0 0 7 1,-0.2 4,-2.3 2,-0.2 3,-0.4 0.785 89.5 73.5 -60.8 -31.6 -25.2 20.5 115.4 51 72 A S H 3> S+ 0 0 0 -6,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.883 95.8 48.8 -48.0 -48.7 -23.2 22.8 117.8 52 73 A S H S+ 0 0 11 -4,-2.5 5,-2.0 1,-0.2 4,-0.3 0.830 110.1 57.5 -66.1 -34.1 -8.3 16.8 123.6 63 84 A K H ><5S+ 0 0 69 -4,-1.8 3,-0.6 -5,-0.2 -1,-0.2 0.864 108.8 45.4 -62.6 -40.4 -9.1 14.2 126.3 64 85 A K H 3<5S+ 0 0 178 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.820 110.5 54.7 -72.8 -31.1 -7.2 11.5 124.2 65 86 A N T 3<5S- 0 0 104 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.428 112.1-119.4 -80.3 -1.1 -4.3 14.0 123.5 66 87 A R T < 5S+ 0 0 59 -3,-0.6 2,-1.2 -4,-0.3 -3,-0.2 0.640 71.5 135.2 68.8 19.7 -3.9 14.6 127.4 67 88 A N >< + 0 0 59 -5,-2.0 4,-1.8 1,-0.2 -1,-0.2 -0.739 25.4 172.4 -97.2 82.3 -4.6 18.3 127.0 68 89 A Y H > + 0 0 84 -2,-1.2 4,-1.5 1,-0.2 -1,-0.2 0.700 69.2 61.5 -69.1 -22.2 -6.9 18.4 130.1 69 90 A D H > S+ 0 0 102 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.941 110.1 39.7 -68.0 -49.8 -7.2 22.3 130.0 70 91 A K H > S+ 0 0 70 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.868 112.3 56.8 -67.4 -38.2 -8.8 22.3 126.5 71 92 A A H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.889 108.4 47.8 -59.4 -42.0 -11.0 19.1 127.3 72 93 A Y H X S+ 0 0 37 -4,-1.5 4,-2.7 2,-0.2 -1,-0.2 0.894 106.2 57.9 -64.7 -44.0 -12.5 21.0 130.3 73 94 A L H X S+ 0 0 70 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.894 112.4 40.2 -53.8 -46.7 -13.2 24.1 128.2 74 95 A F H X S+ 0 0 0 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.855 114.0 50.5 -75.2 -38.4 -15.3 22.1 125.7 75 96 A Y H X S+ 0 0 20 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.866 112.1 50.7 -65.4 -33.7 -17.1 19.9 128.3 76 97 A K H X S+ 0 0 97 -4,-2.7 4,-1.2 2,-0.2 -2,-0.2 0.846 106.2 54.8 -67.6 -37.8 -17.9 23.2 130.1 77 98 A E H X S+ 0 0 11 -4,-1.4 4,-0.5 2,-0.2 -2,-0.2 0.814 111.2 45.1 -63.5 -35.1 -19.3 24.6 126.8 78 99 A L H >X S+ 0 0 11 -4,-1.5 3,-0.8 1,-0.2 4,-0.7 0.870 108.0 58.2 -72.2 -41.4 -21.6 21.6 126.6 79 100 A L H 3< S+ 0 0 27 -4,-2.1 3,-0.2 1,-0.2 -2,-0.2 0.730 96.1 63.0 -62.5 -27.7 -22.5 22.0 130.3 80 101 A Q H 3< S+ 0 0 147 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.833 100.6 52.8 -65.7 -35.0 -23.8 25.6 129.7 81 102 A K H << S+ 0 0 89 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.2 0.735 129.5 15.6 -71.6 -26.9 -26.6 24.2 127.4 82 103 A A >< + 0 0 37 -4,-0.7 3,-1.7 -3,-0.2 -1,-0.2 -0.531 68.6 176.3-148.9 75.1 -27.8 21.7 130.0 83 104 A P T 3 S+ 0 0 65 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.739 81.7 47.7 -51.6 -34.6 -26.5 22.5 133.6 84 105 A N T 3 S+ 0 0 112 4,-0.0 2,-0.7 5,-0.0 3,-0.0 0.289 78.5 119.4 -93.8 8.2 -28.4 19.7 135.4 85 106 A N X> - 0 0 69 -3,-1.7 4,-2.3 -6,-0.2 3,-0.6 -0.674 54.1-153.9 -79.5 111.0 -27.5 16.9 133.0 86 107 A V H 3> S+ 0 0 23 -2,-0.7 4,-2.6 1,-0.2 -1,-0.2 0.802 93.5 53.6 -53.6 -37.0 -25.5 14.3 135.0 87 108 A D H 3> S+ 0 0 103 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.844 110.1 46.9 -68.9 -36.3 -23.6 13.0 132.0 88 109 A X H <> S+ 0 0 33 -3,-0.6 4,-1.5 2,-0.2 -2,-0.2 0.881 113.9 47.8 -71.4 -41.4 -22.4 16.6 131.1 89 110 A L H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.938 109.2 54.9 -62.8 -45.6 -21.4 17.1 134.8 90 111 A E H X S+ 0 0 57 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.871 106.0 51.7 -52.0 -47.7 -19.6 13.7 134.9 91 112 A A H X S+ 0 0 15 -4,-1.6 4,-1.1 1,-0.2 -1,-0.2 0.880 111.8 45.0 -61.6 -43.7 -17.4 14.7 131.8 92 113 A C H X S+ 0 0 1 -4,-1.5 4,-1.9 -17,-0.2 3,-0.3 0.914 109.8 56.1 -65.8 -44.6 -16.3 18.0 133.3 93 114 A A H X S+ 0 0 0 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.862 104.3 52.6 -56.2 -43.1 -15.6 16.4 136.8 94 115 A E H X S+ 0 0 69 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.860 109.0 49.7 -62.1 -40.1 -13.2 13.8 135.2 95 116 A X H X S+ 0 0 7 -4,-1.1 4,-2.3 -3,-0.3 -1,-0.2 0.848 106.8 54.9 -69.3 -35.7 -11.1 16.5 133.5 96 117 A Q H X>S+ 0 0 3 -4,-1.9 5,-1.5 2,-0.2 4,-1.0 0.838 107.5 50.8 -64.6 -33.7 -10.9 18.6 136.8 97 118 A V H <5S+ 0 0 57 -4,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.891 111.8 47.1 -68.6 -42.5 -9.4 15.5 138.5 98 119 A C H <5S+ 0 0 64 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.865 110.9 51.6 -67.1 -39.5 -6.8 15.0 135.7 99 120 A R H <5S- 0 0 92 -4,-2.3 -1,-0.2 -31,-0.2 -2,-0.2 0.733 120.2-107.8 -67.5 -26.0 -5.9 18.8 135.7 100 121 A G T <5S+ 0 0 58 -4,-1.0 2,-2.1 -3,-0.2 3,-0.2 0.280 78.0 133.3 111.4 -5.4 -5.3 18.6 139.5 101 122 A Q >< + 0 0 93 -5,-1.5 4,-1.6 1,-0.2 5,-0.1 -0.532 23.0 161.5 -77.3 77.3 -8.4 20.6 140.6 102 123 A E H > + 0 0 117 -2,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.898 68.6 46.0 -66.6 -46.3 -9.2 18.0 143.3 103 124 A K H > S+ 0 0 183 -3,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.908 114.7 45.7 -67.9 -44.6 -11.6 20.3 145.3 104 125 A D H > S+ 0 0 44 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.820 113.6 50.8 -68.7 -33.5 -13.6 21.6 142.3 105 126 A A H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.871 106.8 54.5 -68.7 -38.8 -13.8 18.0 140.9 106 127 A L H X S+ 0 0 37 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.868 106.5 53.1 -61.9 -37.9 -15.1 16.8 144.3 107 128 A R H X S+ 0 0 125 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.927 107.2 49.8 -62.3 -49.9 -17.9 19.5 144.1 108 129 A X H X S+ 0 0 6 -4,-1.6 4,-1.4 1,-0.2 -2,-0.2 0.873 111.1 48.9 -60.8 -40.6 -19.1 18.4 140.7 109 130 A Y H X S+ 0 0 10 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.862 111.5 49.4 -66.5 -37.8 -19.4 14.7 141.7 110 131 A E H X S+ 0 0 120 -4,-1.7 4,-1.2 1,-0.2 -2,-0.2 0.861 108.5 54.1 -68.6 -35.6 -21.3 15.7 144.9 111 132 A K H X S+ 0 0 68 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.821 104.5 55.0 -64.9 -35.2 -23.6 17.8 142.7 112 133 A I H X S+ 0 0 0 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.920 105.6 52.0 -62.0 -46.4 -24.3 14.7 140.5 113 134 A L H < S+ 0 0 43 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.780 106.7 53.9 -59.9 -31.8 -25.4 12.7 143.6 114 135 A Q H < S+ 0 0 168 -4,-1.2 3,-0.2 1,-0.2 -1,-0.2 0.890 113.3 41.8 -69.2 -43.3 -27.8 15.6 144.5 115 136 A L H < S+ 0 0 78 -4,-1.6 2,-0.3 1,-0.3 -2,-0.2 0.782 136.1 14.4 -72.6 -31.5 -29.5 15.3 141.1 116 137 A E >< - 0 0 73 -4,-2.2 3,-1.3 -5,-0.1 -1,-0.3 -0.826 64.3-162.2-150.1 107.9 -29.4 11.5 141.1 117 138 A A T 3 S+ 0 0 57 -2,-0.3 -1,-0.1 -3,-0.2 61,-0.1 0.911 92.5 39.6 -53.6 -53.2 -28.7 9.5 144.3 118 139 A D T 3 S+ 0 0 50 4,-0.0 -1,-0.2 5,-0.0 63,-0.1 0.077 77.4 152.6 -90.6 22.5 -27.8 6.1 142.7 119 140 A N <> - 0 0 12 -3,-1.3 4,-1.5 1,-0.1 5,-0.1 -0.325 38.2-147.9 -55.0 127.1 -25.7 7.6 139.8 120 141 A L H > S+ 0 0 72 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.935 90.0 49.9 -68.5 -46.6 -23.2 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A L H X S+ 0 0 15 -4,-1.4 4,-1.1 2,-0.2 -2,-0.2 0.851 113.8 45.2 -63.4 -38.6 -9.3 5.0 164.0 162 185 A S H X S+ 0 0 45 -4,-1.5 4,-2.2 2,-0.2 5,-0.2 0.921 115.0 45.8 -71.1 -46.5 -13.0 5.2 165.1 163 186 A K H X S+ 0 0 143 -4,-2.6 4,-1.8 1,-0.2 5,-0.2 0.892 114.0 48.4 -64.5 -44.9 -13.5 8.9 164.1 164 187 A L H X>S+ 0 0 31 -4,-2.4 4,-2.2 -5,-0.2 5,-1.3 0.817 111.2 53.1 -65.6 -32.6 -11.8 8.4 160.7 165 188 A F H <>S+ 0 0 22 -4,-1.1 5,-2.3 3,-0.2 6,-0.2 0.962 112.8 39.6 -68.2 -55.4 -14.0 5.2 160.1 166 189 A T H <5S+ 0 0 88 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.804 124.4 40.6 -65.4 -30.5 -17.4 6.8 160.7 167 190 A T H <5S+ 0 0 58 -4,-1.8 4,-0.2 -5,-0.2 -2,-0.2 0.920 134.6 11.0 -83.0 -49.2 -16.5 10.1 158.9 168 191 A R T X5S+ 0 0 68 -4,-2.2 4,-1.3 -5,-0.2 3,-0.4 0.897 126.7 46.3-102.1 -55.7 -14.5 8.7 155.9 169 192 A Y H > S+ 0 0 105 -3,-0.4 4,-1.4 -4,-0.2 -1,-0.2 0.807 110.6 53.8 -69.7 -32.1 -19.0 7.4 153.0 172 195 A A H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.926 111.5 43.5 -66.7 -47.6 -16.8 5.0 151.0 173 196 A R H X S+ 0 0 67 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.829 109.3 57.9 -68.2 -35.6 -19.0 2.0 151.8 174 197 A N H X S+ 0 0 87 -4,-1.8 4,-0.9 -5,-0.2 -1,-0.2 0.879 112.4 40.7 -61.3 -40.9 -22.3 3.9 151.1 175 198 A S H X S+ 0 0 9 -4,-1.4 4,-1.0 2,-0.2 -2,-0.2 0.886 113.6 52.9 -74.3 -42.4 -21.1 4.7 147.6 176 199 A L H X S+ 0 0 3 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.774 105.2 55.4 -65.4 -30.1 -19.7 1.2 146.9 177 200 A Q H < S+ 0 0 107 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.850 106.4 50.4 -70.2 -37.3 -23.0 -0.5 147.9 178 201 A K H >< S+ 0 0 65 -4,-0.9 3,-0.8 1,-0.2 4,-0.3 0.745 105.2 59.3 -69.7 -25.9 -25.0 1.6 145.4 179 202 A V H 3X S+ 0 0 11 -4,-1.0 4,-0.7 1,-0.2 3,-0.4 0.933 111.7 38.0 -66.6 -48.8 -22.4 0.5 142.7 180 203 A I T 3< S+ 0 0 37 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 -0.028 86.9 107.4 -92.4 29.6 -23.1 -3.2 143.2 181 204 A L T <4 S- 0 0 112 -3,-0.8 -1,-0.2 2,-0.1 -2,-0.1 0.926 109.1 -12.7 -70.2 -48.7 -26.9 -2.5 143.7 182 205 A R T 4 S+ 0 0 171 -3,-0.4 -2,-0.1 -4,-0.3 -1,-0.1 0.401 134.3 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0.845 106.1 49.0 -61.3 -38.2 -16.1 -3.9 150.7 193 216 A D H X S+ 0 0 81 -4,-1.5 4,-1.5 2,-0.2 -1,-0.2 0.811 110.1 51.9 -70.9 -31.9 -14.5 -7.0 152.4 194 217 A K H X S+ 0 0 53 -4,-0.8 4,-2.2 2,-0.2 -2,-0.2 0.852 110.4 48.0 -69.6 -38.5 -11.3 -4.8 153.2 195 218 A I H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.879 112.2 50.0 -66.2 -40.5 -13.6 -2.2 154.8 196 219 A L H X S+ 0 0 103 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.801 110.2 50.9 -65.2 -33.4 -15.3 -5.0 156.7 197 220 A R H X S+ 0 0 134 -4,-1.5 4,-0.9 2,-0.2 -2,-0.2 0.917 111.6 45.9 -68.9 -48.4 -11.9 -6.3 157.8 198 221 A I H X S+ 0 0 14 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.790 108.1 60.2 -64.7 -30.5 -10.8 -2.8 159.1 199 222 A E H X S+ 0 0 54 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.919 103.9 46.6 -65.1 -48.7 -14.2 -2.4 160.9 200 223 A K H < S+ 0 0 129 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.721 111.5 52.6 -69.4 -23.6 -13.8 -5.4 163.2 201 224 A E H < S+ 0 0 94 -4,-0.9 -1,-0.2 1,-0.1 -2,-0.2 0.903 113.4 41.8 -75.3 -45.7 -10.2 -4.5 164.2 202 225 A V H < 0 0 7 -4,-1.7 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-1,-0.2 0.853 102.9 52.4 -62.3 -31.8 -18.4 26.9 249.1 213 29 B K H X S+ 0 0 88 -4,-0.9 4,-2.6 -3,-0.4 -1,-0.2 0.852 106.1 53.3 -71.1 -37.1 -17.0 23.3 249.8 214 30 B V H X S+ 0 0 0 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.959 112.8 44.0 -59.7 -51.7 -15.0 23.6 246.6 215 31 B S H X S+ 0 0 34 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.915 114.1 49.2 -60.5 -47.1 -13.4 26.9 247.9 216 32 B A H X S+ 0 0 59 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.907 111.9 49.1 -59.1 -43.7 -12.9 25.5 251.5 217 33 B A H <>S+ 0 0 2 -4,-2.6 5,-3.2 1,-0.2 4,-0.3 0.895 110.9 50.9 -63.5 -42.3 -11.2 22.3 250.1 218 34 B I H ><5S+ 0 0 47 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.926 110.0 48.3 -61.7 -47.4 -8.9 24.5 247.9 219 35 B E H 3<5S+ 0 0 174 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.739 111.2 50.8 -67.3 -24.2 -7.8 26.8 250.7 220 36 B A T 3<5S- 0 0 70 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.408 117.0-113.2 -89.5 -0.4 -7.1 23.7 253.0 221 37 B G T < 5S+ 0 0 54 -3,-1.4 2,-0.7 -4,-0.3 -3,-0.2 0.790 74.3 136.5 71.8 29.7 -5.0 22.1 250.2 222 38 B Q >< + 0 0 104 -5,-3.2 4,-1.8 1,-0.2 -1,-0.1 -0.661 17.8 160.9-108.7 69.4 -7.5 19.2 249.8 223 39 B N H > + 0 0 70 -2,-0.7 4,-2.0 1,-0.2 -1,-0.2 0.796 65.7 58.5 -62.5 -35.6 -7.4 19.3 246.0 224 40 B G H > S+ 0 0 54 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.935 110.8 40.8 -62.5 -49.5 -8.9 15.8 245.5 225 41 B Q H > S+ 0 0 97 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.825 110.7 59.3 -71.5 -29.5 -12.1 16.5 247.5 226 42 B A H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.917 106.9 47.2 -62.1 -42.6 -12.3 20.0 245.8 227 43 B V H X S+ 0 0 12 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.897 110.8 51.8 -66.2 -40.6 -12.4 18.2 242.3 228 44 B S H X S+ 0 0 43 -4,-1.7 4,-1.7 1,-0.2 -2,-0.2 0.916 110.9 47.0 -61.7 -49.5 -15.1 15.7 243.5 229 45 B Y H X S+ 0 0 67 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.856 109.6 54.9 -59.4 -38.6 -17.3 18.5 244.8 230 46 B F H X S+ 0 0 0 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.887 106.3 51.3 -64.3 -39.6 -16.8 20.4 241.6 231 47 B R H X S+ 0 0 120 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.891 109.3 50.7 -61.4 -42.4 -18.0 17.4 239.5 232 48 B Q H X S+ 0 0 103 -4,-1.7 4,-1.0 1,-0.2 -1,-0.2 0.829 107.9 52.0 -65.6 -34.8 -21.2 17.1 241.6 233 49 B T H X S+ 0 0 0 -4,-1.7 4,-2.9 2,-0.2 8,-0.2 0.827 103.7 58.1 -72.2 -33.7 -22.0 20.9 241.1 234 50 B I H < S+ 0 0 19 -4,-1.6 4,-0.4 1,-0.2 -2,-0.2 0.933 104.6 52.1 -59.0 -44.6 -21.7 20.4 237.3 235 51 B A H < S+ 0 0 89 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.810 113.8 43.8 -60.6 -35.2 -24.4 17.8 237.5 236 52 B L H < S- 0 0 98 -4,-1.0 -2,-0.2 1,-0.2 2,-0.2 0.931 139.6 -12.1 -75.3 -50.6 -26.7 20.2 239.4 237 53 B N X - 0 0 71 -4,-2.9 4,-2.1 1,-0.1 -1,-0.2 -0.675 54.5-174.4-160.6 98.4 -26.0 23.4 237.3 238 54 B I H > S+ 0 0 29 -4,-0.4 4,-2.6 1,-0.2 5,-0.1 0.820 87.0 55.3 -64.5 -37.3 -23.3 23.6 234.7 239 55 B D H > S+ 0 0 94 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.865 110.5 45.4 -64.6 -40.7 -23.8 27.3 233.9 240 56 B R H > S+ 0 0 80 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.925 113.6 50.3 -67.4 -44.7 -23.4 28.3 237.6 241 57 B T H X S+ 0 0 0 -4,-2.1 4,-1.8 -8,-0.2 -2,-0.2 0.899 109.8 50.2 -59.1 -45.8 -20.3 26.1 237.9 242 58 B E H X S+ 0 0 9 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.899 108.4 52.6 -58.0 -47.4 -18.8 27.6 234.7 243 59 B X H X S+ 0 0 90 -4,-2.0 4,-2.5 1,-0.2 5,-0.3 0.890 107.5 52.9 -55.9 -41.5 -19.4 31.1 236.2 244 60 B Y H X>S+ 0 0 8 -4,-2.1 4,-2.8 1,-0.2 5,-0.8 0.891 105.9 53.5 -61.0 -43.9 -17.6 30.0 239.4 245 61 B Y H X5S+ 0 0 4 -4,-1.8 4,-0.9 3,-0.2 -1,-0.2 0.911 113.6 42.8 -57.0 -45.3 -14.6 28.9 237.3 246 62 B W H <5S+ 0 0 108 -4,-1.9 -2,-0.2 1,-0.1 -1,-0.2 0.881 125.1 30.9 -70.2 -42.2 -14.3 32.3 235.6 247 63 B T H <5S+ 0 0 96 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.797 131.0 25.3 -90.0 -32.5 -14.9 34.5 238.7 248 64 B N H <5S+ 0 0 96 -4,-2.8 2,-0.5 -5,-0.3 -3,-0.2 0.568 92.1 93.0-112.8 -15.1 -13.4 32.5 241.6 249 65 B V S < - 0 0 98 -2,-0.5 3,-1.3 1,-0.2 6,-0.4 -0.636 16.0-155.1 -70.1 114.0 -7.1 31.2 240.4 251 67 B K T 3 S+ 0 0 69 -2,-0.6 -1,-0.2 1,-0.2 6,-0.1 0.687 90.6 57.9 -69.8 -19.6 -6.0 30.3 236.8 252 68 B N T 3 S+ 0 0 151 4,-0.1 -1,-0.2 3,-0.0 2,-0.1 0.438 88.4 98.7 -87.0 -1.0 -2.3 30.0 237.9 253 69 B S S < S- 0 0 32 -3,-1.3 4,-0.5 1,-0.1 3,-0.3 -0.460 81.7-121.6 -85.4 159.8 -3.1 27.3 240.5 254 70 B E S >> S+ 0 0 161 1,-0.2 3,-0.7 2,-0.2 4,-0.6 0.865 111.5 59.3 -69.1 -34.4 -2.6 23.5 239.9 255 71 B I H >> S+ 0 0 5 1,-0.2 4,-1.9 2,-0.2 3,-1.0 0.850 87.0 78.6 -60.2 -38.2 -6.3 22.8 240.6 256 72 B S H 3> S+ 0 0 0 -6,-0.4 4,-2.3 1,-0.3 -1,-0.2 0.804 92.6 48.8 -37.6 -49.6 -7.4 25.2 237.7 257 73 B S H <> S+ 0 0 42 -3,-0.7 4,-1.8 -4,-0.5 -1,-0.3 0.835 108.4 52.3 -66.6 -39.1 -6.6 22.6 235.0 258 74 B K H S+ 0 0 8 -4,-2.5 5,-2.7 2,-0.2 4,-0.5 0.861 108.3 54.4 -65.6 -35.8 -20.2 20.2 227.9 268 84 B K H ><5S+ 0 0 68 -4,-1.8 3,-1.0 -5,-0.2 -2,-0.2 0.913 107.9 48.6 -62.3 -47.1 -19.1 17.4 225.5 269 85 B K H 3<5S+ 0 0 141 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.823 110.3 52.0 -61.4 -36.1 -21.7 15.0 227.0 270 86 B N H 3<5S- 0 0 99 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.577 113.4-121.8 -72.7 -12.4 -24.3 17.7 226.7 271 87 B R T <<5 + 0 0 181 -3,-1.0 2,-1.2 -4,-0.5 -3,-0.2 0.787 68.0 140.4 68.6 31.3 -23.4 18.2 223.0 272 88 B N >< + 0 0 61 -5,-2.7 4,-2.1 1,-0.2 -1,-0.2 -0.791 22.0 170.6 -98.9 80.1 -22.6 21.9 223.7 273 89 B Y H > + 0 0 63 -2,-1.2 4,-2.5 2,-0.2 -1,-0.2 0.818 68.2 60.9 -67.6 -32.3 -19.6 21.6 221.4 274 90 B D H > S+ 0 0 97 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.934 111.9 38.8 -58.5 -48.3 -19.0 25.4 221.4 275 91 B K H > S+ 0 0 63 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.848 113.1 55.3 -71.4 -36.2 -18.5 25.3 225.2 276 92 B A H X S+ 0 0 0 -4,-2.1 4,-2.3 -9,-0.2 5,-0.2 0.943 110.4 47.5 -60.5 -46.1 -16.5 22.0 225.1 277 93 B Y H X S+ 0 0 52 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.922 107.3 56.3 -58.2 -48.7 -14.2 23.6 222.6 278 94 B L H X S+ 0 0 68 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.909 112.4 41.7 -52.6 -47.4 -13.8 26.7 224.8 279 95 B F H X S+ 0 0 0 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.833 112.7 50.8 -73.8 -34.7 -12.6 24.6 227.8 280 96 B Y H X S+ 0 0 18 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.846 109.5 53.6 -69.2 -32.1 -10.3 22.3 225.9 281 97 B K H X S+ 0 0 45 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.887 104.8 54.2 -66.5 -40.2 -8.8 25.5 224.3 282 98 B E H X S+ 0 0 18 -4,-1.6 4,-0.8 2,-0.2 -1,-0.2 0.869 111.4 45.6 -59.2 -39.6 -8.2 26.9 227.9 283 99 B L H >X S+ 0 0 11 -4,-1.4 4,-1.0 1,-0.2 3,-0.6 0.911 109.7 55.3 -68.5 -42.9 -6.3 23.6 228.8 284 100 B L H 3< S+ 0 0 26 -4,-2.2 3,-0.3 1,-0.2 6,-0.2 0.799 98.5 60.9 -60.8 -34.1 -4.4 23.8 225.5 285 101 B Q H 3< S+ 0 0 152 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.848 104.4 50.5 -64.6 -32.7 -3.0 27.3 226.2 286 102 B K H << S+ 0 0 88 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.775 130.3 18.1 -72.4 -30.5 -1.3 25.9 229.4 287 103 B A S >< S+ 0 0 35 -4,-1.0 3,-1.7 -3,-0.3 -1,-0.3 -0.621 72.1 173.1-141.1 74.5 0.3 23.1 227.4 288 104 B P T 3 S+ 0 0 62 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 0.680 80.0 46.2 -62.4 -21.4 0.2 24.0 223.6 289 105 B N T 3 S+ 0 0 102 31,-0.0 2,-0.8 4,-0.0 3,-0.1 0.173 78.7 121.0-104.9 13.4 2.3 21.0 222.4 290 106 B N <> - 0 0 66 -3,-1.7 4,-2.2 -6,-0.2 3,-0.3 -0.708 53.0-155.0 -82.7 112.2 0.5 18.4 224.5 291 107 B V H > S+ 0 0 24 -2,-0.8 4,-2.3 1,-0.2 -1,-0.2 0.795 92.1 55.0 -59.0 -31.7 -0.9 15.9 221.9 292 108 B D H > S+ 0 0 106 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.874 109.9 45.9 -69.7 -40.9 -3.7 14.8 224.3 293 109 B X H > S+ 0 0 34 -3,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.864 113.0 50.5 -67.7 -39.8 -4.9 18.4 224.7 294 110 B L H X S+ 0 0 2 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.942 109.6 51.3 -62.2 -44.5 -4.7 18.9 220.9 295 111 B E H X S+ 0 0 53 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.891 108.3 50.6 -58.4 -49.4 -6.7 15.7 220.2 296 112 B A H X S+ 0 0 16 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.894 113.6 46.1 -58.5 -40.9 -9.5 16.8 222.6 297 113 B C H X S+ 0 0 1 -4,-1.7 4,-1.7 -17,-0.2 -2,-0.2 0.923 110.1 52.4 -67.9 -46.4 -9.8 20.2 220.9 298 114 B A H X S+ 0 0 0 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.887 106.4 54.4 -58.2 -41.5 -9.7 18.7 217.3 299 115 B E H X S+ 0 0 61 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.878 106.6 51.0 -59.7 -43.0 -12.6 16.3 218.2 300 116 B X H X S+ 0 0 6 -4,-1.3 4,-1.6 1,-0.2 -1,-0.2 0.867 106.5 55.4 -64.2 -35.6 -14.8 19.2 219.3 301 117 B Q H <>S+ 0 0 6 -4,-1.7 5,-2.8 2,-0.2 -1,-0.2 0.838 106.0 50.9 -65.6 -34.6 -14.0 21.0 216.0 302 118 B V H ><5S+ 0 0 61 -4,-1.5 3,-1.5 1,-0.2 -2,-0.2 0.940 110.2 49.6 -66.3 -47.0 -15.3 18.0 214.1 303 119 B C H 3<5S+ 0 0 58 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.798 109.3 52.6 -62.2 -29.5 -18.5 18.0 216.1 304 120 B R T 3<5S- 0 0 82 -4,-1.6 -1,-0.3 -31,-0.1 -2,-0.2 0.420 117.5-111.3 -84.5 -0.2 -18.9 21.8 215.5 305 121 B G T < 5S+ 0 0 61 -3,-1.5 2,-1.1 -4,-0.2 3,-0.2 0.678 78.8 133.5 75.1 18.1 -18.6 21.3 211.7 306 122 B Q >< + 0 0 92 -5,-2.8 4,-2.3 1,-0.2 -1,-0.2 -0.611 18.9 154.5 -98.9 67.8 -15.2 23.1 211.7 307 123 B E H > + 0 0 56 -2,-1.1 4,-2.4 2,-0.2 -1,-0.2 0.859 66.3 54.8 -65.2 -40.8 -13.6 20.4 209.6 308 124 B K H > S+ 0 0 185 -3,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.970 114.2 39.9 -59.9 -54.7 -10.9 22.7 208.1 309 125 B D H > S+ 0 0 43 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.857 114.1 54.5 -64.9 -35.9 -9.7 23.7 211.6 310 126 B A H X S+ 0 0 1 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.911 107.4 50.2 -63.2 -42.0 -10.1 20.1 213.0 311 127 B L H X S+ 0 0 32 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.873 107.3 54.6 -64.3 -39.9 -7.9 18.8 210.2 312 128 B R H X S+ 0 0 126 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.907 108.8 48.9 -57.6 -45.3 -5.2 21.4 211.0 313 129 B X H X S+ 0 0 5 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.908 110.2 49.3 -65.0 -42.9 -5.1 20.3 214.6 314 130 B Y H X S+ 0 0 7 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.857 111.3 50.2 -64.5 -37.8 -4.8 16.6 213.7 315 131 B E H X S+ 0 0 89 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.823 107.6 53.6 -69.6 -33.4 -1.9 17.4 211.3 316 132 B K H X S+ 0 0 66 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.898 105.5 54.7 -65.5 -41.4 -0.2 19.4 214.0 317 133 B I H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.931 107.6 49.6 -55.5 -46.2 -0.4 16.3 216.3 318 134 B L H < S+ 0 0 39 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.822 106.9 55.2 -63.9 -32.6 1.3 14.2 213.6 319 135 B Q H < S+ 0 0 170 -4,-1.5 3,-0.3 1,-0.2 -1,-0.2 0.915 113.9 40.7 -65.0 -43.4 4.1 16.9 213.3 320 136 B L H < S+ 0 0 76 -4,-2.1 2,-0.3 1,-0.3 -2,-0.2 0.898 137.6 11.0 -70.7 -41.4 4.8 16.6 217.1 321 137 B E >< - 0 0 75 -4,-2.7 3,-1.5 -5,-0.2 -1,-0.3 -0.869 63.8-164.5-144.2 104.6 4.4 12.8 217.2 322 138 B A T 3 S+ 0 0 58 -2,-0.3 -1,-0.1 -3,-0.3 -4,-0.1 0.766 90.8 47.1 -60.7 -32.8 4.3 10.8 213.9 323 139 B D T 3 S+ 0 0 62 -5,-0.0 -1,-0.3 4,-0.0 -5,-0.1 0.189 75.7 149.7 -95.9 14.4 2.9 7.5 215.4 324 140 B N <> - 0 0 9 -3,-1.5 4,-1.5 1,-0.1 5,-0.1 -0.282 40.5-147.8 -54.7 124.6 0.2 9.2 217.5 325 141 B L H > S+ 0 0 62 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.951 90.6 47.6 -65.6 -49.0 -2.6 6.7 217.7 326 142 B A H > S+ 0 0 24 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.867 112.7 47.1 -60.4 -45.1 -5.6 9.1 217.8 327 143 B A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.817 113.1 49.8 -68.7 -34.5 -4.5 11.3 214.9 328 144 B N H X S+ 0 0 2 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.816 110.0 50.0 -73.3 -34.9 -3.7 8.2 212.7 329 145 B I H X S+ 0 0 60 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.958 116.1 43.1 -66.4 -48.3 -7.1 6.7 213.4 330 146 B F H X S+ 0 0 48 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.935 118.8 42.0 -61.4 -53.2 -8.9 9.9 212.5 331 147 B L H X S+ 0 0 4 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.847 110.0 57.6 -65.7 -36.6 -6.8 10.7 209.4 332 148 B G H X S+ 0 0 0 -4,-2.0 4,-1.1 1,-0.2 -1,-0.2 0.933 114.9 38.4 -57.2 -45.8 -6.9 7.1 208.2 333 149 B N H X S+ 0 0 46 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.868 113.1 54.8 -73.9 -40.7 -10.7 7.2 208.2 334 150 B Y H X S+ 0 0 70 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.925 110.6 46.1 -59.8 -48.3 -11.1 10.8 206.9 335 151 B Y H X S+ 0 0 29 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.814 112.6 51.8 -65.3 -31.5 -8.9 10.1 203.8 336 152 B Y H X S+ 0 0 16 -4,-1.1 4,-1.7 -5,-0.2 -2,-0.2 0.948 112.5 42.8 -68.7 -52.3 -10.8 6.9 203.2 337 153 B L H X S+ 0 0 111 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.888 116.1 47.4 -63.2 -42.9 -14.3 8.4 203.3 338 154 B T H X S+ 0 0 12 -4,-2.2 4,-1.3 -5,-0.2 -1,-0.2 0.821 112.3 51.1 -67.2 -33.2 -13.4 11.5 201.2 339 155 B A H X S+ 0 0 0 -4,-1.3 4,-1.2 -5,-0.2 -2,-0.2 0.812 109.2 52.4 -69.3 -32.5 -11.6 9.2 198.7 340 156 B E H X S+ 0 0 75 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.930 109.1 46.8 -70.0 -49.0 -14.8 7.1 198.5 341 157 B Q H X S+ 0 0 134 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.796 111.8 51.6 -65.8 -31.5 -17.2 10.1 197.7 342 158 B E H X S+ 0 0 84 -4,-1.3 4,-1.6 2,-0.2 -1,-0.2 0.798 108.3 52.4 -72.1 -31.9 -14.7 11.4 195.0 343 159 B K H X S+ 0 0 32 -4,-1.2 4,-1.7 2,-0.2 -2,-0.2 0.886 109.3 49.4 -68.1 -41.7 -14.7 7.9 193.4 344 160 B K H X S+ 0 0 148 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.899 111.6 48.0 -63.3 -45.7 -18.5 7.9 193.3 345 161 B K H X S+ 0 0 138 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.845 110.4 52.9 -62.2 -38.7 -18.6 11.4 191.7 346 162 B L H X S+ 0 0 44 -4,-1.6 4,-1.1 1,-0.2 -2,-0.2 0.854 111.6 45.5 -65.5 -39.1 -16.0 10.3 189.1 347 163 B E H X S+ 0 0 68 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.849 110.5 52.8 -73.0 -39.3 -18.1 7.2 188.1 348 164 B T H X S+ 0 0 83 -4,-2.0 4,-1.0 2,-0.2 -2,-0.2 0.870 107.2 51.8 -65.1 -41.1 -21.4 9.1 187.9 349 165 B D H < S+ 0 0 101 -4,-1.7 3,-0.3 1,-0.2 -1,-0.2 0.862 111.4 47.0 -63.5 -38.9 -19.9 11.7 185.5 350 166 B Y H < S+ 0 0 73 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.824 106.5 60.1 -69.2 -34.4 -18.6 8.9 183.2 351 167 B K H < S+ 0 0 78 -4,-1.7 2,-0.5 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