==== 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 ELECTRON TRANSPORT 22-JUN-10 3NMK . COMPND 2 MOLECULE: SOLUBLE CYTOCHROME B562; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.J.RADFORD,F.A.TEZCAN . 424 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23282.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 349 82.3 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 . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 288 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 0 0 0 0 0 3 1 4 0 0 0 4 0 0 4 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 A 0 0 91 0, 0.0 2,-0.2 0, 0.0 364,-0.1 0.000 360.0 360.0 360.0-173.9 -13.2 30.6 -18.1 2 2 A D > - 0 0 46 1,-0.1 4,-2.5 321,-0.0 3,-0.3 -0.544 360.0-102.5-105.3 164.2 -16.1 28.4 -16.8 3 3 A L H > S+ 0 0 39 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.844 116.8 50.0 -51.0 -52.0 -18.1 28.4 -13.6 4 4 A E H > S+ 0 0 143 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.913 112.3 48.0 -55.7 -45.8 -16.4 25.4 -11.9 5 5 A D H > S+ 0 0 80 -3,-0.3 4,-2.5 1,-0.2 3,-0.2 0.956 111.2 51.0 -63.0 -46.3 -12.9 26.9 -12.6 6 6 A N H X S+ 0 0 10 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.874 109.8 49.7 -54.2 -43.1 -14.0 30.3 -11.2 7 7 A M H X S+ 0 0 56 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.825 108.0 54.1 -72.7 -29.8 -15.3 28.6 -8.0 8 8 A E H X S+ 0 0 118 -4,-1.9 4,-3.2 -3,-0.2 5,-0.3 0.946 108.7 48.9 -63.0 -47.0 -12.1 26.7 -7.6 9 9 A T H X S+ 0 0 44 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.950 110.7 50.4 -58.1 -52.3 -10.2 30.0 -7.8 10 10 A L H X S+ 0 0 17 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.898 115.6 43.7 -47.7 -43.8 -12.5 31.6 -5.2 11 11 A N H X S+ 0 0 84 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.928 114.4 46.1 -77.2 -46.2 -12.0 28.6 -3.0 12 12 A D H X S+ 0 0 79 -4,-3.2 4,-2.6 2,-0.2 3,-0.2 0.931 113.7 48.6 -58.4 -50.1 -8.2 28.2 -3.3 13 13 A N H X S+ 0 0 15 -4,-2.7 4,-2.2 -5,-0.3 -1,-0.2 0.822 104.8 59.8 -71.1 -23.0 -7.5 31.9 -2.8 14 14 A L H X S+ 0 0 11 -4,-1.3 4,-1.7 -5,-0.3 -1,-0.2 0.932 108.9 44.6 -66.3 -38.5 -9.8 32.0 0.2 15 15 A K H X S+ 0 0 113 -4,-1.6 4,-1.9 -3,-0.2 3,-0.4 0.975 108.5 56.0 -68.4 -51.1 -7.5 29.4 1.8 16 16 A V H < S+ 0 0 63 -4,-2.6 3,-0.3 1,-0.2 -1,-0.2 0.887 107.9 51.0 -41.8 -47.8 -4.3 31.3 0.7 17 17 A I H >< S+ 0 0 2 -4,-2.2 3,-1.2 1,-0.2 -1,-0.2 0.885 105.6 52.9 -65.9 -39.0 -5.7 34.3 2.5 18 18 A E H 3< S+ 0 0 85 -4,-1.7 -1,-0.2 -3,-0.4 -2,-0.2 0.858 117.6 39.6 -65.7 -24.7 -6.3 32.4 5.8 19 19 A K T 3< S+ 0 0 165 -4,-1.9 -1,-0.3 -3,-0.3 -2,-0.2 0.282 88.9 139.0-102.3 4.5 -2.7 31.2 5.6 20 20 A A < - 0 0 15 -3,-1.2 3,-0.1 -5,-0.2 -3,-0.1 -0.228 35.5-169.9 -67.5 146.3 -1.2 34.4 4.4 21 21 A D S S+ 0 0 138 1,-0.2 2,-0.3 63,-0.0 -1,-0.1 0.740 70.5 17.3-101.5 -33.2 2.1 35.8 5.8 22 22 A N S > S- 0 0 66 62,-0.1 4,-1.2 1,-0.0 -1,-0.2 -0.885 79.1-104.4-135.4 173.2 2.1 39.3 4.3 23 23 A A H > S+ 0 0 25 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.766 113.5 60.9 -71.7 -28.6 -0.2 41.8 2.7 24 24 A A H > S+ 0 0 69 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.951 102.3 52.4 -63.3 -48.7 1.0 41.2 -0.9 25 25 A Q H > S+ 0 0 73 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.899 113.9 44.2 -48.7 -44.9 -0.1 37.6 -0.7 26 26 A V H X S+ 0 0 1 -4,-1.2 4,-2.7 2,-0.2 5,-0.2 0.950 113.4 48.3 -71.1 -58.7 -3.5 38.7 0.4 27 27 A K H X S+ 0 0 92 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.918 112.9 50.8 -30.9 -59.0 -3.8 41.5 -2.2 28 28 A D H X S+ 0 0 87 -4,-3.4 4,-1.9 1,-0.2 -2,-0.2 0.951 112.3 45.0 -61.4 -43.4 -2.7 39.0 -4.8 29 29 A A H X S+ 0 0 2 -4,-2.3 4,-2.6 -5,-0.2 -1,-0.2 0.838 112.8 50.6 -70.3 -36.6 -5.3 36.4 -3.8 30 30 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.906 107.9 53.5 -67.8 -42.1 -8.1 38.9 -3.5 31 31 A T H X S+ 0 0 67 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.910 110.1 47.9 -56.5 -42.2 -7.3 40.3 -7.0 32 32 A K H X S+ 0 0 100 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.972 111.1 50.3 -67.4 -46.4 -7.5 36.7 -8.3 33 33 A M H X S+ 0 0 3 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.869 108.0 54.6 -52.3 -43.8 -10.8 36.2 -6.5 34 34 A R H X S+ 0 0 35 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.959 106.9 49.2 -58.8 -48.9 -12.1 39.5 -8.0 35 35 A A H X S+ 0 0 65 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.901 113.7 48.0 -61.8 -36.2 -11.3 38.4 -11.6 36 36 A A H X S+ 0 0 5 -4,-2.2 4,-3.1 2,-0.2 5,-0.3 0.933 108.7 51.5 -68.9 -47.4 -13.1 35.1 -10.9 37 37 A A H X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.894 110.4 50.2 -57.5 -38.8 -16.2 36.7 -9.3 38 38 A L H < S+ 0 0 20 -4,-2.4 4,-0.4 -5,-0.2 -1,-0.2 0.893 112.4 47.3 -69.6 -34.3 -16.6 39.0 -12.3 39 39 A D H >< S+ 0 0 33 -4,-1.7 3,-2.1 -5,-0.2 4,-0.4 0.966 112.1 48.0 -68.2 -50.2 -16.3 36.0 -14.7 40 40 A A H >< S+ 0 0 0 -4,-3.1 3,-1.5 1,-0.3 -1,-0.2 0.819 99.0 70.4 -61.1 -29.3 -18.8 33.9 -12.8 41 41 A Q T 3< S+ 0 0 54 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.767 98.4 50.1 -60.7 -21.5 -21.1 36.9 -12.7 42 42 A K T < S+ 0 0 68 -3,-2.1 -1,-0.3 -4,-0.4 -2,-0.2 0.602 96.5 96.6 -88.0 -9.0 -21.5 36.3 -16.5 43 43 A A < - 0 0 23 -3,-1.5 19,-0.0 -4,-0.4 -41,-0.0 -0.238 67.2-132.8 -88.8 163.0 -22.4 32.6 -16.3 44 44 A T - 0 0 46 278,-0.1 -41,-0.1 17,-0.0 5,-0.1 -0.967 27.1-137.8-109.6 117.8 -25.5 30.5 -16.2 45 45 A P > - 0 0 3 0, 0.0 3,-2.2 0, 0.0 4,-0.4 -0.473 20.1-115.3 -73.9 145.4 -25.5 27.9 -13.4 46 46 A P G > S+ 0 0 100 0, 0.0 3,-2.0 0, 0.0 4,-0.3 0.907 115.1 59.7 -38.9 -52.4 -26.8 24.4 -14.2 47 47 A K G 3 S+ 0 0 130 58,-0.5 3,-0.2 1,-0.3 59,-0.1 0.734 113.6 36.1 -53.1 -25.9 -29.6 24.9 -11.7 48 48 A L G X S+ 0 0 7 -3,-2.2 3,-2.1 57,-0.1 -1,-0.3 0.237 78.5 116.4-116.1 16.4 -30.9 27.9 -13.6 49 49 A E T < S+ 0 0 140 -3,-2.0 -1,-0.1 -4,-0.4 -2,-0.1 0.728 77.8 49.6 -69.7 -23.3 -30.3 26.9 -17.2 50 50 A D T 3 S+ 0 0 131 -4,-0.3 2,-0.3 -3,-0.2 -1,-0.3 0.161 93.7 103.1 -94.3 12.4 -33.9 26.8 -18.2 51 51 A K S < S- 0 0 81 -3,-2.1 -3,-0.1 4,-0.0 0, 0.0 -0.772 80.1-103.5-104.4 144.2 -34.6 30.3 -16.8 52 52 A S > - 0 0 50 -2,-0.3 3,-3.8 1,-0.2 6,-0.4 -0.459 25.4-127.3 -60.1 130.5 -35.0 33.6 -18.6 53 53 A P T 3 S+ 0 0 47 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.682 115.2 57.3 -44.8 -22.6 -31.9 35.8 -18.4 54 54 A D T 3 S+ 0 0 74 4,-0.1 -2,-0.1 5,-0.0 5,-0.0 0.485 85.1 119.6 -80.8 -20.0 -34.5 38.3 -17.2 55 55 A S S <> S- 0 0 12 -3,-3.8 4,-2.3 1,-0.1 5,-0.2 -0.103 76.2-118.1 -68.1 158.4 -35.8 36.1 -14.4 56 56 A P H > S+ 0 0 73 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.903 116.5 53.9 -54.4 -34.2 -35.8 37.0 -10.7 57 57 A E H > S+ 0 0 66 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.940 108.6 44.6 -68.3 -53.3 -33.5 34.0 -10.2 58 58 A M H > S+ 0 0 24 -6,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.855 114.3 49.9 -58.4 -41.6 -30.8 35.0 -12.8 59 59 A C H X S+ 0 0 31 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.918 110.7 50.2 -62.9 -44.7 -30.8 38.6 -11.5 60 60 A D H X S+ 0 0 40 -4,-2.3 4,-2.0 -5,-0.2 3,-0.3 0.948 108.6 53.7 -58.8 -46.6 -30.4 37.4 -7.9 61 61 A F H >X S+ 0 0 9 -4,-2.8 4,-1.0 1,-0.3 3,-0.6 0.943 111.1 43.8 -49.6 -61.3 -27.6 35.1 -9.0 62 62 A A H 3X S+ 0 0 31 -4,-2.3 4,-1.6 1,-0.2 -1,-0.3 0.778 109.0 59.0 -55.9 -31.8 -25.7 38.0 -10.6 63 63 A A H 3X S+ 0 0 9 -4,-1.8 4,-2.6 -3,-0.3 -1,-0.2 0.868 96.3 62.1 -70.0 -34.4 -26.4 40.3 -7.6 64 64 A G H S+ 0 0 36 -4,-1.4 5,-2.5 2,-0.2 -2,-0.2 0.887 112.4 51.0 -66.7 -41.5 -7.6 47.0 4.0 79 79 A A H ><5S+ 0 0 5 -4,-2.2 3,-2.0 3,-0.2 -2,-0.2 0.920 107.8 52.0 -64.2 -44.7 -4.9 44.9 2.4 80 80 A N H 3<5S+ 0 0 104 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.903 107.2 53.5 -57.7 -38.2 -3.5 48.0 0.5 81 81 A E T 3<5S- 0 0 98 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.382 119.5-118.1 -74.2 2.8 -3.4 49.8 3.9 82 82 A G T < 5 + 0 0 45 -3,-2.0 2,-1.6 1,-0.2 -3,-0.2 0.628 67.1 143.8 68.4 17.3 -1.4 46.8 5.1 83 83 A K >< + 0 0 86 -5,-2.5 4,-2.1 1,-0.2 5,-0.2 -0.546 21.1 173.9 -85.3 78.8 -3.9 45.8 7.7 84 84 A V H > S+ 0 0 37 -2,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.867 71.5 45.9 -58.3 -49.0 -3.4 42.0 7.3 85 85 A K H > S+ 0 0 175 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.878 113.6 49.5 -65.0 -38.8 -5.5 40.7 10.1 86 86 A E H > S+ 0 0 104 2,-0.2 4,-2.3 -3,-0.2 -1,-0.2 0.835 110.7 50.5 -69.1 -33.8 -8.4 43.0 9.3 87 87 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.872 110.4 49.9 -70.4 -37.2 -8.2 41.9 5.6 88 88 A Q H X S+ 0 0 46 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.931 110.5 50.1 -64.6 -44.1 -8.3 38.3 6.8 89 89 A A H X S+ 0 0 59 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.933 110.0 50.9 -54.1 -48.5 -11.3 39.0 8.9 90 90 A A H X S+ 0 0 23 -4,-2.3 4,-0.8 1,-0.2 3,-0.3 0.880 107.6 52.5 -60.0 -39.9 -13.0 40.7 5.9 91 91 A A H < S+ 0 0 2 -4,-2.0 3,-0.5 1,-0.2 4,-0.5 0.846 103.8 56.8 -68.8 -33.8 -12.3 37.7 3.7 92 92 A E H >< S+ 0 0 86 -4,-1.9 3,-1.1 1,-0.2 4,-0.3 0.836 100.3 59.5 -60.3 -35.5 -13.9 35.4 6.3 93 93 A Q H >X S+ 0 0 118 -4,-1.3 3,-1.0 1,-0.3 4,-0.6 0.776 89.2 72.8 -66.2 -29.0 -17.0 37.5 6.0 94 94 A L H >X S+ 0 0 0 -4,-0.8 4,-2.0 -3,-0.5 3,-0.8 0.841 81.1 74.6 -46.1 -39.1 -17.2 36.6 2.3 95 95 A K H <> S+ 0 0 70 -3,-1.1 4,-3.2 -4,-0.5 5,-0.2 0.837 85.2 60.2 -56.4 -34.6 -18.3 33.1 3.3 96 96 A T H <> S+ 0 0 89 -3,-1.0 4,-3.5 -4,-0.3 -1,-0.3 0.933 108.5 45.7 -60.4 -39.9 -21.8 34.1 4.2 97 97 A T H - 0 0 49 1,-0.1 4,-2.4 41,-0.0 5,-0.2 -0.364 360.0-103.1 -94.8 170.0 -34.7 55.4 -16.8 110 3 B L H > S+ 0 0 38 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.897 117.0 51.5 -58.6 -52.1 -33.0 56.1 -13.4 111 4 B E H > S+ 0 0 151 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.930 112.7 46.8 -52.2 -46.1 -35.0 59.2 -12.5 112 5 B D H > S+ 0 0 81 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.909 113.0 48.3 -64.2 -45.5 -38.3 57.5 -13.2 113 6 B N H X S+ 0 0 11 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.913 110.2 52.1 -61.1 -37.8 -37.3 54.4 -11.2 114 7 B M H X S+ 0 0 55 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.884 107.8 52.3 -72.4 -32.0 -36.1 56.6 -8.3 115 8 B E H X S+ 0 0 121 -4,-2.2 4,-2.8 -5,-0.2 -1,-0.2 0.896 108.7 50.1 -63.3 -43.6 -39.5 58.4 -8.4 116 9 B T H X S+ 0 0 45 -4,-2.1 4,-2.6 2,-0.2 5,-0.3 0.944 110.2 50.7 -62.0 -46.7 -41.3 55.0 -8.2 117 10 B L H X S+ 0 0 15 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.940 114.7 43.5 -50.8 -52.3 -39.1 54.0 -5.2 118 11 B N H X S+ 0 0 88 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.871 114.6 48.0 -66.7 -41.0 -39.8 57.2 -3.5 119 12 B D H X S+ 0 0 79 -4,-2.8 4,-2.4 2,-0.2 3,-0.3 0.965 113.4 46.3 -67.1 -49.5 -43.6 57.3 -4.2 120 13 B N H X S+ 0 0 13 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.796 105.9 59.8 -68.4 -27.1 -44.2 53.7 -3.1 121 14 B L H X S+ 0 0 13 -4,-1.7 4,-1.5 -5,-0.3 -1,-0.2 0.940 108.5 45.8 -63.0 -40.8 -42.1 54.2 0.0 122 15 B K H X S+ 0 0 111 -4,-1.5 4,-2.0 -3,-0.3 3,-0.3 0.937 108.5 55.2 -64.9 -50.0 -44.6 56.9 1.0 123 16 B V H < S+ 0 0 65 -4,-2.4 4,-0.4 1,-0.2 3,-0.3 0.930 107.4 52.1 -44.6 -48.0 -47.6 54.6 0.0 124 17 B I H >< S+ 0 0 2 -4,-2.5 3,-0.8 1,-0.2 -1,-0.2 0.863 106.6 51.3 -63.1 -36.0 -46.1 52.1 2.4 125 18 B E H 3< S+ 0 0 83 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.856 118.1 38.6 -73.6 -24.3 -45.9 54.6 5.3 126 19 B K T 3< S+ 0 0 164 -4,-2.0 -1,-0.2 -3,-0.3 -2,-0.2 0.333 89.5 135.2 -96.9 -0.5 -49.6 55.6 4.8 127 20 B A < - 0 0 14 -3,-0.8 3,-0.1 -4,-0.4 -3,-0.1 -0.230 37.4-169.4 -67.9 149.0 -50.9 52.1 4.0 128 21 B D + 0 0 141 1,-0.1 2,-0.3 63,-0.0 -1,-0.1 0.691 69.5 22.1-102.0 -29.1 -54.1 50.8 5.6 129 22 B N S > S- 0 0 70 62,-0.1 4,-1.3 1,-0.1 -1,-0.1 -0.900 78.2-106.9-140.4 167.0 -53.9 47.1 4.6 130 23 B A H > S+ 0 0 24 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.810 112.6 59.1 -68.8 -33.4 -51.3 44.4 3.5 131 24 B A H > S+ 0 0 68 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.937 103.5 54.2 -61.8 -43.1 -52.3 44.3 -0.2 132 25 B Q H > S+ 0 0 71 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.924 112.7 42.8 -52.2 -47.3 -51.5 48.0 -0.4 133 26 B V H X S+ 0 0 0 -4,-1.3 4,-3.1 2,-0.2 5,-0.2 0.939 113.7 50.2 -69.1 -51.9 -48.0 47.3 1.0 134 27 B K H X S+ 0 0 93 -4,-3.1 4,-2.9 2,-0.2 -1,-0.2 0.917 112.0 49.5 -40.7 -52.3 -47.4 44.1 -1.1 135 28 B D H X S+ 0 0 87 -4,-2.9 4,-2.1 -5,-0.2 -2,-0.2 0.942 112.8 45.9 -68.9 -38.3 -48.4 46.1 -4.2 136 29 B A H X S+ 0 0 1 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.901 112.8 50.2 -66.5 -45.3 -46.1 49.0 -3.4 137 30 B L H X S+ 0 0 0 -4,-3.1 4,-2.6 2,-0.2 -2,-0.2 0.924 108.2 53.5 -60.9 -43.0 -43.2 46.6 -2.5 138 31 B T H X S+ 0 0 67 -4,-2.9 4,-2.0 -5,-0.2 -2,-0.2 0.927 109.5 47.4 -57.6 -48.7 -43.7 44.7 -5.8 139 32 B K H X S+ 0 0 98 -4,-2.1 4,-2.0 1,-0.2 5,-0.2 0.965 110.6 53.3 -55.0 -48.3 -43.5 48.0 -7.8 140 33 B M H X S+ 0 0 2 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.891 106.4 53.0 -56.9 -39.9 -40.4 48.9 -5.8 141 34 B R H X S+ 0 0 45 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.927 108.0 48.9 -61.1 -48.8 -38.8 45.6 -6.7 142 35 B A H X S+ 0 0 67 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.857 114.1 47.2 -58.9 -36.5 -39.4 46.1 -10.4 143 36 B A H X S+ 0 0 4 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.880 108.7 53.4 -81.2 -34.7 -37.9 49.5 -10.2 144 37 B A H X S+ 0 0 0 -4,-3.0 4,-2.2 -5,-0.2 -2,-0.2 0.970 110.7 48.1 -56.6 -47.7 -34.9 48.4 -8.2 145 38 B L H < S+ 0 0 37 -4,-2.7 4,-0.4 2,-0.2 -2,-0.2 0.858 112.7 48.6 -67.6 -33.3 -34.2 45.8 -10.9 146 39 B D H >< S+ 0 0 34 -4,-1.7 3,-2.4 -5,-0.2 4,-0.5 0.989 111.6 47.4 -67.1 -60.6 -34.5 48.4 -13.6 147 40 B A H >< S+ 0 0 0 -4,-2.8 3,-1.7 1,-0.3 -2,-0.2 0.809 98.4 72.8 -39.9 -43.8 -32.2 50.9 -11.9 148 41 B Q T 3< S+ 0 0 38 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.750 99.4 46.7 -47.8 -25.6 -29.8 48.1 -11.3 149 42 B K T < S+ 0 0 134 -3,-2.4 -1,-0.3 -4,-0.4 -2,-0.2 0.538 93.9 95.7 -98.3 -17.2 -29.0 48.3 -15.0 150 43 B A < - 0 0 26 -3,-1.7 -41,-0.0 -4,-0.5 107,-0.0 -0.452 68.6-133.5 -75.7 154.8 -28.6 52.0 -15.4 151 44 B T - 0 0 45 -2,-0.1 -41,-0.1 64,-0.1 5,-0.1 -0.947 26.7-130.9-109.9 119.3 -25.3 53.9 -15.3 152 45 B P > - 0 0 4 0, 0.0 3,-2.9 0, 0.0 4,-0.4 -0.450 16.7-117.3 -77.3 140.5 -25.6 56.9 -13.0 153 46 B P G > S+ 0 0 99 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.883 114.9 59.7 -31.6 -50.5 -24.4 60.3 -14.2 154 47 B K G 3 S+ 0 0 130 58,-0.5 3,-0.1 1,-0.3 59,-0.1 0.700 114.4 33.9 -64.1 -15.6 -21.7 60.3 -11.5 155 48 B L G X S+ 0 0 7 -3,-2.9 3,-1.9 57,-0.1 -1,-0.3 0.207 78.8 115.8-123.7 16.4 -20.1 57.1 -12.8 156 49 B E T < S+ 0 0 106 -3,-1.8 -1,-0.1 -4,-0.4 -2,-0.1 0.691 78.8 49.8 -65.4 -24.5 -20.6 57.4 -16.5 157 50 B D T 3 S+ 0 0 133 -4,-0.2 -1,-0.3 -3,-0.1 2,-0.3 0.221 94.7 98.6 -98.9 10.4 -16.8 57.6 -17.2 158 51 B K S < S- 0 0 76 -3,-1.9 -3,-0.1 1,-0.1 0, 0.0 -0.743 80.9 -99.9-104.4 153.1 -16.0 54.5 -15.1 159 52 B S > - 0 0 33 -2,-0.3 3,-3.0 1,-0.1 6,-0.4 -0.377 25.1-127.1 -70.1 137.2 -15.4 50.9 -16.2 160 53 B P T 3 S+ 0 0 54 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.817 115.2 52.9 -50.1 -23.7 -18.4 48.5 -15.7 161 54 B D T 3 S+ 0 0 60 4,-0.1 -2,-0.1 5,-0.1 -123,-0.1 0.312 87.5 119.6 -87.8 -11.5 -15.8 46.4 -13.8 162 55 B S S <> S- 0 0 12 -3,-3.0 4,-2.4 1,-0.1 5,-0.2 -0.264 76.9-113.7 -72.2 159.1 -14.8 49.2 -11.5 163 56 B P H > S+ 0 0 66 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.882 116.7 50.1 -50.9 -44.5 -15.0 49.2 -7.7 164 57 B E H > S+ 0 0 65 2,-0.2 4,-3.1 1,-0.2 5,-0.1 0.933 110.2 45.9 -61.8 -56.7 -17.6 52.0 -8.0 165 58 B M H > S+ 0 0 29 -6,-0.4 4,-2.6 2,-0.2 5,-0.2 0.931 114.3 49.9 -53.8 -44.0 -19.9 50.5 -10.5 166 59 B C H X S+ 0 0 7 -4,-2.4 4,-2.2 2,-0.2 -96,-0.2 0.906 110.6 49.1 -67.4 -39.3 -19.8 47.2 -8.7 167 60 B D H X S+ 0 0 39 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.965 108.7 54.8 -61.2 -49.3 -20.6 48.9 -5.4 168 61 B F H X S+ 0 0 10 -4,-3.1 4,-1.2 1,-0.2 3,-0.4 0.930 110.3 44.8 -44.0 -54.4 -23.5 50.7 -7.2 169 62 B A H X S+ 0 0 23 -4,-2.6 4,-1.8 1,-0.3 -1,-0.2 0.864 109.2 57.0 -69.3 -29.4 -24.9 47.4 -8.3 170 63 B A H X S+ 0 0 6 -4,-2.2 4,-2.7 -104,-0.3 -1,-0.3 0.859 98.3 61.5 -64.9 -37.1 -24.4 45.9 -4.8 171 64 B G H X S+ 0 0 17 -4,-2.3 4,-2.1 -3,-0.4 -1,-0.2 0.918 108.0 43.0 -55.6 -43.4 -26.5 48.7 -3.4 172 65 B F H X S+ 0 0 9 -4,-1.2 4,-3.1 2,-0.2 5,-0.3 0.833 108.5 59.2 -71.8 -32.4 -29.5 47.5 -5.4 173 66 B A H X S+ 0 0 10 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.954 110.5 42.1 -61.8 -44.8 -28.7 43.9 -4.6 174 67 B I H X S+ 0 0 80 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.889 113.3 53.1 -67.6 -40.8 -29.1 44.7 -0.9 175 68 B L H X S+ 0 0 9 -4,-2.1 4,-3.3 -5,-0.2 -2,-0.2 0.955 110.2 47.0 -58.7 -51.1 -32.2 46.8 -1.6 176 69 B V H X S+ 0 0 10 -4,-3.1 4,-3.0 1,-0.2 -2,-0.2 0.936 111.0 52.8 -57.0 -44.9 -33.9 44.0 -3.5 177 70 B G H X S+ 0 0 30 -4,-2.3 4,-1.6 -5,-0.3 -1,-0.2 0.883 111.6 46.4 -56.6 -37.3 -32.9 41.6 -0.7 178 71 B Q H X S+ 0 0 46 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.919 109.7 52.2 -78.7 -40.0 -34.5 44.0 1.8 179 72 B I H X S+ 0 0 0 -4,-3.3 4,-3.0 1,-0.2 -2,-0.2 0.935 108.3 53.7 -54.2 -42.4 -37.6 44.5 -0.3 180 73 B D H X S+ 0 0 52 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.875 106.4 50.8 -64.6 -37.5 -37.9 40.7 -0.4 181 74 B D H X S+ 0 0 110 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.887 112.2 47.7 -65.4 -37.0 -37.7 40.5 3.4 182 75 B A H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.882 107.9 55.4 -74.4 -34.8 -40.5 43.1 3.6 183 76 B L H X S+ 0 0 20 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.860 103.1 55.9 -59.7 -41.9 -42.5 41.1 1.0 184 77 B K H X S+ 0 0 129 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.974 110.5 44.3 -54.1 -53.1 -42.4 38.0 3.2 185 78 B L H <>S+ 0 0 37 -4,-1.5 5,-1.9 1,-0.2 -2,-0.2 0.885 112.6 52.8 -59.9 -39.5 -43.9 39.9 6.1 186 79 B A H ><5S+ 0 0 5 -4,-2.3 3,-1.5 1,-0.2 -1,-0.2 0.905 108.3 49.2 -66.7 -41.8 -46.5 41.5 3.8 187 80 B N H 3<5S+ 0 0 102 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.845 106.2 57.3 -64.1 -31.7 -47.6 38.1 2.4 188 81 B E T 3<5S- 0 0 96 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.401 117.8-117.6 -78.1 2.4 -47.9 36.9 6.0 189 82 B G T < 5 + 0 0 46 -3,-1.5 2,-1.8 1,-0.2 -3,-0.2 0.500 68.7 142.1 74.3 7.2 -50.3 39.8 6.6 190 83 B K >< + 0 0 90 -5,-1.9 4,-2.0 1,-0.2 5,-0.2 -0.518 21.7 173.2 -80.7 80.2 -48.0 41.5 9.1 191 84 B V H > S+ 0 0 38 -2,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.893 72.1 45.1 -56.2 -56.9 -48.7 45.1 8.1 192 85 B K H > S+ 0 0 180 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.902 113.5 52.2 -61.8 -32.4 -46.8 47.0 10.9 193 86 B E H > S+ 0 0 100 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.876 109.3 47.8 -71.3 -38.7 -43.8 44.7 10.6 194 87 B A H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.852 109.1 54.5 -74.4 -31.9 -43.5 45.2 6.8 195 88 B Q H X S+ 0 0 43 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.922 108.3 49.5 -62.0 -42.7 -43.8 48.9 7.3 196 89 B A H >X S+ 0 0 59 -4,-2.2 4,-1.5 1,-0.2 3,-0.5 0.965 109.0 52.6 -60.2 -48.0 -40.9 48.7 9.8 197 90 B A H 3X S+ 0 0 20 -4,-2.4 4,-0.8 1,-0.3 -1,-0.2 0.844 107.0 52.2 -56.5 -39.7 -39.0 46.7 7.2 198 91 B A H 3X S+ 0 0 2 -4,-2.0 4,-0.6 1,-0.2 3,-0.5 0.848 103.3 57.4 -67.2 -35.5 -39.5 49.4 4.6 199 92 B E H X< S+ 0 0 87 -4,-1.8 3,-0.9 -3,-0.5 4,-0.4 0.858 99.3 60.8 -60.7 -34.0 -38.3 52.0 6.9 200 93 B Q H >X S+ 0 0 120 -4,-1.5 3,-0.9 1,-0.2 4,-0.7 0.806 89.9 70.9 -64.5 -33.2 -35.0 50.0 7.1 201 94 B L H >X S+ 0 0 0 -4,-0.8 4,-2.1 -3,-0.5 3,-1.1 0.876 81.5 74.5 -41.0 -46.7 -34.7 50.5 3.4 202 95 B K H S+ 0 0 92 -3,-0.9 4,-3.0 -4,-0.4 -1,-0.3 0.923 110.3 45.0 -58.8 -41.9 -30.3 53.5 5.2 204 97 B T H - 0 0 49 1,-0.1 4,-2.5 41,-0.0 5,-0.2 -0.326 360.0-102.9 -94.8 169.7 -30.7 57.8 -22.4 217 3 C L H > S+ 0 0 37 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.901 117.3 51.2 -57.7 -50.0 -32.1 56.6 -25.8 218 4 C E H > S+ 0 0 146 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.925 112.2 47.1 -56.9 -44.3 -33.8 59.9 -26.7 219 5 C D H > S+ 0 0 82 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.931 113.3 48.7 -63.7 -44.5 -30.6 61.9 -26.0 220 6 C N H X S+ 0 0 10 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.919 110.3 51.0 -61.9 -40.0 -28.5 59.5 -28.0 221 7 C M H X S+ 0 0 53 -4,-3.1 4,-2.5 1,-0.3 -1,-0.2 0.893 108.3 52.9 -68.8 -35.9 -30.9 59.6 -30.9 222 8 C E H X S+ 0 0 119 -4,-2.4 4,-2.9 -5,-0.2 -1,-0.3 0.887 108.6 49.7 -59.5 -43.6 -30.8 63.3 -30.8 223 9 C T H X S+ 0 0 46 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.947 110.0 51.4 -64.8 -44.1 -27.0 63.2 -31.0 224 10 C L H X S+ 0 0 17 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.935 114.8 43.1 -51.8 -50.2 -27.3 60.8 -33.9 225 11 C N H X S+ 0 0 89 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.886 114.0 48.2 -69.6 -43.4 -29.6 63.1 -35.8 226 12 C D H X S+ 0 0 80 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.955 114.0 46.4 -63.2 -47.8 -27.8 66.4 -35.0 227 13 C N H X S+ 0 0 13 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.791 106.1 58.6 -71.2 -27.7 -24.4 65.1 -36.1 228 14 C L H X S+ 0 0 13 -4,-1.7 4,-1.6 -5,-0.3 -1,-0.2 0.946 109.2 46.2 -62.1 -41.0 -25.9 63.5 -39.2 229 15 C K H X S+ 0 0 110 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.905 108.2 55.2 -65.8 -47.3 -27.0 67.0 -40.2 230 16 C V H X S+ 0 0 64 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.922 107.3 52.4 -48.2 -45.0 -23.6 68.5 -39.2 231 17 C I H >< S+ 0 0 1 -4,-2.3 3,-0.7 1,-0.2 -1,-0.2 0.867 106.2 51.1 -65.5 -36.8 -22.1 66.0 -41.6 232 18 C E H 3< S+ 0 0 83 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.897 118.3 38.9 -69.4 -29.3 -24.3 67.0 -44.5 233 19 C K H 3< S+ 0 0 171 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.388 89.1 133.0 -93.7 -4.6 -23.4 70.7 -44.0 234 20 C A << - 0 0 16 -3,-0.7 3,-0.1 -4,-0.6 -3,-0.1 -0.193 38.7-167.9 -65.9 149.1 -19.7 70.1 -43.2 235 21 C D + 0 0 142 1,-0.1 2,-0.3 63,-0.0 -1,-0.1 0.682 69.6 24.1-101.4 -29.3 -16.9 72.2 -44.8 236 22 C N S > S- 0 0 69 62,-0.1 4,-1.3 1,-0.1 -1,-0.1 -0.891 78.5-106.5-139.8 169.2 -13.9 70.2 -43.8 237 23 C A H > S+ 0 0 23 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.830 112.5 57.6 -72.1 -33.6 -12.8 66.7 -42.8 238 24 C A H > S+ 0 0 68 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.950 103.2 55.5 -59.6 -48.8 -12.2 67.4 -39.0 239 25 C Q H > S+ 0 0 72 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.922 112.5 42.7 -46.4 -47.0 -15.8 68.6 -38.8 240 26 C V H X S+ 0 0 1 -4,-1.3 4,-3.1 2,-0.2 5,-0.3 0.957 113.2 50.1 -73.5 -50.3 -16.9 65.2 -40.2 241 27 C K H X S+ 0 0 92 -4,-2.9 4,-2.9 2,-0.2 -1,-0.2 0.923 112.1 50.4 -40.5 -52.5 -14.5 63.1 -38.1 242 28 C D H X S+ 0 0 89 -4,-3.3 4,-2.0 1,-0.2 -2,-0.2 0.931 112.6 44.9 -66.3 -40.5 -15.7 65.0 -35.0 243 29 C A H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 0.883 113.2 50.6 -65.7 -43.4 -19.4 64.4 -35.8 244 30 C L H X S+ 0 0 0 -4,-3.1 4,-2.6 2,-0.2 -2,-0.2 0.939 108.2 53.2 -63.5 -41.9 -18.8 60.7 -36.7 245 31 C T H X S+ 0 0 68 -4,-2.9 4,-1.9 -5,-0.3 -2,-0.2 0.908 109.8 47.1 -59.1 -45.9 -16.9 60.2 -33.4 246 32 C K H X S+ 0 0 97 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.962 110.8 53.2 -58.6 -48.8 -19.8 61.7 -31.4 247 33 C M H X S+ 0 0 3 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.892 106.7 53.1 -52.8 -40.7 -22.2 59.5 -33.4 248 34 C R H X S+ 0 0 44 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.925 107.6 49.3 -63.9 -44.9 -20.1 56.4 -32.5 249 35 C A H X S+ 0 0 65 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.880 113.8 47.4 -63.0 -35.0 -20.2 57.2 -28.8 250 36 C A H X S+ 0 0 4 -4,-2.1 4,-3.2 2,-0.2 5,-0.3 0.901 108.3 53.8 -77.3 -39.1 -24.0 57.6 -29.0 251 37 C A H X S+ 0 0 0 -4,-3.0 4,-2.2 -5,-0.2 -2,-0.2 0.962 111.0 47.1 -54.2 -47.8 -24.5 54.4 -31.0 252 38 C L H < S+ 0 0 39 -4,-2.5 4,-0.3 2,-0.2 -2,-0.2 0.860 113.4 48.9 -67.1 -34.6 -22.6 52.4 -28.3 253 39 C D H >< S+ 0 0 36 -4,-1.8 3,-2.2 -5,-0.2 4,-0.5 0.984 111.7 46.8 -67.3 -56.6 -24.6 54.1 -25.6 254 40 C A H >< S+ 0 0 0 -4,-3.2 3,-1.6 1,-0.3 -2,-0.2 0.817 98.4 73.0 -47.0 -40.0 -28.0 53.4 -27.3 255 41 C Q T 3< S+ 0 0 40 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.717 99.1 47.8 -49.4 -23.0 -26.8 49.8 -27.9 256 42 C K T < S+ 0 0 135 -3,-2.2 -1,-0.3 -4,-0.3 -2,-0.2 0.562 93.5 94.2-100.3 -17.5 -27.3 49.3 -24.1 257 43 C A < - 0 0 26 -3,-1.6 -41,-0.0 -4,-0.5 -107,-0.0 -0.485 69.2-133.5 -76.6 152.3 -30.8 50.8 -23.8 258 44 C T - 0 0 45 -2,-0.2 -41,-0.1 -150,-0.1 5,-0.1 -0.933 26.7-130.5-107.4 118.0 -34.0 48.9 -23.9 259 45 C P > - 0 0 5 0, 0.0 3,-2.8 0, 0.0 4,-0.3 -0.421 17.1-117.0 -73.7 139.1 -36.5 50.6 -26.2 260 46 C P G > S+ 0 0 100 0, 0.0 3,-2.1 0, 0.0 4,-0.3 0.884 114.3 60.7 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0.944 110.7 42.2 -60.1 -42.5 -23.7 46.8 -34.6 281 67 C I H X S+ 0 0 78 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.864 113.1 53.4 -70.1 -38.5 -24.2 47.5 -38.3 282 68 C L H X S+ 0 0 9 -4,-1.8 4,-3.0 -5,-0.2 3,-0.2 0.973 109.9 46.9 -61.5 -51.0 -24.5 51.2 -37.6 283 69 C V H X S+ 0 0 10 -4,-3.3 4,-3.0 1,-0.3 -2,-0.2 0.935 110.8 53.4 -56.3 -46.5 -21.2 51.4 -35.7 284 70 C G H X S+ 0 0 30 -4,-2.3 4,-1.7 -5,-0.3 -1,-0.3 0.903 111.0 46.7 -51.0 -42.8 -19.6 49.3 -38.5 285 71 C Q H X S+ 0 0 48 -4,-2.0 4,-2.0 -3,-0.2 -2,-0.2 0.918 109.6 52.0 -76.3 -40.6 -20.8 51.9 -41.0 286 72 C I H X S+ 0 0 0 -4,-3.0 4,-3.1 1,-0.2 -1,-0.2 0.930 107.9 54.1 -53.0 -44.8 -19.7 54.8 -38.9 287 73 C D H X S+ 0 0 52 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.880 106.7 50.2 -61.4 -39.0 -16.3 53.1 -38.8 288 74 C D H X S+ 0 0 109 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.877 112.2 48.2 -65.2 -37.0 -16.2 52.9 -42.6 289 75 C A H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.893 108.1 54.7 -72.9 -36.3 -17.1 56.6 -42.7 290 76 C L H X S+ 0 0 21 -4,-3.1 4,-2.9 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1,-0.1 4,-2.5 -321,-0.0 3,-0.4 -0.588 360.0-101.6-105.0 164.0 -16.6 28.2 -22.4 324 3 D L H > S+ 0 0 36 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.849 117.1 50.1 -48.7 -54.7 -15.5 29.9 -25.6 325 4 D E H > S+ 0 0 146 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.923 112.4 47.7 -52.7 -45.9 -13.8 26.9 -27.3 326 5 D D H > S+ 0 0 80 -3,-0.4 4,-2.5 1,-0.2 -2,-0.2 0.955 111.1 51.4 -65.7 -45.6 -16.8 24.6 -26.6 327 6 D N H X S+ 0 0 12 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.852 109.8 49.6 -53.1 -42.1 -19.2 27.2 -28.0 328 7 D M H X S+ 0 0 56 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.865 108.0 53.4 -74.0 -33.5 -17.1 27.6 -31.2 329 8 D E H X S+ 0 0 118 -4,-2.2 4,-3.3 2,-0.2 5,-0.3 0.941 108.8 50.0 -59.1 -47.2 -17.1 23.8 -31.6 330 9 D T H X S+ 0 0 45 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.973 110.9 48.6 -57.3 -56.2 -20.9 23.8 -31.4 331 10 D L H X S+ 0 0 17 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.878 116.0 45.3 -43.7 -46.0 -21.1 26.6 -34.0 332 11 D N H X S+ 0 0 88 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.923 113.6 45.6 -75.6 -46.0 -18.7 24.7 -36.2 333 12 D D H X S+ 0 0 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D N S > S- 0 0 68 62,-0.1 4,-1.1 1,-0.0 -1,-0.2 -0.877 79.9-103.0-134.2 175.1 -35.1 17.8 -43.6 344 23 D A H > S+ 0 0 26 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.762 113.5 59.0 -72.8 -30.8 -36.1 21.1 -41.9 345 24 D A H > S+ 0 0 66 2,-0.2 4,-3.8 1,-0.2 5,-0.2 0.949 102.2 54.4 -63.2 -48.8 -36.2 19.8 -38.3 346 25 D Q H > S+ 0 0 72 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.889 113.8 42.8 -47.8 -43.9 -32.5 18.8 -38.5 347 26 D V H X S+ 0 0 0 -4,-1.1 4,-3.1 2,-0.2 5,-0.3 0.977 114.0 48.6 -71.7 -62.2 -31.7 22.4 -39.6 348 27 D K H X S+ 0 0 91 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.900 112.9 51.0 -28.4 -58.5 -34.0 24.0 -37.1 349 28 D D H X S+ 0 0 87 -4,-3.8 4,-1.7 1,-0.2 -2,-0.2 0.948 112.5 44.4 -59.6 -43.3 -32.4 21.8 -34.4 350 29 D A H X S+ 0 0 2 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.853 112.4 51.3 -74.0 -34.3 -28.9 22.7 -35.4 351 30 D L H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 -1,-0.2 0.890 107.5 53.6 -67.4 -39.3 -29.7 26.5 -35.7 352 31 D T H X S+ 0 0 68 -4,-2.5 4,-2.1 -5,-0.3 -2,-0.2 0.899 109.7 48.2 -63.0 -38.2 -31.2 26.4 -32.2 353 32 D K H X S+ 0 0 101 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.967 111.0 50.6 -68.5 -45.2 -28.0 24.9 -30.9 354 33 D M H X S+ 0 0 2 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.880 107.8 54.3 -53.0 -43.2 -25.9 27.5 -32.7 355 34 D R H X S+ 0 0 36 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.960 106.9 49.5 -62.1 -46.7 -28.1 30.2 -31.2 356 35 D A H X S+ 0 0 65 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.890 113.6 47.7 -61.0 -38.1 -27.6 29.0 -27.6 357 36 D A H X S+ 0 0 5 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.895 109.3 51.5 -68.9 -42.9 -23.8 28.9 -28.3 358 37 D A H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.912 110.3 49.7 -62.7 -39.1 -23.7 32.4 -29.9 359 38 D L H < S+ 0 0 20 -4,-2.5 4,-0.4 -5,-0.2 -1,-0.2 0.885 112.8 47.8 -68.1 -33.5 -25.5 33.9 -26.9 360 39 D D H >< S+ 0 0 32 -4,-1.6 3,-2.1 -5,-0.3 4,-0.4 0.966 112.0 47.3 -70.0 -49.1 -23.1 32.1 -24.5 361 40 D A H >< S+ 0 0 0 -4,-3.0 3,-1.6 1,-0.3 -2,-0.2 0.831 99.1 70.6 -62.8 -30.7 -19.9 33.2 -26.4 362 41 D Q T 3< S+ 0 0 56 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.743 98.7 50.6 -57.0 -21.3 -21.3 36.7 -26.5 363 42 D K T < S+ 0 0 69 -3,-2.1 -1,-0.3 -4,-0.4 -2,-0.2 0.608 96.5 93.7 -89.2 -11.9 -20.7 36.8 -22.7 364 43 D A < - 0 0 24 -3,-1.6 -41,-0.0 -4,-0.4 19,-0.0 -0.246 68.4-130.9 -86.8 164.9 -17.0 35.6 -22.9 365 44 D T - 0 0 45 -364,-0.1 -41,-0.1 17,-0.0 5,-0.1 -0.967 27.3-137.6-109.9 119.0 -13.7 37.4 -23.0 366 45 D P > - 0 0 4 0, 0.0 3,-2.5 0, 0.0 4,-0.4 -0.481 21.4-113.5 -73.1 145.0 -11.4 36.0 -25.8 367 46 D P G > S+ 0 0 100 0, 0.0 3,-1.8 0, 0.0 4,-0.3 0.872 115.3 59.5 -37.5 -49.9 -7.7 35.4 -25.0 368 47 D K G 3 S+ 0 0 127 58,-0.5 3,-0.2 1,-0.3 59,-0.1 0.698 112.8 36.8 -59.4 -21.3 -6.8 38.1 -27.5 369 48 D L G X S+ 0 0 7 -3,-2.5 3,-2.0 57,-0.1 -1,-0.3 0.236 78.5 116.3-117.4 13.1 -8.7 40.8 -25.6 370 49 D E T < S+ 0 0 140 -3,-1.8 -1,-0.1 -4,-0.4 -2,-0.1 0.738 76.7 50.4 -67.6 -24.7 -8.1 39.7 -22.0 371 50 D D T 3 S+ 0 0 132 -4,-0.3 2,-0.3 -3,-0.2 -1,-0.3 0.128 93.9 103.6 -94.6 15.8 -6.2 42.8 -21.0 372 51 D K S < S- 0 0 81 -3,-2.0 -3,-0.1 4,-0.0 -4,-0.0 -0.784 79.9-103.0-106.8 144.4 -8.9 45.1 -22.4 373 52 D S > - 0 0 50 -2,-0.3 3,-3.7 1,-0.2 6,-0.4 -0.457 25.7-128.4 -58.9 130.1 -11.6 47.2 -20.6 374 53 D P T 3 S+ 0 0 46 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.675 114.9 56.8 -45.4 -22.5 -15.1 45.5 -20.8 375 54 D D T 3 S+ 0 0 75 4,-0.1 -2,-0.1 5,-0.0 5,-0.0 0.501 85.5 118.9 -82.4 -20.2 -15.9 49.0 -22.0 376 55 D S S <> S- 0 0 12 -3,-3.7 4,-2.5 1,-0.1 5,-0.3 -0.090 76.3-116.8 -69.1 157.4 -13.4 49.1 -24.8 377 56 D P H > S+ 0 0 76 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.903 116.8 53.5 -50.4 -37.6 -14.1 49.5 -28.5 378 57 D E H > S+ 0 0 68 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.928 109.5 44.1 -67.8 -51.4 -12.7 46.0 -29.0 379 58 D M H > S+ 0 0 24 -6,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.865 114.2 50.0 -61.0 -43.3 -14.9 44.2 -26.5 380 59 D C H X S+ 0 0 31 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.929 110.9 50.2 -59.2 -45.8 -18.0 46.0 -27.7 381 60 D D H X S+ 0 0 37 -4,-2.4 4,-2.1 -5,-0.3 3,-0.3 0.949 108.1 54.2 -60.2 -45.2 -17.1 45.1 -31.2 382 61 D F H >X S+ 0 0 9 -4,-2.8 4,-1.0 1,-0.3 3,-0.5 0.939 110.6 44.0 -48.7 -62.5 -16.7 41.5 -30.1 383 62 D A H 3X S+ 0 0 31 -4,-2.2 4,-1.7 1,-0.2 -1,-0.3 0.771 108.9 59.2 -56.8 -30.7 -20.1 41.2 -28.6 384 63 D A H 3X S+ 0 0 8 -4,-1.8 4,-2.7 -3,-0.3 5,-0.2 0.898 96.1 61.9 -67.9 -38.7 -21.6 43.0 -31.6 385 64 D G H S+ 0 0 34 -4,-1.6 5,-2.4 1,-0.2 -2,-0.2 0.916 112.9 49.5 -66.3 -42.1 -36.8 30.1 -43.3 400 79 D A H ><5S+ 0 0 5 -4,-2.3 3,-2.0 1,-0.2 -2,-0.2 0.896 107.3 53.6 -64.3 -44.3 -36.5 26.7 -41.6 401 80 D N H 3<5S+ 0 0 101 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.867 107.3 52.4 -58.9 -35.3 -39.8 27.1 -39.7 402 81 D E T 3<5S- 0 0 97 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.326 119.5-118.9 -77.5 3.5 -41.4 27.8 -43.1 403 82 D G T < 5 + 0 0 44 -3,-2.0 2,-1.7 1,-0.2 -3,-0.2 0.637 66.3 144.7 66.7 18.2 -39.8 24.6 -44.3 404 83 D K >< + 0 0 91 -5,-2.4 4,-2.1 1,-0.2 3,-0.3 -0.564 20.8 173.6 -84.5 78.8 -37.7 26.3 -46.9 405 84 D V H > S+ 0 0 35 -2,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.898 70.9 46.8 -59.5 -49.9 -34.7 23.9 -46.5 406 85 D K H > S+ 0 0 176 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.855 113.7 48.9 -62.9 -37.1 -32.5 25.1 -49.3 407 86 D E H > S+ 0 0 102 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.851 111.0 49.7 -71.7 -35.5 -33.0 28.8 -48.5 408 87 D A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.866 110.4 51.6 -70.0 -35.1 -32.2 28.1 -44.8 409 88 D Q H X S+ 0 0 45 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.922 110.3 48.3 -65.0 -43.6 -29.1 26.3 -46.0 410 89 D A H X S+ 0 0 57 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.926 110.0 52.6 -57.6 -47.6 -28.1 29.3 -48.1 411 90 D A H X S+ 0 0 22 -4,-2.5 4,-1.0 1,-0.2 3,-0.3 0.890 107.3 51.8 -56.4 -42.2 -28.7 31.6 -45.1 412 91 D A H X S+ 0 0 1 -4,-2.0 4,-0.5 1,-0.2 3,-0.4 0.854 103.7 57.4 -69.1 -33.3 -26.4 29.5 -42.9 413 92 D E H >< S+ 0 0 84 -4,-1.8 3,-1.1 1,-0.2 4,-0.3 0.849 100.7 58.4 -59.6 -35.9 -23.7 29.7 -45.5 414 93 D Q H >X S+ 0 0 118 -4,-1.4 3,-1.2 -3,-0.3 4,-0.7 0.813 89.2 73.8 -65.8 -31.3 -23.9 33.5 -45.2 415 94 D L H >X S+ 0 0 0 -4,-1.0 4,-1.9 -3,-0.4 3,-1.0 0.845 81.4 74.0 -42.7 -40.1 -23.1 33.1 -41.5 416 95 D K H S+ 0 0 88 -3,-1.2 4,-3.3 -4,-0.3 -1,-0.3 0.915 108.7 46.0 -60.4 -37.1 -18.6 35.9 -43.5 418 97 D T H