==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 01-MAY-08 3D0I . COMPND 2 MOLECULE: ANGIOTENSIN-CONVERTING ENZYME 2; . SOURCE 2 ORGANISM_SCIENTIFIC: PAGUMA LARVATA, HOMO SAPIENS; . AUTHOR F.LI . 1540 6 10 8 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 66846.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1040 67.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 92 6.0 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 . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 72 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 204 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 589 38.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 31 2.0 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 7 1 6 4 0 3 3 3 0 4 3 0 1 1 2 4 2 0 2 0 0 1 1 0 0 0 4 RESIDUES PER ALPHA HELIX . 7 2 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 . 8 0 2 4 2 2 0 2 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 . 6 2 0 0 0 2 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 19 A S 0 0 92 0, 0.0 1330,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -7.7 29.5 -30.6 106.1 2 20 A T > - 0 0 89 1,-0.1 4,-1.6 4,-0.0 5,-0.2 -0.071 360.0 -95.6 -68.3 177.8 31.5 -30.4 102.8 3 21 A T H > S+ 0 0 39 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.776 126.3 57.6 -69.5 -24.3 35.3 -29.5 102.9 4 22 A E H > S+ 0 0 28 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.920 107.1 46.0 -67.4 -45.7 34.3 -25.8 102.2 5 23 A E H > S+ 0 0 74 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.855 110.3 52.1 -68.2 -37.3 32.1 -25.7 105.4 6 24 A L H X S+ 0 0 31 -4,-1.6 4,-0.6 1,-0.2 -1,-0.2 0.786 110.5 51.3 -68.0 -28.7 34.7 -27.4 107.6 7 25 A A H X S+ 0 0 1 -4,-0.9 4,-2.8 2,-0.2 5,-0.2 0.891 107.3 50.9 -73.9 -45.1 37.2 -24.8 106.4 8 26 A K H X S+ 0 0 79 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.924 110.5 48.5 -58.4 -48.8 34.9 -21.8 107.1 9 27 A T H X S+ 0 0 16 -4,-2.1 4,-1.2 2,-0.2 -1,-0.2 0.764 112.3 53.1 -65.0 -23.4 34.4 -23.0 110.7 10 28 A F H X S+ 0 0 7 -4,-0.6 4,-1.9 2,-0.2 3,-0.5 0.969 109.3 43.3 -74.5 -57.6 38.1 -23.4 110.9 11 29 A L H X S+ 0 0 5 -4,-2.8 4,-3.1 1,-0.2 5,-0.2 0.858 108.7 62.3 -54.7 -37.9 39.1 -19.9 109.8 12 30 A E H X S+ 0 0 72 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.918 106.6 43.4 -53.2 -46.9 36.4 -18.6 112.1 13 31 A T H X S+ 0 0 24 -4,-1.2 4,-1.8 -3,-0.5 -1,-0.2 0.836 112.8 54.8 -67.7 -33.7 38.2 -20.1 115.0 14 32 A F H X S+ 0 0 1 -4,-1.9 4,-4.1 2,-0.2 5,-0.3 0.975 104.6 51.0 -63.9 -56.5 41.5 -18.8 113.7 15 33 A N H X S+ 0 0 26 -4,-3.1 4,-2.6 1,-0.2 -2,-0.2 0.911 112.5 45.9 -47.5 -52.3 40.4 -15.2 113.4 16 34 A Y H X S+ 0 0 41 -4,-1.6 4,-1.0 -5,-0.2 -1,-0.2 0.859 118.7 42.4 -63.2 -36.0 39.1 -15.1 117.0 17 35 A E H X S+ 0 0 53 -4,-1.8 4,-2.3 -3,-0.2 5,-0.3 0.893 112.9 51.3 -78.6 -39.8 42.3 -16.8 118.3 18 36 A A H X S+ 0 0 0 -4,-4.1 4,-3.7 1,-0.2 5,-0.4 0.969 105.1 58.5 -57.3 -51.1 44.7 -14.9 116.2 19 37 A Q H X S+ 0 0 24 -4,-2.6 4,-1.7 -5,-0.3 -1,-0.2 0.828 109.6 43.2 -49.4 -39.8 43.1 -11.6 117.4 20 38 A E H X S+ 0 0 8 -4,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.951 119.7 39.0 -74.7 -50.5 43.8 -12.4 121.0 21 39 A L H X S+ 0 0 21 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.932 116.8 51.2 -66.9 -43.6 47.4 -13.7 120.7 22 40 A S H X S+ 0 0 19 -4,-3.7 4,-2.6 -5,-0.3 5,-0.2 0.926 109.8 50.2 -56.5 -49.3 48.3 -11.2 118.0 23 41 A Y H X S+ 0 0 0 -4,-1.7 4,-2.7 -5,-0.4 5,-0.3 0.922 109.7 50.9 -57.4 -44.8 47.0 -8.3 120.2 24 42 A Q H X S+ 0 0 58 -4,-2.1 4,-1.0 1,-0.2 -1,-0.2 0.850 111.0 50.1 -60.7 -34.6 49.1 -9.7 123.2 25 43 A S H X S+ 0 0 16 -4,-2.0 4,-3.5 22,-0.2 -2,-0.2 0.930 112.9 43.6 -69.5 -49.9 52.2 -9.8 121.0 26 44 A S H X S+ 0 0 24 -4,-2.6 4,-3.9 307,-0.3 5,-0.3 0.930 111.0 52.9 -62.4 -48.0 51.8 -6.2 119.7 27 45 A V H X S+ 0 0 21 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.857 115.0 46.5 -57.3 -32.3 51.0 -4.8 123.1 28 46 A A H X S+ 0 0 12 -4,-1.0 4,-2.1 -5,-0.3 16,-0.3 0.982 111.7 46.0 -70.7 -62.7 54.2 -6.6 124.1 29 47 A S H X S+ 0 0 32 -4,-3.5 4,-2.4 1,-0.2 -2,-0.2 0.880 116.9 48.9 -46.6 -42.2 56.4 -5.4 121.2 30 48 A W H X S+ 0 0 11 -4,-3.9 4,-2.7 2,-0.2 5,-0.4 0.967 105.9 53.2 -63.4 -57.0 55.0 -1.9 121.8 31 49 A N H X S+ 0 0 69 -4,-2.2 4,-1.3 -5,-0.3 6,-0.3 0.837 114.0 45.5 -47.5 -38.7 55.6 -1.8 125.5 32 50 A Y H < S+ 0 0 60 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.939 111.5 49.0 -69.8 -52.4 59.3 -2.8 124.8 33 51 A N H < S+ 0 0 35 -4,-2.4 292,-2.1 1,-0.2 3,-0.2 0.804 119.2 39.9 -62.8 -28.6 59.9 -0.3 122.0 34 52 A T H < S+ 0 0 10 -4,-2.7 2,-0.3 1,-0.3 -1,-0.2 0.695 131.2 25.7 -91.1 -20.8 58.4 2.5 124.1 35 53 A N S < S- 0 0 52 -4,-1.3 2,-2.3 -5,-0.4 -1,-0.3 -0.761 70.6-158.6-145.3 92.9 60.0 1.4 127.4 36 54 A I + 0 0 59 287,-1.7 -4,-0.1 -2,-0.3 -3,-0.1 -0.055 36.2 152.8 -71.6 41.5 63.2 -0.7 127.0 37 55 A T > - 0 0 55 -2,-2.3 4,-1.1 -6,-0.3 -2,-0.1 -0.207 54.4-120.0 -66.3 160.8 63.1 -2.4 130.5 38 56 A E H >> S+ 0 0 143 2,-0.2 4,-1.0 1,-0.2 3,-0.7 0.957 113.6 54.5 -65.3 -53.6 64.6 -5.8 131.1 39 57 A E H >> S+ 0 0 122 1,-0.2 4,-1.8 2,-0.2 3,-0.6 0.854 105.4 57.3 -44.8 -41.7 61.3 -7.4 132.1 40 58 A N H 3> S+ 0 0 13 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.859 94.2 60.9 -63.7 -41.4 59.9 -6.2 128.8 41 59 A V H X S+ 0 0 102 -4,-3.7 4,-1.7 1,-0.2 3,-1.1 0.968 116.8 26.6 -44.4 -71.8 56.8 -14.2 125.7 47 65 A A H 3X S+ 0 0 15 -4,-2.4 4,-2.0 1,-0.3 -22,-0.2 0.764 115.2 69.3 -67.9 -25.2 53.9 -13.3 123.5 48 66 A G H 3> S+ 0 0 16 -5,-0.5 4,-1.0 -4,-0.4 -1,-0.3 0.808 105.8 38.2 -61.8 -31.6 56.2 -13.3 120.5 49 67 A D H < S+ 0 0 59 -4,-2.0 3,-2.1 1,-0.2 -2,-0.2 0.939 109.8 55.5 -70.7 -49.1 46.4 -27.7 110.6 62 80 A A H >< S+ 0 0 0 -4,-4.4 3,-0.9 1,-0.3 -1,-0.2 0.682 96.8 71.1 -55.3 -17.4 45.2 -25.3 107.9 63 81 A Q T 3< S+ 0 0 59 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.863 81.1 70.8 -68.1 -36.0 47.3 -27.6 105.7 64 82 A M T < S+ 0 0 130 -3,-2.1 -1,-0.2 -4,-0.5 -2,-0.1 0.193 85.2 85.0 -71.0 21.0 44.7 -30.3 106.1 65 83 A Y S < S- 0 0 16 -3,-0.9 2,-1.1 -2,-0.2 3,-0.1 -0.989 74.9-137.6-128.3 124.1 42.3 -28.3 103.9 66 84 A P > + 0 0 39 0, 0.0 3,-1.6 0, 0.0 -2,-0.1 -0.661 20.2 179.4 -82.0 93.6 42.3 -28.5 100.0 67 85 A L G > S+ 0 0 28 -2,-1.1 3,-1.1 1,-0.3 9,-0.1 0.736 83.3 65.7 -67.4 -23.0 41.8 -24.9 98.8 68 86 A Q G 3 S+ 0 0 157 1,-0.3 -1,-0.3 -3,-0.1 2,-0.1 0.757 99.2 56.1 -65.5 -24.0 42.0 -26.2 95.3 69 87 A E G < S+ 0 0 107 -3,-1.6 2,-0.4 -66,-0.0 -1,-0.3 -0.292 91.4 103.0-100.5 43.6 38.8 -27.8 96.4 70 88 A I < - 0 0 7 -3,-1.1 2,-0.9 -2,-0.1 6,-0.1 -0.969 52.6-163.4-136.4 123.2 37.2 -24.5 97.3 71 89 A Q + 0 0 153 -2,-0.4 2,-0.2 1,-0.1 -3,-0.1 -0.569 66.2 87.8 -99.4 66.2 34.5 -22.5 95.5 72 90 A N > - 0 0 40 -2,-0.9 4,-1.9 1,-0.1 5,-0.2 -0.651 59.8-154.3-167.0 105.4 35.0 -19.2 97.4 73 91 A L H > S+ 0 0 109 -2,-0.2 4,-1.6 1,-0.2 3,-0.2 0.915 92.8 48.8 -39.2 -69.4 37.5 -16.4 96.5 74 92 A T H >> S+ 0 0 57 1,-0.2 4,-1.5 2,-0.2 3,-1.0 0.901 111.4 45.4 -40.1 -68.9 37.8 -15.0 100.0 75 93 A V H 3> S+ 0 0 12 1,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.843 106.8 58.8 -53.1 -43.1 38.4 -18.1 102.0 76 94 A K H 3X S+ 0 0 76 -4,-1.9 4,-2.6 1,-0.2 -1,-0.3 0.909 105.3 52.1 -51.1 -45.5 41.0 -19.5 99.6 77 95 A L H + 0 0 63 -2,-1.0 4,-1.1 1,-0.2 5,-0.2 0.691 33.5 176.8 -50.3 -18.3 54.8 -24.5 105.2 86 104 A G T >4 - 0 0 20 1,-0.2 3,-0.9 2,-0.2 -1,-0.2 0.019 56.8 -30.8 48.9-148.9 57.3 -21.8 106.3 87 105 A S G >4 S+ 0 0 41 1,-0.2 3,-2.9 2,-0.1 -1,-0.2 0.837 129.0 79.8 -65.1 -33.0 60.8 -22.9 107.3 88 106 A S G 34 S+ 0 0 54 1,-0.3 -1,-0.2 -4,-0.2 -2,-0.2 0.747 71.6 77.6 -46.5 -33.0 59.2 -26.1 108.6 89 107 A V G << S+ 0 0 38 -4,-1.1 -1,-0.3 -3,-0.9 -2,-0.1 0.687 94.4 59.3 -53.8 -19.3 59.1 -27.5 105.0 90 108 A L S < S- 0 0 27 -3,-2.9 2,-0.3 -5,-0.2 -2,-0.0 0.318 100.1 -86.1 -82.8-142.9 62.9 -28.1 105.5 91 109 A S >> - 0 0 47 1,-0.1 4,-3.0 -4,-0.0 5,-0.5 -0.879 38.3 -90.9-130.7 164.7 64.3 -30.4 108.2 92 110 A E H >5S+ 0 0 166 -2,-0.3 4,-1.4 1,-0.2 5,-0.1 0.843 126.9 34.9 -34.6 -54.1 65.3 -30.2 111.9 93 111 A D H >5S+ 0 0 109 2,-0.2 4,-3.6 3,-0.2 5,-0.2 0.919 117.9 50.1 -76.2 -47.5 68.9 -29.2 111.0 94 112 A K H >5S+ 0 0 75 2,-0.2 4,-3.6 1,-0.2 5,-0.2 0.966 115.5 42.9 -54.7 -57.5 68.2 -27.2 107.8 95 113 A S H X5S+ 0 0 23 -4,-3.0 4,-1.7 2,-0.2 -1,-0.2 0.849 116.5 48.8 -58.8 -39.7 65.6 -25.0 109.5 96 114 A K H X -A 119 0A 37 6,-2.0 3,-2.2 3,-0.6 6,-0.2 -0.497 29.6-144.7 -65.3 116.2 90.6 4.1 111.6 117 135 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.829 102.0 36.1 -53.6 -39.6 93.7 2.4 110.1 118 136 A D T 3 S+ 0 0 146 1,-0.2 -2,-0.1 2,-0.0 0, 0.0 -0.164 127.8 39.1-107.5 37.9 96.0 5.2 111.4 119 137 A N E X +A 116 0A 51 -3,-2.2 3,-1.9 3,-0.1 -3,-0.6 -0.164 67.2 174.5-170.8 63.6 94.0 5.6 114.6 120 138 A P E 3 S+ 0 0 101 0, 0.0 3,-0.0 0, 0.0 -2,-0.0 0.579 70.2 74.4 -57.8 -8.7 93.0 2.1 115.6 121 139 A Q E 3 S+ 0 0 173 1,-0.2 2,-0.7 -5,-0.1 -6,-0.0 0.828 89.0 59.4 -73.8 -33.5 91.5 3.5 118.8 122 140 A E E < + 0 0 116 -3,-1.9 -6,-2.0 -6,-0.2 2,-0.3 -0.867 64.2 177.8-108.3 110.3 88.4 5.0 117.2 123 141 A a E -A 115 0A 50 -2,-0.7 2,-0.3 -8,-0.2 -8,-0.3 -0.745 15.4-143.8-103.9 156.7 86.0 2.6 115.4 124 142 A L E -A 114 0A 36 -10,-3.4 -10,-2.1 -2,-0.3 2,-0.3 -0.919 2.4-140.1-124.2 148.4 82.8 3.7 113.7 125 143 A L E > -A 113 0A 70 -2,-0.3 5,-2.5 -12,-0.2 6,-0.4 -0.700 32.1-112.0 -99.1 155.3 79.4 2.0 113.4 126 144 A L T >S+ 0 0 13 -14,-0.7 5,-2.3 -2,-0.3 6,-0.1 0.868 102.9 74.8 -54.8 -35.2 77.4 2.2 110.1 127 145 A E T 5S- 0 0 128 3,-0.2 -1,-0.2 -17,-0.2 2,-0.2 -0.992 117.7 -18.2-127.6 122.8 75.0 4.3 112.2 128 146 A P T > 5S+ 0 0 79 0, 0.0 3,-1.5 0, 0.0 2,-0.7 -0.045 132.1 47.2 -78.8 -94.9 75.9 7.0 112.8 129 147 A G T 3>5S+ 0 0 21 1,-0.3 4,-1.3 -2,-0.2 -3,-0.2 -0.097 119.7 35.2 44.4 -85.8 79.7 7.5 112.3 130 148 A L H >> S+ 0 0 105 2,-0.2 4,-1.0 1,-0.2 5,-0.4 0.844 106.7 47.5 -70.4 -34.6 77.6 10.4 108.7 133 151 A I H XX S+ 0 0 14 -4,-1.3 4,-1.9 -3,-1.2 3,-1.0 0.962 109.4 53.0 -64.7 -53.6 80.8 10.4 106.6 134 152 A M H 3< S+ 0 0 0 -4,-2.2 116,-0.3 1,-0.2 -1,-0.2 0.590 114.1 44.7 -62.0 -9.9 79.0 9.1 103.5 135 153 A A H 3< S+ 0 0 25 -4,-0.6 -1,-0.2 -3,-0.3 -2,-0.2 0.631 128.7 13.3-110.0 -18.4 76.5 11.9 103.8 136 154 A N H << S+ 0 0 103 -4,-1.0 -3,-0.2 -3,-1.0 -2,-0.2 0.646 88.9 109.4-129.2 -32.3 78.6 15.1 104.5 137 155 A S < - 0 0 15 -4,-1.9 -4,-0.0 -5,-0.4 0, 0.0 -0.259 39.3-170.2 -58.7 136.2 82.3 14.5 103.8 138 156 A L + 0 0 103 5,-0.0 2,-0.6 -3,-0.0 -1,-0.1 0.297 55.2 109.4-105.3 3.4 83.8 16.1 100.8 139 157 A D > - 0 0 83 1,-0.2 4,-2.8 2,-0.0 5,-0.3 -0.742 58.0-154.5 -87.3 115.4 87.1 14.2 101.1 140 158 A Y H > S+ 0 0 20 -2,-0.6 4,-2.6 1,-0.2 -1,-0.2 0.882 94.3 43.4 -52.7 -46.5 87.5 11.6 98.3 141 159 A N H > S+ 0 0 89 2,-0.2 4,-3.9 1,-0.2 -1,-0.2 0.898 112.0 50.4 -71.6 -45.2 89.8 9.4 100.3 142 160 A E H > S+ 0 0 79 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.935 115.2 45.6 -55.2 -46.4 87.8 9.6 103.6 143 161 A R H X S+ 0 0 6 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.931 112.9 50.5 -65.4 -42.6 84.7 8.6 101.6 144 162 A L H X S+ 0 0 38 -4,-2.6 4,-2.6 -5,-0.3 5,-0.3 0.927 108.6 54.1 -54.3 -49.3 86.8 6.0 99.8 145 163 A W H X S+ 0 0 52 -4,-3.9 4,-3.6 2,-0.2 5,-0.2 0.974 111.0 41.7 -51.1 -70.5 87.9 4.7 103.2 146 164 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 5,-0.4 0.930 115.2 50.1 -37.2 -76.0 84.4 4.2 104.7 147 165 A W H X S+ 0 0 1 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.800 119.4 37.2 -32.0 -56.6 82.9 2.7 101.6 148 166 A E H X S+ 0 0 32 -4,-2.6 4,-3.0 -5,-0.2 3,-0.3 0.942 113.6 55.0 -68.1 -51.4 85.7 0.2 101.2 149 167 A S H X S+ 0 0 16 -4,-3.6 4,-2.1 -5,-0.3 3,-0.3 0.948 109.2 48.6 -44.0 -61.2 86.2 -0.6 104.9 150 168 A W H <>S+ 0 0 0 -4,-2.2 5,-1.3 1,-0.3 -1,-0.2 0.809 117.2 39.8 -53.8 -39.0 82.6 -1.5 105.4 151 169 A R H <>S+ 0 0 6 -4,-1.2 5,-0.6 -5,-0.4 329,-0.5 0.816 116.2 51.1 -81.9 -28.9 82.5 -3.8 102.4 152 170 A S H <5S+ 0 0 21 -4,-3.0 -2,-0.2 -3,-0.3 -1,-0.2 0.643 121.9 32.3 -81.0 -20.3 85.9 -5.2 103.1 153 171 A E T >X5S+ 0 0 83 -4,-2.1 4,-1.7 -5,-0.3 3,-0.5 0.689 132.9 17.5 -97.4 -97.6 85.0 -6.0 106.7 154 172 A V H 3>5S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -3,-0.2 0.779 125.0 61.2 -48.7 -30.3 81.4 -6.9 107.4 155 173 A G H >> S+ 0 0 75 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.925 119.3 44.0 -55.2 -50.2 80.2 -17.4 103.4 161 179 A L H X S+ 0 0 28 -4,-0.7 4,-3.1 1,-0.2 -2,-0.2 0.870 110.9 53.4 -60.9 -42.3 76.9 -17.1 105.2 162 180 A Y H X S+ 0 0 0 -4,-3.6 4,-2.1 1,-0.2 -1,-0.2 0.873 105.7 55.8 -65.3 -33.7 75.2 -15.5 102.2 163 181 A E H X S+ 0 0 47 -4,-2.3 4,-1.2 -5,-0.3 -1,-0.2 0.927 114.3 37.2 -60.9 -48.7 76.3 -18.4 100.0 164 182 A E H X S+ 0 0 65 -4,-1.7 4,-2.9 2,-0.2 5,-0.4 0.856 110.7 61.9 -72.4 -38.3 74.7 -21.0 102.3 165 183 A Y H X S+ 0 0 0 -4,-3.1 4,-2.6 1,-0.2 5,-0.2 0.913 104.1 49.9 -50.6 -46.1 71.8 -18.7 102.9 166 184 A V H X S+ 0 0 10 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.882 112.8 46.9 -61.7 -41.8 71.0 -18.9 99.2 167 185 A V H >X S+ 0 0 75 -4,-1.2 4,-2.3 2,-0.2 3,-0.6 0.983 116.3 41.0 -63.0 -62.6 71.3 -22.7 99.2 168 186 A L H 3X S+ 0 0 11 -4,-2.9 4,-1.7 1,-0.3 -2,-0.2 0.875 115.7 51.7 -55.8 -41.9 69.1 -23.3 102.2 169 187 A K H 3X S+ 0 0 9 -4,-2.6 4,-1.8 -5,-0.4 -1,-0.3 0.803 109.3 51.7 -67.5 -28.6 66.6 -20.6 101.2 170 188 A N H S+ 0 0 0 -4,-1.8 5,-1.3 1,-0.2 3,-0.5 0.910 113.2 44.8 -58.1 -46.3 61.5 -22.2 97.8 174 192 A R H ><5S+ 0 0 137 -4,-2.7 3,-1.9 1,-0.2 -1,-0.2 0.861 106.4 60.3 -69.3 -37.0 61.4 -25.3 95.6 175 193 A A H 3<5S+ 0 0 47 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.770 103.2 52.3 -61.0 -28.5 59.8 -27.5 98.3 176 194 A N T 3<5S- 0 0 26 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.222 130.7 -95.5 -93.2 13.5 56.8 -25.1 98.3 177 195 A H T < 5S+ 0 0 172 -3,-1.9 2,-0.3 1,-0.3 -3,-0.2 0.851 82.8 127.4 77.9 41.5 56.5 -25.4 94.5 178 196 A Y < - 0 0 54 -5,-1.3 -1,-0.3 -6,-0.1 3,-0.1 -0.855 65.9-124.0-120.7 158.3 58.5 -22.4 93.3 179 197 A E S S- 0 0 120 -2,-0.3 2,-0.3 1,-0.2 -5,-0.2 0.886 86.4 -33.5 -64.5 -41.6 61.4 -22.1 90.8 180 198 A D S > S- 0 0 3 -7,-0.2 4,-2.4 -6,-0.0 -1,-0.2 -0.956 73.3 -78.1-169.2 172.8 63.6 -20.4 93.4 181 199 A Y H > S+ 0 0 8 -2,-0.3 4,-2.7 265,-0.2 5,-0.1 0.846 129.3 57.0 -55.4 -34.8 63.5 -18.0 96.4 182 200 A G H > S+ 0 0 0 261,-0.3 4,-2.9 2,-0.2 5,-0.3 0.981 105.2 48.4 -55.5 -58.6 63.2 -15.2 93.9 183 201 A D H > S+ 0 0 6 1,-0.2 4,-0.9 2,-0.2 -2,-0.2 0.888 109.7 56.4 -47.2 -43.4 60.1 -16.8 92.4 184 202 A Y H >< S+ 0 0 45 -4,-2.4 3,-2.0 2,-0.2 4,-0.4 0.980 110.2 41.6 -51.3 -67.6 58.9 -17.1 96.0 185 203 A W H >< S+ 0 0 27 -4,-2.7 3,-2.0 1,-0.3 4,-0.3 0.921 107.6 58.8 -46.1 -59.8 59.2 -13.4 96.7 186 204 A R H >< S+ 0 0 5 -4,-2.9 3,-1.7 1,-0.3 -1,-0.3 0.720 89.5 82.8 -46.1 -20.2 57.8 -12.4 93.3 187 205 A G G X< + 0 0 12 -3,-2.0 3,-3.8 -4,-0.9 -1,-0.3 0.904 68.7 74.8 -51.4 -50.3 54.8 -14.4 94.7 188 206 A D G < S+ 0 0 72 -3,-2.0 -1,-0.3 -4,-0.4 -2,-0.2 0.746 95.8 52.7 -33.8 -33.0 53.5 -11.4 96.7 189 207 A Y G < S+ 0 0 1 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.473 86.3 118.6 -88.5 -0.1 52.3 -10.0 93.3 190 208 A E < - 0 0 56 -3,-3.8 2,-0.3 -4,-0.2 10,-0.2 -0.314 40.0-171.0 -75.2 146.2 50.3 -13.1 92.1 191 209 A V B -B 199 0B 11 8,-2.8 8,-1.6 356,-0.1 2,-0.5 -0.935 0.3-171.3-139.7 116.7 46.6 -13.3 91.4 192 210 A N + 0 0 101 -2,-0.3 8,-0.0 1,-0.2 -2,-0.0 -0.924 59.2 4.8-111.4 120.5 44.6 -16.5 90.7 193 211 A G S S+ 0 0 48 -2,-0.5 -1,-0.2 0, 0.0 0, 0.0 0.825 85.7 87.9 77.6 109.5 41.0 -16.5 89.5 194 212 A V S S- 0 0 50 -3,-0.1 -2,-0.1 4,-0.0 -121,-0.0 -0.013 79.0-123.3 164.9 -27.9 39.0 -13.3 88.7 195 213 A D S S+ 0 0 136 1,-0.1 -3,-0.0 0, 0.0 0, 0.0 0.807 89.9 24.9 66.9 120.1 39.9 -12.8 85.0 196 214 A G S S+ 0 0 52 1,-0.1 -1,-0.1 2,-0.0 0, 0.0 0.077 120.7 61.5 84.8 -23.9 41.4 -9.6 83.7 197 215 A Y S S+ 0 0 48 2,-0.0 352,-0.3 353,-0.0 353,-0.2 0.371 77.2 115.0-109.8 -1.2 42.8 -9.1 87.2 198 216 A D - 0 0 63 351,-0.1 2,-0.3 -8,-0.0 -6,-0.2 -0.320 43.2-176.5 -67.0 155.2 44.9 -12.3 87.2 199 217 A Y B -B 191 0B 12 -8,-1.6 -8,-2.8 -2,-0.0 2,-0.2 -0.972 11.8-144.7-157.7 139.1 48.6 -11.8 87.4 200 218 A S > - 0 0 63 -2,-0.3 4,-0.9 -10,-0.2 -8,-0.0 -0.686 26.3-116.5-111.0 163.3 51.6 -14.1 87.3 201 219 A R H > S+ 0 0 55 -2,-0.2 4,-0.6 1,-0.2 -1,-0.1 0.755 119.2 46.8 -67.3 -26.7 55.1 -14.2 89.0 202 220 A G H >> S+ 0 0 39 2,-0.2 4,-2.0 1,-0.2 3,-0.5 0.885 99.1 68.0 -76.1 -43.4 56.8 -13.8 85.7 203 221 A Q H 3> S+ 0 0 54 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.771 93.5 63.1 -48.7 -28.7 54.5 -11.0 84.6 204 222 A L H 3X S+ 0 0 0 -4,-0.9 4,-3.7 2,-0.2 -1,-0.2 0.972 103.9 42.2 -61.8 -58.5 56.2 -8.9 87.3 205 223 A I H X S+ 0 0 10 -4,-1.9 3,-2.8 1,-0.2 4,-1.3 0.903 98.1 61.6 -68.8 -44.5 62.1 0.6 83.5 213 231 A E H >< S+ 0 0 107 -4,-2.1 3,-1.1 1,-0.3 -1,-0.2 0.949 100.3 54.5 -41.7 -57.1 63.1 1.0 79.8 214 232 A E T 3< S+ 0 0 95 -4,-1.1 -1,-0.3 1,-0.2 4,-0.2 0.454 106.7 55.2 -60.8 1.7 60.7 4.0 79.7 215 233 A I T <> S+ 0 0 0 -3,-2.8 4,-2.1 2,-0.1 3,-0.4 0.735 83.9 81.8-104.2 -29.1 62.7 5.5 82.7 216 234 A K H S+ 0 0 65 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.919 112.1 44.6 -49.5 -50.0 66.2 8.7 79.3 218 236 A L H > S+ 0 0 9 -3,-0.4 4,-1.9 1,-0.2 -2,-0.2 0.938 117.4 45.2 -59.0 -47.2 65.1 10.6 82.4 219 237 A Y H X S+ 0 0 5 -4,-2.1 4,-3.4 1,-0.2 -1,-0.2 0.868 108.4 56.3 -64.5 -39.6 67.6 8.9 84.6 220 238 A E H X S+ 0 0 64 -4,-3.9 4,-2.7 1,-0.2 367,-0.4 0.868 109.7 46.1 -63.7 -37.2 70.4 9.2 82.0 221 239 A H H X S+ 0 0 33 -4,-1.9 4,-2.6 -5,-0.3 -1,-0.2 0.887 112.5 49.0 -71.5 -36.9 70.0 12.9 82.0 222 240 A L H X S+ 0 0 2 -4,-1.9 4,-2.7 1,-0.2 5,-0.3 0.938 112.4 51.1 -65.9 -43.0 69.8 13.1 85.8 223 241 A H H X S+ 0 0 0 -4,-3.4 4,-2.5 1,-0.2 -2,-0.2 0.937 110.4 47.2 -55.0 -53.9 72.9 11.0 85.7 224 242 A A H X S+ 0 0 1 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.875 111.9 50.2 -59.5 -41.4 74.7 13.4 83.3 225 243 A Y H X S+ 0 0 12 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.972 113.3 43.8 -65.8 -52.1 73.7 16.5 85.2 226 244 A V H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.885 109.9 59.5 -61.2 -33.7 74.9 15.2 88.5 227 245 A R H X S+ 0 0 3 -4,-2.5 4,-2.1 -5,-0.3 -1,-0.2 0.962 107.4 43.1 -56.7 -55.7 78.1 13.9 86.9 228 246 A A H X S+ 0 0 40 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.916 114.5 52.0 -58.3 -43.7 79.2 17.2 85.6 229 247 A K H >X S+ 0 0 70 -4,-2.2 4,-0.7 1,-0.2 3,-0.6 0.892 108.4 51.0 -58.3 -39.6 78.3 18.7 89.0 230 248 A L H >X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 3,-0.7 0.835 99.5 65.1 -68.8 -32.5 80.3 16.1 90.8 231 249 A M H 3< S+ 0 0 56 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.830 102.3 48.8 -57.9 -34.5 83.3 16.9 88.5 232 250 A N H << S+ 0 0 132 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.697 112.3 48.9 -78.7 -20.8 83.4 20.3 90.1 233 251 A A H << S+ 0 0 34 -4,-0.7 -2,-0.2 -3,-0.7 -1,-0.2 0.903 127.7 21.8 -83.2 -44.9 83.2 18.8 93.6 234 252 A Y S >< S- 0 0 12 -4,-3.0 3,-1.5 -95,-0.1 4,-0.5 -0.619 87.5-159.7-122.3 68.1 86.0 16.2 93.1 235 253 A P T 3 S+ 0 0 81 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 -0.165 72.9 12.3 -51.8 141.6 88.0 17.6 90.2 236 254 A S T 3 S+ 0 0 109 2,-0.2 -5,-0.1 -5,-0.1 -4,-0.1 -0.035 105.8 86.0 86.5 -32.8 90.1 15.1 88.4 237 255 A Y S < S+ 0 0 87 -3,-1.5 2,-0.4 -2,-0.3 -1,-0.1 0.624 82.3 67.3 -77.7 -10.4 88.5 12.0 90.0 238 256 A I - 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0 0 17 0, 0.0 3,-3.1 0, 0.0 4,-1.7 -0.781 36.8-124.4 -83.8 132.7 43.7 -8.4 93.8 548 566 A W H 3>>S+ 0 0 8 -2,-0.4 4,-4.6 1,-0.3 5,-0.5 0.825 110.3 69.7 -44.4 -41.6 45.8 -5.2 93.7 549 567 A T H 3>5S+ 0 0 2 -352,-0.3 4,-1.2 1,-0.2 -1,-0.3 0.864 108.9 35.8 -43.3 -41.8 45.0 -5.0 90.0 550 568 A L H <>5S+ 0 0 39 -3,-3.1 4,-2.6 2,-0.2 -2,-0.2 0.915 117.2 51.4 -79.0 -46.4 41.4 -4.2 91.2 551 569 A A H <5S+ 0 0 2 -4,-1.7 4,-0.2 1,-0.2 -2,-0.2 0.914 113.9 44.8 -57.6 -46.4 42.4 -2.2 94.2 552 570 A L H >X5S+ 0 0 0 -4,-4.6 4,-2.8 1,-0.2 3,-1.7 0.883 109.8 55.7 -63.1 -43.1 44.7 -0.0 92.1 553 571 A E H 3X> S+ 0 0 0 -2,-0.4 4,-1.7 1,-0.2 3,-1.1 0.860 78.2 79.3 -73.3 -37.6 55.6 4.6 84.6 564 582 A R H 3> S+ 0 0 138 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.797 87.9 53.2 -46.4 -48.9 54.0 7.6 82.8 565 583 A P H 3> S+ 0 0 3 0, 0.0 4,-1.3 0, 0.0 -1,-0.3 0.911 110.4 50.9 -56.1 -36.9 52.5 9.4 85.8 566 584 A L H <> S+ 0 0 0 -3,-1.1 4,-0.8 -4,-0.5 3,-0.4 0.920 109.8 48.3 -63.1 -46.7 56.0 9.2 87.4 567 585 A L H < S+ 0 0 32 -4,-1.7 3,-0.5 1,-0.2 -1,-0.2 0.835 107.7 57.3 -60.2 -35.3 57.6 10.7 84.3 568 586 A N H >< S+ 0 0 67 -4,-2.3 3,-1.1 1,-0.2 -47,-0.3 0.791 98.5 58.8 -67.5 -31.3 54.9 13.4 84.3 569 587 A Y H 3< S+ 0 0 2 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.791 115.4 37.1 -67.3 -26.2 55.9 14.5 87.8 570 588 A F T 3X S+ 0 0 0 -4,-0.8 4,-2.7 -3,-0.5 -1,-0.2 -0.028 83.7 108.1-114.4 30.1 59.4 15.2 86.4 571 589 A E H <> S+ 0 0 85 -3,-1.1 4,-1.5 2,-0.2 5,-0.2 0.925 79.4 49.8 -73.4 -41.9 58.4 16.6 83.0 572 590 A P H > S+ 0 0 50 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.931 117.2 43.0 -62.1 -39.4 59.4 20.2 83.8 573 591 A L H > S+ 0 0 1 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.975 105.4 61.9 -64.5 -56.7 62.7 18.9 85.1 574 592 A F H X S+ 0 0 32 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.778 106.6 46.1 -39.7 -41.3 63.4 16.4 82.3 575 593 A T H X S+ 0 0 70 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.961 110.4 51.6 -73.1 -49.8 63.4 19.2 79.7 576 594 A W H X S+ 0 0 36 -4,-1.5 4,-2.9 1,-0.2 3,-0.3 0.922 109.9 51.8 -49.9 -49.5 65.6 21.5 81.8 577 595 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.939 105.8 52.6 -50.6 -56.6 68.1 18.6 82.1 578 596 A K H < S+ 0 0 89 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.828 113.1 46.4 -50.6 -37.7 68.3 17.9 78.4 579 597 A D H >< S+ 0 0 85 -4,-1.9 3,-2.7 -3,-0.3 -1,-0.2 0.959 111.2 49.0 -70.5 -54.3 69.1 21.6 77.9 580 598 A Q H >< S+ 0 0 79 -4,-2.9 3,-0.5 1,-0.3 -2,-0.2 0.843 108.7 55.9 -53.4 -34.9 71.7 21.7 80.7 581 599 A N G >< S+ 0 0 8 -4,-3.0 3,-1.2 -5,-0.2 -1,-0.3 0.355 73.5 120.5 -80.9 6.4 73.2 18.6 79.1 582 600 A K G < S+ 0 0 144 -3,-2.7 -1,-0.2 1,-0.3 -2,-0.1 0.817 92.6 13.4 -34.5 -53.4 73.4 20.5 75.8 583 601 A N G < S+ 0 0 156 -3,-0.5 -1,-0.3 -4,-0.2 2,-0.2 0.222 111.8 99.5-115.1 9.1 77.2 20.0 75.6 584 602 A S S < S- 0 0 47 -3,-1.2 2,-0.5 -4,-0.1 -359,-0.1 -0.582 80.0-105.4 -94.0 158.1 77.5 17.4 78.3 585 603 A F - 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0 0 84 1,-0.1 4,-1.9 4,-0.0 5,-0.2 -0.230 360.0-105.1 -72.7 170.8 49.3 25.9 21.4 601 21 B T H > S+ 0 0 37 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.817 122.2 55.6 -69.1 -30.3 45.7 26.3 22.7 602 22 B E H > S+ 0 0 27 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.879 108.8 47.9 -66.5 -38.3 46.9 25.9 26.2 603 23 B E H > S+ 0 0 72 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.866 108.8 51.4 -74.0 -37.2 49.4 28.8 25.7 604 24 B L H < S+ 0 0 37 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.870 113.2 49.1 -63.6 -35.8 46.8 31.1 24.2 605 25 B A H >X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 3,-1.2 0.936 105.1 55.2 -69.0 -50.6 44.6 30.3 27.3 606 26 B K H 3X S+ 0 0 83 -4,-2.6 4,-2.4 1,-0.3 -2,-0.2 0.934 109.0 47.7 -45.4 -56.4 47.4 30.9 29.8 607 27 B T H 3X S+ 0 0 13 -4,-1.8 4,-0.9 1,-0.2 -1,-0.3 0.664 110.8 55.6 -63.3 -17.3 47.9 34.5 28.5 608 28 B F H <> S+ 0 0 8 -3,-1.2 4,-2.5 -4,-0.5 3,-0.3 0.948 108.2 42.7 -78.9 -55.2 44.1 34.9 28.6 609 29 B L H X S+ 0 0 6 -4,-2.4 4,-3.2 1,-0.2 5,-0.2 0.878 109.4 60.9 -57.1 -40.6 43.6 34.1 32.2 610 30 B E H X S+ 0 0 76 -4,-2.4 4,-1.5 -5,-0.3 -1,-0.2 0.896 108.5 43.3 -52.1 -43.5 46.7 36.2 33.0 611 31 B T H X S+ 0 0 25 -4,-0.9 4,-2.1 -3,-0.3 -2,-0.2 0.896 113.1 53.2 -70.6 -40.0 44.8 39.1 31.5 612 32 B F H X S+ 0 0 0 -4,-2.5 4,-4.0 1,-0.2 5,-0.3 0.975 107.2 49.5 -56.9 -60.9 41.6 38.1 33.3 613 33 B N H X S+ 0 0 24 -4,-3.2 4,-2.0 1,-0.2 -1,-0.2 0.856 112.7 47.1 -45.5 -47.4 43.2 38.0 36.7 614 34 B Y H X S+ 0 0 44 -4,-1.5 4,-0.8 -5,-0.2 -1,-0.2 0.875 119.9 39.4 -67.6 -37.7 44.8 41.4 36.4 615 35 B E H X S+ 0 0 56 -4,-2.1 4,-2.1 -3,-0.3 3,-0.3 0.906 113.4 52.8 -77.3 -44.8 41.6 43.0 35.0 616 36 B A H X S+ 0 0 0 -4,-4.0 4,-3.5 1,-0.2 5,-0.4 0.928 104.4 58.2 -54.5 -47.9 39.2 41.2 37.3 617 37 B Q H X S+ 0 0 29 -4,-2.0 4,-1.7 -5,-0.3 -1,-0.2 0.850 108.0 46.4 -52.2 -39.5 41.2 42.3 40.3 618 38 B E H X S+ 0 0 9 -4,-0.8 4,-1.9 -3,-0.3 -1,-0.2 0.953 119.0 37.2 -72.5 -50.0 40.7 46.0 39.4 619 39 B L H X S+ 0 0 22 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.937 117.3 51.4 -67.7 -45.3 37.0 45.9 38.7 620 40 B S H X S+ 0 0 19 -4,-3.5 4,-2.7 -5,-0.2 -1,-0.2 0.907 110.1 50.5 -57.4 -45.9 36.2 43.4 41.5 621 41 B Y H X S+ 0 0 0 -4,-1.7 4,-3.0 -5,-0.4 5,-0.3 0.930 110.3 48.4 -57.3 -48.5 38.1 45.7 44.0 622 42 B Q H X S+ 0 0 59 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.866 111.0 52.4 -62.1 -36.6 36.2 48.7 42.9 623 43 B S H X S+ 0 0 14 -4,-2.5 4,-3.6 22,-0.2 -2,-0.2 0.936 111.9 44.6 -63.3 -49.3 32.9 46.8 43.2 624 44 B S H X S+ 0 0 25 -4,-2.7 4,-3.5 307,-0.3 5,-0.3 0.953 111.2 51.2 -62.2 -51.1 33.7 45.7 46.8 625 45 B V H X S+ 0 0 22 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.848 114.7 48.4 -56.0 -30.0 34.9 49.1 47.9 626 46 B A H X S+ 0 0 11 -4,-1.3 4,-2.0 -5,-0.3 -2,-0.3 0.972 111.7 45.0 -73.1 -56.0 31.5 50.2 46.4 627 47 B S H X S+ 0 0 30 -4,-3.6 4,-2.8 1,-0.2 -2,-0.2 0.874 116.4 49.1 -54.3 -39.6 29.3 47.5 48.1 628 48 B W H X S+ 0 0 12 -4,-3.5 4,-2.0 2,-0.2 5,-0.3 0.968 106.5 53.3 -64.8 -54.9 31.2 48.2 51.3 629 49 B N H < S+ 0 0 70 -4,-2.1 4,-0.5 -5,-0.3 6,-0.3 0.819 114.4 44.9 -51.1 -33.6 30.8 52.0 51.1 630 50 B Y H >< S+ 0 0 60 -4,-2.0 3,-1.4 8,-0.2 -2,-0.2 0.972 111.1 49.9 -70.6 -57.6 27.1 51.4 50.7 631 51 B N H 3< S+ 0 0 32 -4,-2.8 292,-1.8 1,-0.3 3,-0.2 0.689 118.9 39.7 -57.5 -21.3 26.6 48.8 53.4 632 52 B T T 3< S+ 0 0 12 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.505 130.9 24.2-106.6 -8.2 28.4 51.0 55.9 633 53 B N < - 0 0 53 -3,-1.4 2,-2.6 -4,-0.5 -1,-0.2 -0.594 69.8-159.4-159.3 85.8 26.9 54.3 54.9 634 54 B I + 0 0 55 287,-1.8 -4,-0.1 -3,-0.2 -3,-0.1 -0.085 34.9 154.1 -70.0 42.7 23.6 54.0 53.1 635 55 B T > - 0 0 52 -2,-2.6 4,-1.0 -6,-0.3 -2,-0.1 -0.223 53.6-118.2 -65.1 160.8 23.8 57.4 51.3 636 56 B E H >> S+ 0 0 137 2,-0.2 3,-1.6 1,-0.2 4,-1.1 0.985 114.6 52.5 -63.8 -60.8 21.9 58.0 48.1 637 57 B E H >> S+ 0 0 125 1,-0.3 4,-1.8 2,-0.2 3,-0.5 0.827 106.8 58.4 -40.0 -39.9 25.0 58.7 46.0 638 58 B N H 3> S+ 0 0 15 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.817 96.2 57.8 -65.9 -35.7 26.3 55.4 47.4 639 59 B V H X S+ 0 0 93 -4,-3.1 4,-2.2 2,-0.2 3,-1.4 0.949 115.5 27.3 -41.2 -77.3 28.0 51.4 39.0 645 65 B A H 3X S+ 0 0 13 -4,-1.9 4,-2.3 1,-0.3 -22,-0.2 0.804 116.4 65.7 -61.4 -31.4 31.0 49.2 39.7 646 66 B G H 3X S+ 0 0 15 -4,-1.1 4,-1.2 -5,-0.5 -1,-0.3 0.784 109.0 38.0 -60.8 -29.8 28.5 46.3 40.3 647 67 B D H < S+ 0 0 56 -4,-1.7 3,-1.0 1,-0.2 -1,-0.2 0.906 107.1 53.8 -67.8 -43.1 35.3 35.0 25.4 660 80 B A H >< S+ 0 0 0 -4,-2.7 3,-1.8 1,-0.3 -1,-0.2 0.829 96.8 70.6 -59.5 -30.7 36.5 32.3 27.7 661 81 B Q H 3< S+ 0 0 85 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.886 83.6 68.9 -51.7 -43.4 34.0 30.1 25.9 662 82 B M T << S+ 0 0 129 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.358 84.8 87.2 -64.0 7.1 36.3 30.2 22.8 663 83 B Y S < S- 0 0 19 -3,-1.8 2,-1.1 14,-0.1 3,-0.1 -0.949 75.3-139.3-114.9 117.8 38.8 28.1 24.7 664 84 B P > - 0 0 37 0, 0.0 3,-0.7 0, 0.0 -2,-0.1 -0.630 20.0-179.6 -74.4 97.6 38.5 24.2 24.6 665 85 B L G > S+ 0 0 26 -2,-1.1 3,-1.1 1,-0.3 9,-0.1 0.771 83.0 64.2 -68.6 -27.6 39.4 23.2 28.1 666 86 B Q G 3 S+ 0 0 154 1,-0.3 -1,-0.3 -3,-0.1 2,-0.2 0.809 98.4 58.0 -61.7 -29.8 38.9 19.6 27.1 667 87 B E G < S+ 0 0 103 -3,-0.7 2,-0.4 -66,-0.0 -1,-0.3 -0.270 92.5 98.1 -92.6 42.8 41.9 20.4 24.9 668 88 B I < - 0 0 8 -3,-1.1 2,-0.4 -2,-0.2 -3,-0.0 -0.973 52.1-167.5-139.2 125.3 43.9 21.3 28.0 669 89 B Q + 0 0 153 -2,-0.4 2,-0.3 4,-0.0 -3,-0.1 -0.433 63.3 90.1-106.9 54.3 46.5 19.2 29.9 670 90 B N > - 0 0 43 -2,-0.4 4,-1.5 1,-0.1 -1,-0.0 -0.862 62.0-150.7-151.2 114.8 46.8 21.4 33.0 671 91 B L H > S+ 0 0 145 -2,-0.3 4,-1.3 2,-0.2 3,-0.1 0.911 91.4 51.7 -45.9 -59.3 44.7 21.0 36.1 672 92 B T H >> S+ 0 0 58 1,-0.2 3,-1.7 2,-0.2 4,-1.3 0.929 108.5 45.3 -46.5 -73.0 44.8 24.6 37.3 673 93 B V H 3> S+ 0 0 9 1,-0.3 4,-3.0 2,-0.2 5,-0.3 0.807 106.2 62.2 -44.3 -43.1 43.8 26.5 34.1 674 94 B K H 3X S+ 0 0 89 -4,-1.5 4,-2.2 2,-0.2 -1,-0.3 0.858 104.3 48.4 -54.2 -42.0 40.9 24.1 33.5 675 95 B L H + 0 0 85 -2,-0.3 4,-0.7 1,-0.1 3,-0.4 0.737 29.4 170.5-105.5 -30.0 26.0 31.7 31.5 684 104 B G T >4 - 0 0 24 1,-0.2 3,-1.0 2,-0.2 4,-0.2 -0.089 68.1 -23.7 55.1-151.7 24.4 33.1 34.7 685 105 B S G >4 S+ 0 0 47 1,-0.2 3,-3.0 2,-0.1 -1,-0.2 0.899 128.8 76.2 -53.9 -42.8 21.3 35.3 34.5 686 106 B S G 34 S+ 0 0 60 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.771 73.6 77.8 -41.1 -41.7 22.2 36.1 30.9 687 107 B V G << S+ 0 0 42 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.1 0.718 91.8 65.0 -44.3 -25.9 21.1 32.7 29.7 688 108 B L S < S- 0 0 27 -3,-3.0 2,-0.2 -4,-0.2 -2,-0.0 0.292 96.1 -87.2 -76.6-150.7 17.5 34.1 30.0 689 109 B S > - 0 0 47 1,-0.1 4,-2.0 -4,-0.0 5,-0.3 -0.599 38.0 -91.9-116.6 178.4 16.0 36.9 27.9 690 110 B E H > S+ 0 0 166 -2,-0.2 4,-1.0 1,-0.2 5,-0.1 0.936 125.9 34.6 -53.6 -50.1 15.9 40.7 28.0 691 111 B D H > S+ 0 0 112 2,-0.2 4,-3.3 3,-0.2 5,-0.2 0.916 117.5 50.5 -77.9 -46.2 12.5 40.6 29.9 692 112 B K H > S+ 0 0 71 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.972 113.8 44.4 -55.4 -59.0 13.1 37.5 32.0 693 113 B S H X S+ 0 0 24 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.792 115.5 49.6 -57.2 -31.6 16.5 38.6 33.3 694 114 B K H X S+ 0 0 113 -4,-1.0 4,-1.4 -5,-0.3 -1,-0.2 0.953 114.6 43.5 -70.9 -50.7 15.1 42.1 33.9 695 115 B R H >X S+ 0 0 96 -4,-3.3 4,-2.8 2,-0.2 3,-0.8 0.954 108.8 56.8 -59.2 -55.9 12.0 40.8 35.8 696 116 B L H 3X S+ 0 0 0 -4,-3.4 4,-3.4 1,-0.3 -1,-0.2 0.892 109.6 46.4 -42.0 -52.5 14.0 38.2 37.8 697 117 B N H 3X S+ 0 0 71 -4,-1.4 4,-2.3 2,-0.2 -1,-0.3 0.794 109.1 54.8 -64.0 -30.0 16.2 41.0 39.2 698 118 B T H X S+ 0 0 53 -4,-2.8 4,-2.8 2,-0.2 3,-0.9 0.973 112.6 45.3 -64.8 -54.8 11.7 43.6 45.6 703 123 B M H 3X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.3 5,-0.2 0.960 112.4 52.9 -52.2 -52.8 11.7 40.6 47.9 704 124 B S H 3X S+ 0 0 38 -4,-2.1 4,-1.3 -5,-0.4 -1,-0.3 0.759 112.4 45.1 -55.0 -27.6 15.0 41.7 49.4 705 125 B T H -G 717 0F 42 6,-1.8 3,-2.0 3,-0.6 5,-0.1 -0.290 27.8-140.0 -53.5 121.2 0.7 47.2 67.2 715 135 B P T 3 S+ 0 0 92 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.945 106.4 36.1 -50.2 -53.8 -3.0 46.4 66.5 716 136 B D T 3 S+ 0 0 144 1,-0.2 -2,-0.1 2,-0.1 0, 0.0 -0.254 124.4 47.0 -94.0 44.4 -4.1 48.5 69.6 717 137 B N E X +G 714 0F 51 -3,-2.0 -3,-0.6 -2,-0.2 3,-0.6 -0.130 61.6 175.1-176.0 64.0 -1.3 51.0 68.9 718 138 B P E 3 S+ 0 0 109 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 0.374 75.5 65.1 -61.3 3.6 -1.2 52.1 65.2 719 139 B Q E 3 S+ 0 0 162 1,-0.1 2,-0.5 -5,-0.1 -2,-0.0 0.892 92.7 58.4 -89.8 -52.8 1.6 54.6 66.0 720 140 B E E < + 0 0 105 -3,-0.6 -6,-1.8 -6,-0.1 2,-0.3 -0.692 64.2 178.3 -86.3 127.4 4.5 52.4 67.0 721 141 B d E -G 713 0F 47 -2,-0.5 2,-0.4 -8,-0.2 -8,-0.3 -0.842 16.7-139.0-120.6 159.8 5.7 49.8 64.6 722 142 B L E -G 712 0F 33 -10,-2.9 -10,-1.8 -2,-0.3 2,-0.3 -0.929 5.8-138.1-124.0 147.2 8.6 47.4 65.0 723 143 B L E > -G 711 0F 72 -2,-0.4 5,-2.0 -12,-0.2 6,-0.4 -0.750 30.5-112.6-100.2 149.8 11.3 46.2 62.6 724 144 B L T >S+ 0 0 14 -14,-0.7 5,-2.7 -2,-0.3 6,-0.2 0.892 103.8 67.5 -46.2 -43.0 12.3 42.6 62.4 725 145 B E T 5S- 0 0 111 3,-0.2 -1,-0.2 -17,-0.1 2,-0.2 -0.994 115.6 -7.2-126.5 122.8 15.6 43.8 63.8 726 146 B P T > 5S+ 0 0 78 0, 0.0 3,-1.8 0, 0.0 2,-0.4 -0.156 132.2 38.1 -82.9 -97.3 15.7 44.8 66.6 727 147 B G T 3>5S+ 0 0 24 1,-0.3 4,-1.8 -2,-0.2 -3,-0.2 0.048 121.6 39.9 35.3 -81.8 12.2 45.1 68.2 728 148 B L H >> S+ 0 0 109 -4,-0.3 4,-0.9 2,-0.2 5,-0.5 0.884 106.4 49.7 -65.7 -38.2 14.1 41.3 70.7 731 151 B I H XX S+ 0 0 14 -4,-1.8 4,-2.1 -3,-0.5 3,-1.2 0.968 110.3 49.6 -62.6 -52.5 10.6 40.0 71.5 732 152 B M H 3< S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.655 114.0 47.1 -63.5 -16.0 11.3 36.6 70.2 733 153 B A H 3< S+ 0 0 25 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.2 0.597 129.6 11.3-102.8 -10.4 14.5 36.4 72.2 734 154 B N H << S+ 0 0 99 -3,-1.2 -3,-0.2 -4,-0.9 -2,-0.2 0.608 88.1 111.2-137.6 -33.3 13.4 37.5 75.6 735 155 B S < - 0 0 13 -4,-2.1 113,-0.1 -5,-0.5 -4,-0.0 -0.234 37.6-171.2 -56.2 135.6 9.6 37.7 76.0 736 156 B L + 0 0 111 -3,-0.0 2,-0.6 5,-0.0 -1,-0.1 0.237 55.2 109.7-104.7 8.2 8.0 35.2 78.3 737 157 B D > - 0 0 82 1,-0.2 4,-2.2 95,-0.0 5,-0.3 -0.772 59.3-153.3 -93.6 118.5 4.5 36.2 77.2 738 158 B Y H > S+ 0 0 23 -2,-0.6 4,-1.9 1,-0.2 -1,-0.2 0.909 95.1 42.2 -52.2 -49.9 2.7 33.6 75.0 739 159 B N H > S+ 0 0 92 2,-0.2 4,-3.6 1,-0.2 -1,-0.2 0.870 110.3 52.9 -69.4 -43.6 0.6 36.2 73.3 740 160 B E H > S+ 0 0 87 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.901 115.5 43.9 -57.1 -40.6 3.2 38.9 72.7 741 161 B R H X S+ 0 0 6 -4,-2.2 4,-1.7 2,-0.2 5,-0.2 0.858 112.2 52.8 -73.7 -35.3 5.3 36.2 71.1 742 162 B L H X S+ 0 0 39 -4,-1.9 4,-2.5 -5,-0.3 5,-0.2 0.947 109.5 50.2 -61.4 -50.6 2.2 34.9 69.2 743 163 B W H X S+ 0 0 51 -4,-3.6 4,-3.4 2,-0.2 3,-0.3 0.979 112.3 44.4 -47.7 -73.4 1.6 38.4 67.9 744 164 B A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.4 0.898 114.8 47.2 -37.8 -74.4 5.2 39.0 66.7 745 165 B W H X S+ 0 0 0 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.828 119.3 41.3 -35.4 -51.6 5.6 35.6 65.0 746 166 B E H X S+ 0 0 32 -4,-2.5 4,-2.6 -3,-0.3 3,-0.3 0.941 112.5 52.0 -70.2 -48.3 2.2 35.9 63.3 747 167 B S H X S+ 0 0 13 -4,-3.4 4,-3.4 1,-0.2 6,-0.3 0.927 108.8 51.4 -52.1 -51.3 2.4 39.6 62.3 748 168 B W H <>S+ 0 0 0 -4,-2.6 5,-1.3 -5,-0.3 -1,-0.2 0.863 117.2 38.5 -58.0 -37.7 5.7 39.1 60.6 749 169 B R H <5S+ 0 0 9 -4,-1.2 5,-0.4 -5,-0.4 329,-0.4 0.769 117.0 51.9 -85.8 -23.8 4.4 36.2 58.6 750 170 B S H <5S+ 0 0 25 -4,-2.6 -2,-0.2 3,-0.2 -3,-0.2 0.809 121.8 30.4 -77.2 -35.9 1.0 37.8 58.1 751 171 B E T >X5S+ 0 0 82 -4,-3.4 4,-1.8 -5,-0.2 3,-0.6 0.829 133.1 18.9 -87.5 -96.2 2.6 41.0 56.8 752 172 B V H 3>5S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -3,-0.2 0.760 125.1 60.2 -48.0 -29.3 5.9 40.7 55.0 753 173 B G H 3> S+ 0 0 77 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.955 118.3 42.4 -54.7 -58.2 3.3 36.4 44.8 759 179 B L H X S+ 0 0 27 -4,-0.7 4,-3.2 1,-0.2 -2,-0.2 0.876 111.0 55.2 -57.6 -42.5 6.9 37.3 44.1 760 180 B Y H X S+ 0 0 0 -4,-3.6 4,-2.0 1,-0.2 -1,-0.2 0.895 104.8 54.9 -63.2 -37.3 8.3 34.0 45.5 761 181 B E H X S+ 0 0 47 -4,-2.0 4,-1.2 -5,-0.3 -1,-0.2 0.883 114.5 38.9 -58.8 -42.6 5.9 32.1 43.1 762 182 B E H X S+ 0 0 63 -4,-1.5 4,-2.3 2,-0.2 5,-0.4 0.851 109.0 61.9 -77.0 -37.4 7.4 33.9 40.1 763 183 B Y H X S+ 0 0 0 -4,-3.2 4,-2.1 1,-0.2 -2,-0.2 0.905 104.0 51.5 -51.4 -44.2 10.9 33.8 41.5 764 184 B V H X S+ 0 0 11 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.906 110.6 47.2 -62.5 -45.9 10.6 30.0 41.4 765 185 B V H >X S+ 0 0 75 -4,-1.2 4,-2.4 2,-0.2 3,-0.6 0.985 116.3 39.8 -59.4 -64.8 9.5 30.0 37.7 766 186 B L H 3X S+ 0 0 13 -4,-2.3 4,-2.3 1,-0.3 -1,-0.2 0.865 116.6 51.6 -57.7 -39.1 12.1 32.4 36.2 767 187 B K H 3X S+ 0 0 11 -4,-2.1 4,-2.0 -5,-0.4 -1,-0.3 0.799 109.6 50.6 -71.1 -29.7 14.8 30.9 38.4 768 188 B N H <>S+ 0 0 0 -4,-2.0 3,-1.4 1,-0.2 5,-0.8 0.944 113.1 45.7 -55.6 -54.9 18.5 26.5 35.9 772 192 B R H ><5S+ 0 0 130 -4,-3.0 3,-2.0 1,-0.3 -1,-0.2 0.847 105.3 61.4 -60.3 -38.7 17.2 24.2 33.2 773 193 B A H 3<5S+ 0 0 48 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.710 102.0 53.7 -60.4 -23.5 18.7 26.4 30.4 774 194 B N T <<5S- 0 0 27 -3,-1.4 -1,-0.3 -4,-0.9 -2,-0.2 0.236 131.4 -94.3 -97.0 12.3 22.2 25.7 32.0 775 195 B H T < 5S+ 0 0 165 -3,-2.0 2,-0.3 1,-0.3 -3,-0.2 0.894 84.6 127.7 78.4 45.7 21.6 22.0 31.8 776 196 B Y < - 0 0 60 -5,-0.8 -1,-0.3 -4,-0.2 3,-0.1 -0.868 64.6-127.5-124.0 158.8 20.2 21.4 35.3 777 197 B E S S- 0 0 121 1,-0.3 2,-0.3 -2,-0.3 -5,-0.2 0.945 85.3 -31.0 -69.5 -48.2 17.0 19.7 36.4 778 198 B D S > S- 0 0 4 -7,-0.1 4,-2.6 -3,-0.1 -1,-0.3 -0.949 71.7 -82.8-161.2 170.6 16.0 22.7 38.5 779 199 B Y H > S+ 0 0 6 -2,-0.3 4,-2.8 1,-0.2 5,-0.1 0.809 128.2 59.5 -53.2 -30.9 17.4 25.6 40.6 780 200 B G H > S+ 0 0 0 2,-0.2 4,-2.8 261,-0.2 5,-0.3 0.970 104.5 47.1 -61.0 -54.6 17.7 23.0 43.4 781 201 B D H > S+ 0 0 5 1,-0.2 4,-1.0 2,-0.2 -2,-0.2 0.920 110.1 57.0 -49.0 -47.3 20.0 20.9 41.2 782 202 B Y H >< S+ 0 0 67 -4,-2.6 3,-1.3 2,-0.2 4,-0.4 0.955 110.5 40.4 -48.1 -62.9 21.8 24.1 40.5 783 203 B W H >< S+ 0 0 32 -4,-2.8 3,-2.3 1,-0.3 4,-0.3 0.958 109.1 58.0 -55.0 -56.7 22.5 24.9 44.1 784 204 B R H >< S+ 0 0 4 -4,-2.8 3,-1.3 1,-0.3 -1,-0.3 0.704 91.8 80.6 -47.9 -17.5 23.4 21.2 45.0 785 205 B G G X< + 0 0 11 -3,-1.3 3,-3.8 -4,-1.0 -1,-0.3 0.887 67.8 77.1 -57.0 -44.7 25.9 21.8 42.2 786 206 B D G < S+ 0 0 72 -3,-2.3 -1,-0.3 -4,-0.4 -2,-0.2 0.755 95.0 52.9 -37.3 -31.2 28.4 23.5 44.5 787 207 B Y G < S+ 0 0 0 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.431 85.7 117.1 -92.1 1.4 29.3 20.1 45.9 788 208 B E < - 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