==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN, STRUCTURAL PROTEIN 06-AUG-07 2QUQ . COMPND 2 MOLECULE: CENTROMERE DNA-BINDING PROTEIN COMPLEX CBF3 . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.J.BELLIZZI III,S.C.HARRISON . 517 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24175.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 404 78.1 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 . 5 1.0 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 19 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 87 16.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 275 53.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 3.3 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 2 1 0 2 1 0 1 2 2 1 1 3 1 1 0 1 2 0 1 1 0 0 0 0 1 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 . 1 1 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 . 1 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 54 A S > 0 0 101 0, 0.0 2,-4.6 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 98.8 41.2 -19.6 214.6 2 55 A K T 3 + 0 0 131 1,-0.3 0, 0.0 2,-0.1 0, 0.0 -0.181 360.0 120.1 -62.6 58.7 40.3 -15.9 213.8 3 56 A E T 3 + 0 0 141 -2,-4.6 -1,-0.3 1,-0.1 4,-0.2 0.460 61.1 67.9 -98.8 -9.6 36.9 -16.5 215.5 4 57 A Y S X> S+ 0 0 11 -3,-0.5 3,-2.7 1,-0.2 4,-0.6 0.895 72.3 94.7 -75.0 -42.7 37.7 -13.7 218.0 5 58 A L H >> S+ 0 0 29 1,-0.3 3,-1.7 2,-0.2 4,-1.6 0.593 72.3 62.9 -18.7 -53.4 37.5 -11.0 215.4 6 59 A P H 3> S+ 0 0 70 0, 0.0 4,-1.8 0, 0.0 3,-0.3 0.876 106.1 45.7 -48.8 -43.3 33.9 -10.0 215.9 7 60 A D H <4 S+ 0 0 120 -3,-2.7 4,-0.3 1,-0.2 -2,-0.2 0.608 111.7 55.6 -75.6 -13.2 34.7 -8.9 219.5 8 61 A L H > S+ 0 0 45 -4,-0.3 4,-1.8 1,-0.2 3,-1.5 0.850 93.3 65.2 -70.9 -37.6 36.4 -3.0 220.2 12 65 A W H 3X S+ 0 0 0 -4,-0.9 4,-3.8 -3,-0.5 5,-0.3 0.868 88.1 70.4 -54.8 -35.5 37.4 -0.6 217.4 13 66 A Q H 3X S+ 0 0 2 -4,-1.0 4,-1.8 1,-0.2 -1,-0.3 0.858 106.8 37.4 -49.3 -39.1 34.3 1.3 218.2 14 67 A N H <> S+ 0 0 53 -3,-1.5 4,-3.3 -4,-0.4 5,-0.4 0.816 113.1 54.5 -83.7 -34.4 35.9 2.4 221.5 15 68 A Y H X>S+ 0 0 0 -4,-1.8 4,-3.2 2,-0.2 5,-1.0 0.966 111.5 47.6 -62.4 -45.7 39.4 2.8 220.1 16 69 A E H X>S+ 0 0 0 -4,-3.8 5,-1.2 3,-0.2 4,-0.5 0.961 115.2 46.0 -55.3 -55.9 37.8 5.1 217.5 17 70 A Y H <>S+ 0 0 29 -4,-1.8 5,-2.8 -5,-0.3 4,-0.4 0.936 122.4 33.2 -50.9 -59.5 36.0 7.0 220.2 18 71 A W H <>S+ 0 0 31 -4,-3.3 5,-3.5 3,-0.2 -2,-0.2 0.899 131.4 24.2 -70.1 -44.2 38.9 7.3 222.6 19 72 A I H <>S+ 0 0 0 -4,-3.2 5,-1.0 -5,-0.4 -3,-0.2 0.940 127.0 38.1 -88.7 -56.1 41.9 7.7 220.4 20 73 A T T <XS+ 0 0 10 -5,-1.2 4,-2.2 -4,-0.4 5,-0.7 0.743 131.7 24.3-111.6 -79.5 38.2 11.3 218.6 22 75 A I H >> - 0 0 57 -2,-0.3 3,-0.8 1,-0.2 4,-0.5 -0.734 21.3-162.5 -83.2 113.6 49.4 21.5 235.1 32 85 A L T 34 S+ 0 0 139 -2,-0.7 3,-0.3 1,-0.3 -1,-0.2 0.747 87.9 61.6 -69.4 -24.2 48.1 24.8 236.6 33 86 A T T 34 S+ 0 0 115 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.784 111.9 40.9 -71.0 -25.1 51.1 25.2 238.9 34 87 A R T <4 S+ 0 0 206 -3,-0.8 -1,-0.2 2,-0.1 -2,-0.2 0.458 93.4 99.2-100.4 -4.0 53.2 25.4 235.7 35 88 A T S < S- 0 0 69 -4,-0.5 2,-0.1 -3,-0.3 -5,-0.0 -0.753 70.5-132.4 -92.4 120.7 50.9 27.5 233.6 36 89 A P - 0 0 115 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.417 27.4-164.6 -66.9 141.9 51.7 31.2 233.4 37 90 A A + 0 0 90 -2,-0.1 2,-0.2 2,-0.0 0, 0.0 -0.944 23.0 119.8-130.2 152.1 48.7 33.4 233.9 38 91 A N - 0 0 84 -2,-0.3 4,-0.2 2,-0.0 0, 0.0 -0.842 53.8-127.8 165.3 159.6 47.9 37.1 233.3 39 92 A L S S+ 0 0 147 -2,-0.2 -1,-0.0 2,-0.1 -2,-0.0 -0.284 96.2 73.1-117.4 42.0 45.7 39.6 231.5 40 93 A D S > S+ 0 0 95 3,-0.1 4,-1.7 2,-0.1 5,-0.2 0.704 85.5 50.7-122.2 -46.6 48.8 41.4 230.1 41 94 A T H > S+ 0 0 74 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.735 113.5 48.3 -70.3 -23.6 50.4 39.4 227.3 42 95 A D H > S+ 0 0 37 3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.761 108.7 54.5 -86.3 -26.8 47.1 38.9 225.5 43 96 A T H 4 S+ 0 0 50 2,-0.2 -2,-0.2 1,-0.1 -1,-0.1 0.869 114.8 37.7 -73.9 -39.0 46.2 42.7 225.7 44 97 A E H >X S+ 0 0 99 -4,-1.7 4,-1.4 2,-0.1 3,-1.3 0.923 119.8 46.9 -77.9 -46.6 49.4 43.9 224.1 45 98 A E H >X S+ 0 0 38 -4,-1.2 4,-2.1 1,-0.3 3,-0.5 0.925 112.4 48.4 -60.6 -48.2 49.6 41.1 221.6 46 99 A C H 3< S+ 0 0 0 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.1 0.262 111.8 54.5 -77.5 13.0 45.9 41.4 220.5 47 100 A M H <4 S+ 0 0 119 -3,-1.3 4,-0.4 2,-0.1 -1,-0.2 0.583 106.5 48.7-113.1 -30.7 46.6 45.1 220.2 48 101 A F H XX S+ 0 0 38 -4,-1.4 4,-2.4 -3,-0.5 3,-0.7 0.918 111.4 48.3 -74.9 -49.1 49.6 44.7 217.9 49 102 A W H 3X S+ 0 0 8 -4,-2.1 4,-1.1 1,-0.3 -1,-0.1 0.880 105.8 57.6 -58.5 -41.8 47.8 42.3 215.5 50 103 A M H 34 S+ 0 0 13 1,-0.2 -1,-0.3 -5,-0.2 -2,-0.2 0.768 109.9 47.1 -61.7 -24.1 44.8 44.6 215.4 51 104 A N H <4 S+ 0 0 102 -3,-0.7 -2,-0.2 -4,-0.4 -1,-0.2 0.891 99.8 65.3 -82.2 -44.5 47.3 47.2 214.2 52 105 A Y H < S+ 0 0 20 -4,-2.4 2,-0.5 2,-0.0 -2,-0.2 0.736 89.4 84.2 -50.3 -25.0 48.9 44.9 211.6 53 106 A L < - 0 0 2 -4,-1.1 2,-0.3 4,-0.1 77,-0.0 -0.703 69.3-155.5 -88.5 128.3 45.6 44.9 209.8 54 107 A Q > - 0 0 93 -2,-0.5 4,-2.6 1,-0.1 5,-0.3 -0.737 27.2-111.0-102.2 152.3 44.9 47.8 207.4 55 108 A K H > S+ 0 0 94 -2,-0.3 4,-1.2 1,-0.2 -1,-0.1 0.857 118.6 39.1 -43.6 -52.4 41.5 49.2 206.3 56 109 A D H > S+ 0 0 98 2,-0.2 4,-1.1 1,-0.1 -1,-0.2 0.899 113.3 56.8 -69.4 -42.4 41.9 47.9 202.7 57 110 A Q H >> S+ 0 0 21 1,-0.2 3,-2.1 2,-0.2 4,-1.3 0.975 108.1 45.8 -50.9 -64.0 43.5 44.7 203.7 58 111 A S H 3X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.3 -1,-0.2 0.798 108.6 58.9 -50.0 -35.0 40.6 43.7 206.0 59 112 A F H 3X S+ 0 0 33 -4,-1.2 4,-1.0 -5,-0.3 -1,-0.3 0.720 100.2 54.0 -71.8 -21.3 38.2 44.7 203.2 60 113 A Q H S+ 0 0 17 -4,-2.8 4,-0.6 2,-0.2 5,-0.5 0.971 115.2 45.3 -60.5 -45.9 37.3 36.7 199.9 65 118 A A H ><5S+ 0 0 0 -4,-3.3 3,-1.2 3,-0.2 4,-0.4 0.948 113.5 45.4 -59.1 -57.5 34.5 35.8 202.3 66 119 A M H 3<5S+ 0 0 63 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.850 120.3 42.2 -57.5 -35.7 31.6 37.1 200.3 67 120 A E H 3<5S+ 0 0 106 -4,-2.3 257,-0.6 -5,-0.2 258,-0.4 0.432 136.0 7.4 -92.8 -0.0 33.0 35.6 197.1 68 121 A N T X<5S+ 0 0 14 -3,-1.2 3,-0.5 -4,-0.6 -3,-0.2 0.555 114.2 58.3-140.5 -60.1 34.0 32.3 198.7 69 122 A L T >>< + 0 0 0 -5,-0.5 4,-1.9 -4,-0.4 3,-1.5 0.131 63.5 119.9 -75.6 21.2 33.0 31.3 202.3 70 123 A G H 3> + 0 0 10 -5,-0.3 4,-2.1 1,-0.3 5,-0.2 0.878 67.9 59.0 -53.1 -45.9 29.3 31.6 201.9 71 124 A A H <4 S+ 0 0 13 -3,-0.5 -1,-0.3 254,-0.2 4,-0.2 0.623 114.0 38.5 -61.6 -15.0 28.5 28.0 202.9 72 125 A L H <4 S+ 0 0 8 -3,-1.5 4,-0.4 2,-0.1 -2,-0.2 0.863 118.8 39.9 -99.7 -56.5 30.2 28.4 206.2 73 126 A Y H X>S+ 0 0 17 -4,-1.9 4,-1.7 1,-0.2 5,-0.6 0.701 100.0 74.7 -70.1 -21.4 29.3 31.9 207.4 74 127 A F H >X5S+ 0 0 73 -4,-2.1 3,-1.9 -5,-0.3 4,-1.8 0.980 83.4 61.5 -56.5 -68.3 25.7 32.0 206.3 75 128 A G H 345S+ 0 0 2 1,-0.3 -1,-0.2 -5,-0.2 167,-0.2 0.724 121.1 26.0 -26.3 -42.9 24.1 29.8 208.9 76 129 A S H 345S+ 0 0 3 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.2 0.565 139.1 18.1-106.2 -10.6 25.2 32.2 211.6 77 130 A I H <<5S- 0 0 27 -3,-1.9 -3,-0.2 -4,-1.7 -2,-0.2 0.642 82.5-151.2-132.4 -27.3 25.5 35.5 209.9 78 131 A G << + 0 0 13 -4,-1.8 4,-0.1 -5,-0.6 -4,-0.1 0.561 63.7 3.4 60.0 142.3 23.6 35.6 206.6 79 132 A D > - 0 0 81 1,-0.1 3,-1.2 2,-0.1 4,-0.4 0.662 66.3-144.8 11.4 102.5 24.5 37.7 203.5 80 133 A I T >> S+ 0 0 3 1,-0.3 3,-4.0 2,-0.2 4,-1.2 0.846 85.5 90.0 -54.2 -36.1 27.7 39.5 204.6 81 134 A S H >> S+ 0 0 61 1,-0.3 4,-0.8 2,-0.2 3,-0.7 0.788 85.1 52.0 -27.1 -52.4 26.6 42.6 202.6 82 135 A E H <4 S+ 0 0 129 -3,-1.2 4,-0.4 1,-0.2 -1,-0.3 0.794 108.6 52.1 -58.8 -31.5 24.8 43.8 205.8 83 136 A L H X> S+ 0 0 10 -3,-4.0 4,-2.0 -4,-0.4 3,-0.5 0.710 88.5 74.6 -81.2 -24.7 28.1 43.4 207.7 84 137 A Y H S+ 0 0 57 -3,-0.5 4,-1.6 -4,-0.4 -1,-0.3 0.826 107.1 55.0 -68.2 -35.7 30.0 47.2 210.3 87 140 A V H X S+ 0 0 0 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.852 111.8 48.5 -66.1 -31.0 33.4 46.6 209.0 88 141 A E H >X S+ 0 0 77 -4,-2.3 4,-1.8 -5,-0.2 3,-0.9 0.982 112.4 43.0 -69.4 -61.6 33.2 50.2 207.8 89 142 A Q H 3X S+ 0 0 63 -4,-2.7 4,-2.6 1,-0.3 5,-0.2 0.746 104.1 72.0 -57.2 -24.0 32.0 51.7 211.1 90 143 A Y H 3< S+ 0 0 3 -4,-1.6 -1,-0.3 -5,-0.2 4,-0.2 0.966 104.0 37.1 -55.0 -53.7 34.6 49.5 212.7 91 144 A W H XX S+ 0 0 37 -4,-1.1 3,-0.7 -3,-0.9 4,-0.5 0.865 110.5 61.6 -67.2 -39.7 37.3 51.7 211.4 92 145 A D H >< S+ 0 0 105 -4,-1.8 3,-1.1 1,-0.3 -2,-0.2 0.964 115.0 33.5 -51.8 -56.1 35.3 54.9 212.0 93 146 A R G >< S+ 0 0 41 -4,-2.6 3,-0.5 1,-0.2 -1,-0.3 0.474 94.1 95.1 -79.3 -0.6 35.2 54.2 215.7 94 147 A R G <4 S+ 0 0 91 -3,-0.7 2,-0.6 1,-0.3 -1,-0.2 0.772 79.5 61.9 -60.0 -22.9 38.7 52.6 215.4 95 148 A A G << S+ 0 0 86 -3,-1.1 2,-0.3 -4,-0.5 -1,-0.3 -0.487 84.6 108.3-103.4 61.8 39.9 56.1 216.4 96 149 A D < - 0 0 70 -2,-0.6 3,-0.1 -3,-0.5 -3,-0.0 -0.996 49.1-168.7-142.4 144.5 38.3 56.4 219.9 97 150 A K S S+ 0 0 210 -2,-0.3 2,-0.7 1,-0.1 -1,-0.1 0.621 90.0 72.0 -94.4 -22.9 39.4 56.4 223.5 98 151 A N + 0 0 119 -3,-0.1 2,-0.4 -5,-0.0 -1,-0.1 -0.856 67.5 164.5 -97.5 110.4 35.7 56.2 224.3 99 152 A H - 0 0 70 -2,-0.7 3,-0.0 -3,-0.1 -2,-0.0 -0.994 17.2-158.7-134.5 133.5 34.4 52.7 223.4 100 153 A S > - 0 0 76 -2,-0.4 4,-0.8 1,-0.1 -1,-0.0 0.212 29.3-107.0 -87.4-154.4 31.1 51.0 224.3 101 154 A V H > S+ 0 0 50 2,-0.2 4,-2.9 3,-0.1 5,-0.3 0.750 117.4 51.2-108.0 -46.8 29.9 47.4 224.5 102 155 A D H > S+ 0 0 86 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.831 112.0 57.4 -60.7 -24.3 27.6 47.2 221.5 103 156 A G H >> S+ 0 0 7 2,-0.2 4,-1.8 1,-0.1 3,-0.8 0.999 108.7 38.7 -65.5 -67.1 30.7 48.6 220.0 104 157 A K H 3X S+ 0 0 20 -4,-0.8 4,-3.2 1,-0.3 5,-0.3 0.893 110.9 59.6 -51.1 -47.0 33.1 45.9 220.9 105 158 A Y H 3X S+ 0 0 3 -4,-2.9 4,-1.6 1,-0.3 -1,-0.3 0.875 109.0 44.9 -51.9 -39.1 30.5 43.1 220.3 106 159 A W H X S+ 0 0 1 -4,-1.8 4,-2.1 2,-0.2 3,-0.6 0.982 109.7 46.8 -64.1 -57.3 34.1 44.5 216.6 108 161 A A H 3X S+ 0 0 0 -4,-3.2 4,-1.7 1,-0.3 5,-0.2 0.845 106.7 58.8 -54.4 -39.2 34.6 41.0 217.8 109 162 A L H 3X S+ 0 0 2 -4,-1.6 4,-1.0 -5,-0.3 -1,-0.3 0.911 110.8 41.4 -62.5 -39.2 32.1 39.7 215.4 110 163 A I H > - 0 0 33 0, 0.0 4,-1.8 0, 0.0 3,-0.8 -0.403 28.6-123.0 -58.3 122.2 44.5 30.5 199.5 123 176 A V H 3> S+ 0 0 60 1,-0.3 4,-1.7 2,-0.2 5,-0.1 0.757 110.9 53.6 -36.3 -37.5 48.1 31.0 200.7 124 177 A E H 3> S+ 0 0 117 1,-0.2 4,-1.4 2,-0.2 3,-0.3 0.959 108.7 44.8 -67.3 -52.5 48.8 32.6 197.3 125 178 A K H <4 S+ 0 0 96 -3,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.694 111.4 57.6 -66.0 -17.8 46.0 35.2 197.5 126 179 A L H >X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 3,-1.3 0.885 104.3 49.1 -77.3 -42.0 47.0 35.9 201.1 127 180 A A H 3< S+ 0 0 48 -4,-1.7 -2,-0.2 -3,-0.3 -1,-0.2 0.795 102.7 61.0 -66.2 -32.5 50.6 36.8 200.2 128 181 A E T 3< S+ 0 0 129 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.454 116.2 35.9 -73.9 -0.3 49.3 39.2 197.5 129 182 A I T <4 S+ 0 0 29 -3,-1.3 -2,-0.2 1,-0.3 2,-0.2 0.693 124.0 23.2-118.8 -44.3 47.6 41.0 200.4 130 183 A F < - 0 0 8 -4,-2.6 2,-0.3 -73,-0.0 -1,-0.3 -0.688 63.8-142.5-119.4 176.1 50.0 40.7 203.5 131 184 A S - 0 0 61 -2,-0.2 -4,-0.1 -3,-0.1 4,-0.1 -0.915 15.9-140.0-148.1 117.7 53.8 40.2 203.9 132 185 A V S >> S+ 0 0 4 -2,-0.3 4,-2.4 1,-0.2 3,-2.2 0.621 85.5 97.7 -48.2 -13.3 55.5 38.2 206.6 133 186 A Y H 3> S+ 0 0 169 1,-0.3 4,-0.9 2,-0.2 2,-0.7 0.940 86.4 35.0 -42.7 -74.1 58.0 41.0 206.6 134 187 A P H 34 S+ 0 0 66 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.093 120.0 56.0 -75.4 32.1 56.6 43.0 209.6 135 188 A L H <> S+ 0 0 11 -3,-2.2 4,-2.0 -2,-0.7 5,-0.3 0.660 91.3 59.4-125.4 -45.8 55.6 39.7 211.3 136 189 A H H X>S+ 0 0 7 -4,-2.4 4,-2.7 -3,-0.3 5,-1.8 0.895 108.9 50.4 -53.7 -42.6 58.7 37.5 211.7 137 190 A E H <5S+ 0 0 106 -4,-0.9 -1,-0.1 -5,-0.3 -2,-0.1 0.995 108.9 45.3 -58.6 -75.3 60.4 40.2 213.7 138 191 A Y H 45S+ 0 0 85 1,-0.2 -2,-0.2 2,-0.1 -1,-0.1 0.868 119.1 43.9 -34.4 -60.8 57.7 41.0 216.3 139 192 A L H <5S- 0 0 72 -4,-2.0 -1,-0.2 2,-0.1 -2,-0.2 0.977 110.4-124.1 -52.6 -62.7 57.1 37.3 216.9 140 193 A G T <5 + 0 0 62 -4,-2.7 2,-0.5 -5,-0.3 -3,-0.2 0.575 63.0 132.5 121.7 24.0 60.8 36.5 217.0 141 194 A S < - 0 0 23 -5,-1.8 -1,-0.3 -6,-0.2 4,-0.2 -0.928 63.9-104.3-108.7 124.8 61.0 33.8 214.3 142 195 A N > - 0 0 118 -2,-0.5 3,-1.3 1,-0.2 -1,-0.1 -0.000 31.3-109.5 -42.0 149.2 63.8 34.1 211.7 143 196 A K T 3 S+ 0 0 95 1,-0.3 -1,-0.2 -3,-0.0 -10,-0.0 0.219 99.8 109.6 -68.7 19.3 62.6 35.3 208.3 144 197 A R T 3 S+ 0 0 215 -8,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.565 73.1 54.2 -70.5 -12.8 63.5 31.7 207.8 145 198 A L < + 0 0 26 -3,-1.3 2,-0.3 -4,-0.2 -9,-0.1 -0.634 65.1 177.1-117.5 175.3 59.8 31.1 207.4 146 199 A N > > - 0 0 62 -2,-0.2 3,-2.5 -10,-0.0 5,-0.7 -0.934 52.6 -65.4-162.9-178.5 57.0 32.6 205.2 147 200 A W I 3 >S+ 0 0 17 1,-0.3 5,-0.5 -2,-0.3 6,-0.2 0.836 121.6 68.9 -47.4 -40.9 53.3 32.4 204.3 148 201 A E I 3 5S+ 0 0 126 3,-0.1 -1,-0.3 4,-0.1 280,-0.1 0.759 101.7 57.7 -52.0 -26.2 53.8 28.9 202.9 149 202 A D I X 5S- 0 0 68 -3,-2.5 3,-2.0 1,-0.0 4,-0.5 -0.349 117.7 -71.8 -99.6-177.6 54.5 27.8 206.5 150 203 A G I 3 5S+ 0 0 20 1,-0.3 4,-0.2 2,-0.2 5,-0.2 0.505 108.5 95.6 -52.4 -3.4 52.4 28.0 209.7 151 204 A M I 3 >S+ 0 0 0 -3,-1.2 4,-2.9 -5,-0.2 5,-0.7 0.596 101.2 58.1-125.3 -46.2 47.1 34.3 212.3 156 209 A C T <5S+ 0 0 2 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406 A Q H X S+ 0 0 18 -4,-3.1 4,-2.5 -5,-0.2 5,-0.2 0.942 113.1 42.7 -54.4 -56.3 28.9 15.1 204.7 337 407 A I H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.929 114.3 51.7 -58.7 -45.9 26.7 12.4 203.2 338 408 A S H X S+ 0 0 5 -4,-2.1 4,-3.2 -5,-0.2 -1,-0.2 0.938 110.7 49.3 -54.4 -49.5 29.7 10.4 202.0 339 409 A T H X S+ 0 0 9 -4,-2.8 4,-3.0 2,-0.2 -2,-0.2 0.940 112.8 45.0 -54.9 -54.3 31.1 10.5 205.5 340 410 A V H X S+ 0 0 3 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.883 113.8 52.7 -58.9 -38.7 27.9 9.4 207.2 341 411 A S H X S+ 0 0 4 -4,-3.0 4,-2.3 -5,-0.2 5,-0.3 0.928 108.5 48.3 -62.0 -48.3 27.6 6.8 204.5 342 412 A W H X S+ 0 0 2 -4,-3.2 4,-2.4 1,-0.2 5,-0.3 0.954 112.8 48.9 -56.9 -50.4 31.1 5.5 205.2 343 413 A K H X S+ 0 0 12 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.913 108.8 56.5 -55.5 -41.9 30.2 5.5 208.9 344 414 A L H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.907 112.5 36.2 -58.3 -50.4 27.0 3.6 208.0 345 415 A F H X S+ 0 0 12 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.807 110.7 60.7 -77.9 -27.4 28.5 0.7 206.2 346 416 A K H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.3 -1,-0.2 0.938 107.6 49.5 -59.2 -42.8 31.5 0.5 208.5 347 417 A M H X>S+ 0 0 0 -4,-2.1 4,-3.2 -5,-0.3 5,-0.5 0.944 109.6 48.9 -59.5 -52.0 28.8 -0.1 211.2 348 418 A Y H X>S+ 0 0 7 -4,-1.8 5,-1.6 1,-0.2 4,-1.5 0.910 112.3 49.7 -53.5 -45.8 27.1 -2.8 209.1 349 419 A L H <5S+ 0 0 4 -4,-2.9 -1,-0.2 4,-0.3 -2,-0.2 0.866 118.7 38.5 -63.4 -36.2 30.5 -4.5 208.6 350 420 A I H <5S+ 0 0 9 -4,-2.1 -2,-0.2 -5,-0.2 -340,-0.2 0.895 124.8 30.7 -82.8 -47.0 31.3 -4.4 212.3 351 421 A Y H <5S+ 0 0 25 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.1 0.771 141.1 10.0 -87.9 -30.4 28.1 -5.1 214.1 352 422 A Y T < - 0 0 57 -6,-1.2 3,-0.7 1,-0.1 4,-0.4 0.140 28.7 -82.3 -49.8 170.3 26.3 -7.7 206.4 355 425 A A T 3 S+ 0 0 78 1,-0.2 -1,-0.1 2,-0.1 -6,-0.0 -0.594 112.2 12.3 -82.5 141.3 26.9 -8.5 202.7 356 426 A D T 3> S+ 0 0 104 -2,-0.3 4,-3.2 -3,-0.1 -1,-0.2 0.450 91.9 125.5 73.1 0.8 28.8 -5.9 200.5 357 427 A S H <> S+ 0 0 3 -3,-0.7 4,-2.8 2,-0.2 5,-0.2 0.972 75.0 37.2 -53.3 -64.1 29.7 -4.1 203.7 358 428 A L H > S+ 0 0 40 -4,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.875 116.0 55.9 -60.0 -33.7 33.4 -4.0 203.2 359 429 A L H > S+ 0 0 113 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.922 110.3 44.9 -63.3 -41.6 32.8 -3.5 199.5 360 430 A K H X S+ 0 0 56 -4,-3.2 4,-2.6 2,-0.2 5,-0.3 0.885 110.6 53.7 -67.1 -42.7 30.7 -0.4 200.4 361 431 A V H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.939 109.7 47.9 -58.3 -47.0 33.2 0.8 203.0 362 432 A I H X S+ 0 0 22 -4,-2.7 4,-1.7 -5,-0.2 -1,-0.2 0.860 111.2 54.2 -62.3 -34.2 35.9 0.7 200.3 363 433 A H H X S+ 0 0 98 -4,-1.5 4,-2.6 -5,-0.2 -2,-0.2 0.971 113.5 36.5 -63.7 -58.5 33.5 2.5 197.9 364 434 A Y H X S+ 0 0 35 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.790 111.8 62.0 -67.8 -27.6 32.8 5.5 200.1 365 435 A S H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.931 110.9 40.0 -60.3 -45.1 36.4 5.5 201.4 366 436 A K H X S+ 0 0 92 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.883 109.9 57.7 -71.6 -40.1 37.3 6.1 197.7 367 437 A V H X S+ 0 0 38 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.917 109.4 48.7 -55.2 -41.9 34.5 8.6 197.1 368 438 A I H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 5,-0.3 0.973 109.8 47.4 -62.2 -56.7 36.0 10.5 200.0 369 439 A I H X S+ 0 0 18 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.871 112.5 55.6 -52.4 -36.2 39.6 10.5 198.8 370 440 A S H X S+ 0 0 48 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.985 104.1 49.2 -59.3 -62.1 38.0 11.5 195.5 371 441 A L H < S+ 0 0 23 -4,-2.6 4,-0.2 1,-0.2 -1,-0.2 0.798 117.2 42.2 -49.0 -37.6 36.2 14.6 196.7 372 442 A I H >< S+ 0 0 1 -4,-1.9 3,-1.8 2,-0.2 4,-0.4 0.934 114.6 50.2 -75.9 -48.6 39.3 15.9 198.5 373 443 A V H >X S+ 0 0 42 -4,-2.8 3,-0.8 -5,-0.3 4,-0.7 0.781 103.5 61.3 -60.1 -29.2 41.6 14.9 195.6 374 444 A N T 3< S+ 0 0 73 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.600 91.9 68.3 -76.2 -9.4 39.3 16.7 193.2 375 445 A N T X4>S+ 0 0 16 -3,-1.8 5,-1.9 -5,-0.2 3,-0.6 0.676 93.8 52.9 -85.0 -16.7 39.8 20.0 194.9 376 446 A F G X45S+ 0 0 59 -3,-0.8 3,-1.2 -4,-0.4 -1,-0.2 0.815 103.6 63.1 -79.5 -30.3 43.5 20.4 193.9 377 447 A H G 3<5S+ 0 0 136 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.1 0.080 109.1 37.7 -78.3 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79.5-146.5 -93.6 95.7 42.0 -8.9 208.0 408 478 A E + 0 0 101 -2,-0.9 2,-0.2 -3,-0.2 -3,-0.1 -0.289 32.3 150.3 -63.6 144.7 44.4 -9.1 205.1 409 479 A S > - 0 0 39 -5,-0.1 4,-2.3 1,-0.0 5,-0.1 -0.797 43.0-143.0-173.5 130.9 43.1 -7.9 201.7 410 480 A A H > S+ 0 0 79 -2,-0.2 4,-0.9 2,-0.2 5,-0.1 0.688 103.7 59.2 -76.0 -17.4 45.1 -6.4 198.8 411 481 A A H > S+ 0 0 50 2,-0.2 4,-2.3 1,-0.1 3,-0.2 0.940 111.9 38.1 -71.8 -49.5 42.1 -4.1 198.1 412 482 A V H > S+ 0 0 1 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.882 111.5 60.6 -66.1 -41.3 42.3 -2.6 201.6 413 483 A K H < S+ 0 0 124 -4,-2.3 4,-0.5 1,-0.2 -1,-0.2 0.799 110.5 41.6 -57.7 -30.6 46.1 -2.7 201.4 414 484 A Q H >X S+ 0 0 95 -4,-0.9 4,-2.5 -3,-0.2 3,-0.7 0.892 111.9 53.1 -83.4 -45.1 45.9 -0.4 198.4 415 485 A L H 3X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.3 5,-0.2 0.919 107.2 54.2 -54.2 -44.6 43.2 1.8 199.8 416 486 A L H 3X S+ 0 0 26 -4,-3.4 4,-2.4 1,-0.2 -1,-0.3 0.794 106.4 51.9 -61.8 -28.4 45.4 2.2 202.9 417 487 A V H <> S+ 0 0 58 -3,-0.7 4,-2.3 -4,-0.5 -1,-0.2 0.944 109.1 48.9 -73.0 -46.3 48.1 3.4 200.6 418 488 A D H X S+ 0 0 42 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.893 116.1 43.7 -57.5 -43.1 45.9 6.0 199.0 419 489 A L H X S+ 0 0 0 -4,-2.6 4,-3.2 2,-0.2 -1,-0.2 0.910 109.3 55.6 -70.9 -43.3 44.8 7.2 202.4 420 490 A T H X S+ 0 0 66 -4,-2.4 4,-1.4 -5,-0.2 -2,-0.2 0.895 112.7 44.0 -56.7 -39.5 48.3 7.2 203.8 421 491 A E H < S+ 0 0 104 -4,-2.3 3,-0.5 2,-0.2 -2,-0.2 0.994 112.9 49.5 -65.9 -62.3 49.4 9.4 201.0 422 492 A L H >X S+ 0 0 8 -4,-2.5 3,-1.2 1,-0.2 4,-0.8 0.828 104.4 62.6 -43.9 -44.2 46.3 11.7 201.2 423 493 A T H >< S+ 0 0 2 -4,-3.2 2,-1.8 1,-0.3 3,-1.5 0.957 102.6 46.8 -49.5 -61.2 46.9 12.1 204.9 424 494 A A T 3< S+ 0 0 67 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.1 -0.183 112.2 55.4 -78.7 47.9 50.3 13.7 204.5 425 495 A N T <4 S+ 0 0 103 -2,-1.8 -1,-0.2 -3,-1.2 -2,-0.2 0.379 70.6 118.4-149.2 -17.3 48.8 16.0 201.9 426 496 A L S << S- 0 0 7 -3,-1.5 4,-0.1 -4,-0.8 -41,-0.1 -0.278 84.7 -78.3 -55.2 143.1 45.9 17.7 203.7 427 497 A P > - 0 0 24 0, 0.0 3,-0.7 0, 0.0 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2,-0.2 4,-1.6 0.941 102.4 49.1 -78.0 -55.1 50.7 -4.8 212.1 449 519 A L H >X S+ 0 0 78 -4,-1.4 4,-3.2 1,-0.3 3,-0.5 0.898 106.9 55.6 -48.8 -50.8 54.2 -6.1 212.0 450 520 A L H 3< S+ 0 0 25 -4,-1.6 4,-0.4 1,-0.3 -1,-0.3 0.534 109.3 49.6 -63.4 -6.7 54.0 -7.1 215.7 451 521 A W H <4 S+ 0 0 27 -3,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.722 112.1 44.4-101.7 -29.7 50.9 -9.1 214.7 452 522 A D H << S+ 0 0 87 -4,-1.6 -2,-0.2 -3,-0.5 -3,-0.2 0.864 120.5 42.8 -79.4 -38.3 52.6 -10.8 211.7 453 523 A K S < S+ 0 0 148 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.1 0.994 106.4 61.8 -67.2 -76.8 55.7 -11.6 213.8 454 524 A V S S- 0 0 34 -4,-0.4 2,-0.5 -5,-0.2 11,-0.0 -0.019 81.6-118.3 -56.0 155.1 54.3 -12.7 217.1 455 525 A Q - 0 0 128 2,-0.0 -1,-0.1 10,-0.0 2,-0.1 -0.844 16.4-141.9-103.5 123.0 52.1 -15.7 217.7 456 526 A L - 0 0 43 -2,-0.5 2,-0.3 -5,-0.2 9,-0.2 -0.432 21.1-158.9 -76.2 153.3 48.6 -15.6 219.1 457 527 A L E -B 464 0B 109 7,-1.0 7,-1.3 -2,-0.1 2,-0.6 -0.964 15.7-130.9-146.9 130.4 47.5 -18.3 221.5 458 528 A D E -B 463 0B 89 -2,-0.3 5,-0.2 5,-0.2 -2,-0.0 -0.617 14.2-176.6 -77.8 114.5 44.2 -19.8 222.7 459 529 A S - 0 0 60 3,-2.7 -1,-0.2 -2,-0.6 4,-0.1 0.658 52.7-114.2 -80.9 -15.1 43.9 -20.1 226.5 460 530 A G S S+ 0 0 67 2,-0.6 3,-0.1 -3,-0.0 -2,-0.1 0.036 112.0 53.8 104.8 -25.7 40.6 -21.7 225.7 461 531 A D S S- 0 0 162 1,-0.4 2,-0.3 0, 0.0 -3,-0.1 0.654 125.4 -11.6-107.0 -31.2 38.6 -18.9 227.4 462 532 A S - 0 0 45 -5,-0.1 -3,-2.7 2,-0.0 -2,-0.6 -0.948 69.7-103.8-159.5 172.8 40.2 -16.1 225.3 463 533 A F E -B 458 0B 45 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.817 30.2-150.9-107.4 148.0 43.0 -15.3 222.9 464 534 A Y E +B 457 0B 85 -7,-1.3 -7,-1.0 -2,-0.3 3,-0.0 -0.978 24.0 151.8-127.0 131.2 46.2 -13.4 224.0 465 535 A H >> - 0 0 5 -2,-0.4 4,-1.3 -9,-0.2 3,-0.7 -0.993 47.4-123.9-152.7 151.2 48.5 -11.2 222.0 466 536 A P H 3> S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.788 114.0 55.1 -66.7 -27.9 50.9 -8.2 222.7 467 537 A V H 3> S+ 0 0 0 -17,-0.2 4,-1.0 1,-0.2 5,-0.1 0.696 102.8 59.5 -77.2 -18.6 49.1 -6.1 220.1 468 538 A F H <> S+ 0 0 33 -3,-0.7 4,-2.1 2,-0.2 -1,-0.2 0.901 108.5 40.9 -74.5 -44.2 45.9 -6.8 222.0 469 539 A K H X S+ 0 0 100 -4,-1.3 4,-3.7 2,-0.2 5,-0.3 0.980 111.2 56.1 -66.6 -55.9 47.1 -5.2 225.3 470 540 A I H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.3 -1,-0.2 0.811 110.4 46.9 -44.1 -37.3 48.8 -2.3 223.5 471 541 A L H X S+ 0 0 3 -4,-1.0 4,-0.9 2,-0.2 -1,-0.3 0.956 113.6 46.7 -70.8 -51.7 45.4 -1.5 222.0 472 542 A Q H >X S+ 0 0 94 -4,-2.1 4,-1.7 1,-0.2 3,-0.5 0.876 113.8 50.5 -56.0 -42.4 43.6 -1.9 225.3 473 543 A N H 3X S+ 0 0 15 -4,-3.7 4,-3.1 1,-0.2 5,-0.4 0.948 97.8 63.2 -64.1 -51.1 46.2 0.2 227.0 474 544 A D H 3X S+ 0 0 0 -4,-2.2 4,-0.6 -5,-0.3 -1,-0.2 0.786 110.2 44.7 -46.6 -25.6 46.1 3.1 224.4 475 545 A I H < S+ 0 0 122 -4,-1.1 3,-2.1 -5,-0.2 -1,-0.2 0.815 101.3 62.3 -87.0 -31.6 42.9 8.3 232.4 481 551 A K T 3< S+ 0 0 77 -4,-0.7 -453,-0.3 1,-0.3 -1,-0.2 0.567 105.9 52.0 -68.3 -5.4 44.2 11.5 230.8 482 552 A N T 3 S+ 0 0 11 -4,-0.4 2,-0.8 -3,-0.1 -1,-0.3 0.233 80.2 103.3-115.8 13.1 40.6 12.4 230.9 483 553 A D X - 0 0 83 -3,-2.1 3,-0.8 1,-0.1 4,-0.3 -0.863 50.6-168.5 -97.1 109.1 39.9 11.7 234.6 484 554 A E T 3> + 0 0 65 -2,-0.8 4,-2.0 1,-0.2 5,-0.2 0.471 60.5 103.7 -77.7 -0.6 39.8 15.1 236.3 485 555 A M H 3> S+ 0 0 106 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.765 80.8 49.0 -54.5 -29.4 39.8 13.5 239.8 486 556 A F H <> S+ 0 0 103 -3,-0.8 4,-1.7 2,-0.2 -1,-0.3 0.910 108.9 52.6 -77.5 -37.6 43.5 14.4 240.3 487 557 A S H > S+ 0 0 54 -4,-0.3 4,-1.6 1,-0.2 -2,-0.2 0.825 109.4 50.7 -61.4 -31.4 42.7 17.9 239.2 488 558 A L H X S+ 0 0 87 -4,-2.0 4,-0.8 1,-0.2 -1,-0.2 0.897 107.8 53.1 -70.4 -42.7 40.0 18.0 241.9 489 559 A I H < S+ 0 0 63 -4,-1.7 5,-0.4 -5,-0.2 -2,-0.2 0.795 110.7 46.6 -64.6 -28.9 42.5 16.7 244.4 490 560 A K H < S+ 0 0 112 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.839 110.5 49.9 -83.9 -34.4 44.9 19.5 243.6 491 561 A G H < S+ 0 0 68 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.588 112.4 58.0 -78.9 -9.8 42.5 22.4 243.7 492 562 A L S < S- 0 0 113 -4,-0.8 2,-0.7 3,-0.1 -3,-0.1 0.100 125.3 -27.0 -95.7-150.4 41.1 21.2 247.0 493 563 A G S S- 0 0 59 1,-0.2 -3,-0.1 -2,-0.0 -4,-0.1 0.348 81.7-128.1 -48.9 9.2 42.8 20.6 250.4 494 564 A S + 0 0 85 -2,-0.7 -1,-0.2 -5,-0.4 -4,-0.1 0.450 62.4 139.2 53.3 6.7 46.0 20.0 248.3 495 565 A L 0 0 150 1,-0.1 -3,-0.1 -6,-0.1 -1,-0.1 -0.012 360.0 360.0 -59.5-174.3 46.7 16.6 250.0 496 566 A V 0 0 142 -3,-0.1 -1,-0.1 -6,-0.0 -7,-0.1 0.569 360.0 360.0-140.0 360.0 47.9 14.2 247.3 497 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 498 587 A P 0 0 120 0, 0.0 4,-0.4 0, 0.0 -33,-0.0 0.000 360.0 360.0 360.0 48.6 50.6 -14.2 230.0 499 588 A S + 0 0 73 2,-0.2 4,-0.1 1,-0.1 0, 0.0 0.394 360.0 70.4 -97.4 0.4 53.8 -12.5 231.2 500 589 A D S >> S+ 0 0 94 2,-0.2 3,-1.5 1,-0.1 4,-1.3 0.871 98.5 48.6 -82.3 -40.2 55.8 -12.7 228.0 501 590 A F H 3> S+ 0 0 24 1,-0.3 4,-3.6 2,-0.2 5,-0.3 0.859 97.1 73.0 -64.2 -34.0 53.7 -10.2 226.2 502 591 A R H 34 S+ 0 0 169 -4,-0.4 4,-0.5 1,-0.3 -1,-0.3 0.685 103.4 41.4 -53.0 -18.3 54.2 -8.1 229.3 503 592 A T H <> S+ 0 0 65 -3,-1.5 4,-0.8 2,-0.1 -1,-0.3 0.786 115.4 49.2 -96.9 -37.4 57.7 -7.7 228.0 504 593 A I H X S+ 0 0 30 -4,-1.3 4,-1.6 2,-0.2 3,-0.3 0.911 110.7 49.3 -67.4 -48.6 56.7 -7.2 224.3 505 594 A V H >X S+ 0 0 8 -4,-3.6 4,-2.5 1,-0.2 3,-0.8 0.985 107.4 51.9 -55.3 -66.2 54.0 -4.5 225.0 506 595 A E H 3> S+ 0 0 121 -4,-0.5 4,-1.1 -5,-0.3 -1,-0.2 0.720 106.4 58.2 -44.4 -29.1 56.2 -2.3 227.2 507 596 A E H 3X S+ 0 0 114 -4,-0.8 4,-1.1 -3,-0.3 -1,-0.3 0.949 112.8 36.5 -66.5 -53.5 58.8 -2.4 224.4 508 597 A F H XX S+ 0 0 14 -4,-1.6 4,-3.5 -3,-0.8 3,-1.8 0.982 112.0 60.6 -60.3 -60.0 56.5 -0.9 221.8 509 598 A Q H 3< S+ 0 0 30 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.721 107.4 46.0 -38.9 -35.8 54.8 1.3 224.4 510 599 A S H 3< S+ 0 0 103 -4,-1.1 3,-0.3 -5,-0.3 -1,-0.3 0.774 116.7 43.5 -83.6 -28.3 58.2 3.0 224.9 511 600 A E H << S+ 0 0 137 -3,-1.8 2,-0.4 -4,-1.1 -2,-0.2 0.886 132.2 20.7 -80.6 -43.0 58.9 3.4 221.2 512 601 A Y S < S- 0 0 68 -4,-3.5 2,-0.4 -5,-0.1 -1,-0.2 -0.764 75.4-178.1-131.7 84.7 55.4 4.5 220.3 513 602 A N > - 0 0 62 -2,-0.4 3,-1.8 -3,-0.3 4,-0.1 -0.686 26.2-141.4 -82.9 131.7 53.5 5.9 223.3 514 603 A I G > S+ 0 0 0 -2,-0.4 3,-3.8 1,-0.3 4,-0.5 0.881 95.5 80.7 -61.5 -33.5 50.0 7.0 222.4 515 604 A S G 3 S+ 0 0 37 1,-0.3 3,-0.3 2,-0.2 -1,-0.3 0.656 75.5 77.1 -46.3 -14.6 50.4 9.9 224.7 516 605 A D G < S+ 0 0 77 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.684 85.9 59.4 -71.3 -18.3 52.2 11.4 221.7 517 606 A I S < S+ 0 0 0 -3,-3.8 -1,-0.2 -4,-0.1 -2,-0.2 0.832 81.2 100.9 -78.8 -34.1 48.9 12.1 220.0 518 607 A L 0 0 17 -4,-0.5 -494,-0.1 -3,-0.3 -490,-0.1 -0.171 360.0 360.0 -51.7 143.0 47.7 14.4 222.9 519 608 A S 0 0 33 -492,-0.5 -1,-0.1 -496,-0.3 -494,-0.1 -0.412 360.0 360.0-134.6 360.0 48.1 18.1 222.0