==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-JUL-08 3DWB . COMPND 2 MOLECULE: ENDOTHELIN-CONVERTING ENZYME 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.OEFNER . 661 3 4 1 3 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28464.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 459 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 20 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 304 46.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.1 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 0 2 2 2 1 3 2 2 3 1 1 1 2 1 0 0 1 2 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 0 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 PARALLEL BRIDGES PER LADDER . 3 0 2 1 0 0 1 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 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 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 1 101 A S > 0 0 105 0, 0.0 4,-3.8 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -71.7 74.6 61.2 51.2 2 102 A E H > + 0 0 145 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.763 360.0 50.0 -58.8 -24.5 77.0 60.3 54.0 3 103 A A H > S+ 0 0 33 2,-0.2 4,-2.0 3,-0.2 -1,-0.2 0.860 112.1 44.9 -79.3 -42.2 76.6 56.8 52.5 4 104 A C H > S+ 0 0 48 2,-0.2 4,-3.2 3,-0.2 -2,-0.2 0.905 115.7 49.6 -61.3 -40.1 77.4 58.2 49.0 5 105 A V H X S+ 0 0 69 -4,-3.8 4,-2.0 2,-0.2 -2,-0.2 0.879 112.1 45.3 -71.6 -42.9 80.3 60.1 50.6 6 106 A S H X S+ 0 0 58 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.872 116.2 47.8 -61.7 -40.1 81.7 57.1 52.5 7 107 A V H X S+ 0 0 51 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.893 109.6 51.9 -74.2 -40.4 81.3 55.0 49.3 8 108 A T H X S+ 0 0 0 -4,-3.2 4,-3.5 2,-0.2 5,-0.2 0.950 108.0 53.8 -52.8 -49.8 82.9 57.7 47.1 9 109 A S H X S+ 0 0 58 -4,-2.0 4,-3.7 1,-0.2 -2,-0.2 0.897 109.3 46.2 -55.6 -44.8 85.9 57.7 49.6 10 110 A S H X S+ 0 0 73 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.845 113.1 50.0 -70.4 -35.8 86.5 54.0 49.4 11 111 A I H X S+ 0 0 8 -4,-2.1 4,-0.8 2,-0.2 -2,-0.2 0.987 115.8 43.2 -57.5 -58.1 86.2 54.1 45.5 12 112 A L H >< S+ 0 0 57 -4,-3.5 3,-1.0 1,-0.2 -2,-0.2 0.884 109.8 56.3 -60.3 -45.2 88.7 57.0 45.5 13 113 A S H 3< S+ 0 0 90 -4,-3.7 -1,-0.2 1,-0.2 -2,-0.2 0.926 107.0 51.3 -43.3 -53.9 91.0 55.3 48.1 14 114 A S H 3< S+ 0 0 19 -4,-1.9 19,-2.0 -3,-0.2 18,-1.4 0.630 96.9 83.0 -65.2 -21.5 91.3 52.2 45.9 15 115 A M << - 0 0 15 -3,-1.0 14,-0.3 -4,-0.8 13,-0.1 -0.222 65.6-141.9 -89.3 172.3 92.3 53.9 42.6 16 116 A D > - 0 0 46 12,-2.4 3,-2.4 15,-0.1 14,-0.1 -0.782 14.2-176.0-129.8 86.6 95.6 55.2 41.3 17 117 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 11,-0.1 0.680 79.7 72.9 -59.6 -16.6 94.8 58.4 39.4 18 118 A T T 3 S+ 0 0 129 -3,-0.1 2,-0.4 2,-0.1 10,-0.1 0.668 90.3 76.6 -65.0 -18.0 98.5 58.6 38.4 19 119 A V S < S- 0 0 32 -3,-2.4 -3,-0.1 8,-0.1 12,-0.0 -0.818 86.4-125.8 -99.0 138.9 97.5 55.7 36.0 20 120 A D >> - 0 0 91 -2,-0.4 3,-2.7 1,-0.1 4,-2.0 -0.725 10.9-141.2 -86.0 123.0 95.6 56.3 32.8 21 121 A P T 34 S+ 0 0 21 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.777 102.0 55.2 -54.6 -33.8 92.3 54.2 32.5 22 122 A a T 34 S+ 0 0 6 2,-0.2 630,-1.8 622,-0.2 631,-0.3 0.429 110.7 45.8 -82.0 -1.7 92.9 53.7 28.8 23 123 A H T <4 S- 0 0 120 -3,-2.7 2,-0.3 628,-0.2 -1,-0.2 0.809 139.3 -11.2-101.7 -52.3 96.3 52.2 29.4 24 124 A D X - 0 0 16 -4,-2.0 4,-1.7 627,-0.1 -1,-0.2 -0.792 59.8-174.7-152.4 105.5 95.6 49.9 32.3 25 125 A F H > S+ 0 0 0 -2,-0.3 4,-1.6 2,-0.2 5,-0.1 0.737 84.0 57.4 -77.3 -24.6 92.2 50.2 33.9 26 126 A F H > S+ 0 0 6 2,-0.2 4,-3.3 1,-0.2 5,-0.4 0.960 109.3 43.6 -71.0 -53.9 92.9 47.7 36.7 27 127 A S H > S+ 0 0 28 1,-0.2 4,-2.5 3,-0.2 5,-0.3 0.908 114.6 52.6 -50.1 -47.8 95.9 49.6 38.0 28 128 A Y H < S+ 0 0 27 -4,-1.7 -12,-2.4 1,-0.2 -1,-0.2 0.829 119.7 33.6 -56.4 -37.5 93.8 52.8 37.6 29 129 A A H < S+ 0 0 0 -4,-1.6 -2,-0.2 -14,-0.3 -1,-0.2 0.747 136.8 19.2 -92.8 -30.3 90.9 51.3 39.6 30 130 A b H X S+ 0 0 0 -4,-3.3 4,-3.4 -5,-0.1 3,-0.4 0.436 89.9 100.0-122.3 -7.0 92.9 49.1 42.1 31 131 A G H X S+ 0 0 10 -4,-2.5 4,-1.9 -5,-0.4 -16,-0.2 0.816 88.9 49.7 -59.2 -31.9 96.4 50.5 42.1 32 132 A G H > S+ 0 0 16 -18,-1.4 4,-1.9 -5,-0.3 -1,-0.3 0.881 113.8 44.9 -67.9 -41.4 95.7 52.4 45.3 33 133 A W H > S+ 0 0 38 -19,-2.0 4,-3.3 -3,-0.4 -2,-0.2 0.938 111.6 51.8 -72.9 -49.9 94.2 49.3 46.9 34 134 A I H < S+ 0 0 59 -4,-3.4 -2,-0.2 -20,-0.3 -3,-0.2 0.970 113.2 44.4 -43.3 -65.1 97.0 47.0 45.8 35 135 A K H < S+ 0 0 186 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.831 120.1 41.4 -56.7 -38.4 99.7 49.4 47.2 36 136 A A H < S+ 0 0 68 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.972 106.1 64.7 -72.3 -56.9 97.8 50.0 50.5 37 137 A N < - 0 0 56 -4,-3.3 2,-0.3 -5,-0.2 -1,-0.1 -0.579 67.5-165.5 -80.8 116.9 96.6 46.5 51.3 38 138 A P - 0 0 96 0, 0.0 570,-0.1 0, 0.0 -3,-0.0 -0.699 38.5 -93.2 -93.5 152.6 99.3 43.9 52.0 39 139 A V - 0 0 51 -2,-0.3 570,-0.1 5,-0.1 -2,-0.0 -0.535 55.3-132.2 -63.3 110.0 98.6 40.1 51.9 40 140 A P - 0 0 46 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.161 21.8 -88.1 -61.0-178.3 97.8 39.5 55.7 41 141 A D S S+ 0 0 173 1,-0.2 -2,-0.0 3,-0.0 0, 0.0 0.960 120.0 35.8 -57.5 -66.1 99.2 36.8 58.0 42 142 A G S S+ 0 0 72 2,-0.0 2,-0.3 277,-0.0 -1,-0.2 0.492 111.3 73.0 -72.9 -3.8 96.8 33.9 57.6 43 143 A H - 0 0 55 -3,-0.5 3,-0.1 1,-0.1 566,-0.0 -0.798 47.9-173.2-120.2 153.7 96.2 34.5 53.9 44 144 A S S S+ 0 0 48 1,-0.4 566,-2.7 -2,-0.3 2,-0.3 0.289 86.6 29.1-120.6 3.2 98.2 34.0 50.6 45 145 A R E S-A 609 0A 142 564,-0.3 -1,-0.4 568,-0.1 2,-0.3 -0.852 76.1-175.9-169.0 119.1 95.8 35.8 48.2 46 146 A W E +A 608 0A 34 562,-3.0 562,-2.5 -2,-0.3 2,-0.2 -0.932 21.9 103.7-136.9 153.9 93.5 38.6 49.3 47 147 A G E > S-A 607 0A 7 -2,-0.3 4,-1.7 560,-0.2 560,-0.2 -0.867 79.6 -30.7 171.9-148.1 90.8 40.7 47.9 48 148 A T H > S+ 0 0 20 556,-0.5 4,-2.3 558,-0.5 5,-0.2 0.867 132.1 45.2 -71.5 -41.3 87.0 41.2 48.0 49 149 A F H > S+ 0 0 54 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.940 113.8 48.6 -73.7 -50.4 86.1 37.5 48.5 50 150 A S H > S+ 0 0 33 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.922 114.1 49.8 -46.0 -50.4 88.7 37.0 51.2 51 151 A N H X S+ 0 0 86 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.925 112.1 42.4 -62.5 -50.8 87.4 40.1 52.9 52 152 A L H X S+ 0 0 8 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.855 107.8 60.6 -69.8 -37.1 83.7 39.4 52.9 53 153 A W H X S+ 0 0 53 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.924 106.9 46.8 -53.5 -46.7 84.1 35.7 53.9 54 154 A E H X S+ 0 0 45 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.823 107.1 56.2 -70.1 -34.4 85.8 36.9 57.2 55 155 A H H X S+ 0 0 104 -4,-1.4 4,-0.7 2,-0.2 -1,-0.2 0.929 110.6 47.0 -57.5 -45.8 83.1 39.5 57.9 56 156 A N H >X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 3,-1.2 0.913 105.1 57.8 -61.0 -49.6 80.6 36.6 57.7 57 157 A Q H >X S+ 0 0 12 -4,-2.2 4,-1.3 1,-0.3 3,-1.0 0.940 104.3 53.1 -46.7 -54.5 82.6 34.2 60.0 58 158 A A H 3X S+ 0 0 47 -4,-1.7 4,-0.9 1,-0.3 -1,-0.3 0.730 107.8 50.9 -55.8 -26.6 82.5 36.8 62.7 59 159 A I H - 0 0 18 -2,-0.3 4,-4.9 1,-0.1 5,-0.3 -0.141 42.2 -98.7 -76.8 166.5 66.0 24.0 65.8 73 173 A E H > S+ 0 0 72 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.935 126.3 45.2 -42.5 -58.2 67.5 20.5 66.2 74 174 A A H > S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.913 117.8 42.4 -60.3 -47.9 69.6 21.1 63.1 75 175 A E H > S+ 0 0 17 1,-0.2 4,-1.7 2,-0.2 3,-0.4 0.906 113.7 53.3 -64.1 -42.2 70.6 24.6 64.3 76 176 A R H X S+ 0 0 114 -4,-4.9 4,-2.0 1,-0.2 -2,-0.2 0.836 104.9 56.2 -58.8 -34.8 71.1 23.2 67.8 77 177 A K H X S+ 0 0 31 -4,-2.6 4,-2.5 -5,-0.3 -1,-0.2 0.816 104.8 51.0 -70.3 -31.7 73.4 20.5 66.4 78 178 A A H X S+ 0 0 0 -4,-1.2 4,-2.2 -3,-0.4 -1,-0.2 0.879 107.7 52.7 -70.3 -41.0 75.7 23.1 64.8 79 179 A Q H X S+ 0 0 1 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.931 113.1 45.2 -56.5 -46.8 75.9 25.0 68.2 80 180 A V H X S+ 0 0 32 -4,-2.0 4,-2.7 1,-0.2 339,-0.3 0.893 111.5 51.0 -63.7 -46.0 76.9 21.6 69.7 81 181 A Y H X S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.871 113.9 47.2 -56.2 -37.8 79.4 20.9 66.9 82 182 A Y H X S+ 0 0 5 -4,-2.2 4,-2.5 2,-0.2 3,-0.4 0.982 112.4 45.2 -72.1 -59.3 80.8 24.3 67.5 83 183 A R H X S+ 0 0 115 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.935 110.9 57.1 -48.0 -50.7 81.1 24.2 71.3 84 184 A A H < S+ 0 0 0 -4,-2.7 337,-0.5 1,-0.2 -1,-0.2 0.873 112.2 39.1 -51.6 -44.8 82.6 20.7 71.0 85 185 A c H < S+ 0 0 0 -4,-1.6 -1,-0.2 -3,-0.4 -2,-0.2 0.823 113.2 55.7 -77.0 -31.1 85.5 21.9 68.7 86 186 A M H < S+ 0 0 49 -4,-2.5 2,-1.7 1,-0.2 -2,-0.2 0.715 86.1 85.9 -73.0 -24.5 86.0 25.1 70.7 87 187 A N < + 0 0 50 -4,-2.1 4,-0.5 -5,-0.2 334,-0.2 -0.625 51.1 154.9 -76.2 89.5 86.4 23.0 73.9 88 188 A E > + 0 0 67 -2,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.443 58.8 75.7-102.8 -6.4 90.2 22.5 73.3 89 189 A T H > S+ 0 0 116 2,-0.2 4,-0.6 -3,-0.2 -1,-0.2 0.872 104.3 44.0 -59.1 -38.2 91.0 22.0 76.9 90 190 A R H > S+ 0 0 72 2,-0.2 4,-0.9 1,-0.2 -2,-0.2 0.836 109.3 55.0 -71.6 -36.2 89.4 18.7 76.0 91 191 A I H > S+ 0 0 14 -4,-0.5 4,-1.3 1,-0.2 -2,-0.2 0.798 106.7 49.6 -74.0 -31.0 91.3 18.3 72.7 92 192 A E H < S+ 0 0 77 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.703 107.6 57.1 -75.3 -22.6 94.7 18.7 74.4 93 193 A E H < S+ 0 0 133 -4,-0.6 -2,-0.2 1,-0.1 -1,-0.2 0.693 109.5 44.4 -78.9 -22.3 93.6 16.1 76.9 94 194 A L H >< S+ 0 0 45 -4,-0.9 3,-1.1 1,-0.1 -2,-0.2 0.783 82.2 172.5 -91.0 -32.2 92.9 13.5 74.1 95 195 A R T 3< - 0 0 127 -4,-1.3 4,-0.3 1,-0.2 -1,-0.1 -0.177 68.6 -25.4 53.0-145.7 96.1 14.0 72.0 96 196 A A T 3> S+ 0 0 4 95,-0.2 4,-3.9 1,-0.2 3,-0.5 0.646 112.7 101.3 -70.5 -15.4 96.5 11.6 69.1 97 197 A K H <> S+ 0 0 116 -3,-1.1 4,-2.8 1,-0.2 5,-0.3 0.798 75.2 54.0 -40.6 -46.5 94.5 8.9 70.9 98 198 A P H > S+ 0 0 24 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.957 123.6 25.4 -59.4 -52.3 91.3 9.5 68.9 99 199 A L H > S+ 0 0 2 -3,-0.5 4,-2.5 -4,-0.3 -2,-0.2 0.889 120.6 57.2 -74.6 -46.8 92.9 9.0 65.5 100 200 A M H < S+ 0 0 70 -4,-3.9 4,-0.4 1,-0.2 -3,-0.2 0.809 113.7 42.5 -52.4 -35.4 95.7 6.8 66.9 101 201 A E H >X S+ 0 0 129 -4,-2.8 3,-1.5 -5,-0.4 4,-1.5 0.929 108.2 57.4 -71.3 -57.2 92.8 4.6 68.2 102 202 A L H 3X S+ 0 0 16 -4,-2.5 4,-1.3 -5,-0.3 -2,-0.2 0.865 99.9 60.9 -41.4 -50.1 90.7 4.7 65.0 103 203 A I H 3<>S+ 0 0 7 -4,-2.5 5,-2.9 1,-0.2 4,-0.5 0.836 102.6 49.1 -44.6 -42.8 93.5 3.3 63.0 104 204 A E H X45S+ 0 0 99 -3,-1.5 3,-0.8 -4,-0.4 -1,-0.2 0.880 103.1 58.7 -79.4 -35.6 93.7 0.1 64.9 105 205 A R H 3<5S+ 0 0 201 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.846 109.3 48.1 -54.1 -33.0 90.0 -0.6 64.7 106 206 A L T 3<5S- 0 0 22 -4,-1.3 -1,-0.3 20,-0.0 -2,-0.3 0.634 136.0 -92.9 -81.7 -16.6 90.9 -0.4 61.0 107 207 A G T < 5 - 0 0 8 -3,-0.8 -3,-0.3 -4,-0.5 -2,-0.1 0.468 56.7-108.7 116.6 6.1 93.8 -2.8 61.5 108 208 A G < - 0 0 1 -5,-2.9 2,-0.3 -6,-0.1 5,-0.1 -0.119 31.1-103.8 78.8-171.8 96.8 -0.5 62.1 109 209 A W B > -B 112 0B 2 3,-0.9 3,-4.3 5,-0.1 180,-0.1 -0.978 29.9 -98.4-156.9 153.1 99.8 0.4 59.8 110 210 A N T 3 S+ 0 0 54 1,-0.3 3,-0.3 -2,-0.3 5,-0.1 0.568 117.5 70.8 -50.6 -13.8 103.5 -0.5 59.6 111 211 A I T 3 S+ 0 0 9 1,-0.3 -1,-0.3 3,-0.1 2,-0.2 0.694 99.0 55.4 -71.8 -18.8 104.2 2.9 61.3 112 212 A T B < S-B 109 0B 30 -3,-4.3 -3,-0.9 1,-0.3 -1,-0.3 -0.793 131.1 -75.7-147.2 98.3 102.8 1.1 64.4 113 213 A G S S- 0 0 43 -3,-0.3 -1,-0.3 -2,-0.2 2,-0.1 0.149 90.0 -10.1-102.8 -82.1 104.6 -1.3 64.4 114 214 A P - 0 0 119 0, 0.0 2,-0.3 0, 0.0 -5,-0.1 -0.411 58.7-167.3 -73.5 160.6 104.6 -4.4 62.1 115 215 A W + 0 0 28 -5,-0.1 2,-0.2 -2,-0.1 173,-0.1 -0.948 21.0 151.9-153.7 130.1 101.6 -4.9 59.8 116 216 A A + 0 0 93 -2,-0.3 2,-0.3 171,-0.1 -7,-0.0 -0.617 22.8 134.6-162.6 96.4 100.6 -8.0 57.7 117 217 A K - 0 0 99 -2,-0.2 2,-1.1 0, 0.0 3,-0.1 -0.990 55.3-127.6-147.5 151.1 96.9 -8.7 56.8 118 218 A D S S+ 0 0 137 -2,-0.3 4,-0.1 1,-0.2 3,-0.1 -0.416 72.7 116.5 -91.4 59.8 94.5 -9.7 53.9 119 219 A N > + 0 0 24 -2,-1.1 4,-2.3 1,-0.1 5,-0.3 0.047 27.3 121.4-121.4 30.0 92.2 -6.7 54.6 120 220 A F H > S+ 0 0 30 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.941 76.5 34.3 -68.9 -63.2 92.4 -4.5 51.4 121 221 A Q H > S+ 0 0 36 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.822 118.5 58.7 -67.7 -25.1 89.0 -4.0 49.8 122 222 A D H > S+ 0 0 106 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.927 110.3 37.6 -63.0 -55.2 87.6 -4.0 53.4 123 223 A T H X S+ 0 0 10 -4,-2.3 4,-2.3 2,-0.2 5,-0.3 0.812 116.1 56.3 -70.0 -28.4 89.6 -1.1 54.6 124 224 A L H X S+ 0 0 0 -4,-2.4 4,-1.6 -5,-0.3 -2,-0.2 0.960 108.7 46.6 -64.5 -48.3 89.1 0.4 51.2 125 225 A Q H X S+ 0 0 22 -4,-3.1 4,-2.2 1,-0.2 5,-0.3 0.936 113.9 48.9 -59.7 -44.1 85.4 0.1 51.7 126 226 A V H X>S+ 0 0 43 -4,-2.3 4,-3.1 1,-0.2 5,-1.1 0.955 110.0 47.0 -63.1 -54.5 85.5 1.6 55.2 127 227 A V H <5S+ 0 0 4 -4,-2.3 6,-2.4 1,-0.2 4,-0.2 0.833 116.6 46.1 -62.9 -29.8 87.6 4.7 54.5 128 228 A T H <5S+ 0 0 9 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.889 124.2 28.1 -79.8 -37.3 85.5 5.6 51.5 129 229 A A H <5S+ 0 0 7 -4,-2.2 304,-0.2 -5,-0.2 -2,-0.2 0.718 132.0 32.9 -95.2 -26.4 82.0 5.1 53.0 130 230 A H T <5S+ 0 0 86 -4,-3.1 -3,-0.2 -5,-0.3 303,-0.1 0.835 130.8 28.5-100.7 -38.9 82.7 5.8 56.6 131 231 A Y S -C 147 0C 7 6,-2.4 3,-2.3 3,-0.7 6,-0.3 -0.720 21.6-144.0 -71.2 111.7 73.7 11.6 34.9 145 245 A S T 3 S+ 0 0 8 -2,-0.7 372,-3.0 1,-0.3 3,-0.3 0.790 101.1 44.5 -47.9 -32.8 74.9 14.2 32.4 146 246 A K T 3 S+ 0 0 101 1,-0.3 -1,-0.3 370,-0.2 370,-0.1 0.392 126.6 28.5 -97.9 4.3 73.0 12.3 29.6 147 247 A N E X S-C 144 0C 85 -3,-2.3 3,-2.2 3,-0.2 -3,-0.7 -0.509 70.9-175.3-163.5 73.2 69.8 11.8 31.6 148 248 A S E 3 S+ 0 0 8 -3,-0.3 -3,-0.1 1,-0.3 -5,-0.1 0.539 76.2 67.8 -59.4 -15.2 69.5 14.7 34.1 149 249 A N E 3 S+ 0 0 128 294,-0.1 2,-0.3 -6,-0.1 -1,-0.3 0.442 99.7 61.2 -83.6 -1.7 66.4 13.4 35.9 150 250 A S E < S- 0 0 51 -3,-2.2 -6,-2.4 -6,-0.3 2,-0.3 -0.908 73.5-136.6-119.8 154.0 68.5 10.4 37.3 151 251 A N E -C 143 0C 20 291,-0.6 2,-0.3 289,-0.5 -8,-0.2 -0.673 25.9-171.3 -94.2 156.2 71.5 10.1 39.5 152 252 A V E -C 142 0C 3 -10,-2.0 -10,-1.4 -2,-0.3 2,-0.2 -0.978 29.9 -97.8-143.7 155.8 74.3 7.7 38.7 153 253 A I E -Cd 141 267C 0 113,-0.8 115,-2.8 -2,-0.3 2,-0.4 -0.479 41.1-164.9 -67.6 139.1 77.5 6.2 40.2 154 254 A Q E -Cd 140 268C 2 -14,-2.1 -14,-1.8 113,-0.2 2,-0.4 -0.994 11.2-163.8-136.1 130.0 80.6 8.0 39.0 155 255 A V E +Cd 139 269C 0 113,-2.4 115,-1.3 -2,-0.4 2,-0.3 -0.973 23.2 159.6-115.8 133.4 84.1 6.9 39.4 156 256 A D E -C 138 0C 33 -18,-2.2 -18,-2.1 -2,-0.4 2,-0.1 -0.867 42.4 -75.0-141.3 176.0 86.9 9.6 38.8 157 257 A Q + 0 0 29 -2,-0.3 2,-0.3 -20,-0.2 -20,-0.2 -0.411 62.5 124.9 -74.9 152.5 90.5 10.2 39.6 158 258 A S + 0 0 25 -22,-0.5 -22,-0.2 -2,-0.1 -20,-0.1 -0.973 13.4 106.9-177.4-173.9 91.6 11.1 43.1 159 259 A G + 0 0 9 -2,-0.3 2,-0.5 1,-0.3 -23,-0.1 0.576 46.1 134.1 99.8 14.0 93.9 10.3 46.1 160 260 A L - 0 0 41 2,-0.1 -1,-0.3 1,-0.1 5,-0.0 -0.853 44.2-154.9 -96.1 124.1 96.6 13.1 45.9 161 261 A G S S+ 0 0 13 -2,-0.5 -1,-0.1 2,-0.0 50,-0.0 0.388 78.4 72.1 -79.1 2.8 97.5 14.8 49.2 162 262 A L S S- 0 0 8 159,-0.0 -2,-0.1 1,-0.0 6,-0.0 -0.852 94.5-112.3-109.3 157.2 98.6 17.9 47.3 163 263 A P S S+ 0 0 92 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 0.534 95.5 19.8 -59.4 -13.2 96.2 20.4 45.5 164 264 A S S > S- 0 0 24 1,-0.0 3,-1.3 0, 0.0 4,-0.5 -0.965 71.0-121.2-166.6 137.3 97.4 19.4 42.0 165 265 A R T 3> S+ 0 0 52 -2,-0.3 4,-0.7 1,-0.2 3,-0.5 0.668 106.0 67.4 -51.2 -26.1 99.2 16.7 40.1 166 266 A D H 3>>S+ 0 0 47 1,-0.2 4,-2.6 2,-0.2 5,-1.1 0.695 85.4 66.6 -78.8 -22.3 102.0 19.1 38.9 167 267 A Y H <45S+ 0 0 22 -3,-1.3 -1,-0.2 1,-0.2 10,-0.2 0.817 106.6 44.8 -62.0 -31.2 103.4 19.7 42.5 168 268 A Y H 45S+ 0 0 4 -3,-0.5 -1,-0.2 -4,-0.5 -2,-0.2 0.779 126.9 29.2 -78.4 -28.4 104.5 16.0 42.3 169 269 A L H <5S+ 0 0 46 -4,-0.7 4,-0.3 2,-0.1 -2,-0.2 0.876 126.8 33.3-106.4 -54.9 105.8 16.3 38.7 170 270 A N T >X5S+ 0 0 48 -4,-2.6 3,-2.7 1,-0.2 4,-1.0 0.998 111.3 59.8 -63.5 -65.5 107.0 19.9 38.1 171 271 A K T 34 + 0 0 109 1,-0.2 4,-1.5 -3,-0.1 3,-0.4 -0.556 54.8 148.4 -98.0 77.2 110.8 21.2 46.7 177 277 A V H > S+ 0 0 6 -2,-1.5 4,-1.5 1,-0.2 -1,-0.2 0.569 79.8 71.9 -66.9 -11.1 107.3 21.4 48.2 178 278 A L H > S+ 0 0 32 2,-0.2 4,-1.9 -3,-0.2 -1,-0.2 0.872 94.7 47.1 -70.3 -40.2 108.3 17.6 48.1 179 279 A T H > S+ 0 0 80 -3,-0.4 4,-3.5 2,-0.2 5,-0.2 0.971 114.8 47.5 -59.9 -50.4 110.7 18.2 51.0 180 280 A G H X S+ 0 0 14 -4,-1.5 4,-1.5 1,-0.3 -2,-0.2 0.781 114.3 46.2 -63.1 -28.9 108.0 20.2 52.8 181 281 A Y H X S+ 0 0 0 -4,-1.5 4,-1.5 2,-0.2 -1,-0.3 0.765 112.6 48.9 -85.6 -26.9 105.4 17.5 52.2 182 282 A L H X S+ 0 0 31 -4,-1.9 4,-3.1 2,-0.2 -2,-0.2 0.945 111.0 51.7 -77.3 -48.1 107.7 14.6 53.2 183 283 A N H X S+ 0 0 58 -4,-3.5 4,-2.7 1,-0.2 5,-0.3 0.949 109.2 49.5 -37.3 -66.2 108.6 16.5 56.4 184 284 A Y H X S+ 0 0 12 -4,-1.5 4,-1.9 1,-0.3 -1,-0.2 0.834 112.3 48.6 -50.6 -40.2 104.9 17.0 57.2 185 285 A M H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 -1,-0.3 0.926 111.8 49.8 -63.1 -45.6 104.3 13.3 56.6 186 286 A V H X S+ 0 0 3 -4,-3.1 4,-1.5 2,-0.2 -2,-0.2 0.936 110.6 47.6 -60.2 -50.8 107.3 12.4 58.8 187 287 A Q H X S+ 0 0 52 -4,-2.7 4,-2.4 1,-0.3 -1,-0.2 0.887 112.6 48.2 -62.9 -42.9 106.2 14.6 61.8 188 288 A L H X S+ 0 0 0 -4,-1.9 4,-0.9 -5,-0.3 -1,-0.3 0.821 106.6 59.2 -65.0 -29.6 102.7 13.3 61.7 189 289 A G H <>S+ 0 0 0 -4,-1.8 5,-0.6 2,-0.2 -2,-0.2 0.847 108.2 46.0 -62.8 -34.9 104.2 9.8 61.5 190 290 A K H >X5S+ 0 0 90 -4,-1.5 3,-2.2 3,-0.2 4,-0.8 0.965 106.3 56.2 -67.5 -54.5 105.9 10.8 64.8 191 291 A L H 3<5S+ 0 0 16 -4,-2.4 -95,-0.2 1,-0.3 -1,-0.2 0.670 107.6 52.2 -54.7 -20.5 102.7 12.2 66.5 192 292 A L T 3<5S- 0 0 6 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.1 -0.118 133.1 -81.3-113.8 30.1 101.0 8.9 65.8 193 293 A G T <45S+ 0 0 37 -3,-2.2 -3,-0.2 2,-0.1 -2,-0.2 0.868 82.4 135.5 82.8 44.5 103.6 6.6 67.4 194 294 A G << - 0 0 12 -4,-0.8 -4,-0.2 -5,-0.6 5,-0.2 0.451 33.9-174.4-102.6 -4.9 106.3 6.2 64.8 195 295 A G + 0 0 60 -5,-0.4 -1,-0.2 -6,-0.1 2,-0.1 -0.197 53.6 48.7 51.3-117.8 109.4 6.7 67.0 196 296 A D >> - 0 0 107 1,-0.1 3,-2.0 2,-0.1 4,-1.7 -0.316 66.4-143.6 -66.7 126.1 112.6 6.7 65.0 197 297 A E H 3> S+ 0 0 85 1,-0.3 4,-3.3 2,-0.2 -1,-0.1 0.828 103.1 63.1 -51.7 -37.7 112.9 9.0 62.0 198 298 A E H 34 S+ 0 0 146 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.718 108.6 42.6 -58.8 -25.7 115.0 6.3 60.3 199 299 A A H <> S+ 0 0 46 -3,-2.0 4,-0.8 -5,-0.2 -2,-0.2 0.774 120.4 40.0 -90.6 -34.8 112.0 4.1 60.6 200 300 A I H X S+ 0 0 0 -4,-1.7 4,-3.1 2,-0.1 5,-0.3 0.927 104.7 64.6 -77.0 -52.6 109.4 6.7 59.5 201 301 A R H X S+ 0 0 98 -4,-3.3 4,-1.7 1,-0.2 -3,-0.1 0.854 106.3 41.9 -40.0 -58.0 111.3 8.5 56.7 202 302 A P H > S+ 0 0 52 0, 0.0 4,-2.4 0, 0.0 3,-0.3 0.941 116.2 47.9 -59.1 -52.2 111.5 5.4 54.3 203 303 A Q H X S+ 0 0 27 -4,-0.8 4,-1.4 1,-0.2 -2,-0.2 0.948 115.1 44.9 -51.7 -53.2 107.9 4.3 55.0 204 304 A M H X S+ 0 0 0 -4,-3.1 4,-1.3 1,-0.2 -1,-0.2 0.730 109.8 56.8 -69.5 -24.5 106.6 7.8 54.4 205 305 A Q H X S+ 0 0 68 -4,-1.7 4,-2.9 -5,-0.3 -1,-0.2 0.891 102.2 54.5 -69.6 -44.5 108.8 8.2 51.3 206 306 A Q H X S+ 0 0 86 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.872 106.7 51.9 -58.7 -36.0 107.3 5.1 49.7 207 307 A I H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.893 109.5 50.2 -65.4 -39.5 103.8 6.7 50.2 208 308 A L H X S+ 0 0 13 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.947 110.0 49.4 -62.9 -50.0 105.2 9.8 48.4 209 309 A D H X S+ 0 0 93 -4,-2.9 4,-1.7 1,-0.2 3,-0.4 0.910 113.8 46.2 -51.4 -50.2 106.6 7.7 45.5 210 310 A F H X S+ 0 0 13 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.863 109.4 54.7 -62.7 -38.2 103.2 5.9 45.2 211 311 A E H X S+ 0 0 1 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.781 106.6 52.3 -67.5 -26.2 101.4 9.3 45.4 212 312 A T H X S+ 0 0 36 -4,-1.5 4,-1.6 -3,-0.4 -2,-0.2 0.852 106.9 50.8 -79.2 -38.4 103.5 10.5 42.5 213 313 A A H X S+ 0 0 32 -4,-1.7 4,-3.2 2,-0.3 5,-0.3 0.914 106.4 55.8 -59.2 -46.2 102.6 7.5 40.3 214 314 A L H X S+ 0 0 2 -4,-2.3 4,-1.1 1,-0.2 -2,-0.2 0.938 112.1 43.2 -45.4 -49.5 99.0 8.3 41.2 215 315 A A H < S+ 0 0 0 -4,-1.4 -2,-0.3 2,-0.2 -1,-0.2 0.736 110.9 54.8 -70.9 -28.4 99.9 11.8 39.8 216 316 A N H < S+ 0 0 111 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.876 114.4 40.1 -68.1 -43.4 101.8 10.2 36.8 217 317 A I H < S+ 0 0 18 -4,-3.2 -2,-0.2 -5,-0.1 -1,-0.2 0.653 99.3 101.8 -74.8 -22.7 98.6 8.2 35.9 218 318 A T S < S- 0 0 12 -4,-1.1 -3,-0.1 -5,-0.3 -4,-0.0 -0.157 76.0-116.7 -67.5 160.7 96.4 11.2 36.7 219 319 A I - 0 0 31 2,-0.0 -54,-0.1 5,-0.0 -1,-0.1 -0.903 22.4-115.6-111.3 126.7 95.0 13.3 33.8 220 320 A P > - 0 0 33 0, 0.0 3,-2.0 0, 0.0 4,-0.1 -0.314 28.2-119.1 -59.4 136.4 95.9 16.9 33.2 221 321 A Q G > S+ 0 0 135 1,-0.3 3,-0.8 2,-0.2 -2,-0.0 0.578 111.7 66.1 -62.3 -10.7 92.8 19.2 33.5 222 322 A E G > S+ 0 0 108 1,-0.2 3,-0.9 2,-0.2 4,-0.3 0.865 100.1 50.8 -72.8 -37.5 93.2 20.3 29.9 223 323 A K G < S+ 0 0 149 -3,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.176 110.4 55.9 -78.5 17.0 92.5 16.7 28.8 224 324 A R G < S+ 0 0 29 -3,-0.8 -1,-0.2 -4,-0.1 -2,-0.2 0.029 77.7 90.1-139.3 28.2 89.4 17.0 31.1 225 325 A R S < S+ 0 0 44 -3,-0.9 2,-0.7 1,-0.2 -2,-0.1 0.933 72.4 68.1 -84.8 -52.5 87.5 20.1 29.9 226 326 A D >> - 0 0 50 -4,-0.3 4,-1.0 1,-0.2 3,-0.7 -0.609 57.6-171.4 -88.7 107.7 85.1 18.6 27.4 227 327 A E H >> S+ 0 0 28 -2,-0.7 4,-2.7 1,-0.3 3,-0.8 0.894 82.1 63.5 -67.3 -45.6 82.4 16.4 29.0 228 328 A E H 34 S+ 0 0 63 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.858 110.8 41.1 -42.0 -40.7 81.0 15.0 25.7 229 329 A L H <4 S+ 0 0 126 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.673 120.9 39.2 -88.2 -21.9 84.4 13.4 25.1 230 330 A I H << S+ 0 0 19 -4,-1.0 2,-0.6 -3,-0.8 -2,-0.2 0.496 86.1 103.9-106.5 -11.7 85.2 12.2 28.6 231 331 A Y < + 0 0 9 -4,-2.7 2,-0.4 -5,-0.2 39,-0.1 -0.651 45.9 170.3 -68.4 117.9 81.8 11.0 29.6 232 332 A H E -E 269 0C 62 37,-0.8 37,-3.5 -2,-0.6 2,-0.5 -0.944 17.6-160.4-134.4 113.4 81.9 7.1 29.4 233 333 A K E +E 268 0C 89 -2,-0.4 2,-0.3 35,-0.2 35,-0.2 -0.823 18.2 170.5 -91.9 129.6 79.1 5.1 30.7 234 334 A V E -E 267 0C 6 33,-2.5 33,-2.8 -2,-0.5 2,-0.1 -0.941 32.9-112.6-131.4 155.5 79.8 1.4 31.4 235 335 A T E > -E 266 0C 47 -2,-0.3 4,-2.7 31,-0.2 5,-0.2 -0.433 35.5-108.6 -75.4 162.8 78.0 -1.4 33.2 236 336 A A H > S+ 0 0 1 29,-1.1 4,-1.2 27,-0.5 28,-0.2 0.757 125.1 55.0 -64.7 -23.4 79.3 -2.8 36.4 237 337 A A H > S+ 0 0 38 26,-1.6 4,-1.3 28,-0.2 -1,-0.2 0.885 108.7 46.6 -72.7 -41.7 80.2 -5.9 34.4 238 338 A E H > S+ 0 0 103 25,-0.3 4,-2.2 1,-0.2 -2,-0.2 0.886 110.6 53.0 -63.3 -38.7 82.2 -3.6 32.0 239 339 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.871 104.8 56.6 -63.8 -33.6 83.8 -1.9 35.0 240 340 A Q H < S+ 0 0 58 -4,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.854 111.0 40.9 -71.5 -36.8 84.9 -5.3 36.4 241 341 A T H < S+ 0 0 113 -4,-1.3 -1,-0.2 1,-0.1 -2,-0.2 0.887 115.6 53.2 -70.1 -41.0 86.8 -6.2 33.2 242 342 A L H < S+ 0 0 22 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.2 0.881 127.8 17.0 -62.0 -46.1 88.2 -2.6 32.9 243 343 A A S >< S+ 0 0 0 -4,-2.6 3,-0.6 -5,-0.1 -1,-0.3 -0.747 70.6 171.2-131.1 82.2 89.6 -2.6 36.4 244 344 A P T 3 + 0 0 74 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.651 63.0 80.8 -67.0 -16.8 89.8 -6.2 37.7 245 345 A A T 3 S+ 0 0 18 31,-0.1 2,-0.3 2,-0.1 -5,-0.1 0.894 89.4 56.3 -61.9 -44.3 91.8 -5.3 40.9 246 346 A I S < S- 0 0 1 -3,-0.6 2,-1.2 -6,-0.0 -3,-0.1 -0.688 84.4-133.1 -83.8 140.0 88.6 -4.2 42.8 247 347 A N > - 0 0 86 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 -0.817 32.3-171.0 -87.8 93.3 85.8 -6.7 43.1 248 348 A W H > + 0 0 1 -2,-1.2 4,-3.7 2,-0.2 5,-0.4 0.883 68.6 53.4 -66.6 -47.0 83.2 -4.1 42.0 249 349 A L H > S+ 0 0 42 1,-0.2 4,-2.6 2,-0.2 12,-0.2 0.941 116.0 42.0 -60.4 -46.2 79.7 -5.7 42.6 250 350 A P H > S+ 0 0 55 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.930 117.2 49.7 -57.3 -44.7 80.6 -6.5 46.2 251 351 A F H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 5,-0.2 0.940 115.0 41.4 -60.1 -52.8 82.3 -3.1 46.6 252 352 A L H X S+ 0 0 0 -4,-3.7 4,-2.9 1,-0.2 5,-0.2 0.951 112.1 55.5 -62.0 -49.1 79.4 -1.1 45.2 253 353 A N H < S+ 0 0 48 -4,-2.6 -1,-0.2 -5,-0.4 -2,-0.2 0.783 111.2 46.5 -56.8 -30.1 76.8 -3.3 47.0 254 354 A T H < S+ 0 0 69 -4,-1.7 3,-0.4 -3,-0.2 -1,-0.2 0.906 117.8 37.4 -81.4 -39.2 78.6 -2.4 50.3 255 355 A I H < S+ 0 0 4 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.738 121.6 45.7 -85.0 -20.3 79.1 1.4 49.9 256 356 A F S >< S+ 0 0 1 -4,-2.9 3,-2.8 -5,-0.2 -1,-0.2 0.287 93.4 163.2-101.7 11.6 75.7 1.9 48.2 257 357 A Y T 3 + 0 0 180 -3,-0.4 3,-0.1 1,-0.4 -3,-0.1 -0.373 56.4 43.2 -55.2 142.5 73.8 -0.3 50.7 258 358 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.4 0, 0.0 2,-0.3 -0.917 107.5 78.9 -87.7 18.6 70.9 -0.4 51.2 259 359 A V S < S- 0 0 34 -3,-2.8 2,-0.4 -6,-0.1 -3,-0.1 -0.724 78.1-129.4 -89.7 137.7 70.6 -0.3 47.4 260 360 A E - 0 0 128 -2,-0.3 2,-0.5 -3,-0.1 -7,-0.0 -0.737 18.8-159.9 -85.1 135.2 71.3 -3.5 45.5 261 361 A I - 0 0 3 -2,-0.4 2,-0.2 -12,-0.2 -8,-0.2 -0.964 10.7-179.0-117.9 122.5 73.7 -3.4 42.6 262 362 A N > - 0 0 75 -2,-0.5 3,-2.8 -9,-0.0 -26,-0.3 -0.662 48.8 -84.9-112.0 175.0 73.7 -6.0 39.8 263 363 A E T 3 S+ 0 0 129 1,-0.3 -26,-1.6 -2,-0.2 -27,-0.5 0.703 123.6 61.7 -55.2 -22.7 75.9 -6.4 36.8 264 364 A S T 3 S+ 0 0 81 -29,-0.2 -1,-0.3 -28,-0.2 -3,-0.0 0.390 71.6 132.0 -87.6 6.8 73.8 -4.0 34.8 265 365 A E < - 0 0 11 -3,-2.8 -29,-1.1 1,-0.1 2,-0.4 -0.312 58.7-125.2 -54.8 131.0 74.4 -1.0 37.1 266 366 A P E - E 0 235C 47 0, 0.0 -113,-0.8 0, 0.0 2,-0.4 -0.724 30.1-176.0 -74.4 132.8 75.3 2.1 35.0 267 367 A I E -dE 153 234C 0 -33,-2.8 -33,-2.5 -2,-0.4 2,-0.5 -0.967 19.3-142.6-134.0 120.0 78.6 3.7 36.0 268 368 A V E -dE 154 233C 0 -115,-2.8 -113,-2.4 -2,-0.4 2,-0.4 -0.691 21.6-172.9 -79.9 126.0 79.9 7.0 34.5 269 369 A V E -dE 155 232C 1 -37,-3.5 -37,-0.8 -2,-0.5 3,-0.2 -0.983 16.4-163.1-124.5 127.9 83.7 6.7 34.2 270 370 A Y S S+ 0 0 13 -115,-1.3 2,-0.3 -2,-0.4 -114,-0.1 0.774 82.3 22.8 -91.3 -23.2 85.7 9.8 33.1 271 371 A D > - 0 0 36 -116,-0.3 4,-1.9 1,-0.1 -1,-0.3 -0.815 56.9-174.3-145.2 108.1 88.9 8.0 32.1 272 372 A K H > S+ 0 0 89 -2,-0.3 4,-2.0 -3,-0.2 5,-0.1 0.887 89.0 49.3 -59.6 -46.3 88.9 4.3 31.2 273 373 A E H > S+ 0 0 117 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.871 107.4 56.1 -70.0 -35.1 92.8 4.0 30.9 274 374 A Y H > S+ 0 0 3 2,-0.2 4,-3.1 1,-0.2 -2,-0.2 0.983 109.5 45.0 -51.9 -59.6 93.3 5.7 34.3 275 375 A L H X S+ 0 0 2 -4,-1.9 4,-2.2 1,-0.3 -2,-0.2 0.852 113.8 49.9 -59.6 -37.3 91.1 3.1 36.0 276 376 A E H X S+ 0 0 80 -4,-2.0 4,-1.9 2,-0.2 -1,-0.3 0.944 112.4 48.4 -58.8 -48.0 92.8 0.3 34.0 277 377 A Q H X S+ 0 0 63 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.843 109.3 52.6 -64.8 -37.5 96.1 1.9 35.2 278 378 A I H X S+ 0 0 3 -4,-3.1 4,-2.3 2,-0.2 -1,-0.2 0.950 107.9 51.4 -55.3 -53.9 94.9 2.0 38.8 279 379 A S H X S+ 0 0 1 -4,-2.2 4,-3.1 2,-0.2 -2,-0.2 0.887 111.8 45.1 -56.5 -45.1 94.0 -1.7 38.8 280 380 A T H X S+ 0 0 86 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.925 113.9 51.1 -63.9 -44.3 97.4 -2.7 37.5 281 381 A L H X S+ 0 0 25 -4,-2.0 4,-0.9 2,-0.2 -2,-0.2 0.766 113.4 45.7 -61.0 -32.6 98.9 -0.4 40.1 282 382 A I H >< S+ 0 0 8 -4,-2.3 3,-0.6 2,-0.2 -2,-0.2 0.960 115.0 44.7 -75.0 -56.3 96.8 -1.9 42.8 283 383 A N H 3< S+ 0 0 103 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.651 114.7 52.2 -60.3 -18.7 97.5 -5.6 41.8 284 384 A T H 3< S+ 0 0 110 -4,-1.3 -1,-0.2 -5,-0.2 2,-0.2 0.784 95.5 74.7 -93.2 -27.3 101.2 -4.8 41.4 285 385 A T S << S- 0 0 28 -4,-0.9 5,-0.0 -3,-0.6 0, 0.0 -0.558 86.3-101.5 -94.4 153.1 102.1 -3.2 44.7 286 386 A D > - 0 0 95 -2,-0.2 4,-1.4 1,-0.1 -1,-0.1 -0.209 30.4-120.2 -66.8 161.4 102.5 -4.9 48.1 287 387 A R H > S+ 0 0 140 2,-0.2 4,-3.5 1,-0.2 5,-0.2 0.849 104.7 58.9 -79.8 -37.3 99.7 -4.7 50.6 288 388 A C H > S+ 0 0 25 1,-0.3 4,-4.1 2,-0.2 5,-0.2 0.966 110.4 46.0 -57.5 -51.2 101.4 -2.9 53.5 289 389 A L H > S+ 0 0 25 2,-0.2 4,-3.0 1,-0.2 -1,-0.3 0.911 111.5 51.8 -52.5 -45.9 102.2 -0.1 51.2 290 390 A L H X S+ 0 0 8 -4,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.941 114.8 43.5 -59.0 -43.7 98.6 -0.2 50.0 291 391 A N H X S+ 0 0 4 -4,-3.5 4,-2.6 2,-0.2 -2,-0.2 0.921 112.3 51.1 -63.8 -48.3 97.5 -0.1 53.6 292 392 A N H X S+ 0 0 4 -4,-4.1 4,-2.6 1,-0.2 -2,-0.2 0.902 110.4 50.5 -60.3 -41.3 99.9 2.7 54.6 293 393 A Y H X S+ 0 0 0 -4,-3.0 4,-2.2 -5,-0.2 -1,-0.2 0.937 110.0 50.1 -56.2 -49.4 98.7 4.7 51.6 294 394 A M H X S+ 0 0 3 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.920 112.2 46.1 -62.4 -43.9 95.1 4.3 52.7 295 395 A I H X S+ 0 0 7 -4,-2.6 4,-3.0 2,-0.2 -1,-0.2 0.937 107.6 57.7 -64.3 -47.0 95.7 5.3 56.3 296 396 A W H X S+ 0 0 2 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.911 106.1 49.7 -47.2 -48.0 97.7 8.3 55.1 297 397 A N H X S+ 0 0 23 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.950 110.6 50.9 -54.7 -49.9 94.7 9.5 53.2 298 398 A L H X S+ 0 0 0 -4,-2.1 4,-1.0 1,-0.2 -2,-0.2 0.889 110.2 49.4 -52.6 -41.9 92.7 8.9 56.4 299 399 A V H >X S+ 0 0 1 -4,-3.0 4,-2.8 2,-0.2 3,-0.8 0.941 107.5 53.0 -71.9 -39.8 95.2 11.0 58.3 300 400 A R H 3< S+ 0 0 76 -4,-2.9 4,-0.3 1,-0.2 -2,-0.2 0.920 113.6 44.4 -58.9 -42.1 95.1 13.8 55.8 301 401 A K H 3< S+ 0 0 72 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.729 125.6 32.8 -63.3 -23.1 91.3 14.0 56.1 302 402 A T H X< S+ 0 0 0 -4,-1.0 3,-2.4 -3,-0.8 -2,-0.2 0.735 86.8 86.2-119.4 -31.1 91.4 13.7 59.9 303 403 A S G >< S+ 0 0 2 -4,-2.8 3,-1.9 1,-0.3 8,-0.2 0.751 79.8 72.4 -50.4 -34.2 94.5 15.4 61.6 304 404 A S G 3 S+ 0 0 36 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.723 93.8 56.4 -51.9 -24.5 92.7 18.8 61.7 305 405 A F G < S+ 0 0 8 -3,-2.4 -1,-0.3 117,-0.1 117,-0.2 0.410 96.5 76.8 -95.8 1.8 90.5 17.4 64.5 306 406 A L S < S- 0 0 6 -3,-1.9 -210,-0.1 1,-0.2 -214,-0.1 0.005 90.6 -54.6 -95.3-158.3 93.4 16.4 66.8 307 407 A D >> - 0 0 0 -216,-0.1 4,-1.5 1,-0.1 3,-1.5 -0.028 55.9 -87.6 -83.6-177.7 95.5 18.6 69.1 308 408 A Q H 3> S+ 0 0 74 1,-0.3 4,-1.3 2,-0.2 -1,-0.1 0.502 117.7 71.0 -71.6 -5.9 97.7 21.7 68.6 309 409 A R H 3> S+ 0 0 65 2,-0.1 4,-1.0 3,-0.1 -1,-0.3 0.831 106.4 40.4 -71.6 -30.7 100.8 19.6 67.7 310 410 A F H <> S+ 0 0 0 -3,-1.5 4,-2.7 2,-0.2 5,-0.3 0.929 108.7 56.4 -84.2 -50.5 99.0 18.8 64.4 311 411 A Q H X S+ 0 0 32 -4,-1.5 4,-3.5 1,-0.3 5,-0.2 0.890 107.0 53.2 -44.1 -48.2 97.5 22.3 63.7 312 412 A D H X S+ 0 0 66 -4,-1.3 4,-3.2 2,-0.2 -1,-0.3 0.930 108.4 49.5 -50.8 -50.6 101.1 23.5 63.9 313 413 A A H X S+ 0 0 6 -4,-1.0 4,-2.0 1,-0.2 -2,-0.2 0.918 114.5 44.4 -56.2 -45.0 102.0 20.8 61.3 314 414 A D H X S+ 0 0 30 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.882 115.5 48.2 -68.0 -40.5 99.1 21.9 59.0 315 415 A E H X S+ 0 0 109 -4,-3.5 4,-1.3 -5,-0.3 -2,-0.2 0.963 110.4 50.6 -63.5 -54.7 100.0 25.6 59.5 316 416 A K H >< S+ 0 0 118 -4,-3.2 3,-0.8 1,-0.2 4,-0.5 0.914 112.4 46.1 -49.6 -52.1 103.7 25.1 58.8 317 417 A F H >X S+ 0 0 5 -4,-2.0 4,-2.0 1,-0.2 3,-1.5 0.891 108.2 55.7 -63.6 -40.5 103.0 23.3 55.6 318 418 A M H 3< S+ 0 0 136 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.680 99.6 60.5 -68.1 -19.8 100.4 25.8 54.4 319 419 A E T << S+ 0 0 149 -4,-1.3 -1,-0.3 -3,-0.8 -2,-0.2 0.616 112.7 39.9 -74.4 -16.9 103.1 28.5 54.8 320 420 A V T <4 0 0 61 -3,-1.5 -2,-0.3 -4,-0.5 -1,-0.2 0.638 360.0 360.0 -96.8 -26.9 104.9 26.4 52.2 321 421 A M < 0 0 43 -4,-2.0 -3,-0.1 -5,-0.1 292,-0.1 0.483 360.0 360.0 -85.0 360.0 101.8 25.6 50.2 322 ! 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 0.0 323 432 A W > 0 0 92 0, 0.0 3,-0.9 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 48.0 90.6 30.5 66.9 324 433 A K T >> + 0 0 94 1,-0.2 3,-3.0 2,-0.1 4,-1.4 0.672 360.0 113.9 -54.8 -26.8 88.0 31.1 64.2 325 434 A F H 3> S+ 0 0 61 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.689 76.6 36.5 -7.6 -62.7 89.3 27.7 62.9 326 435 A c H <> S+ 0 0 0 -3,-0.9 4,-2.0 2,-0.2 -1,-0.3 0.431 98.7 71.8-103.9 7.2 86.1 25.8 63.6 327 436 A V H <> S+ 0 0 0 -3,-3.0 4,-1.9 2,-0.2 -1,-0.2 0.824 107.3 46.3 -67.3 -37.8 83.5 28.4 62.7 328 437 A S H X S+ 0 0 45 -4,-1.4 4,-3.6 2,-0.2 3,-0.4 0.992 111.8 48.5 -59.2 -61.9 84.9 27.5 59.3 329 438 A D H X S+ 0 0 16 -4,-1.5 4,-2.5 1,-0.3 5,-0.3 0.878 111.9 49.9 -47.8 -47.0 84.7 23.7 60.0 330 439 A T H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -1,-0.3 0.895 113.9 44.3 -62.4 -44.0 81.1 24.1 61.2 331 440 A E H X S+ 0 0 8 -4,-1.9 4,-1.4 -3,-0.4 -2,-0.2 0.956 111.2 56.1 -62.4 -50.2 80.1 26.1 58.1 332 441 A N H < S+ 0 0 105 -4,-3.6 -2,-0.2 1,-0.2 3,-0.2 0.929 124.6 19.8 -45.9 -55.5 81.9 23.6 55.9 333 442 A N H < S+ 0 0 26 -4,-2.5 3,-0.2 -5,-0.2 -1,-0.2 0.862 138.1 29.2 -87.7 -38.6 80.0 20.6 57.2 334 443 A L H X S+ 0 0 1 -4,-2.8 4,-1.3 -5,-0.3 3,-0.4 -0.028 76.3 128.6-119.9 28.2 76.9 22.0 58.8 335 444 A G H X S+ 0 0 1 -4,-1.4 4,-0.8 1,-0.3 -1,-0.2 0.797 76.1 49.4 -57.4 -36.9 76.4 25.1 56.6 336 445 A F H 4 S+ 0 0 46 -3,-0.2 -1,-0.3 1,-0.2 3,-0.2 0.822 106.1 59.7 -73.0 -27.8 72.9 24.3 55.7 337 446 A A H 4 S+ 0 0 0 -3,-0.4 4,-0.3 1,-0.2 -2,-0.2 0.866 111.7 39.2 -60.1 -35.6 72.4 23.8 59.5 338 447 A L H X S+ 0 0 4 -4,-1.3 4,-3.4 -8,-0.2 -1,-0.2 0.554 91.2 94.2 -88.5 -14.2 73.5 27.4 60.0 339 448 A G H X S+ 0 0 0 -4,-0.8 4,-3.2 1,-0.2 5,-0.3 0.908 82.5 49.1 -51.4 -56.9 71.7 28.9 57.0 340 449 A P H > S+ 0 0 7 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.915 115.3 45.6 -50.1 -49.0 68.5 30.0 58.7 341 450 A M H > S+ 0 0 4 -4,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.962 113.7 52.0 -55.0 -52.0 70.5 31.7 61.5 342 451 A F H X S+ 0 0 2 -4,-3.4 4,-2.3 1,-0.2 -1,-0.2 0.887 114.0 39.2 -55.6 -46.4 72.7 33.2 58.8 343 452 A V H X S+ 0 0 9 -4,-3.2 4,-2.4 2,-0.2 -1,-0.2 0.827 108.3 59.9 -83.9 -28.8 70.0 34.7 56.7 344 453 A K H < S+ 0 0 147 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.948 116.7 37.4 -52.0 -47.9 67.8 35.9 59.6 345 454 A A H < S+ 0 0 60 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.896 132.2 22.8 -69.0 -46.1 70.8 38.0 60.6 346 455 A T H < S+ 0 0 39 -4,-2.3 2,-0.6 -5,-0.2 -3,-0.2 0.641 106.7 72.3-104.7 -17.6 72.2 39.1 57.3 347 456 A F < - 0 0 15 -4,-2.4 -1,-0.2 -5,-0.2 5,-0.1 -0.846 56.2-156.5-123.0 96.5 69.4 38.9 54.6 348 457 A A >> - 0 0 56 -2,-0.6 3,-1.0 1,-0.2 4,-0.6 -0.367 23.5-134.7 -51.2 137.3 66.5 41.3 54.4 349 458 A E H >> S+ 0 0 103 1,-0.3 4,-1.5 2,-0.2 3,-0.8 0.804 109.4 69.6 -71.0 -29.7 63.7 39.4 52.5 350 459 A D H 3> S+ 0 0 66 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.836 91.2 61.5 -38.7 -45.0 63.4 42.6 50.7 351 460 A S H <> S+ 0 0 18 -3,-1.0 4,-2.5 1,-0.2 -1,-0.2 0.806 99.2 52.3 -62.8 -33.9 66.8 41.5 49.3 352 461 A K H X S+ 0 0 12 -4,-1.8 3,-0.9 -3,-0.2 4,-0.8 0.862 108.1 55.4 -65.7 -40.0 72.0 40.2 23.0 370 479 A L H >< S+ 0 0 3 -4,-2.2 3,-0.5 1,-0.2 -2,-0.2 0.873 105.8 52.6 -58.9 -32.7 71.1 36.6 22.0 371 480 A S T 3< S+ 0 0 87 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.712 114.4 41.5 -75.0 -18.8 68.5 38.0 19.5 372 481 A T T <4 S+ 0 0 102 -3,-0.9 2,-0.3 -4,-0.5 -1,-0.2 0.381 78.5 128.1-113.7 -3.3 71.1 40.2 17.9 373 482 A L X< - 0 0 6 -4,-0.8 3,-0.8 -3,-0.5 8,-0.1 -0.431 43.4-157.7 -72.2 123.0 74.2 37.9 17.7 374 483 A K T 3 S+ 0 0 196 -2,-0.3 -1,-0.1 1,-0.2 -3,-0.0 0.703 83.0 63.1 -79.7 -22.2 75.6 37.9 14.2 375 484 A W T 3 S+ 0 0 34 285,-0.2 2,-0.4 2,-0.1 -1,-0.2 0.676 94.6 71.3 -80.0 -17.4 77.4 34.6 14.3 376 485 A M S < S- 0 0 4 -3,-0.8 149,-0.0 -6,-0.1 2,-0.0 -0.808 79.9-126.0 -97.5 139.2 74.3 32.5 14.9 377 486 A D > - 0 0 63 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.318 37.1-104.3 -64.5 165.4 71.5 31.8 12.4 378 487 A E H > S+ 0 0 155 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.826 120.5 57.8 -65.7 -33.4 68.0 32.7 13.6 379 488 A E H > S+ 0 0 118 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.949 108.4 45.4 -62.7 -50.1 67.2 29.1 14.3 380 489 A T H > S+ 0 0 3 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.925 110.5 54.1 -60.5 -42.9 70.1 28.7 16.7 381 490 A R H X S+ 0 0 66 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.876 106.5 54.0 -57.2 -35.5 69.2 32.0 18.3 382 491 A K H X S+ 0 0 145 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.905 109.2 46.2 -65.1 -43.2 65.7 30.6 18.9 383 492 A S H X S+ 0 0 32 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.916 111.5 52.2 -65.9 -44.9 67.0 27.4 20.7 384 493 A A H X S+ 0 0 0 -4,-2.4 4,-3.3 2,-0.2 -2,-0.2 0.916 109.3 48.3 -56.6 -48.7 69.4 29.5 22.8 385 494 A K H X S+ 0 0 91 -4,-2.3 4,-3.9 1,-0.2 5,-0.2 0.920 108.6 56.6 -56.3 -43.8 66.6 31.9 24.0 386 495 A E H X S+ 0 0 89 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.888 111.1 41.1 -57.2 -43.2 64.6 28.8 24.7 387 496 A K H X S+ 0 0 0 -4,-2.1 4,-0.7 2,-0.2 3,-0.3 0.905 114.6 52.6 -73.0 -40.1 67.3 27.5 27.1 388 497 A A H >< S+ 0 0 0 -4,-3.3 3,-2.5 1,-0.2 -2,-0.2 0.988 107.2 52.3 -52.8 -60.0 67.8 31.0 28.5 389 498 A D H 3< S+ 0 0 75 -4,-3.9 -1,-0.2 1,-0.3 -2,-0.2 0.756 110.1 50.2 -44.1 -35.9 64.1 31.2 29.2 390 499 A A H 3< S+ 0 0 30 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.475 76.9 122.9 -87.8 -5.2 64.3 27.8 31.1 391 500 A I << - 0 0 8 -3,-2.5 2,-0.4 -4,-0.7 75,-0.2 -0.394 54.0-146.8 -56.9 126.1 67.2 28.8 33.3 392 501 A Y E -f 466 0D 88 73,-2.4 75,-2.9 72,-0.3 2,-0.4 -0.783 12.8-157.2 -94.4 139.6 66.1 28.3 36.9 393 502 A N E -f 467 0D 40 -2,-0.4 2,-0.4 73,-0.2 75,-0.2 -0.954 11.0-164.7-119.9 142.2 67.4 30.6 39.7 394 503 A M E -f 468 0D 11 73,-2.1 75,-2.4 -2,-0.4 2,-0.4 -0.972 10.3-160.1-116.6 142.9 67.8 30.3 43.4 395 504 A I E -f 469 0D 10 -2,-0.4 2,-2.2 2,-0.3 -43,-0.1 -0.967 59.6 -23.9-122.3 129.2 68.5 33.3 45.7 396 505 A G E S-f 470 0D 0 73,-3.1 75,-2.3 -2,-0.4 76,-0.3 -0.396 120.0 -2.1 85.7 -66.2 69.9 33.4 49.2 397 506 A Y S S- 0 0 13 -2,-2.2 -2,-0.3 73,-0.2 2,-0.3 -0.942 78.2 -91.5-154.8 158.2 69.0 29.9 50.5 398 507 A P > - 0 0 0 0, 0.0 3,-1.4 0, 0.0 4,-0.4 -0.657 39.9-121.0 -77.0 145.3 67.3 26.7 49.4 399 508 A N G > S+ 0 0 85 -2,-0.3 3,-1.8 1,-0.3 4,-0.2 0.860 105.2 64.4 -53.6 -42.4 63.6 26.7 50.4 400 509 A F G > S+ 0 0 39 1,-0.3 3,-1.1 47,-0.2 7,-0.6 0.723 93.2 62.5 -62.5 -22.6 63.8 23.5 52.5 401 510 A I G < S+ 0 0 2 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.713 96.4 57.4 -78.0 -19.4 66.1 25.1 55.1 402 511 A M G < S+ 0 0 68 -3,-1.8 -1,-0.3 -4,-0.4 -2,-0.2 0.355 95.2 73.7 -91.5 4.3 63.5 27.8 56.1 403 512 A D S X> S- 0 0 71 -3,-1.1 4,-2.8 -4,-0.2 3,-0.8 -0.909 70.7-161.9-113.1 101.0 61.1 24.9 57.0 404 513 A P H 3> S+ 0 0 67 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.812 89.5 59.3 -55.2 -36.2 62.5 23.5 60.2 405 514 A K H 3> S+ 0 0 168 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.947 114.0 37.9 -53.0 -49.7 60.4 20.3 59.7 406 515 A E H <> S+ 0 0 68 -3,-0.8 4,-1.9 2,-0.2 -1,-0.2 0.918 117.3 48.2 -72.9 -43.8 62.3 19.7 56.4 407 516 A L H X S+ 0 0 0 -4,-2.8 4,-1.3 -7,-0.6 -2,-0.2 0.879 112.4 49.7 -64.3 -37.3 65.8 20.9 57.5 408 517 A D H X S+ 0 0 25 -4,-2.7 4,-0.7 -5,-0.3 -1,-0.2 0.782 107.0 56.0 -68.7 -34.6 65.6 18.8 60.7 409 518 A K H >< S+ 0 0 139 -4,-1.2 3,-0.8 -5,-0.3 4,-0.4 0.933 106.2 50.6 -59.4 -51.1 64.6 15.8 58.6 410 519 A V H 3< S+ 0 0 69 -4,-1.9 3,-0.3 1,-0.2 -2,-0.2 0.846 120.1 35.1 -56.6 -38.1 67.8 16.2 56.5 411 520 A F H >< S+ 0 0 10 -4,-1.3 3,-2.2 1,-0.2 -1,-0.2 0.428 86.0 105.1-100.6 3.3 70.0 16.4 59.6 412 521 A N T << S+ 0 0 90 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.1 0.772 79.2 52.3 -54.8 -36.4 68.1 13.9 61.8 413 522 A D T 3 S+ 0 0 107 -4,-0.4 2,-0.5 -3,-0.3 -1,-0.3 0.385 92.5 88.3 -86.4 3.1 70.7 11.1 61.4 414 523 A Y < - 0 0 1 -3,-2.2 2,-0.4 17,-0.1 14,-0.1 -0.891 58.9-171.1 -98.7 134.2 73.6 13.4 62.4 415 524 A T - 0 0 71 -2,-0.5 2,-0.4 9,-0.1 12,-0.1 -0.985 7.1-160.2-128.7 126.8 74.3 13.5 66.1 416 525 A A - 0 0 17 -2,-0.4 -335,-0.1 11,-0.1 5,-0.1 -0.856 9.1-153.7-108.4 138.4 76.7 15.9 67.7 417 526 A V > - 0 0 34 -2,-0.4 3,-1.1 3,-0.3 2,-0.3 -0.868 24.1-107.7-113.8 141.1 78.1 15.2 71.2 418 527 A P T 3 S+ 0 0 92 0, 0.0 -337,-0.1 0, 0.0 -338,-0.1 -0.547 99.6 1.0 -71.7 129.9 79.4 17.7 73.6 419 528 A D T 3 S+ 0 0 61 -339,-0.3 2,-0.4 -2,-0.3 -338,-0.1 0.476 103.0 103.2 79.5 5.6 83.2 17.8 74.0 420 529 A L <> + 0 0 43 -3,-1.1 4,-2.6 1,-0.2 -3,-0.3 -0.616 35.4 158.3-120.3 73.0 83.8 15.0 71.4 421 530 A Y H > S+ 0 0 5 -337,-0.5 4,-2.1 -2,-0.4 -1,-0.2 0.892 73.9 45.9 -64.0 -47.1 85.0 17.0 68.4 422 531 A F H > S+ 0 0 22 -117,-0.2 4,-2.2 2,-0.2 5,-0.2 0.905 115.1 46.9 -64.7 -43.8 86.9 14.2 66.6 423 532 A E H > S+ 0 0 89 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.906 111.3 54.0 -64.9 -40.6 84.0 11.7 67.1 424 533 A N H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.874 108.7 48.3 -56.0 -44.8 81.6 14.4 65.9 425 534 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.950 112.6 46.3 -61.9 -54.2 83.6 14.9 62.7 426 535 A M H X S+ 0 0 17 -4,-2.2 4,-2.5 1,-0.3 5,-0.2 0.856 110.6 54.1 -57.9 -39.5 83.8 11.2 61.9 427 536 A R H X S+ 0 0 96 -4,-2.2 4,-2.0 1,-0.2 -1,-0.3 0.911 109.7 48.1 -63.1 -40.2 80.2 10.9 62.6 428 537 A F H X S+ 0 0 20 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.883 107.9 54.6 -65.3 -41.5 79.6 13.7 60.1 429 538 A F H X S+ 0 0 9 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.935 111.5 44.3 -59.5 -49.0 81.8 12.0 57.5 430 539 A N H X S+ 0 0 46 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.867 114.5 50.0 -59.2 -40.6 79.8 8.8 57.7 431 540 A F H X S+ 0 0 16 -4,-2.0 4,-1.4 -5,-0.2 -2,-0.2 0.879 110.4 50.4 -62.5 -39.3 76.5 10.8 57.7 432 541 A S H X S+ 0 0 25 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.866 108.2 50.8 -73.3 -40.8 77.7 12.8 54.6 433 542 A W H X S+ 0 0 8 -4,-2.0 4,-2.8 -5,-0.2 3,-0.3 0.922 109.2 52.5 -58.5 -46.7 78.6 9.7 52.7 434 543 A R H X S+ 0 0 135 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.783 103.8 56.9 -63.8 -28.2 75.1 8.2 53.5 435 544 A V H < S+ 0 0 60 -4,-1.4 4,-0.3 2,-0.2 -1,-0.2 0.881 111.9 42.0 -68.6 -38.8 73.3 11.3 52.2 436 545 A T H >< S+ 0 0 30 -4,-1.3 3,-1.8 -3,-0.3 4,-0.4 0.951 114.0 50.6 -74.0 -48.9 75.1 10.9 48.8 437 546 A A H >< S+ 0 0 7 -4,-2.8 3,-1.6 1,-0.3 4,-0.2 0.886 105.4 58.5 -51.2 -42.5 74.6 7.2 48.7 438 547 A D T 3< S+ 0 0 85 -4,-1.9 -1,-0.3 1,-0.3 3,-0.2 0.555 96.4 63.8 -67.7 -13.0 70.8 7.7 49.5 439 548 A Q T X S+ 0 0 33 -3,-1.8 3,-1.7 -4,-0.3 -1,-0.3 0.588 73.8 95.5 -84.8 -12.0 70.5 9.8 46.4 440 549 A L T < S+ 0 0 5 -3,-1.6 -289,-0.5 -4,-0.4 -1,-0.2 0.865 96.1 28.3 -49.2 -47.3 71.3 7.0 44.0 441 550 A R T 3 S+ 0 0 137 -3,-0.2 -1,-0.3 -4,-0.2 2,-0.2 0.246 108.4 89.2-104.1 13.3 67.6 6.0 43.3 442 551 A K S < S- 0 0 102 -3,-1.7 -291,-0.6 1,-0.0 -3,-0.0 -0.641 81.3-104.8-100.1 161.5 66.1 9.5 43.9 443 552 A A - 0 0 67 -2,-0.2 -293,-0.2 -293,-0.1 -294,-0.1 -0.703 34.0-117.2 -77.8 135.8 65.6 12.3 41.3 444 553 A P - 0 0 24 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.402 36.5-164.5 -61.2 145.8 68.0 15.3 41.4 445 554 A N > - 0 0 76 1,-0.1 3,-1.1 3,-0.0 19,-0.1 -0.965 30.3-124.4-134.7 165.8 66.2 18.5 42.2 446 555 A R T 3 S+ 0 0 88 -2,-0.3 -1,-0.1 1,-0.3 18,-0.1 0.678 102.6 71.6 -78.1 -18.6 66.9 22.2 42.0 447 556 A D T 3 S+ 0 0 30 -49,-0.1 2,-0.5 2,-0.1 -1,-0.3 0.430 82.2 88.1 -77.0 3.6 66.3 22.9 45.6 448 557 A Q < - 0 0 65 -3,-1.1 2,-0.3 -50,-0.1 -3,-0.0 -0.924 67.2-161.2-107.1 123.5 69.5 21.0 46.4 449 558 A W - 0 0 17 -2,-0.5 -2,-0.1 2,-0.1 -3,-0.0 -0.745 28.4-152.2-107.6 147.1 72.6 23.2 46.4 450 559 A S S S+ 0 0 93 -2,-0.3 2,-0.3 2,-0.1 -1,-0.1 0.018 90.1 55.3 -97.5 27.1 76.3 22.5 46.1 451 560 A M S S- 0 0 20 8,-0.0 -2,-0.1 6,-0.0 8,-0.0 -0.969 81.8-128.8-153.0 138.2 76.9 25.7 48.1 452 561 A T > - 0 0 14 -2,-0.3 3,-1.8 1,-0.1 20,-0.2 -0.504 31.9-104.0 -88.0 158.6 75.6 26.8 51.5 453 562 A P T 3 S+ 0 0 0 0, 0.0 19,-2.5 0, 0.0 20,-0.2 0.701 114.0 56.4 -56.1 -24.9 74.0 30.1 52.1 454 563 A P T 3 S+ 0 0 1 0, 0.0 -398,-0.1 0, 0.0 2,-0.1 0.490 81.5 116.5 -90.1 3.3 76.8 31.9 53.9 455 564 A M < - 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0 0 67 -2,-0.4 4,-2.8 51,-0.2 3,-0.2 -0.230 38.8-103.7 -71.0 170.1 79.5 59.9 35.5 593 702 A N H > S+ 0 0 10 1,-0.2 4,-2.5 2,-0.2 -1,-0.1 0.892 120.9 55.3 -64.0 -39.9 77.3 56.9 36.4 594 703 A N H > S+ 0 0 38 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.780 112.3 43.1 -65.6 -30.9 78.1 55.1 33.2 595 704 A Q H > S+ 0 0 11 -3,-0.2 4,-2.4 2,-0.2 3,-0.4 0.869 108.2 59.4 -75.9 -44.5 81.7 55.3 34.0 596 705 A L H X S+ 0 0 2 -4,-2.8 4,-3.4 1,-0.2 5,-0.3 0.909 98.7 61.2 -48.1 -44.3 81.0 54.4 37.7 597 706 A F H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.913 108.2 40.5 -45.1 -54.3 79.6 51.2 36.3 598 707 A F H X S+ 0 0 0 -4,-0.8 4,-2.1 -3,-0.4 -1,-0.2 0.883 116.9 50.2 -69.1 -38.4 82.9 50.1 34.8 599 708 A L H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.934 109.2 49.0 -65.4 -51.9 84.9 51.4 37.8 600 709 A G H X S+ 0 0 12 -4,-3.4 4,-1.2 2,-0.2 -2,-0.2 0.930 109.6 54.8 -52.8 -46.0 82.7 49.6 40.4 601 710 A F H >X S+ 0 0 5 -4,-2.0 3,-1.0 -5,-0.3 4,-0.8 0.945 109.4 45.9 -50.5 -57.4 83.1 46.4 38.3 602 711 A A H >< S+ 0 0 0 -4,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.815 105.4 60.4 -56.0 -36.3 86.9 46.6 38.4 603 712 A Q H >< S+ 0 0 28 -4,-2.0 3,-1.0 1,-0.2 -1,-0.2 0.736 93.6 64.6 -72.3 -21.2 87.0 47.4 42.1 604 713 A V H << S+ 0 0 9 -4,-1.2 -556,-0.5 -3,-1.0 -1,-0.2 0.904 104.6 48.5 -59.0 -41.2 85.3 44.0 42.9 605 714 A W T << S+ 0 0 14 -4,-0.8 2,-0.3 -3,-0.5 -1,-0.2 0.248 76.1 133.1 -90.5 11.5 88.4 42.4 41.5 606 715 A b < + 0 0 4 -3,-1.0 -558,-0.5 -577,-0.1 2,-0.3 -0.496 37.5 150.6 -59.8 123.6 91.0 44.4 43.4 607 716 A S E -A 47 0A 33 -2,-0.3 2,-0.3 -560,-0.2 -560,-0.2 -0.996 39.4-154.7-161.4 152.4 93.4 41.8 44.7 608 717 A V E -A 46 0A 26 -562,-2.5 -562,-3.0 -2,-0.3 2,-0.3 -0.955 21.2-177.8-126.0 149.8 96.9 40.8 45.8 609 718 A R E -A 45 0A 80 -2,-0.3 -564,-0.3 -564,-0.3 -570,-0.1 -0.995 34.0 -83.7-153.2 161.7 98.5 37.4 45.8 610 719 A T > - 0 0 25 -566,-2.7 4,-1.9 -2,-0.3 -566,-0.1 -0.210 38.3-125.1 -62.4 137.6 101.6 35.4 46.7 611 720 A P H > S+ 0 0 96 0, 0.0 4,-0.9 0, 0.0 -1,-0.1 0.803 114.8 47.0 -58.0 -29.1 104.3 35.5 44.0 612 721 A E H > S+ 0 0 87 2,-0.2 4,-1.8 1,-0.1 3,-0.5 0.901 105.4 60.0 -73.3 -43.3 104.3 31.7 43.9 613 722 A S H > S+ 0 0 19 1,-0.3 4,-4.5 2,-0.2 5,-0.3 0.888 102.5 53.2 -54.5 -43.6 100.4 31.6 43.8 614 723 A S H X S+ 0 0 22 -4,-1.9 4,-1.4 2,-0.2 -1,-0.3 0.834 107.2 48.5 -63.3 -39.8 100.5 33.6 40.5 615 724 A H H < S+ 0 0 88 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.849 121.3 41.2 -62.3 -31.2 102.9 31.1 38.8 616 725 A E H >X S+ 0 0 44 -4,-1.8 3,-2.3 2,-0.2 4,-2.2 0.915 110.4 49.6 -87.0 -54.4 100.5 28.4 40.1 617 726 A G H 3X S+ 0 0 9 -4,-4.5 4,-2.6 1,-0.3 -3,-0.2 0.921 101.0 70.0 -50.6 -44.9 97.0 29.9 39.5 618 727 A L H 3< S+ 0 0 19 -4,-1.4 -67,-0.4 -5,-0.3 -1,-0.3 0.463 113.6 26.8 -50.7 -5.4 98.3 30.6 36.0 619 728 A I H <4 S+ 0 0 74 -3,-2.3 -1,-0.2 -69,-0.1 -2,-0.2 0.586 131.3 34.1-129.0 -29.4 98.2 26.8 35.5 620 729 A T H < S+ 0 0 63 -4,-2.2 -3,-0.2 -456,-0.0 -2,-0.2 0.759 94.8 83.0 -98.0 -34.5 95.5 25.5 37.9 621 730 A D < - 0 0 54 -4,-2.6 -67,-0.0 -5,-0.3 0, 0.0 -0.608 56.0-159.6 -82.5 129.9 92.7 28.2 38.1 622 731 A P S S+ 0 0 28 0, 0.0 -64,-0.5 0, 0.0 -63,-0.2 0.736 77.5 81.8 -77.2 -21.3 90.2 28.1 35.3 623 732 A H S S- 0 0 11 -65,-0.1 3,-0.1 1,-0.1 -67,-0.1 -0.540 91.0-113.9 -74.0 144.0 89.5 31.7 36.2 624 733 A S - 0 0 3 -69,-0.2 5,-0.1 -2,-0.2 -1,-0.1 -0.422 45.3 -81.2 -70.1 156.3 91.8 34.4 34.8 625 734 A P >> - 0 0 40 0, 0.0 4,-1.3 0, 0.0 3,-0.8 -0.320 51.0-108.1 -53.4 140.3 94.0 36.4 37.2 626 735 A S H 3> S+ 0 0 28 1,-0.2 4,-1.7 2,-0.2 3,-0.2 0.812 116.0 54.9 -41.3 -42.2 91.8 39.1 38.6 627 736 A R H 3> S+ 0 0 82 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.897 109.8 45.2 -69.6 -38.5 93.5 41.9 36.7 628 737 A F H <> S+ 0 0 11 -3,-0.8 4,-1.9 2,-0.2 5,-0.3 0.615 104.2 63.9 -79.3 -12.8 93.0 40.3 33.3 629 738 A R H X S+ 0 0 6 -4,-1.3 4,-1.1 -3,-0.2 -2,-0.2 0.939 112.3 37.1 -66.2 -47.4 89.4 39.5 34.3 630 739 A V H X S+ 0 0 0 -4,-1.7 4,-2.9 2,-0.2 5,-0.3 0.969 124.0 40.9 -58.7 -57.6 88.9 43.3 34.4 631 740 A I H X S+ 0 0 14 -4,-2.7 4,-1.9 1,-0.2 -3,-0.2 0.817 114.2 49.6 -72.0 -38.0 91.1 44.1 31.4 632 741 A G H X S+ 0 0 0 -4,-1.9 4,-0.5 2,-0.2 -1,-0.2 0.820 116.4 44.0 -69.9 -34.2 90.0 41.3 29.2 633 742 A S H >< S+ 0 0 1 -4,-1.1 3,-1.2 -5,-0.3 4,-0.4 0.958 115.6 44.9 -72.8 -56.3 86.4 42.2 29.8 634 743 A L H >< S+ 0 0 0 -4,-2.9 3,-1.3 1,-0.3 7,-0.3 0.854 108.0 61.5 -55.3 -35.2 86.7 45.9 29.4 635 744 A S H 3< S+ 0 0 2 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.720 102.3 49.4 -70.1 -23.6 88.9 45.5 26.4 636 745 A N T << S+ 0 0 22 -3,-1.2 2,-0.7 -4,-0.5 -1,-0.3 0.505 94.3 93.7 -89.8 -2.4 86.1 43.7 24.5 637 746 A S <> - 0 0 11 -3,-1.3 4,-1.6 -4,-0.4 3,-0.1 -0.821 50.1-173.0 -99.4 110.4 83.6 46.5 25.4 638 747 A K H > S+ 0 0 133 -2,-0.7 4,-3.1 1,-0.2 5,-0.2 0.868 91.6 59.6 -54.7 -37.7 83.2 49.3 22.9 639 748 A E H > S+ 0 0 87 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.817 100.8 51.2 -71.4 -34.1 81.1 51.0 25.6 640 749 A F H > S+ 0 0 0 -6,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.937 113.4 46.5 -62.4 -48.7 83.9 51.1 28.1 641 750 A S H X>S+ 0 0 3 -4,-1.6 5,-1.3 -7,-0.3 4,-0.9 0.929 109.9 51.8 -64.3 -43.9 86.1 52.7 25.5 642 751 A E H ><5S+ 0 0 115 -4,-3.1 3,-0.7 1,-0.2 -1,-0.2 0.945 112.8 47.7 -53.3 -44.8 83.5 55.3 24.4 643 752 A H H 3<5S+ 0 0 52 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.721 120.6 33.3 -79.8 -26.8 83.0 56.3 28.1 644 753 A F H 3<5S- 0 0 7 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.253 105.6-129.1 -99.7 9.8 86.7 56.6 29.0 645 754 A R T <<5 - 0 0 175 -4,-0.9 -3,-0.2 -3,-0.7 -4,-0.1 0.887 34.8-175.8 40.5 54.7 87.4 57.9 25.4 646 755 A a < - 0 0 8 -5,-1.3 -1,-0.2 -6,-0.1 -2,-0.1 -0.701 28.2-112.6 -77.3 121.8 90.3 55.5 25.0 647 756 A P > - 0 0 76 0, 0.0 3,-2.4 0, 0.0 6,-0.1 -0.078 41.1 -76.1 -60.4 161.4 91.9 56.2 21.6 648 757 A P T 3 S+ 0 0 121 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.479 124.2 8.5 -33.4 -24.7 91.8 53.9 18.4 649 758 A G T 3 S+ 0 0 59 5,-0.1 -3,-0.0 6,-0.1 0, 0.0 -0.011 81.8 144.2-161.5 45.4 94.4 51.5 19.7 650 759 A S X - 0 0 19 -3,-2.4 3,-2.2 3,-0.2 -627,-0.1 -0.423 69.0 -97.7 -66.2 160.6 95.3 52.3 23.3 651 760 A P T 3 S+ 0 0 78 0, 0.0 -628,-0.2 0, 0.0 -1,-0.1 0.870 125.8 48.2 -46.7 -43.6 96.0 49.1 25.4 652 761 A M T 3 S+ 0 0 3 -630,-1.8 -629,-0.1 1,-0.3 -6,-0.1 0.348 108.6 59.2 -85.5 6.0 92.4 49.0 26.8 653 762 A N S < S+ 0 0 24 -3,-2.2 -1,-0.3 -631,-0.3 -3,-0.2 -0.323 71.5 179.6-136.8 55.7 90.9 49.5 23.4 654 763 A P - 0 0 31 0, 0.0 -5,-0.1 0, 0.0 -4,-0.0 -0.192 28.1-142.9 -56.6 134.2 92.0 46.6 21.0 655 764 A P S S+ 0 0 115 0, 0.0 2,-1.8 0, 0.0 -6,-0.1 0.887 94.8 70.3 -68.8 -36.3 90.8 46.6 17.5 656 765 A H S S+ 0 0 120 -121,-0.0 2,-0.3 -117,-0.0 -117,-0.0 -0.617 75.5 179.1 -75.3 82.3 90.5 42.8 17.6 657 766 A K - 0 0 60 -2,-1.8 2,-0.3 -4,-0.1 -21,-0.1 -0.710 17.8-141.7 -86.8 137.0 87.5 42.8 20.0 658 767 A d + 0 0 5 -2,-0.3 2,-0.3 -123,-0.1 -125,-0.1 -0.778 22.6 173.7 -96.5 144.2 86.2 39.3 20.9 659 768 A E + 0 0 93 -2,-0.3 -124,-0.1 -127,-0.3 -99,-0.1 -0.910 19.2 146.1-152.0 120.9 82.5 38.6 21.3 660 769 A V 0 0 1 -2,-0.3 -285,-0.2 -100,-0.2 -1,-0.1 0.613 360.0 360.0-115.1 -65.3 80.7 35.4 21.9 661 770 A W 0 0 4 -101,-0.3 -292,-0.1 -288,-0.0 -288,-0.1 0.426 360.0 360.0-102.9 360.0 77.7 36.0 24.1 662 ! 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 0.0 663 817 A X 0 0 163 0, 0.0 -204,-0.1 0, 0.0 -206,-0.1 0.000 360.0 360.0 360.0 360.0 82.3 33.0 40.2