==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-NOV-10 2XWY . COMPND 2 MOLECULE: RNA-DIRECTED RNA POLYMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HEPATITIS C VIRUS; . AUTHOR S.DI MARCO,P.BAIOCCO . 507 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22572.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 351 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 11.0 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 . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 . 1 0.2 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 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 188 37.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 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 1 2 2 0 2 3 0 2 0 2 2 1 2 1 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 PARALLEL BRIDGES PER LADDER . 5 0 3 0 2 3 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 . 2 1 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 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A S 0 0 77 0, 0.0 35,-2.2 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 160.4 -0.7 33.8 35.9 2 2 A M B -A 35 0A 79 33,-0.2 33,-0.2 1,-0.1 31,-0.1 -0.814 360.0-138.9 -95.9 129.6 -0.6 32.4 32.3 3 3 A S S S- 0 0 0 31,-3.3 253,-2.4 -2,-0.5 254,-0.3 0.875 78.9 -10.6 -55.8 -48.8 2.9 32.0 30.8 4 4 A Y E -B 255 0B 1 251,-0.2 2,-0.3 30,-0.2 251,-0.2 -0.806 60.6-153.3-136.6 177.9 2.0 33.3 27.4 5 5 A T E -B 254 0B 54 249,-1.6 249,-1.3 -2,-0.2 2,-0.4 -0.953 7.8-151.9-149.3 143.4 -1.1 34.3 25.3 6 6 A W E -B 253 0B 55 -2,-0.3 247,-0.3 247,-0.2 246,-0.1 -0.919 15.5-161.2-117.0 152.6 -1.8 34.4 21.6 7 7 A T - 0 0 93 245,-1.1 246,-0.2 -2,-0.4 -1,-0.1 0.455 63.4 -95.4 -98.1 -6.3 -4.1 36.5 19.6 8 8 A G S S+ 0 0 69 244,-0.5 244,-0.1 1,-0.3 245,-0.1 0.164 77.5 145.8 110.3 -14.9 -4.0 34.0 16.7 9 9 A A - 0 0 23 242,-0.4 2,-0.5 1,-0.1 -1,-0.3 -0.325 49.6-122.1 -61.6 131.3 -1.3 35.9 14.8 10 10 A L - 0 0 69 -2,-0.1 2,-0.6 1,-0.1 240,-0.1 -0.625 17.5-124.0 -78.2 121.8 1.2 33.6 12.9 11 11 A I - 0 0 12 -2,-0.5 14,-0.1 11,-0.1 108,-0.1 -0.568 38.4-158.4 -60.5 112.2 4.8 33.9 13.8 12 12 A T - 0 0 25 -2,-0.6 235,-0.6 106,-0.2 108,-0.3 -0.506 10.0-105.9 -97.0 168.0 6.3 34.7 10.3 13 13 A P 0 0 83 0, 0.0 -1,-0.1 0, 0.0 8,-0.0 -0.232 360.0 360.0 -88.8 175.7 9.9 34.3 9.0 14 14 A C 0 0 126 -2,-0.1 105,-0.0 234,-0.0 234,-0.0 -0.159 360.0 360.0-136.7 360.0 12.9 36.6 8.2 15 ! 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 16 36 A M 0 0 140 0, 0.0 111,-0.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-116.8 18.3 12.6 8.7 17 37 A V E +F 126 0C 57 109,-0.2 2,-0.3 354,-0.1 109,-0.2 -0.665 360.0 169.5 -85.2 145.6 19.6 16.2 9.2 18 38 A Y E -F 125 0C 53 107,-2.2 107,-2.3 -2,-0.3 2,-0.1 -0.831 30.2-139.3-163.6 129.9 17.0 19.0 9.5 19 39 A A E -F 124 0C 32 105,-0.3 105,-0.3 -2,-0.3 2,-0.3 -0.453 34.9-115.6 -68.9 150.1 16.8 22.7 10.3 20 40 A T - 0 0 4 103,-3.0 2,-0.3 -2,-0.1 -1,-0.1 -0.668 35.5-159.9 -86.0 149.8 13.8 23.8 12.4 21 41 A T > - 0 0 50 -2,-0.3 3,-1.5 101,-0.1 114,-0.5 -0.789 35.0-104.6-127.5 167.3 11.4 26.2 10.7 22 42 A S G > S+ 0 0 35 -2,-0.3 3,-2.1 1,-0.2 4,-0.3 0.819 112.5 74.2 -56.3 -33.6 8.7 28.7 11.5 23 43 A R G 3 S+ 0 0 246 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 0.672 94.0 52.4 -56.8 -20.9 6.1 26.0 10.3 24 44 A S G X> S+ 0 0 28 -3,-1.5 4,-1.3 1,-0.2 3,-0.9 0.585 82.2 93.9 -89.0 -11.7 6.8 24.1 13.6 25 45 A A H <> + 0 0 3 -3,-2.1 4,-1.8 -4,-0.3 -1,-0.2 0.675 69.0 71.5 -62.6 -23.4 6.1 27.1 15.8 26 46 A G H 3> S+ 0 0 46 -3,-0.3 4,-1.7 -4,-0.3 -1,-0.3 0.953 103.6 39.5 -53.5 -54.6 2.5 26.2 16.4 27 47 A L H <> S+ 0 0 130 -3,-0.9 4,-3.0 1,-0.2 5,-0.2 0.948 111.5 56.4 -64.8 -52.6 3.3 23.2 18.6 28 48 A R H X S+ 0 0 26 -4,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.857 107.1 53.4 -40.3 -42.1 6.2 25.0 20.4 29 49 A Q H X S+ 0 0 32 -4,-1.8 4,-0.5 2,-0.2 -1,-0.2 0.943 109.6 44.6 -63.6 -49.5 3.5 27.5 21.2 30 50 A K H < S+ 0 0 77 -4,-1.7 3,-0.4 1,-0.2 -2,-0.2 0.817 113.2 53.4 -63.8 -34.8 1.1 25.0 22.8 31 51 A K H < S+ 0 0 76 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.903 110.9 43.9 -68.7 -42.4 4.0 23.4 24.6 32 52 A V H < S+ 0 0 0 -4,-2.2 2,-0.6 -5,-0.2 -1,-0.2 0.387 94.2 92.2 -86.5 0.8 5.3 26.6 26.3 33 53 A T < + 0 0 33 -4,-0.5 2,-0.3 -3,-0.4 -28,-0.0 -0.879 52.0 121.1-102.8 120.8 1.8 27.9 27.3 34 54 A F - 0 0 45 -2,-0.6 -31,-3.3 170,-0.1 2,-0.3 -0.968 61.0 -95.2-164.7 166.1 0.7 27.0 30.8 35 55 A D B -A 2 0A 101 -2,-0.3 2,-0.6 -33,-0.2 -33,-0.2 -0.675 40.8-129.6 -86.7 145.9 -0.4 28.4 34.1 36 56 A R - 0 0 21 -35,-2.2 2,-0.5 -2,-0.3 169,-0.0 -0.885 17.4-167.0-108.8 124.7 2.3 28.7 36.7 37 57 A L + 0 0 136 -2,-0.6 2,-0.3 285,-0.1 288,-0.2 -0.914 16.5 171.2-101.6 127.6 1.9 27.4 40.2 38 58 A Q + 0 0 47 -2,-0.5 2,-0.4 286,-0.1 286,-0.2 -0.956 11.2 170.3-143.9 128.3 4.5 28.6 42.7 39 59 A V - 0 0 92 284,-2.7 2,-0.2 -2,-0.3 286,-0.1 -0.950 17.2-156.6-139.1 116.4 4.7 28.2 46.5 40 60 A L - 0 0 44 -2,-0.4 2,-0.2 284,-0.1 -2,-0.0 -0.600 7.1-167.7 -99.3 152.2 7.8 29.1 48.4 41 61 A D > - 0 0 33 -2,-0.2 4,-2.3 1,-0.0 3,-0.4 -0.695 44.8 -84.0-128.0-178.9 9.1 28.0 51.8 42 62 A D H > S+ 0 0 111 1,-0.3 4,-1.8 -2,-0.2 5,-0.1 0.672 125.3 59.4 -62.5 -19.6 11.7 28.9 54.4 43 63 A H H > S+ 0 0 66 2,-0.2 4,-2.2 3,-0.2 -1,-0.3 0.933 107.2 44.8 -71.5 -49.9 14.3 27.0 52.4 44 64 A Y H > S+ 0 0 3 -3,-0.4 4,-2.3 1,-0.2 -2,-0.2 0.929 115.7 48.9 -56.4 -46.4 13.7 29.2 49.4 45 65 A R H X S+ 0 0 100 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.901 109.0 51.1 -61.6 -43.6 13.8 32.3 51.5 46 66 A D H X S+ 0 0 75 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.957 110.5 48.2 -66.2 -48.8 17.0 31.3 53.4 47 67 A V H >X S+ 0 0 3 -4,-2.2 4,-1.8 1,-0.2 3,-1.0 0.964 109.7 53.9 -48.4 -55.5 18.9 30.7 50.2 48 68 A L H 3X S+ 0 0 15 -4,-2.3 4,-1.7 1,-0.3 3,-0.3 0.870 105.3 53.7 -51.9 -42.9 17.6 34.0 48.8 49 69 A K H 3X S+ 0 0 124 -4,-2.2 4,-2.3 1,-0.3 -1,-0.3 0.841 107.7 50.9 -60.5 -38.3 18.9 35.9 51.8 50 70 A E H < S+ 0 0 62 -4,-2.3 3,-0.8 2,-0.2 4,-0.3 0.951 114.0 44.5 -51.6 -50.4 24.2 39.1 51.4 54 74 A K H >< S+ 0 0 95 -4,-1.7 3,-1.7 1,-0.3 -2,-0.2 0.920 108.9 54.9 -67.4 -42.0 26.7 38.1 48.7 55 75 A A H >< S+ 0 0 0 -4,-2.8 3,-1.1 1,-0.3 -1,-0.3 0.739 98.0 67.8 -59.2 -21.2 25.2 40.5 46.1 56 76 A S T << S+ 0 0 69 -4,-1.4 -1,-0.3 -3,-0.8 -2,-0.2 0.567 90.3 60.2 -78.4 -10.4 25.8 43.3 48.7 57 77 A T T < S+ 0 0 111 -3,-1.7 2,-0.6 -4,-0.3 -1,-0.3 0.471 90.3 95.5 -92.8 -1.4 29.5 43.0 48.4 58 78 A V < - 0 0 8 -3,-1.1 164,-2.4 -4,-0.2 2,-0.4 -0.786 54.0-168.9 -98.4 118.8 29.3 43.9 44.7 59 79 A K B -g 222 0D 147 -2,-0.6 2,-0.3 162,-0.2 164,-0.2 -0.875 12.6-176.4 -95.7 135.8 29.7 47.4 43.3 60 80 A A - 0 0 4 162,-2.5 164,-0.3 -2,-0.4 2,-0.3 -0.942 9.4-151.8-129.9 155.9 28.7 47.8 39.7 61 81 A K - 0 0 118 -2,-0.3 94,-0.4 162,-0.1 2,-0.2 -0.811 24.0-102.9-120.7 159.7 28.9 50.9 37.4 62 82 A L - 0 0 42 -2,-0.3 2,-0.4 93,-0.1 90,-0.2 -0.509 30.8-128.7 -72.2 150.2 26.9 52.1 34.4 63 83 A L - 0 0 13 88,-2.4 2,-0.0 87,-0.2 91,-0.0 -0.840 26.7-119.9 -90.9 143.3 28.4 51.6 31.0 64 84 A S > - 0 0 47 -2,-0.4 4,-2.3 1,-0.1 5,-0.2 -0.316 30.3-101.9 -68.3 165.8 28.4 54.7 28.9 65 85 A V H > S+ 0 0 4 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.906 124.2 52.8 -54.8 -44.3 26.5 54.7 25.7 66 86 A E H > S+ 0 0 84 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.900 107.9 49.1 -58.6 -46.8 29.8 54.3 23.8 67 87 A E H > S+ 0 0 73 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.962 113.9 45.2 -60.6 -50.4 30.8 51.3 25.9 68 88 A A H >< S+ 0 0 0 -4,-2.3 3,-0.7 1,-0.2 4,-0.3 0.902 112.1 53.7 -61.3 -42.0 27.5 49.6 25.4 69 89 A C H >< S+ 0 0 0 -4,-2.8 3,-1.0 -5,-0.2 -1,-0.2 0.908 108.6 48.7 -55.3 -43.6 27.6 50.5 21.7 70 90 A K H 3< S+ 0 0 137 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.602 110.6 51.4 -77.4 -12.3 31.1 48.9 21.4 71 91 A L T << S+ 0 0 78 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.210 79.7 110.5-111.4 8.0 29.9 45.7 23.1 72 92 A T S < S- 0 0 1 -3,-1.0 75,-0.0 -4,-0.3 -3,-0.0 -0.708 80.0-112.4 -69.8 132.1 26.9 45.2 20.9 73 93 A P > - 0 0 54 0, 0.0 3,-1.1 0, 0.0 16,-0.1 -0.483 22.0-122.2 -70.9 148.7 27.7 42.1 18.8 74 94 A P T 3 S+ 0 0 44 0, 0.0 11,-0.3 0, 0.0 12,-0.1 0.906 102.8 41.0 -62.5 -52.4 28.2 42.7 15.0 75 95 A H T 3 S+ 0 0 134 10,-0.1 3,-0.1 11,-0.0 2,-0.1 0.175 84.5 126.6 -91.3 23.1 25.6 40.5 13.3 76 96 A S S < S- 0 0 30 -3,-1.1 9,-0.3 1,-0.1 2,-0.1 -0.375 74.4 -73.3 -73.3 159.0 22.8 41.2 15.8 77 97 A A - 0 0 48 7,-0.1 66,-0.2 1,-0.1 -1,-0.1 -0.276 47.7-121.5 -62.1 129.1 19.4 42.4 14.4 78 98 A K - 0 0 155 1,-0.1 65,-0.3 -3,-0.1 2,-0.2 0.013 36.5-100.3 -55.3 172.6 19.2 46.0 13.1 79 99 A S > - 0 0 3 4,-2.0 3,-0.7 63,-0.1 4,-0.3 -0.667 15.8-114.8-109.0 158.9 16.6 48.4 14.7 80 100 A K T 3 S+ 0 0 112 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.203 107.7 67.7 -69.1 14.4 13.2 49.7 13.8 81 101 A F T 3 S- 0 0 110 2,-0.2 -1,-0.3 3,-0.0 17,-0.1 -0.154 117.3 -90.3-138.0 41.2 14.8 53.2 13.5 82 102 A G S < S+ 0 0 54 -3,-0.7 2,-0.4 1,-0.1 -2,-0.1 0.581 87.5 109.9 70.9 15.9 17.1 53.1 10.5 83 103 A Y - 0 0 3 -4,-0.3 -4,-2.0 11,-0.1 -2,-0.2 -0.984 52.3-142.7-129.9 140.3 20.4 52.0 12.0 84 104 A G > - 0 0 18 -2,-0.4 4,-1.2 -6,-0.2 -7,-0.1 -0.109 32.4-110.5 -78.0 178.6 22.4 48.8 11.8 85 105 A A H > S+ 0 0 6 -9,-0.3 4,-2.5 -11,-0.3 5,-0.1 0.701 124.8 59.4 -79.1 -24.1 24.4 47.1 14.6 86 106 A K H > S+ 0 0 151 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.935 103.4 49.7 -61.2 -49.8 27.3 48.2 12.5 87 107 A D H 4>S+ 0 0 59 1,-0.2 5,-2.9 2,-0.2 -2,-0.2 0.881 110.9 49.8 -56.5 -42.7 26.1 51.8 12.9 88 108 A V H ><5S+ 0 0 0 -4,-1.2 3,-1.5 3,-0.2 -1,-0.2 0.947 111.3 49.0 -57.4 -51.6 25.8 51.2 16.7 89 109 A R H 3<5S+ 0 0 114 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.759 111.6 47.9 -64.0 -27.0 29.4 49.8 16.7 90 110 A N T 3<5S- 0 0 116 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.326 114.7-115.5-100.7 10.5 30.8 52.7 14.8 91 111 A L T < 5 - 0 0 65 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.881 41.3-169.5 61.8 46.1 29.1 55.2 17.0 92 112 A S >< - 0 0 32 -5,-2.9 4,-3.0 1,-0.1 5,-0.2 -0.379 29.6-124.2 -65.0 145.3 26.8 56.7 14.3 93 113 A S H > S+ 0 0 94 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.778 112.4 54.2 -64.1 -27.0 25.0 59.9 15.4 94 114 A K H > S+ 0 0 127 2,-0.2 4,-1.8 3,-0.2 5,-0.3 0.939 111.2 43.3 -71.1 -47.3 21.7 58.2 14.6 95 115 A A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.960 117.9 45.5 -62.3 -49.1 22.4 55.2 16.7 96 116 A V H X S+ 0 0 25 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.894 112.0 50.5 -64.6 -40.1 23.8 57.3 19.6 97 117 A N H X S+ 0 0 114 -4,-2.1 4,-1.2 -5,-0.2 -1,-0.2 0.877 114.1 42.4 -67.5 -39.2 21.0 59.9 19.6 98 118 A H H X S+ 0 0 37 -4,-1.8 4,-2.6 2,-0.2 3,-0.5 0.937 110.6 57.3 -72.5 -47.6 18.2 57.4 19.6 99 119 A I H X S+ 0 0 0 -4,-2.4 4,-1.7 -5,-0.3 -2,-0.2 0.911 106.2 50.3 -45.3 -50.8 19.9 55.3 22.2 100 120 A H H X S+ 0 0 89 -4,-2.2 4,-2.9 1,-0.2 -1,-0.2 0.827 109.9 50.2 -57.3 -37.4 20.1 58.3 24.6 101 121 A S H X S+ 0 0 59 -4,-1.2 4,-2.4 -3,-0.5 -1,-0.2 0.854 107.9 52.2 -73.4 -36.0 16.4 59.0 24.1 102 122 A V H X S+ 0 0 15 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.853 112.7 47.5 -64.0 -33.9 15.5 55.4 24.9 103 123 A W H X S+ 0 0 14 -4,-1.7 4,-1.7 -5,-0.2 -2,-0.2 0.931 111.5 47.0 -73.9 -50.4 17.6 55.8 28.0 104 124 A K H X S+ 0 0 119 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.901 112.5 53.1 -52.1 -42.2 16.0 59.1 29.0 105 125 A D H X S+ 0 0 68 -4,-2.4 4,-1.2 1,-0.2 -2,-0.2 0.879 106.8 52.1 -63.1 -40.5 12.6 57.3 28.3 106 126 A L H < S+ 0 0 1 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.801 112.2 44.3 -62.3 -36.5 13.6 54.5 30.6 107 127 A L H < S+ 0 0 33 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.837 116.1 47.5 -76.5 -34.5 14.4 56.8 33.5 108 128 A E H < S+ 0 0 127 -4,-2.2 2,-0.4 1,-0.2 -2,-0.2 0.643 116.0 41.0 -85.6 -14.5 11.3 58.9 33.0 109 129 A D < + 0 0 39 -4,-1.2 -1,-0.2 -5,-0.2 128,-0.1 -0.941 51.0 175.5-143.0 113.6 8.8 56.1 32.7 110 130 A T S S+ 0 0 42 -2,-0.4 -4,-0.1 -3,-0.1 126,-0.1 -0.033 75.8 43.3-104.4 29.8 8.8 53.0 34.8 111 131 A V + 0 0 98 1,-0.1 -1,-0.1 2,-0.1 -2,-0.0 0.671 67.4 102.2-139.3 -60.9 5.6 51.4 33.5 112 132 A T S S- 0 0 75 1,-0.1 -1,-0.1 130,-0.0 -3,-0.1 -0.123 70.6-121.1 -49.8 121.9 4.7 51.3 29.8 113 133 A P - 0 0 60 0, 0.0 2,-0.4 0, 0.0 125,-0.2 -0.085 28.3-124.3 -57.3 169.6 5.4 47.8 28.5 114 134 A I - 0 0 16 123,-1.1 127,-0.0 127,-0.4 2,-0.0 -0.970 18.0-106.1-129.0 133.2 7.9 47.5 25.6 115 135 A D - 0 0 52 -2,-0.4 27,-0.7 127,-0.1 2,-0.4 -0.304 32.6-170.8 -56.8 129.5 7.6 46.0 22.2 116 136 A T E -Cd 141 244B 0 127,-1.6 129,-0.7 25,-0.2 2,-0.5 -0.998 19.0-134.9-119.4 127.3 9.4 42.7 21.7 117 137 A T E -Cd 140 245B 23 23,-2.8 23,-1.8 -2,-0.4 2,-0.3 -0.708 22.7-150.6 -79.8 123.2 9.7 41.2 18.2 118 138 A I E +C 139 0B 0 127,-1.8 129,-0.3 -2,-0.5 2,-0.3 -0.743 25.0 153.7 -97.0 145.9 8.9 37.4 18.3 119 139 A M E -C 138 0B 39 19,-1.3 19,-1.2 -2,-0.3 2,-0.2 -0.947 39.0-103.4-156.3 171.9 10.4 34.8 15.8 120 140 A A E -C 137 0B 21 -108,-0.3 2,-0.2 -2,-0.3 17,-0.2 -0.700 39.2-113.9-101.4 157.0 11.3 31.1 15.3 121 141 A K - 0 0 84 15,-1.7 2,-1.0 -2,-0.2 -101,-0.1 -0.647 7.2-132.6 -96.4 150.6 14.9 29.8 15.5 122 142 A N + 0 0 143 -2,-0.2 2,-0.4 -103,-0.1 -101,-0.1 -0.439 49.3 156.7 -92.5 59.7 17.1 28.3 12.7 123 143 A E - 0 0 42 -2,-1.0 -103,-3.0 13,-0.1 2,-0.3 -0.718 33.5-142.9 -91.1 134.2 18.2 25.4 14.8 124 144 A V E +F 19 0C 14 -2,-0.4 2,-0.3 -105,-0.3 -105,-0.3 -0.650 24.6 175.2 -88.0 150.3 19.4 22.2 13.1 125 145 A F E -F 18 0C 41 -107,-2.3 -107,-2.2 -2,-0.3 2,-0.2 -0.950 23.9-131.6-147.4 166.3 18.6 18.8 14.6 126 146 A C E -F 17 0C 21 -2,-0.3 -109,-0.2 -109,-0.2 242,-0.1 -0.692 41.7 -82.5-112.8 170.8 18.9 15.1 14.0 127 147 A V - 0 0 82 -111,-0.6 -1,-0.1 -2,-0.2 5,-0.1 -0.256 39.8-152.3 -81.7 159.7 16.2 12.4 14.2 128 148 A Q 0 0 63 1,-0.1 -1,-0.1 -2,-0.0 4,-0.0 -0.769 360.0 360.0-126.7 167.7 14.9 10.5 17.4 129 149 A P 0 0 155 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.396 360.0 360.0-168.3 360.0 13.3 7.2 18.5 130 ! 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 0.0 131 153 A G 0 0 80 0, 0.0 2,-0.9 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0-140.1 10.4 12.6 15.8 132 154 A R - 0 0 86 -5,-0.1 -5,-0.1 -4,-0.0 -112,-0.0 -0.547 360.0-155.6 -76.7 103.2 10.5 16.2 14.8 133 155 A K - 0 0 129 -2,-0.9 -109,-0.1 1,-0.1 -8,-0.0 -0.575 25.9-125.9 -64.7 136.7 11.3 18.5 17.7 134 156 A P - 0 0 21 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.135 28.3 -84.1 -78.9-178.3 9.9 21.9 16.8 135 157 A A - 0 0 1 -114,-0.5 2,-0.2 -116,-0.1 -107,-0.1 -0.703 38.8-122.2 -85.9 139.8 11.8 25.3 16.7 136 158 A R - 0 0 39 -2,-0.3 -15,-1.7 -16,-0.1 2,-0.5 -0.539 26.6-123.4 -72.7 146.0 12.3 27.3 19.9 137 159 A L E -C 120 0B 1 -17,-0.2 2,-0.4 -2,-0.2 -17,-0.2 -0.846 18.0-150.3 -98.6 123.2 10.9 30.9 19.8 138 160 A I E -C 119 0B 51 -19,-1.2 -19,-1.3 -2,-0.5 2,-0.6 -0.801 6.9-160.5 -97.0 129.1 13.3 33.8 20.5 139 161 A V E +C 118 0B 0 -2,-0.4 122,-2.0 -21,-0.2 -21,-0.2 -0.919 20.8 160.1-117.0 107.5 11.8 37.0 22.0 140 162 A F E -C 117 0B 31 -23,-1.8 -23,-2.8 -2,-0.6 122,-0.1 -0.950 29.1-134.6-129.8 147.1 13.8 40.3 21.8 141 163 A P E -C 116 0B 1 0, 0.0 -25,-0.2 0, 0.0 5,-0.1 -0.330 52.2 -61.3 -85.3 175.1 13.1 44.1 22.0 142 164 A D >> - 0 0 23 -27,-0.7 3,-1.6 1,-0.1 4,-1.1 -0.247 49.7-113.9 -58.0 141.6 14.4 46.8 19.6 143 165 A L H >> S+ 0 0 0 -65,-0.3 4,-2.1 1,-0.3 3,-0.6 0.830 115.0 62.9 -43.3 -42.4 18.2 47.2 19.4 144 166 A G H 3> S+ 0 0 0 1,-0.3 4,-1.2 2,-0.2 -1,-0.3 0.867 106.5 46.1 -56.7 -36.9 18.1 50.7 20.9 145 167 A V H <> S+ 0 0 12 -3,-1.6 4,-1.5 2,-0.2 -1,-0.3 0.757 107.2 57.2 -73.1 -28.2 16.7 49.0 24.0 146 168 A R H > S+ 0 0 2 -3,-0.2 4,-2.8 2,-0.2 3,-0.8 0.911 109.5 46.9 -81.3 -47.5 26.2 43.5 36.8 157 179 A V H 3< S+ 0 0 18 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.1 0.768 115.4 46.1 -70.1 -24.7 25.7 40.4 34.7 158 180 A S T 3< S+ 0 0 69 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.511 126.0 28.3 -96.1 -3.7 29.4 39.9 34.2 159 181 A T T <> S+ 0 0 53 -3,-0.8 4,-1.0 -4,-0.3 -2,-0.2 0.739 112.6 55.6-117.5 -47.8 30.3 40.4 37.8 160 182 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 3,-0.3 0.869 98.4 56.7 -62.1 -47.3 27.5 39.4 40.1 161 183 A P H > S+ 0 0 1 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.904 105.1 51.4 -58.5 -45.5 26.7 35.8 39.2 162 184 A Q H > S+ 0 0 78 1,-0.2 4,-0.8 2,-0.2 7,-0.2 0.845 115.3 43.0 -58.9 -39.2 30.3 34.6 39.8 163 185 A V H < S+ 0 0 51 -4,-1.0 -1,-0.2 -3,-0.3 -3,-0.1 0.795 116.5 45.8 -81.4 -27.1 30.3 36.1 43.3 164 186 A V H < S+ 0 0 1 -4,-2.5 -2,-0.2 1,-0.1 -1,-0.1 0.891 126.9 27.6 -77.0 -41.5 26.7 35.1 44.3 165 187 A M H >< S- 0 0 4 -4,-2.9 3,-2.4 -5,-0.3 4,-0.2 0.461 88.4-168.9-104.5 -2.4 27.0 31.4 43.1 166 188 A G G >< S- 0 0 31 -4,-0.8 3,-0.9 -5,-0.3 -1,-0.2 -0.281 71.9 -5.1 54.8-123.3 30.8 31.0 43.5 167 189 A S G 3 S+ 0 0 56 1,-0.2 -1,-0.3 -4,-0.1 -4,-0.1 0.558 124.6 74.2 -81.7 -10.2 32.0 27.8 41.9 168 190 A S G < + 0 0 14 -3,-2.4 125,-3.2 124,-0.1 2,-1.2 0.578 69.5 103.1 -78.0 -9.1 28.5 26.7 41.0 169 191 A Y B X -h 293 0E 31 -3,-0.9 3,-1.3 -7,-0.2 4,-0.2 -0.652 57.7-166.3 -81.3 99.7 28.4 29.3 38.3 170 192 A G G > S+ 0 0 2 123,-2.2 3,-1.4 -2,-1.2 124,-0.2 0.720 74.2 67.0 -58.6 -30.6 28.9 27.2 35.2 171 193 A F G 3 S+ 0 0 101 122,-0.4 -1,-0.2 1,-0.3 123,-0.1 0.626 86.6 70.1 -76.1 -11.2 29.7 29.9 32.6 172 194 A Q G < S+ 0 0 63 -3,-1.3 2,-0.3 -5,-0.0 -1,-0.3 0.712 88.1 87.9 -70.6 -21.3 33.0 30.9 34.3 173 195 A Y < - 0 0 38 -3,-1.4 -3,-0.0 -4,-0.2 0, 0.0 -0.632 65.5-146.3 -93.6 136.6 34.6 27.6 33.1 174 196 A S > - 0 0 25 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.377 49.8 -95.1 -70.8 166.3 36.4 26.5 30.0 175 197 A P H > S+ 0 0 12 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.909 127.9 49.1 -58.2 -36.1 35.6 22.9 29.3 176 198 A G H > S+ 0 0 33 268,-0.4 4,-2.2 1,-0.2 5,-0.1 0.878 112.0 48.3 -69.1 -35.4 38.7 21.7 31.1 177 199 A Q H > S+ 0 0 88 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.858 109.2 53.9 -70.3 -33.5 38.0 23.8 34.1 178 200 A R H X S+ 0 0 19 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.902 111.1 45.3 -66.3 -45.7 34.4 22.5 34.1 179 201 A V H X S+ 0 0 3 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.907 109.3 56.8 -59.2 -43.2 35.7 19.0 34.1 180 202 A E H X S+ 0 0 116 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.950 110.6 43.4 -57.5 -51.1 38.2 19.9 36.8 181 203 A F H X S+ 0 0 34 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.912 114.7 48.5 -60.0 -48.0 35.4 21.1 39.0 182 204 A L H X S+ 0 0 12 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.885 114.3 46.0 -63.5 -40.0 33.1 18.2 38.4 183 205 A V H X S+ 0 0 8 -4,-3.1 4,-2.7 2,-0.2 -2,-0.2 0.898 113.1 48.4 -69.1 -42.2 35.9 15.6 39.0 184 206 A N H X S+ 0 0 97 -4,-2.5 4,-0.6 -5,-0.3 -2,-0.2 0.960 111.9 50.1 -63.4 -48.7 37.1 17.3 42.2 185 207 A T H >< S+ 0 0 10 -4,-2.5 3,-1.2 1,-0.2 4,-0.3 0.929 112.4 48.2 -50.0 -51.5 33.5 17.5 43.5 186 208 A W H >< S+ 0 0 34 -4,-2.1 3,-1.7 1,-0.3 -1,-0.2 0.933 109.5 50.4 -57.5 -48.7 33.0 13.8 42.7 187 209 A K H 3< S+ 0 0 133 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.500 99.6 68.1 -77.9 1.4 36.2 12.6 44.3 188 210 A S T << S+ 0 0 69 -3,-1.2 2,-0.5 -4,-0.6 -1,-0.3 0.491 84.4 82.0 -96.4 -4.4 35.4 14.5 47.5 189 211 A K S < S- 0 0 11 -3,-1.7 113,-0.0 -4,-0.3 114,-0.0 -0.869 72.9-141.8-101.3 130.7 32.5 12.4 48.4 190 212 A K S S+ 0 0 180 -2,-0.5 -1,-0.2 1,-0.3 113,-0.1 0.955 103.9 11.2 -48.8 -57.0 33.0 9.0 50.2 191 213 A N S S- 0 0 112 113,-0.1 113,-3.2 -3,-0.1 -1,-0.3 -0.842 94.5-152.3-123.4 92.8 30.2 7.5 48.2 192 214 A P E +I 303 0E 25 0, 0.0 2,-0.3 0, 0.0 111,-0.2 -0.337 18.6 176.7 -70.2 141.9 29.4 10.0 45.5 193 215 A M E +I 302 0E 0 109,-2.4 109,-3.2 -2,-0.1 2,-0.3 -0.981 9.7 167.1-137.2 137.5 26.0 10.3 43.9 194 216 A G E -IJ 301 335E 0 141,-1.8 141,-2.2 -2,-0.3 2,-0.3 -0.919 10.7-171.8-140.8 170.1 25.1 12.9 41.3 195 217 A F E -I 300 0E 1 105,-1.5 105,-1.7 -2,-0.3 2,-0.3 -0.955 22.3-124.6-162.5 144.9 22.4 13.7 38.8 196 218 A S E -I 299 0E 42 137,-0.3 137,-0.4 -2,-0.3 2,-0.3 -0.704 26.6-173.6 -82.6 142.6 21.4 16.0 35.9 197 219 A Y E +I 298 0E 4 101,-2.0 101,-2.4 -2,-0.3 2,-0.3 -0.954 5.0 176.0-127.8 150.5 18.2 18.0 36.2 198 220 A D - 0 0 65 132,-0.3 131,-1.6 -2,-0.3 2,-0.4 -0.959 27.4-118.4-154.6 142.2 16.7 20.2 33.4 199 221 A T B > -L 328 0F 2 -2,-0.3 3,-0.8 129,-0.2 2,-0.5 -0.700 25.6-114.1 -92.7 131.7 13.4 22.1 33.3 200 222 A R T 3 S- 0 0 98 127,-1.3 5,-0.1 -2,-0.4 -1,-0.1 -0.533 99.8 -21.8 -55.4 109.6 10.7 21.4 30.8 201 223 A C T 3> S- 0 0 15 -2,-0.5 4,-0.7 1,-0.1 -1,-0.3 0.939 79.9-166.8 31.8 84.2 10.8 24.7 28.9 202 224 A F H X> S+ 0 0 11 -3,-0.8 3,-0.7 1,-0.2 4,-0.7 0.823 76.9 62.7 -62.6 -41.7 12.5 26.7 31.6 203 225 A D H >4 S+ 0 0 23 1,-0.2 55,-1.4 2,-0.2 3,-1.4 0.930 105.2 47.9 -52.2 -45.9 11.8 30.2 30.2 204 226 A S H 34 S+ 0 0 0 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.2 0.703 105.1 59.8 -74.6 -16.9 8.1 29.7 30.5 205 227 A T H << S+ 0 0 1 -3,-0.7 2,-0.7 -4,-0.7 -1,-0.3 0.578 78.8 102.0 -82.3 -12.2 8.4 28.5 34.1 206 228 A V << - 0 0 0 -3,-1.4 52,-0.5 -4,-0.7 2,-0.1 -0.658 64.3-157.6 -80.8 113.2 10.0 31.8 35.2 207 229 A T > - 0 0 11 -2,-0.7 4,-1.3 50,-0.1 5,-0.1 -0.313 30.5-100.8 -86.5 172.2 7.2 33.6 36.9 208 230 A E H > S+ 0 0 80 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.842 121.7 56.4 -57.0 -36.8 6.8 37.3 37.5 209 231 A N H > S+ 0 0 73 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.938 100.4 56.6 -68.0 -45.7 7.9 36.8 41.1 210 232 A D H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.882 108.8 48.0 -46.2 -45.1 11.2 35.2 40.1 211 233 A I H X S+ 0 0 1 -4,-1.3 4,-2.6 2,-0.2 -1,-0.2 0.865 111.0 49.4 -67.3 -34.5 12.0 38.3 38.0 212 234 A R H X S+ 0 0 100 -4,-1.7 4,-1.0 2,-0.2 -2,-0.2 0.807 113.5 47.9 -72.8 -29.6 11.0 40.6 40.9 213 235 A V H X S+ 0 0 17 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.877 111.7 49.7 -72.2 -43.7 13.3 38.5 43.1 214 236 A E H >X S+ 0 0 3 -4,-2.4 4,-2.1 -5,-0.2 3,-1.1 0.968 110.0 49.7 -61.7 -55.3 16.1 38.6 40.6 215 237 A E H 3X S+ 0 0 35 -4,-2.6 4,-2.2 1,-0.3 -1,-0.2 0.825 108.1 55.2 -52.1 -35.7 15.8 42.4 40.2 216 238 A S H 3< S+ 0 0 30 -4,-1.0 4,-0.4 1,-0.2 -1,-0.3 0.797 104.2 53.1 -77.1 -25.4 15.9 42.6 44.0 217 239 A I H X< S+ 0 0 3 -4,-1.4 3,-0.8 -3,-1.1 4,-0.3 0.915 109.7 49.8 -67.0 -41.7 19.2 40.7 44.0 218 240 A Y H >< S+ 0 0 0 -4,-2.1 3,-2.1 1,-0.2 -2,-0.2 0.904 105.6 55.2 -60.4 -42.5 20.5 43.2 41.5 219 241 A Q T 3< S+ 0 0 43 -4,-2.2 -1,-0.2 1,-0.3 4,-0.2 0.627 92.2 74.0 -72.1 -11.8 19.4 46.2 43.6 220 242 A C T < S+ 0 0 36 -3,-0.8 -1,-0.3 -4,-0.4 -2,-0.2 0.716 83.2 88.9 -68.8 -21.6 21.4 44.6 46.4 221 243 A C S < S- 0 0 1 -3,-2.1 2,-0.9 -4,-0.3 -162,-0.2 -0.415 96.2-102.6 -71.9 153.2 24.6 45.8 44.5 222 244 A D B +g 59 0D 80 -164,-2.4 -162,-2.5 -167,-0.2 2,-0.3 -0.675 61.4 171.6 -72.2 107.7 26.1 49.2 45.1 223 245 A L - 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0 0 74 -2,-0.5 3,-1.9 -13,-0.2 4,-0.2 -0.888 15.6-140.7 -96.1 125.5 41.5 31.3 10.5 434 456 A P G > S+ 0 0 5 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.833 99.7 64.3 -52.3 -37.5 41.9 27.5 10.2 435 457 A L G 3 S+ 0 0 13 1,-0.3 -17,-0.0 -18,-0.2 63,-0.0 0.710 95.5 60.9 -63.6 -18.6 45.6 27.7 10.3 436 458 A D G X> S+ 0 0 49 -3,-1.9 4,-1.7 1,-0.2 3,-0.7 0.488 71.7 102.3 -85.2 -6.8 45.4 29.1 13.8 437 459 A L H <> S+ 0 0 4 -3,-1.8 4,-3.2 1,-0.2 5,-0.3 0.818 72.1 61.1 -52.7 -40.4 43.7 26.1 15.5 438 460 A P H 3> S+ 0 0 4 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.920 107.9 43.0 -52.8 -48.4 46.9 24.7 17.1 439 461 A Q H <> S+ 0 0 83 -3,-0.7 4,-2.3 2,-0.2 -2,-0.2 0.894 114.9 52.2 -63.7 -43.8 47.5 27.8 19.3 440 462 A I H X S+ 0 0 25 -4,-1.7 4,-2.3 2,-0.2 6,-0.2 0.965 112.8 41.8 -55.0 -57.5 43.7 27.9 20.1 441 463 A I H X>S+ 0 0 1 -4,-3.2 4,-3.7 1,-0.3 5,-1.0 0.896 114.4 52.3 -65.1 -39.4 43.5 24.3 21.2 442 464 A E H X5S+ 0 0 90 -4,-2.6 4,-0.6 -5,-0.3 -1,-0.3 0.866 112.8 45.6 -60.2 -38.8 46.8 24.6 23.1 443 465 A R H <5S+ 0 0 189 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.863 120.7 39.9 -71.1 -35.1 45.5 27.7 24.9 444 466 A L H <5S+ 0 0 41 -4,-2.3 -268,-0.4 -5,-0.2 -2,-0.2 0.850 139.7 4.3 -89.4 -37.4 42.2 26.1 25.6 445 467 A H H <5S- 0 0 35 -4,-3.7 3,-0.3 -5,-0.2 -3,-0.2 0.452 99.1-123.1-125.2 -12.6 43.1 22.5 26.5 446 468 A G ><< - 0 0 24 -5,-1.0 3,-2.0 -4,-0.6 -3,-0.1 -0.009 45.9 -59.8 79.7 167.3 46.9 22.6 26.5 447 469 A L G > S+ 0 0 82 1,-0.3 3,-1.9 2,-0.2 4,-0.2 0.627 122.1 78.4 -62.3 -17.9 49.2 20.3 24.5 448 470 A S G >> S+ 0 0 45 -3,-0.3 3,-1.8 1,-0.3 4,-0.5 0.782 78.1 74.4 -62.7 -23.4 47.9 17.1 26.1 449 471 A A G <4 S+ 0 0 2 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.589 94.9 50.3 -67.5 -8.8 44.9 17.5 23.7 450 472 A F G <4 S+ 0 0 8 -3,-1.9 -1,-0.3 1,-0.1 -2,-0.2 0.434 112.4 46.1-103.6 -2.3 47.1 16.4 20.8 451 473 A S T <4 S+ 0 0 44 -3,-1.8 -2,-0.2 -4,-0.2 2,-0.2 0.263 75.6 134.6-120.1 2.8 48.4 13.3 22.7 452 474 A L < + 0 0 7 -4,-0.5 2,-0.3 -99,-0.1 -99,-0.2 -0.419 27.1 146.9 -64.9 127.1 45.1 11.9 24.1 453 475 A H B +O 352 0H 76 -101,-2.5 -101,-2.9 1,-0.2 -2,-0.1 -0.885 36.7 52.4-146.5 180.0 44.9 8.2 23.5 454 476 A S S S- 0 0 71 -2,-0.3 -1,-0.2 -103,-0.2 2,-0.1 0.967 72.4-164.9 48.9 65.6 43.5 5.0 25.1 455 477 A Y - 0 0 25 -104,-0.2 -104,-0.2 1,-0.1 -1,-0.1 -0.455 30.0 -82.9 -80.6 153.1 40.0 6.4 25.5 456 478 A S > - 0 0 14 -106,-1.8 4,-2.1 -2,-0.1 3,-0.2 -0.203 37.0-123.8 -56.4 142.9 37.4 4.7 27.7 457 479 A P H > S+ 0 0 102 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.803 109.1 57.4 -63.5 -31.4 35.6 1.8 26.0 458 480 A G H > S+ 0 0 43 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.915 107.9 47.2 -60.9 -46.7 32.2 3.3 26.6 459 481 A E H > S+ 0 0 3 -3,-0.2 4,-2.0 2,-0.2 5,-0.2 0.924 110.1 52.1 -60.9 -48.6 33.2 6.5 24.7 460 482 A I H X S+ 0 0 61 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.947 110.7 48.9 -56.8 -49.9 34.7 4.5 21.8 461 483 A N H X S+ 0 0 113 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.860 107.5 53.4 -51.9 -44.6 31.5 2.5 21.4 462 484 A R H X S+ 0 0 66 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.934 111.5 45.5 -65.0 -43.0 29.2 5.5 21.5 463 485 A V H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.954 114.0 49.0 -61.5 -51.3 31.1 7.2 18.7 464 486 A A H X S+ 0 0 32 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.908 113.1 47.5 -53.4 -50.0 31.2 3.9 16.7 465 487 A S H X S+ 0 0 48 -4,-3.1 4,-1.5 1,-0.2 -1,-0.2 0.909 110.1 53.5 -54.6 -48.7 27.5 3.4 17.1 466 488 A C H X S+ 0 0 3 -4,-2.5 4,-1.6 -5,-0.2 6,-0.2 0.866 107.1 50.0 -60.6 -40.9 26.8 7.0 16.2 467 489 A L H X>S+ 0 0 2 -4,-2.3 5,-1.7 1,-0.2 4,-1.0 0.918 110.8 49.1 -63.8 -42.2 28.8 6.7 12.9 468 490 A R H <5S+ 0 0 172 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.764 110.4 53.1 -69.4 -25.1 26.9 3.6 11.8 469 491 A K H <5S+ 0 0 113 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.871 111.3 42.7 -77.1 -39.3 23.6 5.2 12.6 470 492 A L H <5S- 0 0 24 -4,-1.6 -2,-0.2 -5,-0.1 -1,-0.2 0.513 115.1-105.7 -91.4 -6.9 24.1 8.3 10.5 471 493 A G T <5S+ 0 0 70 -4,-1.0 -3,-0.2 1,-0.3 -4,-0.1 0.487 73.3 139.4 98.2 7.0 25.6 6.7 7.4 472 494 A V < - 0 0 34 -5,-1.7 -1,-0.3 -6,-0.2 -2,-0.1 -0.679 59.2 -95.9 -94.1 138.1 29.1 7.8 8.1 473 495 A P - 0 0 40 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.032 45.1-102.2 -43.5 144.2 32.2 5.6 7.5 474 496 A P >> - 0 0 84 0, 0.0 3,-1.2 0, 0.0 4,-1.0 -0.126 38.7 -95.6 -59.4 166.7 33.7 3.7 10.5 475 497 A L H 3> S+ 0 0 34 1,-0.3 4,-1.3 2,-0.2 5,-0.2 0.662 117.9 70.3 -63.6 -20.9 36.8 4.9 12.3 476 498 A R H 3> S+ 0 0 229 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.897 99.7 49.0 -64.8 -37.4 39.1 2.7 10.3 477 499 A V H <> S+ 0 0 50 -3,-1.2 4,-3.3 1,-0.2 5,-0.2 0.894 107.6 54.5 -66.3 -43.0 38.5 4.8 7.2 478 500 A W H X S+ 0 0 8 -4,-1.0 4,-1.5 1,-0.2 -1,-0.2 0.706 105.1 52.4 -69.3 -24.3 39.2 8.0 9.2 479 501 A R H X S+ 0 0 156 -4,-1.3 4,-1.5 -3,-0.2 -1,-0.2 0.874 114.7 43.6 -75.0 -39.2 42.6 6.8 10.3 480 502 A H H >X S+ 0 0 66 -4,-1.5 4,-1.1 2,-0.2 3,-0.8 0.996 116.4 45.1 -64.9 -62.2 43.5 6.0 6.6 481 503 A R H >< S+ 0 0 115 -4,-3.3 3,-0.8 1,-0.3 4,-0.4 0.863 110.6 56.0 -48.6 -45.9 42.0 9.3 5.3 482 504 A A H >X S+ 0 0 0 -4,-1.5 4,-2.8 1,-0.3 3,-1.3 0.862 100.4 56.9 -58.8 -40.3 43.7 11.2 8.0 483 505 A R H S+ 0 0 3 -3,-1.3 4,-1.4 -4,-0.4 -2,-0.2 0.703 114.5 48.9 -99.1 -34.2 45.5 14.7 5.0 486 508 A R H X S+ 0 0 56 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.921 112.5 44.6 -68.3 -50.9 48.4 14.9 7.4 487 509 A A H X S+ 0 0 52 -4,-1.8 4,-1.7 -5,-0.2 -1,-0.2 0.873 110.0 57.6 -63.3 -36.8 51.2 14.0 4.9 488 510 A R H 4 S+ 0 0 105 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.900 108.7 46.8 -59.0 -43.9 49.6 16.4 2.4 489 511 A L H >X S+ 0 0 0 -4,-1.4 3,-1.3 1,-0.2 4,-0.5 0.821 106.8 54.5 -68.4 -38.7 50.0 19.2 4.9 490 512 A L H >< S+ 0 0 80 -4,-1.8 3,-0.9 1,-0.3 -1,-0.2 0.842 102.9 59.6 -65.9 -31.2 53.6 18.3 5.9 491 513 A S T 3< S+ 0 0 113 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.611 101.1 57.2 -65.0 -16.9 54.4 18.6 2.1 492 514 A Q T <4 S- 0 0 110 -3,-1.3 -1,-0.2 -4,-0.2 4,-0.2 0.585 95.0-159.6 -95.9 -13.8 53.1 22.2 2.4 493 515 A G XX + 0 0 32 -3,-0.9 4,-1.0 -4,-0.5 3,-0.9 0.225 49.0 39.7 63.1 176.0 55.6 23.4 5.1 494 516 A G H 3> S- 0 0 66 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 -0.201 124.7 -0.1 50.7-122.9 55.4 26.3 7.5 495 517 A R H >> S+ 0 0 108 1,-0.2 4,-1.3 2,-0.2 3,-0.9 0.880 132.8 52.2 -70.0 -45.0 52.0 26.9 9.0 496 518 A A H <> S+ 0 0 10 -3,-0.9 4,-1.6 1,-0.3 3,-0.4 0.897 105.7 56.6 -60.1 -41.5 50.1 24.1 7.2 497 519 A A H 3X S+ 0 0 18 -4,-1.0 4,-1.9 1,-0.2 -1,-0.3 0.717 100.4 60.0 -61.0 -23.4 52.7 21.5 8.4 498 520 A T H S+ 0 0 0 -4,-0.5 3,-1.9 -5,-0.3 4,-0.3 0.169 78.3 114.5-145.3 13.3 46.8 14.7 13.2 505 527 A N G > + 0 0 63 1,-0.3 3,-0.7 -3,-0.3 -2,-0.1 0.679 69.1 73.9 -62.8 -15.6 49.8 13.4 15.1 506 528 A W G 3 S+ 0 0 46 1,-0.2 -1,-0.3 -4,-0.1 -2,-0.0 0.563 87.9 62.6 -72.0 -8.7 47.4 10.6 16.4 507 529 A A G < S+ 0 0 3 -3,-1.9 -1,-0.2 -25,-0.1 -2,-0.2 0.674 72.0 103.0 -96.5 -20.6 47.5 9.0 12.9 508 530 A V < 0 0 61 -3,-0.7 -25,-0.0 -4,-0.3 -29,-0.0 -0.453 360.0 360.0 -65.3 138.0 51.2 8.1 12.7 509 531 A K 0 0 202 -2,-0.1 -1,-0.1 0, 0.0 -3,-0.0 0.669 360.0 360.0 -78.6 360.0 51.6 4.3 13.3