==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 24-JAN-11 3QGE . COMPND 2 MOLECULE: RNA-DIRECTED RNA POLYMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HEPATITIS C VIRUS SUBTYPE 1B; . AUTHOR S.SHERIFF . 1072 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44328.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 726 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 10.6 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 . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 3 0.3 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 . 40 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 109 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 392 36.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.1 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 3 4 2 0 4 2 2 2 4 4 4 0 2 3 1 0 2 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 PARALLEL BRIDGES PER LADDER . 13 0 2 2 4 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 4 0 4 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 61 0, 0.0 33,-1.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 158.3 34.9 -17.8 30.5 2 2 A M B -A 33 0A 82 31,-0.2 31,-0.2 1,-0.1 3,-0.1 -0.566 360.0-139.4 -73.0 132.6 34.5 -18.5 26.7 3 3 A S S S+ 0 0 0 29,-2.5 253,-3.1 -2,-0.3 254,-0.3 0.914 88.8 5.3 -57.4 -41.4 32.3 -15.9 24.9 4 4 A Y E -B 255 0B 14 251,-0.2 2,-0.4 28,-0.2 251,-0.2 -0.967 60.3-160.7-142.0 151.7 30.9 -18.9 23.0 5 5 A T E -B 254 0B 71 249,-2.3 249,-2.7 -2,-0.3 2,-0.3 -0.978 21.1-152.7-129.2 138.0 31.1 -22.7 23.0 6 6 A W E -B 253 0B 67 -2,-0.4 247,-0.3 247,-0.2 246,-0.1 -0.918 23.7-160.4-120.5 144.7 30.0 -24.6 19.9 7 7 A T - 0 0 80 245,-1.6 246,-0.1 -2,-0.3 -1,-0.1 0.712 53.2-111.4 -86.4 -28.1 28.7 -28.1 19.3 8 8 A G S S+ 0 0 62 244,-0.5 244,-0.1 1,-0.5 2,-0.1 0.193 73.5 137.2 109.9 -12.9 29.6 -28.0 15.6 9 9 A A - 0 0 28 242,-0.4 -1,-0.5 1,-0.1 -2,-0.2 -0.440 61.3-107.4 -62.4 133.5 25.9 -27.9 14.4 10 10 A L - 0 0 126 -2,-0.1 2,-0.9 -3,-0.1 240,-0.1 -0.315 17.7-111.7 -69.9 151.8 25.8 -25.3 11.6 11 11 A I - 0 0 8 9,-0.2 12,-0.2 235,-0.1 13,-0.1 -0.789 51.6-147.9 -79.8 106.6 24.3 -21.8 11.9 12 12 A T - 0 0 10 -2,-0.9 235,-0.4 104,-0.2 106,-0.3 -0.536 8.2-103.7 -86.0 152.4 21.5 -22.6 9.5 13 13 A P 0 0 83 0, 0.0 -1,-0.1 0, 0.0 6,-0.0 -0.281 360.0 360.0 -70.0 160.6 19.7 -20.3 7.0 14 14 A C 0 0 126 104,-0.2 6,-0.0 234,-0.0 234,-0.0 -0.594 360.0 360.0 -81.4 360.0 16.1 -18.9 7.7 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 38 A Y 0 0 38 0, 0.0 107,-2.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 152.9 27.1 -8.7 -2.3 17 39 A A B -F 122 0C 31 105,-0.2 2,-0.2 103,-0.0 105,-0.2 -0.856 360.0-119.4-107.7 141.8 24.8 -9.9 0.5 18 40 A T - 0 0 2 103,-2.3 2,-0.3 -2,-0.4 118,-0.0 -0.611 39.4-174.9 -80.8 134.0 26.2 -11.6 3.7 19 41 A T > - 0 0 46 -2,-0.2 3,-1.8 101,-0.1 116,-0.5 -0.884 43.2 -96.9-131.2 169.5 24.9 -15.2 4.2 20 42 A S G > S+ 0 0 25 -2,-0.3 3,-1.3 1,-0.3 4,-0.4 0.677 112.2 75.7 -55.5 -24.6 25.0 -18.2 6.6 21 43 A R G 3 S+ 0 0 206 1,-0.3 3,-0.4 2,-0.1 -1,-0.3 0.818 97.5 46.2 -57.4 -36.4 27.9 -19.7 4.4 22 44 A S G X> S+ 0 0 25 -3,-1.8 4,-1.2 1,-0.2 3,-1.1 0.465 83.5 99.1 -87.6 -4.4 30.3 -17.2 6.0 23 45 A A H <> S+ 0 0 2 -3,-1.3 4,-2.6 1,-0.2 3,-0.3 0.840 75.2 60.7 -50.6 -43.5 29.0 -17.8 9.6 24 46 A S H 3> S+ 0 0 68 -3,-0.4 4,-1.6 -4,-0.4 -1,-0.2 0.811 102.3 52.3 -54.6 -37.5 32.0 -20.1 10.4 25 47 A L H <> S+ 0 0 116 -3,-1.1 4,-1.2 2,-0.2 -1,-0.2 0.891 111.7 45.7 -67.8 -40.7 34.5 -17.2 9.7 26 48 A R H X S+ 0 0 33 -4,-1.2 4,-2.4 -3,-0.3 3,-0.3 0.919 107.2 58.7 -66.6 -46.8 32.6 -15.0 12.2 27 49 A Q H X S+ 0 0 27 -4,-2.6 4,-0.8 1,-0.2 -2,-0.2 0.864 104.0 51.7 -51.1 -43.7 32.4 -17.8 14.8 28 50 A K H >< S+ 0 0 182 -4,-1.6 3,-0.5 1,-0.2 -1,-0.2 0.903 112.2 46.0 -61.7 -43.4 36.2 -18.0 14.9 29 51 A K H 3< S+ 0 0 94 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.900 114.6 45.3 -66.4 -44.6 36.6 -14.3 15.5 30 52 A V H 3< S+ 0 0 12 -4,-2.4 2,-0.7 1,-0.1 -1,-0.2 0.446 95.0 91.2 -79.9 -5.7 33.9 -13.9 18.2 31 53 A T << + 0 0 37 -4,-0.8 2,-0.3 -3,-0.5 -29,-0.1 -0.873 54.0 113.3-103.3 109.6 35.1 -17.1 20.2 32 54 A F - 0 0 44 -2,-0.7 -29,-2.5 172,-0.1 2,-0.3 -0.969 63.3 -98.6-163.6 161.5 37.7 -16.4 22.9 33 55 A D B -A 2 0A 106 -2,-0.3 2,-0.4 -31,-0.2 -31,-0.2 -0.653 38.2-134.0 -86.1 143.4 38.2 -16.4 26.7 34 56 A R - 0 0 20 -33,-1.6 2,-0.5 -2,-0.3 171,-0.0 -0.889 16.4-169.5-106.4 136.3 37.9 -13.1 28.5 35 57 A L - 0 0 85 -2,-0.4 2,-0.4 2,-0.0 290,-0.2 -0.986 14.3-178.6-122.7 106.7 40.3 -11.8 31.1 36 58 A Q - 0 0 45 -2,-0.5 2,-0.4 288,-0.1 288,-0.2 -0.955 11.0-175.6-116.4 129.8 39.0 -8.8 32.9 37 59 A V - 0 0 95 286,-2.7 2,-0.3 -2,-0.4 288,-0.1 -0.978 11.3-159.5-126.7 115.5 40.8 -6.8 35.7 38 60 A L - 0 0 51 -2,-0.4 2,-0.2 286,-0.1 -2,-0.0 -0.671 9.9-175.4 -96.1 149.6 39.0 -4.0 37.4 39 61 A D > - 0 0 37 -2,-0.3 4,-1.9 285,-0.0 5,-0.1 -0.623 44.6 -81.7-128.3-172.8 40.7 -1.1 39.3 40 62 A D H > S+ 0 0 108 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.817 123.0 58.4 -66.6 -33.5 39.7 2.0 41.4 41 63 A H H > S+ 0 0 56 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.933 108.1 47.4 -61.1 -46.1 39.0 4.2 38.3 42 64 A Y H > S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.932 113.1 48.0 -57.8 -51.2 36.4 1.7 37.2 43 65 A R H X S+ 0 0 91 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.878 112.1 49.8 -61.0 -39.4 34.8 1.5 40.7 44 66 A D H X S+ 0 0 71 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.929 112.1 45.8 -63.8 -51.3 34.7 5.3 41.0 45 67 A V H X S+ 0 0 4 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.923 111.8 53.9 -58.9 -45.4 33.0 5.9 37.6 46 68 A L H X S+ 0 0 13 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.934 108.5 47.8 -54.4 -52.1 30.5 3.0 38.4 47 69 A K H X S+ 0 0 88 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.855 112.1 50.7 -58.6 -37.2 29.5 4.6 41.8 48 70 A E H X S+ 0 0 94 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.896 111.5 47.3 -66.5 -41.3 29.0 8.0 40.0 49 71 A M H X S+ 0 0 4 -4,-2.5 4,-2.2 2,-0.2 3,-0.2 0.913 111.3 51.8 -64.3 -45.0 26.8 6.4 37.3 50 72 A K H X S+ 0 0 3 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.862 104.5 56.0 -61.8 -39.1 24.8 4.6 40.0 51 73 A A H < S+ 0 0 29 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.865 110.8 45.0 -62.9 -35.9 24.2 7.9 41.8 52 74 A K H >< S+ 0 0 117 -4,-1.3 3,-1.4 -3,-0.2 -2,-0.2 0.886 109.3 54.6 -75.1 -36.7 22.7 9.3 38.6 53 75 A A H >< S+ 0 0 0 -4,-2.2 3,-2.4 1,-0.3 -2,-0.2 0.836 94.2 73.1 -62.5 -31.9 20.6 6.1 38.0 54 76 A S T 3< S+ 0 0 1 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.637 87.6 61.5 -54.8 -22.7 19.1 6.6 41.5 55 77 A T T < S+ 0 0 63 -3,-1.4 2,-0.3 -4,-0.2 -1,-0.3 0.568 85.3 104.0 -83.8 -12.0 17.1 9.6 40.2 56 78 A V < - 0 0 9 -3,-2.4 166,-2.5 -4,-0.2 2,-0.5 -0.596 48.2-170.1 -82.1 134.8 15.1 7.3 37.7 57 79 A K B -g 222 0D 109 -2,-0.3 2,-0.4 164,-0.2 166,-0.2 -0.989 15.0-167.6-118.3 117.4 11.5 6.1 38.2 58 80 A A - 0 0 10 164,-2.7 2,-0.3 -2,-0.5 166,-0.2 -0.898 10.6-137.6-111.6 143.6 10.5 3.4 35.7 59 81 A K - 0 0 136 -2,-0.4 96,-0.5 164,-0.1 2,-0.4 -0.703 16.3-122.4 -99.7 148.2 7.1 2.1 34.9 60 82 A L - 0 0 58 -2,-0.3 2,-0.3 95,-0.1 92,-0.2 -0.757 32.3-133.9 -83.1 125.9 6.1 -1.5 34.3 61 83 A L - 0 0 14 90,-2.6 2,-0.1 -2,-0.4 93,-0.0 -0.670 17.0-121.7 -82.9 145.1 4.4 -1.7 30.9 62 84 A S > - 0 0 45 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.401 28.9-104.3 -76.8 165.9 1.1 -3.7 30.6 63 85 A V H > S+ 0 0 10 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.939 123.4 51.0 -53.0 -49.8 0.9 -6.7 28.2 64 86 A E H > S+ 0 0 91 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.886 109.9 46.8 -55.8 -49.4 -1.1 -4.4 25.8 65 87 A E H > S+ 0 0 105 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.892 114.9 48.1 -62.7 -39.5 1.4 -1.5 25.8 66 88 A A H >< S+ 0 0 0 -4,-2.4 3,-0.5 1,-0.2 4,-0.3 0.843 110.1 52.3 -69.0 -34.5 4.2 -4.1 25.3 67 89 A C H >< S+ 0 0 0 -4,-2.5 3,-1.6 1,-0.2 -2,-0.2 0.897 103.2 57.8 -67.0 -42.3 2.3 -5.7 22.4 68 90 A K H 3< S+ 0 0 150 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.672 102.4 55.8 -61.4 -22.8 1.8 -2.4 20.7 69 91 A L T << S+ 0 0 20 -4,-0.6 470,-1.8 -3,-0.5 -1,-0.3 0.505 83.1 107.0 -88.6 -7.6 5.6 -1.9 20.5 70 92 A T S < S- 0 0 0 -3,-1.6 468,-0.1 -4,-0.3 467,-0.1 -0.585 76.4-118.6 -75.0 127.2 6.1 -5.2 18.7 71 93 A P > - 0 0 16 0, 0.0 3,-1.9 0, 0.0 16,-0.1 -0.368 19.4-124.6 -63.3 141.7 7.1 -4.8 14.9 72 94 A P T 3 S+ 0 0 43 0, 0.0 12,-0.3 0, 0.0 11,-0.2 0.772 112.1 43.9 -59.4 -26.1 4.5 -6.5 12.6 73 95 A H T 3 S+ 0 0 153 10,-0.1 3,-0.1 9,-0.1 -3,-0.0 0.208 82.2 139.1-105.7 20.8 7.2 -8.6 10.9 74 96 A S S < S- 0 0 13 -3,-1.9 9,-0.7 1,-0.1 10,-0.1 -0.322 70.3 -83.0 -61.6 139.1 8.9 -9.6 14.2 75 97 A A - 0 0 48 7,-0.1 68,-0.2 1,-0.1 -1,-0.1 -0.162 53.2-111.6 -50.3 130.7 9.9 -13.3 14.2 76 98 A R - 0 0 156 -3,-0.1 6,-0.3 1,-0.1 67,-0.2 -0.225 31.8-102.2 -65.4 156.7 7.0 -15.6 15.1 77 99 A S > - 0 0 4 4,-2.7 3,-0.7 65,-0.1 4,-0.4 -0.484 13.8-132.3 -76.9 154.4 7.0 -17.5 18.4 78 100 A K T 3 S+ 0 0 98 1,-0.2 -1,-0.1 -2,-0.1 4,-0.1 0.526 101.0 74.8 -79.8 -2.0 7.8 -21.2 18.4 79 101 A F T 3 S- 0 0 115 2,-0.2 -1,-0.2 14,-0.0 3,-0.1 0.022 121.8 -83.9-103.6 29.7 4.5 -21.5 20.6 80 102 A G S < S+ 0 0 36 -3,-0.7 2,-0.3 1,-0.2 -2,-0.1 0.711 96.3 83.8 83.3 28.9 1.9 -21.0 17.8 81 103 A Y - 0 0 1 -4,-0.4 -4,-2.7 11,-0.1 -1,-0.2 -0.982 52.4-153.0-154.6 155.8 1.5 -17.3 17.3 82 104 A G > - 0 0 3 -2,-0.3 4,-1.6 -6,-0.3 3,-0.2 -0.570 43.0 -82.4-119.6-176.5 3.2 -14.5 15.4 83 105 A A H > S+ 0 0 4 -9,-0.7 4,-2.6 1,-0.2 5,-0.2 0.805 124.9 57.5 -56.8 -35.8 3.7 -10.7 15.6 84 106 A K H > S+ 0 0 148 -12,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.913 107.1 47.6 -64.5 -44.3 0.2 -10.1 14.0 85 107 A D H 4>S+ 0 0 54 2,-0.2 5,-2.9 -3,-0.2 4,-0.3 0.867 112.1 51.6 -61.9 -39.9 -1.5 -12.1 16.8 86 108 A V H ><5S+ 0 0 0 -4,-1.6 3,-1.6 3,-0.2 -2,-0.2 0.959 111.7 44.6 -62.0 -53.8 0.6 -10.1 19.4 87 109 A R H 3<5S+ 0 0 65 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.795 113.7 51.0 -62.6 -31.6 -0.4 -6.6 18.0 88 110 A N T 3<5S- 0 0 105 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.468 109.9-124.8 -84.0 -3.9 -4.1 -7.8 17.7 89 111 A L T < 5 - 0 0 80 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.876 39.1-168.6 57.8 43.4 -3.9 -8.9 21.4 90 112 A S >< - 0 0 30 -5,-2.9 4,-2.5 -6,-0.1 5,-0.2 -0.322 29.4-119.2 -61.6 142.5 -5.1 -12.4 20.4 91 113 A S H > S+ 0 0 86 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.850 112.7 49.4 -52.0 -41.2 -6.1 -14.7 23.3 92 114 A K H > S+ 0 0 122 2,-0.2 4,-2.1 3,-0.2 -1,-0.2 0.932 113.8 44.4 -65.1 -50.2 -3.4 -17.3 22.5 93 115 A A H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.955 117.0 46.2 -58.0 -54.3 -0.5 -14.7 22.2 94 116 A V H X S+ 0 0 22 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.899 112.5 49.4 -56.0 -50.6 -1.7 -12.9 25.4 95 117 A N H X S+ 0 0 98 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.866 113.4 47.4 -59.6 -39.8 -2.2 -16.1 27.4 96 118 A H H X S+ 0 0 37 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.922 110.9 50.7 -68.4 -43.3 1.3 -17.3 26.4 97 119 A I H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.932 109.7 51.0 -58.7 -45.9 2.9 -13.9 27.2 98 120 A R H X S+ 0 0 123 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.840 111.1 47.8 -61.8 -35.5 1.3 -13.9 30.7 99 121 A S H X S+ 0 0 60 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.860 110.8 51.1 -74.6 -35.1 2.6 -17.5 31.4 100 122 A V H X S+ 0 0 18 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.934 113.5 46.6 -63.0 -46.0 6.2 -16.4 30.1 101 123 A W H X S+ 0 0 26 -4,-2.7 4,-1.8 2,-0.2 3,-0.3 0.922 111.3 49.7 -59.3 -51.5 5.9 -13.4 32.6 102 124 A K H X S+ 0 0 123 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.885 110.2 52.6 -56.6 -42.0 4.7 -15.7 35.5 103 125 A D H X S+ 0 0 65 -4,-2.2 4,-3.2 1,-0.2 -1,-0.2 0.833 105.6 53.6 -64.8 -35.3 7.6 -18.0 34.8 104 126 A L H < S+ 0 0 1 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.882 111.1 46.8 -65.7 -38.5 10.1 -15.1 35.0 105 127 A L H < S+ 0 0 25 -4,-1.8 -2,-0.2 1,-0.1 -1,-0.2 0.803 122.4 35.0 -72.7 -28.4 8.7 -14.2 38.4 106 128 A E H < S+ 0 0 116 -4,-1.6 2,-0.6 1,-0.2 -2,-0.2 0.823 112.2 56.7 -94.5 -41.4 8.8 -17.9 39.6 107 129 A D < + 0 0 42 -4,-3.2 -1,-0.2 -5,-0.2 130,-0.1 -0.894 53.1 169.3 -99.6 117.4 11.9 -19.3 38.0 108 130 A T S S+ 0 0 18 -2,-0.6 128,-0.1 541,-0.2 -1,-0.1 0.435 73.8 33.6-104.0 -6.0 15.1 -17.3 38.8 109 131 A E S S+ 0 0 68 540,-0.1 -2,-0.1 127,-0.1 540,-0.0 0.766 76.4 105.6-121.2 -41.4 17.7 -19.7 37.4 110 132 A T S S- 0 0 76 1,-0.1 127,-0.1 132,-0.0 -3,-0.1 -0.329 70.7-117.9 -56.1 120.2 16.8 -21.8 34.3 111 133 A P - 0 0 56 0, 0.0 2,-0.3 0, 0.0 127,-0.2 -0.165 25.6-128.6 -56.6 142.7 18.5 -20.5 31.2 112 134 A I - 0 0 17 125,-2.8 2,-0.1 129,-0.4 129,-0.0 -0.756 25.0-112.1 -92.5 140.4 16.2 -19.2 28.5 113 135 A D - 0 0 75 -2,-0.3 29,-0.6 129,-0.1 2,-0.3 -0.464 33.3-168.4 -72.6 147.9 16.6 -20.6 25.0 114 136 A T E -Cd 141 244B 0 129,-1.2 131,-2.3 27,-0.2 2,-0.4 -0.950 17.7-128.5-131.8 156.5 17.8 -18.3 22.2 115 137 A T E -Cd 140 245B 34 25,-2.9 25,-2.2 -2,-0.3 2,-0.4 -0.877 17.5-151.0-104.4 136.4 18.0 -18.6 18.4 116 138 A I E +C 139 0B 0 129,-2.3 131,-0.4 -2,-0.4 2,-0.3 -0.902 22.5 169.3-106.8 134.1 21.3 -17.9 16.6 117 139 A M E -C 138 0B 33 21,-2.3 21,-3.2 -2,-0.4 2,-0.4 -0.990 36.6-117.5-143.5 150.1 21.1 -16.6 13.0 118 140 A A E -C 137 0B 8 -106,-0.3 2,-0.3 -2,-0.3 19,-0.2 -0.767 37.6-126.0 -87.9 132.2 23.6 -15.2 10.4 119 141 A K - 0 0 89 17,-3.8 2,-0.7 -2,-0.4 17,-0.4 -0.641 12.2-138.3 -82.5 139.4 22.5 -11.6 9.5 120 142 A N + 0 0 97 -2,-0.3 2,-0.3 15,-0.1 -101,-0.1 -0.905 35.8 162.8-101.5 106.6 22.0 -10.8 5.8 121 143 A E - 0 0 22 -2,-0.7 -103,-2.3 15,-0.0 2,-0.4 -0.954 35.7-122.6-125.3 146.8 23.5 -7.4 5.1 122 144 A V B +F 17 0C 19 -2,-0.3 2,-0.3 -105,-0.2 -105,-0.2 -0.757 33.8 170.6 -94.6 129.3 24.5 -5.8 1.8 123 145 A F - 0 0 19 -107,-2.6 2,-0.5 -2,-0.4 9,-0.0 -0.909 38.4 -90.9-132.2 158.4 28.1 -4.5 1.4 124 146 A C - 0 0 22 -2,-0.3 2,-1.6 1,-0.1 244,-0.1 -0.673 31.4-121.0 -86.5 128.1 30.0 -3.3 -1.6 125 147 A V + 0 0 85 -2,-0.5 -1,-0.1 1,-0.1 7,-0.0 -0.414 45.9 165.8 -58.5 77.1 31.9 -5.7 -3.8 126 148 A Q + 0 0 90 -2,-1.6 -1,-0.1 1,-0.1 3,-0.0 -0.873 14.5 174.2-105.3 99.0 35.4 -4.0 -3.4 127 149 A P S S+ 0 0 122 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.486 70.1 68.0 -84.6 1.4 38.3 -6.3 -4.7 128 150 A E S S+ 0 0 186 1,-0.2 2,-0.8 3,-0.0 3,-0.1 0.938 101.9 36.8 -83.7 -53.1 41.0 -3.7 -4.2 129 151 A K S S- 0 0 153 -3,-0.0 -1,-0.2 1,-0.0 2,-0.2 -0.656 126.1 -58.2-105.8 74.5 41.2 -3.3 -0.3 130 152 A G - 0 0 57 -2,-0.8 2,-0.2 -3,-0.3 -1,-0.0 -0.550 68.4 -75.0 95.0-158.1 40.6 -6.9 1.0 131 153 A G - 0 0 73 -2,-0.2 -5,-0.1 1,-0.1 -3,-0.0 -0.620 63.0 -35.9-130.5-172.4 37.7 -9.3 0.5 132 154 A R - 0 0 168 -2,-0.2 -1,-0.1 1,-0.1 -7,-0.0 -0.190 55.4-123.8 -56.7 134.5 34.1 -10.2 1.6 133 155 A K - 0 0 90 1,-0.1 -1,-0.1 -107,-0.0 -111,-0.1 -0.615 28.3-113.8 -78.7 136.6 33.1 -9.5 5.2 134 156 A P - 0 0 35 0, 0.0 -111,-0.1 0, 0.0 -116,-0.1 -0.365 40.9 -92.0 -70.0 153.7 31.7 -12.5 7.2 135 157 A A - 0 0 0 -116,-0.5 -109,-0.1 1,-0.1 2,-0.1 -0.360 40.7-118.5 -62.4 140.4 28.0 -12.4 8.2 136 158 A R - 0 0 84 -17,-0.4 -17,-3.8 -3,-0.1 2,-0.4 -0.483 28.2-120.4 -79.3 153.7 27.3 -10.9 11.6 137 159 A L E -C 118 0B 21 -19,-0.2 2,-0.4 -2,-0.1 -19,-0.2 -0.841 20.9-160.4-101.9 135.6 25.6 -13.2 14.2 138 160 A I E -C 117 0B 42 -21,-3.2 -21,-2.3 -2,-0.4 2,-0.5 -0.963 4.7-171.1-118.2 130.4 22.2 -12.4 15.8 139 161 A V E +C 116 0B 0 -2,-0.4 122,-2.3 -23,-0.2 -23,-0.2 -0.993 17.2 161.1-122.4 121.2 21.1 -14.1 19.0 140 162 A F E -C 115 0B 33 -25,-2.2 -25,-2.9 -2,-0.5 122,-0.1 -0.999 31.4-127.0-143.9 147.3 17.5 -13.5 20.2 141 163 A P E -C 114 0B 0 0, 0.0 -27,-0.2 0, 0.0 5,-0.1 -0.279 50.1 -69.6 -82.7 177.0 15.0 -15.1 22.5 142 164 A D >> - 0 0 29 -29,-0.6 4,-2.0 1,-0.1 3,-1.0 -0.253 47.0-106.2 -65.0 151.1 11.4 -16.2 21.6 143 165 A L H 3> S+ 0 0 0 1,-0.3 4,-1.9 -67,-0.2 5,-0.2 0.823 120.1 56.7 -44.3 -42.7 8.7 -13.6 20.8 144 166 A G H 3> S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.880 108.7 45.8 -60.0 -40.5 7.0 -14.2 24.2 145 167 A V H <> S+ 0 0 14 -3,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.903 109.2 56.5 -67.9 -41.3 10.2 -13.4 26.0 146 168 A R H X S+ 0 0 11 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.824 106.6 48.6 -61.4 -36.9 10.7 -10.3 23.9 147 169 A V H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.894 111.5 50.8 -69.8 -40.4 7.2 -8.9 24.9 148 170 A C H X S+ 0 0 0 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.862 103.8 58.2 -62.9 -38.0 8.1 -9.6 28.6 149 171 A E H X S+ 0 0 2 -4,-2.2 4,-3.1 1,-0.2 5,-0.3 0.900 106.3 49.6 -58.6 -42.2 11.4 -7.7 28.2 150 172 A K H X S+ 0 0 1 -4,-1.3 4,-2.4 3,-0.2 5,-0.4 0.904 107.3 54.3 -63.8 -43.7 9.4 -4.7 27.1 151 173 A M H < S+ 0 0 6 -4,-1.7 -90,-2.6 1,-0.2 4,-0.2 0.928 120.8 30.2 -55.0 -50.0 7.1 -4.9 30.1 152 174 A A H < S+ 0 0 2 -4,-2.0 -2,-0.2 -92,-0.2 -1,-0.2 0.834 137.2 18.5 -78.4 -42.0 10.0 -5.0 32.6 153 175 A L H X S+ 0 0 0 -4,-3.1 4,-2.9 -5,-0.2 5,-0.3 0.479 88.7 94.4-120.4 -4.2 12.6 -2.8 30.8 154 176 A Y H X S+ 0 0 32 -4,-2.4 4,-1.2 -5,-0.3 5,-0.1 0.924 96.9 42.8 -58.0 -47.1 11.2 -0.7 28.0 155 177 A D H > S+ 0 0 22 -96,-0.5 4,-1.6 -5,-0.4 5,-0.3 0.873 115.1 52.2 -67.1 -34.0 10.8 2.4 30.2 156 178 A V H >> S+ 0 0 0 1,-0.2 4,-2.9 -97,-0.2 3,-0.6 0.980 111.2 44.1 -63.0 -59.1 14.3 1.6 31.7 157 179 A V H 3< S+ 0 0 1 -4,-2.9 375,-0.2 1,-0.2 -1,-0.2 0.666 116.7 49.0 -60.7 -20.6 16.2 1.4 28.4 158 180 A S H 3< S+ 0 0 13 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.791 126.3 22.0 -88.0 -30.0 14.3 4.6 27.2 159 181 A T H S+ 0 0 0 0, 0.0 4,-3.1 0, 0.0 5,-0.3 0.899 110.7 43.6 -55.1 -41.1 20.9 6.0 29.6 162 184 A Q H > S+ 0 0 83 -3,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.876 112.9 51.4 -69.6 -40.4 20.3 9.8 29.4 163 185 A A H < S+ 0 0 35 -4,-1.4 -1,-0.2 2,-0.2 -3,-0.1 0.881 119.6 37.7 -62.2 -37.8 19.8 10.1 33.2 164 186 A V H < S+ 0 0 2 -4,-2.5 -2,-0.2 1,-0.1 -1,-0.2 0.924 130.0 25.8 -79.5 -50.9 23.1 8.2 33.7 165 187 A M H >< S- 0 0 6 -4,-3.1 3,-1.8 -5,-0.2 -3,-0.2 0.585 84.4-170.8 -94.8 -13.6 25.3 9.5 30.9 166 188 A G G >< S- 0 0 27 -4,-2.0 3,-1.9 -5,-0.3 -1,-0.2 -0.297 71.8 -0.1 60.2-133.4 23.7 12.9 30.3 167 189 A S G 3 S+ 0 0 66 1,-0.3 -1,-0.3 125,-0.0 5,-0.1 0.602 125.9 70.1 -64.5 -13.3 25.0 14.7 27.2 168 190 A S G < S+ 0 0 16 -3,-1.8 125,-2.8 -6,-0.1 2,-0.9 0.645 71.4 100.9 -78.7 -18.0 27.4 11.7 26.4 169 191 A Y B X -h 293 0E 0 -3,-1.9 3,-1.2 123,-0.2 125,-0.2 -0.625 60.5-163.6 -72.3 102.8 24.4 9.5 25.5 170 192 A G G > S+ 0 0 0 123,-2.6 3,-1.4 -2,-0.9 124,-0.2 0.748 75.9 67.0 -61.1 -32.4 24.5 9.6 21.7 171 193 A F G 3 S+ 0 0 22 122,-0.4 -1,-0.2 1,-0.3 123,-0.1 0.490 85.2 70.7 -74.2 -2.8 21.0 8.3 20.9 172 194 A Q G < S+ 0 0 31 -3,-1.2 2,-0.4 -5,-0.1 -1,-0.3 0.561 89.7 85.4 -83.6 -12.9 19.2 11.4 22.4 173 195 A Y < - 0 0 26 -3,-1.4 357,-0.1 -4,-0.2 358,-0.0 -0.776 68.9-144.8 -99.1 142.1 20.5 13.4 19.4 174 196 A S > - 0 0 10 -2,-0.4 4,-2.5 355,-0.1 5,-0.2 -0.422 49.2 -93.0 -79.5 167.8 19.1 13.9 16.0 175 197 A P H > S+ 0 0 4 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.910 129.7 49.9 -53.3 -41.1 22.0 14.1 13.3 176 198 A G H > S+ 0 0 31 268,-0.7 4,-2.5 1,-0.2 5,-0.1 0.888 111.0 46.7 -62.8 -43.8 21.9 17.9 13.7 177 199 A Q H > S+ 0 0 87 267,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.849 111.1 53.5 -67.4 -34.3 22.1 17.8 17.5 178 200 A R H X S+ 0 0 4 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.913 110.8 46.8 -64.0 -43.7 25.0 15.3 17.2 179 201 A V H X S+ 0 0 2 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.940 113.0 48.6 -62.4 -49.9 26.8 17.7 14.9 180 202 A E H X S+ 0 0 123 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.906 110.3 52.0 -57.8 -44.7 26.2 20.6 17.2 181 203 A F H X S+ 0 0 27 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.936 114.0 42.6 -57.2 -50.8 27.4 18.5 20.3 182 204 A L H X S+ 0 0 8 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.844 114.7 49.3 -66.0 -38.7 30.7 17.6 18.5 183 205 A V H X S+ 0 0 5 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.940 113.2 47.5 -66.5 -45.5 31.3 21.1 17.1 184 206 A N H X S+ 0 0 96 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.892 113.2 48.4 -62.0 -41.8 30.6 22.7 20.6 185 207 A A H < S+ 0 0 9 -4,-2.4 4,-0.5 -5,-0.2 -1,-0.2 0.888 113.2 47.4 -64.2 -43.7 32.9 20.1 22.3 186 208 A W H >< S+ 0 0 35 -4,-2.1 3,-1.0 1,-0.2 -2,-0.2 0.919 113.6 47.2 -63.4 -46.8 35.7 20.8 19.7 187 209 A K H 3< S+ 0 0 106 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.797 102.6 64.6 -66.4 -30.9 35.3 24.6 20.1 188 210 A A T 3< S+ 0 0 74 -4,-1.9 2,-0.2 -5,-0.2 -1,-0.2 0.623 87.8 85.8 -68.3 -19.2 35.4 24.4 23.9 189 211 A K S < S- 0 0 10 -3,-1.0 114,-0.0 -4,-0.5 99,-0.0 -0.635 72.7-142.6 -87.9 145.5 39.0 23.0 23.9 190 212 A K S S+ 0 0 196 1,-0.3 -1,-0.1 -2,-0.2 113,-0.1 0.972 102.2 5.9 -65.1 -53.9 42.0 25.4 23.9 191 213 A C S S- 0 0 70 113,-0.1 113,-3.4 -3,-0.1 -1,-0.3 -0.871 93.8-148.1-131.7 89.3 43.9 22.9 21.6 192 214 A P E +I 303 0E 24 0, 0.0 2,-0.3 0, 0.0 111,-0.2 -0.351 20.1 177.3 -71.1 146.3 41.5 20.0 20.7 193 215 A M E -I 302 0E 0 109,-2.2 109,-3.4 -2,-0.1 2,-0.3 -0.982 9.0-178.8-139.3 135.8 42.4 16.4 20.0 194 216 A G E -IJ 301 335E 0 141,-2.0 141,-2.5 -2,-0.3 2,-0.3 -0.958 4.6-178.9-137.3 153.5 39.8 13.7 19.2 195 217 A F E -I 300 0E 0 105,-2.1 105,-2.7 -2,-0.3 2,-0.4 -0.990 23.4-132.8-153.7 150.9 39.7 10.0 18.5 196 218 A A E -I 299 0E 39 137,-0.4 2,-0.5 -2,-0.3 137,-0.4 -0.791 20.9-149.3 -98.3 140.0 37.4 7.1 17.7 197 219 A Y E -I 298 0E 4 101,-2.2 101,-0.8 -2,-0.4 2,-0.7 -0.970 8.8-164.7-115.4 115.2 37.9 3.9 19.7 198 220 A D - 0 0 74 132,-0.5 131,-2.7 -2,-0.5 2,-0.4 -0.902 7.7-152.8-102.1 112.9 37.0 0.8 17.9 199 221 A T B > -L 328 0F 5 -2,-0.7 3,-0.7 97,-0.4 2,-0.4 -0.728 21.7-118.8 -85.6 135.3 36.5 -2.3 20.1 200 222 A R T 3 S- 0 0 85 127,-2.3 5,-0.1 -2,-0.4 -1,-0.0 -0.636 89.4 -21.0 -73.1 119.0 37.2 -5.7 18.5 201 223 A C T >> S- 0 0 21 -2,-0.4 4,-1.2 3,-0.1 3,-0.8 0.889 76.5-169.1 42.2 63.6 33.9 -7.7 18.7 202 224 A F H X> S+ 0 0 3 -3,-0.7 3,-1.0 1,-0.2 4,-0.9 0.880 79.9 56.3 -48.4 -49.2 32.4 -5.6 21.5 203 225 A D H >4 S+ 0 0 43 1,-0.3 55,-1.9 2,-0.2 3,-0.7 0.864 108.7 48.0 -52.2 -39.7 29.5 -8.0 22.2 204 226 A S H <4 S+ 0 0 3 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.722 106.3 57.9 -73.4 -24.8 32.0 -10.9 22.8 205 227 A T H << S+ 0 0 0 -4,-1.2 2,-0.5 -3,-1.0 -1,-0.2 0.628 81.2 104.5 -78.3 -17.9 34.1 -8.7 25.1 206 228 A V << - 0 0 0 -4,-0.9 52,-0.2 -3,-0.7 2,-0.1 -0.576 62.2-157.0 -70.5 117.9 31.0 -8.2 27.4 207 229 A T > - 0 0 13 -2,-0.5 4,-1.6 50,-0.1 5,-0.1 -0.439 30.1-106.1 -91.2 170.9 31.5 -10.4 30.5 208 230 A E H > S+ 0 0 46 48,-0.2 4,-1.9 1,-0.2 5,-0.1 0.881 124.1 51.6 -59.9 -40.1 29.1 -11.9 33.0 209 231 A N H > S+ 0 0 70 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.904 105.1 54.3 -65.3 -41.3 30.3 -9.3 35.5 210 232 A D H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.881 110.2 48.0 -56.1 -42.1 29.7 -6.5 33.0 211 233 A I H X S+ 0 0 1 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.838 112.8 47.0 -68.8 -37.8 26.1 -7.7 32.7 212 234 A R H X S+ 0 0 61 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.867 111.6 51.2 -71.3 -37.4 25.6 -7.9 36.5 213 235 A V H X S+ 0 0 10 -4,-2.8 4,-1.4 2,-0.2 -2,-0.2 0.900 109.2 51.9 -63.5 -42.8 27.2 -4.4 36.9 214 236 A E H X S+ 0 0 3 -4,-2.1 4,-2.0 2,-0.2 3,-0.5 0.921 109.8 48.3 -58.3 -47.3 24.6 -3.2 34.2 215 237 A E H X S+ 0 0 3 -4,-1.8 4,-3.0 1,-0.2 -2,-0.2 0.912 104.4 59.6 -61.8 -41.0 21.8 -4.8 36.3 216 238 A S H < S+ 0 0 4 -4,-2.4 4,-0.2 1,-0.2 -1,-0.2 0.840 107.5 47.3 -57.1 -31.9 23.2 -3.1 39.4 217 239 A I H >< S+ 0 0 1 -4,-1.4 3,-1.4 -3,-0.5 4,-0.2 0.920 111.5 48.9 -73.6 -46.6 22.6 0.2 37.5 218 240 A Y H >< S+ 0 0 1 -4,-2.0 3,-1.8 1,-0.3 -2,-0.2 0.874 104.2 61.9 -59.7 -38.3 19.0 -0.8 36.5 219 241 A Q T 3< S+ 0 0 2 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.591 88.7 70.6 -64.2 -14.3 18.3 -1.8 40.2 220 242 A C T < S+ 0 0 0 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.608 82.5 95.6 -77.6 -15.1 18.9 1.9 41.2 221 243 A C S < S- 0 0 0 -3,-1.8 2,-0.6 -4,-0.2 -164,-0.2 -0.405 90.2-109.1 -70.9 156.4 15.6 2.8 39.5 222 244 A D B +g 57 0D 35 -166,-2.5 -164,-2.7 -2,-0.1 2,-0.3 -0.780 57.3 172.4 -82.3 121.2 12.3 3.0 41.4 223 245 A L - 0 0 14 -2,-0.6 -164,-0.1 -166,-0.2 536,-0.1 -0.945 39.5-102.8-133.6 157.3 10.6 -0.1 40.0 224 246 A A > - 0 0 34 -2,-0.3 4,-2.4 -166,-0.2 5,-0.2 -0.493 42.8-111.6 -73.5 148.3 7.5 -2.1 40.6 225 247 A P H > S+ 0 0 32 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.881 119.1 49.2 -49.6 -42.9 8.3 -5.4 42.6 226 248 A E H > S+ 0 0 95 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.897 110.1 51.4 -65.2 -39.5 7.5 -7.6 39.5 227 249 A A H > S+ 0 0 2 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.929 110.3 50.0 -59.7 -44.2 9.7 -5.4 37.3 228 250 A R H X S+ 0 0 5 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.895 114.1 44.0 -60.7 -43.7 12.5 -5.8 39.9 229 251 A Q H X S+ 0 0 4 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.921 112.9 51.8 -67.4 -44.8 12.1 -9.6 39.9 230 252 A A H X S+ 0 0 0 -4,-3.2 4,-3.3 1,-0.2 -2,-0.2 0.895 110.2 48.6 -60.6 -39.2 11.8 -9.8 36.1 231 253 A I H X S+ 0 0 0 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.905 113.7 47.1 -65.9 -41.1 15.1 -7.7 35.7 232 254 A R H X S+ 0 0 12 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.930 117.1 42.7 -62.9 -49.0 16.8 -10.1 38.2 233 255 A S H X S+ 0 0 0 -4,-3.0 4,-2.9 1,-0.2 5,-0.4 0.941 113.1 51.5 -65.1 -50.1 15.5 -13.2 36.5 234 256 A L H X>S+ 0 0 0 -4,-3.3 5,-2.9 1,-0.2 4,-1.7 0.823 109.0 53.3 -58.4 -33.5 16.2 -11.9 32.9 235 257 A T H <>S+ 0 0 1 -4,-1.8 5,-2.6 3,-0.2 6,-0.3 0.955 116.8 35.6 -65.8 -51.9 19.8 -11.1 33.9 236 258 A E H <5S+ 0 0 49 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.865 127.3 35.9 -69.8 -42.1 20.5 -14.6 35.2 237 259 A R H <5S+ 0 0 11 -4,-2.9 -125,-2.8 -5,-0.2 -3,-0.2 0.691 136.5 3.9 -88.2 -24.8 18.5 -16.6 32.7 238 260 A L T <5S+ 0 0 0 -4,-1.7 3,-0.4 -5,-0.4 -3,-0.2 0.692 120.9 51.1-128.0 -58.5 19.0 -14.6 29.5 239 261 A Y T - 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0 0 32 4,-2.4 3,-1.8 -2,-0.4 99,-0.1 -0.195 47.4 -78.7 -85.7-173.9 22.5 28.0 3.6 354 376 A A T 3 S+ 0 0 79 1,-0.3 -1,-0.0 2,-0.1 98,-0.0 0.666 133.1 48.6 -62.5 -16.5 20.6 30.3 1.1 355 377 A S T 3 S- 0 0 103 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.311 121.7-103.3-105.2 7.2 22.0 33.4 2.8 356 378 A G S < S+ 0 0 39 -3,-1.8 2,-0.1 1,-0.3 -2,-0.1 0.402 71.9 147.4 86.4 1.1 25.6 32.2 2.8 357 379 A K - 0 0 148 1,-0.1 -4,-2.4 -5,-0.1 -1,-0.3 -0.465 55.1-104.6 -71.8 137.7 25.6 31.3 6.6 358 380 A R E -N 352 0H 143 -6,-0.2 2,-0.4 -2,-0.1 -6,-0.2 -0.354 36.6-171.0 -60.3 135.3 27.7 28.3 7.6 359 381 A V E -N 351 0H 28 -8,-2.7 -8,-2.3 -2,-0.1 2,-0.3 -0.976 11.5-149.1-134.1 117.1 25.8 25.1 8.4 360 382 A Y E +N 350 0H 69 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.655 26.4 170.9 -81.3 141.3 27.5 22.0 10.0 361 383 A Y E -N 349 0H 5 -12,-2.5 -12,-2.2 -2,-0.3 2,-0.4 -0.980 33.1-110.5-148.3 160.2 26.0 18.6 8.9 362 384 A L E +N 348 0H 13 -2,-0.3 2,-0.2 -14,-0.2 -14,-0.2 -0.781 40.8 162.7 -95.1 134.7 26.8 14.9 9.2 363 385 A T E -N 347 0H 0 -16,-2.4 -16,-2.4 -2,-0.4 2,-0.3 -0.782 14.2-166.9-136.6-179.7 27.8 12.9 6.2 364 386 A R - 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0 0 176 -2,-0.3 -3,-0.1 -3,-0.1 -2,-0.0 -0.445 44.6-171.8 -67.7 130.0 11.6 -6.2 -2.3 381 403 A T - 0 0 23 -5,-0.2 3,-0.0 1,-0.1 -1,-0.0 -0.926 32.3-131.8-123.5 155.2 13.0 -5.8 1.2 382 404 A P S S+ 0 0 96 0, 0.0 40,-0.4 0, 0.0 2,-0.4 0.950 98.1 40.9 -71.2 -44.0 11.3 -5.6 4.7 383 405 A V S S- 0 0 46 38,-0.1 2,-0.8 46,-0.0 40,-0.2 -0.843 75.4-145.0-106.2 138.1 13.3 -2.5 5.7 384 406 A N >> + 0 0 20 38,-2.3 4,-1.2 -2,-0.4 3,-0.8 -0.852 16.9 179.6-103.9 91.1 14.1 0.4 3.3 385 407 A S H 3> S+ 0 0 25 -2,-0.8 4,-2.8 1,-0.2 -1,-0.2 0.788 81.1 64.8 -61.4 -30.2 17.6 1.6 4.2 386 408 A W H 3> S+ 0 0 7 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.840 102.3 49.0 -59.6 -36.1 17.3 4.2 1.4 387 409 A L H <> S+ 0 0 0 -3,-0.8 4,-2.0 2,-0.2 -1,-0.2 0.864 111.6 47.3 -72.5 -39.2 14.4 5.8 3.4 388 410 A G H X S+ 0 0 7 -4,-1.2 4,-2.9 2,-0.2 5,-0.2 0.894 112.9 49.8 -67.4 -41.0 16.5 5.8 6.7 389 411 A N H X S+ 0 0 28 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.843 109.3 51.3 -67.3 -34.4 19.4 7.3 4.8 390 412 A I H < S+ 0 0 0 -4,-1.8 4,-0.4 2,-0.2 -2,-0.2 0.934 115.0 44.1 -65.3 -47.3 17.2 10.1 3.2 391 413 A I H < S+ 0 0 0 -4,-2.0 3,-0.5 2,-0.2 -2,-0.2 0.928 122.5 35.4 -61.1 -50.7 15.9 10.9 6.8 392 414 A M H < S+ 0 0 27 -4,-2.9 -30,-0.2 1,-0.2 -2,-0.2 0.801 128.5 34.1 -78.1 -32.5 19.4 10.8 8.5 393 415 A Y S >< S+ 0 0 23 -4,-2.4 3,-2.2 -5,-0.2 6,-0.4 0.055 74.2 132.1-115.4 28.8 21.5 12.3 5.7 394 416 A A T 3 S+ 0 0 2 -3,-0.5 -1,-0.2 -4,-0.4 -2,-0.1 0.796 72.4 53.2 -47.6 -40.3 18.9 14.7 4.2 395 417 A P T 3 S+ 0 0 8 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.631 89.5 107.2 -74.9 -12.3 21.4 17.6 4.1 396 418 A T S <> S- 0 0 0 -3,-2.2 4,-1.9 -34,-0.2 5,-0.2 -0.308 74.4-130.3 -69.3 150.2 24.0 15.6 2.1 397 419 A L H > S+ 0 0 17 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.924 108.3 47.2 -61.7 -45.3 24.8 16.1 -1.6 398 420 A W H >>S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 5,-1.5 0.836 111.4 47.3 -68.0 -40.4 24.4 12.3 -2.3 399 421 A A H 4>S+ 0 0 0 -6,-0.4 5,-2.4 3,-0.2 -1,-0.2 0.885 117.9 43.1 -71.1 -36.5 21.1 11.8 -0.4 400 422 A R H <>S+ 0 0 10 -4,-1.9 5,-0.5 -7,-0.2 -2,-0.2 0.927 123.7 33.1 -71.5 -50.8 19.4 14.9 -2.0 401 423 A M H <5S+ 0 0 23 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.2 0.847 133.9 20.1 -77.7 -40.4 20.7 14.4 -5.6 402 424 A I T X5S+ 0 0 9 -4,-1.8 4,-2.9 -5,-0.3 5,-0.2 0.905 126.9 38.3 -96.3 -60.5 20.8 10.6 -6.0 403 425 A L H >S+ 0 0 8 -4,-2.6 5,-2.1 2,-0.2 4,-1.0 0.815 111.3 50.9 -64.1 -31.6 7.2 6.2 -6.3 412 434 A L H <5S+ 0 0 16 -4,-1.9 3,-0.3 3,-0.2 -2,-0.2 0.947 113.0 45.8 -66.9 -48.1 5.8 8.4 -9.0 413 435 A A H <5S+ 0 0 81 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.798 119.6 39.7 -63.1 -35.9 5.9 5.5 -11.5 414 436 A Q H <5S- 0 0 107 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.589 103.2-131.1 -91.1 -11.6 4.3 3.0 -9.0 415 437 A E T <5 + 0 0 161 -4,-1.0 -3,-0.2 -3,-0.3 -4,-0.1 0.949 69.6 127.0 56.6 51.0 1.8 5.7 -7.6 416 438 A Q > < + 0 0 62 -5,-2.1 3,-0.9 1,-0.1 -4,-0.1 0.003 16.5 120.7-125.8 26.8 2.9 4.7 -4.1 417 439 A L T 3 S+ 0 0 5 -6,-0.5 18,-1.3 1,-0.2 -1,-0.1 0.828 82.2 44.1 -59.7 -36.4 3.9 8.1 -2.7 418 440 A E T 3 S+ 0 0 99 16,-0.2 2,-0.4 15,-0.1 -1,-0.2 0.504 87.0 111.2 -88.5 -9.1 1.3 7.7 0.2 419 441 A K S < S- 0 0 103 -3,-0.9 2,-0.1 1,-0.1 13,-0.1 -0.585 71.7-123.1 -74.1 121.3 2.2 4.1 1.0 420 442 A A - 0 0 47 -2,-0.4 2,-0.3 13,-0.2 13,-0.3 -0.391 29.1-162.6 -66.3 134.9 3.8 3.8 4.4 421 443 A L E -P 432 0I 26 11,-2.8 11,-3.2 -2,-0.1 2,-0.4 -0.929 16.3-121.5-121.8 147.9 7.3 2.1 4.4 422 444 A D E +P 431 0I 31 -40,-0.4 -38,-2.3 -2,-0.3 2,-0.3 -0.716 36.8 164.6 -86.9 134.8 9.3 0.6 7.3 423 445 A C E -P 430 0I 0 7,-2.3 7,-3.3 -2,-0.4 2,-0.4 -0.947 33.6-115.8-143.2 161.5 12.8 2.0 8.0 424 446 A Q E -P 429 0I 91 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.871 23.2-178.6-102.0 132.0 15.2 1.8 10.9 425 447 A I E > S-P 428 0I 4 3,-2.7 3,-1.7 -2,-0.4 108,-0.1 -0.963 81.0 -23.6-129.1 107.8 16.3 4.9 13.0 426 448 A Y T 3 S- 0 0 45 -2,-0.4 107,-2.6 1,-0.3 108,-0.2 0.901 127.7 -50.6 55.8 46.5 18.9 4.0 15.7 427 449 A G T 3 S+ 0 0 12 1,-0.2 111,-0.4 105,-0.2 108,-0.3 0.150 116.6 111.4 81.5 -21.3 17.7 0.3 15.7 428 450 A A E < -P 425 0I 0 -3,-1.7 -3,-2.7 103,-0.2 2,-0.5 -0.649 68.0-121.3 -88.2 147.6 14.0 1.1 16.1 429 451 A C E -Pq 424 539I 10 109,-3.1 111,-2.1 -2,-0.2 2,-0.4 -0.758 27.2-170.9 -90.5 126.6 11.5 0.5 13.2 430 452 A Y E -Pq 423 540I 1 -7,-3.3 -7,-2.3 -2,-0.5 2,-0.6 -0.969 17.4-145.5-120.4 131.7 9.4 3.4 11.9 431 453 A S E +Pq 422 541I 21 109,-2.0 111,-2.0 -2,-0.4 2,-0.4 -0.884 33.5 175.8 -95.7 113.3 6.5 3.2 9.5 432 454 A I E -P 421 0I 2 -11,-3.2 -11,-2.8 -2,-0.6 -2,-0.0 -0.989 32.7-138.1-129.9 134.9 6.7 6.4 7.4 433 455 A E > - 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0 0 28 -4,-1.4 3,-1.9 -5,-0.9 4,-0.2 -0.034 40.9 -67.7 92.2 160.5 15.8 22.6 9.9 447 469 A L G > S+ 0 0 51 1,-0.3 3,-1.8 2,-0.2 4,-0.2 0.776 124.7 72.4 -53.0 -34.9 14.6 24.5 6.8 448 470 A S G >> S+ 0 0 34 1,-0.3 3,-1.7 2,-0.2 4,-1.0 0.670 77.5 76.9 -56.2 -22.6 18.2 25.0 5.7 449 471 A A G <4 S+ 0 0 3 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.698 96.4 48.6 -62.6 -19.9 18.4 21.3 4.7 450 472 A F G <4 S+ 0 0 5 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.422 116.5 41.7 -95.6 -6.6 16.5 22.2 1.5 451 473 A S T <4 S+ 0 0 26 -3,-1.7 -2,-0.2 -4,-0.2 -1,-0.1 0.387 79.4 134.6-124.0 0.3 18.7 25.2 0.7 452 474 A L < + 0 0 7 -4,-1.0 2,-0.2 -99,-0.1 -99,-0.2 -0.218 19.7 142.8 -60.1 139.5 22.2 23.9 1.4 453 475 A H B +O 352 0H 81 -101,-2.2 -101,-2.8 1,-0.1 -2,-0.1 -0.787 35.4 76.6-155.2-168.0 25.0 24.6 -1.2 454 476 A S - 0 0 64 -2,-0.2 -1,-0.1 -103,-0.2 -104,-0.1 0.923 66.9-171.7 55.0 47.8 28.8 25.4 -1.3 455 477 A Y - 0 0 24 -104,-0.1 -104,-0.1 1,-0.1 -1,-0.1 -0.340 29.9 -92.1 -67.1 152.7 29.6 21.8 -0.4 456 478 A S > - 0 0 37 -106,-0.5 4,-2.7 1,-0.1 5,-0.2 -0.386 25.6-124.8 -67.4 146.5 33.3 21.0 0.3 457 479 A P H > S+ 0 0 96 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.887 113.0 52.7 -56.9 -38.9 35.6 20.0 -2.5 458 480 A G H > S+ 0 0 51 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.881 111.7 45.3 -62.3 -41.0 36.5 16.8 -0.6 459 481 A E H > S+ 0 0 5 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.916 113.6 49.3 -69.4 -44.7 32.8 15.9 -0.2 460 482 A I H X S+ 0 0 67 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.942 113.9 46.4 -59.3 -48.2 32.0 16.7 -3.8 461 483 A N H X S+ 0 0 100 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.872 110.2 52.2 -63.3 -40.6 35.0 14.5 -5.0 462 484 A R H X S+ 0 0 69 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.896 113.7 45.1 -62.4 -42.1 34.1 11.6 -2.7 463 485 A V H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.972 115.4 46.1 -64.8 -55.7 30.5 11.6 -4.1 464 486 A A H X S+ 0 0 27 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.870 113.7 48.3 -55.0 -44.7 31.6 11.9 -7.8 465 487 A S H X S+ 0 0 52 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.875 110.1 53.0 -64.9 -39.1 34.3 9.2 -7.4 466 488 A C H X S+ 0 0 2 -4,-1.7 4,-1.8 -5,-0.2 -2,-0.2 0.881 107.0 51.4 -63.9 -40.1 31.8 6.9 -5.7 467 489 A L H X>S+ 0 0 5 -4,-2.0 5,-2.8 2,-0.2 4,-0.7 0.911 111.4 48.4 -63.8 -41.7 29.3 7.3 -8.6 468 490 A R H ><5S+ 0 0 174 -4,-1.8 3,-0.8 1,-0.2 -2,-0.2 0.927 111.1 49.5 -61.7 -49.8 32.1 6.4 -11.1 469 491 A K H 3<5S+ 0 0 124 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.821 116.3 42.3 -59.5 -36.0 33.1 3.3 -9.2 470 492 A L H 3<5S- 0 0 54 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.464 110.5-116.4 -95.6 -1.7 29.5 2.1 -8.9 471 493 A G T <<5 + 0 0 66 -3,-0.8 -3,-0.2 -4,-0.7 -4,-0.1 0.810 62.8 151.2 69.4 30.4 28.5 2.9 -12.5 472 494 A V < - 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0 0 25 -4,-1.6 3,-1.8 -5,-0.8 4,-0.2 -0.016 41.0 -68.2 91.5 160.9 34.2 10.5 79.4 990 469 B L G > S+ 0 0 51 1,-0.3 3,-1.9 2,-0.2 -1,-0.2 0.768 123.8 72.7 -53.6 -36.3 36.2 10.7 82.7 991 470 B S G >> S+ 0 0 31 1,-0.3 3,-2.0 2,-0.2 4,-0.5 0.692 77.6 77.8 -54.9 -24.3 34.0 13.6 83.8 992 471 B A G <4 S+ 0 0 3 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.693 93.9 50.7 -60.1 -21.0 31.1 11.1 84.4 993 472 B F G <4 S+ 0 0 4 -3,-1.9 -1,-0.3 -4,-0.2 -2,-0.2 0.423 115.0 43.2 -95.8 -0.2 32.9 10.1 87.7 994 473 B S T <4 S+ 0 0 21 -3,-2.0 -2,-0.2 -4,-0.1 2,-0.2 0.244 74.3 136.2-129.6 7.8 33.3 13.8 88.8 995 474 B L < + 0 0 5 -4,-0.5 2,-0.3 -3,-0.1 -99,-0.2 -0.401 23.8 148.3 -67.7 131.4 29.9 15.4 88.0 996 475 B H B +F 895 0Q 82 -101,-2.0 -101,-2.4 1,-0.2 -2,-0.1 -0.907 40.4 53.8-147.8 175.2 28.7 17.7 90.8 997 476 B S S S- 0 0 80 -2,-0.3 -1,-0.2 -103,-0.2 -101,-0.0 0.968 73.0-169.5 52.4 57.1 26.6 20.9 91.3 998 477 B Y - 0 0 18 1,-0.2 -104,-0.2 -104,-0.1 -1,-0.1 -0.222 31.1 -79.9 -66.9 161.4 23.7 19.5 89.3 999 478 B S > - 0 0 30 -106,-0.7 4,-2.8 1,-0.1 3,-0.2 -0.386 32.4-123.9 -68.1 147.4 20.8 21.8 88.3 1000 479 B P H > S+ 0 0 97 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.886 113.1 53.7 -58.3 -38.0 18.1 22.6 90.8 1001 480 B G H > S+ 0 0 51 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.871 111.6 44.2 -61.2 -41.4 15.4 21.3 88.4 1002 481 B E H > S+ 0 0 6 2,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.916 114.0 49.7 -70.3 -44.6 17.3 17.9 88.1 1003 482 B I H X S+ 0 0 67 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.936 113.3 47.4 -59.3 -47.5 17.9 17.7 91.9 1004 483 B N H X S+ 0 0 100 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.876 110.3 50.9 -62.4 -42.2 14.2 18.4 92.5 1005 484 B R H X S+ 0 0 69 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.901 114.3 44.7 -62.8 -41.9 12.9 15.9 90.0 1006 485 B V H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.972 115.5 46.7 -65.0 -55.3 15.2 13.2 91.5 1007 486 B A H X S+ 0 0 27 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.866 113.2 48.2 -54.9 -45.1 14.2 14.1 95.1 1008 487 B S H X S+ 0 0 53 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.872 110.6 52.4 -64.7 -39.5 10.4 14.2 94.4 1009 488 B C H X S+ 0 0 2 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.878 107.5 51.1 -63.6 -40.9 10.6 10.8 92.6 1010 489 B L H X>S+ 0 0 3 -4,-2.0 5,-2.7 2,-0.2 4,-0.7 0.911 111.7 48.6 -63.4 -41.3 12.4 9.2 95.6 1011 490 B R H ><5S+ 0 0 177 -4,-1.9 3,-0.9 1,-0.2 -2,-0.2 0.925 111.0 49.6 -62.2 -49.3 9.6 10.5 97.9 1012 491 B K H 3<5S+ 0 0 129 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.815 116.4 42.1 -59.2 -36.1 6.8 9.3 95.5 1013 492 B L H 3<5S- 0 0 58 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.443 110.5-116.5 -96.2 -0.7 8.4 5.8 95.4 1014 493 B G T <<5 + 0 0 69 -3,-0.9 -3,-0.2 -4,-0.7 -4,-0.1 0.790 62.9 151.0 68.8 28.8 9.3 5.5 99.1 1015 494 B V < - 0 0 36 -5,-2.7 -1,-0.3 -6,-0.2 -2,-0.1 -0.754 54.4-101.4 -89.2 137.2 13.0 5.3 98.2 1016 495 B P - 0 0 40 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.218 48.2 -94.4 -55.8 150.4 15.3 6.7 101.0 1017 496 B P >> - 0 0 51 0, 0.0 3,-1.6 0, 0.0 4,-1.1 -0.160 38.6 -96.3 -65.7 165.2 16.7 10.3 100.3 1018 497 B L H 3> S+ 0 0 31 1,-0.3 4,-1.7 2,-0.2 5,-0.1 0.762 120.4 62.3 -51.0 -35.7 20.1 11.0 98.6 1019 498 B R H 3> S+ 0 0 175 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.824 102.0 52.3 -61.2 -33.7 21.9 11.5 102.0 1020 499 B V H <> S+ 0 0 44 -3,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.890 107.2 52.5 -66.9 -42.1 21.1 7.9 102.9 1021 500 B W H X S+ 0 0 10 -4,-1.1 4,-2.8 2,-0.2 -2,-0.2 0.874 104.6 55.7 -62.7 -37.0 22.6 6.7 99.6 1022 501 B R H X S+ 0 0 113 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.928 109.7 46.6 -58.3 -49.7 25.8 8.7 100.3 1023 502 B H H X S+ 0 0 128 -4,-1.6 4,-1.1 1,-0.2 3,-0.2 0.926 114.3 47.0 -60.2 -48.8 26.2 6.7 103.6 1024 503 B R H X S+ 0 0 115 -4,-2.4 4,-2.0 1,-0.2 3,-0.3 0.883 109.0 54.6 -63.0 -40.0 25.5 3.4 101.9 1025 504 B A H X S+ 0 0 0 -4,-2.8 4,-3.4 1,-0.2 -1,-0.2 0.839 100.4 60.4 -64.4 -34.4 27.9 4.1 99.0 1026 505 B R H X S+ 0 0 66 -4,-1.7 4,-2.3 -3,-0.2 -1,-0.2 0.882 109.3 42.0 -59.6 -42.3 30.8 4.8 101.5 1027 506 B S H X S+ 0 0 58 -4,-1.1 4,-2.2 -3,-0.3 -1,-0.2 0.891 115.6 49.7 -70.1 -43.9 30.5 1.2 102.9 1028 507 B V H X S+ 0 0 1 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.937 113.6 47.4 -59.4 -46.8 30.1 -0.3 99.3 1029 508 B R H X S+ 0 0 21 -4,-3.4 4,-2.8 1,-0.2 -2,-0.2 0.912 109.8 51.8 -59.8 -49.2 33.1 1.7 98.2 1030 509 B A H X S+ 0 0 56 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.905 111.5 47.2 -57.8 -43.5 35.2 0.6 101.2 1031 510 B R H X S+ 0 0 105 -4,-2.2 4,-0.6 2,-0.2 -1,-0.2 0.855 112.0 49.9 -67.4 -36.6 34.5 -3.1 100.5 1032 511 B L H >< S+ 0 0 0 -4,-2.0 3,-1.2 1,-0.2 4,-0.5 0.942 109.9 51.3 -66.7 -44.3 35.2 -2.7 96.8 1033 512 B L H >< S+ 0 0 64 -4,-2.8 3,-1.1 1,-0.3 -2,-0.2 0.863 103.9 58.5 -59.1 -40.6 38.6 -1.0 97.6 1034 513 B S H 3< S+ 0 0 98 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.672 100.4 58.2 -62.5 -23.5 39.6 -3.9 100.0 1035 514 B Q T << S- 0 0 105 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.610 94.5-152.9 -83.2 -19.5 39.3 -6.5 97.2 1036 515 B G X> + 0 0 32 -3,-1.1 4,-1.4 -4,-0.5 3,-0.9 -0.036 52.5 51.6 72.2-176.1 41.9 -4.9 94.8 1037 516 B G H 3> S- 0 0 64 1,-0.2 4,-1.6 2,-0.2 3,-0.2 -0.138 123.5 -12.0 53.6-138.4 42.1 -5.1 91.0 1038 517 B R H 3> S+ 0 0 99 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.796 135.8 60.5 -62.5 -32.5 38.9 -4.2 89.0 1039 518 B A H <> S+ 0 0 7 -3,-0.9 4,-2.0 2,-0.2 -2,-0.2 0.930 105.8 46.8 -62.0 -44.6 36.8 -4.3 92.2 1040 519 B A H X S+ 0 0 20 -4,-1.4 4,-3.0 2,-0.2 -2,-0.2 0.862 109.7 54.2 -64.1 -37.9 39.0 -1.4 93.7 1041 520 B T H X S+ 0 0 39 -4,-1.6 4,-2.7 2,-0.2 5,-0.5 0.892 107.5 51.2 -62.0 -40.3 38.7 0.5 90.3 1042 521 B C H X>S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 5,-0.6 0.943 113.4 45.0 -60.5 -45.8 34.9 0.2 90.7 1043 522 B G H X5S+ 0 0 0 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.928 116.7 44.2 -61.8 -48.9 35.1 1.6 94.2 1044 523 B K H <5S+ 0 0 44 -4,-3.0 11,-0.2 2,-0.1 -2,-0.2 0.872 125.2 29.5 -65.1 -46.5 37.5 4.4 93.3 1045 524 B Y H ><5S+ 0 0 12 -4,-2.7 3,-0.7 -5,-0.2 4,-0.2 0.899 122.0 42.8 -85.6 -50.6 35.7 5.6 90.1 1046 525 B L H 3<5S+ 0 0 2 -4,-1.9 3,-0.2 -5,-0.5 -3,-0.2 0.798 123.7 36.2 -70.5 -28.5 32.0 4.8 90.5 1047 526 B F T >X - 0 0 16 1,-0.2 3,-1.5 -79,-0.1 4,-0.3 -0.654 19.2-147.3 -73.6 115.7 41.7 4.0 83.0 1061 540 B P T >> S+ 0 0 112 0, 0.0 3,-1.5 0, 0.0 4,-0.5 0.859 91.9 74.2 -54.2 -32.2 44.4 2.5 80.7 1062 541 B A H 3> S+ 0 0 52 1,-0.2 4,-0.8 2,-0.2 -2,-0.0 0.333 81.1 73.2 -61.8 4.8 42.0 -0.5 79.9 1063 542 B A H <4 S+ 0 0 9 -3,-1.5 -1,-0.2 2,-0.2 5,-0.2 0.839 88.3 57.2 -88.0 -38.0 39.9 1.9 77.7 1064 543 B S H <4 S+ 0 0 116 -3,-1.5 -2,-0.2 -4,-0.3 -1,-0.1 0.823 104.5 63.2 -56.8 -35.0 42.6 1.9 74.9 1065 544 B Q H < S+ 0 0 82 -4,-0.5 2,-0.5 1,-0.2 -2,-0.2 0.970 99.9 34.9 -54.6 -85.6 42.1 -2.0 74.9 1066 545 B L S < S- 0 0 38 -4,-0.8 2,-0.3 1,-0.0 -1,-0.2 -0.778 81.8-121.8 -94.5 121.6 38.5 -3.0 73.9 1067 546 B D 0 0 147 -2,-0.5 -3,-0.1 -3,-0.1 -1,-0.0 -0.380 360.0 360.0 -65.3 116.2 36.5 -1.0 71.2 1068 547 B L 0 0 79 -2,-0.3 -351,-0.1 -5,-0.2 -1,-0.0 -0.934 360.0 360.0-118.6 360.0 33.1 0.5 72.3 1069 ! 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 1070 550 B W 0 0 75 0, 0.0 -96,-1.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -16.0 31.4 -6.5 74.9 1071 551 B F B +H 973 0R 74 -98,-0.2 2,-0.3 1,-0.1 -98,-0.2 -0.487 360.0 171.5 -66.3 123.6 29.0 -6.6 71.9 1072 552 B V - 0 0 40 -100,-1.6 -460,-0.1 1,-0.4 -1,-0.1 -0.741 49.6 -44.9-141.1 84.9 27.5 -10.0 71.4 1073 553 B A S S+ 0 0 3 -2,-0.3 -101,-1.9 -459,-0.1 -1,-0.4 0.387 83.7 80.4 78.6 159.4 24.7 -10.2 68.8 1074 554 B G - 0 0 22 -462,-0.9 -102,-0.4 -103,-0.2 -2,-0.1 0.730 27.5-178.3 77.8 122.0 21.6 -8.2 67.7 1075 555 B Y 0 0 112 -104,-0.1 -265,-0.2 -269,-0.0 -104,-0.2 -0.213 360.0 360.0-139.8 40.6 21.6 -5.0 65.6 1076 556 B S 0 0 48 -106,-1.4 -105,-0.1 -267,-0.1 -270,-0.1 0.188 360.0 360.0-157.2 360.0 17.8 -4.2 65.5