==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 18-JUL-12 4G68 . COMPND 2 MOLECULE: ABC TRANSPORTER; . SOURCE 2 ORGANISM_SCIENTIFIC: CALDANAEROBIUS; . AUTHOR V.AGARWAL,S.K.NAIR . 1176 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45040.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 850 72.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 57 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 107 9.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 40 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 133 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 419 35.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 39 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 4 5 2 1 3 6 0 0 3 6 0 10 2 0 0 0 0 0 3 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 6 0 0 0 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 PARALLEL BRIDGES PER LADDER . 6 6 0 3 7 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 6 0 0 3 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 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 25 A I 0 0 84 0, 0.0 32,-3.0 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 141.3 -23.4 31.7 38.7 2 26 A T E -a 33 0A 77 30,-0.2 2,-0.4 32,-0.0 32,-0.2 -0.960 360.0-161.8-124.6 118.1 -20.3 32.2 36.5 3 27 A L E -a 34 0A 0 30,-3.4 32,-2.7 -2,-0.5 2,-0.3 -0.713 13.3-136.1 -89.7 141.3 -17.4 29.7 36.7 4 28 A T E -a 35 0A 54 -2,-0.4 56,-2.1 30,-0.2 2,-0.4 -0.782 19.9-172.5 -96.6 147.2 -14.0 30.6 35.5 5 29 A F E -ab 36 60A 0 30,-2.1 32,-2.0 -2,-0.3 2,-0.4 -0.992 4.9-162.6-138.5 124.8 -12.0 28.0 33.3 6 30 A W E +ab 37 61A 36 54,-2.1 56,-1.9 -2,-0.4 2,-0.3 -0.905 19.7 154.1-111.3 140.0 -8.4 28.4 32.2 7 31 A N E -a 38 0A 0 30,-1.5 32,-2.4 -2,-0.4 -2,-0.0 -0.930 42.6-128.2-148.0 176.1 -6.8 26.4 29.4 8 32 A L + 0 0 24 -2,-0.3 2,-1.9 30,-0.2 33,-0.5 0.166 58.1 128.4-115.5 14.9 -3.9 26.6 26.9 9 33 A F + 0 0 19 1,-0.2 9,-0.1 5,-0.1 31,-0.1 -0.530 22.7 144.6 -76.7 84.7 -5.7 25.7 23.7 10 34 A T + 0 0 54 -2,-1.9 -1,-0.2 29,-0.1 2,-0.1 0.755 42.8 78.3 -94.3 -29.9 -4.4 28.7 21.7 11 35 A G S > S- 0 0 43 -3,-0.3 4,-2.8 4,-0.1 5,-0.1 -0.393 84.0 -70.1 -81.5 163.1 -4.0 27.3 18.2 12 36 A E T 4 S+ 0 0 83 1,-0.3 237,-0.1 2,-0.2 -1,-0.1 -0.720 109.4 17.8 -95.7 144.8 -6.7 26.6 15.5 13 37 A P T > S+ 0 0 29 0, 0.0 4,-2.5 0, 0.0 -1,-0.3 -0.994 124.1 57.3 -87.0 -0.0 -8.8 24.7 15.2 14 38 A A H > S+ 0 0 4 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.906 102.1 55.7 -56.8 -42.8 -8.7 23.9 19.0 15 39 A K H X S+ 0 0 94 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.939 112.8 42.4 -59.0 -42.4 -9.3 27.5 20.1 16 40 A T H > S+ 0 0 62 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.898 115.2 50.6 -69.6 -40.8 -12.5 27.6 18.0 17 41 A K H X S+ 0 0 67 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.886 109.1 49.5 -65.1 -43.9 -13.6 24.1 19.1 18 42 A V H X S+ 0 0 1 -4,-3.1 4,-2.7 2,-0.2 5,-0.2 0.924 110.1 51.8 -58.3 -44.6 -13.1 24.8 22.8 19 43 A K H X S+ 0 0 93 -4,-2.0 4,-2.8 -5,-0.3 -2,-0.2 0.909 110.0 50.1 -58.5 -40.6 -15.1 28.0 22.5 20 44 A E H X S+ 0 0 102 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.875 108.4 51.5 -65.0 -41.1 -17.9 25.9 20.8 21 45 A I H X S+ 0 0 16 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.923 113.7 45.1 -62.7 -44.9 -17.8 23.4 23.7 22 46 A I H X S+ 0 0 2 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.887 110.6 53.5 -64.4 -40.3 -18.1 26.2 26.2 23 47 A D H X S+ 0 0 73 -4,-2.8 4,-1.7 -5,-0.2 -2,-0.2 0.907 108.3 51.2 -63.9 -39.5 -20.9 27.9 24.1 24 48 A Q H X S+ 0 0 97 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.928 110.6 47.8 -64.0 -44.4 -22.8 24.6 24.1 25 49 A W H X S+ 0 0 6 -4,-2.0 4,-0.9 1,-0.2 -1,-0.2 0.931 110.4 52.4 -57.6 -44.4 -22.5 24.3 27.9 26 50 A N H < S+ 0 0 29 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.810 108.9 49.0 -66.5 -30.4 -23.6 27.8 28.3 27 51 A K H < S+ 0 0 179 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.844 115.6 44.8 -72.5 -37.2 -26.8 27.3 26.2 28 52 A E H < S+ 0 0 109 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.419 117.3 44.9 -87.9 -3.1 -27.6 24.1 28.2 29 53 A N >< + 0 0 21 -4,-0.9 3,-1.9 -5,-0.1 -1,-0.2 -0.553 60.7 171.7-139.8 68.7 -26.9 25.7 31.6 30 54 A P T 3 S+ 0 0 96 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.815 83.2 42.8 -50.6 -33.5 -28.5 29.2 31.8 31 55 A N T 3 S+ 0 0 133 1,-0.2 2,-0.3 -29,-0.0 -5,-0.1 0.374 111.8 53.0-100.5 4.6 -27.7 29.5 35.5 32 56 A V S < S- 0 0 18 -3,-1.9 -1,-0.2 -7,-0.2 -30,-0.2 -0.771 74.3-179.3-133.8 89.5 -24.2 28.1 35.5 33 57 A Q E -a 2 0A 59 -32,-3.0 -30,-3.4 -2,-0.3 2,-0.4 -0.552 14.5-147.2 -87.1 149.7 -22.2 30.0 32.9 34 58 A I E -a 3 0A 3 -12,-0.2 2,-0.4 -32,-0.2 -30,-0.2 -0.978 9.6-170.1-113.9 140.8 -18.5 29.4 32.1 35 59 A V E -a 4 0A 84 -32,-2.7 -30,-2.1 -2,-0.4 2,-0.3 -0.996 13.0-154.6-125.2 133.3 -16.0 32.0 31.1 36 60 A E E -a 5 0A 38 -2,-0.4 2,-0.4 -32,-0.2 -30,-0.2 -0.717 12.6-161.4-105.8 151.5 -12.6 30.9 29.8 37 61 A S E -a 6 0A 45 -32,-2.0 -30,-1.5 -2,-0.3 2,-0.5 -0.995 17.7-155.4-126.4 128.4 -9.2 32.6 29.7 38 62 A V E -a 7 0A 38 -2,-0.4 2,-0.4 -32,-0.2 -30,-0.2 -0.895 12.9-179.1-113.1 128.3 -6.7 31.0 27.3 39 63 A T - 0 0 26 -32,-2.4 -29,-0.1 -2,-0.5 5,-0.1 -0.986 35.9-100.2-132.7 136.1 -2.9 31.4 27.7 40 64 A E > - 0 0 63 -2,-0.4 4,-2.5 -31,-0.1 3,-0.4 -0.235 46.0-103.9 -51.4 137.3 -0.1 30.0 25.5 41 65 A N H > S+ 0 0 12 -33,-0.5 4,-1.8 1,-0.2 -1,-0.1 0.756 115.7 39.7 -24.9 -68.4 1.4 26.8 26.9 42 66 A D H > S+ 0 0 20 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.918 119.3 46.4 -69.2 -34.6 4.7 28.0 28.4 43 67 A A H > S+ 0 0 48 -3,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.825 107.3 61.3 -70.0 -26.5 3.1 31.3 29.7 44 68 A Y H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.910 97.3 56.3 -68.6 -39.4 0.3 29.2 31.1 45 69 A K H X S+ 0 0 26 -4,-1.8 4,-2.0 -5,-0.2 5,-0.2 0.947 111.3 44.4 -53.6 -47.4 2.6 27.2 33.4 46 70 A T H X S+ 0 0 100 -4,-1.3 4,-2.2 1,-0.2 -2,-0.2 0.931 114.8 48.9 -60.2 -46.3 3.7 30.5 34.9 47 71 A K H X S+ 0 0 60 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.928 112.9 44.4 -60.0 -52.7 0.2 31.8 35.2 48 72 A I H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 5,-0.2 0.888 113.1 50.6 -70.3 -37.3 -1.4 28.7 36.9 49 73 A K H X S+ 0 0 99 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.944 114.1 44.5 -62.4 -45.8 1.5 28.2 39.4 50 74 A A H X S+ 0 0 59 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.898 113.7 50.2 -64.8 -40.6 1.4 31.9 40.5 51 75 A A H <>S+ 0 0 10 -4,-2.3 5,-3.2 2,-0.2 6,-0.5 0.912 110.7 48.6 -65.6 -42.4 -2.4 31.9 40.7 52 76 A I H ><5S+ 0 0 7 -4,-2.5 3,-1.4 1,-0.2 5,-0.2 0.942 112.8 48.0 -65.2 -43.3 -2.5 28.7 42.8 53 77 A A H 3<5S+ 0 0 75 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.823 114.0 46.3 -63.7 -33.3 0.1 30.0 45.2 54 78 A A T 3<5S- 0 0 52 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.272 112.6-118.5 -92.4 4.3 -1.7 33.4 45.5 55 79 A N T < 5S+ 0 0 88 -3,-1.4 -3,-0.2 -4,-0.2 -2,-0.1 0.865 85.9 113.0 54.2 42.4 -5.1 31.7 46.0 56 80 A E < + 0 0 143 -5,-3.2 -4,-0.2 -6,-0.1 -5,-0.1 -0.110 38.3 137.0-130.0 25.5 -6.4 33.3 42.9 57 81 A A - 0 0 17 -6,-0.5 -53,-0.1 -5,-0.2 4,-0.1 -0.418 56.1-105.0 -71.3 154.5 -6.8 30.2 40.8 58 82 A P - 0 0 3 0, 0.0 230,-0.4 0, 0.0 3,-0.1 -0.175 30.7-103.1 -74.8 168.2 -10.0 29.7 38.6 59 83 A D S S+ 0 0 19 -55,-0.2 229,-2.1 1,-0.2 2,-0.4 0.922 109.6 19.8 -53.2 -43.1 -12.8 27.4 39.4 60 84 A I E S+bC 5 287A 0 -56,-2.1 -54,-2.1 227,-0.2 2,-0.4 -0.992 73.8 178.3-134.4 134.2 -11.4 24.9 36.8 61 85 A F E -bC 6 286A 0 225,-2.4 225,-2.8 -2,-0.4 -54,-0.2 -0.998 28.3-122.2-140.8 145.3 -8.0 24.7 35.3 62 86 A Q E + C 0 285A 9 -56,-1.9 2,-0.3 -2,-0.4 223,-0.2 -0.496 43.9 161.6 -76.9 146.9 -6.1 22.6 32.9 63 87 A T E - C 0 284A 1 221,-2.3 221,-2.0 -2,-0.2 2,-0.5 -0.934 43.0-103.8-154.1 175.7 -3.0 20.9 34.3 64 88 A W E > - C 0 283A 25 -2,-0.3 5,-0.6 219,-0.2 219,-0.2 -0.973 40.5-132.1-109.7 121.7 -0.5 18.2 33.9 65 89 A A T 5 + 0 0 2 217,-3.1 2,-0.4 -2,-0.5 3,-0.3 -0.388 69.7 31.1 -74.7 162.3 -1.0 15.3 36.3 66 90 A G T >>5S+ 0 0 12 34,-1.1 4,-1.2 1,-0.2 3,-0.7 -0.813 124.2 0.6 91.5-139.2 1.8 13.8 38.3 67 91 A G T 345S+ 0 0 5 289,-0.7 3,-0.3 -2,-0.4 290,-0.2 0.831 125.2 61.7 -59.4 -37.1 4.7 15.9 39.4 68 92 A F T 345S+ 0 0 23 288,-1.5 4,-0.3 -3,-0.3 -1,-0.3 0.893 115.0 33.0 -51.8 -47.8 3.5 19.1 38.0 69 93 A S T <> S+ 0 0 58 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.893 108.4 51.5 -63.4 -40.2 2.7 20.8 44.9 72 96 A F H 4>S+ 0 0 13 -3,-0.5 5,-2.4 -4,-0.3 6,-0.4 0.905 114.2 44.4 -59.3 -42.9 -0.9 22.2 44.4 73 97 A V H ><5S+ 0 0 10 -4,-2.0 3,-1.7 1,-0.2 5,-0.3 0.936 113.0 50.2 -67.7 -46.2 -2.4 19.0 45.9 74 98 A E H 3<5S+ 0 0 126 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.836 107.5 55.5 -64.9 -29.6 0.1 18.9 48.8 75 99 A A T 3<5S- 0 0 59 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.421 115.7-114.1 -81.0 1.0 -0.7 22.6 49.5 76 100 A G T < 5S+ 0 0 51 -3,-1.7 -3,-0.2 -5,-0.1 -2,-0.1 0.706 81.5 123.7 75.9 22.1 -4.4 21.9 49.9 77 101 A K < + 0 0 49 -5,-2.4 212,-2.4 -6,-0.2 2,-0.4 0.510 53.8 72.8 -95.0 -4.4 -5.2 24.0 46.8 78 102 A V B S-F 288 0B 7 -6,-0.4 210,-0.2 210,-0.3 2,-0.2 -0.928 81.2-119.0-120.9 130.1 -7.1 21.3 44.9 79 103 A L - 0 0 24 208,-3.1 208,-0.3 -2,-0.4 2,-0.3 -0.448 28.7-123.0 -63.9 129.1 -10.6 19.9 45.6 80 104 A Q - 0 0 83 -2,-0.2 28,-0.2 1,-0.1 3,-0.1 -0.525 23.6-165.3 -68.7 140.0 -10.6 16.1 46.3 81 105 A L > + 0 0 0 26,-3.3 3,-2.1 -2,-0.3 4,-0.3 0.485 56.8 102.4-110.7 -2.3 -12.9 14.4 43.8 82 106 A D G > S+ 0 0 35 25,-0.7 3,-2.2 1,-0.3 -1,-0.1 0.916 82.2 54.9 -50.3 -45.4 -13.6 10.9 45.2 83 107 A S G 3 S+ 0 0 95 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.627 108.5 49.6 -64.2 -16.5 -17.0 11.8 46.5 84 108 A Y G < S+ 0 0 44 -3,-2.1 -1,-0.3 1,-0.2 3,-0.3 0.252 99.1 69.1-101.8 5.9 -18.0 13.0 43.0 85 109 A L S < S+ 0 0 6 -3,-2.2 5,-0.4 -4,-0.3 3,-0.3 0.076 70.7 86.2-115.5 29.1 -16.8 9.8 41.4 86 110 A N S S+ 0 0 145 -3,-0.3 -1,-0.2 1,-0.2 -3,-0.1 0.073 70.1 83.7-109.0 18.4 -19.4 7.4 42.7 87 111 A D S S- 0 0 94 -3,-0.3 -1,-0.2 0, 0.0 -2,-0.1 0.123 115.9 -90.4-107.5 14.5 -21.8 8.2 39.8 88 112 A G S > S+ 0 0 34 -3,-0.3 3,-0.6 3,-0.0 4,-0.3 0.479 89.7 126.8 91.4 -0.6 -20.4 5.9 37.1 89 113 A T G > + 0 0 5 1,-0.2 3,-2.0 2,-0.2 4,-0.3 0.918 65.6 60.3 -58.2 -40.9 -18.0 8.5 35.7 90 114 A K G > S+ 0 0 89 -5,-0.4 3,-1.5 1,-0.3 -1,-0.2 0.824 96.4 59.6 -57.1 -34.2 -15.0 6.3 36.0 91 115 A D G < S+ 0 0 118 -3,-0.6 -1,-0.3 1,-0.3 -2,-0.2 0.537 96.1 64.2 -72.9 -12.0 -16.4 3.7 33.7 92 116 A Q G < S+ 0 0 101 -3,-2.0 231,-2.4 -4,-0.3 2,-0.3 0.479 96.2 69.0 -86.6 -11.7 -16.6 6.3 31.0 93 117 A L B < S-G 322 0C 5 -3,-1.5 229,-0.3 -4,-0.3 3,-0.1 -0.743 94.8 -92.8-105.9 157.5 -12.8 6.7 30.9 94 118 A L > - 0 0 38 227,-3.0 3,-1.7 -2,-0.3 -1,-0.1 -0.265 58.5 -79.7 -61.0 153.7 -10.2 4.2 29.7 95 119 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 -0.250 115.7 16.1 -56.1 136.7 -8.6 1.9 32.2 96 120 A G T > S+ 0 0 42 -3,-0.1 3,-1.5 1,-0.1 4,-0.4 0.375 82.6 132.6 81.3 3.5 -5.9 3.4 34.4 97 121 A S T < + 0 0 2 -3,-1.7 3,-0.2 1,-0.3 4,-0.1 0.746 69.0 49.2 -57.9 -30.7 -6.9 7.0 33.5 98 122 A F T > S+ 0 0 22 1,-0.2 3,-1.4 2,-0.1 4,-0.5 0.564 79.2 96.2 -90.9 -9.5 -6.9 8.2 37.2 99 123 A D G X S+ 0 0 58 -3,-1.5 3,-1.5 1,-0.3 -1,-0.2 0.910 86.3 46.2 -52.7 -49.8 -3.6 6.9 38.3 100 124 A N G 3 S+ 0 0 36 -4,-0.4 -34,-1.1 181,-0.3 -1,-0.3 0.647 111.0 51.8 -71.9 -17.2 -1.7 10.1 37.7 101 125 A V G < S+ 0 0 2 -3,-1.4 7,-2.7 -36,-0.2 2,-0.5 0.237 91.6 96.5 -95.3 9.4 -4.3 12.3 39.4 102 126 A T E < +H 107 0D 5 -3,-1.5 2,-0.4 -4,-0.5 5,-0.2 -0.857 49.2 174.4-103.1 127.7 -4.3 10.2 42.5 103 127 A Y E > -H 106 0D 16 3,-2.8 3,-1.8 -2,-0.5 479,-0.1 -0.997 69.2 -2.4-137.6 135.4 -2.1 11.3 45.4 104 128 A N T 3 S- 0 0 85 -2,-0.4 478,-0.2 476,-0.4 477,-0.2 0.905 131.5 -58.8 48.8 36.7 -2.0 9.7 48.8 105 129 A G T 3 S+ 0 0 1 476,-3.3 2,-0.3 1,-0.2 -1,-0.2 0.580 117.7 104.6 76.6 9.5 -4.7 7.3 47.6 106 130 A K E < S-H 103 0D 40 -3,-1.8 -3,-2.8 475,-0.4 2,-0.4 -0.943 70.0-118.6-127.0 150.3 -7.2 10.1 46.8 107 131 A I E +H 102 0D 7 -2,-0.3 -26,-3.3 -5,-0.2 -25,-0.7 -0.723 29.6 170.0 -96.4 132.4 -8.3 11.5 43.4 108 132 A Y + 0 0 28 -7,-2.7 179,-0.3 -2,-0.4 2,-0.3 0.149 58.2 37.3-124.4 14.1 -7.7 15.2 42.7 109 133 A G - 0 0 0 -8,-0.3 177,-0.2 177,-0.1 -8,-0.1 -0.997 65.5-122.7-159.9 162.6 -8.4 15.6 39.0 110 134 A I E -D 285 0A 0 175,-3.0 175,-2.6 -2,-0.3 -12,-0.0 -0.947 38.0-137.9-106.3 109.4 -10.6 14.6 36.0 111 135 A P E +D 284 0A 2 0, 0.0 173,-0.3 0, 0.0 198,-0.1 -0.323 31.7 165.4 -63.0 150.1 -8.3 13.1 33.3 112 136 A F E + 0 0 0 171,-3.0 209,-1.6 1,-0.3 210,-0.5 0.499 55.6 26.5-135.2 -23.2 -9.0 14.1 29.6 113 137 A D E -DE 283 320A 12 170,-1.7 170,-2.3 207,-0.2 169,-0.7 -0.973 51.4-146.2-147.8 159.4 -5.9 13.2 27.6 114 138 A Q E -DE 281 319A 28 205,-2.6 205,-1.6 -2,-0.3 2,-0.3 -0.872 16.9-145.3-117.3 150.5 -2.8 11.0 27.1 115 139 A Q E +D 280 0A 13 165,-2.7 165,-2.1 -2,-0.3 2,-0.3 -0.841 16.5 177.3-112.7 155.1 0.5 11.8 25.7 116 140 A A E -D 279 0A 0 -2,-0.3 125,-1.7 163,-0.2 2,-0.3 -0.967 33.0-111.3-154.4 145.1 2.9 9.6 23.6 117 141 A S E -I 240 0E 2 161,-0.9 2,-0.4 -2,-0.3 147,-0.2 -0.623 38.1-173.5 -82.2 132.0 6.2 10.3 21.9 118 142 A V E -I 239 0E 0 121,-2.9 121,-2.0 -2,-0.3 2,-0.7 -0.990 24.3-149.6-133.7 127.4 6.1 10.3 18.1 119 143 A L E -IJ 238 262E 0 143,-2.6 143,-2.7 -2,-0.4 2,-0.4 -0.908 26.3-152.8 -89.3 111.8 8.7 10.5 15.4 120 144 A Y E -IJ 237 261E 0 117,-3.3 117,-1.7 -2,-0.7 2,-0.4 -0.768 7.8-160.2 -93.3 136.1 6.9 12.2 12.5 121 145 A I E -IJ 236 260E 0 139,-2.7 139,-2.2 -2,-0.4 2,-1.1 -0.978 17.8-139.6-119.5 129.0 8.2 11.5 9.0 122 146 A N E > - J 0 259E 1 113,-2.8 4,-2.3 -2,-0.4 137,-0.2 -0.769 19.7-166.7 -85.8 100.5 7.6 13.6 5.9 123 147 A K H > S+ 0 0 80 135,-2.7 4,-2.4 -2,-1.1 -1,-0.2 0.767 82.4 58.7 -61.3 -31.7 7.0 10.7 3.4 124 148 A E H > S+ 0 0 103 134,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.939 109.4 42.0 -65.3 -47.4 7.3 13.1 0.5 125 149 A L H > S+ 0 0 17 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.899 113.8 52.2 -66.0 -43.8 10.8 14.2 1.4 126 150 A F H X>S+ 0 0 3 -4,-2.3 5,-2.6 1,-0.2 4,-0.5 0.946 113.7 44.6 -56.8 -42.8 11.8 10.6 2.3 127 151 A D H ><5S+ 0 0 127 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.897 105.8 61.3 -69.6 -38.7 10.6 9.4 -1.1 128 152 A K H 3<5S+ 0 0 144 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.882 118.5 28.3 -51.8 -46.5 12.2 12.3 -3.0 129 153 A Y H 3<5S- 0 0 60 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.305 108.8-119.2-102.0 7.2 15.7 11.2 -1.8 130 154 A N T <<5 + 0 0 147 -3,-0.8 2,-0.5 -4,-0.5 -3,-0.2 0.891 56.5 159.7 54.5 42.9 14.9 7.4 -1.5 131 155 A V < - 0 0 21 -5,-2.6 -1,-0.2 -6,-0.2 2,-0.2 -0.808 35.9-133.8 -92.0 133.3 15.6 7.5 2.3 132 156 A K - 0 0 133 -2,-0.5 11,-0.0 1,-0.1 758,-0.0 -0.565 31.8 -96.0 -82.2 150.6 14.1 4.6 4.3 133 157 A V - 0 0 39 -2,-0.2 2,-0.2 1,-0.1 -1,-0.1 -0.505 49.9-115.7 -61.2 130.6 12.4 5.4 7.6 134 158 A P + 0 0 4 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.521 37.5 174.7 -78.8 140.8 15.0 4.9 10.3 135 159 A T + 0 0 32 -2,-0.2 131,-2.4 130,-0.1 2,-0.3 0.540 67.9 46.0-117.0 -15.2 14.4 2.1 12.7 136 160 A T B > S-m 266 0F 43 129,-0.3 4,-2.2 1,-0.1 131,-0.2 -0.893 84.6-116.7-124.9 158.1 17.8 2.2 14.5 137 161 A F H > S+ 0 0 9 129,-2.5 4,-2.7 -2,-0.3 5,-0.2 0.921 116.7 56.2 -64.2 -36.8 19.8 5.2 15.9 138 162 A S H > S+ 0 0 43 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.914 108.8 46.8 -55.3 -44.0 22.6 4.3 13.4 139 163 A E H > S+ 0 0 61 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.854 109.7 55.0 -64.0 -37.5 20.1 4.6 10.6 140 164 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.911 108.1 46.9 -65.4 -45.1 18.8 7.9 12.1 141 165 A I H X S+ 0 0 9 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.919 112.1 51.8 -63.8 -38.7 22.2 9.5 12.1 142 166 A D H X S+ 0 0 104 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.925 110.6 48.5 -61.9 -39.5 22.8 8.3 8.5 143 167 A A H X S+ 0 0 3 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.900 108.0 53.0 -67.6 -41.7 19.5 9.8 7.5 144 168 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.933 111.4 47.5 -55.4 -44.3 20.3 13.1 9.1 145 169 A K H X S+ 0 0 114 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.900 111.5 51.3 -66.4 -37.0 23.6 13.1 7.1 146 170 A T H X S+ 0 0 35 -4,-2.5 4,-1.1 2,-0.2 -2,-0.2 0.952 113.3 43.1 -66.5 -48.0 21.7 12.3 3.9 147 171 A F H ><>S+ 0 0 0 -4,-2.9 5,-2.6 1,-0.2 3,-0.9 0.927 112.1 53.1 -62.6 -44.5 19.2 15.0 4.3 148 172 A K H ><5S+ 0 0 108 -4,-2.8 3,-1.8 1,-0.3 -1,-0.2 0.910 106.2 54.9 -57.5 -41.8 21.8 17.6 5.4 149 173 A S H 3<5S+ 0 0 91 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.737 107.6 49.7 -61.7 -29.5 23.8 16.7 2.2 150 174 A K T <<5S- 0 0 100 -4,-1.1 -1,-0.3 -3,-0.9 -2,-0.2 0.390 120.3-109.5 -89.5 0.6 20.8 17.5 0.1 151 175 A G T < 5S+ 0 0 71 -3,-1.8 2,-0.5 -4,-0.4 -3,-0.2 0.683 76.2 136.2 78.3 17.6 20.3 20.8 1.9 152 176 A V < - 0 0 18 -5,-2.6 -1,-0.3 -6,-0.2 -2,-0.2 -0.865 62.2-119.6-100.6 123.2 17.1 19.5 3.6 153 177 A T - 0 0 25 -2,-0.5 82,-2.4 80,-0.4 83,-0.3 -0.475 23.0-153.7 -57.3 119.3 16.8 20.4 7.4 154 178 A P S S+ 0 0 1 0, 0.0 82,-1.8 0, 0.0 2,-0.4 0.960 73.2 20.9 -66.2 -47.5 16.7 16.9 9.0 155 179 A F B -kl 213 236E 1 57,-2.3 2,-0.7 80,-0.2 59,-0.6 -0.981 64.8-143.7-124.2 131.7 14.6 17.9 12.1 156 180 A A + 0 0 0 80,-2.3 82,-0.4 -2,-0.4 2,-0.4 -0.862 38.5 163.8 -85.0 110.5 12.4 20.9 12.8 157 181 A L - 0 0 7 -2,-0.7 2,-0.6 80,-0.1 63,-0.2 -0.999 29.7-163.1-136.9 134.4 13.1 21.7 16.5 158 182 A G + 0 0 1 -2,-0.4 3,-0.3 1,-0.1 7,-0.2 -0.949 15.6 171.7-117.0 103.2 12.3 24.8 18.5 159 183 A E > + 0 0 6 58,-2.7 3,-1.7 -2,-0.6 59,-0.2 0.463 45.9 102.6 -99.2 1.6 14.4 24.7 21.6 160 184 A K T 3 S+ 0 0 126 60,-2.6 -1,-0.2 57,-0.5 61,-0.2 0.866 87.9 41.6 -50.5 -45.0 13.8 28.2 23.1 161 185 A D T 3 S- 0 0 48 59,-0.3 2,-1.8 -3,-0.3 -1,-0.3 0.393 101.4-140.9 -89.2 2.1 11.4 27.0 25.7 162 186 A E S <> S+ 0 0 40 -3,-1.7 4,-2.0 1,-0.2 3,-0.1 -0.154 80.4 87.7 75.8 -38.9 13.6 24.0 26.5 163 187 A W H > S+ 0 0 13 -2,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.868 82.5 57.7 -66.7 -31.3 10.9 21.3 27.0 164 188 A P H > S+ 0 0 8 0, 0.0 4,-0.6 0, 0.0 3,-0.3 0.937 110.9 42.3 -67.0 -39.0 10.7 20.3 23.3 165 189 A G H >> S+ 0 0 0 1,-0.2 4,-1.4 -7,-0.2 3,-0.9 0.844 106.3 64.2 -68.9 -37.5 14.4 19.4 23.0 166 190 A X H 3X S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.3 5,-0.2 0.839 91.7 64.4 -54.8 -38.2 14.2 17.7 26.4 167 191 A W H 3X S+ 0 0 5 -4,-1.4 4,-2.4 -3,-0.3 -1,-0.3 0.867 99.9 53.3 -50.8 -37.3 11.8 15.2 24.9 168 192 A Y H S+ 0 0 26 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.872 125.3 57.1 -66.9 -38.1 11.9 2.5 32.0 180 204 A Q H > S+ 0 0 112 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.920 107.4 47.8 -60.8 -44.3 12.8 1.1 35.4 181 205 A L H > S+ 0 0 33 -4,-0.4 4,-2.5 -3,-0.3 -1,-0.2 0.922 111.7 50.4 -65.8 -40.1 16.2 3.1 35.5 182 206 A T H X S+ 0 0 0 -4,-1.7 4,-3.1 2,-0.2 5,-0.2 0.969 112.9 46.3 -56.8 -51.0 14.4 6.3 34.5 183 207 A R H X S+ 0 0 66 -4,-2.7 4,-2.2 1,-0.2 6,-0.2 0.923 111.5 51.4 -59.8 -44.9 11.8 5.8 37.2 184 208 A D H <>S+ 0 0 22 -4,-2.9 5,-3.4 -5,-0.2 6,-0.9 0.917 112.5 45.9 -58.7 -42.1 14.4 5.0 39.8 185 209 A A H ><5S+ 0 0 1 -4,-2.5 3,-1.5 4,-0.3 5,-0.2 0.941 113.7 47.7 -66.7 -45.0 16.4 8.1 39.0 186 210 A L H 3<5S+ 0 0 16 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.779 114.2 48.4 -68.6 -26.7 13.3 10.3 39.0 187 211 A N T 3<5S- 0 0 82 -4,-2.2 310,-0.4 -5,-0.2 -1,-0.3 0.338 118.9-109.3 -90.0 3.8 12.2 8.8 42.3 188 212 A G T < 5S+ 0 0 6 -3,-1.5 310,-2.9 -4,-0.3 311,-0.3 0.626 88.4 116.4 74.5 19.0 15.5 9.2 43.9 189 213 A K S - 0 0 57 -2,-1.8 4,-1.9 -4,-0.1 3,-0.4 -0.939 68.1-116.9-138.1 152.1 24.9 6.8 35.6 195 219 A Q H > S+ 0 0 119 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.832 111.3 57.1 -69.9 -32.1 26.4 5.6 32.3 196 220 A A H > S+ 0 0 14 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.899 109.6 44.9 -62.8 -39.8 23.1 5.2 30.5 197 221 A F H > S+ 0 0 2 -3,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.829 115.2 47.9 -72.1 -33.4 22.2 8.9 31.1 198 222 A T H X S+ 0 0 7 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.913 111.0 50.8 -70.9 -42.3 25.7 10.0 30.1 199 223 A D H X S+ 0 0 59 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.903 108.7 53.0 -58.8 -42.3 25.5 7.8 27.0 200 224 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.905 107.2 51.4 -57.8 -41.6 22.1 9.4 26.2 201 225 A A H X S+ 0 0 0 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.937 109.7 49.9 -63.0 -45.5 23.7 12.9 26.5 202 226 A Q H X S+ 0 0 69 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.903 109.7 50.2 -58.1 -46.3 26.4 11.9 24.1 203 227 A K H X S+ 0 0 35 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.855 108.6 53.1 -61.5 -36.6 23.8 10.5 21.6 204 228 A L H X S+ 0 0 1 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.940 111.6 45.2 -62.5 -44.4 21.8 13.8 21.8 205 229 A Q H X S+ 0 0 5 -4,-2.4 4,-3.3 1,-0.2 -2,-0.2 0.853 105.7 61.3 -72.3 -25.7 25.1 15.7 21.0 206 230 A D H X S+ 0 0 57 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.888 104.7 50.3 -62.7 -40.5 25.8 13.2 18.2 207 231 A X H <>S+ 0 0 0 -4,-1.9 5,-1.8 2,-0.2 4,-0.4 0.927 112.3 45.6 -61.2 -50.4 22.5 14.4 16.6 208 232 A V H ><5S+ 0 0 29 -4,-1.9 3,-1.8 1,-0.2 5,-0.3 0.939 113.0 49.2 -58.0 -48.3 23.6 18.0 17.0 209 233 A N H 3<5S+ 0 0 94 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.798 104.9 58.4 -64.4 -30.5 27.1 17.3 15.6 210 234 A A T 3<5S- 0 0 20 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.520 121.4-107.8 -74.7 -8.4 25.6 15.4 12.6 211 235 A G T < 5 + 0 0 14 -3,-1.8 -3,-0.2 -4,-0.4 -2,-0.1 0.814 65.9 152.7 88.3 37.1 23.7 18.7 11.7 212 236 A A < + 0 0 0 -5,-1.8 -57,-2.3 -58,-0.1 2,-0.3 0.797 59.1 50.5 -67.2 -27.6 20.2 17.4 12.7 213 237 A F B S-k 155 0E 13 -5,-0.3 -57,-0.1 -6,-0.2 2,-0.1 -0.819 90.6-101.1-118.3 151.5 18.9 20.9 13.5 214 238 A D > - 0 0 57 -59,-0.6 3,-2.2 -2,-0.3 4,-0.2 -0.399 42.6-106.8 -61.9 144.9 18.8 24.2 11.7 215 239 A S T 3 S+ 0 0 118 1,-0.3 3,-0.4 2,-0.1 -1,-0.1 0.787 117.4 44.0 -42.8 -43.6 21.5 26.7 12.9 216 240 A G T > S+ 0 0 49 1,-0.2 3,-1.8 2,-0.1 4,-0.4 0.146 74.8 119.9 -94.5 22.3 19.0 29.0 14.7 217 241 A F G X + 0 0 14 -3,-2.2 -58,-2.7 1,-0.3 3,-1.0 0.758 67.0 61.7 -62.0 -26.1 17.0 26.2 16.5 218 242 A M G 3 S+ 0 0 83 -3,-0.4 -1,-0.3 1,-0.2 -56,-0.1 0.720 103.0 53.5 -72.7 -19.8 17.7 27.4 20.0 219 243 A G G < S+ 0 0 47 -3,-1.8 2,-0.3 -60,-0.1 -1,-0.2 0.526 94.7 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95.6 -91.2 -8.9 21.7 -0.6 45.9 492 123 B D G X S+ 0 0 58 -3,-1.3 3,-1.6 1,-0.3 -1,-0.2 0.908 86.3 47.3 -52.4 -46.1 18.4 0.6 44.6 493 124 B N G 3 S+ 0 0 38 -4,-0.4 -34,-1.3 -3,-0.3 -1,-0.3 0.677 110.9 50.6 -78.9 -12.3 16.5 -0.1 47.9 494 125 B V G < S+ 0 0 2 -3,-1.3 7,-2.9 -36,-0.2 2,-0.5 0.295 91.6 97.1 -99.0 11.8 19.1 1.6 50.1 495 126 B T E < +V 500 0K 5 -3,-1.6 2,-0.4 -4,-0.4 5,-0.2 -0.861 48.7 173.7-103.2 126.3 19.1 4.7 47.9 496 127 B Y E > -V 499 0K 13 3,-2.7 3,-1.8 -2,-0.5 -308,-0.1 -1.000 69.6 -3.2-135.1 134.3 17.0 7.7 49.1 497 128 B N T 3 S- 0 0 86 -310,-0.4 -308,-0.2 -2,-0.4 -309,-0.2 0.890 131.5 -58.1 48.4 38.9 16.9 11.1 47.5 498 129 B G T 3 S+ 0 0 1 -310,-2.9 2,-0.3 1,-0.2 -1,-0.3 0.551 116.9 105.9 78.8 7.1 19.6 9.9 45.1 499 130 B K E < -V 496 0K 42 -3,-1.8 -3,-2.7 -311,-0.3 2,-0.4 -0.933 69.3-119.4-129.7 147.2 22.0 9.0 47.9 500 131 B I E +V 495 0K 7 -2,-0.3 -26,-3.5 -5,-0.2 -25,-0.7 -0.728 29.9 169.7 -96.3 129.0 23.1 5.7 49.2 501 132 B Y + 0 0 26 -7,-2.9 179,-0.3 -2,-0.4 2,-0.3 0.208 57.6 36.0-121.6 9.7 22.5 4.9 52.9 502 133 B G - 0 0 0 -8,-0.2 177,-0.2 177,-0.1 -8,-0.1 -0.993 64.9-122.7-158.8 162.7 23.3 1.2 53.3 503 134 B I E -R 678 0H 1 175,-2.8 175,-2.5 -2,-0.3 -12,-0.1 -0.942 37.8-138.4-107.2 111.0 25.4 -1.8 52.3 504 135 B P E +R 677 0H 1 0, 0.0 173,-0.3 0, 0.0 198,-0.1 -0.286 30.8 166.4 -62.9 148.9 23.1 -4.5 50.9 505 136 B F E + 0 0 0 171,-2.9 209,-1.8 1,-0.3 210,-0.5 0.537 56.1 24.3-134.2 -20.5 23.8 -8.1 51.9 506 137 B D E -RS 676 713H 14 170,-1.6 170,-2.3 207,-0.2 169,-0.5 -0.974 51.4-146.3-149.8 156.9 20.7 -10.2 50.9 507 138 B Q E - S 0 712H 29 205,-2.6 205,-1.6 -2,-0.3 2,-0.3 -0.876 17.4-143.5-114.4 153.8 17.7 -10.6 48.7 508 139 B Q E +R 673 0H 13 165,-2.6 165,-2.4 -2,-0.3 2,-0.3 -0.813 16.1 178.2-112.6 158.2 14.4 -12.1 49.5 509 140 B A E -R 672 0H 0 -2,-0.3 125,-1.8 163,-0.2 2,-0.3 -0.958 31.9-112.6-155.8 141.3 12.0 -14.1 47.4 510 141 B S E -W 633 0L 2 161,-1.2 2,-0.4 -2,-0.3 147,-0.2 -0.567 38.1-174.7 -76.8 132.0 8.6 -15.8 48.1 511 142 B V E 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-39.3 4.3 -38.8 47.0 521 152 B K H 3<5S+ 0 0 145 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.876 118.4 26.7 -48.8 -45.9 2.7 -40.6 50.0 522 153 B Y T 3<5S- 0 0 61 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.263 109.2-117.9-107.0 8.2 -0.8 -39.5 48.9 523 154 B N T < 5 + 0 0 144 -3,-1.0 2,-0.5 -4,-0.5 -3,-0.2 0.905 57.4 158.9 52.1 50.6 -0.0 -39.2 45.1 524 155 B V < - 0 0 18 -5,-2.6 -1,-0.2 -6,-0.2 2,-0.2 -0.853 36.3-133.7-101.2 131.1 -0.8 -35.5 45.2 525 156 B K - 0 0 169 -2,-0.5 11,-0.0 1,-0.1 3,-0.0 -0.572 31.4 -95.8 -83.2 152.7 0.7 -33.4 42.4 526 157 B V - 0 0 43 -2,-0.2 2,-0.2 1,-0.1 -1,-0.1 -0.488 50.1-114.8 -63.0 131.8 2.5 -30.1 43.2 527 158 B P + 0 0 4 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.467 37.4 175.1 -79.8 136.4 -0.2 -27.4 42.6 528 159 B T + 0 0 87 -2,-0.2 131,-2.4 130,-0.1 2,-0.3 0.518 68.9 44.7-111.0 -15.3 0.4 -25.0 39.8 529 160 B T B > S-a 659 0M 42 129,-0.3 4,-2.3 1,-0.1 131,-0.2 -0.905 84.0-117.4-125.1 160.3 -3.0 -23.2 40.0 530 161 B F H > S+ 0 0 11 129,-2.6 4,-2.6 -2,-0.3 5,-0.2 0.905 116.8 56.5 -67.9 -36.5 -5.0 -21.9 42.9 531 162 B S H > S+ 0 0 86 128,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.912 109.4 46.0 -51.5 -48.1 -7.8 -24.3 42.0 532 163 B E H > S+ 0 0 81 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.843 110.2 55.2 -65.0 -35.0 -5.3 -27.1 42.3 533 164 B L H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.933 107.9 47.0 -63.5 -47.0 -4.0 -25.7 45.5 534 165 B I H X S+ 0 0 23 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.913 111.8 51.6 -62.5 -41.3 -7.4 -25.7 47.1 535 166 B D H X S+ 0 0 102 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.917 111.0 48.1 -58.0 -43.6 -7.9 -29.3 45.9 536 167 B A H X S+ 0 0 2 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.915 109.1 52.6 -66.0 -42.2 -4.6 -30.3 47.5 537 168 B I H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.947 111.3 47.6 -55.4 -46.8 -5.4 -28.6 50.7 538 169 B K H X S+ 0 0 123 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.886 111.9 50.8 -64.2 -37.0 -8.7 -30.6 50.8 539 170 B T H X S+ 0 0 36 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.958 112.5 44.4 -68.1 -47.7 -6.9 -33.9 50.0 540 171 B F H ><>S+ 0 0 0 -4,-2.9 5,-2.7 1,-0.2 3,-0.6 0.918 112.2 52.0 -62.3 -41.0 -4.4 -33.4 52.7 541 172 B K H ><5S+ 0 0 115 -4,-2.6 3,-1.6 -5,-0.3 -1,-0.2 0.901 105.8 56.0 -65.4 -34.0 -7.0 -32.4 55.2 542 173 B S H 3<5S+ 0 0 85 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.787 107.8 48.6 -68.9 -26.7 -9.0 -35.5 54.3 543 174 B K T <<5S- 0 0 104 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.327 119.9-109.6 -90.2 3.4 -5.9 -37.7 55.2 544 175 B G T < 5S+ 0 0 71 -3,-1.6 2,-0.5 1,-0.3 -3,-0.2 0.766 76.4 134.7 72.6 25.4 -5.4 -35.9 58.6 545 176 B V < - 0 0 18 -5,-2.7 -1,-0.3 -6,-0.2 -2,-0.2 -0.936 63.2-117.6-106.6 125.1 -2.3 -34.1 57.3 546 177 B T - 0 0 22 -2,-0.5 82,-2.2 80,-0.5 83,-0.3 -0.475 22.3-152.2 -56.4 122.6 -1.9 -30.4 58.0 547 178 B P S S+ 0 0 3 0, 0.0 82,-1.9 0, 0.0 2,-0.4 0.967 74.6 18.3 -69.0 -49.0 -1.8 -28.7 54.6 548 179 B F B -yz 606 629L 0 57,-2.4 2,-0.8 80,-0.2 59,-0.5 -0.965 65.6-141.1-125.6 135.0 0.2 -25.6 55.6 549 180 B A + 0 0 0 80,-2.1 82,-0.4 -2,-0.4 2,-0.4 -0.868 39.3 166.0 -86.9 108.2 2.5 -24.9 58.6 550 181 B L - 0 0 6 -2,-0.8 2,-0.6 80,-0.1 63,-0.2 -0.994 29.2-164.9-130.1 137.8 1.7 -21.3 59.4 551 182 B G + 0 0 1 -2,-0.4 3,-0.3 1,-0.1 7,-0.2 -0.919 15.4 170.0-120.3 102.6 2.5 -19.3 62.5 552 183 B E > + 0 0 6 58,-2.3 3,-1.8 -2,-0.6 59,-0.2 0.441 45.2 103.4 -97.9 2.7 0.4 -16.1 62.4 553 184 B K T 3 S+ 0 0 120 60,-2.5 -1,-0.2 57,-0.6 61,-0.2 0.873 88.4 40.6 -58.5 -40.7 1.0 -14.7 65.9 554 185 B D T 3 S- 0 0 44 -3,-0.3 2,-1.9 59,-0.3 -1,-0.3 0.359 102.3-139.7 -94.1 9.0 3.5 -12.0 64.7 555 186 B E S <> S+ 0 0 41 -3,-1.8 4,-1.8 1,-0.2 3,-0.1 -0.094 80.9 87.5 72.4 -38.7 1.3 -11.2 61.7 556 187 B W H > S+ 0 0 12 -2,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.882 82.6 58.2 -66.5 -31.8 3.9 -10.7 59.0 557 188 B P H > S+ 0 0 8 0, 0.0 4,-0.6 0, 0.0 3,-0.3 0.929 111.4 41.2 -65.1 -38.5 4.2 -14.5 58.0 558 189 B G H >> S+ 0 0 0 1,-0.2 4,-1.4 2,-0.2 3,-0.8 0.848 106.6 64.8 -77.1 -30.2 0.5 -14.7 57.1 559 190 B X H 3X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 -1,-0.2 0.843 91.9 63.3 -56.6 -41.3 0.7 -11.3 55.5 560 191 B W H 3X S+ 0 0 4 -4,-1.5 4,-2.5 -3,-0.3 -1,-0.2 0.868 100.8 53.6 -51.3 -35.0 3.1 -12.8 52.9 561 192 B Y H S+ 0 0 25 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.870 124.8 58.4 -65.2 -37.9 3.0 -5.8 40.3 573 204 B Q H > S+ 0 0 109 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.937 106.9 46.2 -60.7 -45.6 2.0 -2.4 38.9 574 205 B L H > S+ 0 0 36 -4,-0.4 4,-2.5 1,-0.2 5,-0.2 0.916 112.7 51.9 -66.5 -38.8 -1.3 -2.2 40.8 575 206 B T H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.938 112.7 44.5 -56.9 -48.7 0.4 -3.3 44.0 576 207 B R H X S+ 0 0 65 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.890 112.0 53.2 -66.6 -40.7 3.1 -0.6 43.6 577 208 B D H <>S+ 0 0 20 -4,-3.0 5,-3.0 -5,-0.2 6,-0.8 0.920 111.8 45.0 -59.5 -45.5 0.4 2.1 42.7 578 209 B A H ><5S+ 0 0 1 -4,-2.5 3,-1.6 4,-0.2 5,-0.2 0.948 113.4 48.3 -64.8 -42.6 -1.5 1.3 45.8 579 210 B L H 3<5S+ 0 0 17 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.810 114.7 47.8 -68.8 -29.5 1.5 1.2 48.1 580 211 B N T 3<5S- 0 0 88 -4,-2.0 -476,-0.4 -5,-0.2 -1,-0.3 0.348 119.2-109.9 -88.9 4.5 2.7 4.6 46.6 581 212 B G T < 5S+ 0 0 7 -3,-1.6 -476,-3.3 -4,-0.3 -475,-0.4 0.607 87.7 116.2 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