==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 01-NOV-05 2EW2 . COMPND 2 MOLECULE: 2-DEHYDROPANTOATE 2-REDUCTASE, PUTATIVE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR Y.KIM,M.ZHOU,S.MOY,S.CLANCY,F.COLLART,A.JOACHIMIAK,MIDWEST C . 627 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26985.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 475 75.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 5.4 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 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 . 39 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 228 36.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 1 3 0 2 0 3 5 4 2 0 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 4 6 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 PARALLEL BRIDGES PER LADDER . 0 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 0 0 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 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 X 0 0 62 0, 0.0 24,-1.7 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 136.4 41.3 26.3 55.9 2 2 A K E -a 25 0A 91 22,-0.2 71,-2.3 24,-0.0 72,-2.1 -0.873 360.0-176.3 -93.3 119.8 40.7 28.5 52.9 3 3 A I E -ab 26 74A 1 22,-3.4 24,-2.1 -2,-0.6 2,-0.4 -0.954 18.7-163.0-126.2 131.9 43.5 31.1 52.8 4 4 A A E -ab 27 75A 1 70,-2.9 72,-2.8 -2,-0.4 2,-0.7 -0.953 11.6-150.4-109.1 136.5 44.2 34.1 50.5 5 5 A I E -ab 28 76A 0 22,-2.9 24,-2.6 -2,-0.4 2,-1.2 -0.924 5.7-156.5-106.7 107.6 47.7 35.6 50.5 6 6 A A E S+ab 29 77A 0 70,-2.3 72,-3.1 -2,-0.7 73,-1.5 -0.731 78.5 26.6 -87.7 97.2 47.5 39.3 49.7 7 7 A G - 0 0 10 22,-3.0 2,-0.2 -2,-1.2 23,-0.2 0.547 67.3-157.1 112.1 96.8 50.9 40.0 48.3 8 8 A A + 0 0 0 21,-0.4 22,-0.1 4,-0.2 -2,-0.1 -0.195 46.9 130.1 -99.2 43.3 52.7 37.1 46.7 9 9 A G S > S- 0 0 28 -2,-0.2 4,-2.7 4,-0.0 5,-0.2 0.204 82.1 -62.3 -69.9-157.3 56.3 38.4 47.1 10 10 A A H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 123,-0.2 0.962 139.1 39.4 -61.1 -55.5 59.1 36.3 48.6 11 11 A X H > S+ 0 0 39 121,-0.2 4,-2.8 2,-0.2 5,-0.2 0.916 116.4 51.6 -59.6 -46.6 57.5 35.9 52.1 12 12 A G H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.890 110.5 49.3 -57.5 -42.0 54.0 35.4 50.6 13 13 A S H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.892 110.3 50.3 -63.6 -44.2 55.3 32.7 48.2 14 14 A R H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.2 5,-0.2 0.966 114.3 44.4 -56.0 -53.8 57.0 30.9 51.1 15 15 A L H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.921 113.5 51.5 -59.4 -45.2 53.8 31.0 53.2 16 16 A G H X S+ 0 0 0 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.928 111.5 45.6 -56.6 -51.4 51.7 29.9 50.2 17 17 A I H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.948 116.0 45.9 -55.3 -52.8 53.9 26.9 49.3 18 18 A X H X S+ 0 0 14 -4,-2.5 4,-1.3 -5,-0.2 -2,-0.2 0.876 114.5 46.7 -63.4 -40.4 54.1 25.8 53.0 19 19 A L H <>S+ 0 0 0 -4,-2.7 5,-2.2 -5,-0.2 -1,-0.2 0.874 111.7 52.1 -70.4 -37.5 50.4 26.2 53.6 20 20 A H H ><5S+ 0 0 79 -4,-2.4 3,-2.0 -5,-0.3 -2,-0.2 0.960 110.1 48.6 -57.0 -54.3 49.6 24.4 50.3 21 21 A Q H 3<5S+ 0 0 104 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.770 103.8 61.7 -56.0 -31.7 51.9 21.5 51.4 22 22 A G T 3<5S- 0 0 35 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.504 125.7-100.9 -76.8 -4.2 50.1 21.5 54.8 23 23 A G T < 5S+ 0 0 65 -3,-2.0 -3,-0.2 1,-0.3 2,-0.2 0.547 76.4 135.9 100.1 9.9 46.8 20.6 53.0 24 24 A N < - 0 0 20 -5,-2.2 2,-0.8 143,-0.1 -1,-0.3 -0.532 62.1-109.8 -90.0 155.7 45.1 24.1 52.9 25 25 A D E -a 2 0A 104 -24,-1.7 -22,-3.4 -2,-0.2 2,-0.4 -0.780 44.8-172.8 -78.4 108.9 43.3 25.8 50.0 26 26 A V E -a 3 0A 6 -2,-0.8 2,-0.4 -24,-0.2 -22,-0.2 -0.924 14.6-178.2-115.6 129.9 45.7 28.7 49.1 27 27 A T E -a 4 0A 23 -24,-2.1 -22,-2.9 -2,-0.4 2,-0.4 -0.991 15.8-147.6-122.2 131.7 45.0 31.5 46.6 28 28 A L E -ac 5 59A 0 30,-2.9 32,-2.0 -2,-0.4 2,-0.4 -0.790 8.1-166.0 -99.0 143.1 47.6 34.1 45.8 29 29 A I E +ac 6 60A 0 -24,-2.6 -22,-3.0 -2,-0.4 -21,-0.4 -0.999 21.7 159.6-128.0 128.9 46.9 37.7 45.0 30 30 A D - 0 0 17 30,-2.2 -24,-0.0 -2,-0.4 -2,-0.0 -0.962 41.5-145.0-150.5 159.1 49.7 39.8 43.5 31 31 A Q S S+ 0 0 81 -2,-0.3 30,-0.1 30,-0.2 -1,-0.0 0.302 71.6 98.6-113.2 5.8 50.3 42.9 41.5 32 32 A W > - 0 0 105 1,-0.2 4,-2.4 2,-0.0 3,-0.3 -0.822 55.6-162.5 -99.8 102.0 53.4 41.8 39.5 33 33 A P H > S+ 0 0 82 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.871 88.4 49.0 -52.8 -49.6 52.2 40.7 36.0 34 34 A A H > S+ 0 0 43 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.907 112.3 50.6 -53.6 -45.3 55.3 38.7 35.0 35 35 A H H > S+ 0 0 1 -3,-0.3 4,-2.5 2,-0.2 5,-0.2 0.939 111.8 47.0 -59.1 -50.2 55.2 36.9 38.3 36 36 A I H X S+ 0 0 10 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.936 113.8 47.5 -56.8 -50.9 51.5 36.1 37.8 37 37 A E H X S+ 0 0 137 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.912 111.7 50.4 -58.7 -45.9 52.1 34.8 34.2 38 38 A A H X S+ 0 0 20 -4,-2.9 4,-3.1 -5,-0.2 5,-0.4 0.917 112.9 45.7 -58.1 -47.6 55.0 32.7 35.3 39 39 A I H X S+ 0 0 4 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.896 113.1 50.2 -66.3 -39.7 53.1 31.1 38.1 40 40 A R H < S+ 0 0 123 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.915 118.7 38.6 -63.4 -41.0 50.1 30.5 35.8 41 41 A K H < S+ 0 0 179 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.917 137.5 10.2 -75.6 -45.8 52.3 28.9 33.1 42 42 A N H < S- 0 0 91 -4,-3.1 -3,-0.2 1,-0.3 -2,-0.2 0.350 101.4-113.7-119.9 2.5 54.8 26.9 35.2 43 43 A G < - 0 0 3 -4,-1.8 2,-0.6 -5,-0.4 -1,-0.3 -0.103 54.6 -53.0 80.2 169.2 53.5 26.9 38.8 44 44 A L E -H 55 0B 0 11,-3.4 11,-2.9 -5,-0.1 2,-0.6 -0.768 62.1-153.5 -80.2 119.0 55.2 28.6 41.7 45 45 A I E -Hi 54 139B 19 93,-2.7 95,-2.4 -2,-0.6 2,-0.5 -0.874 12.5-171.1-103.2 118.1 58.8 27.2 41.6 46 46 A A E -Hi 53 140B 0 7,-3.9 7,-3.1 -2,-0.6 2,-1.3 -0.921 27.6-149.5-113.1 129.4 60.7 27.2 44.9 47 47 A D E -Hi 52 141B 46 93,-3.3 95,-3.4 -2,-0.5 2,-0.9 -0.829 37.0-174.8 -82.9 92.5 64.3 26.4 45.5 48 48 A F E > -Hi 51 142B 23 3,-2.8 3,-1.4 -2,-1.3 95,-0.2 -0.828 60.1 -37.3-107.5 96.4 63.3 25.1 48.9 49 49 A N T 3 S- 0 0 90 93,-2.9 -1,-0.2 -2,-0.9 94,-0.1 0.881 121.9 -45.4 57.4 45.9 66.3 24.1 51.0 50 50 A G T 3 S+ 0 0 63 92,-0.2 2,-0.4 1,-0.2 -1,-0.3 0.295 124.0 100.0 82.8 -8.3 68.3 22.7 48.1 51 51 A E E < S-H 48 0B 144 -3,-1.4 -3,-2.8 2,-0.0 2,-0.4 -0.908 74.6-122.6-111.6 135.2 65.2 20.8 46.7 52 52 A E E -H 47 0B 131 -2,-0.4 2,-0.5 -5,-0.2 -5,-0.2 -0.644 29.1-174.9 -76.5 125.4 63.0 22.0 43.9 53 53 A V E -H 46 0B 35 -7,-3.1 -7,-3.9 -2,-0.4 2,-0.5 -0.991 6.3-166.6-121.9 124.7 59.3 22.4 44.9 54 54 A V E -H 45 0B 64 -2,-0.5 2,-0.5 -9,-0.2 -9,-0.2 -0.950 5.3-171.8-108.8 124.8 56.7 23.3 42.3 55 55 A A E -H 44 0B 2 -11,-2.9 -11,-3.4 -2,-0.5 2,-1.6 -0.973 18.1-149.4-120.6 120.6 53.3 24.4 43.5 56 56 A N + 0 0 131 -2,-0.5 -16,-0.1 -13,-0.3 -13,-0.0 -0.609 36.5 166.4 -86.2 77.4 50.3 24.9 41.2 57 57 A L - 0 0 10 -2,-1.6 -30,-0.1 -18,-0.1 2,-0.1 -0.781 40.3-112.5 -96.6 137.2 48.6 27.6 43.2 58 58 A P - 0 0 64 0, 0.0 -30,-2.9 0, 0.0 2,-0.4 -0.429 38.6-172.6 -60.4 137.5 45.8 29.8 41.8 59 59 A I E +c 28 0A 4 -32,-0.2 2,-0.3 -2,-0.1 -30,-0.2 -0.992 8.1 179.3-135.6 142.5 46.9 33.4 41.4 60 60 A F E -c 29 0A 54 -32,-2.0 -30,-2.2 -2,-0.4 5,-0.0 -0.975 27.2-126.8-134.1 152.1 45.0 36.5 40.6 61 61 A S > - 0 0 8 -2,-0.3 3,-1.6 -32,-0.2 4,-0.4 -0.659 40.0-108.2 -83.2 157.2 45.8 40.2 40.2 62 62 A P G > S+ 0 0 11 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.852 117.7 58.9 -55.3 -38.5 43.4 42.4 42.3 63 63 A E G 3 S+ 0 0 157 1,-0.2 -3,-0.0 28,-0.0 28,-0.0 0.632 100.2 59.0 -67.5 -14.3 41.5 43.7 39.2 64 64 A E G < S+ 0 0 81 -3,-1.6 2,-0.3 2,-0.1 -1,-0.2 0.545 81.6 102.8 -91.3 -11.0 40.5 40.1 38.3 65 65 A I < + 0 0 15 -3,-1.3 2,-0.2 -4,-0.4 27,-0.1 -0.574 44.7 143.2 -78.1 134.7 38.7 39.4 41.6 66 66 A D > - 0 0 52 -2,-0.3 3,-1.7 25,-0.1 -2,-0.1 -0.818 64.8 -63.2-151.4-167.8 34.9 39.4 41.5 67 67 A H T 3 S+ 0 0 158 1,-0.3 -2,-0.0 -2,-0.2 0, 0.0 0.770 121.6 64.9 -57.5 -29.6 31.8 37.8 42.9 68 68 A Q T 3 S+ 0 0 141 2,-0.0 -1,-0.3 26,-0.0 -3,-0.1 0.669 80.2 102.6 -71.0 -20.3 32.7 34.4 41.3 69 69 A N S < S- 0 0 19 -3,-1.7 2,-0.1 1,-0.1 -4,-0.0 -0.290 81.6-101.4 -67.1 150.9 35.8 34.0 43.4 70 70 A E - 0 0 134 1,-0.1 2,-0.2 24,-0.0 -1,-0.1 -0.386 35.3-116.1 -70.8 149.7 35.7 31.6 46.4 71 71 A Q - 0 0 80 -2,-0.1 2,-0.3 24,-0.0 24,-0.2 -0.538 31.3-142.9 -83.0 155.0 35.4 33.0 49.9 72 72 A V - 0 0 6 22,-2.5 24,-0.5 -2,-0.2 -69,-0.2 -0.843 21.4-149.1-126.0 156.9 38.2 32.5 52.4 73 73 A D S S+ 0 0 66 -71,-2.3 27,-3.0 -2,-0.3 2,-0.4 0.811 89.0 23.2 -85.2 -37.5 38.6 31.9 56.1 74 74 A L E -bd 3 100A 0 -72,-2.1 -70,-2.9 25,-0.2 2,-0.5 -0.996 57.0-163.9-137.8 135.1 41.9 33.8 56.4 75 75 A I E -bd 4 101A 0 25,-2.5 27,-2.9 -2,-0.4 2,-0.7 -0.990 12.9-154.4-112.7 125.5 43.7 36.5 54.4 76 76 A I E -bd 5 102A 0 -72,-2.8 -70,-2.3 -2,-0.5 2,-0.7 -0.921 15.7-148.4 -95.7 115.2 47.4 36.9 55.2 77 77 A A E +bd 6 103A 0 25,-2.5 27,-2.3 -2,-0.7 28,-0.2 -0.775 40.3 145.9 -94.2 115.9 48.2 40.6 54.4 78 78 A L + 0 0 43 -72,-3.1 -71,-0.2 -2,-0.7 -1,-0.2 0.423 34.6 121.4-119.3 -9.1 51.8 41.2 53.1 79 79 A T S S- 0 0 6 -73,-1.5 5,-0.1 1,-0.1 26,-0.1 -0.312 74.1-101.2 -57.9 132.7 50.9 44.0 50.7 80 80 A K >> - 0 0 111 1,-0.1 3,-1.8 3,-0.1 4,-1.0 -0.131 34.7-104.8 -59.4 155.8 52.8 47.2 51.6 81 81 A A H >> S+ 0 0 16 1,-0.3 3,-0.6 2,-0.2 4,-0.5 0.820 116.2 57.1 -57.5 -38.9 51.0 49.9 53.5 82 82 A Q H 34 S+ 0 0 72 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.666 116.1 35.9 -72.6 -14.7 50.5 52.3 50.6 83 83 A Q H <> S+ 0 0 62 -3,-1.8 4,-2.6 2,-0.1 -1,-0.2 0.417 92.2 95.7-107.9 -1.9 48.7 49.6 48.5 84 84 A L H S+ 0 0 66 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.877 112.4 50.9 -60.7 -41.6 43.4 49.2 47.3 87 87 A X H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.944 112.7 45.3 -60.5 -49.1 44.3 45.5 47.7 88 88 A F H X S+ 0 0 0 -4,-2.6 4,-0.7 1,-0.2 -2,-0.2 0.873 109.2 54.7 -68.3 -35.3 41.5 45.0 50.3 89 89 A K H < S+ 0 0 139 -4,-2.5 3,-0.5 -5,-0.2 -1,-0.2 0.901 110.8 48.0 -59.3 -40.6 38.9 46.9 48.3 90 90 A A H < S+ 0 0 26 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.890 113.0 45.2 -68.8 -41.0 39.7 44.5 45.3 91 91 A I H >< S+ 0 0 0 -4,-2.1 3,-2.4 1,-0.2 4,-0.3 0.443 79.2 109.9 -89.3 3.3 39.5 41.3 47.3 92 92 A Q G >< + 0 0 94 -4,-0.7 3,-2.0 -3,-0.5 -1,-0.2 0.803 67.8 65.0 -41.5 -46.0 36.3 42.3 49.2 93 93 A P G 3 S+ 0 0 46 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.768 99.8 54.2 -54.6 -22.9 34.2 39.7 47.3 94 94 A X G < S+ 0 0 3 -3,-2.4 -22,-2.5 -23,-0.1 2,-0.4 0.521 94.2 91.7 -85.5 -6.9 36.3 36.9 49.0 95 95 A I < + 0 0 25 -3,-2.0 2,-0.2 -4,-0.3 -22,-0.1 -0.764 48.4 176.4 -99.1 130.1 35.5 38.3 52.5 96 96 A T > - 0 0 48 -24,-0.5 3,-1.8 -2,-0.4 -2,-0.0 -0.706 50.8 -94.9-114.1 176.4 32.7 37.2 54.8 97 97 A E T 3 S+ 0 0 152 1,-0.3 -2,-0.0 -2,-0.2 25,-0.0 0.753 127.6 53.6 -61.5 -21.7 31.8 38.3 58.3 98 98 A K T 3 S+ 0 0 157 -26,-0.1 2,-0.3 20,-0.1 -1,-0.3 0.461 82.7 114.2 -92.0 -2.3 33.8 35.2 59.4 99 99 A T < - 0 0 0 -3,-1.8 2,-0.3 -25,-0.1 -25,-0.2 -0.523 51.3-156.2 -75.6 130.4 36.9 36.0 57.5 100 100 A Y E -d 74 0A 30 -27,-3.0 -25,-2.5 -2,-0.3 2,-0.4 -0.722 2.2-146.8-100.2 155.7 40.0 36.8 59.6 101 101 A V E -de 75 123A 0 21,-2.4 23,-3.4 -2,-0.3 2,-0.7 -0.990 3.5-159.5-121.8 130.6 43.1 38.8 58.6 102 102 A L E -de 76 124A 0 -27,-2.9 -25,-2.5 -2,-0.4 2,-0.7 -0.930 15.9-155.5-104.1 108.4 46.6 38.2 59.7 103 103 A C E +de 77 125A 6 21,-2.9 23,-2.2 -2,-0.7 -25,-0.1 -0.756 21.5 171.3 -87.7 113.0 48.5 41.4 59.2 104 104 A L + 0 0 13 -27,-2.3 24,-0.2 -2,-0.7 -1,-0.1 0.218 37.0 125.9-104.1 14.0 52.2 40.8 58.7 105 105 A L - 0 0 18 -28,-0.2 21,-0.1 1,-0.1 2,-0.1 -0.324 61.5-116.1 -68.1 151.1 53.1 44.4 57.7 106 106 A N S S+ 0 0 127 2,-0.1 -25,-0.1 -2,-0.0 -1,-0.1 -0.467 73.8 26.2 -73.5 156.7 55.7 46.5 59.5 107 107 A G S S- 0 0 17 -2,-0.1 2,-0.3 78,-0.1 3,-0.2 -0.192 86.4 -46.3 87.3-170.1 54.6 49.6 61.3 108 108 A L S S+ 0 0 5 169,-2.1 -2,-0.1 1,-0.2 174,-0.0 -0.704 91.2 12.9-114.4 148.8 51.5 50.9 63.0 109 109 A G > + 0 0 7 -2,-0.3 3,-2.1 1,-0.1 4,-0.5 0.517 58.3 140.6 84.2 10.2 47.8 51.3 62.6 110 110 A H T >> + 0 0 15 1,-0.3 4,-2.5 -3,-0.2 3,-0.8 0.739 63.7 74.8 -60.7 -21.3 47.0 49.0 59.7 111 111 A E H 3> S+ 0 0 31 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.740 84.4 65.7 -64.9 -23.0 43.8 47.9 61.5 112 112 A D H <4 S+ 0 0 30 -3,-2.1 -1,-0.3 2,-0.2 -2,-0.2 0.874 109.0 37.7 -67.7 -37.6 42.2 51.3 60.7 113 113 A V H X4 S+ 0 0 41 -3,-0.8 3,-1.7 -4,-0.5 4,-0.2 0.940 117.4 51.9 -70.5 -49.3 42.3 50.3 57.0 114 114 A L H >X S+ 0 0 1 -4,-2.5 3,-2.0 1,-0.3 4,-1.4 0.790 96.5 66.5 -60.7 -32.7 41.5 46.6 57.6 115 115 A E T 3< S+ 0 0 92 -4,-2.3 -1,-0.3 1,-0.3 5,-0.2 0.577 89.1 67.0 -70.5 -8.4 38.4 47.4 59.8 116 116 A K T <4 S+ 0 0 122 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.630 114.9 29.2 -75.6 -15.3 36.6 48.8 56.7 117 117 A Y T <4 S+ 0 0 32 -3,-2.0 -2,-0.2 1,-0.3 -1,-0.1 0.600 128.6 23.6-119.2 -18.5 36.6 45.3 55.3 118 118 A V S < S- 0 0 5 -4,-1.4 -1,-0.3 -20,-0.0 -21,-0.1 -0.986 88.9 -90.3-153.3 141.7 36.5 43.0 58.3 119 119 A P > - 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0 0 1 -5,-1.1 -1,-0.2 0, 0.0 2,-0.1 -0.964 63.7 -96.9-160.6 168.8 73.2 63.5 59.9 205 205 A N > - 0 0 16 -2,-0.3 4,-2.3 54,-0.1 54,-0.2 -0.356 46.0 -95.2 -87.8 177.6 74.1 59.9 60.8 206 206 A I H > S+ 0 0 7 52,-2.5 4,-2.7 49,-0.3 51,-0.2 0.900 122.7 44.7 -63.9 -44.1 72.9 58.1 64.0 207 207 A A H > S+ 0 0 22 49,-3.0 4,-1.8 51,-0.3 -1,-0.2 0.873 111.7 54.0 -70.8 -36.3 76.0 58.8 66.2 208 208 A E H 4 S+ 0 0 88 48,-0.4 4,-0.5 2,-0.2 -1,-0.2 0.899 111.7 45.2 -62.4 -42.4 76.0 62.4 65.1 209 209 A F H >< S+ 0 0 0 -4,-2.3 3,-2.0 1,-0.2 6,-0.2 0.965 110.5 53.7 -63.0 -52.4 72.4 62.8 66.1 210 210 A G H 3< S+ 0 0 13 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.801 104.0 57.5 -51.3 -33.9 73.0 61.0 69.4 211 211 A A T 3< S+ 0 0 76 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.621 82.1 105.9 -75.9 -14.8 75.9 63.4 70.2 212 212 A L S X S- 0 0 8 -3,-2.0 3,-1.7 -4,-0.5 4,-0.4 -0.441 74.3-133.0 -66.3 136.9 73.6 66.5 70.0 213 213 A P T 3 S+ 0 0 94 0, 0.0 4,-0.3 0, 0.0 3,-0.3 0.770 108.3 53.5 -59.6 -24.6 72.7 68.1 73.3 214 214 A V T 3> S+ 0 0 17 1,-0.2 4,-2.2 402,-0.2 5,-0.2 0.445 83.5 89.9 -84.9 -3.6 69.1 68.2 72.1 215 215 A S H <> S+ 0 0 7 -3,-1.7 4,-2.7 -6,-0.2 5,-0.3 0.916 83.5 52.7 -66.6 -40.8 68.9 64.5 71.2 216 216 A E H > S+ 0 0 96 -4,-0.4 4,-2.6 -3,-0.3 5,-0.2 0.921 112.5 42.7 -58.8 -49.9 67.7 63.4 74.7 217 217 A S H > S+ 0 0 46 -4,-0.3 4,-2.3 2,-0.2 5,-0.2 0.906 115.8 48.5 -66.6 -44.0 64.8 65.8 74.8 218 218 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.951 116.1 43.0 -59.0 -50.6 63.7 65.2 71.2 219 219 A V H X S+ 0 0 0 -4,-2.7 4,-3.0 -5,-0.2 5,-0.2 0.950 116.4 47.3 -63.3 -50.3 63.8 61.4 71.5 220 220 A K H X S+ 0 0 86 -4,-2.6 4,-2.2 -5,-0.3 -1,-0.2 0.869 110.6 51.5 -63.2 -36.8 62.1 61.4 74.9 221 221 A T H X S+ 0 0 48 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.945 113.0 46.3 -63.7 -45.3 59.4 63.7 73.8 222 222 A L H X S+ 0 0 1 -4,-2.2 4,-2.1 -5,-0.2 3,-0.3 0.929 110.6 51.7 -63.0 -45.7 58.7 61.5 70.8 223 223 A I H X S+ 0 0 2 -4,-3.0 4,-3.0 1,-0.2 -1,-0.2 0.919 107.5 54.5 -55.6 -43.6 58.7 58.3 72.9 224 224 A S H X S+ 0 0 56 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.836 107.4 49.5 -60.0 -36.5 56.2 59.8 75.3 225 225 A E H X S+ 0 0 12 -4,-1.5 4,-1.9 -3,-0.3 -1,-0.2 0.910 111.4 47.5 -69.6 -47.2 53.8 60.6 72.5 226 226 A F H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.952 114.6 48.9 -54.8 -49.2 54.0 57.0 71.1 227 227 A A H X S+ 0 0 9 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.849 108.1 53.0 -59.9 -38.6 53.5 55.8 74.7 228 228 A A H X S+ 0 0 40 -4,-2.0 4,-0.7 2,-0.2 -1,-0.2 0.873 114.8 41.2 -66.6 -38.7 50.5 58.0 75.3 229 229 A V H >X S+ 0 0 0 -4,-1.9 3,-0.7 2,-0.2 4,-0.6 0.916 113.7 52.2 -72.8 -45.6 48.7 56.8 72.2 230 230 A A H ><>S+ 0 0 0 -4,-2.8 5,-2.2 1,-0.2 3,-1.1 0.837 101.7 61.9 -58.3 -36.3 49.8 53.1 72.8 231 231 A E H ><5S+ 0 0 85 -4,-2.0 3,-1.7 1,-0.3 -1,-0.2 0.843 96.9 58.4 -60.2 -35.6 48.3 53.3 76.3 232 232 A K H <<5S+ 0 0 118 -4,-0.7 -1,-0.3 -3,-0.7 -2,-0.2 0.716 106.8 48.4 -66.8 -20.8 44.9 54.0 74.8 233 233 A E T <<5S- 0 0 29 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.091 125.1-105.2-105.3 20.4 45.3 50.7 73.0 234 234 A A T < 5S+ 0 0 54 -3,-1.7 2,-0.5 1,-0.2 -3,-0.2 0.815 81.4 128.3 60.4 35.7 46.3 48.9 76.2 235 235 A I < - 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0 0 13 -16,-0.2 2,-0.3 -2,-0.1 -16,-0.1 -0.978 23.4-136.8 173.1-169.8 64.3 109.2 63.5 462 147 B E - 0 0 76 -2,-0.3 -18,-3.4 2,-0.0 -17,-0.6 -0.951 10.7-134.6-160.4 165.6 61.9 108.7 66.3 463 148 B I E -Pq 443 490C 0 26,-1.2 28,-1.8 -2,-0.3 2,-0.4 -0.993 12.8-163.6-131.5 127.2 61.4 106.5 69.4 464 149 B E E +Pq 442 491C 51 -22,-2.3 -22,-2.6 -2,-0.4 2,-0.3 -0.902 18.9 178.3-103.2 138.0 58.0 104.9 70.2 465 150 B L E -Pq 441 492C 0 26,-1.9 28,-2.7 -2,-0.4 2,-0.3 -0.960 14.8-175.1-141.9 161.0 57.7 103.6 73.8 466 151 B E E -P 440 0C 18 -26,-2.3 -26,-3.2 -2,-0.3 2,-0.3 -0.978 27.7-120.0-154.3 135.9 55.1 101.9 76.0 467 152 B N E -P 439 0C 11 -2,-0.3 -28,-0.2 -28,-0.3 30,-0.1 -0.628 16.3-151.6 -71.1 139.5 55.0 100.9 79.7 468 153 B I S S+ 0 0 32 -30,-2.5 -1,-0.1 -2,-0.3 -29,-0.1 0.853 82.4 51.7 -79.6 -37.2 54.4 97.2 80.1 469 154 B D S > S- 0 0 39 -31,-0.6 3,-2.3 -33,-0.3 4,-0.2 -0.824 86.5-126.6-103.3 138.5 52.6 97.5 83.5 470 155 B P G > S+ 0 0 111 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.782 108.7 61.9 -59.1 -25.4 49.7 99.9 83.9 471 156 B S G 3 S+ 0 0 89 1,-0.2 3,-0.4 2,-0.1 4,-0.3 0.638 92.9 65.9 -69.0 -19.7 51.4 101.6 86.9 472 157 B G G <> S+ 0 0 0 -3,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.405 73.8 95.9 -82.0 2.9 54.3 102.7 84.7 473 158 B K H <> S+ 0 0 84 -3,-1.1 4,-2.1 1,-0.2 -1,-0.2 0.899 79.6 49.7 -64.6 -46.7 52.2 105.1 82.6 474 159 B K H > S+ 0 0 157 -3,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.928 114.9 44.5 -60.7 -46.6 53.0 108.3 84.4 475 160 B F H > S+ 0 0 24 -4,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.879 108.1 57.4 -67.3 -37.1 56.7 107.7 84.3 476 161 B A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.918 107.6 49.5 -54.0 -44.3 56.6 106.6 80.6 477 162 B L H X S+ 0 0 74 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.873 108.8 52.4 -63.2 -37.8 55.0 110.0 79.9 478 163 B E H X S+ 0 0 77 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.857 107.9 50.8 -65.1 -39.7 57.8 111.7 81.8 479 164 B V H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.912 107.8 53.3 -62.9 -45.3 60.4 109.8 79.7 480 165 B V H X S+ 0 0 20 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.932 109.2 49.5 -52.3 -50.4 58.6 111.0 76.5 481 166 B D H X S+ 0 0 88 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.925 112.4 47.2 -54.4 -50.4 58.9 114.6 77.8 482 167 B V H X S+ 0 0 26 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.937 113.8 46.9 -56.9 -49.1 62.6 114.2 78.6 483 168 B F H <>S+ 0 0 0 -4,-2.9 5,-2.5 1,-0.2 6,-0.4 0.790 107.9 58.5 -63.2 -31.8 63.3 112.6 75.2 484 169 B Q H ><5S+ 0 0 104 -4,-2.2 3,-1.5 -5,-0.2 5,-0.3 0.937 105.7 46.9 -64.9 -46.8 61.3 115.4 73.5 485 170 B K H 3<5S+ 0 0 170 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.794 108.4 57.2 -66.4 -27.0 63.5 118.1 74.9 486 171 B A T 3<5S- 0 0 11 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.411 116.3-114.2 -83.7 -0.5 66.6 116.1 73.8 487 172 B G T < 5S+ 0 0 33 -3,-1.5 -3,-0.2 -4,-0.2 -2,-0.1 0.636 76.3 132.0 79.4 17.6 65.3 116.0 70.2 488 173 B L < - 0 0 0 -5,-2.5 -4,-0.2 -6,-0.1 -25,-0.1 0.502 65.8-129.9 -82.7 -0.4 64.8 112.3 70.1 489 174 B N - 0 0 77 -6,-0.4 -26,-1.2 -5,-0.3 -5,-0.1 0.913 40.4-177.5 51.1 54.2 61.3 112.6 68.5 490 175 B P E -q 463 0C 12 0, 0.0 2,-0.3 0, 0.0 -26,-0.2 -0.348 13.7-177.1 -77.7 157.0 59.5 110.3 71.1 491 176 B S E -q 464 0C 38 -28,-1.8 -26,-1.9 -2,-0.1 2,-0.4 -0.976 28.6-121.4-146.2 149.3 55.9 109.3 71.1 492 177 B Y E -q 465 0C 69 -2,-0.3 2,-0.4 -28,-0.2 -26,-0.2 -0.741 37.1-174.6 -80.9 132.7 53.9 107.2 73.5 493 178 B S > - 0 0 20 -28,-2.7 3,-0.9 -2,-0.4 4,-0.3 -0.972 30.6-162.5-136.6 126.0 52.4 104.3 71.6 494 179 B S T 3 S+ 0 0 95 -2,-0.4 4,-0.2 1,-0.2 -28,-0.1 0.205 92.1 64.0 -83.1 15.3 50.0 101.6 72.8 495 180 B N T 3> S+ 0 0 86 -30,-0.1 4,-2.9 2,-0.1 -1,-0.2 0.413 72.4 93.9-113.3 0.5 51.0 99.4 69.8 496 181 B V H <> S+ 0 0 0 -3,-0.9 4,-2.2 2,-0.2 5,-0.2 0.939 89.2 42.1 -60.1 -52.9 54.6 98.9 70.7 497 182 B R H > S+ 0 0 38 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.920 116.2 51.2 -61.2 -43.6 54.1 95.5 72.6 498 183 B Y H > S+ 0 0 47 1,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.916 109.5 48.9 -58.8 -47.3 51.7 94.4 69.8 499 184 B S H X S+ 0 0 34 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.886 110.6 51.1 -65.0 -37.9 54.1 95.2 67.0 500 185 B I H X S+ 0 0 29 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.902 113.2 45.0 -62.3 -43.8 57.0 93.4 68.8 501 186 B W H X S+ 0 0 4 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.905 113.7 49.9 -65.3 -45.2 54.8 90.3 69.2 502 187 B R H X S+ 0 0 62 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.890 112.5 47.4 -60.4 -41.6 53.5 90.5 65.6 503 188 B K H X S+ 0 0 96 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.897 111.6 49.4 -66.7 -42.4 57.1 90.8 64.3 504 189 B A H X S+ 0 0 5 -4,-2.2 4,-0.6 2,-0.2 -2,-0.2 0.875 108.3 55.5 -65.4 -37.7 58.3 87.9 66.5 505 190 B C H >< S+ 0 0 0 -4,-2.3 3,-0.9 2,-0.2 -2,-0.2 0.946 110.0 44.4 -57.8 -50.9 55.4 85.8 65.2 506 191 B V H >X S+ 0 0 21 -4,-2.1 3,-1.3 1,-0.3 4,-0.8 0.938 117.0 46.2 -57.8 -47.6 56.5 86.5 61.6 507 192 B N H 3< S+ 0 0 49 -4,-2.7 5,-0.3 1,-0.3 -1,-0.3 0.512 103.2 65.8 -73.4 -6.7 60.1 85.7 62.5 508 193 B G T << S+ 0 0 0 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.331 107.3 39.9 -97.4 5.4 59.0 82.6 64.4 509 194 B T T <> S+ 0 0 0 -3,-1.3 4,-2.2 -4,-0.1 5,-0.2 0.669 117.5 28.1-113.4 -81.6 57.8 80.9 61.2 510 195 B L H X S+ 0 0 10 -4,-0.8 4,-3.1 1,-0.2 5,-0.5 0.825 114.2 62.8 -60.0 -38.3 59.9 81.2 58.0 511 196 B N H > S+ 0 0 7 -5,-0.4 4,-1.6 2,-0.2 -1,-0.2 0.954 114.0 28.7 -50.5 -63.4 63.2 81.7 59.8 512 197 B G H > S+ 0 0 0 -5,-0.3 4,-2.6 -3,-0.2 5,-0.2 0.908 122.8 52.7 -71.0 -38.3 63.4 78.3 61.6 513 198 B L H X S+ 0 0 1 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.922 112.3 41.6 -65.0 -48.2 61.4 76.5 58.9 514 199 B C H X>S+ 0 0 0 -4,-3.1 4,-1.5 -5,-0.2 5,-1.3 0.863 115.8 53.1 -67.6 -35.9 63.4 77.6 55.9 515 200 B T H <5S+ 0 0 1 -4,-1.6 -2,-0.2 -5,-0.5 -1,-0.2 0.917 114.8 39.4 -61.1 -47.5 66.6 77.0 57.9 516 201 B I H <5S+ 0 0 5 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.923 123.3 38.6 -72.6 -45.9 65.6 73.4 58.9 517 202 B L H <5S- 0 0 0 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.678 105.0-129.3 -76.7 -17.1 64.1 72.4 55.5 518 203 B D T <5 + 0 0 82 -4,-1.5 2,-0.3 -5,-0.2 -3,-0.2 0.999 62.5 113.8 59.2 77.0 66.9 74.3 53.5 519 204 B C < - 0 0 1 -5,-1.3 -1,-0.2 4,-0.0 2,-0.1 -0.976 63.1-100.7-160.7 166.3 64.7 76.3 51.1 520 205 B N > - 0 0 16 -2,-0.3 4,-2.6 54,-0.1 54,-0.2 -0.334 44.7 -94.4 -89.3 179.6 63.7 79.9 50.2 521 206 B I H > S+ 0 0 6 52,-2.3 4,-3.0 49,-0.3 51,-0.2 0.909 122.2 42.3 -64.9 -50.5 60.5 81.7 51.2 522 207 B A H > S+ 0 0 23 49,-3.1 4,-1.9 51,-0.2 -1,-0.2 0.857 113.2 54.4 -62.7 -39.5 58.4 81.0 48.0 523 208 B E H > S+ 0 0 90 48,-0.4 4,-0.5 2,-0.2 -2,-0.2 0.945 112.8 44.0 -61.1 -47.3 59.6 77.3 47.9 524 209 B F H >< S+ 0 0 0 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.950 110.0 55.7 -58.3 -51.2 58.4 77.0 51.5 525 210 B G H 3< S+ 0 0 10 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.840 102.5 55.9 -52.0 -39.0 55.1 78.7 50.9 526 211 B A H 3< S+ 0 0 87 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.642 81.7 110.4 -71.7 -17.0 54.2 76.4 48.0 527 212 B L S X< S- 0 0 7 -3,-1.7 3,-1.5 -4,-0.5 4,-0.4 -0.261 75.9-128.0 -62.1 144.4 54.5 73.2 50.2 528 213 B P T 3 S+ 0 0 102 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.625 110.6 50.6 -69.8 -9.5 51.2 71.5 51.0 529 214 B V T 3> S+ 0 0 15 -5,-0.2 4,-2.5 -228,-0.1 5,-0.2 0.330 82.5 93.6-103.3 2.8 52.2 71.7 54.7 530 215 B S H <> S+ 0 0 8 -3,-1.5 4,-2.5 1,-0.2 5,-0.3 0.943 84.6 49.8 -64.8 -46.5 53.1 75.4 54.8 531 216 B E H > S+ 0 0 95 -4,-0.4 4,-2.5 1,-0.2 5,-0.2 0.912 114.3 44.5 -56.7 -43.5 49.6 76.5 55.9 532 217 B S H > S+ 0 0 45 -4,-0.2 4,-2.1 2,-0.2 5,-0.3 0.935 115.1 46.7 -69.7 -46.8 49.5 73.9 58.8 533 218 B L H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.947 116.8 43.9 -57.7 -52.1 53.0 74.6 60.0 534 219 B V H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.933 114.9 46.9 -64.2 -49.1 52.6 78.4 59.9 535 220 B K H X S+ 0 0 85 -4,-2.5 4,-2.5 -5,-0.3 -1,-0.2 0.859 110.9 51.5 -63.6 -37.9 49.1 78.5 61.5 536 221 B T H X S+ 0 0 48 -4,-2.1 4,-1.6 -5,-0.2 -1,-0.2 0.950 112.6 46.3 -62.7 -48.7 50.0 76.1 64.3 537 222 B L H X S+ 0 0 1 -4,-2.0 4,-2.2 -5,-0.3 -2,-0.2 0.906 112.0 51.1 -59.2 -43.8 53.1 78.3 65.1 538 223 B I H X S+ 0 0 1 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.900 106.9 54.6 -58.7 -44.0 51.0 81.5 64.9 539 224 B S H X S+ 0 0 53 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.842 107.1 50.5 -58.1 -38.0 48.4 79.9 67.3 540 225 B E H X S+ 0 0 13 -4,-1.6 4,-1.8 2,-0.2 5,-0.2 0.921 110.8 47.9 -67.7 -47.5 51.2 79.3 69.9 541 226 B F H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.944 115.8 45.8 -52.7 -51.6 52.5 82.9 69.7 542 227 B A H X S+ 0 0 8 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.868 108.1 55.6 -62.1 -41.5 48.9 84.1 70.1 543 228 B A H X S+ 0 0 39 -4,-2.4 4,-0.7 -5,-0.2 -1,-0.2 0.896 115.0 38.9 -58.9 -42.8 48.0 81.7 73.0 544 229 B V H >X S+ 0 0 0 -4,-1.8 3,-0.7 2,-0.2 4,-0.7 0.892 113.3 54.0 -75.6 -44.1 51.0 83.0 75.0 545 230 B A H ><>S+ 0 0 0 -4,-2.7 5,-1.8 1,-0.2 3,-1.7 0.906 101.5 62.0 -55.5 -42.6 50.6 86.7 74.0 546 231 B E H ><5S+ 0 0 88 -4,-2.4 3,-1.8 1,-0.3 -1,-0.2 0.844 96.1 58.5 -51.1 -39.3 47.0 86.5 75.2 547 232 B K H <<5S+ 0 0 117 -3,-0.7 -1,-0.3 -4,-0.7 -2,-0.2 0.711 107.4 47.5 -63.8 -23.7 48.2 85.7 78.7 548 233 B E T <<5S- 0 0 25 -3,-1.7 -1,-0.3 -4,-0.7 -2,-0.2 0.098 125.8-103.7-103.8 14.7 50.1 89.1 78.6 549 234 B A T < 5S+ 0 0 52 -3,-1.8 2,-0.4 1,-0.2 -3,-0.2 0.853 81.0 129.8 69.1 37.0 47.0 90.8 77.3 550 235 B I < - 0 0 15 -5,-1.8 2,-0.8 -8,-0.2 -1,-0.2 -0.996 43.6-157.8-122.1 126.5 48.2 91.1 73.7 551 236 B Y - 0 0 151 -2,-0.4 2,-0.1 -3,-0.1 -9,-0.1 -0.827 9.7-154.1-115.7 91.2 45.6 89.9 71.2 552 237 B L - 0 0 17 -2,-0.8 2,-1.2 -10,-0.2 3,-0.1 -0.405 17.1-129.2 -71.1 136.2 47.2 88.9 67.9 553 238 B D > - 0 0 82 1,-0.2 4,-2.4 -2,-0.1 5,-0.2 -0.741 27.0-172.1 -82.1 98.1 45.2 89.1 64.7 554 239 B Q H > S+ 0 0 85 -2,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.818 81.1 50.4 -69.4 -32.7 46.1 85.5 63.6 555 240 B A H > S+ 0 0 66 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.906 110.7 48.6 -69.8 -43.8 44.4 86.0 60.2 556 241 B E H > S+ 0 0 66 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.894 111.5 50.6 -62.9 -41.2 46.2 89.3 59.5 557 242 B V H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.931 111.4 47.6 -63.8 -45.2 49.5 87.7 60.5 558 243 B Y H X S+ 0 0 41 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.904 110.5 52.9 -58.7 -42.8 48.9 84.7 58.2 559 244 B T H X S+ 0 0 73 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.901 108.4 50.0 -61.3 -42.6 48.0 87.1 55.4 560 245 B H H X S+ 0 0 56 -4,-2.3 4,-1.0 2,-0.2 -1,-0.2 0.921 110.9 49.3 -59.9 -46.1 51.2 89.0 55.8 561 246 B I H >X S+ 0 0 0 -4,-2.1 3,-0.9 1,-0.2 4,-0.7 0.935 108.7 52.3 -62.7 -43.9 53.2 85.7 55.7 562 247 B V H >< S+ 0 0 55 -4,-2.8 3,-1.7 1,-0.2 4,-0.4 0.923 103.9 58.1 -57.7 -41.9 51.5 84.6 52.5 563 248 B Q H >< S+ 0 0 130 -4,-2.0 3,-0.8 1,-0.3 7,-0.3 0.748 97.0 62.2 -60.7 -25.4 52.4 88.0 50.9 564 249 B T H << S+ 0 0 15 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.729 90.3 69.3 -71.0 -21.5 56.1 87.2 51.5 565 250 B Y T << S+ 0 0 31 -3,-1.7 -1,-0.2 -4,-0.7 -2,-0.2 0.711 71.7 111.8 -68.0 -23.8 55.8 84.2 49.2 566 251 B D X > - 0 0 73 -3,-0.8 5,-2.5 -4,-0.4 3,-1.1 -0.342 62.8-150.3 -55.4 118.3 55.3 86.4 46.2 567 252 B P T 3 5S+ 0 0 77 0, 0.0 5,-0.4 0, 0.0 -1,-0.2 0.777 98.4 62.7 -65.2 -20.3 58.4 86.1 44.0 568 253 B N T 3 5S+ 0 0 151 3,-0.1 -2,-0.1 2,-0.1 -3,-0.0 0.775 116.2 30.9 -66.4 -29.8 57.8 89.7 42.9 569 254 B G T < 5S- 0 0 42 -3,-1.1 3,-0.2 -6,-0.2 -5,-0.1 0.574 136.8 -43.5 -92.0-113.0 58.4 90.7 46.5 570 255 B I T > 5S+ 0 0 78 -7,-0.3 3,-2.4 -6,-0.1 -49,-0.3 0.348 97.1 113.0-107.4 6.6 60.7 88.7 48.8 571 256 B G T 3 > - 0 0 13 0, 0.0 4,-1.7 0, 0.0 3,-0.6 -0.227 32.4-101.9 -72.6 165.2 65.1 84.6 55.7 576 261 B S H 3> S+ 0 0 71 1,-0.3 4,-2.4 2,-0.2 5,-0.1 0.785 119.9 55.7 -60.2 -33.9 67.8 86.1 58.0 577 262 B X H 3> S+ 0 0 2 2,-0.2 4,-2.8 1,-0.2 5,-0.4 0.888 105.9 52.8 -66.4 -38.6 68.1 83.0 60.2 578 263 B Y H <>>S+ 0 0 22 -3,-0.6 5,-1.7 2,-0.2 4,-1.6 0.929 110.1 47.9 -58.2 -47.3 68.9 80.9 57.1 579 264 B Q H <>S+ 0 0 66 -4,-1.7 5,-1.7 3,-0.2 -2,-0.2 0.900 113.4 49.8 -60.5 -43.8 71.7 83.5 56.2 580 265 B D H <5S+ 0 0 28 -4,-2.4 6,-2.6 3,-0.2 -2,-0.2 0.968 127.8 17.5 -55.1 -60.2 73.0 83.3 59.8 581 266 B L H X5S+ 0 0 0 -4,-2.8 4,-1.4 4,-0.2 -3,-0.2 0.948 131.1 37.3 -87.3 -53.8 73.1 79.5 60.1 582 267 B I T <5S+ 0 0 31 -4,-1.6 -3,-0.2 -5,-0.4 -4,-0.1 0.917 128.6 30.3 -74.1 -43.4 73.0 77.9 56.7 583 268 B K T 4 S+ 0 0 83 1,-0.2 3,-2.2 -2,-0.1 4,-0.1 0.172 73.7 121.8 -87.5 14.7 68.5 84.2 67.3 590 275 B I G > > + 0 0 0 1,-0.3 5,-2.9 2,-0.2 3,-1.8 0.799 62.7 62.9 -57.0 -33.2 66.0 81.3 68.0 591 276 B D G 3 5S+ 0 0 68 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.742 106.1 46.7 -62.3 -21.8 66.2 81.6 71.8 592 277 B Y G < 5S+ 0 0 52 -3,-2.2 -169,-1.7 3,-0.2 -1,-0.3 0.169 123.1 31.8-107.4 11.9 64.7 85.1 71.6 593 278 B I T <>5S+ 0 0 15 -3,-1.8 4,-1.7 -4,-0.1 3,-0.4 0.305 137.8 5.7-127.0 -94.8 61.9 84.2 69.1 594 279 B N H >5S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -3,-0.2 0.872 131.1 56.7 -63.0 -38.4 60.5 80.6 69.4 595 280 B G H > S+ 0 0 0 -6,-0.5 4,-2.6 -3,-0.4 -2,-0.2 0.904 108.8 48.0 -73.4 -42.2 61.0 83.0 74.2 597 282 B V H X S+ 0 0 0 -4,-1.7 4,-3.0 2,-0.2 -2,-0.2 0.906 113.3 50.1 -59.9 -43.8 57.4 81.8 73.5 598 283 B W H X S+ 0 0 75 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.947 110.3 48.5 -62.8 -49.8 58.4 78.4 74.8 599 284 B R H X S+ 0 0 102 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.947 115.6 44.5 -55.4 -49.3 59.9 79.8 78.0 600 285 B K H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.921 110.1 55.0 -63.0 -45.7 56.8 82.0 78.6 601 286 B G H X>S+ 0 0 0 -4,-3.0 5,-2.9 1,-0.2 4,-0.7 0.865 105.0 54.1 -53.7 -40.4 54.4 79.1 77.8 602 287 B Q H <5S+ 0 0 126 -4,-2.1 3,-0.4 1,-0.2 -1,-0.2 0.898 111.8 43.7 -63.1 -40.1 56.1 76.9 80.4 603 288 B K H <5S+ 0 0 99 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.795 118.1 44.5 -80.1 -21.5 55.5 79.5 83.1 604 289 B Y H <5S- 0 0 59 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.399 111.0-115.7 -97.8 0.2 51.9 80.2 82.0 605 290 B N T <5 + 0 0 159 -4,-0.7 2,-0.5 -3,-0.4 -3,-0.2 0.902 68.8 140.8 63.8 39.9 50.9 76.6 81.6 606 291 B V < - 0 0 19 -5,-2.9 -1,-0.2 -6,-0.1 2,-0.2 -0.976 53.5-124.7-115.8 125.6 50.4 77.0 77.8 607 292 B A + 0 0 78 -2,-0.5 -64,-0.1 -3,-0.1 3,-0.1 -0.498 33.8 168.1 -68.4 129.5 51.5 74.3 75.4 608 293 B T > + 0 0 3 -2,-0.2 4,-2.2 -10,-0.1 5,-0.1 -0.390 14.6 150.4-134.9 57.4 53.9 75.5 72.8 609 294 B P H > S+ 0 0 28 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.852 70.1 52.0 -67.6 -36.5 55.2 72.2 71.3 610 295 B F H > S+ 0 0 8 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.936 112.6 47.8 -64.0 -41.9 55.9 73.4 67.7 611 296 B C H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.916 113.7 48.6 -58.9 -43.3 58.0 76.3 69.1 612 297 B A H X S+ 0 0 6 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.932 114.5 43.1 -64.8 -48.0 59.8 73.8 71.4 613 298 B X H X S+ 0 0 1 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.914 114.3 50.0 -66.0 -42.3 60.6 71.3 68.7 614 299 B L H X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.3 5,-0.2 0.925 110.6 50.7 -63.2 -43.3 61.6 74.0 66.2 615 300 B T H X S+ 0 0 2 -4,-2.3 4,-2.6 -5,-0.3 -2,-0.2 0.941 112.8 45.9 -56.7 -49.6 63.9 75.6 68.8 616 301 B Q H X S+ 0 0 9 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.882 112.3 50.7 -62.8 -40.0 65.5 72.2 69.5 617 302 B L H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 -1,-0.2 0.930 111.0 48.4 -64.7 -45.4 65.9 71.3 65.8 618 303 B V H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.941 113.0 47.4 -60.0 -49.1 67.6 74.7 65.1 619 304 B H H X S+ 0 0 45 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.867 111.0 53.6 -57.9 -38.4 70.0 74.2 68.1 620 305 B G H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.952 110.0 46.0 -58.1 -51.9 70.6 70.6 66.7 621 306 B K H X S+ 0 0 30 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.871 108.1 56.7 -59.4 -41.5 71.5 72.0 63.3 622 307 B E H X>S+ 0 0 13 -4,-2.6 5,-2.6 2,-0.2 4,-0.6 0.951 110.1 45.5 -53.1 -51.6 73.8 74.7 64.9 623 308 B E H ><5S+ 0 0 110 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.917 112.1 50.9 -58.6 -47.3 75.7 71.9 66.7 624 309 B L H 3<5S+ 0 0 49 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.836 115.4 42.0 -59.9 -35.3 75.9 69.8 63.5 625 310 B L H 3<5S- 0 0 51 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.473 109.3-122.5 -90.2 -3.1 77.3 72.7 61.4 626 311 B G T <<5 - 0 0 49 -3,-0.9 -3,-0.2 -4,-0.6 -4,-0.1 0.854 41.4-170.5 57.5 40.5 79.6 73.9 64.2 627 312 B A < 0 0 15 -5,-2.6 -41,-0.3 -6,-0.2 -1,-0.1 -0.257 360.0 360.0 -60.3 146.7 78.0 77.3 64.3 628 313 B K 0 0 200 -43,-1.7 -41,-2.2 -41,-0.1 -1,-0.1 -0.816 360.0 360.0-126.0 360.0 79.8 80.0 66.4