==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 16-JAN-12 4DBS . COMPND 2 MOLECULE: ALDO-KETO REDUCTASE FAMILY 1 MEMBER C3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.CHEN,D.W.CHRISTIANSON,J.D.WINKLER,T.M.PENNING . 633 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27748.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 426 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 74 11.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 3.2 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 39 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 177 28.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.5 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 0 0 0 2 4 2 2 2 0 4 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 4 4 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 PARALLEL BRIDGES PER LADDER . 6 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 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 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 6 A Q 0 0 151 0, 0.0 12,-2.0 0, 0.0 13,-0.4 0.000 360.0 360.0 360.0 83.4 -4.3 9.4 25.2 2 7 A C E -A 12 0A 75 10,-0.3 2,-0.4 11,-0.1 8,-0.0 -0.878 360.0-138.5-127.7 158.5 -3.8 13.1 24.5 3 8 A V E -A 11 0A 50 8,-2.4 8,-2.6 -2,-0.3 2,-0.6 -0.944 26.0-121.3-113.9 141.8 -3.7 16.3 26.4 4 9 A K E -A 10 0A 133 -2,-0.4 6,-0.2 6,-0.2 5,-0.1 -0.733 27.7-140.6 -85.6 118.9 -5.4 19.5 25.2 5 10 A L > - 0 0 5 4,-3.0 3,-2.1 -2,-0.6 201,-0.1 -0.271 26.4-103.7 -74.1 164.0 -2.9 22.4 24.7 6 11 A N T 3 S+ 0 0 41 199,-0.4 174,-0.1 1,-0.3 -1,-0.1 0.451 121.2 55.7 -71.5 0.7 -3.8 26.0 25.6 7 12 A D T 3 S- 0 0 39 2,-0.2 -1,-0.3 172,-0.1 3,-0.1 0.260 122.4-102.9-111.8 7.1 -4.3 26.8 21.9 8 13 A G S < S+ 0 0 33 -3,-2.1 -2,-0.1 1,-0.3 0, 0.0 0.062 83.9 117.4 100.7 -24.8 -6.8 24.0 21.4 9 14 A H - 0 0 68 147,-0.1 -4,-3.0 -5,-0.1 2,-0.4 -0.190 60.3-119.9 -72.3 169.2 -4.7 21.4 19.6 10 15 A F E -A 4 0A 118 -6,-0.2 -6,-0.2 -3,-0.1 -1,-0.1 -0.936 17.6-161.6-120.8 137.3 -4.0 18.0 21.1 11 16 A M E -A 3 0A 0 -8,-2.6 -8,-2.4 -2,-0.4 2,-0.1 -0.959 24.7-122.1-118.4 124.7 -0.6 16.4 22.0 12 17 A P E -A 2 0A 18 0, 0.0 -10,-0.3 0, 0.0 29,-0.0 -0.436 21.2-135.6 -60.6 132.5 -0.1 12.6 22.5 13 18 A V S S+ 0 0 27 -12,-2.0 249,-2.3 -2,-0.1 2,-0.5 0.633 90.0 60.7 -71.9 -14.9 1.2 12.2 26.0 14 19 A L E S-b 262 0B 11 -13,-0.4 29,-0.7 247,-0.2 28,-0.5 -0.970 71.4-175.3-114.1 124.0 3.8 9.6 24.8 15 20 A G E -bc 263 43B 0 247,-2.5 249,-1.7 -2,-0.5 2,-0.5 -0.885 23.6-124.6-121.9 150.6 6.4 10.9 22.3 16 21 A F E -bc 264 44B 1 27,-2.9 29,-2.7 -2,-0.3 2,-0.4 -0.819 21.9-141.0 -97.1 123.0 9.2 9.2 20.4 17 22 A G E -bc 265 45B 7 247,-1.9 249,-0.6 -2,-0.5 29,-0.1 -0.675 17.7-176.7 -84.7 134.0 12.7 10.6 20.7 18 23 A T + 0 0 1 27,-1.4 2,-0.2 -2,-0.4 -1,-0.1 0.556 37.7 117.8-112.1 -9.7 14.7 10.7 17.5 19 24 A Y + 0 0 54 26,-0.2 32,-0.1 27,-0.0 -2,-0.1 -0.401 32.4 169.7 -62.8 129.8 18.1 12.1 18.4 20 25 A A - 0 0 1 30,-0.3 9,-0.0 -2,-0.2 -2,-0.0 -0.990 39.2 -99.0-135.3 144.9 21.0 9.7 17.8 21 26 A P > - 0 0 12 0, 0.0 3,-2.1 0, 0.0 29,-0.0 -0.124 40.6-102.1 -57.4 159.9 24.7 10.6 18.0 22 27 A P T 3 S+ 0 0 84 0, 0.0 4,-0.1 0, 0.0 28,-0.0 0.726 117.3 69.0 -58.4 -27.3 26.6 11.2 14.7 23 28 A E T 3 S+ 0 0 151 2,-0.1 3,-0.0 3,-0.0 0, 0.0 0.639 81.7 88.3 -72.0 -12.4 28.2 7.8 14.7 24 29 A V S < S- 0 0 36 -3,-2.1 5,-0.1 1,-0.1 -4,-0.1 -0.783 91.8-113.5 -86.0 120.6 24.7 6.3 14.1 25 30 A P >> - 0 0 63 0, 0.0 3,-1.5 0, 0.0 4,-0.5 -0.207 18.9-124.8 -51.8 139.8 24.0 6.0 10.3 26 31 A R H 3> S+ 0 0 37 1,-0.3 4,-1.0 2,-0.2 3,-0.4 0.697 105.8 71.8 -61.7 -22.4 21.2 8.3 9.2 27 32 A S H 3> S+ 0 0 15 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.816 87.8 64.6 -64.2 -29.1 19.4 5.4 7.7 28 33 A K H <> S+ 0 0 61 -3,-1.5 4,-3.5 1,-0.2 5,-0.4 0.898 94.2 57.2 -61.1 -43.2 18.6 4.2 11.2 29 34 A A H X S+ 0 0 1 -4,-0.5 4,-2.0 -3,-0.4 5,-0.2 0.917 108.6 48.2 -55.7 -42.6 16.4 7.2 12.0 30 35 A L H X S+ 0 0 18 -4,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.952 115.2 44.7 -60.0 -49.4 14.3 6.3 8.9 31 36 A E H X S+ 0 0 97 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.916 116.2 43.8 -64.1 -48.4 14.1 2.6 10.0 32 37 A V H X S+ 0 0 0 -4,-3.5 4,-2.3 2,-0.2 -1,-0.2 0.799 108.5 57.1 -73.7 -29.3 13.3 3.2 13.7 33 38 A T H X S+ 0 0 0 -4,-2.0 4,-2.5 -5,-0.4 5,-0.2 0.929 107.2 50.0 -66.4 -42.0 10.8 6.0 13.1 34 39 A K H X S+ 0 0 59 -4,-1.8 4,-2.7 -5,-0.2 -2,-0.2 0.940 111.2 49.5 -56.3 -44.9 8.8 3.5 10.9 35 40 A L H X S+ 0 0 25 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.882 109.0 52.1 -63.5 -37.9 9.1 1.0 13.8 36 41 A A H X>S+ 0 0 0 -4,-2.3 5,-2.6 2,-0.2 4,-1.2 0.949 111.4 45.5 -65.0 -48.5 7.9 3.5 16.3 37 42 A I H ><5S+ 0 0 2 -4,-2.5 3,-0.6 3,-0.2 -2,-0.2 0.923 113.2 51.5 -58.5 -42.9 4.8 4.4 14.2 38 43 A E H 3<5S+ 0 0 99 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.901 109.0 50.9 -60.9 -40.4 4.2 0.7 13.7 39 44 A A H 3<5S- 0 0 19 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.673 131.4 -91.3 -72.7 -19.0 4.4 0.1 17.5 40 45 A G T <<5S+ 0 0 40 -4,-1.2 -3,-0.2 -3,-0.6 2,-0.2 0.396 75.6 142.4 125.4 -1.9 1.9 2.9 18.1 41 46 A F < + 0 0 3 -5,-2.6 -1,-0.3 -6,-0.2 -26,-0.1 -0.489 11.5 164.5 -66.7 138.3 3.9 6.1 18.6 42 47 A R + 0 0 80 -28,-0.5 33,-3.1 -2,-0.2 2,-0.6 0.558 58.3 74.5-124.5 -28.7 2.1 9.1 17.0 43 48 A H E -cd 15 75B 1 -29,-0.7 -27,-2.9 31,-0.2 2,-0.4 -0.806 65.3-173.8 -88.8 120.2 4.0 12.0 18.7 44 49 A I E -cd 16 76B 0 31,-3.3 33,-2.7 -2,-0.6 2,-0.6 -0.984 10.0-154.0-125.2 125.8 7.5 12.2 17.1 45 50 A D E +cd 17 77B 4 -29,-2.7 -27,-1.4 -2,-0.4 -26,-0.2 -0.874 28.9 144.1-109.9 116.1 10.2 14.6 18.4 46 51 A S - 0 0 0 31,-2.3 2,-0.3 -2,-0.6 3,-0.1 -0.601 21.7-165.3-133.6-168.3 12.9 16.0 16.1 47 52 A A > > - 0 0 0 31,-0.2 3,-0.8 -2,-0.2 5,-0.6 -0.957 39.8-106.7-176.3 156.1 14.8 19.1 15.5 48 53 A H G > 5S+ 0 0 52 31,-1.3 3,-1.4 -2,-0.3 5,-0.1 0.893 119.0 61.6 -60.8 -37.6 17.1 20.9 13.0 49 54 A L G 3 5S+ 0 0 46 30,-0.2 -1,-0.2 1,-0.2 74,-0.1 0.789 91.7 65.3 -54.6 -32.3 19.9 20.1 15.4 50 55 A Y G < 5S- 0 0 24 -3,-0.8 -30,-0.3 1,-0.1 -1,-0.2 0.581 91.4-140.2 -78.8 -8.2 19.4 16.3 15.0 51 56 A N T < 5S+ 0 0 114 -3,-1.4 -3,-0.1 -4,-0.3 -2,-0.1 0.920 80.2 92.1 48.4 48.5 20.4 16.2 11.4 52 57 A N >< + 0 0 1 -5,-0.6 4,-2.9 2,-0.1 5,-0.3 0.338 37.1 108.9-148.4 1.8 17.6 13.7 10.8 53 58 A E H > S+ 0 0 7 -6,-0.4 4,-2.8 1,-0.2 5,-0.2 0.876 82.3 54.8 -55.8 -37.7 14.5 15.6 9.8 54 59 A E H > S+ 0 0 38 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.944 113.2 41.9 -58.6 -48.1 14.8 14.3 6.2 55 60 A Q H > S+ 0 0 4 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.873 115.6 48.1 -68.2 -41.2 14.8 10.7 7.5 56 61 A V H X S+ 0 0 0 -4,-2.9 4,-1.9 2,-0.2 -2,-0.2 0.923 112.1 50.3 -65.7 -42.7 12.0 11.2 10.1 57 62 A G H X S+ 0 0 2 -4,-2.8 4,-2.5 -5,-0.3 -2,-0.2 0.865 109.8 51.2 -61.9 -37.1 9.9 13.0 7.5 58 63 A L H X S+ 0 0 23 -4,-1.7 4,-3.0 -5,-0.2 -1,-0.2 0.890 106.3 53.6 -68.9 -39.8 10.4 10.1 5.0 59 64 A A H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.906 111.8 46.5 -59.0 -42.1 9.4 7.5 7.6 60 65 A I H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.932 112.0 49.1 -66.4 -47.4 6.2 9.5 8.1 61 66 A R H X S+ 0 0 101 -4,-2.5 4,-2.2 1,-0.2 3,-0.2 0.918 111.2 51.9 -58.4 -43.3 5.5 9.8 4.4 62 67 A S H X S+ 0 0 36 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.902 109.7 47.7 -58.8 -44.1 6.1 6.1 4.1 63 68 A K H <>S+ 0 0 12 -4,-2.0 6,-1.6 1,-0.2 5,-1.1 0.726 111.5 50.5 -76.6 -21.3 3.6 5.2 6.8 64 69 A I H ><5S+ 0 0 61 -4,-1.7 3,-1.2 -3,-0.2 -1,-0.2 0.882 109.1 52.4 -75.8 -41.1 1.0 7.5 5.3 65 70 A A H 3<5S+ 0 0 63 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.1 0.888 107.6 49.1 -64.7 -41.7 1.4 6.0 1.9 66 71 A D T 3<5S- 0 0 90 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.1 0.410 118.0-112.6 -81.9 4.3 1.0 2.4 3.0 67 72 A G T < 5S+ 0 0 61 -3,-1.2 -3,-0.2 2,-0.3 -2,-0.1 0.485 82.1 122.9 84.9 5.3 -2.2 3.4 4.9 68 73 A S S > - 0 0 122 -2,-0.3 3,-1.5 -3,-0.1 4,-0.7 -0.732 36.1-107.9-104.8 162.2 -2.9 9.8 8.1 71 76 A R G >4 S+ 0 0 35 -2,-0.3 3,-1.3 1,-0.3 -1,-0.1 0.886 120.1 56.7 -55.2 -40.0 -0.9 13.0 8.4 72 77 A E G 34 S+ 0 0 125 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.626 99.6 60.5 -71.8 -11.2 -3.5 14.3 11.0 73 78 A D G <4 S+ 0 0 75 -3,-1.5 2,-0.4 2,-0.0 -1,-0.3 0.676 94.1 79.4 -82.8 -21.8 -2.8 11.2 13.1 74 79 A I << - 0 0 2 -3,-1.3 2,-0.6 -4,-0.7 -31,-0.2 -0.728 64.2-157.7 -93.6 136.3 0.9 12.2 13.5 75 80 A F E -d 43 0B 10 -33,-3.1 -31,-3.3 -2,-0.4 2,-0.5 -0.923 20.0-171.2-110.6 103.6 2.1 14.9 15.9 76 81 A Y E -d 44 0B 1 -2,-0.6 31,-1.8 -33,-0.2 32,-1.7 -0.849 5.4-164.0-106.3 126.0 5.4 16.1 14.6 77 82 A T E +de 45 108B 0 -33,-2.7 -31,-2.3 -2,-0.5 2,-0.3 -0.893 10.4 173.3-109.7 132.0 7.8 18.4 16.5 78 83 A S E - e 0 109B 0 30,-2.4 32,-1.8 -2,-0.5 2,-0.4 -0.802 17.8-141.4-121.9 174.6 10.7 20.4 15.2 79 84 A K E - e 0 110B 0 -2,-0.3 -31,-1.3 30,-0.2 2,-0.5 -0.999 15.3-119.8-143.0 140.0 12.8 23.0 16.9 80 85 A L E - e 0 111B 0 30,-4.1 32,-2.2 -2,-0.4 33,-0.4 -0.655 37.2-130.2 -75.6 119.2 14.4 26.3 16.0 81 86 A W > - 0 0 29 -2,-0.5 3,-2.2 30,-0.1 36,-0.1 -0.399 19.5-110.6 -76.9 156.0 18.2 25.9 16.5 82 87 A S G > S+ 0 0 2 1,-0.3 35,-2.8 2,-0.2 3,-0.7 0.570 113.0 64.2 -68.2 -16.0 20.1 28.6 18.5 83 88 A T G 3 S+ 0 0 2 1,-0.2 -1,-0.3 33,-0.2 37,-0.3 0.430 100.8 56.3 -82.6 -0.1 21.9 30.1 15.5 84 89 A F G < + 0 0 49 -3,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.013 68.2 112.4-119.8 27.4 18.5 31.1 14.2 85 90 A H < + 0 0 1 -3,-0.7 -1,-0.1 32,-0.3 5,-0.1 0.766 45.5 103.0 -71.8 -26.8 17.2 33.2 17.1 86 91 A R S >> S- 0 0 99 -3,-0.2 3,-2.9 1,-0.2 4,-0.6 -0.429 84.1-122.1 -64.1 131.7 17.3 36.5 15.2 87 92 A P H >> S+ 0 0 52 0, 0.0 3,-0.7 0, 0.0 4,-0.5 0.741 108.5 56.9 -52.7 -32.8 13.7 37.2 14.3 88 93 A E H 34 S+ 0 0 126 1,-0.2 -2,-0.1 2,-0.1 -3,-0.1 0.601 105.2 53.0 -77.9 -9.1 14.4 37.4 10.6 89 94 A L H <> S+ 0 0 47 -3,-2.9 4,-2.0 -5,-0.1 -1,-0.2 0.614 88.7 81.4 -95.4 -14.3 15.9 33.9 10.6 90 95 A V H S+ 0 0 69 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.895 110.3 53.5 -56.0 -38.4 13.3 30.5 6.8 93 98 A A H X S+ 0 0 12 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.945 111.3 44.8 -59.1 -49.1 14.6 28.1 9.4 94 99 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.910 111.5 52.7 -62.5 -42.2 11.1 26.5 9.8 95 100 A E H X S+ 0 0 86 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.870 108.5 51.1 -62.9 -36.5 10.6 26.5 6.0 96 101 A N H X S+ 0 0 57 -4,-2.2 4,-2.8 -5,-0.2 -1,-0.2 0.903 109.3 49.7 -67.0 -40.8 13.9 24.6 5.6 97 102 A S H X S+ 0 0 1 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.930 112.4 48.8 -59.4 -45.4 12.8 22.1 8.3 98 103 A L H <>S+ 0 0 12 -4,-2.6 5,-2.5 2,-0.2 4,-0.4 0.877 111.7 48.2 -62.3 -40.9 9.5 21.6 6.4 99 104 A K H ><5S+ 0 0 144 -4,-2.3 3,-1.0 3,-0.2 -2,-0.2 0.940 112.4 50.0 -64.8 -46.4 11.3 21.2 3.1 100 105 A K H 3<5S+ 0 0 88 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.948 117.1 38.4 -53.5 -55.0 13.7 18.7 4.6 101 106 A A T 3<5S- 0 0 1 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.433 106.7-128.1 -78.1 0.8 10.9 16.6 6.2 102 107 A Q T < 5 + 0 0 105 -3,-1.0 2,-0.3 -4,-0.4 -3,-0.2 0.934 62.5 139.0 41.9 55.9 8.8 17.1 3.1 103 108 A L < - 0 0 19 -5,-2.5 -1,-0.2 -6,-0.1 3,-0.1 -0.884 57.7-142.6-121.9 157.7 5.9 18.3 5.3 104 109 A D S S- 0 0 142 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.766 85.3 -3.2 -86.7 -29.0 3.4 21.1 4.9 105 110 A Y - 0 0 36 -7,-0.1 2,-0.4 50,-0.0 -1,-0.3 -0.979 63.8-125.4-156.0 156.3 3.4 22.0 8.6 106 111 A V E - f 0 155B 0 48,-2.2 50,-2.5 -2,-0.3 51,-0.3 -0.852 18.5-138.2-101.6 147.4 4.9 20.9 11.9 107 112 A D E S+ 0 0 18 -31,-1.8 50,-0.9 -2,-0.4 2,-0.3 0.834 90.5 15.6 -71.6 -29.3 2.5 20.2 14.7 108 113 A L E -ef 77 157B 2 -32,-1.7 -30,-2.4 48,-0.2 2,-0.4 -0.993 63.5-167.1-147.9 133.1 4.8 21.9 17.2 109 114 A Y E -ef 78 158B 1 48,-1.9 50,-2.3 -2,-0.3 2,-0.4 -0.989 16.6-169.7-121.8 128.8 7.7 24.2 16.7 110 115 A L E -ef 79 159B 0 -32,-1.8 -30,-4.1 -2,-0.4 2,-0.7 -0.897 33.5-119.9-118.1 148.3 10.0 25.0 19.7 111 116 A I E -ef 80 160B 0 48,-1.4 50,-1.2 -2,-0.4 -30,-0.1 -0.790 34.2-149.1 -70.7 115.1 12.8 27.4 20.5 112 117 A H - 0 0 16 -32,-2.2 -1,-0.2 -2,-0.7 -31,-0.1 0.836 68.1 -8.6 -62.1 -33.9 15.3 24.6 21.2 113 118 A S - 0 0 9 -33,-0.4 -1,-0.2 -3,-0.1 49,-0.2 -0.987 52.8-130.8-163.1 147.1 17.2 26.6 23.8 114 119 A P S S+ 0 0 0 0, 0.0 2,-1.6 0, 0.0 25,-0.1 0.545 84.3 100.2 -81.4 -3.6 17.4 30.1 25.2 115 120 A M - 0 0 24 196,-0.1 -33,-0.1 195,-0.1 21,-0.1 -0.575 69.2-152.9 -87.2 81.6 21.1 30.1 24.7 116 121 A S - 0 0 0 -2,-1.6 19,-1.8 21,-0.2 2,-0.3 -0.143 9.6-160.6 -57.7 143.2 21.5 32.1 21.5 117 122 A L B -J 134 0C 1 -35,-2.8 -32,-0.3 17,-0.3 17,-0.2 -0.866 32.0 -81.8-125.2 157.6 24.4 31.5 19.2 118 123 A K - 0 0 102 15,-2.3 17,-0.1 -2,-0.3 15,-0.1 -0.321 54.0-105.8 -57.1 131.4 26.0 33.5 16.4 119 124 A P + 0 0 40 0, 0.0 2,-0.3 0, 0.0 -35,-0.1 -0.319 68.0 116.7 -56.4 141.0 24.2 33.1 13.1 120 125 A G S S- 0 0 36 -37,-0.3 -37,-0.1 1,-0.1 -3,-0.0 -0.978 74.6 -85.3 172.4 177.3 26.1 30.8 10.7 121 126 A E S S+ 0 0 196 -2,-0.3 -1,-0.1 3,-0.0 -38,-0.1 0.919 100.7 74.0 -73.3 -46.1 26.5 27.7 8.7 122 127 A E S S- 0 0 136 1,-0.1 -2,-0.1 -3,-0.1 -39,-0.0 -0.334 77.9-135.7 -68.7 149.1 27.8 25.5 11.5 123 128 A L S S+ 0 0 57 1,-0.3 -1,-0.1 -74,-0.1 -40,-0.1 0.860 105.6 26.1 -68.5 -37.4 25.5 24.4 14.3 124 129 A S S S- 0 0 57 -7,-0.0 -1,-0.3 -42,-0.0 -3,-0.0 -0.634 84.3-163.2-131.9 73.2 28.2 25.3 16.8 125 130 A P - 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0 0 37 -2,-0.2 4,-2.0 -3,-0.1 5,-0.2 -0.842 29.9-109.7-120.6 160.4 25.0 -21.7 -7.9 563 252 B P H > S+ 0 0 30 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.902 119.7 54.4 -53.6 -41.7 27.5 -19.0 -6.7 564 253 B A H > S+ 0 0 11 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.935 108.1 48.7 -59.0 -48.3 26.0 -16.6 -9.2 565 254 B L H > S+ 0 0 2 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.824 109.7 52.4 -59.7 -35.0 22.5 -17.1 -7.7 566 255 B I H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.928 109.9 49.2 -66.0 -42.9 23.9 -16.6 -4.2 567 256 B A H X S+ 0 0 0 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.879 113.4 46.4 -64.5 -40.3 25.5 -13.3 -5.3 568 257 B L H X S+ 0 0 0 -4,-2.4 4,-1.7 2,-0.2 3,-0.2 0.929 112.6 48.6 -66.0 -47.4 22.2 -12.1 -6.9 569 258 B R H X S+ 0 0 41 -4,-2.4 4,-2.2 1,-0.2 5,-0.2 0.871 103.0 63.3 -64.5 -36.9 20.1 -13.1 -3.9 570 259 B Y H X S+ 0 0 0 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.934 105.0 46.3 -48.7 -49.6 22.5 -11.4 -1.5 571 260 B Q H ><>S+ 0 0 0 -4,-1.2 5,-2.5 -3,-0.2 3,-0.9 0.922 109.5 53.0 -64.5 -44.8 21.7 -8.1 -3.2 572 261 B L H ><5S+ 0 0 28 -4,-1.7 3,-1.2 1,-0.2 -1,-0.2 0.884 108.4 50.0 -58.7 -39.6 17.9 -8.5 -3.2 573 262 B Q H 3<5S+ 0 0 63 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.642 107.8 54.0 -79.2 -12.9 17.8 -9.3 0.6 574 263 B R T <<5S- 0 0 33 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.193 123.2-101.1-104.1 15.4 19.9 -6.2 1.4 575 264 B G T < 5S+ 0 0 37 -3,-1.2 2,-0.4 1,-0.3 -51,-0.4 0.728 79.0 134.1 78.8 22.7 17.5 -3.9 -0.4 576 265 B V < - 0 0 2 -5,-2.5 2,-0.4 -6,-0.2 -1,-0.3 -0.877 54.8-132.0-106.5 135.7 19.6 -3.5 -3.6 577 266 B V E - u 0 525G 2 -53,-2.1 -51,-3.0 -2,-0.4 2,-0.4 -0.752 33.7-148.0 -83.4 131.5 18.2 -3.8 -7.1 578 267 B V E -nu 330 526G 0 -249,-2.5 -247,-2.8 -2,-0.4 2,-0.3 -0.863 13.4-153.2-118.3 135.2 20.5 -6.1 -9.0 579 268 B L E -n 331 0G 10 -53,-2.5 -50,-0.4 -2,-0.4 2,-0.3 -0.739 9.1-170.4 -95.8 150.6 21.7 -6.4 -12.6 580 269 B A E -n 332 0G 2 -249,-1.9 -247,-1.9 -2,-0.3 2,-0.5 -0.902 4.6-161.7-142.8 111.6 22.8 -9.6 -14.3 581 270 B K E +n 333 0G 71 -2,-0.3 2,-0.3 -249,-0.2 -247,-0.1 -0.801 23.0 151.6 -92.6 129.8 24.4 -9.8 -17.7 582 271 B S - 0 0 8 -249,-0.6 -230,-0.1 -2,-0.5 -2,-0.1 -0.901 29.4-173.6-152.6 132.4 24.5 -13.0 -19.6 583 272 B Y + 0 0 34 -2,-0.3 2,-0.5 5,-0.0 -234,-0.0 0.033 67.0 98.5-104.5 22.7 24.6 -13.7 -23.3 584 273 B N > - 0 0 49 1,-0.1 4,-2.9 -236,-0.1 5,-0.2 -0.957 68.4-146.3-114.9 122.0 24.2 -17.4 -22.6 585 274 B E H > S+ 0 0 88 -2,-0.5 4,-2.1 1,-0.2 -1,-0.1 0.830 98.5 49.2 -56.9 -38.5 20.7 -18.9 -22.9 586 275 B Q H > S+ 0 0 130 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.935 114.1 44.4 -67.5 -44.2 21.2 -21.4 -20.1 587 276 B R H > S+ 0 0 140 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.877 110.8 54.3 -71.6 -36.6 22.6 -18.8 -17.6 588 277 B I H X S+ 0 0 1 -4,-2.9 4,-0.9 1,-0.2 -1,-0.2 0.954 111.0 47.3 -53.4 -50.4 19.9 -16.4 -18.6 589 278 B R H < S+ 0 0 141 -4,-2.1 3,-0.2 -5,-0.2 -2,-0.2 0.854 113.2 48.9 -61.2 -37.4 17.4 -19.2 -17.7 590 279 B Q H >< S+ 0 0 54 -4,-2.0 3,-2.5 1,-0.2 -1,-0.2 0.920 100.4 63.8 -68.5 -44.2 19.2 -19.9 -14.4 591 280 B N H >< S+ 0 0 6 -4,-2.6 3,-1.5 1,-0.3 -1,-0.2 0.752 91.0 63.0 -61.3 -26.9 19.4 -16.3 -13.2 592 281 B V G >< S+ 0 0 29 -4,-0.9 3,-1.2 1,-0.3 -1,-0.3 0.630 84.4 80.1 -72.7 -9.2 15.7 -15.8 -12.8 593 282 B Q G X + 0 0 68 -3,-2.5 3,-1.9 1,-0.3 -1,-0.3 0.470 62.2 97.1 -75.0 1.0 15.7 -18.5 -10.2 594 283 B V G X S+ 0 0 0 -3,-1.5 3,-0.6 1,-0.3 -1,-0.3 0.775 79.5 56.1 -58.0 -24.7 17.0 -15.9 -7.8 595 284 B F G < S+ 0 0 104 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.1 0.513 90.2 75.1 -87.3 -4.8 13.4 -15.6 -6.7 596 285 B E G < S+ 0 0 120 -3,-1.9 2,-0.3 -4,-0.1 -1,-0.2 0.390 101.2 22.8 -90.6 0.5 13.0 -19.3 -5.8 597 286 B F < - 0 0 19 -3,-0.6 2,-0.3 -4,-0.2 -38,-0.0 -0.933 64.1-135.8-153.7 174.7 15.0 -19.3 -2.5 598 287 B Q - 0 0 139 -2,-0.3 2,-0.2 -39,-0.0 -28,-0.1 -0.996 13.9-129.0-142.2 150.7 16.3 -17.2 0.3 599 288 B L - 0 0 10 -2,-0.3 2,-0.1 -30,-0.1 -44,-0.0 -0.622 30.9-116.8 -88.7 151.8 19.5 -16.8 2.3 600 289 B T > - 0 0 45 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.450 26.8-107.8 -81.7 163.2 19.5 -16.9 6.1 601 290 B A H > S+ 0 0 69 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.883 126.3 50.7 -53.5 -39.5 20.5 -13.9 8.3 602 291 B E H > S+ 0 0 119 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.864 107.7 51.8 -68.1 -37.8 23.6 -16.0 9.0 603 292 B D H > S+ 0 0 8 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.926 110.0 49.8 -61.3 -45.4 24.2 -16.5 5.3 604 293 B M H X S+ 0 0 23 -4,-2.7 4,-3.1 1,-0.2 -2,-0.2 0.910 109.7 49.9 -63.1 -44.0 23.9 -12.8 4.7 605 294 B K H X S+ 0 0 148 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.884 109.1 53.6 -61.0 -37.8 26.4 -12.0 7.5 606 295 B A H < S+ 0 0 43 -4,-2.0 3,-0.5 2,-0.2 -2,-0.2 0.951 111.5 44.2 -61.5 -48.4 28.7 -14.6 5.9 607 296 B I H >< S+ 0 0 0 -4,-2.6 3,-2.3 1,-0.2 4,-0.4 0.917 107.5 58.8 -62.5 -43.7 28.5 -12.8 2.5 608 297 B D H >< S+ 0 0 70 -4,-3.1 3,-1.3 1,-0.3 -1,-0.2 0.836 96.9 65.4 -49.7 -34.2 28.9 -9.4 4.2 609 298 B G T 3< S+ 0 0 65 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.540 87.1 68.5 -71.5 -6.5 32.2 -10.7 5.5 610 299 B L T < + 0 0 18 -3,-2.3 -1,-0.3 -4,-0.2 -2,-0.2 0.662 66.7 126.1 -86.9 -17.3 33.7 -10.9 2.0 611 300 B D < + 0 0 65 -3,-1.3 -104,-0.2 -4,-0.4 -103,-0.2 -0.117 21.0 158.3 -48.5 127.4 33.8 -7.2 1.5 612 301 B R - 0 0 132 -105,-2.0 -104,-0.2 2,-0.1 -1,-0.1 0.086 59.0-107.2-144.8 27.1 37.3 -6.2 0.5 613 302 B N + 0 0 117 1,-0.2 2,-0.8 0, 0.0 -105,-0.2 0.819 65.0 155.6 50.2 39.6 37.0 -2.8 -1.2 614 303 B L - 0 0 34 -107,-2.5 2,-0.5 2,-0.0 -1,-0.2 -0.845 23.2-176.6-102.9 109.1 37.7 -4.3 -4.6 615 304 B H - 0 0 28 -2,-0.8 -111,-0.0 1,-0.1 -107,-0.0 -0.915 16.2-153.4 -98.5 127.7 36.3 -2.6 -7.7 616 305 B Y S S+ 0 0 2 -2,-0.5 2,-0.6 -88,-0.1 -76,-0.5 0.805 75.6 79.4 -69.2 -32.0 37.1 -4.6 -10.8 617 306 B F + 0 0 68 -78,-0.1 2,-0.3 -3,-0.1 -78,-0.2 -0.709 60.2 167.8 -82.9 118.3 37.1 -1.5 -13.1 618 307 B N + 0 0 75 -80,-1.3 2,-0.2 -2,-0.6 -2,-0.0 -0.959 13.1 174.7-127.4 150.0 40.3 0.5 -12.9 619 308 B S > - 0 0 36 -2,-0.3 4,-1.4 1,-0.1 -81,-0.1 -0.732 18.8-164.9-156.9 104.5 41.7 3.3 -15.1 620 309 B D T 4 S+ 0 0 153 -2,-0.2 4,-0.4 1,-0.2 3,-0.3 0.901 94.8 55.3 -48.2 -45.6 44.9 5.2 -14.4 621 310 B S T >4 S+ 0 0 76 1,-0.2 3,-1.1 2,-0.2 -1,-0.2 0.924 111.7 38.9 -58.2 -52.1 43.8 7.8 -16.9 622 311 B F G >4 S+ 0 0 40 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.589 93.5 87.1 -80.1 -9.4 40.4 8.6 -15.3 623 312 B A G 3< S+ 0 0 39 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.742 93.1 46.7 -57.2 -22.4 41.9 8.3 -11.8 624 313 B S G < S+ 0 0 102 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.392 79.8 121.0-105.2 1.1 42.7 12.0 -12.3 625 314 B H S X S- 0 0 7 -3,-1.5 3,-2.5 1,-0.1 -194,-0.0 -0.477 72.1-124.6 -63.4 133.4 39.4 13.2 -13.6 626 315 B P T 3 S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -195,-0.1 0.803 112.2 47.2 -51.0 -31.3 38.1 15.9 -11.3 627 316 B N T 3 S+ 0 0 38 -195,-0.1 -196,-0.1 -197,-0.1 -2,-0.1 0.029 75.2 147.9-102.3 26.9 34.9 13.9 -10.9 628 317 B Y X - 0 0 34 -3,-2.5 3,-0.8 1,-0.2 -5,-0.1 -0.484 37.5-153.8 -62.8 119.4 36.6 10.5 -10.3 629 318 B P T 3 S+ 0 0 10 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.687 80.1 65.4 -73.5 -19.9 34.1 8.7 -8.0 630 319 B Y T 3 S+ 0 0 49 1,-0.2 -2,-0.1 -150,-0.1 -7,-0.0 0.102 76.2 83.6 -99.2 23.7 36.6 6.4 -6.3 631 320 B S S < S+ 0 0 86 -3,-0.8 -1,-0.2 3,-0.0 2,-0.1 0.828 80.9 69.8 -86.2 -35.7 38.8 8.9 -4.4 632 321 B D S S- 0 0 64 -3,-0.5 -151,-0.0 1,-0.1 0, 0.0 -0.316 95.3-102.8 -87.7 163.6 36.5 9.4 -1.3 633 322 B E 0 0 154 1,-0.2 -121,-0.1 -2,-0.1 -1,-0.1 0.892 360.0 360.0 -45.3 -47.2 35.6 7.0 1.6 634 323 B Y 0 0 62 -122,-0.1 -153,-1.7 -121,-0.1 -1,-0.2 0.176 360.0 360.0-171.1 360.0 32.3 6.5 -0.2