==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 29-SEP-09 3K1Y . COMPND 2 MOLECULE: OXIDOREDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM DIPHTHERIAE; . AUTHOR A.KUZIN,S.LEW,S.SAHDEV,R.XIAO,C.CICCOSANTI,H.WANG, . 1085 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43249.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 822 75.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 173 15.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 1.6 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 . 0 0.0 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 . 1 0.1 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 . 81 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 404 37.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 2.2 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 6 0 0 6 2 9 2 1 3 0 0 0 0 0 2 4 0 0 0 3 3 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 6 1 6 6 5 6 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 . 4 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 1 0 0 4 0 0 0 0 1 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 87 0, 0.0 2,-4.4 0, 0.0 39,-0.3 0.000 360.0 360.0 360.0 -90.7 25.6 -3.4 -9.5 2 0 A H - 0 0 179 1,-0.2 37,-0.0 37,-0.1 0, 0.0 -0.253 360.0 -19.3 -63.4 63.0 25.2 -5.9 -6.7 3 1 A X S S- 0 0 98 -2,-4.4 -1,-0.2 37,-0.1 38,-0.2 0.654 83.6-121.2 94.0 109.3 21.7 -4.6 -6.2 4 2 A R E -a 41 0A 25 36,-2.3 38,-2.6 -3,-0.3 2,-0.3 -0.365 24.4-134.3 -73.1 154.5 20.8 -1.3 -7.7 5 3 A T E -a 42 0A 48 36,-0.2 75,-0.9 72,-0.1 74,-0.9 -0.837 15.1-166.7-113.1 150.4 19.6 1.5 -5.4 6 4 A L E -ab 43 80A 1 36,-2.2 38,-3.1 -2,-0.3 2,-0.4 -0.999 6.1-156.4-136.6 130.7 16.6 3.8 -5.8 7 5 A A E -ab 44 81A 4 73,-1.8 75,-2.4 -2,-0.4 2,-0.4 -0.881 8.9-166.9-107.2 140.5 15.9 7.0 -3.8 8 6 A V E -ab 45 82A 0 36,-3.0 38,-3.3 -2,-0.4 2,-0.5 -0.964 4.6-163.2-132.7 117.4 12.3 8.3 -3.6 9 7 A I E -ab 46 83A 2 73,-3.8 75,-2.6 -2,-0.4 2,-0.4 -0.862 9.9-177.6 -99.6 129.8 11.5 11.8 -2.2 10 8 A S E -ab 47 84A 0 36,-2.2 38,-2.0 -2,-0.5 39,-0.4 -0.977 12.5-174.2-131.7 120.1 7.8 12.3 -1.3 11 9 A A + 0 0 0 73,-2.2 85,-0.1 -2,-0.4 84,-0.1 0.108 35.9 134.6-100.9 21.1 6.6 15.7 0.0 12 10 A G - 0 0 3 1,-0.1 37,-0.4 72,-0.1 5,-0.1 -0.375 35.1-168.2 -71.6 150.4 3.0 14.9 0.9 13 11 A L + 0 0 52 3,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.427 55.6 89.4-117.4 -1.7 1.6 16.1 4.2 14 12 A S S S- 0 0 84 2,-0.0 5,-0.1 0, 0.0 -2,-0.0 -0.690 76.6-108.4-100.7 152.8 -1.7 14.1 4.5 15 13 A T S S+ 0 0 139 -2,-0.3 2,-0.2 1,-0.1 -2,-0.0 -0.963 116.4 28.5-124.2 113.7 -2.3 10.8 6.1 16 14 A P S S- 0 0 107 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.602 104.9-145.1 -69.0 161.8 -2.9 8.8 4.0 17 15 A S > - 0 0 13 -2,-0.2 4,-1.5 1,-0.1 -2,-0.1 -0.878 16.9-161.5-104.9 122.5 -0.7 10.8 1.5 18 16 A S H > S+ 0 0 56 -2,-0.6 4,-1.6 1,-0.2 5,-0.2 0.784 96.7 55.6 -66.6 -28.1 -1.7 10.9 -2.1 19 17 A T H > S+ 0 0 3 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.891 107.0 48.2 -71.9 -38.5 1.9 11.9 -2.9 20 18 A R H > S+ 0 0 72 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.802 108.0 58.2 -70.4 -27.5 3.3 8.9 -1.2 21 19 A Q H X S+ 0 0 100 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.920 109.6 39.6 -69.9 -44.6 0.8 6.7 -3.1 22 20 A I H X S+ 0 0 9 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.857 113.8 57.4 -73.3 -30.4 1.9 7.7 -6.6 23 21 A A H X S+ 0 0 0 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.921 108.1 46.4 -62.4 -44.1 5.5 7.6 -5.3 24 22 A D H X S+ 0 0 44 -4,-2.1 4,-2.2 2,-0.2 5,-0.2 0.895 110.6 52.4 -66.1 -40.1 5.0 4.0 -4.3 25 23 A S H X S+ 0 0 49 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.928 111.2 48.9 -61.4 -42.1 3.4 3.1 -7.6 26 24 A I H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.955 113.2 43.8 -64.2 -50.1 6.4 4.7 -9.3 27 25 A S H X S+ 0 0 6 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.797 111.9 54.7 -67.8 -26.3 9.1 2.8 -7.3 28 26 A E H X S+ 0 0 124 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.928 110.7 45.1 -69.7 -44.9 7.2 -0.5 -7.6 29 27 A A H X S+ 0 0 25 -4,-2.2 4,-2.9 -5,-0.2 -2,-0.2 0.884 112.5 51.8 -65.5 -37.2 7.1 -0.2 -11.3 30 28 A V H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.3 0.936 107.9 52.7 -64.3 -43.0 10.8 0.8 -11.3 31 29 A T H X S+ 0 0 53 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.912 111.8 45.2 -58.0 -42.9 11.4 -2.3 -9.2 32 30 A A H X S+ 0 0 58 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.932 111.2 53.3 -66.3 -44.9 9.7 -4.4 -11.7 33 31 A A H X S+ 0 0 11 -4,-2.9 4,-0.9 1,-0.2 -2,-0.2 0.850 111.0 45.3 -58.9 -38.7 11.5 -2.7 -14.6 34 32 A V H <>S+ 0 0 0 -4,-2.5 5,-2.5 2,-0.2 -1,-0.2 0.824 111.3 54.5 -74.0 -30.8 14.9 -3.4 -13.1 35 33 A S H ><5S+ 0 0 77 -4,-1.6 3,-1.9 -5,-0.3 -2,-0.2 0.916 104.7 53.7 -66.9 -41.8 13.8 -6.9 -12.4 36 34 A A H 3<5S+ 0 0 86 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.773 104.4 56.0 -64.2 -25.6 12.9 -7.3 -16.1 37 35 A R T 3<5S- 0 0 97 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.2 0.310 127.1 -99.5 -90.6 12.4 16.4 -6.2 -16.9 38 36 A G T < 5S+ 0 0 68 -3,-1.9 2,-0.2 1,-0.3 -3,-0.2 0.499 86.6 100.6 88.6 4.8 17.9 -9.0 -14.8 39 37 A E < - 0 0 50 -5,-2.5 2,-0.3 -6,-0.1 -1,-0.3 -0.660 63.5-115.9-121.5 176.0 18.7 -7.1 -11.6 40 38 A A - 0 0 51 -39,-0.3 -36,-2.3 -2,-0.2 2,-0.4 -0.840 22.5-145.1-112.0 149.5 17.5 -6.3 -8.1 41 39 A L E -a 4 0A 24 -2,-0.3 2,-0.5 -38,-0.2 -36,-0.2 -0.921 8.0-162.8-121.1 138.5 16.4 -3.0 -6.6 42 40 A S E -a 5 0A 48 -38,-2.6 -36,-2.2 -2,-0.4 2,-0.4 -0.952 20.2-155.8-111.9 131.1 16.8 -1.5 -3.1 43 41 A V E -a 6 0A 66 -2,-0.5 2,-0.6 -38,-0.2 -36,-0.2 -0.931 12.5-166.9-117.7 136.1 14.4 1.4 -2.5 44 42 A S E -a 7 0A 49 -38,-3.1 -36,-3.0 -2,-0.4 2,-0.6 -0.927 8.9-166.2-120.6 104.4 14.8 4.2 -0.0 45 43 A T E -a 8 0A 43 -2,-0.6 2,-0.6 -38,-0.2 -36,-0.2 -0.828 2.1-165.7 -96.5 120.0 11.7 6.3 0.5 46 44 A I E -a 9 0A 23 -38,-3.3 -36,-2.2 -2,-0.6 2,-0.8 -0.902 6.7-155.3-108.9 111.6 12.2 9.6 2.3 47 45 A E E > -a 10 0A 23 -2,-0.6 3,-2.1 -38,-0.2 -36,-0.2 -0.758 3.4-156.9 -86.8 111.4 9.1 11.4 3.6 48 46 A L G > S+ 0 0 0 -38,-2.0 3,-1.9 -2,-0.8 4,-0.2 0.812 91.0 64.4 -57.3 -31.9 9.9 15.1 3.9 49 47 A S G 3 S+ 0 0 44 -39,-0.4 -1,-0.3 -37,-0.4 3,-0.2 0.621 100.2 53.8 -68.4 -10.6 7.1 15.5 6.5 50 48 A E G < S+ 0 0 128 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.342 106.9 52.1-102.3 4.5 9.2 13.3 8.8 51 49 A L <> + 0 0 5 -3,-1.9 4,-3.3 -4,-0.2 5,-0.3 0.227 70.0 115.5-121.1 10.4 12.3 15.5 8.3 52 50 A I H > S+ 0 0 2 1,-0.2 4,-3.1 -3,-0.2 5,-0.1 0.917 81.5 42.5 -49.7 -52.3 10.8 18.8 9.3 53 51 A P H 4 S+ 0 0 74 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 0.895 117.7 45.4 -64.4 -38.5 12.9 19.3 12.4 54 52 A D H > S+ 0 0 16 2,-0.2 4,-1.0 1,-0.2 3,-0.5 0.859 116.6 48.1 -71.0 -33.8 16.1 18.1 10.7 55 53 A L H >< S+ 0 0 0 -4,-3.3 3,-0.7 1,-0.2 4,-0.3 0.961 112.7 44.3 -71.0 -53.7 15.3 20.2 7.6 56 54 A X T 3X S+ 0 0 9 -4,-3.1 4,-0.8 -5,-0.3 -1,-0.2 0.312 109.2 59.1 -78.2 13.0 14.5 23.4 9.5 57 55 A T T 34 S+ 0 0 65 -3,-0.5 6,-0.3 2,-0.2 -1,-0.2 0.646 101.7 53.0-102.4 -31.4 17.6 22.9 11.6 58 56 A A T << S+ 0 0 10 -4,-1.0 -2,-0.2 -3,-0.7 -3,-0.1 0.523 109.6 53.9 -77.6 -5.9 19.7 22.9 8.5 59 57 A X T 4 S+ 0 0 19 -4,-0.3 -2,-0.2 1,-0.1 -1,-0.2 0.901 111.3 38.5 -89.5 -55.7 18.0 26.2 7.8 60 58 A T S < S+ 0 0 87 -4,-0.8 2,-0.3 2,-0.0 -2,-0.2 0.255 133.6 22.2 -79.4 11.6 18.7 28.0 11.1 61 59 A T S S- 0 0 76 -4,-0.1 -4,-0.0 2,-0.1 0, 0.0 -0.953 77.7-120.0-167.5 162.3 22.2 26.4 11.0 62 60 A R S S+ 0 0 213 -2,-0.3 2,-0.3 2,-0.1 -4,-0.1 0.438 80.3 89.5 -94.5 0.7 24.6 24.9 8.4 63 61 A V - 0 0 83 -6,-0.3 2,-0.2 1,-0.0 -2,-0.1 -0.757 63.7-137.1-106.3 150.1 24.9 21.4 9.9 64 62 A H - 0 0 48 -2,-0.3 -9,-0.1 1,-0.1 2,-0.1 -0.651 20.8-113.2 -99.2 153.0 22.8 18.3 9.3 65 63 A T > - 0 0 43 -2,-0.2 4,-2.9 -11,-0.2 5,-0.3 -0.350 37.0-103.6 -75.7 164.5 21.5 15.7 11.8 66 64 A T H > S+ 0 0 107 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.923 125.7 53.7 -54.3 -41.9 22.9 12.2 11.6 67 65 A K H > S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.922 110.3 43.2 -58.3 -49.0 19.6 11.3 10.0 68 66 A L H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.871 111.2 55.1 -67.0 -38.1 19.9 13.9 7.2 69 67 A E H X S+ 0 0 99 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.888 109.5 48.5 -62.5 -37.6 23.6 13.1 6.6 70 68 A E H X S+ 0 0 129 -4,-2.1 4,-1.7 -5,-0.3 -2,-0.2 0.896 113.6 47.1 -68.7 -38.9 22.6 9.5 6.1 71 69 A I H X S+ 0 0 21 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.956 113.9 44.3 -67.9 -52.1 19.8 10.5 3.7 72 70 A T H X S+ 0 0 18 -4,-3.1 4,-2.3 1,-0.2 5,-0.2 0.886 113.3 51.7 -62.4 -39.2 21.8 13.0 1.6 73 71 A S H X S+ 0 0 59 -4,-1.9 4,-1.6 -5,-0.3 -1,-0.2 0.904 112.8 43.8 -64.5 -42.7 24.8 10.7 1.3 74 72 A A H X S+ 0 0 45 -4,-1.7 4,-1.1 2,-0.2 -1,-0.2 0.904 109.8 58.6 -68.7 -40.6 22.7 7.7 0.1 75 73 A L H >< S+ 0 0 5 -4,-2.5 3,-1.4 1,-0.2 -2,-0.2 0.959 108.9 42.8 -52.6 -56.3 20.8 10.0 -2.2 76 74 A S H 3< S+ 0 0 54 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.840 114.5 51.9 -60.2 -33.4 24.0 11.0 -4.0 77 75 A A H 3< S+ 0 0 73 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.583 90.5 108.1 -79.8 -8.8 25.2 7.4 -4.0 78 76 A S << - 0 0 12 -3,-1.4 -72,-0.1 -4,-1.1 3,-0.1 -0.249 63.8-146.1 -69.3 157.0 21.9 6.2 -5.5 79 77 A D S S+ 0 0 30 -74,-0.9 2,-0.3 1,-0.1 -73,-0.2 0.725 82.7 17.7 -92.0 -28.4 21.6 5.0 -9.1 80 78 A G E -b 6 0A 0 -75,-0.9 -73,-1.8 31,-0.1 2,-0.3 -0.904 65.9-159.2-139.0 167.2 18.1 6.3 -9.6 81 79 A L E -bc 7 113A 0 31,-0.8 33,-1.9 -2,-0.3 2,-0.4 -0.996 5.8-165.2-152.7 146.4 15.8 8.8 -8.0 82 80 A V E -bc 8 114A 0 -75,-2.4 -73,-3.8 -2,-0.3 2,-0.4 -0.999 8.1-170.0-132.8 132.4 12.1 9.6 -7.8 83 81 A V E -bc 9 115A 0 31,-1.8 33,-1.9 -2,-0.4 2,-0.4 -0.991 4.7-178.3-126.7 129.8 10.6 12.9 -6.6 84 82 A A E +bc 10 116A 0 -75,-2.6 -73,-2.2 -2,-0.4 33,-0.2 -0.989 3.0 177.6-130.1 137.1 6.9 13.4 -5.9 85 83 A T E - c 0 117A 0 31,-1.4 33,-1.5 -2,-0.4 -73,-0.1 -0.998 26.8-130.3-142.0 140.9 5.3 16.6 -4.7 86 84 A P E - c 0 118A 13 0, 0.0 2,-0.6 0, 0.0 7,-0.5 -0.325 41.3-106.8 -74.6 173.7 1.7 17.7 -4.0 87 85 A V + 0 0 25 31,-0.7 2,-0.4 5,-0.1 5,-0.2 -0.919 39.8 177.5-112.1 116.0 0.8 21.0 -5.7 88 86 A F B > S-F 91 0B 56 3,-2.1 3,-1.3 -2,-0.6 194,-0.1 -0.956 72.4 -8.6-116.5 134.5 0.6 24.0 -3.5 89 87 A K T 3 S- 0 0 27 -2,-0.4 -1,-0.2 1,-0.3 230,-0.2 0.848 130.5 -56.1 45.9 41.9 -0.1 27.5 -4.9 90 88 A A T 3 S+ 0 0 5 1,-0.2 2,-0.3 -3,-0.2 -1,-0.3 0.712 123.4 53.5 68.5 27.5 0.3 26.0 -8.4 91 89 A S B < S-F 88 0B 5 -3,-1.3 -3,-2.1 40,-0.0 -1,-0.2 -0.916 97.3 -45.3-164.7-171.9 3.8 24.6 -8.0 92 90 A Y S S- 0 0 3 -2,-0.3 -5,-0.1 -5,-0.2 25,-0.0 -0.282 70.5 -89.5 -67.9 158.1 6.0 22.3 -6.0 93 91 A T > - 0 0 0 -7,-0.5 4,-2.8 1,-0.1 5,-0.2 -0.307 21.7-127.1 -69.7 149.9 5.8 22.6 -2.2 94 92 A G H > S+ 0 0 0 184,-0.3 4,-3.0 1,-0.2 185,-0.2 0.907 115.1 52.2 -61.1 -38.8 8.0 24.9 -0.2 95 93 A L H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.882 108.1 49.9 -64.0 -39.8 9.0 21.9 1.9 96 94 A F H > S+ 0 0 0 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.951 113.6 47.1 -61.8 -47.7 9.9 20.0 -1.3 97 95 A K H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 178,-0.3 0.891 105.5 59.5 -61.8 -41.0 12.0 23.0 -2.4 98 96 A X H X S+ 0 0 0 -4,-3.0 4,-1.9 2,-0.2 -1,-0.2 0.925 100.8 54.7 -54.8 -48.7 13.6 23.3 1.0 99 97 A F H >X S+ 0 0 0 -4,-1.8 4,-0.8 1,-0.2 3,-0.7 0.953 110.8 44.8 -50.7 -56.9 15.1 19.8 0.8 100 98 A F H >< S+ 0 0 2 -4,-1.4 3,-1.4 1,-0.3 -1,-0.2 0.904 107.8 58.0 -56.0 -43.1 16.8 20.5 -2.5 101 99 A D H 3< S+ 0 0 22 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.873 103.7 55.6 -53.5 -36.8 18.0 23.9 -1.3 102 100 A I H << S+ 0 0 23 -4,-1.9 -1,-0.3 -3,-0.7 -2,-0.2 0.685 89.7 96.9 -70.9 -21.2 19.8 22.0 1.5 103 101 A L S << S- 0 0 9 -3,-1.4 -3,-0.0 -4,-0.8 5,-0.0 -0.240 84.4 -96.6 -71.2 157.7 21.7 19.7 -0.9 104 102 A D > - 0 0 104 1,-0.1 3,-1.6 2,-0.0 4,-0.3 -0.276 40.9-104.2 -65.9 161.3 25.3 20.3 -2.0 105 103 A T T 3 S+ 0 0 115 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.909 121.9 33.2 -53.6 -44.6 25.7 22.0 -5.4 106 104 A D T > S+ 0 0 109 1,-0.2 3,-1.1 2,-0.1 -1,-0.3 0.023 80.2 118.7-104.0 26.9 26.6 18.7 -7.0 107 105 A A T < S+ 0 0 7 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.1 0.861 87.3 29.5 -59.9 -37.7 24.5 16.3 -4.9 108 106 A L T > S+ 0 0 1 -3,-0.3 3,-1.1 -4,-0.3 2,-0.3 -0.084 79.0 150.5-116.5 34.5 22.5 15.1 -8.0 109 107 A T T < S- 0 0 61 -3,-1.1 32,-0.2 1,-0.2 31,-0.2 -0.526 80.4 -3.3 -71.5 126.3 24.9 15.4 -10.9 110 108 A G T 3 S+ 0 0 37 30,-2.6 -1,-0.2 -2,-0.3 31,-0.2 0.439 91.6 155.8 75.0 0.4 24.2 12.8 -13.6 111 109 A X < - 0 0 9 -3,-1.1 31,-0.9 1,-0.1 -1,-0.2 -0.442 45.5-128.5 -67.0 112.6 21.4 11.3 -11.5 112 110 A P E - d 0 142A 5 0, 0.0 -31,-0.8 0, 0.0 2,-0.3 -0.420 42.7-177.0 -59.1 135.7 18.8 9.4 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111.3 43.7 -62.4 -48.6 -22.4 56.4 -24.0 614 66 D L H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.850 111.1 55.4 -68.1 -33.3 -24.7 57.9 -26.7 615 67 D E H X S+ 0 0 94 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.872 109.7 46.2 -67.7 -35.8 -22.2 60.7 -27.4 616 68 D E H X S+ 0 0 11 -4,-1.8 4,-2.3 -5,-0.2 -250,-0.5 0.871 113.7 49.3 -73.0 -37.2 -19.4 58.2 -28.1 617 69 D I H X S+ 0 0 10 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.959 114.3 43.0 -66.2 -51.4 -21.7 56.1 -30.2 618 70 D T H X S+ 0 0 17 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.844 115.8 50.0 -65.3 -32.4 -22.9 58.9 -32.4 619 71 D S H X S+ 0 0 43 -4,-1.6 4,-1.1 -5,-0.3 -1,-0.2 0.916 113.3 44.3 -70.4 -44.3 -19.4 60.4 -32.6 620 72 D A H < S+ 0 0 18 -4,-2.3 3,-0.3 2,-0.2 4,-0.3 0.920 111.9 56.2 -64.6 -43.3 -17.9 57.1 -33.7 621 73 D L H >< S+ 0 0 6 -4,-3.0 3,-2.1 1,-0.2 -2,-0.2 0.955 108.2 44.3 -52.2 -59.5 -20.9 56.6 -36.1 622 74 D S H 3< S+ 0 0 60 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.726 114.6 52.2 -60.5 -21.5 -20.3 59.9 -37.9 623 75 D A T 3< S+ 0 0 72 -4,-1.1 -1,-0.3 -3,-0.3 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-2,-0.4 2,-0.3 -0.994 13.1 172.4-142.4 148.9 -31.3 45.5 -43.9 663 115 D A E -tv 631 695E 0 31,-2.3 33,-2.6 -2,-0.3 2,-0.3 -0.945 12.1-154.6-146.1 164.3 -34.5 44.2 -42.3 664 116 D T E +tv 632 696E 8 -33,-1.5 -31,-0.7 -2,-0.3 2,-0.3 -0.999 21.4 143.4-148.0 145.6 -35.9 40.8 -41.2 665 117 D A E - v 0 697E 26 31,-1.7 33,-1.5 -2,-0.3 34,-0.3 -0.875 55.0 -88.6-159.0-171.2 -39.3 39.2 -40.7 666 118 D G S S+ 0 0 29 -2,-0.3 33,-1.1 31,-0.2 -1,-0.2 0.985 104.9 19.1 -75.5 -68.4 -41.1 35.9 -41.2 667 119 D S S S- 0 0 36 31,-0.1 3,-0.2 30,-0.1 31,-0.1 -0.246 77.4-120.2 -91.3-176.1 -42.4 36.1 -44.7 668 120 D A S > S+ 0 0 46 1,-0.1 3,-2.4 29,-0.1 4,-0.2 0.353 85.0 104.1-107.2 3.4 -41.1 38.4 -47.5 669 121 D R T 3 S+ 0 0 189 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.761 84.9 48.9 -58.1 -21.5 -44.4 40.1 -48.0 670 122 D H T > + 0 0 40 -3,-0.2 3,-1.9 1,-0.2 -1,-0.3 0.065 67.8 117.0-106.0 25.9 -42.9 43.0 -46.1 671 123 D S G X + 0 0 60 -3,-2.4 3,-1.7 1,-0.3 4,-0.5 0.643 59.0 86.9 -65.5 -8.9 -39.6 43.2 -48.1 672 124 D L G 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684 136 D Y H 3<5S+ 0 0 179 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.838 106.6 51.1 -49.8 -32.8 -32.8 62.0 -46.8 685 137 D X T 3<5S- 0 0 13 -4,-0.9 -1,-0.3 -5,-0.2 -31,-0.2 0.177 118.9-113.5 -92.7 19.0 -29.6 62.0 -44.7 686 138 D R T < 5 + 0 0 89 -3,-3.3 -30,-2.4 1,-0.2 -3,-0.2 0.674 63.3 153.5 61.1 20.8 -27.4 61.9 -47.8 687 139 D A < - 0 0 1 -5,-2.4 2,-0.9 -32,-0.2 -1,-0.2 -0.413 48.6-123.8 -73.8 156.5 -26.1 58.5 -47.0 688 140 D V E -u 658 0E 43 -31,-2.4 -29,-2.4 -34,-0.1 2,-0.5 -0.852 29.0-165.5-106.5 96.3 -24.9 56.4 -50.0 689 141 D V E -u 659 0E 18 -2,-0.9 181,-0.2 -31,-0.2 -29,-0.2 -0.717 19.7-125.5 -83.3 123.4 -27.0 53.2 -49.7 690 142 D V - 0 0 5 -31,-2.6 -29,-0.3 -2,-0.5 30,-0.1 -0.428 23.9-113.2 -68.5 145.0 -25.6 50.4 -52.0 691 143 D P S S+ 0 0 28 0, 0.0 2,-1.3 0, 0.0 -1,-0.1 0.790 98.3 83.0 -46.2 -38.8 -28.2 49.0 -54.4 692 144 D T - 0 0 1 23,-0.1 2,-0.2 175,-0.1 -2,-0.1 -0.580 61.7-176.9 -79.5 93.7 -28.3 45.6 -52.6 693 145 D G - 0 0 4 -2,-1.3 2,-0.5 -33,-0.1 -31,-0.2 -0.515 21.1-131.2 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S+ 0 0 0 -4,-2.9 3,-1.1 1,-0.2 -2,-0.2 0.958 112.9 42.8 -66.2 -52.0 24.6 8.9 -30.2 1087 177 F V H 3< S+ 0 0 38 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.700 108.4 62.2 -69.3 -17.1 27.2 6.1 -30.2 1088 178 F E H 3< S+ 0 0 114 -4,-1.4 2,-0.3 -5,-0.3 -1,-0.3 0.701 86.8 88.8 -79.5 -20.4 25.0 4.1 -27.9 1089 179 F E << 0 0 65 -3,-1.1 -102,-0.0 -4,-0.7 -4,-0.0 -0.643 360.0 360.0 -80.1 133.0 22.3 4.0 -30.6 1090 180 F S 0 0 158 -2,-0.3 -1,-0.2 0, 0.0 -2,-0.0 0.863 360.0 360.0-104.3 360.0 22.7 1.0 -32.9