==== 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 LIGASE 21-NOV-08 3FCC . COMPND 2 MOLECULE: D-ALANINE--POLY(PHOSPHORIBITOL) LIGASE SUBUNIT 1; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR K.T.OSMAN,L.DU,Y.HE,Y.LUO . 500 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21970.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 349 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 72 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 . 34 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 131 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 2 1 0 1 2 4 2 2 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 1 6 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 0 4 3 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 0 0 1 0 0 0 0 0 0 1 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 M 0 0 105 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 144.5 18.3 -37.4 4.9 2 2 A K > - 0 0 108 1,-0.1 4,-2.2 3,-0.1 5,-0.2 -0.160 360.0-107.5 -58.0 158.4 19.5 -34.5 2.7 3 3 A L H > S+ 0 0 2 1,-0.2 4,-1.2 2,-0.2 3,-0.1 0.939 121.7 46.4 -55.0 -50.2 17.6 -31.3 3.1 4 4 A L H > S+ 0 0 19 1,-0.2 4,-3.9 2,-0.2 5,-0.3 0.878 110.4 53.6 -61.8 -37.1 15.9 -31.7 -0.2 5 5 A E H > S+ 0 0 91 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.861 103.0 56.0 -67.1 -34.9 15.0 -35.3 0.5 6 6 A Q H < S+ 0 0 80 -4,-2.2 4,-0.3 2,-0.2 -1,-0.2 0.834 116.9 38.8 -64.8 -29.5 13.4 -34.3 3.8 7 7 A I H >X S+ 0 0 3 -4,-1.2 3,-2.5 -5,-0.2 4,-0.8 0.952 111.3 53.1 -82.2 -58.3 11.2 -32.1 1.6 8 8 A E H 3X S+ 0 0 44 -4,-3.9 4,-0.8 1,-0.3 -2,-0.2 0.699 97.4 74.1 -51.2 -20.1 10.7 -34.3 -1.4 9 9 A K H 3X S+ 0 0 82 -4,-1.3 4,-2.7 -5,-0.3 3,-0.3 0.841 93.9 48.9 -63.4 -36.8 9.5 -36.8 1.2 10 10 A W H <> S+ 0 0 42 -3,-2.5 4,-1.7 -4,-0.3 7,-0.3 0.748 99.6 65.0 -76.5 -22.0 6.3 -35.0 1.6 11 11 A A H < S+ 0 0 11 -4,-0.8 -1,-0.2 18,-0.2 -2,-0.2 0.820 114.1 35.8 -66.5 -26.6 5.8 -34.8 -2.1 12 12 A A H < S+ 0 0 69 -4,-0.8 -2,-0.2 -3,-0.3 -1,-0.2 0.906 124.0 36.6 -90.8 -51.3 5.5 -38.6 -1.7 13 13 A E H < S+ 0 0 131 -4,-2.7 -3,-0.2 1,-0.2 -2,-0.1 0.881 137.0 18.9 -71.1 -41.3 3.7 -39.2 1.6 14 14 A T S >< S+ 0 0 32 -4,-1.7 3,-1.7 -5,-0.2 15,-0.4 -0.462 73.1 160.2-130.4 60.8 1.4 -36.2 1.3 15 15 A P T 3 S+ 0 0 43 0, 0.0 15,-2.1 0, 0.0 16,-0.3 0.810 75.9 45.3 -51.5 -40.1 1.4 -35.3 -2.4 16 16 A D T 3 S+ 0 0 123 13,-0.2 2,-0.2 12,-0.2 -5,-0.1 0.358 84.0 116.4 -92.5 7.6 -1.9 -33.3 -2.4 17 17 A Q S < S- 0 0 72 -3,-1.7 12,-1.9 -7,-0.3 2,-0.5 -0.523 76.9-105.5 -74.9 142.2 -1.2 -31.3 0.7 18 18 A T E +A 28 0A 38 10,-0.2 10,-0.3 -2,-0.2 3,-0.1 -0.546 37.1 179.8 -70.5 119.3 -0.9 -27.5 0.2 19 19 A A E + 0 0 1 8,-2.8 191,-2.8 -2,-0.5 2,-0.3 0.883 68.0 6.5 -86.6 -41.8 2.8 -26.5 0.4 20 20 A F E -Ab 27 210A 1 7,-1.6 7,-1.8 189,-0.2 2,-0.4 -0.998 61.8-174.0-144.6 143.5 2.3 -22.8 -0.3 21 21 A V E +Ab 26 211A 2 189,-2.2 191,-2.6 -2,-0.3 2,-0.4 -0.985 8.2 176.1-145.0 130.4 -0.6 -20.4 -0.6 22 22 A W E > S-Ab 25 212A 60 3,-2.6 3,-1.9 -2,-0.4 2,-0.4 -0.930 70.1 -54.6-134.1 109.3 -0.9 -16.8 -1.5 23 23 A R T 3 S- 0 0 105 189,-0.5 189,-0.0 -2,-0.4 190,-0.0 -0.447 123.0 -19.0 58.7-113.3 -4.4 -15.4 -1.8 24 24 A D T 3 S+ 0 0 160 -2,-0.4 2,-0.4 -3,-0.1 -1,-0.3 0.632 115.7 97.1 -98.4 -16.1 -6.1 -17.8 -4.3 25 25 A A E < +A 22 0A 41 -3,-1.9 -3,-2.6 2,-0.0 2,-0.3 -0.626 52.6 172.5 -77.6 125.9 -2.9 -19.2 -5.9 26 26 A K E -A 21 0A 122 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.944 18.6-167.3-134.1 154.7 -1.9 -22.6 -4.3 27 27 A I E -A 20 0A 11 -7,-1.8 -8,-2.8 -2,-0.3 -7,-1.6 -0.992 14.0-141.2-144.1 135.6 0.6 -25.4 -4.9 28 28 A T E > -A 18 0A 25 -2,-0.3 4,-2.5 -10,-0.3 -10,-0.2 -0.453 33.9-105.0 -87.9 163.8 0.8 -28.9 -3.5 29 29 A Y H > S+ 0 0 3 -12,-1.9 4,-2.1 -15,-0.4 -18,-0.2 0.823 122.6 56.7 -58.4 -29.9 4.0 -30.7 -2.5 30 30 A K H > S+ 0 0 98 -15,-2.1 4,-3.1 -13,-0.2 -1,-0.2 0.940 109.1 42.7 -67.1 -47.8 3.6 -32.7 -5.7 31 31 A Q H > S+ 0 0 70 -16,-0.3 4,-4.1 2,-0.2 5,-0.4 0.898 112.2 55.2 -64.0 -42.7 3.5 -29.7 -8.0 32 32 A L H X S+ 0 0 2 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.941 113.6 40.8 -54.6 -51.1 6.3 -28.1 -6.1 33 33 A K H X S+ 0 0 61 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.972 118.2 47.8 -61.3 -55.4 8.5 -31.1 -6.7 34 34 A E H X S+ 0 0 74 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.939 117.5 39.8 -50.9 -57.5 7.2 -31.6 -10.2 35 35 A D H X S+ 0 0 26 -4,-4.1 4,-2.4 1,-0.2 -1,-0.2 0.895 115.8 48.7 -65.9 -41.0 7.7 -28.0 -11.3 36 36 A S H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.4 -1,-0.2 0.836 110.2 55.0 -68.2 -28.3 11.0 -27.4 -9.4 37 37 A D H X S+ 0 0 9 -4,-2.4 4,-2.7 -5,-0.3 -2,-0.2 0.959 109.7 46.0 -64.0 -50.8 12.2 -30.7 -11.0 38 38 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.884 113.1 49.0 -59.7 -42.3 11.4 -29.3 -14.5 39 39 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.923 111.3 49.8 -65.6 -43.5 13.0 -25.9 -13.8 40 40 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.949 109.1 51.5 -58.3 -51.5 16.2 -27.6 -12.5 41 41 A H H X S+ 0 0 63 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.909 111.7 48.7 -52.6 -44.0 16.4 -29.8 -15.5 42 42 A W H X S+ 0 0 23 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.936 108.3 52.1 -62.9 -49.3 16.1 -26.7 -17.7 43 43 A I H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.894 110.9 49.0 -55.0 -41.9 18.8 -24.8 -15.8 44 44 A S H < S+ 0 0 22 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.909 110.3 49.7 -65.7 -42.4 21.2 -27.7 -16.2 45 45 A S H < S+ 0 0 63 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.834 117.3 42.2 -65.9 -32.2 20.5 -28.0 -20.0 46 46 A E H < S+ 0 0 83 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.826 129.2 25.3 -84.2 -34.2 21.0 -24.2 -20.4 47 47 A Y < + 0 0 34 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 -0.531 68.9 169.1-130.2 66.6 24.1 -23.9 -18.1 48 48 A P S S+ 0 0 81 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.802 83.3 19.6 -47.9 -38.1 25.8 -27.4 -18.1 49 49 A D S S+ 0 0 148 -5,-0.0 -2,-0.1 2,-0.0 2,-0.0 0.752 103.2 94.2-107.7 -28.2 28.9 -26.2 -16.4 50 50 A D + 0 0 33 1,-0.1 -3,-0.1 -6,-0.1 26,-0.0 -0.306 37.0 176.2 -68.7 146.9 28.0 -22.9 -14.7 51 51 A R + 0 0 89 -2,-0.0 26,-0.6 25,-0.0 -1,-0.1 0.082 27.8 147.8-135.3 20.1 26.9 -22.7 -11.1 52 52 A S - 0 0 25 24,-0.1 48,-0.1 1,-0.1 47,-0.1 -0.191 58.8 -90.2 -58.4 149.0 26.6 -18.9 -10.7 53 53 A P - 0 0 20 0, 0.0 47,-0.6 0, 0.0 48,-0.5 -0.296 41.6-140.5 -62.1 148.0 23.9 -17.6 -8.3 54 54 A I E -no 78 101B 3 23,-2.8 25,-2.7 45,-0.2 48,-0.2 -0.942 7.6-130.4-116.3 131.1 20.5 -17.0 -9.9 55 55 A M E -no 79 102B 0 46,-2.4 48,-3.4 -2,-0.4 2,-0.5 -0.529 14.0-161.2 -79.0 144.0 18.3 -14.1 -9.1 56 56 A V E -no 80 103B 0 23,-2.3 25,-2.4 46,-0.2 2,-0.4 -0.926 11.3-163.7-129.9 103.2 14.6 -14.8 -8.3 57 57 A Y E +no 81 104B 4 46,-2.6 48,-2.3 -2,-0.5 2,-0.3 -0.746 39.1 77.2 -93.7 131.0 12.5 -11.7 -8.7 58 58 A G E -n 82 0B 0 23,-1.7 25,-1.2 -2,-0.4 133,-0.1 -0.985 60.5-117.6 165.2-164.0 9.0 -11.5 -7.2 59 59 A H S S- 0 0 28 -2,-0.3 132,-0.4 23,-0.2 -1,-0.1 0.338 81.8 -23.5-129.9 -91.9 7.0 -10.9 -4.0 60 60 A M S S+ 0 0 1 130,-0.1 152,-0.1 152,-0.1 154,-0.0 0.181 86.7 130.2-118.3 18.0 4.7 -13.6 -2.6 61 61 A Q >> - 0 0 28 1,-0.1 3,-1.8 2,-0.0 4,-0.6 -0.366 67.2-119.8 -70.8 150.7 3.8 -15.8 -5.6 62 62 A P H 3> S+ 0 0 4 0, 0.0 4,-2.2 0, 0.0 3,-0.5 0.791 109.2 74.3 -61.5 -23.8 4.2 -19.6 -5.2 63 63 A E H 3> S+ 0 0 53 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.780 84.3 66.7 -60.2 -24.9 6.7 -19.4 -8.1 64 64 A M H <> S+ 0 0 2 -3,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.962 106.8 38.4 -60.0 -50.5 9.2 -17.9 -5.7 65 65 A I H X S+ 0 0 1 -4,-0.6 4,-2.0 -3,-0.5 5,-0.2 0.915 115.9 52.1 -66.9 -42.9 9.4 -21.1 -3.8 66 66 A I H X S+ 0 0 3 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.939 112.5 47.5 -57.2 -45.5 9.2 -23.3 -6.9 67 67 A N H X S+ 0 0 0 -4,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.843 107.6 54.3 -66.0 -37.1 12.1 -21.2 -8.3 68 68 A F H X S+ 0 0 2 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.966 112.1 43.4 -61.0 -53.7 14.3 -21.4 -5.2 69 69 A L H X S+ 0 0 1 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.813 112.1 54.0 -62.6 -32.4 14.2 -25.2 -5.1 70 70 A G H X S+ 0 0 0 -4,-1.7 4,-1.1 -5,-0.2 -1,-0.2 0.922 108.9 49.5 -67.9 -42.7 14.7 -25.5 -8.8 71 71 A C H <>S+ 0 0 0 -4,-2.3 5,-2.3 1,-0.2 3,-0.4 0.914 114.1 43.4 -61.3 -48.0 17.8 -23.3 -8.6 72 72 A V H ><5S+ 0 0 0 -4,-2.3 69,-2.4 1,-0.2 3,-1.4 0.817 106.9 60.3 -71.5 -29.8 19.4 -25.3 -5.7 73 73 A K H 3<5S+ 0 0 7 -4,-1.9 -1,-0.2 1,-0.3 66,-0.2 0.800 106.2 49.4 -66.3 -26.0 18.5 -28.7 -7.3 74 74 A A T 3<5S- 0 0 0 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.382 125.3-103.4 -92.6 3.1 20.6 -27.6 -10.3 75 75 A G T < 5S+ 0 0 9 -3,-1.4 2,-0.3 1,-0.3 -3,-0.2 0.444 83.0 123.5 91.1 -0.1 23.5 -26.7 -8.0 76 76 A H < - 0 0 1 -5,-2.3 -1,-0.3 -6,-0.2 -2,-0.2 -0.748 58.1-131.6 -97.1 143.9 23.0 -22.9 -8.2 77 77 A A - 0 0 5 -26,-0.6 -23,-2.8 -2,-0.3 2,-0.3 -0.527 25.7-134.2 -83.7 157.0 22.4 -20.7 -5.2 78 78 A Y E -np 54 148B 4 69,-1.7 71,-2.4 -25,-0.2 -23,-0.2 -0.866 7.2-150.1-115.7 153.1 19.4 -18.3 -5.5 79 79 A I E -n 55 0B 0 -25,-2.7 -23,-2.3 -2,-0.3 2,-0.3 -0.914 16.3-145.2-121.6 101.7 19.2 -14.6 -4.7 80 80 A P E -n 56 0B 5 0, 0.0 2,-0.5 0, 0.0 71,-0.3 -0.524 17.8-175.4 -70.7 125.6 15.7 -13.6 -3.6 81 81 A V E -n 57 0B 0 -25,-2.4 -23,-1.7 -2,-0.3 2,-0.1 -0.953 12.0-151.4-123.8 107.8 15.0 -10.1 -4.8 82 82 A D E > -n 58 0B 3 -2,-0.5 3,-2.2 -25,-0.2 -23,-0.2 -0.474 26.3-114.8 -79.3 151.2 11.6 -8.7 -3.5 83 83 A L T 3 S+ 0 0 69 -25,-1.2 -1,-0.1 1,-0.3 -24,-0.1 0.720 112.0 68.4 -56.8 -21.4 9.7 -6.1 -5.6 84 84 A S T 3 S+ 0 0 43 2,-0.1 -1,-0.3 402,-0.0 -25,-0.1 0.651 72.3 104.3 -75.3 -14.0 10.3 -3.6 -2.8 85 85 A I S < S- 0 0 20 -3,-2.2 5,-0.1 1,-0.1 -4,-0.0 -0.563 84.7-108.8 -72.1 122.1 14.1 -3.4 -3.4 86 86 A P >> - 0 0 59 0, 0.0 4,-1.7 0, 0.0 3,-0.8 -0.195 25.0-117.9 -51.2 136.3 14.8 -0.1 -5.3 87 87 A A H 3> S+ 0 0 40 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.830 111.8 57.1 -45.4 -43.9 15.8 -0.6 -8.9 88 88 A D H 3> S+ 0 0 113 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.927 108.1 46.2 -57.8 -45.5 19.3 0.8 -8.4 89 89 A R H <> S+ 0 0 76 -3,-0.8 4,-2.6 1,-0.2 -1,-0.2 0.821 109.5 56.5 -66.5 -31.0 20.1 -1.7 -5.7 90 90 A V H X S+ 0 0 1 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.878 107.7 46.6 -67.6 -39.4 18.7 -4.5 -7.9 91 91 A Q H X S+ 0 0 67 -4,-2.1 4,-2.1 2,-0.2 5,-0.3 0.897 111.0 53.2 -68.5 -40.3 21.1 -3.5 -10.7 92 92 A R H X S+ 0 0 122 -4,-2.0 4,-4.3 1,-0.2 5,-0.3 0.955 108.9 48.3 -58.0 -51.7 23.9 -3.4 -8.2 93 93 A I H X S+ 0 0 3 -4,-2.6 4,-2.1 1,-0.2 6,-0.3 0.866 107.7 58.5 -56.3 -37.1 23.1 -6.9 -7.0 94 94 A A H < S+ 0 0 2 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.924 120.2 25.0 -59.6 -48.3 23.0 -7.9 -10.7 95 95 A E H < S+ 0 0 136 -4,-2.1 -2,-0.2 -3,-0.2 -1,-0.2 0.842 116.6 63.1 -85.7 -38.0 26.6 -6.9 -11.4 96 96 A N H < S+ 0 0 48 -4,-4.3 -3,-0.2 -5,-0.3 -2,-0.2 0.958 107.5 46.7 -49.5 -57.8 27.8 -7.2 -7.8 97 97 A S S < S- 0 0 4 -4,-2.1 -45,-0.0 -5,-0.3 0, 0.0 -0.249 95.0-117.2 -77.3 172.2 27.0 -11.0 -7.9 98 98 A G + 0 0 44 -2,-0.0 -46,-0.1 -44,-0.0 -3,-0.1 0.182 59.5 153.2 -97.4 18.3 28.1 -13.1 -10.8 99 99 A A + 0 0 7 -6,-0.3 -45,-0.2 -5,-0.2 3,-0.1 -0.129 22.9 175.2 -49.4 137.4 24.5 -13.8 -11.6 100 100 A K + 0 0 113 -47,-0.6 16,-2.2 1,-0.2 2,-0.3 0.390 65.5 49.8-121.9 -6.7 23.9 -14.6 -15.3 101 101 A L E -oq 54 116B 4 -48,-0.5 -46,-2.4 14,-0.2 2,-0.4 -0.990 55.7-169.4-139.5 145.2 20.2 -15.5 -14.9 102 102 A L E -oq 55 117B 2 14,-2.4 16,-2.5 -2,-0.3 2,-0.5 -0.988 10.2-157.4-134.7 122.1 17.1 -14.0 -13.3 103 103 A L E -oq 56 118B 0 -48,-3.4 -46,-2.6 -2,-0.4 2,-0.4 -0.876 13.9-161.4-101.8 130.1 13.9 -15.9 -12.9 104 104 A S E -oq 57 119B 0 14,-2.4 16,-0.8 -2,-0.5 19,-0.2 -0.942 23.1-166.5-122.2 132.8 10.7 -13.8 -12.5 105 105 A A S S+ 0 0 17 -48,-2.3 -1,-0.2 -2,-0.4 15,-0.2 0.993 84.5 9.7 -68.0 -65.6 7.2 -14.6 -11.2 106 106 A T S S- 0 0 53 -49,-0.3 14,-0.7 1,-0.2 2,-0.2 0.013 114.4 -44.9 -96.4-157.1 5.5 -11.5 -12.5 107 107 A A - 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0 0 48 -37,-1.5 3,-0.0 -2,-0.4 -2,-0.0 -0.987 48.1-109.2-154.1 158.9 0.9 10.0 15.7 480 483 A S S S+ 0 0 113 -2,-0.3 2,-0.3 -37,-0.1 -37,-0.1 0.616 94.3 1.2 -64.6 -17.8 -1.5 7.1 15.1 481 484 A S - 0 0 70 -39,-0.1 -1,-0.1 -58,-0.0 -39,-0.0 -0.990 66.4-111.1-166.8 159.9 1.1 4.5 14.3 482 485 A I - 0 0 36 -2,-0.3 -237,-0.0 -241,-0.1 -58,-0.0 -0.846 43.4-118.4 -98.2 125.2 4.8 3.7 13.8 483 486 A P - 0 0 21 0, 0.0 8,-2.9 0, 0.0 2,-0.4 -0.319 23.0-151.3 -64.6 145.4 5.8 3.1 10.2 484 487 A M B -W 490 0E 57 6,-0.3 6,-0.2 7,-0.1 0, 0.0 -0.905 12.4-128.9-114.4 144.1 7.2 -0.3 9.2 485 488 A T > - 0 0 36 4,-3.0 3,-1.8 -2,-0.4 6,-0.1 -0.201 45.1 -86.2 -78.2-179.3 9.6 -0.8 6.4 486 489 A P T 3 S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 -402,-0.0 0.794 130.5 58.3 -62.0 -25.7 8.8 -3.5 3.8 487 490 A N T 3 S- 0 0 44 -298,-0.1 -248,-0.2 2,-0.1 3,-0.1 0.541 121.5-106.1 -79.7 -7.1 10.5 -6.1 6.0 488 491 A G S < S+ 0 0 4 -3,-1.8 -246,-0.3 1,-0.3 -247,-0.2 0.577 79.0 126.5 93.7 10.3 8.1 -5.3 8.9 489 492 A K S S- 0 0 47 -248,-0.1 -4,-3.0 1,-0.1 -1,-0.3 -0.589 73.4 -76.6-100.3 163.3 10.7 -3.4 11.0 490 493 A V B -W 484 0E 30 -6,-0.2 2,-1.8 -2,-0.2 -6,-0.3 -0.378 42.4-134.0 -58.9 124.6 10.5 0.1 12.5 491 494 A D > + 0 0 28 -8,-2.9 4,-2.0 1,-0.2 -1,-0.1 -0.567 38.8 162.6 -84.0 79.0 11.1 2.6 9.7 492 495 A R H > S+ 0 0 66 -2,-1.8 4,-2.8 1,-0.2 5,-0.2 0.864 73.6 57.0 -64.4 -35.4 13.5 4.9 11.5 493 496 A K H > S+ 0 0 167 -3,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.928 107.5 46.4 -61.5 -47.5 14.7 6.3 8.1 494 497 A K H > S+ 0 0 95 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.938 113.2 50.6 -60.4 -46.0 11.1 7.4 7.2 495 498 A L H X S+ 0 0 0 -4,-2.0 4,-0.7 1,-0.2 -2,-0.2 0.930 111.8 45.3 -58.2 -50.4 10.6 8.9 10.7 496 499 A L H X S+ 0 0 77 -4,-2.8 4,-1.5 1,-0.2 3,-0.4 0.823 110.2 57.2 -63.7 -31.2 13.9 10.9 10.6 497 500 A S H X S+ 0 0 81 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.2 0.887 110.4 42.4 -67.6 -38.7 13.0 12.0 7.1 498 501 A E H < S+ 0 0 73 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.477 109.8 55.8 -88.2 -2.7 9.7 13.5 8.3 499 502 A V H < S+ 0 0 30 -4,-0.7 -1,-0.2 -3,-0.4 -2,-0.2 0.755 109.4 48.4 -92.2 -31.3 11.1 15.1 11.4 500 503 A T H < 0 0 109 -4,-1.5 -2,-0.2 -5,-0.2 -3,-0.1 0.922 360.0 360.0 -69.5 -45.4 13.5 16.9 9.2 501 504 A A < 0 0 113 -4,-1.6 -3,-0.1 -5,-0.1 0, 0.0 0.194 360.0 360.0 -80.1 360.0 10.7 18.0 6.9