==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-OCT-05 2B99 . COMPND 2 MOLECULE: RIBOFLAVIN SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR A.RAMSPERGER,M.AUGUSTIN,A.K.SCHOTT,S.GERHARDT,T.KROJER, . 734 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29701.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 558 76.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 95 12.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 40 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 319 43.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.9 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 5 0 0 0 0 10 0 0 0 0 0 0 0 1 0 4 0 0 5 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 5 5 0 5 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 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 . 0 0 5 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 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 2 A T 0 0 118 0, 0.0 2,-0.2 0, 0.0 30,-0.1 0.000 360.0 360.0 360.0 -49.7 15.3 0.1 -29.8 2 3 A K - 0 0 85 55,-0.0 30,-2.4 56,-0.0 2,-0.4 -0.521 360.0-139.1 -87.6 159.7 12.7 0.2 -27.0 3 4 A K E -a 32 0A 42 53,-0.2 55,-2.2 28,-0.2 56,-1.1 -0.955 11.8-164.5-123.7 138.6 11.2 -2.9 -25.4 4 5 A V E -ab 33 59A 0 28,-3.3 30,-1.4 -2,-0.4 2,-0.4 -0.984 7.6-151.0-126.7 127.8 7.6 -3.5 -24.4 5 6 A G E -ab 34 60A 0 54,-2.7 56,-2.9 -2,-0.4 2,-0.5 -0.811 7.7-162.0 -98.6 136.8 6.4 -6.2 -22.1 6 7 A I E -ab 35 61A 0 28,-2.7 30,-1.8 -2,-0.4 2,-0.5 -0.961 7.5-176.0-122.9 115.6 2.9 -7.6 -22.5 7 8 A V E +ab 36 62A 0 54,-2.9 56,-3.2 -2,-0.5 30,-0.2 -0.944 12.4 158.5-116.0 122.7 1.3 -9.5 -19.6 8 9 A D E -a 37 0A 6 28,-1.6 30,-2.4 -2,-0.5 2,-0.3 -0.629 26.2-118.4-127.3-171.0 -2.1 -11.2 -19.9 9 10 A T E -a 38 0A 1 28,-0.2 278,-2.7 -2,-0.2 279,-0.3 -0.841 15.7-136.0-133.9 166.6 -4.1 -14.0 -18.3 10 11 A T S S+ 0 0 27 28,-1.4 30,-0.2 29,-0.9 279,-0.1 0.590 105.1 64.9 -91.8 -16.1 -5.7 -17.4 -18.7 11 12 A F S S+ 0 0 100 28,-1.6 29,-0.1 27,-0.4 -1,-0.1 0.891 79.5 97.2 -72.6 -39.9 -8.8 -16.1 -16.8 12 13 A A - 0 0 2 27,-0.2 278,-0.1 51,-0.2 55,-0.0 -0.159 66.3-148.9 -52.3 139.7 -9.7 -13.5 -19.4 13 14 A R S S+ 0 0 50 277,-0.1 277,-0.4 275,-0.1 2,-0.4 0.366 80.5 56.7 -93.2 4.9 -12.4 -14.6 -21.8 14 15 A V S S- 0 0 8 275,-0.1 2,-1.0 276,-0.1 273,-0.1 -1.000 81.7-126.1-139.0 137.6 -10.9 -12.4 -24.6 15 16 A D + 0 0 51 -2,-0.4 4,-0.4 272,-0.2 272,-0.1 -0.720 37.9 161.8 -84.1 101.3 -7.5 -12.4 -26.1 16 17 A M > + 0 0 4 -2,-1.0 4,-1.4 2,-0.1 -1,-0.2 0.681 60.5 71.2 -93.7 -20.6 -6.4 -8.8 -25.9 17 18 A A H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.886 90.5 56.4 -63.0 -45.6 -2.6 -9.4 -26.4 18 19 A S H > S+ 0 0 53 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.930 108.7 47.2 -55.1 -48.2 -2.7 -10.3 -30.1 19 20 A I H > S+ 0 0 43 -4,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.855 113.7 48.1 -62.2 -38.8 -4.4 -7.0 -31.0 20 21 A A H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.953 111.7 48.3 -67.0 -52.2 -2.0 -4.9 -28.9 21 22 A I H X S+ 0 0 22 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.914 111.0 51.2 -54.5 -47.1 1.1 -6.6 -30.2 22 23 A K H X S+ 0 0 156 -4,-2.4 4,-1.3 -5,-0.3 -1,-0.2 0.872 109.7 51.0 -60.7 -37.9 -0.0 -6.2 -33.8 23 24 A K H X S+ 0 0 31 -4,-1.5 4,-2.0 -5,-0.2 -1,-0.2 0.898 110.9 47.4 -68.3 -40.3 -0.7 -2.5 -33.2 24 25 A L H X S+ 0 0 3 -4,-2.3 4,-2.8 2,-0.2 7,-0.2 0.937 111.2 48.9 -67.2 -46.9 2.7 -1.9 -31.7 25 26 A K H < S+ 0 0 111 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.816 110.2 55.9 -62.5 -26.7 4.6 -3.7 -34.5 26 27 A E H < S+ 0 0 109 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.951 115.2 34.5 -69.3 -50.0 2.6 -1.7 -36.9 27 28 A L H < S+ 0 0 46 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.755 140.9 17.0 -76.1 -27.1 3.6 1.7 -35.5 28 29 A S >< - 0 0 6 -4,-2.8 3,-3.4 -5,-0.2 -1,-0.3 -0.535 63.9-178.7-148.2 74.8 7.1 0.5 -34.6 29 30 A P T 3 S+ 0 0 100 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.613 88.1 56.5 -51.0 -11.1 8.0 -2.7 -36.5 30 31 A N T 3 S+ 0 0 97 2,-0.1 -5,-0.1 -5,-0.0 -3,-0.0 0.449 77.1 114.0-103.3 -4.3 11.3 -2.4 -34.6 31 32 A I < - 0 0 14 -3,-3.4 2,-0.4 -7,-0.2 -28,-0.2 -0.336 67.7-123.2 -64.3 153.5 9.9 -2.3 -31.1 32 33 A K E -a 3 0A 123 -30,-2.4 -28,-3.3 2,-0.0 2,-0.3 -0.863 28.4-164.2-101.0 132.8 10.9 -5.4 -29.0 33 34 A I E +a 4 0A 39 -2,-0.4 2,-0.3 -30,-0.2 -28,-0.2 -0.891 13.5 178.8-119.8 150.9 8.1 -7.4 -27.5 34 35 A I E -a 5 0A 56 -30,-1.4 -28,-2.7 -2,-0.3 2,-0.2 -0.922 13.3-157.6-151.8 120.9 8.1 -10.0 -24.7 35 36 A R E +a 6 0A 74 -2,-0.3 2,-0.3 -30,-0.2 -28,-0.2 -0.674 12.3 178.4-103.0 155.7 4.9 -11.8 -23.4 36 37 A K E -a 7 0A 66 -30,-1.8 -28,-1.6 -2,-0.2 2,-0.4 -0.933 11.7-157.0-155.3 129.2 4.1 -13.5 -20.2 37 38 A T E -a 8 0A 3 242,-0.3 -28,-0.2 -2,-0.3 246,-0.2 -0.922 12.0-177.9-113.1 132.9 0.8 -15.1 -19.3 38 39 A V E -a 9 0A 0 -30,-2.4 -28,-1.4 -2,-0.4 -27,-0.4 -0.748 41.3 -98.9-120.2 170.3 -0.3 -15.7 -15.7 39 40 A P S S- 0 0 6 0, 0.0 -28,-1.6 0, 0.0 -29,-0.9 0.961 85.6 -37.0 -55.1 -56.1 -3.4 -17.3 -14.2 40 41 A G S >> S- 0 0 9 -31,-0.2 3,-2.4 -30,-0.2 4,-0.5 -0.848 76.5 -51.4-155.0-170.0 -5.3 -14.1 -13.5 41 42 A I G >4 S+ 0 0 20 1,-0.3 3,-1.4 -2,-0.3 -1,-0.0 0.818 121.1 49.9 -38.8 -54.8 -5.7 -10.5 -12.4 42 43 A K G 34 S+ 0 0 29 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.550 104.5 60.6 -72.1 -3.7 -3.9 -10.7 -9.1 43 44 A D G <> S+ 0 0 13 -3,-2.4 4,-0.9 1,-0.1 -1,-0.3 0.545 86.5 79.2 -99.1 -5.2 -0.9 -12.4 -10.7 44 45 A L H S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.901 108.0 38.1 -45.4 -57.5 1.7 -7.0 -10.7 46 47 A V H > S+ 0 0 0 -4,-0.3 4,-2.5 2,-0.2 5,-0.2 0.820 116.1 53.7 -68.7 -29.3 4.8 -9.1 -10.0 47 48 A A H X S+ 0 0 0 -4,-0.9 4,-1.8 2,-0.2 -1,-0.2 0.917 111.1 46.1 -69.3 -42.5 4.9 -10.4 -13.5 48 49 A C H X S+ 0 0 0 -4,-3.3 4,-2.3 1,-0.2 -2,-0.2 0.924 113.7 49.5 -64.0 -42.6 4.8 -6.8 -14.8 49 50 A K H X S+ 0 0 11 -4,-2.6 4,-2.6 -5,-0.3 5,-0.3 0.912 108.7 51.4 -64.5 -41.8 7.5 -5.9 -12.2 50 51 A K H X>S+ 0 0 49 -4,-2.5 4,-3.1 1,-0.2 5,-0.7 0.882 110.4 50.3 -63.1 -37.4 9.8 -8.8 -13.2 51 52 A L H X5S+ 0 0 2 -4,-1.8 6,-1.9 3,-0.2 4,-1.3 0.942 112.6 45.8 -66.4 -44.9 9.5 -7.8 -16.8 52 53 A L H <5S+ 0 0 2 -4,-2.3 -2,-0.2 4,-0.2 -1,-0.2 0.898 127.7 27.2 -64.7 -40.4 10.4 -4.1 -16.1 53 54 A E H <5S+ 0 0 87 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.731 131.4 32.0 -95.3 -28.1 13.3 -5.0 -13.8 54 55 A E H <5S+ 0 0 88 -4,-3.1 -3,-0.2 -5,-0.3 -2,-0.1 0.630 123.9 38.0-108.4 -16.6 14.5 -8.4 -15.0 55 56 A E S <> S- 0 0 49 1,-0.2 3,-2.2 3,-0.1 4,-1.0 -0.222 83.9-121.1 -56.0 141.3 -19.4 -10.6 -9.1 70 71 A E H 3> S+ 0 0 115 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.748 116.7 64.7 -56.4 -21.1 -18.6 -7.7 -6.7 71 72 A K H 3> S+ 0 0 74 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.829 98.1 53.7 -70.5 -29.2 -15.9 -10.1 -5.4 72 73 A D H <> S+ 0 0 45 -3,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.774 103.7 56.2 -73.1 -26.8 -14.4 -9.7 -8.8 73 74 A K H X S+ 0 0 92 -4,-1.0 4,-2.3 2,-0.2 -2,-0.2 0.844 107.1 48.9 -73.1 -34.3 -14.5 -5.9 -8.4 74 75 A V H X S+ 0 0 61 -4,-1.5 4,-2.5 2,-0.2 5,-0.2 0.941 110.7 49.1 -70.0 -47.1 -12.5 -6.2 -5.2 75 76 A C H X S+ 0 0 43 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.919 111.2 51.1 -57.9 -43.2 -9.9 -8.5 -6.8 76 77 A A H X S+ 0 0 5 -4,-2.0 4,-3.2 1,-0.2 5,-0.2 0.952 109.9 49.4 -57.6 -51.4 -9.6 -6.0 -9.7 77 78 A H H X S+ 0 0 33 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.871 112.5 47.5 -55.6 -41.7 -9.1 -3.1 -7.2 78 79 A E H X S+ 0 0 3 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.907 112.5 49.5 -68.8 -40.3 -6.4 -5.1 -5.4 79 80 A A H X S+ 0 0 0 -4,-2.9 4,-2.0 -5,-0.2 -2,-0.2 0.923 110.0 50.7 -63.2 -45.5 -4.8 -6.0 -8.7 80 81 A S H X S+ 0 0 4 -4,-3.2 4,-2.2 1,-0.2 -1,-0.2 0.862 107.2 54.2 -61.1 -37.9 -4.8 -2.4 -9.9 81 82 A L H X S+ 0 0 23 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.886 106.9 51.8 -63.2 -38.1 -3.2 -1.3 -6.6 82 83 A G H X S+ 0 0 0 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.909 108.7 50.5 -65.0 -40.7 -0.4 -3.8 -7.3 83 84 A L H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.887 108.6 52.2 -63.9 -38.7 0.1 -2.3 -10.7 84 85 A M H X S+ 0 0 6 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.947 112.7 45.2 -62.8 -46.5 0.3 1.2 -9.2 85 86 A L H X S+ 0 0 36 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.858 107.1 56.8 -65.6 -38.8 2.9 0.1 -6.8 86 87 A A H X S+ 0 0 0 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.908 109.0 48.7 -60.0 -41.0 5.0 -1.8 -9.3 87 88 A Q H >X>S+ 0 0 5 -4,-1.7 4,-2.6 1,-0.2 3,-0.9 0.932 110.3 48.8 -64.3 -48.0 5.3 1.4 -11.3 88 89 A L H 3<5S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.834 111.0 52.3 -63.8 -28.8 6.3 3.6 -8.4 89 90 A M H 3<5S+ 0 0 79 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.643 122.2 29.1 -81.7 -14.8 8.9 1.0 -7.4 90 91 A T H <<5S- 0 0 22 -3,-0.9 -2,-0.2 -4,-0.8 -1,-0.2 0.499 95.7-129.6-119.8 -13.1 10.5 0.9 -10.9 91 92 A N T <5S+ 0 0 25 -4,-2.6 2,-0.4 1,-0.3 -3,-0.2 0.850 72.0 117.9 61.7 32.7 9.7 4.4 -12.2 92 93 A K < - 0 0 65 -5,-0.9 -1,-0.3 -6,-0.2 -2,-0.2 -0.981 67.5-110.1-131.8 143.6 8.3 2.8 -15.3 93 94 A H - 0 0 18 -35,-0.4 -33,-1.7 -2,-0.4 2,-0.5 -0.427 20.6-164.9 -74.5 144.7 4.8 3.0 -16.7 94 95 A I E -c 60 0A 1 -35,-0.2 2,-0.8 -2,-0.1 -33,-0.2 -0.973 16.1-144.4-129.6 109.9 2.4 0.0 -16.7 95 96 A I E -c 61 0A 0 -35,-2.7 -33,-2.6 -2,-0.5 2,-0.5 -0.700 15.8-144.5 -81.1 110.8 -0.6 0.6 -19.0 96 97 A E E -c 62 0A 30 -2,-0.8 2,-0.5 -35,-0.2 -33,-0.2 -0.661 18.6-177.0 -82.7 121.5 -3.5 -1.0 -17.4 97 98 A V E +c 63 0A 0 -35,-3.4 -33,-2.3 -2,-0.5 2,-0.4 -0.801 16.2 161.0-120.4 85.0 -6.0 -2.6 -19.8 98 99 A F E -c 64 0A 14 -2,-0.5 2,-0.4 -35,-0.2 -33,-0.2 -0.848 17.8-170.7-107.0 143.2 -8.9 -4.0 -17.8 99 100 A V - 0 0 0 -35,-1.6 2,-0.3 -2,-0.4 15,-0.1 -0.942 11.3-151.0-136.3 110.6 -12.3 -4.8 -19.3 100 101 A H > - 0 0 33 -2,-0.4 3,-1.8 -35,-0.2 4,-0.4 -0.618 17.6-134.3 -80.5 139.9 -15.2 -5.7 -17.0 101 102 A E G > S+ 0 0 36 -35,-1.0 3,-1.4 -2,-0.3 -1,-0.1 0.801 102.3 73.9 -62.5 -26.9 -17.7 -8.0 -18.5 102 103 A D G 3 S+ 0 0 69 1,-0.3 -1,-0.3 -35,-0.2 -35,-0.0 0.635 85.9 65.4 -60.1 -16.7 -20.4 -5.6 -17.1 103 104 A E G < S+ 0 0 78 -3,-1.8 -1,-0.3 7,-0.0 2,-0.2 0.769 94.4 64.2 -79.6 -28.1 -19.5 -3.1 -19.8 104 105 A A S < S- 0 0 16 -3,-1.4 3,-0.1 -4,-0.4 4,-0.0 -0.604 70.8-143.5 -96.0 158.9 -20.7 -5.3 -22.7 105 106 A K S S- 0 0 173 1,-0.2 2,-0.3 -2,-0.2 -1,-0.1 0.437 86.6 -11.7 -97.5 -0.7 -24.3 -6.3 -23.3 106 107 A D S > S- 0 0 59 -5,-0.1 4,-2.0 1,-0.1 -1,-0.2 -0.945 80.8 -88.5-179.1 174.3 -23.0 -9.7 -24.6 107 108 A D H > S+ 0 0 74 -2,-0.3 4,-3.8 2,-0.2 5,-0.4 0.896 119.2 65.5 -66.5 -43.5 -19.8 -11.4 -25.6 108 109 A K H > S+ 0 0 171 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.936 114.4 32.9 -41.8 -54.4 -20.2 -10.2 -29.2 109 110 A E H > S+ 0 0 65 2,-0.2 4,-3.2 1,-0.2 -1,-0.3 0.809 114.8 59.4 -73.9 -33.4 -19.7 -6.7 -27.8 110 111 A L H X S+ 0 0 3 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.929 106.8 47.0 -63.3 -45.1 -17.3 -7.8 -25.0 111 112 A D H X S+ 0 0 63 -4,-3.8 4,-1.9 2,-0.2 5,-0.2 0.908 115.6 46.1 -62.1 -42.7 -14.9 -9.3 -27.5 112 113 A W H X S+ 0 0 146 -4,-1.4 4,-2.6 -5,-0.4 5,-0.2 0.952 113.7 48.2 -64.3 -50.9 -15.1 -6.1 -29.6 113 114 A L H X S+ 0 0 24 -4,-3.2 4,-2.4 1,-0.2 -2,-0.2 0.888 111.9 48.0 -58.3 -45.1 -14.7 -3.8 -26.7 114 115 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.932 114.6 44.8 -65.2 -47.4 -11.8 -5.5 -25.1 115 116 A K H X S+ 0 0 63 -4,-1.9 4,-2.7 -5,-0.2 5,-0.2 0.904 113.9 50.5 -63.7 -41.2 -9.8 -5.7 -28.3 116 117 A R H X S+ 0 0 72 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.914 113.2 45.5 -64.0 -42.5 -10.6 -2.1 -29.2 117 118 A R H X S+ 0 0 64 -4,-2.4 4,-2.0 -5,-0.2 -2,-0.2 0.904 112.8 50.5 -69.0 -39.4 -9.5 -0.9 -25.8 118 119 A A H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.939 112.3 47.1 -61.8 -47.9 -6.3 -3.0 -25.9 119 120 A E H X S+ 0 0 51 -4,-2.7 4,-1.1 1,-0.2 -2,-0.2 0.897 111.1 51.2 -62.3 -42.1 -5.4 -1.7 -29.4 120 121 A E H X S+ 0 0 54 -4,-2.3 4,-1.2 1,-0.2 3,-0.2 0.872 110.9 47.2 -65.9 -36.4 -6.1 2.0 -28.4 121 122 A H H X S+ 0 0 43 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.759 102.9 64.8 -75.5 -22.4 -3.9 1.7 -25.3 122 123 A A H X S+ 0 0 0 -4,-1.4 4,-1.8 1,-0.2 -1,-0.2 0.846 101.4 50.0 -65.4 -32.2 -1.3 0.1 -27.5 123 124 A E H X S+ 0 0 45 -4,-1.1 4,-2.9 -3,-0.2 -1,-0.2 0.868 106.5 55.6 -71.5 -36.1 -1.2 3.4 -29.3 124 125 A N H X S+ 0 0 24 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.877 105.7 51.0 -64.4 -35.3 -0.8 5.2 -26.0 125 126 A V H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.945 110.6 50.1 -64.7 -45.3 2.2 3.0 -25.3 126 127 A Y H X>S+ 0 0 63 -4,-1.8 4,-2.8 1,-0.2 5,-0.6 0.941 111.9 46.2 -54.9 -53.9 3.6 4.0 -28.6 127 128 A Y H X5S+ 0 0 42 -4,-2.9 4,-0.8 1,-0.2 -1,-0.2 0.872 111.1 52.2 -59.4 -40.6 3.1 7.7 -28.0 128 129 A L H <5S+ 0 0 34 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.884 115.2 43.4 -64.1 -37.3 4.6 7.5 -24.5 129 130 A L H <5S+ 0 0 34 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.870 135.9 4.9 -76.3 -41.7 7.7 5.8 -26.0 130 131 A F H <5S+ 0 0 75 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.1 0.725 132.7 34.3-119.5 -29.5 8.3 7.9 -29.1 131 132 A K >X< + 0 0 91 -4,-0.8 3,-2.3 -5,-0.6 4,-0.8 -0.341 52.9 155.1-128.1 56.9 5.9 10.9 -29.2 132 133 A P H 3> S+ 0 0 51 0, 0.0 4,-1.1 0, 0.0 491,-0.3 0.778 75.0 67.2 -51.1 -24.7 5.2 12.1 -25.7 133 134 A E H 3> S+ 0 0 138 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.818 90.0 61.4 -67.6 -32.3 4.5 15.5 -27.3 134 135 A Y H X> S+ 0 0 70 -3,-2.3 4,-1.3 1,-0.2 3,-0.6 0.954 99.8 53.6 -59.8 -50.7 1.4 14.1 -29.1 135 136 A L H 3< S+ 0 0 1 -4,-0.8 3,-0.3 1,-0.3 -1,-0.2 0.855 106.3 53.4 -52.7 -38.8 -0.4 13.3 -25.8 136 137 A T H >< S+ 0 0 42 -4,-1.1 3,-1.6 1,-0.2 -1,-0.3 0.869 103.1 56.9 -65.4 -36.4 0.2 16.9 -24.6 137 138 A R H << S+ 0 0 194 -4,-1.5 -1,-0.2 -3,-0.6 -2,-0.2 0.822 111.0 44.8 -63.0 -29.5 -1.4 18.2 -27.8 138 139 A M T >< S+ 0 0 37 -4,-1.3 3,-1.9 -3,-0.3 5,-0.3 0.243 82.8 143.0 -98.4 11.3 -4.5 16.1 -26.8 139 140 A A T < S- 0 0 10 -3,-1.6 457,-0.3 1,-0.3 462,-0.1 -0.307 77.5 -2.5 -55.6 125.8 -4.4 17.2 -23.1 140 141 A G T 3 S+ 0 0 12 455,-2.8 -1,-0.3 460,-0.1 461,-0.2 0.699 91.1 124.0 65.7 22.5 -7.9 17.6 -21.8 141 142 A K S < S- 0 0 148 -3,-1.9 458,-0.2 455,-0.2 -2,-0.1 0.220 82.6-109.9 -97.4 16.8 -9.7 16.8 -25.1 142 143 A G - 0 0 7 456,-2.7 4,-0.4 1,-0.2 2,-0.4 0.873 46.4-177.1 61.5 43.4 -11.6 14.0 -23.4 143 144 A L + 0 0 70 453,-3.6 -1,-0.2 -5,-0.3 -3,-0.1 -0.581 40.4 101.5 -74.6 129.2 -10.0 11.0 -25.1 144 145 A R S S- 0 0 96 -2,-0.4 -1,-0.2 482,-0.0 453,-0.1 -0.051 106.1 -52.3-163.0 -77.7 -11.7 7.8 -23.9 145 146 A Q 0 0 104 -3,-0.3 -2,-0.1 1,-0.1 -3,-0.0 0.054 360.0 360.0-162.8 8.4 -14.1 6.4 -26.5 146 147 A G 0 0 91 -4,-0.4 -1,-0.1 0, 0.0 0, 0.0 -0.673 360.0 360.0-163.5 360.0 -16.0 9.6 -27.0 147 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 148 2 B T 0 0 112 0, 0.0 2,-0.3 0, 0.0 30,-0.1 0.000 360.0 360.0 360.0 -87.4 16.3 -27.6 -8.3 149 3 B K - 0 0 66 28,-0.2 30,-1.9 55,-0.0 2,-0.4 -0.707 360.0-162.2 -95.4 143.1 12.9 -25.8 -7.8 150 4 B K E -d 179 0B 42 -2,-0.3 55,-2.8 53,-0.2 56,-1.2 -0.978 3.6-163.6-127.7 134.0 11.2 -25.3 -4.5 151 5 B V E -de 180 206B 0 28,-2.7 30,-1.9 -2,-0.4 2,-0.4 -0.928 9.1-149.5-115.5 136.2 7.6 -24.4 -3.6 152 6 B G E -de 181 207B 0 54,-2.6 56,-2.9 -2,-0.4 2,-0.5 -0.866 8.3-161.2-104.5 138.3 6.4 -23.1 -0.3 153 7 B I E -de 182 208B 0 28,-2.7 30,-1.7 -2,-0.4 2,-0.5 -0.968 7.8-175.7-123.8 116.2 2.9 -23.9 0.9 154 8 B V E +de 183 209B 0 54,-2.9 56,-3.2 -2,-0.5 30,-0.2 -0.950 12.4 158.6-116.9 123.1 1.3 -21.8 3.6 155 9 B D E -d 184 0B 6 28,-1.6 30,-2.3 -2,-0.5 2,-0.3 -0.631 26.2-117.7-128.1-172.3 -2.1 -22.6 5.1 156 10 B T E -d 185 0B 0 28,-0.2 427,-3.0 -2,-0.2 31,-0.2 -0.850 15.4-136.4-133.3 164.5 -4.1 -21.9 8.2 157 11 B T S S+ 0 0 36 28,-1.4 427,-0.2 29,-0.8 30,-0.2 0.595 105.3 64.4 -89.1 -15.8 -5.8 -23.4 11.3 158 12 B F S S+ 0 0 117 28,-1.5 -1,-0.1 27,-0.4 29,-0.1 0.871 79.6 97.2 -74.6 -38.3 -8.8 -21.2 10.7 159 13 B A - 0 0 2 27,-0.2 55,-0.0 51,-0.2 -4,-0.0 -0.201 66.6-148.5 -53.8 139.6 -9.7 -22.8 7.3 160 14 B R S S+ 0 0 85 425,-0.1 2,-0.4 1,-0.0 425,-0.2 0.362 80.3 56.9 -93.0 5.5 -12.4 -25.4 7.6 161 15 B V S S- 0 0 9 423,-0.1 2,-1.0 424,-0.1 423,-0.1 -0.999 81.5-126.0-139.0 138.7 -10.9 -27.4 4.7 162 16 B D + 0 0 51 -2,-0.4 4,-0.4 421,-0.2 421,-0.1 -0.736 38.1 161.2 -84.9 101.4 -7.5 -28.9 4.3 163 17 B M > + 0 0 4 -2,-1.0 4,-1.4 2,-0.1 -1,-0.2 0.676 60.3 71.3 -94.6 -19.9 -6.3 -27.6 0.9 164 18 B A H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.889 90.6 56.3 -64.3 -44.3 -2.6 -28.2 1.3 165 19 B S H > S+ 0 0 53 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.932 109.0 47.3 -55.7 -46.9 -2.6 -32.0 1.0 166 20 B I H > S+ 0 0 41 -4,-0.4 4,-1.6 2,-0.2 -1,-0.2 0.862 113.7 47.7 -63.0 -39.7 -4.3 -31.8 -2.4 167 21 B A H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.952 112.1 48.2 -66.7 -51.8 -1.9 -29.2 -3.7 168 22 B I H X S+ 0 0 23 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.907 111.1 50.9 -55.2 -46.6 1.2 -30.9 -2.5 169 23 B K H X S+ 0 0 154 -4,-2.4 4,-1.3 -5,-0.3 -1,-0.2 0.880 109.9 51.1 -60.6 -38.9 0.1 -34.3 -4.0 170 24 B K H X S+ 0 0 29 -4,-1.6 4,-2.2 -5,-0.2 -1,-0.2 0.899 111.0 47.3 -67.3 -40.9 -0.6 -32.6 -7.3 171 25 B L H X S+ 0 0 3 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.933 111.2 49.0 -66.8 -47.7 2.8 -30.9 -7.4 172 26 B K H < S+ 0 0 114 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.810 111.0 54.5 -61.8 -27.5 4.7 -34.1 -6.5 173 27 B E H < S+ 0 0 114 -4,-1.3 -2,-0.2 -5,-0.3 -1,-0.2 0.957 114.6 36.6 -69.0 -51.8 2.7 -35.8 -9.2 174 28 B L H < S+ 0 0 48 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.750 138.7 17.5 -73.6 -25.8 3.6 -33.3 -12.0 175 29 B S >< - 0 0 18 -4,-2.8 3,-2.8 -5,-0.2 -1,-0.3 -0.563 60.7-179.1-150.9 81.8 7.2 -33.0 -10.7 176 30 B P T 3 S+ 0 0 112 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.705 87.5 61.0 -54.1 -21.2 8.4 -35.7 -8.3 177 31 B N T 3 S+ 0 0 111 -3,-0.1 2,-0.3 2,-0.1 -28,-0.2 0.336 79.7 119.5 -89.5 9.6 11.7 -33.8 -8.0 178 32 B I < - 0 0 14 -3,-2.8 2,-0.4 -7,-0.2 -28,-0.2 -0.559 58.6-140.9 -78.4 134.5 9.9 -30.8 -6.6 179 33 B K E -d 150 0B 114 -30,-1.9 -28,-2.7 -2,-0.3 2,-0.4 -0.798 20.4-165.3 -94.9 137.8 10.9 -29.7 -3.1 180 34 B I E -d 151 0B 43 -2,-0.4 2,-0.4 -30,-0.2 -28,-0.2 -0.985 13.9-174.3-132.9 135.2 8.2 -28.6 -0.8 181 35 B I E -d 152 0B 43 -30,-1.9 -28,-2.7 -2,-0.4 2,-0.3 -0.990 13.0-158.9-128.5 124.4 8.1 -26.7 2.5 182 36 B R E +d 153 0B 74 -2,-0.4 2,-0.3 -30,-0.2 -28,-0.2 -0.702 12.2 177.3-103.3 155.4 4.9 -26.1 4.6 183 37 B K E -d 154 0B 62 -30,-1.7 -28,-1.6 -2,-0.3 2,-0.4 -0.934 11.9-157.4-155.7 129.3 4.0 -23.6 7.2 184 38 B T E -d 155 0B 3 391,-0.3 -28,-0.2 -2,-0.3 395,-0.2 -0.930 11.9-177.8-112.9 134.0 0.7 -23.2 9.0 185 39 B V E -d 156 0B 0 -30,-2.3 -28,-1.4 -2,-0.4 -27,-0.4 -0.767 41.1 -99.0-121.7 169.3 -0.3 -19.9 10.6 186 40 B P S S- 0 0 6 0, 0.0 -28,-1.5 0, 0.0 -29,-0.8 0.956 85.6 -36.0 -54.4 -56.8 -3.5 -19.1 12.6 187 41 B G S >> S- 0 0 10 -31,-0.2 3,-2.4 -30,-0.2 4,-0.5 -0.854 76.4 -52.7-154.6-170.8 -5.4 -17.4 9.8 188 42 B I G >4 S+ 0 0 20 1,-0.3 3,-1.4 -2,-0.3 -1,-0.0 0.818 121.2 50.2 -37.8 -54.5 -5.7 -15.2 6.7 189 43 B K G 34 S+ 0 0 31 1,-0.2 -1,-0.3 2,-0.1 4,-0.3 0.566 104.3 60.2 -72.0 -5.0 -3.9 -12.2 8.0 190 44 B D G <> S+ 0 0 13 -3,-2.4 4,-0.9 1,-0.1 -1,-0.2 0.546 86.7 79.7 -97.6 -6.5 -0.9 -14.2 9.1 191 45 B L H S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.901 107.7 38.5 -45.3 -58.3 1.6 -12.6 4.0 193 47 B V H > S+ 0 0 0 -4,-0.3 4,-2.6 1,-0.2 5,-0.2 0.826 116.1 53.5 -67.6 -29.7 4.7 -12.5 6.2 194 48 B A H X S+ 0 0 0 -4,-0.9 4,-1.7 2,-0.2 -1,-0.2 0.903 111.2 46.3 -70.3 -40.5 4.8 -16.3 6.3 195 49 B C H X S+ 0 0 0 -4,-3.1 4,-2.3 2,-0.2 -2,-0.2 0.925 113.8 49.2 -65.6 -42.1 4.8 -16.4 2.6 196 50 B K H X S+ 0 0 11 -4,-2.6 4,-2.5 -5,-0.3 5,-0.3 0.914 108.9 51.3 -64.4 -43.0 7.5 -13.6 2.4 197 51 B K H X>S+ 0 0 50 -4,-2.6 4,-3.2 1,-0.2 5,-0.7 0.878 110.4 50.4 -62.0 -37.5 9.8 -15.4 4.9 198 52 B L H X5S+ 0 0 1 -4,-1.7 6,-1.9 3,-0.2 4,-1.3 0.945 112.6 45.8 -66.6 -45.2 9.5 -18.6 2.8 199 53 B L H <5S+ 0 0 1 -4,-2.3 -2,-0.2 4,-0.2 -1,-0.2 0.880 127.6 27.6 -64.4 -39.5 10.4 -16.7 -0.4 200 54 B E H <5S+ 0 0 86 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.730 131.4 31.7 -95.7 -28.3 13.3 -14.8 1.2 201 55 B E H <5S+ 0 0 86 -4,-3.2 -3,-0.2 -5,-0.3 -2,-0.1 0.609 123.9 38.1-109.0 -16.3 14.5 -17.1 4.0 202 56 B E S < S- 0 0 38 1,-0.1 4,-0.8 3,-0.1 5,-0.1 -0.014 80.5-121.6 -49.5 156.1 -19.4 -12.2 7.6 217 71 B E H > S+ 0 0 124 2,-0.2 4,-0.9 1,-0.2 -1,-0.1 0.695 116.2 60.0 -74.2 -16.8 -18.8 -8.9 5.7 218 72 B K H >> S+ 0 0 93 2,-0.2 4,-2.2 1,-0.2 3,-2.1 0.974 98.2 54.7 -69.1 -57.2 -16.0 -8.4 8.2 219 73 B D H 3> S+ 0 0 44 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.759 103.2 58.4 -46.2 -29.1 -14.3 -11.6 7.0 220 74 B K H 3X S+ 0 0 80 -4,-0.8 4,-2.2 2,-0.2 -1,-0.3 0.858 106.5 47.6 -71.2 -34.4 -14.5 -10.0 3.5 221 75 B V H X>S+ 0 0 5 -4,-1.7 4,-2.4 1,-0.2 5,-0.9 0.920 110.3 48.7 -65.3 -47.2 5.3 -10.5 -4.2 235 89 B L H 3<5S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.819 111.1 52.0 -64.5 -28.8 6.3 -7.1 -5.3 236 90 B M H 3<5S+ 0 0 78 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.637 122.3 29.7 -81.5 -15.0 8.9 -6.9 -2.6 237 91 B T H <<5S- 0 0 24 -3,-0.8 -2,-0.2 -4,-0.7 -1,-0.2 0.516 95.4-129.7-119.2 -12.8 10.5 -10.3 -3.6 238 92 B N T <5S+ 0 0 24 -4,-2.4 2,-0.3 1,-0.3 -3,-0.2 0.853 72.1 117.7 61.0 34.1 9.8 -10.4 -7.3 239 93 B K < - 0 0 62 -5,-0.9 -1,-0.3 -6,-0.2 -2,-0.2 -0.982 67.6-109.7-133.2 143.1 8.3 -13.9 -6.8 240 94 B H - 0 0 17 -35,-0.4 -33,-1.7 -2,-0.3 2,-0.5 -0.436 20.7-165.1 -74.4 142.9 4.8 -15.1 -7.4 241 95 B I E -f 207 0B 1 -35,-0.2 2,-0.8 -2,-0.1 -33,-0.2 -0.967 16.1-144.8-127.6 109.3 2.4 -16.1 -4.6 242 96 B I E -f 208 0B 1 -35,-2.6 -33,-2.4 -2,-0.5 2,-0.5 -0.689 15.9-143.9 -80.0 110.8 -0.5 -18.1 -5.9 243 97 B E E -f 209 0B 30 -2,-0.8 2,-0.6 -35,-0.2 -33,-0.2 -0.637 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1,-0.1 -1,-0.2 -0.972 82.6 -76.8-180.0 178.1 -23.0 -26.6 2.1 254 108 B D H > S+ 0 0 96 -2,-0.3 4,-2.8 2,-0.2 5,-0.3 0.894 121.3 55.2 -61.4 -44.6 -20.0 -28.4 3.7 255 109 B K H > S+ 0 0 177 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.953 114.9 39.9 -54.5 -52.3 -19.9 -31.2 1.2 256 110 B E H > S+ 0 0 67 1,-0.2 4,-3.3 2,-0.2 -1,-0.2 0.851 112.7 56.0 -66.0 -36.3 -19.6 -28.8 -1.7 257 111 B L H X S+ 0 0 4 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.927 108.7 46.9 -62.6 -44.8 -17.3 -26.4 0.2 258 112 B D H X S+ 0 0 60 -4,-2.8 4,-1.9 2,-0.2 5,-0.2 0.914 115.6 46.0 -63.1 -43.4 -14.8 -29.2 0.8 259 113 B W H X S+ 0 0 158 -4,-2.0 4,-2.6 -5,-0.3 5,-0.2 0.946 113.8 48.4 -63.1 -50.4 -15.0 -30.3 -2.9 260 114 B L H X S+ 0 0 34 -4,-3.3 4,-2.3 2,-0.2 5,-0.2 0.899 111.9 47.8 -58.4 -46.6 -14.7 -26.8 -4.2 261 115 B A H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.931 114.6 45.2 -64.1 -46.9 -11.7 -25.8 -2.0 262 116 B K H X S+ 0 0 62 -4,-1.9 4,-2.7 -5,-0.2 -2,-0.2 0.904 113.5 50.1 -64.6 -41.0 -9.7 -28.9 -2.8 263 117 B R H X S+ 0 0 78 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