==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-JAN-09 3FRI . COMPND 2 MOLECULE: 16S RRNA METHYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR E.SCHMITT,M.GALIMAND,M.PANVERT,M.DUPECHEZ,P.COURVALIN, . 242 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11369.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 180 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 8.3 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 . 1 0.4 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 . 14 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 34.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 1 1 1 1 3 0 1 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 0 2 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 PARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 1 1 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 0 0 0 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 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 N > 0 0 110 0, 0.0 4,-1.7 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0-179.3 23.3 41.4 9.4 2 3 A I H > + 0 0 37 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.899 360.0 54.6 -58.7 -43.1 22.4 38.7 11.9 3 4 A N H > S+ 0 0 78 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.861 106.1 51.6 -60.6 -37.9 23.8 40.6 14.9 4 5 A D H > S+ 0 0 101 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.911 111.0 48.0 -64.9 -42.3 21.7 43.7 14.1 5 6 A A H X S+ 0 0 9 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.862 109.4 53.9 -65.7 -36.6 18.5 41.6 14.0 6 7 A L H X S+ 0 0 15 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.930 108.1 49.7 -62.8 -47.1 19.5 39.9 17.3 7 8 A T H X S+ 0 0 98 -4,-2.1 4,-0.7 1,-0.2 -2,-0.2 0.903 111.7 48.4 -59.0 -43.6 19.8 43.3 18.9 8 9 A S H >X S+ 0 0 79 -4,-2.0 3,-0.6 1,-0.2 4,-0.5 0.910 112.5 47.3 -65.9 -42.8 16.4 44.5 17.6 9 10 A I H >< S+ 0 0 0 -4,-2.3 3,-1.2 1,-0.2 6,-0.4 0.905 109.1 53.4 -66.7 -40.5 14.6 41.3 18.7 10 11 A L H 3< S+ 0 0 43 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.651 102.2 60.6 -69.3 -14.8 16.2 41.3 22.2 11 12 A A H << S+ 0 0 68 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.635 85.6 96.5 -85.4 -15.7 15.0 44.9 22.7 12 13 A S S 4 S+ 0 0 12 -6,-0.4 3,-1.8 -3,-0.3 -1,-0.2 0.342 85.8 107.2-116.6 8.3 11.6 38.4 23.7 16 17 A R T 3< S+ 0 0 142 -4,-1.2 -1,-0.1 1,-0.3 -2,-0.1 0.732 83.5 50.6 -59.8 -22.3 13.9 40.4 25.9 17 18 A A T 3 S+ 0 0 29 -4,-0.3 116,-2.7 -3,-0.2 -1,-0.3 0.447 86.3 112.2 -96.4 0.1 14.2 37.5 28.4 18 19 A L B < S-A 132 0A 9 -3,-1.8 114,-0.2 114,-0.2 -3,-0.1 -0.418 82.2 -95.8 -75.1 148.7 15.1 34.9 25.7 19 20 A C >> - 0 0 2 112,-2.1 4,-1.6 1,-0.2 3,-0.7 -0.425 31.8-136.3 -59.7 125.7 18.6 33.3 25.6 20 21 A P H 3> S+ 0 0 56 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.879 103.4 57.6 -55.8 -37.7 20.5 35.4 23.0 21 22 A D H 3> S+ 0 0 69 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.854 103.7 53.9 -61.5 -34.4 22.0 32.2 21.5 22 23 A T H <> S+ 0 0 0 -3,-0.7 4,-2.3 2,-0.2 5,-0.2 0.935 109.5 46.0 -65.1 -46.5 18.4 30.9 20.9 23 24 A V H X S+ 0 0 0 -4,-1.6 4,-2.5 1,-0.2 -2,-0.2 0.913 115.6 47.2 -62.9 -42.9 17.4 34.1 19.0 24 25 A R H X S+ 0 0 89 -4,-2.6 4,-3.4 2,-0.2 5,-0.3 0.921 109.0 54.9 -64.8 -43.2 20.7 33.9 17.0 25 26 A R H X S+ 0 0 25 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.947 113.7 39.9 -54.7 -52.6 20.2 30.2 16.2 26 27 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.914 116.0 51.5 -63.8 -44.1 16.7 30.8 14.7 27 28 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.925 109.8 49.8 -58.8 -47.1 17.8 34.0 13.0 28 29 A T H X S+ 0 0 64 -4,-3.4 4,-1.2 1,-0.2 -1,-0.2 0.914 111.0 48.5 -61.4 -42.5 20.8 32.2 11.4 29 30 A E H < S+ 0 0 69 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.878 114.1 46.9 -66.0 -35.5 18.7 29.3 10.2 30 31 A E H >< S+ 0 0 15 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.838 105.2 58.8 -73.9 -33.4 16.2 31.8 8.7 31 32 A W H >< S+ 0 0 68 -4,-2.5 3,-1.0 1,-0.3 -1,-0.2 0.813 94.4 66.5 -64.8 -28.7 18.9 33.9 7.1 32 33 A G T 3< S+ 0 0 54 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.576 89.3 66.6 -68.1 -7.6 19.9 30.7 5.2 33 34 A R T < S- 0 0 140 -3,-1.8 -1,-0.3 -4,-0.0 -2,-0.1 -0.170 106.1-134.4-104.0 36.6 16.5 31.1 3.6 34 35 A H < + 0 0 160 -3,-1.0 2,-0.3 1,-0.1 -2,-0.1 0.596 44.8 149.8 4.3 111.3 17.9 34.3 1.9 35 36 A K - 0 0 110 -4,-0.2 -1,-0.1 3,-0.0 -2,-0.0 -0.948 56.6 -76.4-152.3 167.5 15.2 37.0 2.3 36 37 A S >> - 0 0 58 -2,-0.3 4,-1.9 1,-0.2 3,-1.1 -0.557 55.0-114.9 -67.3 132.8 14.5 40.7 2.7 37 38 A P H 3> S+ 0 0 81 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.805 117.5 63.8 -39.4 -34.8 15.4 41.3 6.4 38 39 A K H 3> S+ 0 0 170 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.968 107.4 40.2 -52.8 -57.7 11.8 42.1 6.8 39 40 A Q H <> S+ 0 0 94 -3,-1.1 4,-2.4 2,-0.2 5,-0.2 0.900 114.8 51.6 -57.4 -51.7 10.8 38.6 5.9 40 41 A T H X S+ 0 0 2 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.940 112.0 45.2 -55.2 -53.6 13.7 36.9 7.8 41 42 A V H X S+ 0 0 25 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.918 113.2 50.4 -59.3 -45.1 12.9 38.7 11.1 42 43 A E H X S+ 0 0 103 -4,-2.2 4,-1.7 -5,-0.3 -1,-0.2 0.876 110.5 49.5 -62.9 -36.5 9.2 38.1 10.8 43 44 A A H X S+ 0 0 33 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.841 111.0 51.3 -70.1 -32.3 9.8 34.4 10.2 44 45 A A H X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.2 3,-0.3 0.926 108.1 50.1 -70.2 -44.8 12.1 34.3 13.2 45 46 A R H X S+ 0 0 66 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.879 106.4 56.4 -61.0 -38.5 9.6 35.9 15.5 46 47 A T H X S+ 0 0 110 -4,-1.7 4,-0.6 -5,-0.2 -1,-0.2 0.863 112.0 43.0 -61.9 -35.0 7.0 33.4 14.4 47 48 A R H < S+ 0 0 57 -4,-1.2 3,-0.4 -3,-0.3 -2,-0.2 0.883 109.6 55.5 -77.6 -39.8 9.3 30.6 15.5 48 49 A L H >< S+ 0 0 3 -4,-2.7 3,-1.7 1,-0.2 4,-0.4 0.815 93.7 73.0 -62.7 -29.6 10.4 32.3 18.7 49 50 A H H 3< S+ 0 0 105 -4,-1.8 5,-0.5 1,-0.3 3,-0.4 0.924 107.1 30.7 -51.8 -51.9 6.7 32.5 19.8 50 51 A G T 3< S+ 0 0 51 -4,-0.6 -1,-0.3 -3,-0.4 -2,-0.2 -0.044 92.3 100.1-101.6 35.8 6.3 28.8 20.5 51 52 A I S < S+ 0 0 20 -3,-1.7 -1,-0.2 1,-0.1 -2,-0.1 0.725 88.9 34.0 -90.3 -23.1 9.9 28.1 21.6 52 53 A C S S- 0 0 14 -3,-0.4 -2,-0.1 -4,-0.4 -1,-0.1 0.581 134.6 -64.0-108.0 -13.4 9.4 28.2 25.3 53 54 A G 0 0 54 -4,-0.2 -3,-0.1 3,-0.1 28,-0.1 0.433 360.0 360.0 142.5 5.7 5.9 26.7 25.8 54 55 A A 0 0 83 -5,-0.5 -4,-0.1 2,-0.1 3,-0.1 0.744 360.0 360.0 52.2 360.0 3.5 29.2 24.1 55 ! 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 56 57 A V 0 0 46 0, 0.0 -2,-0.1 0, 0.0 -4,-0.1 0.000 360.0 360.0 360.0 97.2 4.9 30.9 29.4 57 58 A T > - 0 0 60 -3,-0.1 4,-2.1 -4,-0.1 3,-0.2 -0.828 360.0-109.9-122.5 161.3 4.1 34.6 29.7 58 59 A P H > S+ 0 0 75 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.818 122.0 55.7 -60.0 -26.0 5.5 37.3 31.9 59 60 A E H > S+ 0 0 125 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.895 104.6 49.9 -72.0 -41.6 2.2 37.2 33.7 60 61 A S H > S+ 0 0 29 -3,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.903 111.8 48.6 -64.7 -40.3 2.5 33.5 34.5 61 62 A L H X S+ 0 0 19 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.881 107.9 54.6 -66.6 -39.6 6.0 33.9 35.9 62 63 A K H X S+ 0 0 139 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.947 110.2 46.3 -57.7 -50.7 5.0 36.9 38.0 63 64 A A H X S+ 0 0 41 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.897 109.5 55.7 -58.9 -42.4 2.2 34.7 39.6 64 65 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.953 109.9 44.4 -56.3 -52.4 4.7 31.9 40.1 65 66 A A H X S+ 0 0 31 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.852 111.3 55.2 -61.0 -36.6 7.1 34.1 42.0 66 67 A A H X S+ 0 0 63 -4,-2.2 4,-0.7 2,-0.2 -1,-0.2 0.936 110.3 44.2 -62.1 -48.1 4.2 35.5 44.1 67 68 A A H ><>S+ 0 0 5 -4,-2.6 5,-2.6 1,-0.2 3,-0.7 0.892 114.5 51.1 -63.5 -39.7 3.1 32.1 45.1 68 69 A L H ><5S+ 0 0 5 -4,-2.4 3,-2.1 -5,-0.3 -2,-0.2 0.909 104.2 56.0 -65.0 -42.7 6.7 31.1 45.8 69 70 A S H 3<5S+ 0 0 99 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.689 107.2 52.3 -63.3 -17.2 7.2 34.2 48.0 70 71 A A T <<5S- 0 0 82 -4,-0.7 -1,-0.3 -3,-0.7 -2,-0.2 0.334 121.1-108.7 -99.6 4.9 4.3 33.1 50.1 71 72 A G T < 5S+ 0 0 51 -3,-2.1 2,-1.1 1,-0.2 -3,-0.2 0.638 77.5 133.8 78.4 14.4 5.7 29.6 50.6 72 73 A D >< + 0 0 71 -5,-2.6 4,-1.8 1,-0.2 3,-0.2 -0.660 19.3 164.4 -99.4 78.5 3.2 27.9 48.3 73 74 A V H > S+ 0 0 7 -2,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.876 73.5 56.6 -61.0 -41.2 5.5 25.7 46.2 74 75 A K H > S+ 0 0 99 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.882 106.9 49.0 -60.0 -39.3 2.6 23.6 44.9 75 76 A K H > S+ 0 0 115 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.908 109.2 52.4 -67.7 -40.7 0.9 26.7 43.5 76 77 A A H >< S+ 0 0 0 -4,-1.8 3,-1.3 1,-0.2 -2,-0.2 0.917 107.8 51.9 -60.5 -42.9 4.1 27.9 41.8 77 78 A L H >< S+ 0 0 2 -4,-2.3 3,-1.0 1,-0.3 -1,-0.2 0.810 104.3 57.2 -63.5 -29.9 4.4 24.5 40.1 78 79 A S H 3< S+ 0 0 36 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.615 93.6 70.4 -77.1 -11.1 0.8 24.7 38.8 79 80 A L T << S+ 0 0 56 -3,-1.3 2,-0.4 -4,-0.6 -1,-0.2 0.310 91.4 62.8 -89.9 8.5 1.8 28.0 37.1 80 81 A H S X> S- 0 0 13 -3,-1.0 4,-2.5 1,-0.1 3,-0.6 -0.982 82.1-136.2-133.4 120.2 3.9 26.2 34.5 81 82 A A H 3> S+ 0 0 76 -2,-0.4 4,-1.9 1,-0.2 5,-0.1 0.799 100.1 50.7 -42.6 -45.4 2.2 23.8 32.2 82 83 A S H 34 S+ 0 0 7 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.892 115.8 39.2 -67.6 -41.2 4.8 21.1 32.3 83 84 A T H X> S+ 0 0 5 -3,-0.6 4,-0.7 -6,-0.2 3,-0.5 0.806 111.8 59.4 -78.3 -28.4 5.1 20.9 36.1 84 85 A K H >< S+ 0 0 127 -4,-2.5 3,-1.2 1,-0.2 4,-0.4 0.939 102.9 50.2 -64.7 -47.3 1.3 21.4 36.5 85 86 A E T 3< S+ 0 0 59 -4,-1.9 148,-0.4 1,-0.3 -1,-0.2 0.641 110.0 53.5 -67.5 -10.9 0.5 18.2 34.6 86 87 A R T X4 S+ 0 0 8 -3,-0.5 3,-0.9 -4,-0.3 4,-0.4 0.574 83.1 91.8 -96.5 -14.1 3.0 16.3 36.7 87 88 A L G X< S+ 0 0 52 -3,-1.2 3,-1.2 -4,-0.7 4,-0.3 0.857 75.9 60.5 -48.4 -50.0 1.4 17.4 40.0 88 89 A A G 3 S+ 0 0 91 -4,-0.4 -1,-0.2 1,-0.3 3,-0.1 0.816 121.8 21.5 -52.3 -39.3 -1.0 14.4 40.5 89 90 A E G <> S+ 0 0 87 -3,-0.9 4,-2.8 -4,-0.2 -1,-0.3 0.103 84.4 127.2-119.6 23.3 1.8 11.8 40.5 90 91 A L H <> S+ 0 0 23 -3,-1.2 4,-2.0 -4,-0.4 5,-0.2 0.889 78.7 40.4 -45.0 -55.9 4.8 14.0 41.5 91 92 A D H > S+ 0 0 103 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.839 112.8 55.0 -67.5 -32.7 5.9 11.9 44.5 92 93 A T H > S+ 0 0 68 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.926 108.2 51.8 -64.8 -41.5 5.3 8.6 42.6 93 94 A L H X S+ 0 0 1 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.942 113.3 40.6 -59.6 -53.2 7.5 9.9 39.9 94 95 A Y H X S+ 0 0 1 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.767 108.6 59.9 -72.6 -22.5 10.5 10.8 42.1 95 96 A D H < S+ 0 0 92 -4,-1.9 -1,-0.2 -5,-0.2 4,-0.2 0.886 110.2 46.1 -67.3 -35.1 10.1 7.7 44.3 96 97 A F H >< S+ 0 0 23 -4,-1.6 3,-0.6 2,-0.2 4,-0.4 0.918 115.2 43.7 -70.3 -47.3 10.7 5.9 41.0 97 98 A I H 3< S+ 0 0 13 -4,-2.1 4,-0.4 1,-0.2 3,-0.2 0.882 123.8 36.5 -67.1 -39.5 13.6 8.0 39.9 98 99 A F T 3< S+ 0 0 15 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.239 85.8 105.7 -98.3 11.4 15.3 7.9 43.3 99 100 A S S < S+ 0 0 82 -3,-0.6 -1,-0.2 -4,-0.2 -2,-0.1 0.968 90.8 29.8 -55.2 -57.9 14.3 4.4 44.3 100 101 A A S S+ 0 0 90 -4,-0.4 2,-0.4 1,-0.2 -2,-0.1 0.993 135.9 0.0 -66.1 -65.2 17.8 3.0 43.8 101 102 A E - 0 0 102 -4,-0.4 -1,-0.2 0, 0.0 -2,-0.0 -0.967 59.4-139.5-131.6 145.0 20.0 6.0 44.6 102 103 A T - 0 0 99 -2,-0.4 -4,-0.1 -3,-0.1 -3,-0.0 -0.913 30.6-131.6-104.4 114.5 19.3 9.5 45.7 103 104 A P - 0 0 13 0, 0.0 21,-0.3 0, 0.0 3,-0.2 -0.265 9.9-153.9 -64.8 145.0 21.6 12.0 43.9 104 105 A R S S+ 0 0 150 1,-0.3 21,-2.5 19,-0.1 2,-0.4 0.836 89.1 29.4 -84.5 -38.3 23.5 14.6 45.8 105 106 A R E S-b 125 0B 36 19,-0.2 62,-2.0 18,-0.1 63,-1.4 -0.989 73.2-170.4-128.2 128.5 23.8 16.8 42.7 106 107 A V E -bc 126 168B 0 19,-2.6 21,-2.3 -2,-0.4 2,-0.6 -0.949 14.2-149.4-121.5 137.3 21.2 16.9 39.9 107 108 A L E -bc 127 169B 0 61,-2.7 63,-3.4 -2,-0.4 2,-0.8 -0.922 11.1-161.1-104.0 120.6 21.4 18.6 36.5 108 109 A D E > -bc 128 170B 0 19,-2.8 21,-1.8 -2,-0.6 3,-0.8 -0.875 9.9-155.2-105.8 101.3 18.0 19.6 35.3 109 110 A I E 3 S+b 129 0B 0 61,-2.3 63,-0.4 -2,-0.8 21,-0.1 -0.680 80.6 0.1 -83.1 119.8 18.3 20.1 31.5 110 111 A A T 3 S- 0 0 0 19,-1.6 -1,-0.3 -2,-0.5 20,-0.2 0.964 90.6-175.4 63.8 54.7 15.7 22.5 30.0 111 112 A C X + 0 0 0 18,-1.8 3,-1.9 -3,-0.8 19,-0.1 0.665 9.9 179.8 -59.7 -27.6 14.5 22.7 33.6 112 113 A G T 3 S- 0 0 0 1,-0.3 -1,-0.2 133,-0.2 -2,-0.1 -0.366 73.9 -39.9 54.9-135.8 11.4 24.9 33.4 113 114 A L T > S+ 0 0 0 1,-0.2 3,-1.9 -36,-0.1 4,-0.4 0.353 110.3 109.0-103.2 6.3 10.1 25.2 37.0 114 115 A N T X> + 0 0 0 -3,-1.9 3,-1.9 1,-0.3 4,-1.2 0.785 60.6 75.9 -53.0 -32.2 10.8 21.6 37.9 115 116 A P H 3> S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 0.818 85.8 64.4 -51.9 -28.7 13.7 22.5 40.2 116 117 A L H <> S+ 0 0 0 -3,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.844 100.5 51.0 -62.5 -33.2 11.2 23.7 42.8 117 118 A A H <4 S+ 0 0 3 -3,-1.9 4,-0.5 -4,-0.4 -1,-0.2 0.810 106.2 55.3 -72.9 -31.1 10.0 20.0 43.0 118 119 A L H ><>S+ 0 0 0 -4,-1.2 5,-2.0 2,-0.2 3,-0.7 0.879 103.3 55.8 -69.6 -36.6 13.6 19.0 43.6 119 120 A Y H ><5S+ 0 0 66 -4,-1.9 3,-2.4 1,-0.3 -2,-0.2 0.957 105.9 49.2 -59.1 -51.4 13.9 21.4 46.5 120 121 A E T 3<5S+ 0 0 89 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.629 105.5 61.0 -64.3 -11.9 10.9 19.8 48.3 121 122 A R T < 5S- 0 0 62 -3,-0.7 -1,-0.3 -4,-0.5 -2,-0.2 0.331 116.5-115.6 -94.9 5.0 12.6 16.5 47.6 122 123 A G T < 5 + 0 0 65 -3,-2.4 2,-0.4 1,-0.2 -3,-0.2 0.709 51.4 169.1 70.3 21.5 15.6 17.5 49.7 123 124 A I < - 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0 0 17 -5,-3.2 2,-2.1 -6,-0.2 -1,-0.2 -0.799 48.6-123.8 -96.6 130.1 19.5 26.1 48.8 149 150 A D E +d 125 0B 71 -25,-0.7 -23,-2.4 -2,-0.5 2,-0.4 -0.477 57.9 141.4 -74.1 78.7 22.4 25.4 46.5 150 151 A F E -d 126 0B 0 -2,-2.1 2,-0.4 -25,-0.2 -23,-0.2 -0.967 27.8-172.2-121.0 138.0 20.6 26.0 43.2 151 152 A T E -d 127 0B 66 -25,-2.0 -23,-2.5 -2,-0.4 2,-0.4 -0.995 7.3-155.2-132.5 136.9 22.1 27.6 40.1 152 153 A F E -d 128 0B 28 -2,-0.4 2,-0.4 -25,-0.2 -23,-0.2 -0.914 4.7-165.4-113.5 139.5 20.4 28.6 36.9 153 154 A A E -d 129 0B 21 -25,-2.2 -23,-1.8 -2,-0.4 2,-1.3 -0.985 19.9-140.4-125.6 126.8 22.0 29.0 33.5 154 155 A L E +d 130 0B 57 -2,-0.4 2,-0.4 -25,-0.2 -23,-0.2 -0.734 53.1 146.9 -82.8 97.7 20.4 30.8 30.5 155 156 A Q - 0 0 33 -25,-1.7 2,-0.7 -2,-1.3 -45,-0.1 -0.991 49.1-145.2-145.2 132.9 21.7 28.3 28.0 156 157 A D >> - 0 0 0 -2,-0.4 4,-1.9 1,-0.1 3,-1.6 -0.852 16.0-153.0 -93.2 116.8 20.5 26.8 24.7 157 158 A V T 34 S+ 0 0 12 -2,-0.7 -1,-0.1 1,-0.3 -48,-0.0 0.650 92.5 62.6 -68.6 -13.5 21.7 23.2 24.6 158 159 A L T 34 S+ 0 0 33 1,-0.1 -1,-0.3 2,-0.1 -2,-0.0 0.628 112.4 38.0 -83.2 -12.0 21.7 23.2 20.8 159 160 A C T <4 S+ 0 0 59 -3,-1.6 -2,-0.2 1,-0.3 -1,-0.1 0.711 134.4 9.8-105.4 -30.6 24.4 25.9 21.0 160 161 A A S < S- 0 0 37 -4,-1.9 -1,-0.3 0, 0.0 3,-0.1 -0.889 76.3-130.5-154.1 117.9 26.4 24.8 24.0 161 162 A P - 0 0 75 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.257 44.1 -82.9 -67.8 157.0 26.1 21.5 25.8 162 163 A P - 0 0 5 0, 0.0 32,-0.3 0, 0.0 -53,-0.0 -0.431 41.7-169.6 -60.4 125.4 25.7 21.4 29.6 163 164 A A + 0 0 85 -2,-0.2 30,-0.0 -3,-0.1 0, 0.0 0.632 50.3 102.5 -94.5 -15.3 29.3 21.6 31.0 164 165 A E - 0 0 75 1,-0.1 30,-0.7 31,-0.0 2,-0.3 -0.207 64.0-133.3 -68.5 158.4 28.5 20.8 34.6 165 166 A A B +h 194 0C 51 28,-0.1 2,-0.3 -59,-0.0 30,-0.2 -0.814 33.9 154.2-110.4 151.8 29.1 17.5 36.3 166 167 A G - 0 0 14 28,-1.9 -60,-0.2 -2,-0.3 31,-0.2 -0.969 52.2-111.4-163.9 176.7 26.6 15.6 38.4 167 168 A D S S+ 0 0 73 -62,-2.0 30,-0.6 1,-0.3 2,-0.3 0.797 101.9 13.1 -87.5 -33.1 25.3 12.3 39.8 168 169 A L E -ce 106 197B 16 -63,-1.4 -61,-2.7 28,-0.1 2,-0.4 -0.999 63.3-153.7-146.5 143.5 22.1 12.4 37.8 169 170 A A E -ce 107 198B 0 28,-1.4 30,-2.3 -2,-0.3 2,-0.5 -0.947 10.4-149.8-117.5 139.1 20.7 14.4 34.9 170 171 A L E +ce 108 199B 0 -63,-3.4 -61,-2.3 -2,-0.4 2,-0.3 -0.936 15.2 177.6-108.9 129.2 17.0 15.0 34.3 171 172 A I E + e 0 200B 0 28,-2.9 30,-2.0 -2,-0.5 2,-0.5 -0.700 16.0 174.8-130.6 78.3 15.9 15.4 30.7 172 173 A F E - 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G 0 223B 51 -45,-2.4 2,-0.3 -2,-0.4 -18,-0.2 -0.891 18.8-162.2-100.9 119.2 26.0 6.0 30.7 242 250 A N 0 0 61 -20,-3.3 -45,-0.0 -2,-0.6 -2,-0.0 -0.763 360.0 360.0-102.4 147.0 29.1 3.7 30.7 243 251 A G 0 0 151 -2,-0.3 -1,-0.1 -47,-0.0 -21,-0.0 0.461 360.0 360.0 138.9 360.0 32.6 4.8 29.8 244 ! 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 0.0 245 260 A X 0 0 27 0, 0.0 -133,-0.2 0, 0.0 -134,-0.1 0.000 360.0 360.0 360.0 360.0 10.8 20.7 32.3