==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 26-MAR-10 3MC4 . COMPND 2 MOLECULE: WW/RSP5/WWP DOMAIN:BACTERIAL TRANSFERASE HEXAPEPT . SOURCE 2 ORGANISM_SCIENTIFIC: BRUCELLA MELITENSIS BIOVAR ABORTUS; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIONS DISEASE (S . 482 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20174.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 379 78.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 74 15.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 2 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 . 43 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 172 35.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.1 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 2 2 0 0 0 0 0 2 4 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 18 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 0 0 PARALLEL BRIDGES PER LADDER . 1 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 4 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 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 0 103 0, 0.0 2,-0.2 0, 0.0 390,-0.1 0.000 360.0 360.0 360.0 -31.0 37.3 5.6 66.6 2 3 A A + 0 0 2 1,-0.1 3,-0.5 388,-0.1 388,-0.2 -0.789 360.0 3.8-176.8 147.4 40.3 6.6 68.7 3 4 A G S > S- 0 0 12 -2,-0.2 3,-2.1 1,-0.2 4,-0.2 -0.134 107.0 -23.8 79.1-164.3 41.6 6.6 72.3 4 5 A L G > S+ 0 0 16 386,-0.3 3,-1.8 1,-0.3 -1,-0.2 0.737 120.7 75.5 -59.8 -24.5 40.1 5.3 75.6 5 6 A D G 3 S+ 0 0 72 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.709 80.0 72.4 -56.6 -28.4 36.5 5.5 74.2 6 7 A Q G < S+ 0 0 98 -3,-2.1 2,-0.6 2,-0.0 -1,-0.3 0.738 76.4 88.5 -60.0 -27.1 37.2 2.4 72.2 7 8 A V < + 0 0 85 -3,-1.8 3,-0.1 -4,-0.2 309,-0.0 -0.687 48.2 146.7 -75.8 114.7 37.1 0.3 75.5 8 9 A D > + 0 0 23 -2,-0.6 4,-2.2 1,-0.1 5,-0.2 -0.461 14.0 167.8-153.9 65.4 33.4 -0.5 75.7 9 10 A P H > S+ 0 0 82 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.794 78.4 57.6 -58.5 -30.5 33.0 -3.9 77.3 10 11 A I H > S+ 0 0 16 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.947 110.2 41.1 -67.4 -47.9 29.2 -3.4 77.8 11 12 A W H > S+ 0 0 20 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.888 115.0 51.2 -63.5 -45.1 28.6 -2.8 74.1 12 13 A H H X S+ 0 0 105 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.930 111.7 47.7 -62.1 -41.3 30.8 -5.6 73.0 13 14 A S H X S+ 0 0 42 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.925 110.9 51.7 -64.9 -41.7 29.1 -8.0 75.4 14 15 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.899 109.2 49.6 -59.0 -43.5 25.7 -6.9 74.2 15 16 A R H X S+ 0 0 77 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.889 112.7 47.2 -66.9 -39.4 26.7 -7.5 70.6 16 17 A A H X S+ 0 0 62 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.927 111.3 51.5 -65.0 -42.2 28.0 -10.9 71.4 17 18 A E H X S+ 0 0 37 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.855 111.4 47.1 -65.7 -37.6 24.8 -11.7 73.4 18 19 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.826 110.4 52.8 -72.0 -34.2 22.5 -10.6 70.5 19 20 A E H X S+ 0 0 67 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.982 112.7 44.1 -65.1 -52.5 24.6 -12.7 68.0 20 21 A E H X S+ 0 0 124 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.859 113.3 51.3 -59.2 -40.7 24.2 -15.8 70.2 21 22 A A H X S+ 0 0 23 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.898 107.6 50.9 -66.7 -40.7 20.5 -15.2 70.8 22 23 A T H < S+ 0 0 17 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.920 110.7 51.8 -63.9 -39.8 19.6 -14.8 67.0 23 24 A R H < S+ 0 0 177 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.897 112.2 45.2 -59.6 -41.1 21.5 -18.1 66.4 24 25 A N H < S+ 0 0 134 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.779 131.0 19.8 -79.2 -24.9 19.4 -19.8 69.1 25 26 A D >< - 0 0 75 -4,-1.9 3,-2.1 -5,-0.1 -1,-0.3 -0.646 67.8-179.0-146.8 80.4 16.1 -18.3 68.0 26 27 A P G > S+ 0 0 94 0, 0.0 3,-2.2 0, 0.0 4,-0.3 0.732 76.7 69.8 -62.9 -26.3 16.3 -17.1 64.3 27 28 A V G > S+ 0 0 121 1,-0.3 3,-0.5 2,-0.1 4,-0.3 0.808 94.5 58.9 -57.0 -29.2 12.7 -15.9 64.2 28 29 A L G <> S+ 0 0 67 -3,-2.1 4,-2.7 1,-0.2 -1,-0.3 0.296 78.5 103.5 -80.7 11.0 13.8 -13.1 66.6 29 30 A G H <> S+ 0 0 12 -3,-2.2 4,-2.8 2,-0.2 5,-0.4 0.883 74.7 50.6 -62.6 -47.5 16.4 -12.1 63.9 30 31 A A H <> S+ 0 0 81 -3,-0.5 4,-2.4 -4,-0.3 5,-0.2 0.932 115.0 46.4 -53.8 -49.3 14.5 -9.0 62.6 31 32 A F H > S+ 0 0 54 -4,-0.3 4,-2.1 2,-0.2 5,-0.3 0.956 116.7 40.7 -57.2 -54.4 14.2 -7.9 66.2 32 33 A L H X>S+ 0 0 1 -4,-2.7 4,-2.1 2,-0.2 5,-2.1 0.833 118.5 46.0 -73.3 -34.2 17.8 -8.5 67.3 33 34 A Y H <>S+ 0 0 81 -4,-2.8 5,-2.9 3,-0.2 6,-0.3 0.940 115.8 44.8 -71.8 -43.4 19.4 -7.2 64.1 34 35 A A H <5S+ 0 0 42 -4,-2.4 -2,-0.2 -5,-0.4 -3,-0.2 0.857 123.2 36.7 -68.8 -34.0 17.3 -4.1 63.9 35 36 A T H <5S- 0 0 4 -4,-2.1 14,-0.2 -5,-0.2 -2,-0.2 0.843 138.3 -2.0 -88.9 -37.4 17.7 -3.3 67.6 36 37 A I T ><5S+ 0 0 0 -4,-2.1 3,-1.5 -5,-0.3 -3,-0.2 0.760 122.6 48.6-119.0 -62.1 21.3 -4.4 68.2 37 38 A L T 3 S- 0 0 30 1,-0.1 4,-2.2 -5,-0.1 5,-0.1 -0.996 70.3-111.4-161.1 161.1 26.7 2.1 68.8 42 43 A L H > S+ 0 0 0 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.873 116.8 58.8 -63.7 -41.4 25.1 1.3 72.1 43 44 A E H > S+ 0 0 21 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.959 108.9 44.0 -48.3 -54.2 23.7 4.9 72.2 44 45 A E H > S+ 0 0 45 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.884 111.1 54.8 -65.2 -35.1 21.9 4.2 68.9 45 46 A A H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.931 111.2 44.2 -61.9 -45.7 20.7 0.8 70.0 46 47 A V H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 5,-0.2 0.925 114.9 48.2 -70.3 -44.0 19.1 2.3 73.2 47 48 A M H X S+ 0 0 0 -4,-2.6 4,-3.0 -5,-0.2 5,-0.3 0.957 112.5 49.6 -56.4 -50.6 17.5 5.3 71.2 48 49 A H H X S+ 0 0 25 -4,-2.9 4,-2.4 -5,-0.2 -2,-0.2 0.925 110.5 49.1 -56.8 -48.4 16.2 3.0 68.6 49 50 A R H X S+ 0 0 42 -4,-2.5 4,-2.3 -14,-0.2 -1,-0.2 0.947 115.3 43.6 -57.1 -45.8 14.6 0.6 71.2 50 51 A I H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.915 112.0 51.5 -73.6 -40.0 12.9 3.4 73.1 51 52 A A H X S+ 0 0 1 -4,-3.0 4,-2.0 -5,-0.2 -1,-0.2 0.892 111.2 50.7 -60.9 -39.0 11.7 5.2 70.0 52 53 A E H < S+ 0 0 92 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.891 111.4 46.5 -63.4 -42.9 10.2 1.9 68.8 53 54 A R H < S+ 0 0 71 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.894 121.7 36.6 -67.0 -39.8 8.4 1.2 72.1 54 55 A L H < S+ 0 0 4 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.665 88.6 119.0 -87.5 -20.7 7.0 4.8 72.3 55 56 A G < + 0 0 21 -4,-2.0 5,-0.2 -5,-0.2 3,-0.1 -0.173 36.4 164.5 -51.6 138.5 6.4 5.3 68.5 56 57 A H - 0 0 68 3,-1.5 3,-0.2 1,-0.1 -2,-0.0 -0.966 54.5-103.7-150.6 154.2 2.8 6.0 67.6 57 58 A P S S+ 0 0 127 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.920 122.6 59.5 -43.7 -42.6 0.7 7.3 64.7 58 59 A D S S+ 0 0 124 1,-0.3 2,-0.3 -3,-0.1 -3,-0.1 0.907 130.0 2.3 -55.6 -49.7 0.4 10.5 66.7 59 60 A V S S- 0 0 34 -3,-0.2 -3,-1.5 -5,-0.2 -1,-0.3 -0.910 89.6-131.0-145.3 110.4 4.3 10.9 66.8 60 61 A S > - 0 0 46 -3,-0.3 4,-1.9 -2,-0.3 5,-0.2 -0.103 17.6-115.3 -69.8 151.7 6.4 8.4 64.9 61 62 A A H > S+ 0 0 14 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.884 116.2 58.0 -40.7 -47.9 9.4 6.4 66.1 62 63 A D H > S+ 0 0 84 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.948 105.5 46.9 -58.1 -47.8 11.5 8.2 63.5 63 64 A I H > S+ 0 0 72 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.914 114.7 48.2 -59.8 -37.0 10.7 11.7 64.9 64 65 A L H X S+ 0 0 2 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.895 112.0 49.5 -69.7 -42.0 11.4 10.4 68.5 65 66 A R H X S+ 0 0 38 -4,-3.1 4,-2.3 2,-0.2 -1,-0.2 0.876 109.6 51.4 -62.8 -40.4 14.7 8.9 67.2 66 67 A Q H X S+ 0 0 103 -4,-2.7 4,-1.6 -5,-0.2 -2,-0.2 0.898 112.2 46.7 -64.8 -39.0 15.6 12.2 65.5 67 68 A T H X S+ 0 0 9 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.867 108.7 54.3 -70.8 -42.6 15.0 14.1 68.7 68 69 A F H X S+ 0 0 2 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.919 106.0 54.3 -54.1 -46.5 16.9 11.5 70.8 69 70 A D H X S+ 0 0 60 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.927 107.3 49.8 -51.9 -45.8 19.9 12.2 68.4 70 71 A T H X S+ 0 0 60 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.886 109.9 52.0 -64.9 -37.8 19.6 15.9 69.1 71 72 A M H X S+ 0 0 4 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.936 109.0 48.2 -65.1 -46.9 19.7 15.2 72.8 72 73 A L H < S+ 0 0 35 -4,-2.7 6,-0.2 2,-0.2 -2,-0.2 0.955 110.0 53.4 -57.5 -47.3 22.8 13.0 72.6 73 74 A E H < S+ 0 0 141 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.934 117.0 37.2 -52.1 -48.3 24.5 15.7 70.6 74 75 A A H < S+ 0 0 53 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.737 124.5 42.5 -73.3 -25.7 23.7 18.3 73.3 75 76 A N >< + 0 0 31 -4,-2.3 3,-2.8 -5,-0.2 4,-0.3 -0.534 62.0 166.9-125.0 65.8 24.3 15.9 76.2 76 77 A P T > S+ 0 0 36 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.782 71.4 71.5 -56.5 -26.8 27.4 13.9 75.4 77 78 A E T >> S+ 0 0 61 1,-0.3 4,-2.4 2,-0.2 3,-0.9 0.669 73.4 85.6 -61.4 -18.6 27.5 12.6 79.0 78 79 A W H <> S+ 0 0 6 -3,-2.8 4,-2.5 1,-0.2 5,-0.3 0.839 78.4 67.5 -51.9 -31.9 24.5 10.4 78.2 79 80 A S H <> S+ 0 0 29 -3,-1.6 4,-0.9 -4,-0.3 -1,-0.2 0.907 108.8 35.2 -52.6 -44.2 27.0 7.8 76.9 80 81 A H H <> S+ 0 0 40 -3,-0.9 4,-2.6 282,-0.6 5,-0.3 0.919 114.9 55.6 -75.7 -46.8 28.3 7.3 80.3 81 82 A V H X S+ 0 0 20 -4,-2.4 4,-2.5 281,-0.3 73,-0.6 0.914 109.0 48.0 -52.8 -48.2 24.9 7.7 82.2 82 83 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.824 111.1 51.3 -66.3 -31.9 23.3 5.0 80.1 83 84 A R H X S+ 0 0 37 -4,-0.9 4,-2.8 -5,-0.3 -1,-0.2 0.903 111.6 45.0 -72.7 -39.6 26.1 2.6 80.6 84 85 A V H X S+ 0 0 37 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.877 111.7 53.4 -75.1 -31.6 26.1 3.0 84.4 85 86 A D H X S+ 0 0 0 -4,-2.5 4,-1.4 -5,-0.3 -2,-0.2 0.930 111.5 47.2 -59.3 -45.5 22.3 2.7 84.4 86 87 A I H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 3,-0.3 0.942 110.9 51.3 -56.4 -52.0 22.9 -0.5 82.5 87 88 A Q H X S+ 0 0 58 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.885 103.7 58.8 -54.7 -41.0 25.5 -1.6 85.0 88 89 A A H X S+ 0 0 2 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.900 106.8 46.9 -55.3 -47.6 23.2 -0.9 87.9 89 90 A V H X S+ 0 0 6 -4,-1.4 4,-1.9 -3,-0.3 -1,-0.2 0.957 113.4 48.1 -60.6 -50.5 20.7 -3.4 86.5 90 91 A Y H < S+ 0 0 95 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.838 118.7 39.5 -56.7 -44.7 23.3 -6.1 85.9 91 92 A D H < S+ 0 0 104 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.837 121.1 40.7 -75.2 -37.9 24.9 -5.7 89.4 92 93 A R H < S+ 0 0 84 -4,-2.3 -2,-0.2 -5,-0.3 -3,-0.2 0.669 105.1 63.1 -96.2 -15.8 21.7 -5.3 91.4 93 94 A D >< - 0 0 15 -4,-1.9 3,-1.0 -5,-0.2 -1,-0.2 -0.904 51.2-169.8-115.1 108.9 19.3 -7.8 89.9 94 95 A P T 3 S+ 0 0 125 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.727 80.5 75.8 -64.1 -19.1 20.0 -11.6 90.0 95 96 A A T 3 S+ 0 0 71 1,-0.1 2,-0.5 2,-0.0 -5,-0.1 0.808 95.3 47.7 -62.3 -29.4 17.0 -12.2 87.6 96 97 A Y < - 0 0 89 -3,-1.0 -3,-0.2 -7,-0.2 -1,-0.1 -0.955 56.1-178.5-124.5 125.2 18.9 -11.0 84.5 97 98 A S + 0 0 93 -2,-0.5 2,-0.4 4,-0.0 -1,-0.1 0.260 61.1 76.1-107.3 5.9 22.5 -12.2 83.6 98 99 A R > - 0 0 86 1,-0.1 3,-1.2 -81,-0.0 -84,-0.0 -0.967 68.9-140.7-125.8 141.5 23.0 -10.1 80.4 99 100 A F T 3> S+ 0 0 24 -2,-0.4 4,-0.8 1,-0.3 -1,-0.1 0.786 105.5 63.2 -59.5 -31.5 23.8 -6.4 79.8 100 101 A M H 3> S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.709 84.2 79.5 -66.8 -24.4 21.4 -6.7 76.8 101 102 A D H <>>S+ 0 0 8 -3,-1.2 4,-2.4 1,-0.2 5,-0.9 0.919 96.2 39.6 -58.0 -48.5 18.5 -7.4 79.1 102 103 A P H >5S+ 0 0 1 0, 0.0 4,-0.5 0, 0.0 8,-0.2 0.935 114.8 54.9 -68.3 -36.6 17.7 -3.9 80.2 103 104 A V H <5S+ 0 0 1 -4,-0.8 -2,-0.2 1,-0.2 -3,-0.1 0.916 121.6 26.9 -58.1 -48.1 18.4 -2.5 76.8 104 105 A L H <5S+ 0 0 1 -4,-2.6 -1,-0.2 1,-0.0 -3,-0.2 0.890 136.3 12.4 -81.9 -36.9 15.9 -4.8 75.0 105 106 A Y H <5S+ 0 0 94 -4,-2.4 2,-0.7 -5,-0.3 -2,-0.1 0.738 87.5 93.1-122.4 -35.8 13.3 -5.6 77.7 106 107 A L X< - 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0 0 39 -2,-0.3 4,-2.0 -3,-0.3 5,-0.2 -0.048 16.1-116.5 -63.6 158.5 44.9 22.6 93.8 300 62 B A H > S+ 0 0 18 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.858 116.7 55.6 -51.7 -39.4 47.4 20.0 92.6 301 63 B D H > S+ 0 0 80 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.902 104.6 50.8 -68.2 -37.2 46.0 17.5 95.1 302 64 B I H > S+ 0 0 69 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.924 110.3 50.1 -64.5 -42.3 42.5 17.9 93.7 303 65 B L H X S+ 0 0 3 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.890 112.2 48.0 -59.8 -39.9 43.8 17.3 90.1 304 66 B R H X S+ 0 0 53 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.868 110.7 50.4 -71.8 -37.7 45.7 14.1 91.4 305 67 B Q H X S+ 0 0 118 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.941 113.4 46.5 -63.4 -47.7 42.6 12.8 93.2 306 68 B T H X S+ 0 0 9 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.914 110.5 52.0 -60.2 -45.0 40.6 13.3 90.1 307 69 B F H X S+ 0 0 1 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.872 105.7 55.6 -57.2 -43.3 43.3 11.7 87.9 308 70 B D H X S+ 0 0 60 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.900 104.9 53.3 -59.8 -39.0 43.3 8.6 90.3 309 71 B T H X S+ 0 0 64 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.905 109.1 49.0 -62.4 -38.4 39.6 8.2 89.7 310 72 B M H X S+ 0 0 0 -4,-1.6 4,-1.3 2,-0.2 -2,-0.2 0.905 110.1 50.2 -69.2 -40.6 40.2 8.2 85.9 311 73 B L H < S+ 0 0 33 -4,-2.5 3,-0.4 2,-0.2 -2,-0.2 0.926 109.5 51.2 -58.0 -46.7 43.0 5.6 86.1 312 74 B E H < S+ 0 0 84 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.916 115.2 42.4 -60.2 -42.4 40.8 3.3 88.2 313 75 B A H < S+ 0 0 56 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.634 120.6 45.3 -77.7 -17.9 38.0 3.6 85.6 314 76 B N >< + 0 0 21 -4,-1.3 3,-2.0 -3,-0.4 4,-0.3 -0.561 56.0 162.1-129.6 69.5 40.5 3.3 82.7 315 77 B P T > S+ 0 0 95 0, 0.0 3,-0.9 0, 0.0 4,-0.5 0.713 75.7 68.7 -59.6 -21.3 43.0 0.4 83.3 316 78 B E T >> S+ 0 0 84 1,-0.2 4,-2.2 2,-0.2 3,-0.6 0.724 80.3 77.6 -66.6 -23.9 43.8 0.5 79.5 317 79 B W H <> S+ 0 0 0 -3,-2.0 4,-3.5 1,-0.2 5,-0.3 0.854 82.8 66.4 -52.5 -34.0 45.4 3.9 80.1 318 80 B S H <> S+ 0 0 33 -3,-0.9 4,-1.5 -4,-0.3 -1,-0.2 0.913 107.2 38.6 -55.1 -46.9 48.4 1.9 81.6 319 81 B H H <> S+ 0 0 110 -3,-0.6 4,-2.4 -4,-0.5 5,-0.2 0.957 116.2 50.8 -65.1 -50.7 49.1 0.5 78.1 320 82 B V H X S+ 0 0 9 -4,-2.2 4,-2.6 1,-0.2 73,-0.5 0.930 108.1 54.2 -57.2 -44.4 48.3 3.8 76.3 321 83 B L H X S+ 0 0 0 -4,-3.5 4,-2.2 1,-0.2 -1,-0.2 0.916 109.9 46.9 -54.3 -47.6 50.6 5.8 78.6 322 84 B R H X S+ 0 0 44 -4,-1.5 4,-2.5 -5,-0.3 -1,-0.2 0.876 110.9 50.4 -67.6 -36.6 53.5 3.4 77.8 323 85 B V H X S+ 0 0 35 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.913 110.9 50.4 -67.5 -39.7 52.9 3.5 74.0 324 86 B D H X S+ 0 0 0 -4,-2.6 4,-1.2 -5,-0.2 -2,-0.2 0.879 112.3 46.8 -63.4 -41.7 52.9 7.3 74.2 325 87 B I H X S+ 0 0 0 -4,-2.2 4,-1.8 -5,-0.2 3,-0.3 0.910 110.4 51.8 -64.7 -45.0 56.1 7.4 76.1 326 88 B Q H X S+ 0 0 62 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.799 103.8 61.2 -60.8 -30.8 57.8 4.9 73.7 327 89 B A H X S+ 0 0 3 -4,-1.7 4,-2.3 2,-0.2 5,-0.3 0.888 105.1 45.4 -65.3 -41.0 56.7 7.2 70.9 328 90 B V H X S+ 0 0 8 -4,-1.2 4,-2.4 -3,-0.3 -2,-0.2 0.933 113.8 49.2 -66.5 -48.4 58.8 10.0 72.2 329 91 B Y H < S+ 0 0 90 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.921 118.1 39.4 -55.7 -46.8 61.8 7.8 72.8 330 92 B D H < S+ 0 0 113 -4,-2.7 -2,-0.2 1,-0.1 -1,-0.2 0.889 123.4 37.1 -73.3 -40.0 61.6 6.2 69.3 331 93 B R H < S+ 0 0 82 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.764 104.0 69.1 -90.6 -27.2 60.8 9.4 67.3 332 94 B D >< - 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