==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 20-SEP-06 2J5Y . COMPND 2 MOLECULE: PEPTOSTREPTOCOCCAL ALBUMIN-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PEPTOSTREPTOCOCCUS MAGNUS; . AUTHOR S.LEJON,J.F.CRAMER,P.A.NORDBERG,T.LUNDQVIST,K.VALEGARD . 122 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8184.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 88 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 4 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 60.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.6 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 0 0 0 0 2 0 0 0 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 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 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 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 -7 A L 0 0 171 0, 0.0 16,-0.0 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 148.3 12.9 5.8 34.2 2 -6 A V - 0 0 39 11,-0.2 2,-0.1 1,-0.1 15,-0.1 -0.627 360.0-118.8 -71.2 129.3 13.1 8.5 31.5 3 -5 A P - 0 0 111 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 -0.512 25.0-110.4 -76.7 167.8 12.3 11.6 33.5 4 -4 A R - 0 0 128 -2,-0.1 2,-0.1 2,-0.0 6,-0.1 -0.793 25.7-152.7-102.8 115.7 9.2 13.6 32.6 5 -3 A G > - 0 0 25 -2,-0.6 3,-1.5 1,-0.1 8,-0.1 -0.341 34.0-107.5 -76.4 164.5 9.6 17.0 31.0 6 -2 A S T 3 S+ 0 0 134 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.651 117.4 69.3 -64.7 -13.9 6.9 19.7 31.5 7 -1 A H T 3 S+ 0 0 150 2,-0.1 2,-0.5 1,-0.0 -1,-0.3 0.281 89.4 83.5 -79.0 4.6 6.2 19.0 27.7 8 0 A M < - 0 0 21 -3,-1.5 -1,-0.0 4,-0.0 -4,-0.0 -0.929 65.9-142.1-139.1 119.3 4.8 15.6 28.4 9 1 A T > - 0 0 68 -2,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.255 36.4-110.9 -65.3 162.8 1.6 14.0 29.4 10 2 A I H > S+ 0 0 80 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.925 121.2 53.5 -56.1 -42.5 1.6 11.0 31.8 11 3 A D H > S+ 0 0 128 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.906 110.0 44.9 -62.1 -45.3 0.5 8.9 28.9 12 4 A Q H > S+ 0 0 106 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.882 113.0 52.6 -62.4 -41.5 3.3 10.1 26.6 13 5 A W H X S+ 0 0 54 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.912 108.8 48.4 -62.6 -44.2 5.8 9.6 29.4 14 6 A L H X S+ 0 0 93 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.878 112.0 50.3 -64.0 -38.4 4.7 6.0 30.1 15 7 A L H X S+ 0 0 32 -4,-1.9 4,-2.3 -5,-0.2 -2,-0.2 0.925 110.5 49.0 -63.7 -44.7 4.9 5.2 26.4 16 8 A K H X S+ 0 0 91 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.911 111.9 49.5 -63.1 -41.3 8.5 6.7 26.2 17 9 A N H X S+ 0 0 9 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.907 108.8 52.1 -64.3 -40.3 9.5 4.6 29.2 18 10 A A H X S+ 0 0 18 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.909 109.3 50.9 -60.3 -41.4 8.1 1.5 27.7 19 11 A K H X S+ 0 0 30 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.943 112.1 46.1 -61.9 -48.8 10.1 2.1 24.5 20 12 A E H X S+ 0 0 81 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.910 113.2 49.0 -60.8 -42.1 13.3 2.6 26.5 21 13 A D H X S+ 0 0 99 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.873 111.3 50.0 -65.9 -39.6 12.7 -0.5 28.6 22 14 A A H X S+ 0 0 5 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.920 110.6 48.7 -63.6 -47.4 11.9 -2.6 25.5 23 15 A I H X S+ 0 0 8 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.903 110.3 52.9 -59.0 -41.0 15.1 -1.4 23.7 24 16 A A H X S+ 0 0 58 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.903 108.9 49.6 -61.0 -39.7 17.1 -2.2 26.9 25 17 A E H X S+ 0 0 84 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.922 110.3 49.6 -65.2 -42.4 15.7 -5.7 27.0 26 18 A L H <>S+ 0 0 0 -4,-2.4 5,-2.4 1,-0.2 -2,-0.2 0.916 110.6 50.7 -61.0 -43.3 16.6 -6.2 23.3 27 19 A K H ><5S+ 0 0 126 -4,-2.6 3,-1.6 1,-0.2 -1,-0.2 0.892 106.3 54.6 -61.6 -41.1 20.1 -5.0 24.0 28 20 A K H 3<5S+ 0 0 194 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.874 107.2 52.2 -61.0 -33.1 20.4 -7.5 26.9 29 21 A A T 3<5S- 0 0 45 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.408 126.3-101.5 -83.6 0.6 19.5 -10.2 24.5 30 22 A G T < 5S+ 0 0 46 -3,-1.6 2,-0.4 1,-0.3 -3,-0.2 0.544 71.7 145.1 91.6 9.7 22.2 -9.2 22.0 31 23 A I < + 0 0 12 -5,-2.4 -1,-0.3 -6,-0.1 -2,-0.1 -0.654 14.6 167.5 -81.1 131.7 20.2 -7.3 19.5 32 24 A T + 0 0 120 -2,-0.4 2,-0.7 5,-0.0 -1,-0.1 0.198 28.1 131.2-127.4 12.3 22.1 -4.3 18.1 33 25 A S > - 0 0 36 1,-0.2 4,-2.4 2,-0.1 5,-0.2 -0.581 39.2-166.5 -80.2 112.7 19.8 -3.4 15.1 34 26 A D H > S+ 0 0 113 -2,-0.7 4,-2.5 1,-0.2 -1,-0.2 0.816 91.2 61.5 -59.6 -31.8 18.9 0.3 14.8 35 27 A F H > S+ 0 0 71 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.942 107.9 42.8 -59.8 -46.5 16.2 -0.6 12.3 36 28 A Y H > S+ 0 0 38 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.915 113.6 51.1 -68.8 -44.0 14.5 -2.7 15.0 37 29 A F H X S+ 0 0 15 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.885 107.7 54.5 -58.0 -38.6 15.0 -0.1 17.7 38 30 A N H X S+ 0 0 84 -4,-2.5 4,-1.3 2,-0.2 -1,-0.2 0.879 103.3 55.6 -63.0 -37.1 13.5 2.5 15.3 39 31 A A H X S+ 0 0 16 -4,-1.5 4,-0.6 1,-0.2 3,-0.5 0.918 109.0 47.3 -62.6 -45.0 10.4 0.4 14.9 40 32 A I H >< S+ 0 0 0 -4,-1.7 3,-1.4 1,-0.2 -2,-0.2 0.934 109.4 53.8 -61.6 -42.2 9.9 0.4 18.7 41 33 A N H 3< S+ 0 0 64 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.718 106.9 52.0 -65.9 -19.4 10.4 4.1 18.8 42 34 A K H 3< S+ 0 0 123 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.532 83.8 116.7 -90.3 -9.4 7.7 4.6 16.1 43 35 A A << - 0 0 5 -3,-1.4 -24,-0.1 -4,-0.6 3,-0.1 -0.264 52.2-157.1 -63.6 149.9 5.1 2.6 18.1 44 36 A K + 0 0 170 1,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.531 69.8 38.9-109.1 -8.2 2.0 4.5 19.3 45 37 A T S > S- 0 0 54 1,-0.1 4,-2.1 -30,-0.1 3,-0.2 -0.968 76.9-120.0-136.5 156.9 0.9 2.3 22.3 46 38 A V H > S+ 0 0 52 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.870 115.5 56.3 -60.5 -38.2 2.6 0.3 25.0 47 39 A E H > S+ 0 0 136 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.861 105.3 50.7 -65.3 -36.9 1.0 -2.9 23.7 48 40 A E H > S+ 0 0 57 2,-0.2 4,-2.8 -3,-0.2 5,-0.2 0.921 110.1 50.6 -62.7 -43.1 2.5 -2.3 20.3 49 41 A V H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.943 111.4 48.4 -56.5 -46.8 5.9 -1.8 22.0 50 42 A N H X S+ 0 0 66 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.879 112.7 47.6 -61.3 -43.5 5.4 -5.1 23.9 51 43 A A H X S+ 0 0 35 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.919 112.5 48.1 -68.1 -44.0 4.4 -7.0 20.7 52 44 A L H X S+ 0 0 8 -4,-2.8 4,-2.3 2,-0.2 5,-0.2 0.954 115.4 46.0 -56.7 -52.2 7.4 -5.6 18.7 53 45 A K H X S+ 0 0 31 -4,-2.9 4,-2.7 -5,-0.2 -2,-0.2 0.932 112.9 49.0 -56.6 -49.6 9.8 -6.5 21.5 54 46 A N H X S+ 0 0 87 -4,-2.9 4,-2.4 -5,-0.2 -1,-0.2 0.887 110.8 49.3 -61.9 -40.8 8.3 -9.9 22.1 55 47 A E H X S+ 0 0 48 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.907 111.1 49.7 -66.3 -40.6 8.4 -10.9 18.4 56 48 A I H X S+ 0 0 1 -4,-2.3 4,-1.7 -5,-0.2 -2,-0.2 0.938 112.0 48.3 -63.4 -43.7 12.0 -9.8 18.0 57 49 A L H X S+ 0 0 40 -4,-2.7 4,-0.8 1,-0.2 -2,-0.2 0.914 113.0 48.1 -61.7 -42.6 13.0 -11.8 21.1 58 50 A K H >< S+ 0 0 148 -4,-2.4 3,-0.6 1,-0.2 -1,-0.2 0.894 111.3 49.9 -62.8 -41.9 11.2 -14.9 19.8 59 51 A A H 3< S+ 0 0 50 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.815 116.0 43.2 -66.2 -31.0 12.8 -14.6 16.3 60 52 A H H 3< 0 0 102 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.464 360.0 360.0 -93.3 -11.6 16.3 -14.2 17.9 61 53 A A << 0 0 140 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.1 0.705 360.0 360.0 -71.5 360.0 15.9 -17.0 20.5 62 !* 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 63 -7 B L 0 0 87 0, 0.0 16,-0.0 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 147.5 -0.0 -4.3 13.9 64 -6 B V - 0 0 22 11,-0.2 2,-0.1 1,-0.1 15,-0.1 -0.582 360.0-116.4 -69.4 132.5 -0.2 -6.9 11.2 65 -5 B P - 0 0 109 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.524 25.4-114.5 -78.0 162.6 0.5 -10.0 13.1 66 -4 B R - 0 0 47 -2,-0.1 2,-0.1 2,-0.0 6,-0.1 -0.793 26.3-154.8-101.6 115.1 3.7 -12.0 12.3 67 -3 B G > - 0 0 25 -2,-0.7 3,-1.7 1,-0.1 8,-0.1 -0.366 33.9-106.2 -79.1 165.7 3.3 -15.4 10.8 68 -2 B S T 3 S+ 0 0 136 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.675 119.1 66.1 -64.2 -16.6 6.0 -18.1 11.1 69 -1 B H T 3 S+ 0 0 146 2,-0.1 2,-0.5 0, 0.0 -1,-0.3 0.329 90.2 84.7 -77.3 -3.7 6.7 -17.4 7.4 70 0 B M < - 0 0 14 -3,-1.7 2,-0.1 4,-0.0 -4,-0.0 -0.920 65.5-143.9-121.5 126.5 7.9 -13.9 8.1 71 1 B T > - 0 0 70 -2,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.383 36.5-109.5 -70.0 163.5 11.3 -12.4 9.1 72 2 B I H > S+ 0 0 7 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.920 121.9 53.4 -56.9 -42.3 11.2 -9.5 11.5 73 3 B D H > S+ 0 0 72 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.910 110.1 45.3 -62.1 -43.5 12.4 -7.3 8.6 74 4 B Q H > S+ 0 0 106 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.896 113.0 51.8 -63.3 -42.5 9.6 -8.5 6.3 75 5 B W H X S+ 0 0 5 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.911 109.1 49.4 -61.2 -45.4 7.1 -8.0 9.2 76 6 B L H X S+ 0 0 13 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.891 111.5 49.7 -64.6 -36.8 8.2 -4.4 9.8 77 7 B L H X S+ 0 0 31 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.924 110.4 49.5 -64.2 -46.0 8.0 -3.7 6.1 78 8 B K H X S+ 0 0 85 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.898 111.1 50.4 -61.2 -40.6 4.4 -5.1 5.9 79 9 B N H X S+ 0 0 8 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.902 108.4 51.5 -63.8 -40.0 3.4 -3.0 9.0 80 10 B A H X S+ 0 0 14 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.901 109.3 51.1 -62.4 -41.0 4.8 0.1 7.4 81 11 B K H X S+ 0 0 34 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.941 112.3 46.1 -60.3 -47.6 2.8 -0.5 4.2 82 12 B E H X S+ 0 0 89 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.906 113.3 48.7 -63.1 -41.3 -0.4 -1.0 6.2 83 13 B D H X S+ 0 0 99 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.874 111.5 49.9 -66.2 -38.5 0.2 2.1 8.3 84 14 B A H X S+ 0 0 4 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.922 110.4 48.9 -65.2 -46.8 0.9 4.2 5.2 85 15 B I H X S+ 0 0 9 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.900 110.4 52.9 -58.5 -41.4 -2.2 3.0 3.5 86 16 B A H X S+ 0 0 34 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.911 108.8 49.4 -61.8 -39.6 -4.2 3.8 6.7 87 17 B E H X S+ 0 0 82 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.928 110.8 49.4 -65.7 -42.2 -2.8 7.3 6.7 88 18 B L H <>S+ 0 0 0 -4,-2.5 5,-2.5 1,-0.2 -2,-0.2 0.915 110.5 50.8 -61.7 -42.7 -3.7 7.8 3.0 89 19 B K H ><5S+ 0 0 130 -4,-2.6 3,-1.8 1,-0.2 -1,-0.2 0.908 106.1 54.8 -62.0 -41.0 -7.2 6.6 3.7 90 20 B K H 3<5S+ 0 0 179 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.866 106.7 52.8 -58.6 -35.1 -7.5 9.1 6.6 91 21 B A T 3<5S- 0 0 46 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.394 126.5-101.3 -81.8 0.8 -6.6 11.8 4.2 92 22 B G T < 5S+ 0 0 46 -3,-1.8 2,-0.4 1,-0.3 -3,-0.2 0.531 71.9 145.9 90.6 10.5 -9.4 10.7 1.7 93 23 B I < + 0 0 13 -5,-2.5 -1,-0.3 -6,-0.2 -2,-0.1 -0.658 14.2 167.0 -81.0 132.1 -7.3 8.8 -0.8 94 24 B T + 0 0 120 -2,-0.4 2,-0.7 5,-0.0 -1,-0.1 0.229 27.6 131.3-128.8 11.3 -9.2 5.9 -2.2 95 25 B S > - 0 0 37 1,-0.2 4,-2.4 2,-0.0 5,-0.2 -0.543 39.4-166.2 -77.1 113.1 -6.9 4.9 -5.2 96 26 B D H > S+ 0 0 128 -2,-0.7 4,-2.5 1,-0.2 -1,-0.2 0.818 91.0 61.1 -61.2 -29.9 -6.0 1.3 -5.4 97 27 B F H > S+ 0 0 159 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.942 107.8 43.3 -62.2 -44.8 -3.3 2.2 -8.0 98 28 B Y H > S+ 0 0 103 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.914 113.6 50.9 -69.2 -42.7 -1.6 4.3 -5.3 99 29 B F H X S+ 0 0 16 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.892 107.5 54.6 -60.5 -38.4 -2.1 1.6 -2.6 100 30 B N H X S+ 0 0 83 -4,-2.5 4,-1.4 2,-0.2 -1,-0.2 0.875 103.8 54.6 -61.9 -35.9 -0.6 -1.0 -5.0 101 31 B A H X S+ 0 0 34 -4,-1.5 4,-0.6 1,-0.2 3,-0.5 0.929 108.9 48.1 -65.5 -44.4 2.5 1.2 -5.4 102 32 B I H >< S+ 0 0 0 -4,-1.8 3,-1.3 1,-0.2 -2,-0.2 0.932 109.8 53.2 -57.3 -43.6 2.9 1.2 -1.6 103 33 B N H 3< S+ 0 0 70 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.732 106.6 52.3 -68.7 -21.4 2.5 -2.5 -1.5 104 34 B K H 3< S+ 0 0 142 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 0.553 83.7 116.9 -86.6 -10.3 5.2 -3.1 -4.1 105 35 B A << - 0 0 6 -3,-1.3 -24,-0.1 -4,-0.6 3,-0.1 -0.241 52.1-156.8 -62.1 149.9 7.8 -1.0 -2.2 106 36 B K + 0 0 166 1,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.536 69.2 38.7-109.3 -8.8 10.9 -2.9 -0.9 107 37 B T S > S- 0 0 54 1,-0.1 4,-2.2 -30,-0.1 5,-0.1 -0.969 77.0-119.1-137.2 157.9 12.0 -0.7 2.0 108 38 B V H > S+ 0 0 14 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.830 115.9 55.7 -61.3 -34.7 10.4 1.3 4.8 109 39 B E H > S+ 0 0 131 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.864 105.5 50.4 -68.1 -37.8 11.9 4.4 3.4 110 40 B E H > S+ 0 0 92 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.914 110.0 51.6 -63.6 -43.5 10.4 3.9 -0.0 111 41 B V H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.939 111.0 47.8 -54.2 -48.2 7.0 3.4 1.7 112 42 B N H X S+ 0 0 55 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.877 112.7 48.1 -61.8 -42.3 7.5 6.7 3.6 113 43 B A H X S+ 0 0 52 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.916 112.0 48.0 -70.0 -42.4 8.4 8.6 0.5 114 44 B L H X S+ 0 0 59 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.956 115.4 46.2 -58.5 -49.9 5.5 7.2 -1.6 115 45 B K H X S+ 0 0 31 -4,-2.7 4,-2.7 -5,-0.2 5,-0.2 0.934 113.1 48.8 -57.3 -49.6 3.1 8.1 1.2 116 46 B N H X S+ 0 0 76 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.880 110.9 49.4 -62.4 -39.3 4.6 11.5 1.8 117 47 B E H X S+ 0 0 108 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.913 111.3 49.5 -67.3 -41.5 4.5 12.5 -1.9 118 48 B I H X S+ 0 0 23 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.934 112.1 47.9 -62.4 -45.5 0.9 11.3 -2.3 119 49 B L H X S+ 0 0 40 -4,-2.7 4,-0.8 1,-0.2 -1,-0.2 0.908 113.4 48.4 -60.2 -41.3 -0.2 13.4 0.8 120 50 B K H >< S+ 0 0 133 -4,-2.3 3,-0.6 1,-0.2 -2,-0.2 0.912 111.5 49.0 -64.0 -44.4 1.7 16.5 -0.5 121 51 B A H 3< S+ 0 0 89 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.834 116.4 43.2 -65.1 -33.4 0.1 16.2 -3.9 122 52 B H H 3< 0 0 104 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.467 360.0 360.0 -88.8 -10.7 -3.4 15.8 -2.4 123 53 B A << 0 0 141 -4,-0.8 -3,-0.0 -3,-0.6 -32,-0.0 -0.254 360.0 360.0 -69.8 360.0 -3.0 18.5 0.3