==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 17-MAY-12 4F8D . COMPND 2 MOLECULE: REGULATORY PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTER SP.; . AUTHOR R.N.A.MARTIN,J.E.MCGEEHAN,G.G.KNEALE . 155 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9542.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 111 71.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 60.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.9 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 0 0 2 2 1 2 0 0 0 2 1 0 0 0 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 2 A E 0 0 123 0, 0.0 42,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 148.6 12.9 -4.2 -25.0 2 3 A S > - 0 0 62 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.089 360.0-110.3 -68.1 167.1 13.7 -0.9 -26.8 3 4 A F H > S+ 0 0 48 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.896 118.6 57.1 -63.2 -42.3 12.1 2.4 -26.0 4 5 A L H > S+ 0 0 88 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.930 108.2 45.2 -56.7 -51.7 10.2 2.1 -29.4 5 6 A L H > S+ 0 0 44 1,-0.2 4,-2.0 2,-0.2 39,-0.4 0.936 114.9 48.1 -62.6 -39.1 8.6 -1.2 -28.6 6 7 A S H X S+ 0 0 36 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.887 111.5 50.5 -69.5 -31.4 7.6 -0.1 -25.1 7 8 A K H X S+ 0 0 32 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.816 104.3 56.0 -83.2 -25.0 6.2 3.1 -26.5 8 9 A V H X S+ 0 0 19 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.946 113.4 43.5 -60.9 -44.1 4.0 1.4 -29.1 9 10 A S H X S+ 0 0 4 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.902 112.9 51.6 -66.0 -42.0 2.5 -0.5 -26.2 10 11 A F H X S+ 0 0 92 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.905 109.8 48.5 -58.1 -46.8 2.3 2.5 -24.0 11 12 A V H X S+ 0 0 1 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.923 110.3 51.8 -63.2 -40.9 0.4 4.6 -26.7 12 13 A I H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.945 114.2 43.2 -56.3 -51.1 -2.1 1.7 -27.4 13 14 A K H X S+ 0 0 73 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.858 112.1 53.8 -61.8 -43.0 -2.9 1.4 -23.7 14 15 A K H X S+ 0 0 80 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.939 112.1 42.7 -59.6 -45.4 -3.0 5.2 -23.3 15 16 A I H X S+ 0 0 2 -4,-2.6 4,-2.2 2,-0.2 6,-0.2 0.935 111.4 57.0 -67.8 -40.5 -5.6 5.7 -26.1 16 17 A R H <>S+ 0 0 5 -4,-2.6 5,-2.7 -5,-0.3 -2,-0.2 0.930 111.4 41.7 -55.8 -43.0 -7.5 2.6 -24.8 17 18 A L H ><5S+ 0 0 25 -4,-2.5 3,-1.6 1,-0.2 -1,-0.2 0.866 111.0 56.6 -74.6 -35.1 -7.9 4.1 -21.4 18 19 A E H 3<5S+ 0 0 114 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.872 108.4 48.9 -60.9 -30.6 -8.7 7.6 -22.9 19 20 A K T 3<5S- 0 0 106 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.355 116.6-119.3 -85.6 -1.5 -11.5 5.9 -24.8 20 21 A G T < 5 + 0 0 17 -3,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.762 62.9 149.2 71.9 21.3 -12.7 4.3 -21.6 21 22 A M < - 0 0 17 -5,-2.7 -1,-0.2 -6,-0.2 2,-0.2 -0.741 40.9-143.2 -97.7 143.5 -12.2 0.8 -22.9 22 23 A T > - 0 0 23 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.453 38.4-102.2 -82.7 174.1 -11.3 -2.5 -21.2 23 24 A Q H > S+ 0 0 25 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.875 125.6 52.7 -65.4 -37.3 -9.0 -5.1 -22.9 24 25 A E H > S+ 0 0 80 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.898 106.3 52.1 -66.0 -36.7 -12.1 -7.1 -23.7 25 26 A D H > S+ 0 0 73 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.926 112.6 45.7 -62.9 -47.5 -13.8 -4.1 -25.3 26 27 A L H X S+ 0 0 0 -4,-2.4 4,-1.7 2,-0.2 6,-0.3 0.877 110.5 53.3 -62.9 -35.8 -10.7 -3.5 -27.5 27 28 A A H X>S+ 0 0 11 -4,-2.3 5,-1.2 2,-0.2 4,-1.1 0.963 109.8 48.6 -63.8 -47.1 -10.4 -7.2 -28.4 28 29 A Y H ><5S+ 0 0 201 -4,-2.4 3,-0.6 1,-0.2 -2,-0.2 0.936 115.5 42.2 -58.8 -43.9 -13.9 -7.3 -29.6 29 30 A K H 3<5S+ 0 0 83 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.718 118.0 45.9 -81.1 -16.5 -13.6 -4.1 -31.7 30 31 A S H 3<5S- 0 0 2 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.444 103.0-125.2 -98.6 -7.6 -10.2 -5.0 -33.1 31 32 A N T <<5S+ 0 0 135 -4,-1.1 2,-0.4 -3,-0.6 -3,-0.2 0.776 76.7 111.6 60.7 31.2 -11.0 -8.6 -34.0 32 33 A L S > - 0 0 101 -2,-0.4 4,-2.3 1,-0.1 3,-0.9 -0.088 26.0-106.0 -78.3 169.5 -8.6 -11.8 -28.8 34 35 A R H 3> S+ 0 0 103 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.866 119.4 50.5 -57.8 -43.3 -8.1 -10.6 -25.3 35 36 A T H 3> S+ 0 0 85 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.783 110.7 51.9 -64.7 -31.5 -4.8 -12.5 -24.6 36 37 A Y H <> S+ 0 0 71 -3,-0.9 4,-2.3 2,-0.2 -2,-0.2 0.876 111.5 45.8 -69.9 -45.4 -3.5 -11.1 -27.9 37 38 A I H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.926 114.9 47.2 -61.9 -52.5 -4.3 -7.5 -26.8 38 39 A S H X S+ 0 0 8 -4,-3.0 4,-1.2 -5,-0.2 -2,-0.2 0.933 111.5 51.8 -59.4 -38.2 -2.9 -8.1 -23.3 39 40 A G H X S+ 0 0 28 -4,-2.1 4,-2.6 1,-0.2 3,-0.5 0.919 110.7 46.8 -64.0 -41.8 0.4 -9.6 -24.8 40 41 A I H < S+ 0 0 10 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.793 106.9 57.5 -76.3 -29.8 1.0 -6.7 -27.1 41 42 A E H < S+ 0 0 22 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.768 113.4 41.2 -60.7 -30.9 0.4 -4.2 -24.3 42 43 A R H < S+ 0 0 160 -4,-1.2 2,-0.3 -3,-0.5 -2,-0.2 0.813 138.8 1.9 -78.0 -40.9 3.2 -6.0 -22.4 43 44 A N < - 0 0 72 -4,-2.6 3,-0.4 -5,-0.2 -1,-0.3 -0.838 55.0-171.6-156.0 113.5 5.5 -6.4 -25.4 44 45 A S > + 0 0 5 -39,-0.4 3,-1.8 -2,-0.3 -4,-0.1 0.302 55.6 111.9 -87.9 4.8 4.7 -5.1 -29.0 45 46 A A T 3 S+ 0 0 48 1,-0.3 -1,-0.2 -5,-0.0 -5,-0.1 0.852 85.6 35.1 -46.7 -47.0 7.7 -6.9 -30.6 46 47 A N T 3 S+ 0 0 146 -3,-0.4 -1,-0.3 2,-0.1 2,-0.3 0.325 84.9 122.9 -95.7 6.8 5.6 -9.3 -32.6 47 48 A L < - 0 0 27 -3,-1.8 2,-0.2 -7,-0.1 -3,-0.0 -0.522 55.4-142.6 -64.5 127.4 2.6 -6.9 -33.3 48 49 A T > - 0 0 74 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.518 19.2-113.4 -87.8 164.9 2.2 -6.8 -37.1 49 50 A I H > S+ 0 0 138 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.900 119.5 53.0 -64.9 -41.1 1.3 -3.8 -39.1 50 51 A K H > S+ 0 0 159 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.939 110.4 47.2 -60.2 -41.7 -2.0 -5.4 -40.1 51 52 A S H > S+ 0 0 14 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.887 110.3 53.5 -66.4 -38.3 -2.8 -6.1 -36.3 52 53 A L H X S+ 0 0 14 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.927 107.5 49.8 -59.8 -39.7 -1.8 -2.5 -35.5 53 54 A E H X S+ 0 0 90 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.934 111.0 50.5 -64.4 -40.4 -4.3 -1.2 -38.2 54 55 A L H X S+ 0 0 55 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.923 112.4 47.4 -63.9 -40.0 -7.0 -3.5 -36.6 55 56 A I H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.921 109.5 51.4 -64.4 -44.7 -6.2 -2.0 -33.2 56 57 A M H X>S+ 0 0 12 -4,-2.9 5,-2.1 1,-0.2 4,-0.7 0.935 112.4 48.5 -64.5 -37.1 -6.3 1.6 -34.4 57 58 A K H ><5S+ 0 0 129 -4,-2.5 3,-0.7 -5,-0.2 -1,-0.2 0.915 110.7 49.0 -62.8 -45.6 -9.7 0.8 -35.9 58 59 A G H 3<5S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.858 112.9 47.8 -68.1 -32.2 -10.9 -0.8 -32.7 59 60 A L H 3<5S- 0 0 1 -4,-2.8 -1,-0.3 -5,-0.1 -2,-0.2 0.588 108.5-130.1 -74.8 -9.9 -9.7 2.3 -30.7 60 61 A E T <<5 + 0 0 141 -3,-0.7 2,-0.4 -4,-0.7 -3,-0.2 0.946 63.7 134.5 51.7 46.6 -11.4 4.6 -33.4 61 62 A V < - 0 0 18 -5,-2.1 -1,-0.3 -6,-0.1 -2,-0.1 -0.985 57.6-119.1-115.5 140.7 -8.2 6.5 -33.7 62 63 A S > - 0 0 61 -2,-0.4 4,-2.9 1,-0.1 5,-0.2 -0.389 21.5-118.9 -73.3 155.6 -6.7 7.5 -37.1 63 64 A D H > S+ 0 0 80 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.904 115.1 56.8 -59.4 -37.5 -3.3 6.2 -38.1 64 65 A V H > S+ 0 0 80 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.928 109.1 44.2 -60.3 -47.3 -2.1 9.8 -38.4 65 66 A V H > S+ 0 0 63 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.924 112.9 53.8 -65.6 -40.8 -3.1 10.6 -34.7 66 67 A F H X S+ 0 0 1 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.949 112.1 41.5 -56.2 -51.3 -1.7 7.3 -33.5 67 68 A F H X S+ 0 0 91 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.861 111.4 56.0 -69.9 -30.1 1.7 7.9 -35.1 68 69 A E H X S+ 0 0 112 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.875 108.7 48.6 -67.8 -39.0 1.7 11.6 -34.0 69 70 A M H X S+ 0 0 42 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.924 111.8 49.8 -64.9 -36.5 1.2 10.5 -30.3 70 71 A L H X S+ 0 0 16 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.924 110.6 48.2 -68.0 -42.7 4.0 7.9 -30.7 71 72 A I H X S+ 0 0 92 -4,-2.5 4,-3.3 1,-0.2 5,-0.3 0.915 110.1 52.6 -66.3 -43.1 6.4 10.5 -32.2 72 73 A K H X S+ 0 0 129 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.933 111.0 48.0 -59.2 -37.2 5.5 13.0 -29.3 73 74 A E H X S+ 0 0 22 -4,-2.1 4,-2.0 1,-0.2 5,-0.3 0.920 113.2 47.1 -62.8 -45.6 6.4 10.1 -26.8 74 75 A I H X S+ 0 0 48 -4,-2.2 4,-2.4 3,-0.2 -2,-0.2 0.941 115.8 45.0 -62.5 -50.7 9.6 9.3 -28.4 75 76 A L H < S+ 0 0 135 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.926 118.8 40.0 -60.9 -44.2 10.7 13.0 -28.7 76 77 A K H < S+ 0 0 141 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.817 130.1 25.0 -78.2 -29.1 9.7 14.0 -25.2 77 78 A H H < 0 0 115 -4,-2.0 -3,-0.2 -5,-0.3 -2,-0.2 0.589 360.0 360.0-117.2 -12.6 10.9 10.9 -23.4 78 79 A D < 0 0 140 -4,-2.4 -4,-0.0 -5,-0.3 0, 0.0 -0.440 360.0 360.0 -97.4 360.0 13.7 9.1 -25.4 79 !* 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 80 2 B E 0 0 142 0, 0.0 42,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 117.0 -31.1 -2.1 -11.9 81 3 B S - 0 0 71 1,-0.1 0, 0.0 3,-0.0 0, 0.0 -0.169 360.0-100.3 -64.3 167.0 -32.4 1.2 -10.3 82 4 B F S S+ 0 0 56 2,-0.2 5,-0.2 1,-0.2 -1,-0.1 0.894 124.3 55.0 -53.0 -45.7 -30.9 4.5 -11.1 83 5 B L 0 0 87 1,-0.2 4,-2.5 3,-0.2 -1,-0.2 0.921 360.0 360.0 -60.8 -47.9 -29.0 4.2 -7.7 84 6 B L 0 0 47 2,-0.2 4,-2.0 3,-0.1 39,-0.3 0.921 360.0 360.0 -62.8 360.0 -27.4 0.9 -8.5 85 ! 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 86 8 B K > 0 0 55 0, 0.0 4,-2.7 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 -25.2 -25.0 5.2 -10.7 87 9 B V H > + 0 0 19 -4,-2.5 4,-2.1 2,-0.2 5,-0.2 0.956 360.0 43.5 -59.7 -43.1 -22.9 3.5 -8.0 88 10 B S H > S+ 0 0 7 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.911 113.1 52.4 -63.3 -41.3 -21.4 1.5 -10.9 89 11 B F H > S+ 0 0 91 -5,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.921 109.3 47.3 -59.9 -47.1 -21.1 4.6 -13.0 90 12 B V H X S+ 0 0 2 -4,-2.7 4,-2.6 2,-0.2 5,-0.3 0.925 110.2 52.9 -68.1 -36.8 -19.2 6.6 -10.3 91 13 B I H X S+ 0 0 1 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.937 114.4 42.8 -56.3 -56.1 -16.7 3.7 -9.6 92 14 B K H X S+ 0 0 89 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.895 112.6 53.1 -59.0 -41.2 -16.0 3.5 -13.4 93 15 B K H X S+ 0 0 89 -4,-2.9 4,-2.5 -5,-0.2 -2,-0.2 0.945 112.1 43.3 -63.0 -43.3 -15.8 7.2 -13.8 94 16 B I H X S+ 0 0 2 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.927 111.9 54.6 -66.3 -42.5 -13.3 7.7 -11.0 95 17 B R H <>S+ 0 0 2 -4,-2.5 5,-2.5 -5,-0.3 -2,-0.2 0.931 113.3 41.9 -55.0 -48.9 -11.2 4.7 -12.2 96 18 B L H ><5S+ 0 0 42 -4,-2.5 3,-1.8 1,-0.2 -1,-0.2 0.860 110.4 57.3 -68.0 -37.9 -10.9 6.1 -15.8 97 19 B E H 3<5S+ 0 0 121 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.864 108.5 48.1 -60.1 -32.6 -10.3 9.7 -14.4 98 20 B K T 3<5S- 0 0 93 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.301 116.4-117.1 -85.0 2.4 -7.4 8.2 -12.6 99 21 B G T < 5 + 0 0 39 -3,-1.8 2,-0.4 1,-0.2 -3,-0.2 0.822 64.1 149.4 64.1 27.9 -6.1 6.4 -15.7 100 22 B M < - 0 0 9 -5,-2.5 -1,-0.2 -6,-0.2 2,-0.1 -0.812 40.7-141.7 -98.7 138.3 -6.6 3.0 -14.1 101 23 B T > - 0 0 10 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.429 32.8-108.1 -78.3 171.2 -7.5 -0.3 -15.7 102 24 B Q H > S+ 0 0 18 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.872 123.8 54.5 -62.8 -40.0 -9.9 -2.8 -14.1 103 25 B E H > S+ 0 0 88 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.930 107.3 49.1 -67.0 -37.5 -6.9 -5.0 -13.4 104 26 B D H > S+ 0 0 57 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.927 113.3 47.0 -62.9 -48.5 -5.0 -2.0 -11.6 105 27 B L H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 6,-0.3 0.897 109.4 54.3 -62.5 -38.5 -8.1 -1.3 -9.5 106 28 B A H X>S+ 0 0 9 -4,-2.5 5,-1.2 1,-0.2 4,-1.0 0.967 111.1 46.0 -53.7 -53.7 -8.5 -5.1 -8.7 107 29 B Y H ><5S+ 0 0 197 -4,-2.4 3,-0.6 1,-0.2 -2,-0.2 0.922 115.9 44.4 -56.6 -43.9 -4.9 -5.2 -7.4 108 30 B K H 3<5S+ 0 0 108 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.716 117.7 44.8 -79.1 -17.8 -5.3 -2.0 -5.3 109 31 B S H 3<5S- 0 0 2 -4,-1.9 -1,-0.2 -3,-0.3 -2,-0.2 0.426 102.4-125.4-101.1 -7.1 -8.8 -3.0 -3.9 110 32 B N T <<5S+ 0 0 135 -4,-1.0 2,-0.4 -3,-0.6 -3,-0.2 0.786 76.3 112.9 59.0 30.8 -8.0 -6.6 -3.0 111 33 B L S > - 0 0 101 -2,-0.4 4,-2.4 1,-0.1 3,-0.5 -0.096 25.8-109.6 -69.9 163.4 -10.4 -9.7 -8.3 113 35 B R H 3> S+ 0 0 64 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.867 118.1 51.5 -58.1 -39.2 -10.7 -8.4 -11.8 114 36 B T H 3> S+ 0 0 82 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.852 109.9 52.7 -66.7 -30.1 -13.9 -10.4 -12.6 115 37 B Y H <> S+ 0 0 69 -3,-0.5 4,-2.9 2,-0.2 -2,-0.2 0.941 110.5 45.8 -71.1 -46.2 -15.4 -9.0 -9.4 116 38 B I H X S+ 0 0 2 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.918 113.8 48.9 -59.0 -49.6 -14.6 -5.4 -10.4 117 39 B S H X S+ 0 0 8 -4,-2.7 4,-1.2 1,-0.2 -1,-0.2 0.935 112.2 50.1 -60.1 -43.0 -15.9 -5.9 -13.9 118 40 B G H >X S+ 0 0 25 -4,-2.2 4,-2.8 1,-0.2 3,-0.7 0.926 110.2 48.6 -58.3 -46.7 -19.1 -7.4 -12.4 119 41 B I H 3< S+ 0 0 8 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.850 106.6 55.6 -63.2 -38.4 -19.7 -4.5 -10.0 120 42 B E H 3< S+ 0 0 23 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.734 113.7 43.1 -70.9 -20.3 -19.2 -1.9 -12.8 121 43 B R H << S+ 0 0 161 -4,-1.2 2,-0.3 -3,-0.7 -2,-0.2 0.809 137.5 0.6 -84.4 -42.3 -22.0 -3.8 -14.7 122 44 B N < - 0 0 77 -4,-2.8 3,-0.4 -5,-0.2 -1,-0.3 -0.872 56.7-172.6-153.6 112.7 -24.4 -4.3 -11.7 123 45 B S > + 0 0 5 -39,-0.3 3,-1.8 -2,-0.3 -4,-0.1 0.406 53.6 113.9 -91.3 17.3 -23.6 -3.1 -8.1 124 46 B A T 3 S+ 0 0 46 1,-0.3 -1,-0.2 -5,-0.0 -5,-0.1 0.831 84.4 34.0 -58.9 -41.2 -26.6 -4.8 -6.5 125 47 B N T 3 S+ 0 0 138 -3,-0.4 2,-0.3 2,-0.1 -1,-0.3 0.355 84.7 123.2-106.3 12.5 -24.5 -7.2 -4.5 126 48 B L < - 0 0 27 -3,-1.8 2,-0.2 -7,-0.1 -3,-0.0 -0.534 55.4-142.2 -64.5 130.0 -21.5 -4.9 -3.7 127 49 B T > - 0 0 74 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.494 19.1-112.2 -92.5 163.2 -21.2 -4.8 0.0 128 50 B I H > S+ 0 0 136 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.907 119.5 53.8 -60.8 -40.4 -20.2 -1.8 2.1 129 51 B K H > S+ 0 0 150 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.917 110.1 46.6 -60.2 -46.0 -17.0 -3.5 3.0 130 52 B S H > S+ 0 0 13 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.891 109.5 54.2 -64.9 -35.1 -16.1 -4.0 -0.7 131 53 B L H X S+ 0 0 15 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.925 107.3 51.7 -64.6 -35.2 -17.1 -0.4 -1.6 132 54 B E H X S+ 0 0 96 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.917 109.8 48.8 -64.8 -42.2 -14.6 0.7 1.1 133 55 B L H X S+ 0 0 46 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.889 112.0 48.7 -62.2 -43.3 -11.9 -1.4 -0.4 134 56 B I H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.916 109.2 52.0 -64.3 -39.4 -12.7 0.0 -3.9 135 57 B M H <>S+ 0 0 12 -4,-2.9 5,-2.3 1,-0.2 4,-0.5 0.946 112.2 47.4 -64.1 -39.5 -12.6 3.7 -2.6 136 58 B K H ><5S+ 0 0 145 -4,-2.6 3,-1.0 1,-0.2 -1,-0.2 0.905 110.8 50.3 -62.6 -42.5 -9.2 2.9 -1.1 137 59 B G H 3<5S+ 0 0 2 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.840 112.3 47.8 -67.8 -30.8 -8.1 1.3 -4.4 138 60 B L T 3<5S- 0 0 1 -4,-2.7 -1,-0.3 2,-0.1 -2,-0.2 0.503 108.5-128.8 -76.8 -8.0 -9.3 4.5 -6.2 139 61 B E T < 5 + 0 0 153 -3,-1.0 2,-0.4 -4,-0.5 -3,-0.2 0.888 64.8 133.9 52.8 46.8 -7.5 6.6 -3.7 140 62 B V < - 0 0 20 -5,-2.3 -1,-0.2 -6,-0.1 -2,-0.1 -0.965 57.2-119.9-118.9 139.3 -10.7 8.6 -3.2 141 63 B S > - 0 0 61 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.392 23.1-116.8 -71.8 158.0 -12.1 9.5 0.2 142 64 B D H > S+ 0 0 77 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.893 115.9 55.0 -59.9 -39.6 -15.6 8.3 1.1 143 65 B V H > S+ 0 0 82 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.929 109.4 45.8 -59.5 -48.8 -16.8 11.8 1.3 144 66 B V H > S+ 0 0 62 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.940 113.1 51.2 -64.1 -40.3 -15.7 12.6 -2.3 145 67 B F H X S+ 0 0 1 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.960 113.4 42.8 -63.3 -44.6 -17.2 9.4 -3.5 146 68 B F H X S+ 0 0 92 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.883 112.2 54.1 -72.1 -28.9 -20.6 10.0 -1.9 147 69 B E H X S+ 0 0 114 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.885 109.5 48.3 -66.5 -40.5 -20.6 13.7 -3.0 148 70 B M H X S+ 0 0 46 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.918 112.1 50.2 -66.1 -38.8 -19.9 12.6 -6.6 149 71 B L H X S+ 0 0 16 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.914 109.9 49.1 -62.0 -48.1 -22.8 10.0 -6.3 150 72 B I H X S+ 0 0 91 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.916 110.9 51.4 -60.1 -44.4 -25.3 12.7 -4.9 151 73 B K H X S+ 0 0 127 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.917 109.8 49.2 -61.7 -39.5 -24.4 15.0 -7.7 152 74 B E H X S+ 0 0 23 -4,-2.0 4,-1.7 2,-0.2 5,-0.4 0.931 113.8 45.8 -63.6 -45.2 -25.0 12.3 -10.3 153 75 B I H X S+ 0 0 50 -4,-2.3 4,-2.5 3,-0.2 -2,-0.2 0.933 116.2 45.6 -60.2 -54.6 -28.4 11.5 -8.7 154 76 B L H < S+ 0 0 133 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.904 118.5 39.7 -57.4 -47.1 -29.5 15.2 -8.4 155 77 B K H < S+ 0 0 143 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.763 130.8 24.4 -87.3 -8.4 -28.5 16.2 -11.8 156 78 B H H < 0 0 119 -4,-1.7 -3,-0.2 -5,-0.3 -2,-0.2 0.649 360.0 360.0-130.5 -11.2 -29.6 13.1 -13.7 157 79 B D < 0 0 143 -4,-2.5 -4,-0.0 -5,-0.4 0, 0.0 -0.418 360.0 360.0 -95.1 360.0 -32.4 11.3 -11.8