==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 29-DEC-00 1HT9 . COMPND 2 MOLECULE: CALBINDIN D9K; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR M.HAKANSSON,A.L.SVENSSON,J.FAST,S.LINSE . 152 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8988.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 104 68.4 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 . 4 2.6 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 0.7 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 . 5 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 47.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 0 1 0 0 2 1 3 2 0 0 0 0 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 . 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 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 0 A M 0 0 193 0, 0.0 2,-0.5 0, 0.0 152,-0.0 0.000 360.0 360.0 360.0 133.9 -3.3 -6.7 34.2 2 1 A K - 0 0 52 4,-0.0 0, 0.0 3,-0.0 0, 0.0 -0.668 360.0-145.5 -88.5 125.5 -1.1 -3.8 32.9 3 2 A S > - 0 0 51 -2,-0.5 4,-2.2 1,-0.1 3,-0.3 -0.395 27.6-109.0 -74.6 169.6 -1.6 -0.3 34.4 4 3 A P H > S+ 0 0 99 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.890 120.3 55.3 -65.8 -38.1 -1.2 2.9 32.4 5 4 A E H > S+ 0 0 147 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.869 106.2 50.9 -62.8 -42.1 2.1 3.6 34.2 6 5 A E H > S+ 0 0 84 -3,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.906 108.3 51.6 -61.6 -44.2 3.5 0.2 33.2 7 6 A L H X S+ 0 0 10 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.872 107.8 52.6 -62.5 -34.8 2.6 0.8 29.5 8 7 A K H X S+ 0 0 98 -4,-1.9 4,-2.6 -5,-0.2 -1,-0.2 0.944 109.0 50.1 -62.4 -42.3 4.4 4.2 29.6 9 8 A G H X S+ 0 0 39 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.907 110.1 50.3 -64.6 -39.1 7.5 2.4 31.0 10 9 A I H X S+ 0 0 10 -4,-2.5 4,-2.2 1,-0.2 5,-0.3 0.962 110.7 49.2 -64.7 -43.2 7.3 -0.2 28.2 11 10 A F H X S+ 0 0 6 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.923 114.3 45.6 -58.3 -51.8 7.0 2.5 25.5 12 11 A E H X S+ 0 0 95 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.874 109.4 54.8 -64.0 -39.0 10.0 4.4 27.0 13 12 A K H < S+ 0 0 109 -4,-2.8 4,-0.3 1,-0.2 3,-0.2 0.955 116.6 35.5 -58.3 -50.0 12.2 1.3 27.4 14 13 A Y H >< S+ 0 0 11 -4,-2.2 3,-1.3 1,-0.2 4,-0.4 0.893 112.6 58.6 -77.8 -32.0 11.9 0.3 23.7 15 14 A A H 3< S+ 0 0 0 -4,-2.8 8,-0.5 -5,-0.3 3,-0.4 0.802 102.3 56.8 -63.6 -32.2 11.8 3.8 22.3 16 15 A A T 3< S+ 0 0 59 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.557 85.6 81.8 -74.0 -11.1 15.2 4.5 23.8 17 16 A K S < S+ 0 0 108 -3,-1.3 2,-0.3 -4,-0.3 -1,-0.2 0.885 98.5 15.7 -66.6 -45.5 17.1 1.6 22.2 18 17 A E S S- 0 0 99 -4,-0.4 -1,-0.1 -3,-0.4 7,-0.1 -0.944 110.3 -26.5-130.2 155.1 17.8 3.1 18.8 19 18 A G S S+ 0 0 75 -2,-0.3 5,-0.0 2,-0.1 -4,-0.0 -0.093 120.4 26.7 52.4-138.2 17.9 6.5 17.0 20 19 A D S > S- 0 0 67 1,-0.2 3,-1.1 2,-0.1 -2,-0.3 -0.474 75.5-150.7 -56.7 119.1 15.6 9.1 18.5 21 20 A P T 3 S+ 0 0 73 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.648 89.1 52.5 -78.0 -9.1 15.3 8.0 22.1 22 21 A N T 3 S+ 0 0 113 -6,-0.1 119,-0.4 -7,-0.0 2,-0.3 0.339 104.8 57.2-102.1 -4.1 11.8 9.3 22.6 23 22 A N S < S- 0 0 33 -3,-1.1 2,-0.5 -8,-0.5 117,-0.2 -0.965 78.1-120.9-132.2 154.7 10.1 7.7 19.6 24 23 A L B -A 139 0A 0 115,-2.7 115,-2.9 -2,-0.3 2,-0.1 -0.817 20.1-155.9 -97.2 126.2 9.6 4.1 18.5 25 24 A S > - 0 0 22 -2,-0.5 4,-2.3 113,-0.2 5,-0.2 -0.475 37.6-100.5 -83.0 178.6 10.9 3.0 15.1 26 25 A K H > S+ 0 0 74 111,-0.4 4,-2.3 1,-0.2 5,-0.1 0.880 125.0 53.1 -69.6 -34.3 9.4 -0.1 13.4 27 26 A E H > S+ 0 0 117 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.914 110.5 46.7 -67.2 -35.1 12.3 -2.2 14.5 28 27 A E H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.890 110.0 53.2 -70.6 -34.0 11.7 -1.1 18.1 29 28 A L H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.893 106.3 54.5 -66.1 -38.6 8.0 -1.7 17.8 30 29 A K H X S+ 0 0 82 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.947 110.3 45.1 -58.4 -47.2 8.7 -5.3 16.6 31 30 A L H X S+ 0 0 65 -4,-1.8 4,-1.7 1,-0.2 5,-0.2 0.843 111.4 53.0 -65.0 -41.4 10.9 -6.0 19.7 32 31 A L H X>S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 5,-0.6 0.941 113.7 42.4 -59.1 -52.7 8.3 -4.4 22.0 33 32 A L H X5S+ 0 0 3 -4,-2.8 4,-1.5 1,-0.2 7,-0.2 0.939 113.2 50.6 -63.8 -46.2 5.5 -6.6 20.6 34 33 A Q H <5S+ 0 0 108 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.860 120.7 37.0 -58.8 -36.3 7.5 -9.9 20.5 35 34 A T H <5S+ 0 0 86 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.922 130.6 21.7 -79.7 -52.7 8.6 -9.4 24.1 36 35 A E H <5S+ 0 0 55 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.1 0.760 136.6 21.4 -93.5 -35.3 5.6 -7.9 25.9 37 36 A F >X< + 0 0 26 -4,-1.5 3,-1.4 -5,-0.6 4,-0.6 -0.449 68.0 162.3-133.1 57.6 2.6 -8.8 23.8 38 37 A P H 3> S+ 0 0 81 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.708 73.2 49.9 -60.1 -26.7 3.6 -11.8 21.7 39 38 A S H 3> S+ 0 0 91 2,-0.1 4,-1.8 1,-0.1 5,-0.2 0.641 90.4 83.5 -85.6 -13.8 0.2 -13.1 20.7 40 39 A L H <> S+ 0 0 35 -3,-1.4 4,-0.6 1,-0.2 3,-0.5 0.928 95.6 37.9 -57.8 -53.1 -1.0 -9.7 19.5 41 40 A L H >< S+ 0 0 43 -4,-0.6 3,-1.3 1,-0.2 -1,-0.2 0.914 113.3 59.1 -65.0 -35.4 0.4 -9.7 16.0 42 41 A K H 3< S+ 0 0 185 -4,-0.5 -1,-0.2 1,-0.3 -2,-0.2 0.804 108.7 44.4 -61.3 -36.1 -0.4 -13.4 15.7 43 42 A G H 3< S+ 0 0 70 -4,-1.8 -1,-0.3 -3,-0.5 2,-0.2 0.506 96.9 91.5 -82.4 -13.4 -4.1 -12.7 16.3 44 43 A M << - 0 0 25 -3,-1.3 2,-0.3 -4,-0.6 79,-0.1 -0.660 63.8-145.1 -86.5 150.0 -4.4 -9.7 14.0 45 44 A S > - 0 0 47 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.832 16.8-129.9-112.0 156.7 -5.4 -9.9 10.3 46 45 A T H > S+ 0 0 21 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.893 109.8 52.7 -64.0 -41.0 -4.0 -7.7 7.5 47 46 A L H > S+ 0 0 19 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.917 107.5 51.3 -60.8 -46.1 -7.5 -6.9 6.3 48 47 A D H > S+ 0 0 59 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.958 113.6 44.1 -59.4 -44.1 -8.6 -5.8 9.8 49 48 A E H X S+ 0 0 15 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.860 110.9 53.4 -72.2 -34.0 -5.6 -3.5 10.2 50 49 A L H X S+ 0 0 2 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.934 109.8 50.0 -62.3 -42.8 -6.0 -2.1 6.6 51 50 A F H X S+ 0 0 15 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.947 111.2 47.9 -58.9 -44.8 -9.6 -1.3 7.5 52 51 A E H < S+ 0 0 85 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.857 108.6 54.7 -65.5 -37.4 -8.6 0.4 10.6 53 52 A E H < S+ 0 0 28 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.905 115.4 39.0 -59.8 -41.6 -5.9 2.4 8.8 54 53 A L H < S+ 0 0 3 -4,-2.0 2,-2.1 1,-0.2 -2,-0.2 0.864 99.7 76.1 -79.3 -35.3 -8.5 3.7 6.3 55 54 A D >< + 0 0 9 -4,-2.8 3,-1.2 1,-0.2 -1,-0.2 -0.473 58.6 168.0 -79.5 77.2 -11.4 4.2 8.8 56 55 A K T 3 S+ 0 0 163 -2,-2.1 -1,-0.2 1,-0.3 6,-0.1 0.805 72.3 44.8 -65.3 -35.4 -10.0 7.4 10.3 57 56 A N T 3 S- 0 0 105 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.383 104.0-127.7 -93.3 3.2 -13.1 8.5 12.2 58 57 A G < + 0 0 55 -3,-1.2 -2,-0.1 -6,-0.2 4,-0.1 0.778 67.3 131.1 61.3 33.6 -13.8 5.0 13.5 59 58 A D S S- 0 0 94 2,-0.4 -1,-0.1 0, 0.0 3,-0.1 0.346 77.9-113.2 -93.6 3.9 -17.4 4.7 12.4 60 59 A G S S+ 0 0 36 1,-0.2 43,-0.4 -5,-0.1 2,-0.3 0.712 88.4 97.4 76.1 15.8 -16.7 1.3 10.8 61 60 A E - 0 0 53 41,-0.1 2,-0.6 42,-0.1 -2,-0.4 -0.990 65.8-141.1-132.2 140.7 -17.3 2.6 7.3 62 61 A V B -B 101 0B 0 39,-2.8 39,-2.5 -2,-0.3 -7,-0.1 -0.921 20.3-155.9-105.9 118.7 -14.7 3.8 4.8 63 62 A S > - 0 0 20 -2,-0.6 4,-2.7 37,-0.2 5,-0.2 -0.322 32.6-101.9 -86.1 171.7 -15.8 6.8 2.8 64 63 A F H > S+ 0 0 61 35,-0.4 4,-1.3 2,-0.2 -1,-0.1 0.910 125.0 51.4 -59.4 -40.5 -14.5 7.7 -0.6 65 64 A E H 4 S+ 0 0 137 2,-0.2 4,-0.4 1,-0.2 3,-0.3 0.926 111.4 47.3 -63.4 -38.8 -12.2 10.4 0.9 66 65 A E H >4 S+ 0 0 14 1,-0.2 3,-1.2 2,-0.2 4,-0.4 0.905 107.7 57.6 -64.8 -37.2 -10.9 7.8 3.4 67 66 A F H >X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 3,-1.3 0.775 86.3 79.3 -66.4 -25.8 -10.4 5.3 0.5 68 67 A Q H 3X S+ 0 0 51 -4,-1.3 4,-2.4 -3,-0.3 -1,-0.2 0.788 81.1 66.2 -55.4 -32.3 -8.1 7.7 -1.3 69 68 A V H <> S+ 0 0 61 -3,-1.2 4,-0.7 -4,-0.4 -1,-0.3 0.914 107.1 41.2 -53.7 -42.6 -5.2 6.7 0.9 70 69 A L H <> S+ 0 0 8 -3,-1.3 4,-0.9 -4,-0.4 3,-0.4 0.855 109.8 58.1 -77.1 -30.6 -5.4 3.3 -0.7 71 70 A V H >X S+ 0 0 6 -4,-1.7 4,-1.8 1,-0.2 3,-0.9 0.929 104.9 51.1 -63.4 -37.8 -5.9 4.7 -4.2 72 71 A K H 3< S+ 0 0 167 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.723 108.3 53.4 -74.6 -21.9 -2.7 6.7 -4.0 73 72 A K H 3< S+ 0 0 111 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.621 121.0 26.5 -80.1 -26.3 -0.7 3.6 -2.9 74 73 A I H << S+ 0 0 50 -3,-0.9 2,-0.3 -4,-0.9 -2,-0.2 0.539 112.3 65.0-121.3 -1.5 -1.8 1.3 -5.8 75 74 A S < 0 0 22 -4,-1.8 5,-0.1 -5,-0.2 -1,-0.1 -0.864 360.0 360.0-130.3 153.8 -2.6 3.6 -8.7 76 75 A Q 0 0 209 3,-0.7 4,-0.2 -2,-0.3 -1,-0.1 0.630 360.0 360.0-117.3 360.0 -1.0 6.0 -11.1 77 !* 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 78 0 B M 0 0 222 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 0.000 360.0 360.0 360.0 -75.5 -2.5 -1.3 -14.3 79 1 B K - 0 0 37 -5,-0.2 -3,-0.7 1,-0.1 -5,-0.0 -0.490 360.0-136.1 -66.0 143.7 -5.7 0.4 -13.0 80 2 B S > - 0 0 43 -2,-0.2 4,-2.0 -4,-0.2 3,-0.2 -0.395 24.1-111.5 -90.1 164.3 -6.2 4.2 -13.1 81 3 B P H > S+ 0 0 47 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.837 118.7 56.8 -63.6 -33.3 -7.6 6.3 -10.3 82 4 B E H > S+ 0 0 145 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.871 106.5 48.6 -68.4 -36.4 -10.7 6.9 -12.4 83 5 B E H > S+ 0 0 84 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.890 107.3 56.5 -61.2 -41.9 -11.3 3.2 -12.6 84 6 B L H X S+ 0 0 1 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.865 101.5 56.5 -65.1 -27.8 -10.8 3.0 -8.9 85 7 B K H X S+ 0 0 99 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.936 108.6 47.1 -62.8 -49.6 -13.6 5.5 -8.3 86 8 B G H X S+ 0 0 38 -4,-1.5 4,-2.4 1,-0.2 -1,-0.2 0.915 112.2 50.4 -51.2 -53.8 -15.9 3.2 -10.3 87 9 B I H X S+ 0 0 10 -4,-2.4 4,-2.3 2,-0.2 5,-0.3 0.922 109.1 50.1 -54.0 -46.3 -14.7 0.2 -8.3 88 10 B F H X S+ 0 0 5 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.931 112.6 47.9 -61.0 -45.1 -15.3 2.0 -4.9 89 11 B E H X S+ 0 0 101 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.873 110.2 52.2 -64.9 -38.4 -18.8 3.0 -6.0 90 12 B K H < S+ 0 0 114 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.937 116.3 36.6 -63.5 -52.0 -19.7 -0.5 -7.2 91 13 B Y H >< S+ 0 0 6 -4,-2.3 3,-1.3 1,-0.2 4,-0.4 0.833 111.6 58.9 -77.8 -25.4 -18.7 -2.3 -4.0 92 14 B A H 3< S+ 0 0 0 -4,-2.2 8,-0.5 -5,-0.3 3,-0.4 0.771 100.4 58.8 -70.1 -28.8 -19.9 0.3 -1.5 93 15 B A T 3< S+ 0 0 55 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.457 84.4 84.2 -77.0 -0.5 -23.4 0.1 -2.9 94 16 B K S < S+ 0 0 129 -3,-1.3 2,-0.3 1,-0.2 -1,-0.2 0.886 99.3 6.5 -74.1 -43.9 -23.7 -3.7 -2.1 95 17 B E S S- 0 0 77 -4,-0.4 5,-0.2 -3,-0.4 -1,-0.2 -0.954 110.6 -13.3-139.7 154.3 -24.8 -3.4 1.5 96 18 B G S S+ 0 0 72 -2,-0.3 5,-0.0 2,-0.1 -4,-0.0 -0.179 120.3 18.7 64.8-141.2 -25.8 -0.9 4.1 97 19 B D S > S- 0 0 67 1,-0.1 3,-1.2 2,-0.1 -2,-0.2 -0.606 74.9-146.6 -64.1 128.0 -25.1 2.7 3.3 98 20 B P T 3 S+ 0 0 72 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.549 92.8 53.8 -81.3 -9.7 -24.7 2.7 -0.5 99 21 B N T 3 S+ 0 0 118 -6,-0.1 -35,-0.4 -7,-0.0 2,-0.3 0.279 104.8 59.5 -99.7 -5.1 -22.0 5.4 -0.5 100 22 B N S < S- 0 0 33 -3,-1.2 2,-0.6 -8,-0.5 -5,-0.2 -0.951 75.8-123.5-129.5 153.1 -19.6 3.8 2.0 101 23 B L B -B 62 0B 0 -39,-2.5 -39,-2.8 -2,-0.3 -9,-0.1 -0.851 19.0-158.0-100.5 123.2 -17.6 0.6 2.3 102 24 B S > - 0 0 13 -2,-0.6 4,-2.5 -41,-0.2 5,-0.2 -0.309 39.5 -99.0 -79.2 175.8 -18.1 -1.7 5.2 103 25 B K H > S+ 0 0 76 -43,-0.4 4,-2.3 1,-0.2 5,-0.1 0.874 126.4 53.0 -65.7 -36.8 -15.3 -4.2 6.1 104 26 B E H > S+ 0 0 112 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.888 109.8 47.3 -65.3 -37.8 -17.2 -6.9 4.3 105 27 B E H > S+ 0 0 3 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.856 110.5 52.3 -74.0 -33.1 -17.5 -4.8 1.1 106 28 B L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.913 108.7 51.2 -65.8 -40.8 -13.7 -3.9 1.4 107 29 B K H X S+ 0 0 82 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.928 112.4 45.8 -57.8 -45.1 -13.0 -7.6 1.6 108 30 B L H X S+ 0 0 69 -4,-1.9 4,-1.9 2,-0.2 5,-0.2 0.864 111.2 52.9 -67.7 -37.2 -15.1 -8.3 -1.5 109 31 B L H X>S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 5,-0.5 0.933 114.6 40.7 -61.9 -49.8 -13.5 -5.4 -3.4 110 32 B L H X5S+ 0 0 2 -4,-2.5 4,-1.4 2,-0.2 7,-0.3 0.892 114.0 51.5 -70.2 -43.6 -10.0 -6.6 -2.8 111 33 B Q H <5S+ 0 0 136 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.896 120.1 36.5 -58.6 -38.7 -10.7 -10.3 -3.3 112 34 B T H <5S+ 0 0 77 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.937 131.4 22.9 -80.5 -47.3 -12.3 -9.5 -6.7 113 35 B E H <5S+ 0 0 47 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.1 0.742 135.9 20.7 -97.7 -32.3 -10.2 -6.6 -8.1 114 36 B F >X< + 0 0 36 -4,-1.4 3,-1.9 -5,-0.5 4,-0.5 -0.527 66.7 161.8-133.2 57.8 -6.8 -6.9 -6.4 115 37 B P T 34 S+ 0 0 84 0, 0.0 4,-0.3 0, 0.0 3,-0.1 0.760 74.5 51.2 -66.5 -18.1 -6.5 -10.4 -5.1 116 38 B S T 3> S+ 0 0 85 1,-0.2 4,-0.8 2,-0.1 3,-0.1 0.499 87.5 86.0 -96.1 3.3 -2.7 -10.4 -4.7 117 39 B L H X> S+ 0 0 41 -3,-1.9 3,-0.8 -7,-0.3 4,-0.5 0.960 90.1 44.8 -70.2 -45.8 -2.7 -7.2 -2.6 118 40 B L H 3< S+ 0 0 50 -4,-0.5 -1,-0.2 1,-0.2 3,-0.2 0.690 109.0 54.8 -74.4 -16.3 -3.3 -8.8 0.8 119 41 B K H 34 S+ 0 0 172 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.685 106.9 52.3 -88.6 -13.2 -0.8 -11.7 0.3 120 42 B G H << S+ 0 0 72 -4,-0.8 2,-0.3 -3,-0.8 -1,-0.2 0.582 97.7 83.4 -88.9 -13.3 2.0 -9.2 -0.4 121 43 B M < - 0 0 43 -4,-0.5 2,-0.3 -3,-0.2 -75,-0.1 -0.655 68.8-142.1 -94.6 151.3 1.3 -7.1 2.7 122 44 B S > - 0 0 46 -2,-0.3 4,-2.1 1,-0.1 5,-0.1 -0.820 14.2-133.6-112.5 146.7 2.6 -7.9 6.2 123 45 B T H > S+ 0 0 33 -2,-0.3 4,-3.2 1,-0.2 5,-0.2 0.925 107.3 53.0 -63.4 -42.4 0.5 -7.3 9.4 124 46 B L H > S+ 0 0 29 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.915 108.9 49.8 -59.3 -42.1 3.4 -5.6 11.1 125 47 B D H > S+ 0 0 74 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.929 113.1 45.7 -65.7 -39.5 3.9 -3.2 8.2 126 48 B E H X S+ 0 0 4 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.919 111.1 51.9 -72.5 -33.4 0.2 -2.3 8.1 127 49 B L H X S+ 0 0 1 -4,-3.2 4,-2.8 1,-0.2 5,-0.2 0.902 109.7 51.0 -63.9 -44.5 0.0 -1.9 11.9 128 50 B F H X S+ 0 0 11 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.947 110.5 48.6 -56.9 -44.8 3.0 0.5 11.7 129 51 B E H < S+ 0 0 76 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.888 110.5 51.3 -64.0 -37.6 1.2 2.5 9.0 130 52 B E H < S+ 0 0 4 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.950 115.9 41.4 -62.9 -38.8 -2.0 2.6 11.0 131 53 B L H < S+ 0 0 0 -4,-2.8 2,-2.0 1,-0.2 3,-0.2 0.857 100.8 71.7 -77.0 -38.9 -0.1 3.9 14.1 132 54 B D >< + 0 0 8 -4,-2.6 3,-1.2 -5,-0.2 -1,-0.2 -0.441 59.5 167.3 -82.6 75.0 2.2 6.4 12.2 133 55 B K T 3 S+ 0 0 133 -2,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.823 74.0 43.5 -62.4 -36.1 -0.4 9.0 11.4 134 56 B N T 3 S- 0 0 106 -3,-0.2 -1,-0.3 4,-0.2 -2,-0.1 0.438 103.6-129.0 -94.0 -2.1 2.0 11.7 10.3 135 57 B G < + 0 0 54 -3,-1.2 -2,-0.1 -6,-0.1 -3,-0.1 0.627 64.9 132.9 71.6 25.2 4.2 9.4 8.3 136 58 B D S S- 0 0 89 2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.394 77.2-110.9 -88.2 9.4 7.5 10.4 9.8 137 59 B G S S+ 0 0 35 1,-0.2 -111,-0.4 -5,-0.2 2,-0.3 0.729 88.3 94.3 76.8 10.9 8.6 6.7 10.3 138 60 B E - 0 0 49 -113,-0.1 2,-0.6 -112,-0.1 -2,-0.3 -0.983 67.5-137.0-135.4 145.4 8.4 7.0 14.1 139 61 B V B -A 24 0A 0 -115,-2.9 -115,-2.7 -2,-0.3 -7,-0.1 -0.942 25.0-158.5-101.1 118.5 5.6 6.1 16.6 140 62 B S > - 0 0 31 -2,-0.6 4,-2.6 -117,-0.2 5,-0.2 -0.285 34.6-100.0 -82.7 172.8 5.3 8.8 19.3 141 63 B F H > S+ 0 0 84 -119,-0.4 4,-0.7 1,-0.2 -1,-0.1 0.916 125.6 52.9 -62.6 -34.1 3.8 8.3 22.7 142 64 B E H >4 S+ 0 0 162 1,-0.2 3,-1.1 2,-0.2 4,-0.3 0.955 110.4 46.0 -61.3 -49.1 0.6 10.0 21.4 143 65 B E H >4 S+ 0 0 17 1,-0.2 3,-1.6 2,-0.2 4,-0.5 0.881 103.0 65.1 -62.0 -30.8 0.4 7.6 18.4 144 66 B F H >X S+ 0 0 1 -4,-2.6 4,-2.2 1,-0.3 3,-0.8 0.717 83.1 77.7 -64.7 -23.8 1.1 4.6 20.7 145 67 B Q H S+ 0 0 51 -3,-1.6 4,-0.6 -4,-0.3 -1,-0.3 0.857 106.5 46.6 -69.3 -31.0 -4.0 3.7 19.4 147 69 B L H X> S+ 0 0 0 -3,-0.8 3,-1.6 -4,-0.5 4,-1.2 0.919 104.8 60.5 -75.2 -34.8 -2.0 0.4 20.1 148 70 B V H >< S+ 0 0 31 -4,-2.2 3,-0.5 1,-0.3 -2,-0.2 0.882 98.9 58.1 -61.1 -35.0 -2.9 0.7 23.8 149 71 B K H 3< S+ 0 0 187 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.763 104.6 52.2 -62.7 -31.8 -6.6 0.5 22.9 150 72 B K H << S+ 0 0 45 -3,-1.6 2,-0.5 -4,-0.6 -1,-0.2 0.739 82.9 103.3 -76.9 -29.0 -6.0 -2.9 21.1 151 73 B I << - 0 0 14 -4,-1.2 -114,-0.0 -3,-0.5 -4,-0.0 -0.465 67.9-139.0 -60.6 122.8 -4.2 -4.6 24.0 152 74 B S 0 0 112 -2,-0.5 -1,-0.1 1,-0.2 -4,-0.0 0.839 360.0 360.0 -44.8 -81.8 -6.6 -7.1 25.8 153 75 B Q 0 0 121 -152,-0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.136 360.0 360.0 68.1 360.0 -6.0 -6.8 29.6