==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-JAN-04 1S6B . COMPND 2 MOLECULE: PHOSPHOLIPASE A2 ISOFORM 1; . SOURCE 2 ORGANISM_SCIENTIFIC: NAJA SAGITTIFERA; . AUTHOR T.JABEEN,S.SHARMA,R.K.SINGH,P.KAUR,T.P.SINGH . 238 2 14 14 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11581.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 153 64.3 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 . 16 6.7 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 1 0.4 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 . 16 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 38.2 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+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 3 0 0 0 0 0 0 2 0 0 0 0 2 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 . 3 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 . 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 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 1 A N > 0 0 22 0, 0.0 4,-2.1 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 166.5 7.6 28.1 38.7 2 2 A T H > + 0 0 65 61,-2.4 4,-2.2 1,-0.2 5,-0.1 0.832 360.0 55.2 -55.4 -33.2 10.7 30.0 37.5 3 3 A Y H > S+ 0 0 184 60,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.910 109.5 47.9 -66.7 -41.9 13.1 27.3 38.6 4 4 A Q H > S+ 0 0 24 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.870 108.7 52.7 -65.2 -41.2 11.1 24.8 36.5 5 5 A F H X S+ 0 0 28 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.924 108.3 52.3 -64.2 -39.3 11.1 27.0 33.4 6 6 A K H X S+ 0 0 59 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.912 109.4 48.9 -58.2 -46.5 14.9 27.3 33.8 7 7 A N H X S+ 0 0 75 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.870 108.2 54.3 -62.2 -37.2 15.2 23.5 33.9 8 8 A M H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 5,-0.3 0.926 110.0 46.3 -63.7 -42.5 12.9 23.3 30.8 9 9 A I H X S+ 0 0 7 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.908 108.1 55.7 -65.7 -39.7 15.2 25.6 28.9 10 10 A Q H < S+ 0 0 79 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.825 110.5 50.9 -58.1 -28.0 18.3 23.7 30.1 11 11 A a H < S+ 0 0 19 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.917 116.8 31.6 -77.0 -51.3 16.5 20.7 28.6 12 12 A T H < S+ 0 0 25 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.1 0.641 132.1 36.1 -84.5 -21.9 15.7 21.9 25.0 13 13 A V >< + 0 0 10 -4,-2.3 3,-1.8 -5,-0.3 -1,-0.2 -0.525 65.7 156.3-129.7 69.5 18.7 24.1 24.8 14 14 A P T 3 + 0 0 106 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.809 69.4 68.7 -68.2 -26.4 21.6 22.3 26.7 15 15 A K T 3 S+ 0 0 149 -3,-0.1 2,-0.3 2,-0.0 -5,-0.1 0.560 98.5 57.3 -65.6 -11.5 24.2 24.2 24.7 16 17 A R S < S- 0 0 60 -3,-1.8 2,-0.2 -7,-0.2 -3,-0.1 -0.940 78.1-114.7-131.8 154.9 23.3 27.7 26.5 17 18 A S > - 0 0 45 -2,-0.3 3,-1.5 1,-0.1 4,-0.4 -0.520 31.0-123.7 -67.8 148.9 23.1 29.3 29.9 18 19 A W T >> S+ 0 0 74 1,-0.3 4,-1.8 2,-0.2 3,-1.6 0.809 111.1 69.1 -64.7 -26.7 19.6 30.4 30.9 19 20 A W H 3> S+ 0 0 27 1,-0.3 4,-0.7 2,-0.2 -1,-0.3 0.808 85.0 69.4 -61.6 -27.5 21.0 33.9 31.3 20 21 A D H <4 S+ 0 0 37 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.783 110.1 34.5 -61.0 -29.1 21.5 34.0 27.5 21 22 A F H X4 S+ 0 0 8 -3,-1.6 3,-1.8 -4,-0.4 -2,-0.2 0.820 102.5 74.9 -93.7 -29.0 17.7 34.1 27.3 22 23 A A H 3< S+ 0 0 34 -4,-1.8 8,-0.3 1,-0.3 -2,-0.2 0.531 109.7 28.0 -62.7 -15.0 17.0 36.2 30.5 23 24 A D T 3< S+ 0 0 6 -4,-0.7 88,-3.4 6,-0.2 2,-0.4 -0.111 92.4 128.7-140.1 40.8 18.1 39.5 28.9 24 25 A Y B <> -A 110 0A 0 -3,-1.8 4,-1.9 86,-0.2 5,-0.5 -0.806 64.7 -32.1-101.4 134.2 17.4 38.9 25.2 25 26 A G T 4 S- 0 0 3 84,-3.2 87,-0.2 -2,-0.4 4,-0.2 -0.081 95.7 -52.3 67.0-162.2 15.4 41.1 22.9 26 27 A b T 4 S+ 0 0 0 9,-0.1 6,-2.8 91,-0.1 7,-0.7 0.598 134.6 29.2 -86.1 -13.5 12.5 43.3 23.9 27 28 A Y T 4 S+ 0 0 22 -3,-0.3 -2,-0.2 4,-0.2 -1,-0.1 0.612 92.1 81.2-125.2 -18.7 10.6 40.5 25.6 28 29 A c S < S- 0 0 26 -4,-1.9 -3,-0.1 2,-0.1 3,-0.1 0.868 116.5 -15.2 -72.0 -31.9 12.7 37.8 27.1 29 30 A G S S+ 0 0 15 1,-0.5 -6,-0.2 -5,-0.5 121,-0.1 0.261 122.3 17.1-125.6 -95.4 13.5 39.6 30.3 30 31 A R S S+ 0 0 10 -8,-0.3 2,-1.2 1,-0.1 -1,-0.5 -0.251 108.2 32.2 -84.3 162.9 13.0 43.3 30.7 31 32 A G - 0 0 21 111,-0.4 -4,-0.2 1,-0.2 -1,-0.1 -0.696 63.8-163.0 94.8 -86.5 10.9 45.7 28.7 32 33 A G + 0 0 24 -6,-2.8 2,-0.3 -2,-1.2 -5,-0.2 0.686 58.7 72.6 78.9 16.4 8.0 43.4 27.6 33 34 A S + 0 0 37 -7,-0.7 -1,-0.2 -3,-0.1 2,-0.2 -0.948 58.7 57.3-152.2 172.2 6.8 45.7 24.8 34 35 A G S S- 0 0 23 -2,-0.3 84,-0.1 -3,-0.1 85,-0.1 -0.461 94.7 -32.9 98.8-172.7 7.6 47.0 21.4 35 36 A T - 0 0 106 84,-0.5 -9,-0.1 82,-0.2 -2,-0.1 -0.718 68.2-111.2 -84.5 126.1 8.2 45.0 18.2 36 37 A P - 0 0 33 0, 0.0 6,-0.1 0, 0.0 -1,-0.1 -0.312 24.0-141.9 -54.0 132.4 9.9 41.6 18.8 37 38 A I S S- 0 0 47 72,-0.1 2,-0.3 1,-0.1 -12,-0.0 0.719 70.1 -19.1 -76.5 -21.3 13.4 41.9 17.3 38 39 A D S > S- 0 0 38 71,-0.1 4,-2.0 1,-0.0 5,-0.1 -0.923 85.0 -71.8-164.4-174.1 13.5 38.4 15.9 39 40 A D H > S+ 0 0 79 -2,-0.3 4,-2.0 2,-0.2 5,-0.1 0.883 126.3 52.5 -64.5 -38.5 11.9 35.0 16.1 40 41 A L H > S+ 0 0 1 64,-0.5 4,-1.6 2,-0.2 -1,-0.2 0.938 110.0 49.6 -62.3 -45.2 13.5 34.1 19.5 41 42 A D H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.897 107.1 55.4 -62.0 -34.9 12.1 37.4 20.9 42 43 A R H X S+ 0 0 123 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.894 100.8 58.8 -64.5 -38.5 8.7 36.5 19.5 43 44 A d H X S+ 0 0 4 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.913 108.6 46.2 -50.4 -45.4 8.9 33.2 21.5 44 45 A c H X S+ 0 0 4 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.860 108.3 53.8 -68.9 -36.8 9.2 35.4 24.5 45 46 A Q H X S+ 0 0 49 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.928 110.9 47.5 -61.0 -45.4 6.4 37.7 23.5 46 47 A V H X S+ 0 0 87 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.888 110.1 52.9 -62.2 -37.6 4.1 34.7 23.2 47 48 A H H X S+ 0 0 14 -4,-1.8 4,-2.5 -5,-0.2 -1,-0.2 0.922 109.3 48.7 -65.8 -41.6 5.3 33.4 26.5 48 49 A D H X S+ 0 0 18 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.945 112.2 48.4 -64.6 -43.3 4.4 36.7 28.1 49 50 A N H X S+ 0 0 86 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.911 110.2 52.7 -64.3 -38.9 1.0 36.6 26.5 50 51 A e H X S+ 0 0 34 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.914 109.5 47.6 -61.9 -44.4 0.5 33.0 27.6 51 52 A Y H X S+ 0 0 3 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.875 107.2 57.9 -62.2 -37.9 1.3 33.9 31.3 52 53 A N H < S+ 0 0 58 -4,-2.3 4,-0.4 2,-0.2 -1,-0.2 0.906 108.0 45.7 -63.5 -39.9 -1.1 36.8 31.0 53 54 A S H >X S+ 0 0 67 -4,-1.9 3,-1.5 1,-0.2 4,-0.5 0.943 111.5 53.6 -64.0 -45.3 -3.9 34.4 30.1 54 55 A A H >< S+ 0 0 0 -4,-2.5 3,-1.4 1,-0.3 -2,-0.2 0.860 99.6 61.6 -57.4 -38.1 -2.8 32.1 32.9 55 56 A R T 3< S+ 0 0 46 -4,-2.4 -1,-0.3 1,-0.3 4,-0.2 0.601 85.6 74.9 -68.5 -15.2 -3.0 34.9 35.6 56 57 A E T <4 S+ 0 0 159 -3,-1.5 2,-0.5 -4,-0.4 -1,-0.3 0.862 76.7 85.2 -61.6 -38.5 -6.7 35.4 34.9 57 58 A Q S X< S- 0 0 49 -3,-1.4 3,-2.0 -4,-0.5 122,-0.1 -0.556 99.2-114.6 -63.5 114.7 -7.2 32.1 36.9 58 59 A G T 3 S+ 0 0 61 -2,-0.5 3,-0.1 1,-0.3 27,-0.1 -0.289 96.5 18.5 -66.9 140.3 -7.2 33.6 40.4 59 60 A G T 3 S+ 0 0 62 1,-0.2 2,-0.9 -4,-0.2 -1,-0.3 0.156 94.0 131.2 87.5 -13.5 -4.4 32.7 42.7 60 61 A f < + 0 0 6 -3,-2.0 -1,-0.2 -5,-0.2 3,-0.1 -0.612 28.2 171.5 -81.4 105.3 -2.5 31.7 39.6 61 62 A R >> - 0 0 65 -2,-0.9 4,-2.1 1,-0.1 3,-1.7 -0.898 18.1-160.3-114.4 95.7 0.9 33.3 39.7 62 63 A P T 34 S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -10,-0.0 0.794 87.6 53.9 -49.1 -37.9 2.9 31.7 36.8 63 64 A K T 34 S+ 0 0 85 1,-0.2 -61,-2.4 -62,-0.1 -60,-0.3 0.760 121.2 29.8 -71.7 -23.7 6.3 32.6 38.2 64 65 A Q T <4 S+ 0 0 113 -3,-1.7 2,-0.4 -63,-0.2 -1,-0.2 0.560 89.8 108.1-110.8 -14.9 5.6 30.9 41.5 65 66 A K < - 0 0 64 -4,-2.1 2,-0.5 20,-0.1 -5,-0.0 -0.559 60.3-143.7 -74.7 122.8 3.2 28.1 40.7 66 67 A T + 0 0 89 -2,-0.4 2,-0.2 -65,-0.0 20,-0.1 -0.753 24.9 178.4 -87.3 129.9 4.9 24.7 40.9 67 68 A Y - 0 0 5 -2,-0.5 2,-0.5 19,-0.1 20,-0.1 -0.610 30.5-105.9-121.3-179.6 3.7 22.2 38.3 68 69 A S + 0 0 47 -2,-0.2 11,-2.2 11,-0.2 2,-0.3 -0.956 50.6 145.2-112.2 123.9 4.6 18.6 37.4 69 70 A Y E -B 78 0B 57 -2,-0.5 2,-0.3 9,-0.2 9,-0.2 -0.961 32.0-141.8-151.2 168.0 6.6 18.0 34.3 70 71 A E E -B 77 0B 112 7,-2.3 7,-2.0 -2,-0.3 2,-0.5 -0.992 2.9-155.1-138.1 143.4 9.3 15.8 32.8 71 72 A a E +B 76 0B 51 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.943 26.3 168.2-115.7 105.0 12.3 16.4 30.5 72 73 A K E > -B 75 0B 128 3,-1.7 3,-2.8 -2,-0.5 2,-0.4 -0.975 68.6 -23.4-125.2 122.7 13.2 13.2 28.6 73 74 A A T 3 S- 0 0 102 -2,-0.5 3,-0.1 1,-0.3 -1,-0.0 0.148 127.0 -52.9 69.4 -23.2 15.6 13.0 25.7 74 75 A G T 3 S+ 0 0 29 -2,-0.4 2,-0.7 1,-0.2 -1,-0.3 0.273 113.4 120.4 137.2 4.2 14.9 16.7 25.1 75 76 A T E < -B 72 0B 102 -3,-2.8 -3,-1.7 2,-0.0 2,-0.2 -0.861 51.2-150.3-108.9 108.1 11.1 16.2 25.0 76 77 A L E -B 71 0B 12 -2,-0.7 2,-0.4 -5,-0.2 -5,-0.2 -0.526 14.5-177.3 -74.9 136.1 9.1 18.1 27.6 77 78 A S E -B 70 0B 66 -7,-2.0 -7,-2.3 -2,-0.2 2,-0.5 -0.999 20.6-142.9-134.2 132.5 5.8 16.7 28.9 78 79 A g E -B 69 0B 38 -2,-0.4 -9,-0.2 -9,-0.2 9,-0.0 -0.856 32.8-124.4 -89.6 128.1 3.4 18.4 31.4 79 80 A S > - 0 0 51 -11,-2.2 3,-0.7 -2,-0.5 -11,-0.2 -0.267 10.3-119.6 -71.9 162.2 1.9 15.6 33.6 80 81 A G T 3 S+ 0 0 86 1,-0.2 -1,-0.1 -2,-0.0 7,-0.1 0.509 102.0 77.6 -81.7 -2.0 -1.8 14.9 34.1 81 82 A S T 3 + 0 0 95 -13,-0.1 -1,-0.2 5,-0.0 6,-0.1 0.852 69.1 112.4 -72.5 -34.4 -1.6 15.6 37.8 82 83 A N < - 0 0 23 -3,-0.7 -15,-0.1 -14,-0.2 -4,-0.0 -0.069 62.3-135.7 -47.5 128.8 -1.6 19.4 37.3 83 84 A N > - 0 0 90 4,-0.1 4,-3.1 1,-0.1 5,-0.3 0.028 44.4 -80.5 -70.2-173.3 -4.5 21.6 38.5 84 85 A S H > S+ 0 0 79 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.935 131.5 41.6 -62.3 -50.1 -5.8 24.3 36.2 85 86 A f H > S+ 0 0 15 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.968 117.8 48.0 -61.8 -51.1 -3.2 26.9 37.0 86 87 A A H > S+ 0 0 3 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.900 111.7 49.2 -54.6 -49.3 -0.4 24.3 37.0 87 88 A A H X S+ 0 0 44 -4,-3.1 4,-2.1 2,-0.2 -1,-0.2 0.918 114.3 45.9 -59.0 -44.9 -1.5 22.8 33.7 88 89 A T H X S+ 0 0 50 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.933 115.7 44.0 -65.7 -45.3 -1.7 26.2 32.0 89 90 A V H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.910 111.9 53.2 -72.0 -35.6 1.6 27.5 33.3 90 91 A g H X S+ 0 0 0 -4,-2.8 4,-3.0 -5,-0.3 -1,-0.2 0.935 109.5 49.7 -62.5 -43.9 3.4 24.3 32.5 91 92 A D H X S+ 0 0 63 -4,-2.1 4,-2.7 -5,-0.2 5,-0.2 0.921 108.8 51.7 -61.7 -43.3 2.1 24.5 28.9 92 93 A e H X S+ 0 0 2 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.921 113.7 44.7 -54.4 -48.4 3.3 28.1 28.6 93 94 A D H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.909 113.0 50.7 -64.1 -46.7 6.7 27.1 29.8 94 95 A R H X S+ 0 0 70 -4,-3.0 4,-2.4 -5,-0.2 5,-0.2 0.948 111.1 47.6 -55.9 -52.7 6.9 24.0 27.6 95 96 A L H X S+ 0 0 82 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.886 112.5 49.4 -59.7 -41.7 5.9 25.9 24.5 96 97 A A H X S+ 0 0 5 -4,-2.1 4,-2.8 -5,-0.2 -2,-0.2 0.938 109.3 51.3 -66.7 -43.4 8.4 28.6 25.2 97 98 A A H X S+ 0 0 0 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.904 112.8 46.2 -60.2 -41.6 11.3 26.1 25.8 98 99 A I H X S+ 0 0 83 -4,-2.4 4,-1.3 -5,-0.2 -1,-0.2 0.937 112.5 51.2 -62.7 -45.1 10.5 24.3 22.5 99 100 A d H X S+ 0 0 47 -4,-2.3 4,-1.0 -5,-0.2 3,-0.3 0.901 106.4 54.2 -60.8 -41.1 10.3 27.7 20.7 100 101 A F H < S+ 0 0 10 -4,-2.8 3,-0.5 1,-0.2 -1,-0.2 0.874 106.0 52.5 -58.9 -44.7 13.7 28.8 22.1 101 102 A A H < S+ 0 0 52 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.805 112.2 46.0 -59.9 -34.5 15.4 25.7 20.7 102 103 A G H < S+ 0 0 71 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.585 96.9 84.4 -87.8 -12.2 14.0 26.3 17.2 103 104 A A S < S- 0 0 16 -4,-1.0 2,-0.1 -3,-0.5 -65,-0.0 -0.715 83.9-110.1 -98.0 139.7 14.8 30.0 16.9 104 105 A P - 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0 0 46 1,-0.1 2,-0.2 -122,-0.1 17,-0.1 -0.108 66.8-158.3 80.1-175.1 12.5 40.7 37.8 152 33 B G + 0 0 37 -4,-0.0 2,-0.3 16,-0.0 -5,-0.2 -0.693 17.1 158.8 163.2 144.2 15.5 41.2 40.1 153 34 B S + 0 0 51 -7,-0.7 2,-0.1 -2,-0.2 86,-0.1 -0.948 43.1 41.3-169.6 166.7 18.1 39.3 42.1 154 35 B G S S- 0 0 25 85,-0.3 84,-0.1 -2,-0.3 85,-0.1 -0.349 98.9 -27.9 79.5-165.2 21.5 39.8 43.6 155 36 B T - 0 0 112 82,-0.4 -9,-0.2 1,-0.1 -2,-0.1 -0.741 67.0-109.2 -94.6 126.0 22.7 42.9 45.5 156 37 B P - 0 0 21 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.256 23.3-146.5 -54.0 133.0 21.2 46.3 44.7 157 38 B V - 0 0 31 72,-0.1 2,-0.2 1,-0.0 -12,-0.1 0.715 66.8 -20.4 -80.7 -18.8 23.9 48.3 42.9 158 39 B D S > S- 0 0 25 1,-0.1 4,-1.7 71,-0.1 5,-0.1 -0.887 83.5 -68.9-168.5-170.8 22.9 51.8 44.3 159 40 B D H > S+ 0 0 86 -2,-0.2 4,-1.8 2,-0.2 5,-0.1 0.925 127.8 51.1 -65.9 -45.4 20.2 53.8 45.9 160 41 B L H > S+ 0 0 1 64,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.914 109.7 50.8 -57.0 -44.0 18.0 53.9 42.8 161 42 B D H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.868 105.6 56.3 -64.6 -33.6 18.3 50.1 42.6 162 43 B R H X S+ 0 0 112 -4,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.882 102.9 55.4 -64.5 -39.2 17.3 49.8 46.2 163 44 B k H X S+ 0 0 7 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.915 109.4 46.9 -56.7 -42.0 14.1 51.7 45.3 164 45 B j H X S+ 0 0 5 -4,-1.6 4,-3.0 2,-0.2 -2,-0.2 0.882 108.5 54.3 -70.7 -38.0 13.3 49.1 42.7 165 46 B Q H X S+ 0 0 52 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.934 111.1 45.5 -59.6 -44.6 14.1 46.3 45.1 166 47 B V H X S+ 0 0 97 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.883 111.3 53.6 -67.7 -35.7 11.5 47.7 47.5 167 48 B H H X S+ 0 0 12 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.936 109.1 48.0 -65.8 -42.9 9.1 48.3 44.7 168 49 B D H X S+ 0 0 32 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.910 112.6 49.4 -62.2 -38.2 9.4 44.5 43.6 169 50 B N H X S+ 0 0 87 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.913 110.0 51.2 -63.7 -41.9 8.9 43.5 47.3 170 51 B l H X S+ 0 0 37 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.923 110.5 47.8 -61.4 -47.6 5.9 45.8 47.5 171 52 B Y H X S+ 0 0 9 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.866 107.9 57.2 -60.0 -39.4 4.4 44.2 44.3 172 53 B N H < S+ 0 0 63 -4,-2.0 4,-0.4 -5,-0.2 -2,-0.2 0.902 109.6 44.3 -54.9 -45.4 5.2 40.8 45.9 173 54 B E H >< S+ 0 0 109 -4,-2.1 3,-1.2 1,-0.2 4,-0.4 0.891 111.1 53.4 -68.7 -40.5 3.0 41.7 48.9 174 55 B A H >< S+ 0 0 3 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.872 100.5 62.5 -62.8 -32.3 0.3 43.2 46.7 175 56 B E T 3< S+ 0 0 51 -4,-2.1 -1,-0.2 1,-0.3 5,-0.2 0.660 87.2 72.0 -69.8 -12.7 0.2 39.9 44.8 176 57 B K T < S+ 0 0 139 -3,-1.2 2,-0.4 -4,-0.4 -1,-0.3 0.720 77.6 93.2 -70.7 -20.4 -0.9 38.1 48.0 177 58 B I S X S- 0 0 53 -3,-1.8 3,-2.5 -4,-0.4 -118,-0.2 -0.622 97.6-102.6 -74.4 127.6 -4.2 39.8 47.5 178 59 B S T 3 S+ 0 0 107 -2,-0.4 27,-0.1 1,-0.3 3,-0.1 -0.312 101.1 2.7 -57.0 122.5 -6.4 37.4 45.6 179 60 B G T 3 S+ 0 0 48 1,-0.2 2,-0.6 -4,-0.2 -1,-0.3 0.439 91.9 145.6 84.1 3.0 -6.7 38.3 42.0 180 61 B m < + 0 0 4 -3,-2.5 -1,-0.2 -5,-0.2 -3,-0.1 -0.650 21.7 176.2 -84.8 112.8 -4.4 41.3 42.4 181 62 B N >> - 0 0 54 -2,-0.6 4,-2.6 1,-0.1 3,-1.9 -0.870 12.8-164.6-115.8 94.2 -2.3 41.8 39.2 182 63 B P T 34 S+ 0 0 4 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.782 85.8 54.6 -53.2 -32.5 -0.2 45.0 39.8 183 64 B R T 34 S+ 0 0 75 1,-0.2 -61,-2.4 -62,-0.2 -60,-0.3 0.756 121.0 29.5 -74.9 -21.4 0.8 45.4 36.1 184 65 B F T <4 S+ 0 0 113 -3,-1.9 2,-0.5 -63,-0.2 -1,-0.2 0.608 88.2 106.1-112.4 -22.5 -2.9 45.4 35.0 185 66 B R < - 0 0 103 -4,-2.6 2,-0.5 20,-0.1 -5,-0.0 -0.515 60.2-145.5 -68.8 120.1 -4.9 46.8 37.9 186 67 B T - 0 0 84 -2,-0.5 2,-0.2 -65,-0.0 20,-0.1 -0.720 23.3-174.6 -86.0 126.0 -6.0 50.3 37.1 187 68 B Y - 0 0 7 -2,-0.5 2,-0.5 19,-0.1 15,-0.1 -0.607 25.9-109.3-111.8 178.0 -6.1 52.5 40.2 188 69 B S + 0 0 17 -2,-0.2 11,-1.8 11,-0.2 2,-0.3 -0.936 51.1 138.5-114.3 124.3 -7.3 56.0 41.0 189 70 B Y E -E 198 0D 51 -2,-0.5 2,-0.4 9,-0.3 9,-0.2 -0.944 37.4-131.1-153.1 171.0 -4.6 58.7 41.7 190 71 B E E -E 197 0D 94 7,-2.3 7,-2.2 -2,-0.3 2,-0.6 -0.993 1.7-159.3-132.1 138.0 -3.7 62.3 41.1 191 72 B h E +E 196 0D 61 -2,-0.4 2,-0.5 5,-0.2 5,-0.2 -0.989 23.9 174.3-108.9 112.0 -0.4 63.9 40.0 192 73 B T E > -E 195 0D 82 3,-2.8 3,-1.9 -2,-0.6 -2,-0.1 -0.940 68.6 -33.6-122.9 105.8 -0.8 67.6 41.1 193 74 B A T 3 S- 0 0 108 -2,-0.5 3,-0.1 1,-0.3 -1,-0.1 0.893 126.4 -42.1 50.0 47.0 2.3 69.8 40.5 194 75 B G T 3 S+ 0 0 37 1,-0.3 2,-0.4 -61,-0.0 -1,-0.3 0.449 115.2 116.6 81.8 -1.4 4.7 66.9 41.2 195 76 B T E < -E 192 0D 83 -3,-1.9 -3,-2.8 2,-0.0 2,-0.5 -0.841 51.6-153.0-100.3 137.2 2.7 65.5 44.2 196 77 B L E +E 191 0D 10 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.948 14.6 179.6-108.2 131.9 1.2 62.0 43.9 197 78 B T E -E 190 0D 51 -7,-2.2 -7,-2.3 -2,-0.5 2,-0.5 -0.987 22.2-143.7-133.3 127.0 -1.9 61.1 45.8 198 79 B n E -E 189 0D 34 -2,-0.4 -9,-0.3 -9,-0.2 4,-0.1 -0.753 31.7-131.9 -83.5 131.3 -3.6 57.8 45.8 199 80 B T - 0 0 36 -11,-1.8 3,-0.3 -2,-0.5 -11,-0.2 -0.187 13.3-112.5 -83.5 168.6 -7.3 58.5 46.0 200 81 B G S S+ 0 0 83 1,-0.2 2,-1.2 -11,-0.0 -1,-0.1 0.714 98.9 81.4 -71.8 -17.6 -9.9 56.9 48.3 201 82 B R + 0 0 194 5,-0.0 2,-0.4 6,-0.0 -1,-0.2 -0.226 67.4 111.1 -89.7 47.5 -11.8 55.2 45.5 202 83 B N - 0 0 27 -2,-1.2 -15,-0.1 -3,-0.3 -4,-0.0 -0.971 61.2-135.0-119.1 136.4 -9.5 52.2 45.3 203 84 B N > - 0 0 79 -2,-0.4 4,-2.9 1,-0.1 5,-0.3 -0.168 47.5 -82.9 -72.5-177.6 -10.3 48.6 46.2 204 85 B A H > S+ 0 0 64 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.888 130.5 44.8 -57.7 -46.1 -7.7 46.7 48.2 205 86 B m H > S+ 0 0 9 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.964 116.2 46.1 -63.5 -50.4 -5.6 45.6 45.2 206 87 B A H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.906 112.9 49.7 -60.3 -41.5 -5.8 49.1 43.6 207 88 B A H X S+ 0 0 40 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.916 113.5 46.2 -65.4 -42.7 -4.9 50.9 46.8 208 89 B S H X S+ 0 0 45 -4,-2.1 4,-2.0 -5,-0.3 -2,-0.2 0.921 115.7 44.7 -66.2 -43.9 -1.9 48.6 47.5 209 90 B V H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 5,-0.2 0.917 111.8 52.4 -69.6 -43.0 -0.6 48.8 44.0 210 91 B n H X S+ 0 0 0 -4,-2.9 4,-2.8 -5,-0.3 -1,-0.2 0.921 109.5 50.0 -55.2 -47.8 -1.1 52.6 43.8 211 92 B D H X S+ 0 0 63 -4,-2.0 4,-2.7 -5,-0.2 5,-0.3 0.911 109.3 51.2 -61.4 -41.6 0.8 53.0 47.0 212 93 B l H X S+ 0 0 4 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.933 114.0 44.6 -55.1 -50.2 3.7 50.8 45.7 213 94 B D H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.914 113.7 49.1 -64.1 -42.0 3.9 52.9 42.6 214 95 B R H X S+ 0 0 71 -4,-2.8 4,-2.2 -5,-0.2 5,-0.2 0.948 112.2 47.2 -63.9 -48.4 3.6 56.2 44.4 215 96 B L H X S+ 0 0 87 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.898 113.7 49.2 -65.5 -36.6 6.3 55.3 47.0 216 97 B A H X S+ 0 0 4 -4,-2.2 4,-3.0 -5,-0.3 -1,-0.2 0.916 108.4 51.5 -68.3 -42.1 8.7 54.1 44.2 217 98 B A H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.892 113.4 46.1 -65.6 -34.9 8.2 57.2 42.0 218 99 B I H X S+ 0 0 83 -4,-2.2 4,-0.8 2,-0.2 -1,-0.2 0.899 112.1 50.2 -69.6 -43.7 9.1 59.3 45.0 219 100 B k H >X S+ 0 0 57 -4,-2.5 3,-1.1 -5,-0.2 4,-1.0 0.918 110.4 50.8 -58.3 -45.6 12.1 57.1 45.9 220 101 B F H >< S+ 0 0 9 -4,-3.0 3,-0.7 1,-0.3 -1,-0.2 0.900 104.6 57.4 -60.2 -41.3 13.3 57.4 42.2 221 102 B A H 3< S+ 0 0 53 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.710 108.7 46.9 -65.0 -19.2 13.0 61.1 42.3 222 103 B G H << S+ 0 0 68 -3,-1.1 -1,-0.2 -4,-0.8 -2,-0.2 0.666 97.3 88.5 -94.1 -14.0 15.4 61.2 45.3 223 104 B A S << S- 0 0 17 -4,-1.0 2,-0.1 -3,-0.7 -65,-0.0 -0.576 79.1-116.6 -96.0 141.6 18.0 58.9 43.9 224 105 B P - 0 0 90 0, 0.0 2,-0.6 0, 0.0 -64,-0.4 -0.499 27.7-135.5 -69.2 136.7 21.1 59.8 41.8 225 106 B Y - 0 0 39 -2,-0.1 2,-0.6 -66,-0.1 3,-0.1 -0.912 17.0-163.6-100.5 120.8 20.9 58.2 38.3 226 107 B N > - 0 0 70 -2,-0.6 3,-2.2 1,-0.1 4,-0.2 -0.917 13.2-152.5-106.8 112.8 24.2 56.7 37.2 227 108 B D G > S+ 0 0 118 -2,-0.6 3,-1.4 1,-0.3 -1,-0.1 0.786 95.2 63.7 -56.3 -25.7 24.4 56.0 33.4 228 109 B N G 3 S+ 0 0 143 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.478 99.7 55.1 -75.7 -2.3 26.9 53.1 34.1 229 110 B N G X S+ 0 0 13 -3,-2.2 -84,-3.4 3,-0.1 3,-0.5 0.378 84.3 102.7-109.3 4.0 24.1 51.3 36.0 230 111 B Y B < S-D 144 0C 40 -3,-1.4 -86,-0.3 1,-0.2 -89,-0.1 -0.687 97.8 -7.3 -86.4 131.7 21.7 51.4 33.1 231 112 B N T 3 S- 0 0 25 -88,-3.2 -1,-0.2 -2,-0.3 -87,-0.1 0.887 92.4-178.9 52.6 54.1 21.3 48.1 31.2 232 113 B I < - 0 0 11 -3,-0.5 2,-1.2 -87,-0.2 3,-0.1 -0.198 42.2 -83.8 -79.6 173.6 24.2 46.4 33.0 233 114 B D > - 0 0 84 1,-0.2 4,-2.1 2,-0.1 5,-0.2 -0.637 45.9-171.9 -76.3 97.3 25.5 42.9 32.6 234 115 B L H > S+ 0 0 17 -2,-1.2 4,-2.5 1,-0.2 -1,-0.2 0.880 80.0 53.7 -64.5 -40.8 23.0 41.1 34.8 235 116 B Q H 4 S+ 0 0 83 1,-0.2 -1,-0.2 2,-0.2 4,-0.2 0.912 115.6 40.7 -58.8 -44.2 24.8 37.7 34.8 236 117 B A H 4 S+ 0 0 70 1,-0.1 -2,-0.2 2,-0.1 -1,-0.2 0.790 127.7 28.2 -75.2 -31.9 28.0 39.3 35.9 237 118 B R H < S+ 0 0 118 -4,-2.1 -82,-0.4 1,-0.1 -3,-0.2 0.636 113.1 55.7-110.7 -13.1 26.6 41.8 38.5 238 119 B i < 0 0 3 -4,-2.5 -1,-0.1 -5,-0.2 -2,-0.1 -0.006 360.0 360.0-116.7 30.8 23.4 40.3 39.9 239 120 B N 0 0 141 -4,-0.2 -85,-0.3 -3,-0.1 -1,-0.2 0.564 360.0 360.0-102.6 360.0 24.0 36.8 41.3