==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-SEP-07 2RD4 . COMPND 2 MOLECULE: PHOSPHOLIPASE A2 ISOFORM 1; . SOURCE 2 ORGANISM_SCIENTIFIC: NAJA SAGITTIFERA; . AUTHOR Z.MIRZA,A.KAUR,N.SINGH,M.SINHA,S.SHARMA,A.SRINIVASAN,P.KAUR, . 243 3 14 14 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11396.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 70.4 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 . 16 6.6 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 . 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 . 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 . 19 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 16.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 38.3 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 2 1 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 26 0, 0.0 4,-2.2 0, 0.0 3,-1.0 0.000 360.0 360.0 360.0 168.4 -8.0 36.9 5.1 2 2 A T H 3> + 0 0 48 61,-1.4 4,-2.0 1,-0.3 5,-0.1 0.736 360.0 63.8 -63.6 -22.4 -11.0 35.3 3.4 3 3 A Y H 3> S+ 0 0 167 60,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.875 109.1 42.7 -66.8 -34.2 -13.4 37.8 4.9 4 4 A Q H X> S+ 0 0 25 -3,-1.0 4,-1.8 2,-0.2 3,-1.1 0.929 111.9 51.0 -75.4 -47.3 -11.4 40.4 2.9 5 5 A F H 3X S+ 0 0 13 -4,-2.2 4,-1.5 1,-0.3 -2,-0.2 0.843 107.7 56.1 -58.7 -31.2 -11.2 38.2 -0.3 6 6 A K H 3X S+ 0 0 80 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.3 0.747 106.5 50.7 -71.6 -24.0 -15.0 37.8 0.1 7 7 A N H < + 0 0 13 -4,-3.0 3,-2.3 -5,-0.2 -1,-0.2 -0.409 68.4 162.4-135.6 56.7 -19.1 40.9 -9.0 14 14 A P T 3 + 0 0 106 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.652 67.6 67.6 -53.1 -19.3 -22.0 42.5 -7.0 15 15 A K T 3 S+ 0 0 165 -3,-0.1 2,-0.4 1,-0.1 -5,-0.1 0.513 95.1 69.0 -83.9 0.3 -24.6 40.5 -8.8 16 17 A R S < S- 0 0 63 -3,-2.3 -3,-0.1 -7,-0.2 -1,-0.1 -0.956 77.4-125.3-129.6 135.8 -23.4 37.2 -7.2 17 18 A S > - 0 0 48 -2,-0.4 3,-1.0 1,-0.1 4,-0.2 -0.331 31.1-121.8 -61.9 149.2 -23.4 35.7 -3.8 18 19 A W G > S+ 0 0 69 1,-0.2 3,-2.2 2,-0.2 4,-0.5 0.847 110.8 68.9 -65.3 -28.9 -19.9 34.7 -2.8 19 20 A W G >> S+ 0 0 43 1,-0.3 3,-1.2 2,-0.2 4,-0.6 0.810 81.7 74.6 -57.4 -30.8 -21.2 31.1 -2.3 20 21 A D G <4 S+ 0 0 31 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.734 105.7 36.5 -53.3 -22.8 -21.7 31.0 -6.1 21 22 A F G X4 S+ 0 0 6 -3,-2.2 3,-0.6 -4,-0.2 -1,-0.3 0.462 97.7 80.5-110.1 -5.0 -17.9 30.6 -6.2 22 23 A A T <4 S+ 0 0 20 -3,-1.2 8,-0.3 -4,-0.5 -2,-0.2 0.585 109.6 21.4 -79.6 -9.5 -17.3 28.5 -3.2 23 24 A D T 3< S+ 0 0 6 -4,-0.6 88,-3.1 6,-0.2 2,-0.5 -0.092 90.6 130.6-151.2 41.4 -18.2 25.3 -4.9 24 25 A Y B <> -A 110 0A 0 -3,-0.6 4,-1.5 86,-0.2 3,-0.3 -0.876 66.3 -31.8-109.2 129.1 -17.8 25.9 -8.6 25 26 A G T 4 S- 0 0 3 84,-2.4 87,-0.2 -2,-0.5 5,-0.2 -0.216 98.5 -51.8 67.2-158.3 -15.9 23.7 -11.0 26 27 A b T 4 S+ 0 0 0 9,-0.1 6,-0.9 91,-0.1 7,-0.7 0.666 133.1 30.1 -90.1 -18.1 -12.8 21.6 -10.0 27 28 A Y T 4 S+ 0 0 22 -3,-0.3 -2,-0.2 5,-0.2 -1,-0.1 0.690 89.5 84.9-115.8 -20.3 -10.8 24.4 -8.4 28 29 A c S < S- 0 0 17 -4,-1.5 -3,-0.1 2,-0.1 -4,-0.1 0.400 116.9 -30.6 -68.3 6.7 -13.0 27.2 -6.8 29 30 A G S S+ 0 0 17 1,-0.4 2,-0.2 -6,-0.1 -6,-0.2 -0.297 119.9 33.8-173.4 -94.5 -13.4 25.2 -3.6 30 31 A R S S+ 0 0 12 -8,-0.3 2,-0.7 -5,-0.2 -1,-0.4 -0.533 107.6 29.8 -85.7 151.8 -13.4 21.5 -3.1 31 32 A G - 0 0 1 111,-0.3 -4,-0.2 -2,-0.2 -1,-0.1 -0.405 64.7-164.5 102.2 -60.3 -11.3 19.1 -5.3 32 33 A G + 0 0 8 -6,-0.9 2,-0.3 -2,-0.7 -5,-0.2 0.759 57.8 79.8 41.4 42.2 -8.3 21.3 -6.2 33 34 A S + 0 0 29 -7,-0.7 2,-0.3 -3,-0.2 -1,-0.1 -0.928 61.3 40.6-171.5 145.6 -7.1 19.0 -9.0 34 35 A G S S- 0 0 25 -2,-0.3 84,-0.1 85,-0.0 85,-0.1 -0.798 92.3 -27.6 115.8-159.6 -7.8 18.1 -12.6 35 36 A T - 0 0 111 -2,-0.3 -9,-0.1 82,-0.2 -2,-0.1 -0.850 66.3-109.0-102.0 126.1 -8.6 20.2 -15.6 36 37 A P - 0 0 18 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.252 22.0-144.9 -50.4 123.7 -10.4 23.5 -15.2 37 38 A I - 0 0 47 1,-0.1 2,-0.3 72,-0.1 -12,-0.1 0.821 69.6 -17.1 -64.8 -31.7 -13.9 23.1 -16.5 38 39 A D S > S- 0 0 27 71,-0.1 4,-2.1 68,-0.0 3,-0.4 -0.957 84.2 -68.0-161.4-180.0 -14.0 26.7 -17.9 39 40 A D H > S+ 0 0 95 -2,-0.3 4,-0.5 1,-0.2 63,-0.1 0.774 128.6 46.4 -47.6 -32.0 -12.7 30.2 -18.0 40 41 A L H >> S+ 0 0 0 64,-0.3 4,-1.3 2,-0.2 3,-0.6 0.863 107.5 53.8 -80.4 -39.8 -13.9 30.8 -14.4 41 42 A D H 3> S+ 0 0 0 -3,-0.4 4,-1.8 1,-0.3 -2,-0.2 0.825 104.8 57.9 -64.2 -29.7 -12.6 27.6 -13.0 42 43 A R H 3X S+ 0 0 114 -4,-2.1 4,-1.8 1,-0.2 -1,-0.3 0.804 98.8 59.3 -69.9 -28.6 -9.2 28.5 -14.4 43 44 A d H X S+ 0 0 23 -4,-2.7 4,-1.4 2,-0.2 3,-0.5 0.936 111.0 46.8 -62.9 -48.5 -4.7 28.3 -5.8 49 50 A N H >X S+ 0 0 86 -4,-2.3 4,-2.2 1,-0.2 3,-0.7 0.949 108.7 57.5 -57.5 -48.0 -1.2 28.4 -7.3 50 51 A e H 3X S+ 0 0 38 -4,-2.3 4,-1.8 1,-0.3 -1,-0.2 0.804 105.3 50.1 -52.0 -34.6 -0.8 32.0 -6.1 51 52 A Y H < S+ 0 0 69 -4,-2.2 3,-1.8 1,-0.2 4,-0.3 0.958 114.3 47.1 -62.1 -47.4 3.8 30.6 -3.8 54 55 A A H >< S+ 0 0 1 -4,-1.8 3,-1.0 1,-0.3 -1,-0.2 0.766 100.5 67.4 -64.8 -24.9 2.7 33.0 -1.0 55 56 A R T 3< S+ 0 0 40 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.555 83.3 79.0 -71.8 -6.1 2.7 30.1 1.5 56 57 A E T < S+ 0 0 159 -3,-1.8 2,-0.4 -4,-0.3 -1,-0.2 0.790 71.2 86.6 -73.2 -30.0 6.5 30.0 1.0 57 58 A Q S X S- 0 0 61 -3,-1.0 3,-2.1 -4,-0.3 122,-0.1 -0.598 97.1 -98.8 -74.3 126.5 7.3 33.0 3.3 58 59 A G T 3 S+ 0 0 70 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 -0.124 104.7 5.0 -47.8 128.8 7.6 31.8 6.9 59 60 A G T 3 S+ 0 0 65 1,-0.2 2,-0.6 -4,-0.2 -1,-0.3 0.133 91.3 136.3 84.3 -23.3 4.5 32.4 8.9 60 61 A f < + 0 0 8 -3,-2.1 -1,-0.2 -6,-0.1 -3,-0.1 -0.462 25.4 174.1 -63.5 106.6 2.6 33.6 5.8 61 62 A R >> - 0 0 64 -2,-0.6 3,-2.1 1,-0.1 4,-1.2 -0.824 17.3-159.8-121.3 90.3 -0.8 32.0 6.0 62 63 A P T 34 S+ 0 0 2 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.743 88.0 51.0 -33.7 -52.3 -3.0 33.3 3.1 63 64 A K T 34 S+ 0 0 84 1,-0.2 -61,-1.4 -62,-0.1 -60,-0.2 0.767 122.1 33.2 -65.5 -25.6 -6.4 32.4 4.6 64 65 A Q T <4 S+ 0 0 103 -3,-2.1 2,-0.5 -63,-0.2 -1,-0.2 0.459 92.3 103.3-111.7 -1.9 -5.6 34.1 7.9 65 66 A K < - 0 0 66 -4,-1.2 2,-0.3 -3,-0.3 -5,-0.0 -0.733 59.0-146.5 -88.9 124.6 -3.3 37.0 6.9 66 67 A T + 0 0 81 -2,-0.5 2,-0.2 -62,-0.0 20,-0.1 -0.695 22.6 176.8 -90.1 137.2 -5.0 40.5 6.9 67 68 A Y - 0 0 8 -2,-0.3 2,-0.7 -66,-0.1 20,-0.1 -0.659 33.9 -95.8-128.8-175.0 -3.9 43.1 4.4 68 69 A S + 0 0 47 11,-0.2 11,-2.6 -2,-0.2 2,-0.3 -0.892 50.6 153.9-110.8 105.9 -4.7 46.6 3.3 69 70 A Y E -B 78 0B 62 -2,-0.7 2,-0.4 9,-0.2 9,-0.2 -0.856 25.6-157.1-127.6 164.0 -7.1 46.9 0.3 70 71 A E E -B 77 0B 98 7,-1.7 7,-0.7 -2,-0.3 2,-0.6 -0.992 2.0-161.0-142.7 130.2 -9.5 49.5 -0.9 71 72 A a E +B 76 0B 50 -2,-0.4 2,-0.4 5,-0.2 5,-0.2 -0.953 23.4 157.6-117.3 112.5 -12.5 48.9 -3.1 72 73 A K E > -B 75 0B 133 3,-2.0 3,-1.3 -2,-0.6 -2,-0.1 -0.967 69.4 -13.6-138.9 118.1 -13.8 52.0 -4.9 73 74 A A T 3 S- 0 0 92 -2,-0.4 3,-0.1 1,-0.3 -2,-0.0 0.269 123.3 -57.8 78.2 -10.2 -15.9 52.0 -8.1 74 75 A G T 3 S+ 0 0 38 1,-0.4 2,-0.6 -61,-0.0 -1,-0.3 0.308 113.0 119.0 115.5 -0.7 -15.1 48.3 -8.9 75 76 A T E < -B 72 0B 74 -3,-1.3 -3,-2.0 2,-0.0 -1,-0.4 -0.888 50.5-158.9-100.5 114.5 -11.5 49.1 -8.9 76 77 A L E -B 71 0B 17 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.509 10.8-177.3 -88.3 164.0 -9.6 47.1 -6.3 77 78 A S E -B 70 0B 48 -7,-0.7 -7,-1.7 -2,-0.2 2,-0.6 -0.865 23.7-146.0-165.2 126.5 -6.2 48.2 -4.9 78 79 A g E -B 69 0B 36 -2,-0.3 -9,-0.2 -9,-0.2 2,-0.1 -0.863 35.1-130.5 -93.0 124.1 -3.7 46.7 -2.5 79 80 A S > - 0 0 51 -11,-2.6 3,-1.1 -2,-0.6 2,-1.0 -0.391 17.8-109.7 -76.7 155.0 -2.1 49.7 -0.7 80 81 A G T 3 S+ 0 0 92 1,-0.2 -1,-0.1 -2,-0.1 7,-0.0 0.024 104.4 81.6 -72.8 33.0 1.6 50.1 -0.3 81 82 A S T 3 + 0 0 94 -2,-1.0 -1,-0.2 -13,-0.2 6,-0.1 0.768 64.2 98.8-103.0 -38.4 1.3 49.4 3.5 82 83 A N S < S- 0 0 23 -3,-1.1 -15,-0.1 -14,-0.2 2,-0.1 -0.070 70.6-127.5 -49.1 148.7 1.1 45.6 3.4 83 84 A N > - 0 0 85 4,-0.0 4,-4.1 1,-0.0 5,-0.3 -0.232 44.5 -71.2 -89.0-175.9 4.3 43.7 4.2 84 85 A S H > S+ 0 0 76 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.895 134.6 34.1 -42.4 -61.1 5.9 41.0 2.0 85 86 A f H >> S+ 0 0 11 2,-0.2 4,-2.9 1,-0.2 3,-1.4 0.990 120.9 48.0 -59.4 -63.1 3.3 38.3 2.8 86 87 A A H 3> S+ 0 0 3 1,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.848 111.5 52.7 -46.5 -40.7 0.3 40.7 3.1 87 88 A A H 3X S+ 0 0 43 -4,-4.1 4,-1.3 2,-0.2 -1,-0.3 0.809 114.6 41.2 -68.7 -29.8 1.4 42.3 -0.2 88 89 A T H X S+ 0 0 88 -4,-2.2 3,-1.4 -5,-0.2 4,-1.1 0.981 111.6 53.9 -64.4 -57.9 -11.1 40.8 -11.3 99 100 A d H >X S+ 0 0 49 -4,-1.9 4,-1.2 1,-0.3 3,-1.1 0.862 105.1 54.8 -42.2 -48.9 -10.8 37.4 -13.2 100 101 A F H 3< S+ 0 0 10 -4,-2.9 3,-0.4 1,-0.3 -1,-0.3 0.861 105.6 53.5 -57.7 -36.4 -14.1 36.4 -11.6 101 102 A A H << S+ 0 0 54 -3,-1.4 -1,-0.3 -4,-1.1 -2,-0.2 0.690 114.7 40.1 -73.5 -18.9 -15.7 39.5 -13.0 102 103 A G H << S+ 0 0 68 -3,-1.1 -1,-0.2 -4,-1.1 -2,-0.2 0.474 96.6 87.2-109.5 -3.1 -14.6 38.8 -16.5 103 104 A A S < S- 0 0 14 -4,-1.2 -65,-0.0 -3,-0.4 -63,-0.0 -0.846 82.7-112.3-101.4 132.2 -15.1 35.1 -16.7 104 105 A P - 0 0 91 0, 0.0 2,-0.5 0, 0.0 -64,-0.3 -0.166 29.1-130.7 -55.3 153.5 -18.5 33.7 -17.8 105 106 A Y - 0 0 45 -66,-0.1 2,-0.6 -65,-0.1 3,-0.1 -0.949 17.1-164.1-115.1 125.8 -20.5 31.9 -15.1 106 107 A N > - 0 0 71 -2,-0.5 3,-1.2 1,-0.2 -68,-0.0 -0.934 12.4-163.6-112.4 119.9 -22.0 28.5 -15.9 107 108 A D G > S+ 0 0 120 -2,-0.6 3,-2.2 1,-0.3 -1,-0.2 0.890 92.6 66.0 -64.6 -37.3 -24.7 27.2 -13.5 108 109 A N G 3 S+ 0 0 129 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.703 98.5 54.7 -56.4 -19.7 -24.1 23.8 -15.0 109 110 A N G < S+ 0 0 17 -3,-1.2 -84,-2.4 3,-0.1 2,-0.5 0.065 84.7 107.2-103.6 23.3 -20.6 23.9 -13.5 110 111 A Y B < S-A 24 0A 50 -3,-2.2 -86,-0.2 1,-0.2 -89,-0.1 -0.883 92.4 -6.8-104.9 131.8 -21.8 24.6 -10.0 111 112 A N S S+ 0 0 43 -88,-3.1 -1,-0.2 -2,-0.5 -87,-0.1 0.926 91.2 179.1 53.7 50.0 -21.5 21.8 -7.4 112 113 A I - 0 0 7 -3,-0.4 2,-1.7 -89,-0.3 3,-0.1 -0.332 43.7 -85.3 -81.0 166.1 -20.5 19.2 -10.0 113 114 A D >> - 0 0 76 1,-0.2 3,-1.3 -2,-0.1 4,-1.2 -0.534 44.0-169.3 -71.9 87.1 -19.6 15.6 -9.4 114 115 A L H >> S+ 0 0 2 -2,-1.7 4,-1.6 1,-0.3 3,-0.6 0.867 80.1 57.8 -46.4 -45.3 -15.9 16.1 -8.4 115 116 A K H 34 S+ 0 0 71 1,-0.2 -1,-0.3 24,-0.2 24,-0.1 0.780 114.6 34.5 -59.8 -30.9 -15.2 12.3 -8.6 116 117 A A H <4 S+ 0 0 76 -3,-1.3 -1,-0.2 1,-0.1 -2,-0.2 0.482 125.6 38.3-104.5 -4.3 -16.3 11.9 -12.2 117 118 A R H << S+ 0 0 123 -4,-1.2 -82,-0.2 -3,-0.6 -2,-0.2 0.406 109.5 51.3-127.5 2.4 -15.2 15.2 -13.6 118 119 A b < 0 0 2 -4,-1.6 -3,-0.1 -5,-0.2 -2,-0.1 0.038 360.0 360.0-129.6 28.8 -11.9 16.2 -12.0 119 120 A Q 0 0 183 -85,-0.1 -3,-0.1 -84,-0.1 -2,-0.1 0.909 360.0 360.0 -93.6 360.0 -9.7 13.1 -12.5 120 !* 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 0.0 121 1 B N >> 0 0 24 0, 0.0 4,-1.6 0, 0.0 3,-1.5 0.000 360.0 360.0 360.0 161.7 1.6 15.2 2.2 122 2 B R H 3> + 0 0 0 61,-2.2 4,-0.8 1,-0.3 62,-0.1 0.795 360.0 54.7 -34.8 -46.8 -1.9 15.3 0.6 123 3 B W H >> S+ 0 0 157 60,-0.3 4,-1.2 1,-0.2 3,-0.6 0.871 105.0 52.0 -61.0 -41.8 -1.1 12.2 -1.4 124 4 B Q H <> S+ 0 0 24 -3,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.865 102.7 58.6 -64.0 -38.1 -0.1 10.1 1.6 125 5 B F H 3X S+ 0 0 0 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.760 102.1 56.4 -64.1 -23.2 -3.3 11.0 3.3 126 6 B K H < + 0 0 18 -4,-2.0 3,-2.8 -5,-0.2 -1,-0.1 -0.435 66.4 165.5-138.4 59.9 -11.3 1.9 3.9 134 14 B P T 3 S+ 0 0 110 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.614 72.9 63.5 -53.5 -16.0 -10.1 -0.2 0.9 135 15 B S T 3 S+ 0 0 105 1,-0.1 2,-0.4 -3,-0.1 -5,-0.1 0.462 99.3 65.8 -89.9 -0.3 -13.6 -0.3 -0.5 136 17 B R S < S- 0 0 74 -3,-2.8 -3,-0.2 -7,-0.2 -1,-0.1 -0.976 74.1-135.7-131.6 130.3 -13.7 3.4 -1.0 137 18 B S > - 0 0 52 -2,-0.4 3,-0.8 1,-0.1 4,-0.1 -0.189 33.5-113.3 -65.7 167.0 -11.8 5.8 -3.2 138 19 B W T >> S+ 0 0 43 1,-0.2 3,-1.3 2,-0.1 4,-0.8 0.644 110.1 77.0 -79.8 -12.1 -10.5 8.9 -1.6 139 20 B W H 3> S+ 0 0 10 1,-0.3 4,-0.7 2,-0.2 -1,-0.2 0.668 80.3 68.0 -69.5 -16.7 -12.9 10.9 -3.8 140 21 B D H <4 S+ 0 0 21 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.1 0.616 108.3 38.5 -77.5 -11.7 -15.9 9.9 -1.6 141 22 B F H X4 S+ 0 0 5 -3,-1.3 3,-0.7 -4,-0.1 -1,-0.2 0.531 94.0 88.3-110.1 -15.0 -14.4 12.0 1.2 142 23 B A H 3< S+ 0 0 1 -4,-0.8 -111,-0.3 1,-0.3 2,-0.2 0.887 108.8 10.0 -51.8 -47.8 -13.3 14.8 -1.1 143 24 B D T 3< S+ 0 0 0 -4,-0.7 88,-2.8 6,-0.1 2,-0.4 -0.631 90.3 130.8-140.4 81.7 -16.6 16.6 -0.9 144 25 B Y B <> -CD 148 230C 0 4,-1.4 4,-0.7 -3,-0.7 3,-0.4 -0.997 64.6 -18.8-134.6 134.5 -18.9 15.2 1.8 145 26 B G T 4 S- 0 0 0 84,-2.9 87,-0.2 -2,-0.4 86,-0.1 -0.277 101.6 -58.0 69.0-155.5 -20.8 17.0 4.5 146 27 B i T 4 S+ 0 0 1 91,-0.1 7,-0.8 85,-0.1 -1,-0.2 0.569 133.5 31.3 -99.0 -11.9 -19.7 20.6 5.5 147 28 B Y T 4 S+ 0 0 25 -3,-0.4 98,-0.2 5,-0.2 -2,-0.2 0.830 84.6 92.8-113.2 -50.5 -16.2 19.5 6.4 148 29 B j B < S+C 144 0C 0 -4,-0.7 -4,-1.4 96,-0.1 2,-0.1 -0.277 91.8 24.6 -53.0 118.6 -14.7 16.6 4.5 149 30 B G S S- 0 0 1 -6,-0.2 96,-0.2 15,-0.1 -6,-0.1 -0.355 115.9 -19.5 109.3 167.8 -12.8 18.3 1.6 150 31 B R S S- 0 0 22 -8,-0.2 -120,-0.1 -2,-0.1 95,-0.1 0.301 111.0 -4.6 -36.9 166.5 -11.5 21.9 1.5 151 32 B G S S- 0 0 59 -122,-0.1 2,-0.1 1,-0.1 94,-0.1 0.109 71.4-155.6 40.8-150.8 -12.6 24.7 3.9 152 33 B G + 0 0 38 -4,-0.0 2,-0.3 16,-0.0 -5,-0.2 -0.353 19.3 161.5 146.1 132.5 -15.4 24.0 6.3 153 34 B S + 0 0 50 -7,-0.8 2,-0.1 -2,-0.1 86,-0.1 -0.983 40.8 30.6-163.4 162.5 -18.1 25.7 8.2 154 35 B G S S- 0 0 27 -2,-0.3 84,-0.1 2,-0.1 85,-0.1 -0.410 96.4 -26.4 85.3-160.3 -21.4 25.2 10.0 155 36 B T - 0 0 108 82,-0.4 -9,-0.1 84,-0.3 -2,-0.0 -0.853 67.5-109.1-102.3 123.9 -22.7 22.1 11.8 156 37 B P - 0 0 15 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.197 21.0-142.0 -48.7 126.9 -21.3 18.6 10.8 157 38 B V S S- 0 0 36 72,-0.1 2,-0.2 2,-0.0 -12,-0.0 0.873 71.3 -24.9 -63.8 -37.6 -24.1 16.7 9.1 158 39 B D S > S- 0 0 16 71,-0.1 4,-1.3 1,-0.0 5,-0.1 -0.705 83.6 -64.1-151.7-156.3 -23.1 13.4 10.7 159 40 B D H > S+ 0 0 97 -2,-0.2 4,-1.2 2,-0.2 5,-0.1 0.905 125.4 51.3 -71.4 -43.3 -20.3 11.3 12.4 160 41 B L H > S+ 0 0 2 64,-0.4 4,-1.2 1,-0.2 3,-0.5 0.903 110.1 49.7 -60.7 -43.2 -18.1 11.1 9.3 161 42 B D H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 3,-0.2 0.876 105.7 57.3 -65.1 -35.4 -18.3 14.9 8.8 162 43 B R H X S+ 0 0 109 -4,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.787 100.8 57.9 -64.7 -28.8 -17.3 15.4 12.4 163 44 B k H X S+ 0 0 7 -4,-1.2 4,-1.9 -3,-0.5 -1,-0.2 0.881 108.4 46.9 -65.7 -40.4 -14.2 13.3 11.7 164 45 B j H X S+ 0 0 0 -4,-1.2 4,-1.8 -3,-0.2 -2,-0.2 0.801 107.8 53.3 -73.5 -32.3 -13.3 15.8 9.1 165 46 B Q H >X S+ 0 0 57 -4,-1.7 4,-2.5 2,-0.2 3,-0.5 0.973 111.2 48.0 -65.5 -51.1 -14.0 18.9 11.2 166 47 B V H 3X S+ 0 0 88 -4,-2.1 4,-2.8 1,-0.3 -2,-0.2 0.901 109.5 53.9 -53.3 -44.1 -11.6 17.5 13.8 167 48 B H H 3X S+ 0 0 3 -4,-1.9 4,-1.9 1,-0.2 -1,-0.3 0.848 107.6 50.3 -61.0 -35.4 -9.1 16.8 11.1 168 49 B D H X S+ 0 0 42 -4,-2.8 4,-2.6 1,-0.3 3,-0.5 0.867 108.7 47.6 -47.9 -48.9 -5.8 19.3 13.8 171 52 B Y H 3X S+ 0 0 4 -4,-1.9 4,-1.1 1,-0.2 -1,-0.3 0.824 106.7 59.7 -63.4 -34.0 -4.2 20.8 10.6 172 53 B N H 3< S+ 0 0 63 -4,-2.0 -1,-0.2 -3,-0.5 -2,-0.2 0.782 109.6 41.7 -66.6 -29.8 -4.9 24.2 12.1 173 54 B E H XX S+ 0 0 105 -4,-1.4 3,-3.9 -3,-0.5 4,-0.5 0.939 107.7 58.9 -80.0 -52.9 -2.7 23.4 15.0 174 55 B A H >< S+ 0 0 1 -4,-2.6 3,-0.7 1,-0.3 -2,-0.2 0.727 99.9 61.9 -47.4 -24.6 -0.0 21.7 13.0 175 56 B E T 3< S+ 0 0 47 -4,-1.1 -1,-0.3 1,-0.2 5,-0.3 0.596 84.3 73.9 -80.8 -11.4 0.3 25.0 11.2 176 57 B K T <4 S+ 0 0 140 -3,-3.9 -1,-0.2 2,-0.1 -2,-0.2 0.774 77.7 93.0 -71.0 -22.6 1.4 26.8 14.3 177 58 B I S X< S- 0 0 66 -3,-0.7 3,-1.5 -4,-0.5 -118,-0.1 -0.495 100.1 -92.1 -68.9 138.3 4.7 25.1 13.9 178 59 B S T 3 S- 0 0 114 1,-0.3 -1,-0.1 -2,-0.2 27,-0.1 -0.305 101.2 -7.4 -58.8 125.0 7.1 27.3 11.9 179 60 B G T 3 S+ 0 0 47 -4,-0.2 2,-0.9 1,-0.2 -1,-0.3 0.753 89.1 152.0 61.8 31.1 7.0 26.6 8.2 180 61 B m < - 0 0 5 -3,-1.5 -1,-0.2 -5,-0.3 3,-0.1 -0.796 22.6-177.4 -99.2 101.0 4.8 23.6 8.5 181 62 B N >> - 0 0 62 -2,-0.9 4,-3.6 1,-0.2 3,-2.6 -0.771 7.0-167.6 -97.6 92.0 2.6 23.0 5.3 182 63 B P T 34 S+ 0 0 5 0, 0.0 -1,-0.2 0, 0.0 -60,-0.0 0.889 85.6 57.1 -41.1 -55.4 0.5 19.9 6.2 183 64 B R T 34 S+ 0 0 40 1,-0.2 -61,-2.2 -62,-0.2 -60,-0.3 0.626 122.8 24.7 -55.0 -16.9 -0.7 19.5 2.6 184 65 B F T <4 S+ 0 0 74 -3,-2.6 2,-0.4 -63,-0.2 -1,-0.2 0.654 87.4 111.2-120.5 -31.0 3.0 19.2 1.5 185 66 B R < - 0 0 79 -4,-3.6 2,-0.5 1,-0.1 -5,-0.0 -0.280 60.7-146.7 -52.4 106.2 5.0 18.0 4.5 186 67 B T - 0 0 87 -2,-0.4 2,-0.2 -65,-0.0 20,-0.1 -0.661 23.1-170.8 -77.6 123.7 6.0 14.5 3.4 187 68 B Y - 0 0 9 -2,-0.5 2,-0.7 19,-0.1 20,-0.1 -0.476 26.2-102.8-109.1-176.0 6.1 12.3 6.5 188 69 B S + 0 0 33 11,-0.2 11,-2.1 -2,-0.2 2,-0.2 -0.863 53.1 148.9-112.1 97.1 7.2 8.8 7.4 189 70 B Y E -E 198 0D 55 -2,-0.7 2,-0.3 9,-0.2 9,-0.2 -0.771 30.5-150.8-127.9 175.3 4.5 6.2 7.8 190 71 B E E -E 197 0D 84 7,-2.0 7,-1.8 -2,-0.2 2,-0.6 -0.982 3.0-159.3-148.4 128.7 3.6 2.5 7.3 191 72 B h E -E 196 0D 58 -2,-0.3 2,-0.6 5,-0.2 5,-0.2 -0.933 16.9-178.6-111.2 111.3 0.4 0.7 6.5 192 73 B T E > -E 195 0D 78 3,-2.5 3,-3.9 -2,-0.6 -2,-0.0 -0.943 66.4 -43.4-116.1 114.0 0.6 -2.9 7.5 193 74 B A T 3 S- 0 0 108 -2,-0.6 -1,-0.1 1,-0.3 3,-0.1 0.838 128.0 -33.9 31.7 56.4 -2.4 -5.2 6.8 194 75 B G T 3 S+ 0 0 43 1,-0.2 2,-0.7 -63,-0.0 -1,-0.3 0.113 114.2 115.6 94.3 -21.6 -4.8 -2.4 8.0 195 76 B T E < -E 192 0D 91 -3,-3.9 -3,-2.5 2,-0.0 2,-0.3 -0.741 50.5-154.4 -92.6 114.6 -2.6 -0.9 10.7 196 77 B L E +E 191 0D 15 -2,-0.7 2,-0.4 -5,-0.2 -5,-0.2 -0.652 16.0 179.6 -84.1 135.8 -1.4 2.7 10.2 197 78 B T E -E 190 0D 52 -7,-1.8 -7,-2.0 -2,-0.3 2,-0.8 -0.974 24.4-150.2-143.3 127.5 1.8 3.8 11.9 198 79 B n E -E 189 0D 30 -2,-0.4 -9,-0.2 -9,-0.2 4,-0.0 -0.838 28.8-143.4 -91.6 110.1 3.7 7.1 12.0 199 80 B T > - 0 0 33 -11,-2.1 3,-0.6 -2,-0.8 -11,-0.2 -0.157 20.5-109.7 -67.8 171.5 7.4 6.1 12.5 200 81 B G T 3 S+ 0 0 78 1,-0.2 -1,-0.1 -11,-0.0 7,-0.1 0.450 96.7 93.7 -84.0 0.9 9.6 8.2 14.6 201 82 B R T 3 + 0 0 201 -13,-0.2 2,-0.2 5,-0.1 -1,-0.2 0.378 66.7 102.4 -73.7 5.7 11.7 9.5 11.7 202 83 B N < - 0 0 27 -3,-0.6 2,-0.1 -14,-0.2 -15,-0.1 -0.636 69.1-127.2 -94.9 149.1 9.5 12.6 11.4 203 84 B N > - 0 0 82 -2,-0.2 4,-4.3 1,-0.1 5,-0.4 -0.425 45.5 -84.9 -84.7 166.1 10.2 16.1 12.7 204 85 B A H > S+ 0 0 67 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.815 133.1 43.1 -37.5 -41.6 7.8 18.0 15.0 205 86 B m H > S+ 0 0 10 2,-0.2 4,-2.9 3,-0.2 5,-0.3 0.991 118.4 39.7 -71.1 -63.5 5.9 19.1 11.8 206 87 B A H > S+ 0 0 2 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.917 116.4 54.6 -51.2 -46.3 5.9 15.8 9.9 207 88 B A H X S+ 0 0 41 -4,-4.3 4,-1.6 2,-0.2 -1,-0.2 0.911 112.6 41.7 -53.7 -50.3 5.2 14.1 13.2 208 89 B S H >X S+ 0 0 50 -4,-1.9 4,-2.2 -5,-0.4 3,-0.7 0.991 115.5 48.8 -61.1 -62.5 2.2 16.2 13.9 209 90 B V H 3X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.3 5,-0.2 0.876 108.9 53.7 -45.7 -47.2 0.8 16.1 10.4 210 91 B n H 3X S+ 0 0 0 -4,-3.3 4,-2.5 -5,-0.3 -1,-0.3 0.903 109.4 48.7 -58.9 -39.4 1.2 12.3 10.3 211 92 B D H - 0 0 79 -2,-0.7 3,-3.1 1,-0.2 4,-0.2 -0.761 3.1-162.2 -90.9 92.4 -24.4 8.5 4.2 227 108 B D G > S+ 0 0 115 -2,-1.1 3,-1.7 1,-0.3 -1,-0.2 0.813 88.9 63.1 -45.1 -34.9 -24.5 8.7 0.3 228 109 B N G 3 S+ 0 0 157 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.395 97.3 58.3 -74.9 7.3 -27.0 11.5 0.7 229 110 B N G X S+ 0 0 17 -3,-3.1 -84,-2.9 3,-0.1 3,-0.6 0.274 80.3 106.2-114.3 4.9 -24.4 13.6 2.4 230 111 B Y B < S-D 144 0C 47 -3,-1.7 -86,-0.3 1,-0.3 -89,-0.1 -0.765 97.4 -7.8 -87.4 126.6 -21.9 13.5 -0.5 231 112 B N T 3 S+ 0 0 25 -88,-2.8 -1,-0.3 -2,-0.5 -87,-0.1 0.940 90.1 175.8 53.1 55.3 -21.7 16.7 -2.4 232 113 B I < - 0 0 15 -3,-0.6 2,-1.0 -87,-0.2 3,-0.1 -0.120 45.7 -80.8 -78.2-178.1 -24.6 18.4 -0.5 233 114 B D > - 0 0 63 1,-0.2 4,-2.3 2,-0.1 5,-0.2 -0.787 42.7-164.9 -91.2 104.1 -25.6 22.0 -1.1 234 115 B L H > S+ 0 0 13 -2,-1.0 4,-2.5 1,-0.2 5,-0.3 0.913 83.6 51.5 -54.0 -50.6 -23.1 23.9 1.0 235 116 B Q H > S+ 0 0 80 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.944 114.0 42.4 -54.2 -54.7 -25.0 27.2 1.0 236 117 B A H 4 S+ 0 0 77 1,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.871 127.5 29.0 -60.9 -42.0 -28.3 25.7 2.2 237 118 B R H < S+ 0 0 124 -4,-2.3 -82,-0.4 1,-0.1 -2,-0.2 0.478 117.0 47.3-104.3 -2.4 -26.8 23.4 4.8 238 119 B i H < 0 0 2 -4,-2.5 -3,-0.1 -5,-0.2 -2,-0.1 0.458 360.0 360.0-123.8 5.3 -23.6 24.9 6.2 239 120 B N < 0 0 158 -4,-0.7 -84,-0.3 -5,-0.3 -86,-0.0 -0.297 360.0 360.0 -71.3 360.0 -23.9 28.6 7.1 240 !* 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 0.0 241 2 C L 0 0 81 0, 0.0 -57,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 136.6 -2.0 19.7 -3.5 242 3 C V + 0 0 7 1,-0.5 -92,-0.1 2,-0.1 2,-0.1 0.148 360.0 66.0-177.6-167.0 -4.4 22.0 -1.3 243 4 C F + 0 0 3 -94,-0.1 -1,-0.5 -2,-0.1 -213,-0.1 -0.009 56.9 66.7 94.9 119.9 -7.7 20.2 -0.5 244 5 C F 0 0 0 -102,-0.2 -2,-0.1 -97,-0.1 -102,-0.1 0.891 360.0 360.0 82.1 95.4 -9.1 17.2 1.5 245 6 C A 0 0 1 -98,-0.2 -77,-0.2 -104,-0.2 -78,-0.2 -0.513 360.0 360.0-103.0 360.0 -9.1 17.0 5.4