==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-JUL-02 1M8T . COMPND 2 MOLECULE: PHOSPHOLIPASE A2; . SOURCE 2 ORGANISM_SCIENTIFIC: OPHIOPHAGUS HANNAH; . AUTHOR S.XU,L.GU,Q.WANG,Y.SHU,Z.LIN . 714 6 42 42 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41045.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 458 64.1 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 . 54 7.6 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 . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 45 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 82 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 272 38.1 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 12 0 0 0 0 0 0 6 0 0 0 1 5 1 2 3 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 . 8 4 4 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 . 6 6 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 H >> 0 0 46 0, 0.0 4,-2.0 0, 0.0 3,-1.5 0.000 360.0 360.0 360.0 136.6 41.1 39.8 -1.8 2 2 A L H 3> + 0 0 87 62,-1.4 4,-2.0 1,-0.3 5,-0.1 0.785 360.0 57.0 -45.7 -35.7 40.3 36.1 -1.3 3 3 A V H 3> S+ 0 0 98 61,-0.3 4,-1.6 1,-0.2 -1,-0.3 0.861 109.0 45.2 -67.2 -35.2 42.5 36.1 1.8 4 4 A Q H <> S+ 0 0 39 -3,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.777 108.7 56.6 -76.9 -29.1 40.3 38.8 3.3 5 5 A F H X S+ 0 0 22 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.910 106.1 51.2 -65.4 -41.3 37.2 36.9 2.2 6 6 A N H X S+ 0 0 18 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.922 108.4 51.9 -59.2 -45.0 38.6 34.0 4.2 7 7 A G H X S+ 0 0 6 -4,-1.6 4,-1.1 1,-0.2 -1,-0.2 0.814 108.1 51.4 -62.0 -32.3 39.0 36.4 7.1 8 8 A M H X S+ 0 0 1 -4,-1.6 4,-1.4 2,-0.2 -1,-0.2 0.885 108.2 50.4 -72.4 -40.3 35.4 37.5 6.7 9 9 A I H X S+ 0 0 4 -4,-2.2 4,-2.3 1,-0.2 7,-0.2 0.799 107.6 53.9 -68.0 -29.7 34.1 33.9 6.8 10 10 A R H < S+ 0 0 128 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.845 103.8 58.2 -70.4 -32.6 36.1 33.3 10.0 11 11 A a H < S+ 0 0 12 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.892 117.4 30.0 -63.0 -42.1 34.4 36.3 11.5 12 12 A T H < S+ 0 0 32 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.726 133.6 32.1 -90.8 -26.1 30.9 34.8 11.0 13 13 A I S >< S- 0 0 40 -4,-2.3 3,-2.5 -5,-0.2 -1,-0.2 -0.691 70.6-178.9-132.3 76.6 31.9 31.1 11.3 14 14 A P T 3 S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.751 81.0 54.6 -47.8 -34.1 34.8 31.1 13.8 15 15 A G T 3 S+ 0 0 76 2,-0.0 2,-0.2 0, 0.0 -5,-0.1 0.438 90.1 111.0 -82.8 2.1 35.3 27.3 13.6 16 16 A S < - 0 0 9 -3,-2.5 3,-0.1 -7,-0.2 -3,-0.1 -0.499 55.0-161.6 -83.2 145.8 35.6 27.5 9.8 17 17 A I >> - 0 0 89 -2,-0.2 4,-3.2 1,-0.2 3,-1.7 -0.790 25.8-172.2-120.1 74.9 38.8 26.9 7.8 18 18 A P H 3> S+ 0 0 7 0, 0.0 4,-2.6 0, 0.0 5,-0.4 0.814 73.5 56.5 -38.7 -61.7 37.2 28.8 4.8 19 19 A W H 34 S+ 0 0 175 1,-0.2 -16,-0.0 2,-0.2 -13,-0.0 0.695 124.5 29.9 -53.7 -16.8 39.8 28.2 2.0 20 20 A W H <4 S+ 0 0 170 -3,-1.7 4,-0.4 2,-0.1 3,-0.3 0.794 119.4 50.1-106.0 -49.8 39.2 24.5 2.7 21 21 A D H < S+ 0 0 35 -4,-3.2 -2,-0.2 1,-0.2 3,-0.1 0.751 126.6 23.0 -64.4 -28.4 35.6 24.3 4.0 22 22 A Y S < S+ 0 0 25 -4,-2.6 3,-0.4 -5,-0.2 -1,-0.2 0.325 94.2 93.2-125.0 9.9 34.1 26.3 1.1 23 23 A S S S+ 0 0 56 -5,-0.4 8,-0.6 -3,-0.3 2,-0.1 0.622 100.3 26.3 -78.7 -14.6 36.5 25.9 -1.8 24 24 A D E S+A 30 0A 63 -4,-0.4 88,-3.0 6,-0.2 2,-0.4 -0.588 87.3 129.5-149.0 79.2 34.7 22.9 -3.4 25 25 A Y E > -AB 29 111A 0 4,-2.4 4,-1.1 -3,-0.4 3,-0.3 -0.999 64.5 -35.5-139.1 133.0 31.1 23.0 -2.4 26 26 A G T 4 S- 0 0 2 84,-3.1 87,-0.3 -2,-0.4 89,-0.1 -0.108 98.1 -49.0 57.5-150.6 28.0 22.6 -4.6 27 27 A b T 4 S+ 0 0 11 9,-0.1 7,-1.2 91,-0.1 -1,-0.2 0.644 136.3 24.6 -95.4 -19.2 27.8 24.1 -8.1 28 28 A Y T 4 S+ 0 0 30 -3,-0.3 2,-0.8 5,-0.2 -2,-0.2 0.686 91.0 96.8-118.5 -31.3 29.1 27.6 -7.3 29 29 A c E < S+A 25 0A 6 -4,-1.1 -4,-2.4 -5,-0.0 2,-0.2 -0.534 88.7 19.6 -66.4 108.6 31.2 27.4 -4.2 30 30 A G E S-A 24 0A 29 -2,-0.8 -6,-0.2 -6,-0.2 -7,-0.1 -0.645 116.3 -9.8 122.1 177.7 34.7 27.1 -5.6 31 31 A S S S- 0 0 132 -8,-0.6 -2,-0.0 -2,-0.2 -8,-0.0 -0.207 117.9 -13.7 -49.7 127.8 36.4 27.9 -8.9 32 32 A G S S- 0 0 53 1,-0.1 2,-0.2 17,-0.0 17,-0.1 -0.043 71.5-140.7 69.0-173.7 33.7 28.7 -11.5 33 33 A G + 0 0 38 -4,-0.1 2,-0.3 16,-0.0 -5,-0.2 -0.817 23.2 158.4 176.2 141.6 30.0 28.0 -11.2 34 34 A S + 0 0 53 -7,-1.2 12,-0.0 -2,-0.2 2,-0.0 -0.979 39.5 26.6-163.2 169.5 27.1 26.8 -13.2 35 35 A G S S- 0 0 36 -2,-0.3 84,-0.1 84,-0.2 83,-0.0 -0.219 98.1 -27.5 72.0-160.3 23.7 25.3 -13.1 36 36 A T S S- 0 0 116 82,-0.3 -9,-0.1 1,-0.1 -2,-0.1 -0.771 74.0-101.9 -94.0 135.7 21.1 25.5 -10.4 37 37 A P - 0 0 36 0, 0.0 6,-0.1 0, 0.0 -1,-0.1 -0.259 23.8-141.1 -56.2 141.2 22.4 26.0 -6.8 38 38 A V S S- 0 0 48 72,-0.1 2,-0.2 1,-0.1 -12,-0.1 0.788 70.6 -25.3 -76.3 -27.7 22.4 22.7 -4.9 39 39 A D S > S- 0 0 28 1,-0.1 4,-1.2 71,-0.1 5,-0.1 -0.871 83.9 -63.0-161.4-166.9 21.3 24.2 -1.6 40 40 A E H > S+ 0 0 117 -2,-0.2 4,-1.3 2,-0.2 3,-0.2 0.934 128.7 44.5 -59.4 -52.1 21.2 27.3 0.6 41 41 A L H >> S+ 0 0 1 64,-0.5 4,-1.5 1,-0.2 3,-0.8 0.941 112.6 50.7 -59.7 -49.8 25.0 27.6 0.9 42 42 A D H 3> S+ 0 0 0 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.774 106.5 58.8 -59.3 -25.6 25.6 26.9 -2.8 43 43 A R H 3X S+ 0 0 33 -4,-1.2 4,-1.8 2,-0.2 -1,-0.3 0.834 100.5 54.4 -71.6 -35.7 23.1 29.7 -3.3 44 44 A d H X S+ 0 0 82 -4,-2.3 3,-0.7 1,-0.2 4,-0.5 0.884 112.9 45.1 -60.6 -41.4 31.6 39.2 -12.2 54 54 A Q H >< S+ 0 0 102 -4,-2.4 3,-1.3 1,-0.2 4,-0.4 0.891 108.2 56.7 -67.7 -42.8 29.9 42.6 -11.8 55 55 A A T 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.490 100.4 63.7 -66.3 -5.9 32.8 43.9 -9.7 56 56 A Q T <4 S+ 0 0 94 -3,-0.7 5,-0.5 -4,-0.3 -1,-0.3 0.727 89.5 61.9 -89.6 -27.2 35.0 42.9 -12.7 57 57 A Q S << S+ 0 0 177 -3,-1.3 -2,-0.2 -4,-0.5 -1,-0.2 0.635 84.5 103.9 -71.9 -15.1 33.3 45.4 -15.2 58 58 A L S > S- 0 0 42 -4,-0.4 3,-1.1 3,-0.2 -3,-0.0 -0.444 98.5 -80.2 -69.8 141.7 34.6 48.1 -12.9 59 59 A T T 3 S- 0 0 122 1,-0.3 -1,-0.2 -2,-0.1 27,-0.1 -0.180 106.6 -25.4 -45.5 114.5 37.7 50.0 -14.2 60 60 A E T 3 S+ 0 0 193 1,-0.2 2,-0.5 -4,-0.1 -1,-0.3 0.895 96.1 152.8 34.0 72.0 40.5 47.6 -13.3 61 61 A f < - 0 0 8 -3,-1.1 -3,-0.2 -5,-0.5 -1,-0.2 -0.971 22.3-177.8-130.3 111.5 38.7 45.9 -10.4 62 67 A S >> - 0 0 45 -2,-0.5 4,-2.7 1,-0.1 3,-0.6 -0.956 15.3-161.8-113.6 113.7 39.7 42.4 -9.6 63 68 A P T 34 S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 -10,-0.1 0.784 91.8 60.4 -60.8 -24.8 37.6 40.9 -6.7 64 69 A Y T 34 S+ 0 0 111 -63,-0.2 -62,-1.4 1,-0.1 -61,-0.3 0.822 121.3 14.8 -73.1 -36.8 40.3 38.3 -6.4 65 70 A S T <4 S+ 0 0 69 -3,-0.6 2,-0.2 -64,-0.2 -1,-0.1 0.614 90.4 113.6-114.9 -22.6 43.3 40.7 -5.6 66 71 A K < - 0 0 55 -4,-2.7 2,-0.6 1,-0.1 -5,-0.0 -0.362 59.1-144.4 -57.6 120.3 41.8 44.0 -4.7 67 72 A R - 0 0 193 -2,-0.2 2,-0.2 -64,-0.0 20,-0.1 -0.799 21.0-169.5 -92.6 122.2 42.6 44.5 -1.0 68 73 A Y - 0 0 9 -2,-0.6 2,-0.6 19,-0.1 20,-0.1 -0.640 23.6-115.6-109.3 167.3 39.8 46.3 0.9 69 74 A S + 0 0 40 -2,-0.2 11,-1.4 11,-0.2 2,-0.3 -0.896 47.5 148.8-105.5 118.2 39.5 47.8 4.4 70 75 A Y E -C 79 0B 56 -2,-0.6 2,-0.4 9,-0.3 9,-0.3 -0.934 33.3-134.5-142.2 165.5 37.0 46.1 6.6 71 76 A D E -C 78 0B 60 7,-3.4 7,-2.4 -2,-0.3 2,-0.5 -0.936 5.9-162.0-125.4 146.8 36.5 45.5 10.3 72 77 A a E +C 77 0B 54 -2,-0.4 5,-0.2 5,-0.2 2,-0.0 -0.887 19.3 164.8-130.1 104.7 35.6 42.4 12.2 73 78 A S - 0 0 56 3,-1.9 2,-2.6 -2,-0.5 5,-0.0 0.116 69.2 -33.1 -89.8-149.6 34.3 42.9 15.6 74 79 A E S S- 0 0 186 1,-0.2 -1,-0.1 -2,-0.0 3,-0.1 -0.423 121.9 -46.3 -72.2 71.5 32.5 40.2 17.6 75 80 A G S S+ 0 0 35 -2,-2.6 2,-0.3 1,-0.3 -1,-0.2 -0.139 110.9 115.2 95.8 -38.8 30.8 38.7 14.6 76 81 A T - 0 0 94 -2,-0.1 -3,-1.9 1,-0.0 2,-0.5 -0.511 55.1-148.7 -72.8 131.2 29.6 42.0 13.0 77 82 A L E -C 72 0B 5 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.884 16.5-177.7-105.5 129.7 31.2 42.6 9.7 78 83 A T E -C 71 0B 67 -7,-2.4 -7,-3.4 -2,-0.5 2,-0.8 -0.988 21.1-148.1-134.2 128.5 31.8 46.1 8.5 79 84 A g E -C 70 0B 31 -2,-0.4 -9,-0.3 -9,-0.3 9,-0.0 -0.833 36.0-120.0 -93.7 111.7 33.3 47.4 5.2 80 85 A K > - 0 0 108 -11,-1.4 3,-0.7 -2,-0.8 -11,-0.2 -0.051 13.2-126.5 -50.6 150.0 35.1 50.6 6.1 81 86 A A T 3 S+ 0 0 81 1,-0.2 -1,-0.1 -3,-0.0 7,-0.1 0.677 97.6 68.6 -76.3 -16.7 34.0 53.8 4.4 82 87 A D T 3 S+ 0 0 124 -13,-0.0 -1,-0.2 6,-0.0 6,-0.1 0.662 70.5 121.4 -77.5 -15.6 37.3 55.0 2.9 83 88 A N < - 0 0 22 -3,-0.7 -15,-0.1 -14,-0.2 -4,-0.0 -0.094 66.4-118.3 -46.4 142.2 37.5 52.2 0.4 84 89 A D > - 0 0 80 1,-0.1 4,-2.5 4,-0.1 5,-0.3 -0.095 41.8 -83.4 -73.0-177.3 37.6 53.2 -3.2 85 90 A E H > S+ 0 0 141 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.892 129.3 39.5 -57.4 -42.5 34.8 52.3 -5.6 86 91 A f H > S+ 0 0 10 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.967 117.3 46.0 -72.3 -54.0 36.3 48.8 -6.3 87 92 A A H > S+ 0 0 3 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.866 115.3 50.0 -56.9 -38.4 37.5 47.9 -2.8 88 93 A A H X S+ 0 0 31 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.964 114.1 42.7 -63.8 -54.9 34.2 49.1 -1.4 89 94 A F H X S+ 0 0 77 -4,-2.0 4,-1.8 -5,-0.3 -2,-0.2 0.916 117.1 46.8 -57.4 -49.4 32.1 47.0 -3.9 90 95 A V H X S+ 0 0 0 -4,-3.3 4,-1.9 1,-0.2 -1,-0.2 0.866 109.6 53.3 -63.0 -39.4 34.3 43.9 -3.5 91 96 A g H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.824 108.2 53.5 -64.8 -30.7 34.3 44.2 0.3 92 97 A D H X S+ 0 0 81 -4,-1.5 4,-2.4 2,-0.2 5,-0.3 0.893 104.6 53.4 -67.7 -45.7 30.5 44.3 -0.1 93 98 A e H X S+ 0 0 3 -4,-1.8 4,-1.4 1,-0.2 -2,-0.2 0.908 113.9 42.0 -55.9 -47.3 30.4 41.1 -2.1 94 99 A D H X S+ 0 0 0 -4,-1.9 4,-3.0 2,-0.2 -1,-0.2 0.878 112.2 53.1 -71.7 -39.5 32.4 39.2 0.5 95 100 A R H X S+ 0 0 89 -4,-2.1 4,-2.3 2,-0.2 5,-0.3 0.971 110.8 46.5 -59.9 -54.5 30.5 40.6 3.5 96 101 A V H X S+ 0 0 70 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.859 115.9 47.1 -54.3 -38.9 27.1 39.6 2.1 97 102 A A H X S+ 0 0 2 -4,-1.4 4,-3.1 -5,-0.3 -1,-0.2 0.905 109.8 51.8 -71.4 -42.4 28.5 36.2 1.3 98 103 A A H X S+ 0 0 0 -4,-3.0 4,-1.4 2,-0.2 -2,-0.2 0.868 113.9 44.5 -61.0 -39.0 30.2 35.7 4.7 99 104 A I H X S+ 0 0 74 -4,-2.3 4,-0.7 -5,-0.2 -1,-0.2 0.888 113.9 50.1 -71.4 -42.6 26.9 36.6 6.4 100 105 A d H >X S+ 0 0 51 -4,-2.0 3,-1.4 -5,-0.3 4,-0.9 0.938 107.9 53.2 -61.3 -48.7 24.9 34.3 4.0 101 106 A F H >< S+ 0 0 5 -4,-3.1 3,-0.7 1,-0.3 -1,-0.2 0.872 106.3 54.0 -52.8 -43.7 27.4 31.4 4.7 102 107 A A H 3< S+ 0 0 50 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.650 109.9 47.1 -67.5 -19.5 26.8 31.8 8.4 103 108 A G H << S+ 0 0 63 -3,-1.4 -1,-0.2 -4,-0.7 -2,-0.2 0.508 99.6 80.1-101.1 -7.0 23.0 31.5 7.9 104 109 A A S << S- 0 0 18 -4,-0.9 2,-0.1 -3,-0.7 -65,-0.0 -0.753 83.2-112.8-101.6 147.5 23.0 28.5 5.6 105 110 A P - 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0 0 88 -2,-1.2 2,-1.1 -11,-0.6 3,-0.7 0.308 14.6 -93.1 -51.6 176.1 61.4 61.7 31.3 681 86 F A T 3 S+ 0 0 98 1,-0.2 -1,-0.1 -11,-0.0 -11,-0.1 -0.514 109.2 65.0 -94.6 60.6 64.7 60.3 32.3 682 87 F D T 3 + 0 0 131 -2,-1.1 -1,-0.2 -13,-0.2 5,-0.1 0.361 68.3 117.6-147.1 -29.4 66.0 63.2 34.3 683 88 F N < - 0 0 27 -3,-0.7 -15,-0.1 -14,-0.2 -4,-0.0 -0.214 52.7-144.2 -55.1 131.7 63.6 63.3 37.3 684 89 F D > - 0 0 74 -3,-0.0 4,-2.1 4,-0.0 5,-0.3 -0.008 46.6 -72.4 -80.5-169.0 64.9 62.7 40.7 685 90 F E H > S+ 0 0 126 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.938 134.0 34.2 -55.2 -50.6 63.0 60.9 43.4 686 91 F o H > S+ 0 0 4 2,-0.2 4,-3.3 -26,-0.2 5,-0.4 0.964 117.1 50.1 -70.1 -57.1 60.5 63.8 43.9 687 92 F A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.884 111.7 50.0 -51.1 -45.0 60.3 65.2 40.4 688 93 F A H X S+ 0 0 39 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.954 114.9 43.0 -60.7 -50.9 59.6 61.7 38.9 689 94 F F H X S+ 0 0 78 -4,-1.5 4,-2.5 -5,-0.3 -2,-0.2 0.956 116.6 46.1 -59.7 -53.7 56.8 61.0 41.5 690 95 F V H X S+ 0 0 0 -4,-3.3 4,-1.7 1,-0.2 -1,-0.2 0.820 111.9 53.0 -59.0 -34.0 55.3 64.5 41.2 691 96 F p H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.4 -1,-0.2 0.904 108.1 50.2 -68.0 -41.1 55.5 64.2 37.5 692 97 F D H X S+ 0 0 77 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.919 107.0 56.0 -61.5 -44.2 53.6 60.9 37.6 693 98 F n H X S+ 0 0 3 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.899 113.2 39.7 -53.6 -48.2 50.9 62.5 39.8 694 99 F D H X S+ 0 0 0 -4,-1.7 4,-3.1 2,-0.2 -1,-0.2 0.832 113.0 55.6 -72.7 -35.0 50.2 65.2 37.2 695 100 F R H X S+ 0 0 79 -4,-2.4 4,-2.1 2,-0.2 5,-0.2 0.952 111.2 44.0 -62.7 -48.8 50.5 62.8 34.3 696 101 F V H X S+ 0 0 58 -4,-2.8 4,-1.2 2,-0.2 -1,-0.2 0.880 116.4 47.4 -62.4 -41.4 47.9 60.5 35.7 697 102 F A H X S+ 0 0 3 -4,-1.6 4,-2.7 -5,-0.3 3,-0.5 0.964 111.2 50.2 -65.9 -52.3 45.6 63.5 36.6 698 103 F A H X S+ 0 0 0 -4,-3.1 4,-1.4 1,-0.2 -2,-0.2 0.858 115.9 42.2 -53.6 -40.9 46.0 65.1 33.2 699 104 F I H < S+ 0 0 69 -4,-2.1 4,-0.4 -5,-0.2 -1,-0.2 0.696 111.7 56.3 -80.5 -19.1 45.1 61.9 31.4 700 105 F m H >X S+ 0 0 48 -4,-1.2 4,-1.3 -3,-0.5 3,-0.9 0.894 105.1 51.8 -76.4 -43.3 42.3 61.2 33.9 701 106 F F H >< S+ 0 0 6 -4,-2.7 3,-0.7 1,-0.3 -2,-0.2 0.928 103.1 58.1 -58.6 -47.8 40.7 64.5 33.1 702 107 F A T 3< S+ 0 0 55 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.722 111.5 43.3 -57.1 -21.6 40.8 63.8 29.4 703 108 F G T <4 S+ 0 0 58 -3,-0.9 -1,-0.2 -4,-0.4 -2,-0.2 0.661 99.8 81.3 -98.8 -19.0 38.7 60.6 30.1 704 109 F A S << S- 0 0 14 -4,-1.3 2,-0.2 -3,-0.7 -65,-0.0 -0.591 84.5-110.4 -88.3 148.3 36.2 62.1 32.6 705 110 F P - 0 0 61 0, 0.0 2,-0.8 0, 0.0 -64,-0.5 -0.566 23.6-129.4 -79.2 141.1 33.1 64.1 31.5 706 111 F Y - 0 0 72 -2,-0.2 2,-0.9 -66,-0.1 3,-0.1 -0.819 21.6-167.0 -91.0 109.1 33.1 67.8 32.2 707 112 F N > - 0 0 46 -2,-0.8 3,-3.0 1,-0.1 4,-0.0 -0.852 7.9-159.3-101.3 100.5 29.8 68.6 34.0 708 113 F K G > S+ 0 0 141 -2,-0.9 3,-1.3 1,-0.3 -1,-0.1 0.706 88.8 67.1 -48.0 -29.2 29.5 72.4 33.9 709 114 F E G 3 S+ 0 0 115 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.665 94.7 59.5 -69.7 -16.0 27.0 72.2 36.8 710 115 F N G < S+ 0 0 22 -3,-3.0 -84,-3.3 3,-0.1 3,-0.5 0.172 81.6 108.2 -97.1 13.2 29.9 71.0 39.0 711 116 F I B < S-Q 625 0K 63 -3,-1.3 -86,-0.3 -86,-0.2 -89,-0.1 -0.786 89.2 -0.8 -95.1 136.0 32.0 74.1 38.5 712 117 F N S S+ 0 0 117 -88,-3.9 -1,-0.2 -2,-0.4 2,-0.2 0.911 90.2 178.0 53.1 48.4 32.5 76.6 41.4 713 118 F I - 0 0 18 -3,-0.5 2,-1.9 -87,-0.2 -1,-0.2 -0.544 40.5-102.4 -84.3 148.5 30.2 74.5 43.6 714 119 F D >> + 0 0 86 -2,-0.2 4,-1.9 1,-0.2 3,-1.2 -0.516 43.4 176.9 -74.6 84.2 29.5 75.5 47.2 715 120 F T H 3> + 0 0 58 -2,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.926 63.7 78.0 -53.7 -53.7 31.8 73.0 48.9 716 121 F T H 34 S+ 0 0 119 1,-0.3 -1,-0.2 2,-0.2 -2,-0.1 0.673 116.5 19.5 -34.7 -26.3 31.2 74.2 52.5 717 122 F T H <4 S+ 0 0 99 -3,-1.2 -1,-0.3 0, 0.0 -2,-0.2 0.716 125.0 52.7-113.4 -37.8 28.0 72.2 52.4 718 123 F R H < 0 0 137 -4,-1.9 -82,-0.4 -92,-0.1 -3,-0.2 0.536 360.0 360.0 -81.3 -8.4 28.4 69.8 49.5 719 124 F k < 0 0 49 -4,-2.4 -84,-0.4 -5,-0.2 -91,-0.0 -0.730 360.0 360.0-127.2 360.0 31.7 68.3 50.7