==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-MAY-95 1PSJ . COMPND 2 MOLECULE: PHOSPHOLIPASE A2; . SOURCE 2 ORGANISM_SCIENTIFIC: GLOYDIUS HALYS; . AUTHOR X.Q.WANG,Z.J.LIN . 124 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7420.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 75 60.5 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 . 10 8.1 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 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 4 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 46 37.1 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 2 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 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 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 S >> 0 0 14 0, 0.0 4,-2.0 0, 0.0 3,-0.7 0.000 360.0 360.0 360.0 175.5 11.1 58.3 -8.3 2 2 A L H 3> + 0 0 67 58,-1.7 4,-2.4 1,-0.3 5,-0.2 0.844 360.0 57.3 -62.7 -32.2 13.0 60.5 -5.9 3 3 A I H 3> S+ 0 0 133 57,-0.3 4,-1.6 2,-0.2 -1,-0.3 0.854 106.8 49.7 -65.2 -38.1 9.8 61.8 -4.2 4 4 A Q H <> S+ 0 0 29 -3,-0.7 4,-2.4 2,-0.2 -2,-0.2 0.927 107.7 54.0 -69.8 -39.5 8.9 58.1 -3.4 5 5 A F H X S+ 0 0 28 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.942 107.5 50.5 -56.4 -47.7 12.4 57.6 -1.9 6 6 A E H X S+ 0 0 47 -4,-2.4 4,-2.6 1,-0.2 11,-0.3 0.931 110.9 51.2 -52.6 -41.5 11.8 60.6 0.4 7 7 A T H X S+ 0 0 50 -4,-1.6 4,-2.7 2,-0.2 -2,-0.2 0.897 108.5 48.8 -64.2 -45.2 8.5 59.0 1.3 8 8 A L H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 5,-0.5 0.895 110.7 51.2 -66.5 -38.3 10.1 55.6 2.2 9 9 A I H X>S+ 0 0 6 -4,-2.5 4,-2.0 2,-0.2 6,-0.8 0.945 112.5 47.7 -64.4 -45.7 12.8 57.4 4.4 10 10 A M H X5S+ 0 0 96 -4,-2.6 4,-0.8 -5,-0.2 -2,-0.2 0.932 116.6 42.4 -59.1 -43.9 10.0 59.2 6.2 11 11 A K H <5S+ 0 0 95 -4,-2.7 -2,-0.2 2,-0.1 -1,-0.2 0.937 126.1 30.4 -68.4 -47.2 7.9 56.0 6.7 12 12 A V H <5S+ 0 0 23 -4,-3.0 -3,-0.2 -5,-0.1 -2,-0.2 0.905 133.0 26.9 -82.4 -47.9 10.8 53.7 7.7 13 13 A A H <5S- 0 0 3 -4,-2.0 -3,-0.2 -5,-0.5 -2,-0.1 0.599 93.2-133.1 -94.7 -9.4 13.3 56.0 9.4 14 14 A K S < - 0 0 32 -2,-0.3 4,-2.3 1,-0.2 5,-0.3 -0.722 20.7-158.6 -83.7 131.8 13.3 63.7 6.3 17 18 A G H > S+ 0 0 5 -2,-0.5 4,-2.3 -11,-0.3 5,-0.2 0.899 94.0 54.8 -73.2 -39.3 15.8 62.5 3.8 18 19 A M H 4 S+ 0 0 145 1,-0.2 4,-0.4 3,-0.2 -1,-0.2 0.894 115.8 39.4 -67.3 -33.8 16.1 66.0 2.3 19 20 A F H 4 S+ 0 0 132 2,-0.1 -2,-0.2 1,-0.1 -1,-0.2 0.927 129.8 22.7 -79.9 -47.9 16.9 67.4 5.7 20 21 A W H < S+ 0 0 80 -4,-2.3 -3,-0.2 1,-0.1 -2,-0.2 0.658 129.9 34.3 -97.8 -15.2 19.2 64.8 7.3 21 22 A Y S < S+ 0 0 14 -4,-2.3 3,-0.3 -5,-0.3 -3,-0.2 0.238 87.5 88.4-128.4 20.4 20.7 63.0 4.2 22 23 A S S S+ 0 0 53 -4,-0.4 8,-0.3 -5,-0.2 -1,-0.1 0.611 105.2 15.2 -99.5 -11.8 21.1 65.4 1.4 23 24 A N S S+ 0 0 78 6,-0.1 87,-2.5 -4,-0.1 2,-0.4 -0.300 88.7 131.1-153.3 64.6 24.6 66.6 2.2 24 25 A Y B > -AB 28 109A 0 4,-2.1 4,-2.1 -3,-0.3 3,-0.4 -0.966 67.9 -31.1-122.4 131.2 26.2 64.3 4.7 25 26 A G T 4 S- 0 0 8 83,-2.4 87,-0.3 -2,-0.4 86,-0.2 -0.259 104.1 -48.8 62.9-156.1 29.7 62.7 4.4 26 27 A a T 4 S+ 0 0 13 9,-0.3 7,-0.5 1,-0.1 -1,-0.2 0.689 134.7 26.8 -85.8 -20.8 31.1 61.9 0.9 27 28 A Y T 4 S+ 0 0 15 -3,-0.4 2,-1.4 5,-0.2 -2,-0.2 0.629 83.3 100.7-123.1 -13.0 28.1 60.2 -0.6 28 29 A b B < S+A 24 0A 4 -4,-2.1 -4,-2.1 2,-0.0 2,-0.2 -0.661 86.3 35.8 -85.5 99.5 24.8 61.2 1.0 29 30 A G S S- 0 0 29 -2,-1.4 -6,-0.1 -6,-0.2 -7,-0.1 -0.817 115.7 -31.4 143.6-179.8 23.6 63.6 -1.6 30 31 A W S S- 0 0 220 -8,-0.3 -2,-0.0 -2,-0.2 18,-0.0 -0.346 112.6 -16.7 -69.9 141.7 24.0 63.6 -5.5 31 32 A G S S- 0 0 39 1,-0.1 2,-0.2 17,-0.0 -2,-0.2 -0.158 73.4-162.0 63.0-159.3 27.1 61.9 -6.7 32 33 A G - 0 0 39 -4,-0.1 2,-0.3 84,-0.0 -5,-0.2 -0.659 12.4-165.4 154.8 159.9 30.0 61.3 -4.3 33 34 A Q + 0 0 71 -7,-0.5 85,-0.2 -2,-0.2 2,-0.1 -0.938 50.6 35.5-157.7 164.8 33.8 60.6 -4.3 34 35 A G S S- 0 0 0 -2,-0.3 88,-1.4 84,-0.2 82,-0.1 -0.380 98.4 -27.6 86.0-156.0 36.3 59.4 -1.7 35 36 A R - 0 0 145 86,-0.2 -9,-0.3 -2,-0.1 2,-0.2 -0.728 63.1-107.6 -97.4 138.9 35.8 56.9 1.1 36 37 A P - 0 0 11 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.528 36.1-152.4 -52.8 128.1 32.3 56.3 2.8 37 38 A Q - 0 0 56 -2,-0.2 2,-0.2 1,-0.1 -12,-0.1 0.784 60.7 -12.7 -84.5 -31.0 33.1 58.0 6.2 38 39 A D S > S- 0 0 27 1,-0.1 4,-2.3 70,-0.0 5,-0.2 -0.876 87.4 -72.3-154.0-171.9 30.8 56.1 8.5 39 40 A A H > S+ 0 0 34 -2,-0.2 4,-2.1 2,-0.2 3,-0.2 0.945 127.4 48.4 -65.2 -48.2 27.8 53.6 8.5 40 41 A T H > S+ 0 0 0 59,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.924 112.7 50.4 -57.9 -38.1 25.2 56.2 7.3 41 42 A D H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.895 107.5 52.5 -71.2 -35.0 27.6 57.3 4.5 42 43 A R H X S+ 0 0 104 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.890 104.6 56.7 -67.2 -34.0 28.1 53.7 3.4 43 44 A c H X S+ 0 0 5 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.910 110.1 46.2 -59.0 -40.1 24.3 53.3 3.2 44 45 A b H X S+ 0 0 9 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.850 110.3 51.5 -68.6 -40.2 24.4 56.2 0.8 45 46 A F H X S+ 0 0 15 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.947 111.0 48.2 -60.8 -48.6 27.3 54.8 -1.2 46 47 A V H X S+ 0 0 82 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.934 109.9 52.5 -61.7 -40.3 25.4 51.4 -1.6 47 48 A H H X S+ 0 0 17 -4,-2.1 4,-2.6 -5,-0.2 5,-0.2 0.924 109.9 49.1 -61.4 -42.8 22.3 53.3 -2.7 48 49 A D H X S+ 0 0 50 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.944 112.8 47.4 -56.3 -45.6 24.4 55.2 -5.4 49 50 A d H X S+ 0 0 16 -4,-2.5 4,-1.0 2,-0.2 -2,-0.2 0.929 110.5 52.9 -64.5 -41.5 25.9 51.9 -6.5 50 51 A e H >X S+ 0 0 42 -4,-2.9 3,-1.1 1,-0.2 4,-0.6 0.956 110.6 45.6 -61.1 -48.3 22.3 50.3 -6.6 51 52 A Y H >< S+ 0 0 44 -4,-2.6 3,-1.4 1,-0.3 -1,-0.2 0.924 107.9 60.0 -62.9 -35.9 20.9 53.1 -8.8 52 53 A G H 3< S+ 0 0 64 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.728 104.7 48.5 -63.2 -22.3 24.0 52.8 -11.0 53 54 A K H << S+ 0 0 142 -3,-1.1 2,-0.6 -4,-1.0 -1,-0.3 0.405 81.6 107.4-102.5 2.0 23.2 49.1 -11.8 54 55 A V << + 0 0 12 -3,-1.4 2,-0.4 -4,-0.6 3,-0.1 -0.644 46.3 177.8 -77.7 116.4 19.5 49.5 -12.7 55 56 A T + 0 0 113 -2,-0.6 3,-0.1 1,-0.1 -2,-0.0 -0.980 57.0 41.7-117.0 140.8 19.3 49.1 -16.5 56 59 A G S S+ 0 0 79 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.241 113.8 28.9 119.2 -15.8 16.0 49.3 -18.3 57 61 A f S S- 0 0 28 24,-0.1 -1,-0.3 -3,-0.1 25,-0.0 -0.907 83.2 -94.2-161.4-176.5 14.3 52.2 -16.5 58 67 A D > - 0 0 66 -2,-0.3 4,-2.8 1,-0.1 -3,-0.1 -0.934 15.0-160.9-124.8 115.1 15.1 55.4 -14.7 59 68 A P T 4 S+ 0 0 18 0, 0.0 -1,-0.1 0, 0.0 -7,-0.0 0.675 91.1 53.8 -66.7 -20.7 15.5 55.6 -10.9 60 69 A K T 4 S+ 0 0 108 -59,-0.2 -58,-1.7 -58,-0.1 -57,-0.3 0.937 124.1 17.7 -81.7 -48.0 15.0 59.3 -10.8 61 70 A M T 4 S+ 0 0 128 -60,-0.2 -1,-0.1 -59,-0.1 -58,-0.0 0.784 94.9 98.6-102.7 -24.4 11.7 59.6 -12.6 62 71 A D < - 0 0 47 -4,-2.8 2,-0.5 1,-0.1 -5,-0.0 -0.353 62.8-135.8 -73.3 144.9 9.9 56.1 -12.8 63 72 A V - 0 0 94 -59,-0.0 2,-0.2 -62,-0.0 -1,-0.1 -0.874 21.0-164.5 -98.8 125.6 7.2 55.5 -10.3 64 73 A Y - 0 0 9 -2,-0.5 2,-0.3 -63,-0.1 13,-0.1 -0.649 14.9-122.0-108.7 173.0 7.2 52.1 -8.6 65 74 A S E +C 76 0B 65 11,-0.5 11,-2.6 -2,-0.2 2,-0.3 -0.829 32.9 162.7-113.5 146.5 4.5 50.3 -6.6 66 75 A F E -C 75 0B 53 -2,-0.3 2,-0.3 9,-0.3 9,-0.2 -0.987 17.5-161.7-154.4 161.0 4.7 49.1 -3.0 67 76 A S E -C 74 0B 59 7,-2.3 7,-3.0 -2,-0.3 2,-0.5 -0.884 21.7-125.9-135.7 167.4 2.4 48.0 -0.2 68 77 A E E +C 73 0B 110 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.984 46.2 140.1-119.7 130.7 3.1 47.7 3.6 69 78 A E E > +C 72 0B 104 3,-1.9 3,-2.3 -2,-0.5 -2,-0.1 -0.954 55.4 24.0-164.9 156.7 2.3 44.3 5.2 70 79 A N T 3 S- 0 0 167 1,-0.3 3,-0.1 -2,-0.3 -2,-0.0 0.727 130.9 -63.7 52.0 29.0 3.7 41.8 7.8 71 80 A G T 3 S+ 0 0 88 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.655 116.9 95.4 69.4 23.3 5.4 44.9 9.2 72 81 A D E < S-C 69 0B 71 -3,-2.3 -3,-1.9 2,-0.0 2,-0.5 -0.815 80.4-104.6-134.4 167.2 7.6 45.6 6.0 73 82 A I E -C 68 0B 11 -2,-0.2 2,-0.5 -5,-0.2 -5,-0.2 -0.843 39.2-158.4 -85.6 130.2 7.6 47.7 2.8 74 83 A V E -C 67 0B 49 -7,-3.0 -7,-2.3 -2,-0.5 2,-0.3 -0.962 6.1-144.0-119.0 116.4 6.8 45.2 0.0 75 84 A g E +C 66 0B 10 -2,-0.5 -9,-0.3 -9,-0.2 2,-0.1 -0.595 36.5 151.4 -81.2 133.1 7.9 46.3 -3.5 76 85 A G E +C 65 0B 25 -11,-2.6 -11,-0.5 -2,-0.3 3,-0.2 -0.393 9.7 113.8-134.9-148.1 5.4 45.1 -6.2 77 86 A G S S- 0 0 60 1,-0.1 -13,-0.0 -2,-0.1 6,-0.0 -0.228 71.3 -86.9 96.4 175.8 4.0 45.8 -9.6 78 88 A D S S+ 0 0 164 -2,-0.1 -1,-0.1 1,-0.1 0, 0.0 0.352 100.7 85.6-101.6 4.0 4.3 43.9 -12.8 79 89 A D > - 0 0 58 -3,-0.2 4,-1.9 1,-0.2 3,-0.3 -0.890 58.8-161.8-109.5 115.3 7.5 45.5 -14.0 80 90 A P H > S+ 0 0 105 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.855 90.7 56.1 -66.2 -31.9 10.8 43.9 -12.7 81 91 A f H > S+ 0 0 14 2,-0.2 4,-1.4 1,-0.2 -24,-0.1 0.950 110.1 45.4 -67.7 -35.6 12.9 47.0 -13.6 82 92 A K H > S+ 0 0 68 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.868 108.5 57.0 -76.0 -30.1 10.7 49.3 -11.4 83 93 A K H X S+ 0 0 79 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.870 102.9 55.1 -64.4 -36.2 10.7 46.7 -8.6 84 94 A E H X S+ 0 0 80 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.905 105.5 51.3 -69.8 -30.9 14.5 46.9 -8.6 85 95 A I H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 5,-0.2 0.951 110.4 50.4 -60.7 -45.8 14.4 50.7 -8.1 86 96 A g H X S+ 0 0 0 -4,-1.9 4,-2.8 1,-0.2 5,-0.2 0.940 108.3 51.8 -58.3 -45.0 12.0 50.1 -5.2 87 97 A E H X S+ 0 0 64 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.914 107.8 51.8 -62.5 -40.6 14.3 47.6 -3.7 88 98 A e H X S+ 0 0 5 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.948 114.3 43.5 -57.8 -48.2 17.3 50.0 -3.8 89 99 A D H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.873 113.1 50.6 -68.7 -39.0 15.2 52.7 -2.0 90 100 A R H X S+ 0 0 55 -4,-2.8 4,-2.4 -5,-0.2 5,-0.2 0.942 110.1 50.2 -61.4 -50.6 13.8 50.3 0.6 91 101 A A H X S+ 0 0 50 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.889 112.2 47.5 -54.5 -46.8 17.3 48.9 1.4 92 102 A A H X S+ 0 0 5 -4,-1.9 4,-2.6 -5,-0.2 -1,-0.2 0.904 109.8 52.0 -65.6 -43.7 18.7 52.5 1.9 93 103 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.927 113.9 44.7 -60.7 -41.8 15.7 53.6 4.1 94 104 A I H X S+ 0 0 33 -4,-2.4 4,-3.2 2,-0.2 5,-0.2 0.946 111.2 53.2 -64.8 -48.4 16.2 50.5 6.4 95 105 A c H X S+ 0 0 37 -4,-2.5 4,-1.4 -5,-0.2 -2,-0.2 0.935 110.0 48.7 -52.8 -45.4 20.0 51.1 6.4 96 106 A F H >< S+ 0 0 6 -4,-2.6 3,-0.6 2,-0.2 4,-0.3 0.956 112.7 47.9 -60.1 -47.3 19.5 54.7 7.6 97 107 A R H >< S+ 0 0 111 -4,-2.3 3,-1.2 1,-0.2 4,-0.2 0.920 112.1 49.2 -56.0 -52.7 17.0 53.5 10.3 98 108 A D H 3< S+ 0 0 92 -4,-3.2 3,-0.3 1,-0.2 -1,-0.2 0.738 113.1 47.6 -64.8 -20.1 19.5 50.8 11.5 99 109 A N T X< S+ 0 0 36 -4,-1.4 3,-1.5 -3,-0.6 4,-0.5 0.243 72.5 107.8-109.0 14.8 22.4 53.3 11.7 100 110 A L G X + 0 0 62 -3,-1.2 3,-0.9 -4,-0.3 -1,-0.2 0.789 68.8 72.2 -59.8 -28.8 20.8 56.2 13.5 101 111 A T G 3 S+ 0 0 127 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.836 107.5 34.1 -52.9 -32.7 22.9 55.1 16.6 102 112 A L G < S+ 0 0 87 -3,-1.5 -1,-0.2 2,-0.0 -2,-0.2 0.425 82.3 131.1-103.1 -6.1 25.9 56.5 14.8 103 113 A Y < + 0 0 38 -3,-0.9 2,-0.3 -4,-0.5 -3,-0.0 -0.297 30.0 179.0 -57.9 133.0 24.5 59.5 12.9 104 114 A N > + 0 0 62 1,-0.1 4,-2.5 2,-0.1 3,-0.2 -0.724 17.3 169.0-145.4 92.5 26.7 62.5 13.5 105 115 A D H > S+ 0 0 52 -2,-0.3 4,-2.2 1,-0.2 -1,-0.1 0.838 77.4 65.0 -71.4 -33.0 25.7 65.7 11.7 106 116 A K H 4 S+ 0 0 171 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.888 115.1 30.3 -56.9 -42.0 28.1 67.8 13.7 107 117 A K H 4 S+ 0 0 126 -3,-0.2 -2,-0.2 1,-0.1 -1,-0.2 0.876 129.9 32.3 -86.8 -40.3 31.0 66.0 12.2 108 118 A Y H >< S+ 0 0 25 -4,-2.5 -83,-2.4 2,-0.1 3,-1.4 0.665 79.3 109.6-103.2 -13.5 29.7 65.0 8.7 109 119 A W B 3< S+B 24 0A 98 -4,-2.2 -85,-0.2 1,-0.3 -88,-0.0 -0.398 100.1 0.4 -62.3 136.3 27.3 67.7 7.4 110 120 A A T 3 S+ 0 0 55 -87,-2.5 -1,-0.3 1,-0.1 -86,-0.1 0.847 80.4 175.4 48.9 44.0 28.9 69.5 4.5 111 121 A F < - 0 0 33 -3,-1.4 4,-0.3 -86,-0.2 -1,-0.1 0.718 32.6-133.8 -44.8 -37.1 32.1 67.5 4.8 112 122 A G > - 0 0 45 -87,-0.3 3,-1.8 1,-0.1 4,-0.4 0.636 14.1 -91.5 85.8 135.9 33.7 69.1 1.7 113 123 A A G > S+ 0 0 65 1,-0.3 3,-1.3 2,-0.2 -1,-0.1 0.651 115.6 60.5 -60.2 -30.0 35.6 67.7 -1.3 114 124 A K G 3 S+ 0 0 187 1,-0.3 -1,-0.3 3,-0.1 -2,-0.1 0.852 104.8 54.9 -66.5 -26.5 39.2 67.8 -0.2 115 125 A N G < S+ 0 0 87 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.631 108.0 51.4 -73.8 -10.5 38.1 65.5 2.6 116 126 A a S < S- 0 0 6 -3,-1.3 -1,-0.3 -4,-0.4 -82,-0.1 -0.572 85.4-167.3-122.0 67.5 36.7 63.2 -0.1 117 127 A P > - 0 0 35 0, 0.0 3,-1.8 0, 0.0 -83,-0.2 -0.313 24.2-133.4 -61.6 132.8 39.8 62.9 -2.5 118 128 A Q G > S+ 0 0 137 1,-0.3 3,-1.3 2,-0.2 -84,-0.2 0.763 105.1 63.4 -57.1 -28.1 38.9 61.4 -5.8 119 129 A E G 3 S+ 0 0 180 1,-0.2 -1,-0.3 -86,-0.1 -3,-0.0 0.687 99.4 54.3 -73.4 -13.9 41.9 59.0 -5.5 120 130 A E G < S+ 0 0 77 -3,-1.8 2,-0.7 2,-0.1 -1,-0.2 0.222 77.1 137.9 -96.3 13.7 40.3 57.4 -2.4 121 131 A S < - 0 0 49 -3,-1.3 -86,-0.2 -86,-0.1 -3,-0.1 -0.453 49.6-140.5 -69.9 110.1 37.1 56.6 -4.3 122 132 A E - 0 0 74 -88,-1.4 2,-0.2 -2,-0.7 -2,-0.1 -0.464 17.7-128.9 -62.6 130.6 35.9 53.1 -3.4 123 133 A P 0 0 107 0, 0.0 -1,-0.0 0, 0.0 -74,-0.0 -0.625 360.0 360.0 -80.8 148.3 34.5 51.2 -6.5 124 134 A d 0 0 119 -2,-0.2 -2,-0.0 -75,-0.0 -75,-0.0 0.823 360.0 360.0 -62.3 360.0 31.1 49.6 -6.2