==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-MAY-07 2PYC . COMPND 2 MOLECULE: PHOSPHOLIPASE A2 VRV-PL-VIIIA; . SOURCE 2 ORGANISM_SCIENTIFIC: DABOIA RUSSELLII PULCHELLA; . AUTHOR S.KUMAR,N.SINGH,S.SHARMA,P.KAUR,C.BETZEL,T.P.SINGH . 121 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7539.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 76 62.8 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 . 7 5.8 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 0.8 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 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 36.4 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+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 0 0 0 0 0 0 1 0 1 0 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 . 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 10 0, 0.0 4,-2.6 0, 0.0 60,-0.3 0.000 360.0 360.0 360.0 162.9 10.9 13.7 5.4 2 2 A L H > + 0 0 101 58,-2.6 4,-2.4 1,-0.2 5,-0.1 0.862 360.0 52.3 -58.8 -40.3 9.1 17.0 6.0 3 3 A L H > S+ 0 0 148 57,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.902 110.5 47.6 -63.9 -41.2 12.2 19.0 5.1 4 4 A E H > S+ 0 0 38 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.910 110.7 51.6 -65.7 -41.8 12.5 17.1 1.8 5 5 A F H X S+ 0 0 19 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.932 108.9 52.0 -59.4 -41.0 8.8 17.6 1.1 6 6 A G H X S+ 0 0 19 -4,-2.4 4,-2.2 1,-0.2 11,-0.4 0.904 110.8 46.7 -63.9 -40.5 9.3 21.4 1.8 7 7 A K H X S+ 0 0 119 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.920 110.8 51.9 -67.4 -42.3 12.2 21.5 -0.8 8 8 A M H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.909 109.9 50.3 -59.5 -43.6 10.1 19.5 -3.4 9 9 A I H X S+ 0 0 4 -4,-2.5 4,-3.0 2,-0.2 6,-0.4 0.924 111.3 47.5 -57.9 -49.3 7.3 22.1 -2.9 10 10 A L H X S+ 0 0 70 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.933 111.7 51.1 -60.8 -45.0 9.7 25.0 -3.4 11 11 A E H < S+ 0 0 83 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.911 117.0 40.3 -56.8 -44.4 11.2 23.4 -6.5 12 12 A E H < S+ 0 0 38 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.931 132.3 18.5 -71.0 -46.9 7.8 22.8 -8.0 13 13 A T H < S- 0 0 20 -4,-3.0 -3,-0.2 2,-0.2 -2,-0.2 0.618 86.5-126.7-106.5 -20.3 6.0 26.0 -7.1 14 14 A G S < S+ 0 0 61 -4,-2.7 2,-0.4 -5,-0.4 -4,-0.2 0.348 75.1 118.1 80.9 -3.7 8.7 28.6 -6.3 15 16 A K S S- 0 0 59 -6,-0.4 2,-0.3 -5,-0.1 -1,-0.3 -0.786 73.6-114.1 -96.7 137.2 6.8 29.2 -2.9 16 17 A L > - 0 0 106 -2,-0.4 4,-2.1 1,-0.2 5,-0.5 -0.535 20.3-137.6 -67.2 128.1 8.4 28.5 0.5 17 18 A A H >>S+ 0 0 16 -11,-0.4 4,-2.8 -2,-0.3 5,-1.9 0.913 87.0 75.2 -57.3 -45.9 6.5 25.6 2.0 18 19 A I H 45S+ 0 0 129 1,-0.3 -1,-0.2 3,-0.2 -2,-0.0 -0.960 114.0 3.9 -99.6 119.2 6.6 27.4 5.3 19 20 A P H 45S+ 0 0 76 0, 0.0 4,-0.4 0, 0.0 -1,-0.3 -0.927 127.7 58.5-107.0 12.5 4.6 29.7 5.3 20 21 A S H <5S+ 0 0 18 -4,-2.1 -3,-0.2 1,-0.2 -2,-0.2 0.844 127.6 10.4 -70.8 -32.8 2.8 29.3 2.0 21 22 A Y T ><5S+ 0 0 8 -4,-2.8 3,-1.3 -5,-0.5 -3,-0.2 0.675 105.2 84.4-119.4 -16.7 1.6 25.9 2.6 22 23 A S T 3 -A 108 0A 0 -3,-1.3 4,-2.1 84,-0.2 3,-0.4 -0.645 64.5 -46.1 -90.0 129.5 -3.2 26.7 4.5 25 26 A G T 4 S- 0 0 9 82,-2.6 85,-0.1 -2,-0.4 90,-0.1 -0.095 99.0 -43.6 53.6-146.4 -6.9 26.0 4.7 26 27 A a T 4 S+ 0 0 12 9,-0.1 7,-0.5 1,-0.1 -1,-0.2 0.649 134.4 31.9 -95.3 -19.0 -8.2 23.0 6.6 27 28 A Y T 4 S+ 0 0 11 -3,-0.4 2,-0.7 5,-0.2 -2,-0.2 0.605 85.0 98.4-120.3 -5.0 -5.7 20.4 5.5 28 29 A b S < S- 0 0 10 -4,-2.1 2,-0.3 19,-0.0 3,-0.2 -0.723 89.2 -5.2 -87.3 122.0 -2.3 21.8 4.8 29 30 A G S S+ 0 0 38 -2,-0.7 -6,-0.1 1,-0.2 -7,-0.1 -0.707 118.3 4.7 103.8-159.7 -0.0 21.4 7.8 30 31 A W S S+ 0 0 243 -8,-0.5 -1,-0.2 -2,-0.3 -7,-0.1 0.784 114.6 5.2 -29.3 -84.4 -0.7 19.9 11.3 31 32 A G - 0 0 35 -3,-0.2 2,-0.2 2,-0.0 17,-0.1 0.082 59.1-146.9 -96.3-155.4 -4.3 18.6 11.5 32 33 A G + 0 0 45 83,-0.0 2,-0.3 -4,-0.0 -5,-0.2 -0.601 27.7 135.1 176.9 117.8 -7.3 18.1 9.2 33 34 A K + 0 0 87 -7,-0.5 85,-0.1 -2,-0.2 83,-0.1 -0.945 48.1 28.2-153.9 163.2 -11.1 18.3 9.5 34 35 A G S S- 0 0 0 83,-0.5 83,-0.3 -2,-0.3 82,-0.1 -0.125 96.2 -32.7 82.3-174.5 -13.9 19.7 7.5 35 36 A T - 0 0 77 81,-2.7 81,-0.2 1,-0.1 -9,-0.1 -0.725 68.9-108.6 -85.7 126.2 -14.4 20.5 3.8 36 37 A P - 0 0 9 0, 0.0 3,-0.1 0, 0.0 6,-0.1 -0.210 22.5-135.5 -52.1 139.6 -11.3 21.5 1.9 37 38 A K S S- 0 0 67 1,-0.2 2,-0.3 70,-0.1 -12,-0.0 0.916 70.5 -26.7 -65.9 -43.5 -11.3 25.2 1.1 38 39 A D S > S- 0 0 19 66,-0.0 4,-2.3 1,-0.0 3,-0.4 -0.915 83.1 -65.2-159.9 179.5 -10.1 24.9 -2.5 39 40 A A H > S+ 0 0 14 -2,-0.3 4,-1.7 1,-0.3 5,-0.1 0.850 128.7 51.2 -46.2 -45.1 -8.1 22.8 -4.9 40 41 A T H > S+ 0 0 0 59,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.931 110.4 49.0 -60.1 -45.4 -4.8 23.5 -3.1 41 42 A D H > S+ 0 0 0 -3,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.845 107.0 56.6 -62.8 -34.8 -6.4 22.4 0.2 42 43 A R H X S+ 0 0 138 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.860 100.2 58.6 -66.5 -32.6 -7.7 19.3 -1.6 43 44 A c H X S+ 0 0 4 -4,-1.7 4,-2.3 -5,-0.2 -1,-0.2 0.928 109.2 44.9 -58.0 -43.9 -4.1 18.5 -2.5 44 45 A b H X S+ 0 0 7 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.876 109.4 54.6 -69.3 -37.7 -3.3 18.5 1.2 45 46 A F H X S+ 0 0 21 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.959 112.5 43.8 -56.9 -52.8 -6.4 16.4 2.1 46 47 A V H X S+ 0 0 92 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.894 112.3 53.1 -61.3 -37.8 -5.3 13.8 -0.4 47 48 A H H X S+ 0 0 15 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.897 108.5 50.2 -64.5 -39.9 -1.7 14.0 0.9 48 49 A D H X S+ 0 0 52 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.928 111.7 47.7 -63.4 -44.2 -3.0 13.5 4.5 49 50 A d H X S+ 0 0 24 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.898 109.1 55.2 -61.0 -39.6 -4.9 10.4 3.3 50 51 A e H >< S+ 0 0 42 -4,-2.6 3,-0.5 1,-0.2 -2,-0.2 0.930 111.6 42.0 -60.7 -47.1 -1.8 9.2 1.4 51 52 A Y H >< S+ 0 0 43 -4,-2.4 3,-2.1 1,-0.2 -1,-0.2 0.861 108.3 62.0 -65.3 -36.6 0.2 9.3 4.6 52 53 A G H 3< S+ 0 0 58 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.755 94.6 62.3 -62.4 -26.2 -2.7 7.8 6.5 53 54 A N T << S+ 0 0 106 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.494 94.5 67.2 -74.3 -6.5 -2.4 4.8 4.3 54 55 A L X + 0 0 7 -3,-2.1 3,-2.0 1,-0.1 -1,-0.2 -0.510 58.1 161.1-120.4 73.8 1.1 4.2 5.8 55 56 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.823 79.1 43.2 -52.4 -48.3 0.6 3.3 9.6 56 59 A D T 3 S+ 0 0 148 -3,-0.1 2,-0.2 2,-0.0 25,-0.1 0.203 101.3 84.6 -91.5 7.8 3.8 1.8 10.0 57 61 A f < - 0 0 10 -3,-2.0 -3,-0.1 -6,-0.2 25,-0.0 -0.673 67.5-138.5-106.4 166.3 5.8 4.5 8.2 58 67 A N >> + 0 0 106 -2,-0.2 4,-2.9 1,-0.1 3,-1.1 -0.674 23.7 174.4-125.5 77.8 7.2 7.8 9.5 59 68 A P T 34 S+ 0 0 18 0, 0.0 -1,-0.1 0, 0.0 -8,-0.0 0.719 73.3 59.8 -59.8 -25.9 6.6 10.3 6.8 60 69 A K T 34 S+ 0 0 144 -59,-0.2 -58,-2.6 1,-0.1 -57,-0.4 0.844 123.6 15.1 -71.3 -32.5 7.8 13.3 8.9 61 70 A S T <4 S+ 0 0 84 -3,-1.1 2,-0.2 -60,-0.3 -1,-0.1 0.704 95.2 101.4-117.0 -27.1 11.3 12.0 9.5 62 71 A D < - 0 0 40 -4,-2.9 2,-0.4 1,-0.1 -5,-0.0 -0.470 64.1-140.1 -67.8 127.9 12.0 9.2 7.1 63 72 A R - 0 0 181 -2,-0.2 2,-0.3 -62,-0.1 19,-0.1 -0.736 20.3-176.3 -94.8 138.4 14.2 10.4 4.2 64 73 A Y - 0 0 9 -2,-0.4 2,-0.4 -63,-0.1 13,-0.1 -0.809 18.3-128.2-122.0 167.0 13.8 9.3 0.6 65 74 A K + 0 0 156 11,-0.4 11,-2.7 -2,-0.3 2,-0.3 -0.912 27.6 167.6-115.7 143.8 15.8 10.0 -2.6 66 75 A Y E -B 75 0B 38 -2,-0.4 2,-0.3 9,-0.3 9,-0.2 -0.971 13.5-158.6-145.7 162.3 14.4 11.3 -5.9 67 76 A K E -B 74 0B 100 7,-2.3 7,-2.6 -2,-0.3 2,-0.5 -0.768 22.8-110.6-130.3 177.6 15.8 12.7 -9.1 68 77 A R E -B 73 0B 86 -2,-0.3 2,-0.8 5,-0.2 5,-0.2 -0.964 15.5-166.1-116.3 123.8 14.6 14.8 -12.0 69 78 A V E > S-B 72 0B 70 3,-2.9 3,-1.9 -2,-0.5 4,-0.0 -0.854 79.3 -48.4-106.8 92.7 14.1 13.3 -15.5 70 79 A N T 3 S- 0 0 156 -2,-0.8 -1,-0.1 1,-0.3 0, 0.0 -0.363 124.4 -26.7 60.7-160.7 13.7 16.5 -17.4 71 80 A G T 3 S+ 0 0 66 -3,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.631 119.4 108.6 -59.7 -6.1 11.2 18.4 -15.3 72 81 A A E < -B 69 0B 56 -3,-1.9 -3,-2.9 1,-0.1 2,-0.5 -0.483 67.0-129.6 -81.2 139.4 9.7 15.0 -13.9 73 82 A I E -B 68 0B 6 -5,-0.2 2,-0.5 -2,-0.2 -5,-0.2 -0.689 23.2-172.2 -82.7 125.9 10.1 13.7 -10.3 74 83 A V E -B 67 0B 52 -7,-2.6 -7,-2.3 -2,-0.5 2,-0.2 -0.958 18.0-139.4-122.1 109.3 11.3 10.1 -10.2 75 84 A g E -B 66 0B 22 -2,-0.5 -9,-0.3 -9,-0.2 2,-0.2 -0.523 21.9-137.3 -65.9 130.2 11.3 8.5 -6.8 76 85 A E - 0 0 80 -11,-2.7 -11,-0.4 -2,-0.2 2,-0.2 -0.575 29.7 -85.2 -92.3 157.0 14.5 6.4 -6.4 77 86 A K + 0 0 195 -2,-0.2 2,-0.2 -13,-0.1 -1,-0.1 -0.437 66.5 132.4 -72.8 120.6 14.5 3.0 -4.8 78 88 A G - 0 0 31 1,-0.4 -14,-0.1 -2,-0.2 -1,-0.0 -0.431 66.6 -32.5-130.1-142.8 14.8 2.9 -0.9 79 89 A T > - 0 0 72 -2,-0.2 4,-2.6 1,-0.1 -1,-0.4 -0.313 66.8-104.0 -73.3 169.9 12.8 1.0 1.7 80 90 A S H > S+ 0 0 83 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.934 124.5 51.0 -62.1 -42.3 9.2 0.3 0.9 81 91 A f H > S+ 0 0 25 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.926 110.2 50.1 -57.8 -47.1 8.1 3.1 3.4 82 92 A E H > S+ 0 0 45 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.925 110.8 48.9 -56.8 -46.8 10.5 5.5 1.7 83 93 A N H X S+ 0 0 42 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.916 114.0 45.3 -61.7 -43.3 9.2 4.7 -1.8 84 94 A R H X S+ 0 0 113 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.882 112.5 50.2 -70.6 -40.2 5.6 5.1 -0.7 85 95 A I H X S+ 0 0 0 -4,-2.9 4,-2.5 -5,-0.2 5,-0.2 0.952 109.5 52.6 -60.8 -45.1 6.2 8.4 1.2 86 96 A g H X S+ 0 0 1 -4,-2.7 4,-3.2 1,-0.2 -2,-0.2 0.910 107.3 51.5 -58.0 -42.2 8.0 9.7 -1.8 87 97 A E H X S+ 0 0 96 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.881 109.6 50.3 -65.4 -36.8 5.0 8.9 -4.1 88 98 A e H X S+ 0 0 4 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.928 114.2 44.0 -61.5 -46.3 2.7 10.8 -1.6 89 99 A D H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.919 111.4 53.4 -68.5 -43.1 5.0 13.8 -1.6 90 100 A K H X S+ 0 0 52 -4,-3.2 4,-2.4 -5,-0.2 5,-0.2 0.922 109.4 49.4 -54.7 -48.6 5.5 13.8 -5.4 91 101 A A H X S+ 0 0 54 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.921 112.0 47.7 -59.0 -43.1 1.7 13.8 -5.9 92 102 A A H X S+ 0 0 4 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.916 111.0 50.3 -68.3 -40.6 1.1 16.7 -3.6 93 103 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.921 113.0 46.0 -63.6 -43.5 3.9 18.8 -5.1 94 104 A I H X S+ 0 0 73 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.910 111.9 53.3 -62.1 -42.7 2.5 18.2 -8.6 95 105 A c H X S+ 0 0 33 -4,-2.5 4,-1.1 -5,-0.2 -2,-0.2 0.915 107.3 50.1 -61.2 -43.0 -0.9 19.0 -7.3 96 106 A F H >< S+ 0 0 4 -4,-2.9 3,-0.6 1,-0.2 4,-0.3 0.934 111.4 49.4 -61.1 -42.9 0.2 22.3 -5.8 97 107 A R H >< S+ 0 0 134 -4,-2.1 3,-1.0 1,-0.2 4,-0.2 0.896 108.5 52.7 -61.6 -41.5 1.8 23.2 -9.1 98 108 A Q H 3< S+ 0 0 143 -4,-2.4 -1,-0.2 1,-0.2 3,-0.2 0.731 115.4 42.0 -65.7 -20.7 -1.4 22.3 -11.0 99 109 A N T XX S+ 0 0 31 -4,-1.1 3,-1.9 -3,-0.6 4,-0.5 0.228 73.1 108.7-118.8 15.9 -3.4 24.6 -8.7 100 110 A L G X4 S+ 0 0 47 -3,-1.0 3,-0.8 -4,-0.3 -1,-0.2 0.795 71.6 72.0 -59.5 -28.2 -1.2 27.6 -8.3 101 111 A N G 34 S+ 0 0 136 1,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.586 108.5 31.3 -64.3 -13.4 -3.8 29.4 -10.5 102 112 A T G <4 S+ 0 0 61 -3,-1.9 -1,-0.2 2,-0.0 -2,-0.2 0.303 82.8 133.3-126.3 4.4 -6.3 29.3 -7.6 103 113 A Y << - 0 0 30 -3,-0.8 2,-0.4 -4,-0.5 3,-0.1 -0.373 40.3-160.2 -54.1 134.3 -4.0 29.6 -4.6 104 114 A S > - 0 0 41 1,-0.1 3,-2.4 -2,-0.0 4,-0.2 -0.962 22.2-151.9-129.9 119.1 -5.4 32.2 -2.3 105 115 A K G > S+ 0 0 154 -2,-0.4 3,-2.0 1,-0.3 -1,-0.1 0.756 92.4 75.4 -56.0 -27.8 -3.5 34.0 0.4 106 116 A K G 3 S+ 0 0 157 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.650 90.2 58.1 -60.9 -14.1 -6.7 34.4 2.4 107 117 A Y G X S+ 0 0 35 -3,-2.4 -82,-2.6 3,-0.1 3,-1.1 0.473 78.1 108.3 -96.5 -3.0 -6.4 30.8 3.3 108 118 A M B < S+A 24 0A 58 -3,-2.0 -84,-0.2 1,-0.3 -88,-0.1 -0.560 92.0 10.0 -69.4 141.3 -3.0 31.1 5.0 109 119 A L T 3 S- 0 0 143 -86,-0.8 -1,-0.3 -2,-0.2 -85,-0.2 0.846 91.2-172.1 56.8 37.1 -3.3 30.7 8.8 110 120 A Y < - 0 0 45 -87,-1.5 -1,-0.2 -3,-1.1 2,-0.2 -0.366 26.9-109.4 -64.7 129.5 -6.9 29.6 8.3 111 121 A P > - 0 0 56 0, 0.0 3,-1.6 0, 0.0 4,-0.2 -0.438 16.5-133.0 -67.4 135.1 -8.7 29.4 11.7 112 122 A D G > S+ 0 0 99 1,-0.3 3,-1.9 -2,-0.2 -2,-0.1 0.799 99.6 64.0 -54.2 -40.1 -9.5 25.8 12.8 113 124 A F G 3 S+ 0 0 157 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.719 95.0 61.3 -68.2 -14.2 -13.2 26.6 13.8 114 125 A L G < S+ 0 0 73 -3,-1.6 2,-2.1 1,-0.1 -1,-0.3 0.446 73.0 102.7 -88.6 1.0 -14.1 27.4 10.2 115 126 A a < + 0 0 12 -3,-1.9 2,-0.2 -4,-0.2 -1,-0.1 -0.532 56.9 164.6 -87.3 75.6 -13.2 23.9 9.1 116 127 A K + 0 0 176 -2,-2.1 -81,-2.7 -81,-0.2 2,-0.2 -0.571 29.7 34.8 -95.2 154.7 -16.8 22.8 8.9 117 128 A G S S- 0 0 38 -83,-0.3 -83,-0.5 -2,-0.2 2,-0.3 -0.453 75.8 -97.1 98.2-174.7 -18.3 19.8 7.2 118 129 A E - 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