==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 04-AUG-01 1JQ8 . COMPND 2 MOLECULE: PHOSPHOLIPASE A2; . SOURCE 2 ORGANISM_SCIENTIFIC: DABOIA RUSSELLII PULCHELLA; . AUTHOR V.CHANDRA,J.JASTI,P.KAUR,S.DEY,C.BETZEL,T.P.SINGH . 247 3 14 14 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12774.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 150 60.7 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 6.5 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 . 2 0.8 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 . 10 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 34.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 2 1 1 0 0 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 S >> 0 0 0 0, 0.0 4,-2.0 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0-176.3 17.3 13.8 41.3 2 2 A L H 3> + 0 0 2 58,-1.1 4,-2.0 240,-0.6 241,-0.2 0.764 360.0 65.2 -53.5 -27.6 15.4 17.0 40.5 3 3 A L H 3> S+ 0 0 35 239,-0.9 4,-1.2 57,-0.2 -1,-0.2 0.939 107.1 36.0 -62.7 -52.4 13.0 14.8 38.6 4 4 A E H <> S+ 0 0 16 -3,-0.6 4,-2.2 2,-0.2 -2,-0.2 0.919 117.0 52.7 -68.4 -46.0 11.7 12.8 41.6 5 5 A F H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.888 108.3 51.7 -57.6 -41.7 11.8 15.7 44.1 6 6 A G H X S+ 0 0 0 -4,-2.0 4,-2.1 239,-0.5 11,-0.4 0.853 107.1 52.2 -65.0 -35.0 9.7 17.8 41.7 7 7 A K H X S+ 0 0 84 -4,-1.2 4,-2.6 238,-0.3 -1,-0.2 0.908 110.5 49.1 -65.7 -42.7 7.1 15.0 41.4 8 8 A M H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.909 108.9 52.5 -62.0 -45.4 6.9 15.0 45.2 9 9 A I H X>S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 6,-0.6 0.920 111.7 45.5 -59.3 -44.5 6.6 18.7 45.4 10 10 A L H X5S+ 0 0 54 -4,-2.1 4,-2.7 236,-0.2 -2,-0.2 0.949 113.2 50.3 -63.6 -48.8 3.7 18.7 43.0 11 11 A E H <5S+ 0 0 85 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.868 119.3 36.6 -53.0 -44.3 2.0 15.8 44.8 12 12 A E H <5S+ 0 0 24 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.755 132.1 23.7 -85.1 -29.8 2.3 17.5 48.2 13 13 A T H <5S- 0 0 16 -4,-2.5 -3,-0.2 2,-0.3 -2,-0.2 0.635 88.1-129.0-112.8 -19.6 1.7 21.1 47.2 14 14 A G S < - 0 0 38 -2,-0.3 4,-1.4 1,-0.2 5,-0.4 -0.680 24.2-134.9 -77.7 127.2 4.9 22.8 40.0 17 18 A A H > S+ 0 0 0 229,-0.6 4,-3.0 -2,-0.4 5,-0.3 0.880 85.3 78.8 -51.0 -40.7 8.3 22.9 41.7 18 19 A I H 4 S+ 0 0 3 1,-0.2 228,-0.2 2,-0.2 -1,-0.1 -0.966 109.9 3.2-111.0 127.0 9.5 25.0 38.8 19 20 A P H 4 S+ 0 0 30 0, 0.0 4,-0.5 0, 0.0 3,-0.4 -0.977 128.0 60.5 -94.9 4.1 8.8 28.0 38.8 20 21 A S H < S+ 0 0 21 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.2 0.874 124.3 15.5 -58.8 -42.7 7.0 28.0 42.1 21 22 A Y S < S+ 0 0 0 -4,-3.0 -1,-0.2 -5,-0.4 -3,-0.2 0.169 106.2 85.4-119.0 17.6 9.9 27.0 44.3 22 23 A S S S+ 0 0 12 -3,-0.4 8,-0.2 -5,-0.3 -2,-0.1 0.556 103.7 23.5 -97.6 -7.5 12.9 27.5 42.0 23 24 A S S S+ 0 0 32 -4,-0.5 87,-2.1 6,-0.1 2,-0.4 0.026 91.0 137.0-141.5 24.7 13.6 31.2 42.7 24 25 A Y B > -A 28 0A 0 4,-1.0 4,-1.9 84,-0.2 3,-0.3 -0.640 66.1 -45.9 -85.8 126.9 12.0 31.5 46.1 25 26 A G T 4 S- 0 0 9 82,-2.4 85,-0.1 -2,-0.4 90,-0.1 -0.077 96.0 -47.8 55.0-152.0 13.7 33.4 48.9 26 27 A a T 4 S+ 0 0 13 9,-0.1 7,-0.6 1,-0.1 -1,-0.2 0.716 135.1 31.7 -89.3 -24.6 17.4 33.0 49.6 27 28 A Y T 4 S+ 0 0 5 -3,-0.3 2,-1.5 5,-0.1 -2,-0.2 0.576 90.2 87.8-114.7 -10.2 17.6 29.2 49.7 28 29 A b B < S+A 24 0A 2 -4,-1.9 -4,-1.0 2,-0.0 2,-0.3 -0.609 96.7 28.0 -91.1 76.9 15.0 27.8 47.2 29 30 A G S S- 0 0 11 -2,-1.5 -6,-0.1 220,-0.3 -3,-0.1 -0.902 119.6 -52.4 169.8-143.1 17.3 27.9 44.2 30 31 A W S S+ 0 0 96 -2,-0.3 -7,-0.1 -8,-0.2 -4,-0.0 0.729 98.9 104.8 -95.2 -25.7 21.1 27.7 43.7 31 32 A G - 0 0 34 1,-0.1 -2,-0.3 -3,-0.0 -5,-0.0 0.070 49.2-166.6 -50.6 163.8 21.9 30.4 46.2 32 33 A G + 0 0 30 83,-0.1 2,-0.3 80,-0.1 87,-0.2 -0.124 45.5 65.0-153.6 52.1 23.3 29.6 49.6 33 34 A K + 0 0 94 -7,-0.6 85,-0.2 85,-0.1 2,-0.1 -0.998 55.5 47.7-167.2 166.0 23.3 32.4 52.1 34 35 A G S S- 0 0 4 83,-4.2 83,-0.1 -2,-0.3 85,-0.1 -0.206 88.7 -45.1 91.1 176.2 21.6 34.9 54.3 35 36 A T - 0 0 115 81,-0.3 -9,-0.1 1,-0.1 81,-0.1 -0.695 66.4-107.8 -84.1 125.8 18.7 34.5 56.7 36 37 A P - 0 0 13 0, 0.0 6,-0.1 0, 0.0 -1,-0.1 -0.248 25.2-135.2 -51.2 139.8 15.9 32.4 55.3 37 38 A K - 0 0 78 70,-0.1 2,-0.2 1,-0.1 -12,-0.1 0.850 69.1 -26.0 -69.2 -38.4 12.9 34.8 54.5 38 39 A D S > S- 0 0 19 66,-0.0 4,-2.0 1,-0.0 5,-0.2 -0.837 83.8 -64.1-156.6-166.7 10.1 32.6 55.9 39 40 A A H > S+ 0 0 13 -2,-0.2 4,-1.5 2,-0.2 5,-0.1 0.878 129.0 49.9 -60.9 -42.4 9.0 29.1 56.8 40 41 A T H > S+ 0 0 0 59,-0.2 4,-1.3 1,-0.2 3,-0.2 0.924 111.0 50.0 -63.0 -43.5 9.0 27.9 53.1 41 42 A D H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.856 107.0 54.5 -63.8 -35.9 12.5 29.4 52.7 42 43 A R H X S+ 0 0 136 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.832 100.1 62.1 -67.4 -30.0 13.7 27.5 55.8 43 44 A c H X S+ 0 0 2 -4,-1.5 4,-1.9 -3,-0.2 -1,-0.2 0.926 106.4 44.5 -59.5 -43.6 12.4 24.3 54.2 44 45 A b H X S+ 0 0 0 -4,-1.3 4,-2.5 2,-0.2 -2,-0.2 0.890 109.9 55.9 -68.3 -36.7 14.9 24.8 51.5 45 46 A F H X S+ 0 0 30 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.957 109.9 45.0 -58.2 -52.0 17.6 25.7 54.0 46 47 A V H X S+ 0 0 90 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.860 110.6 55.5 -59.4 -37.2 17.1 22.4 55.8 47 48 A H H X S+ 0 0 4 -4,-1.9 4,-2.4 -5,-0.2 5,-0.3 0.907 106.8 49.4 -64.5 -40.6 17.0 20.6 52.4 48 49 A D H X S+ 0 0 51 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.923 110.5 50.9 -63.7 -43.1 20.4 22.1 51.6 49 50 A d H < S+ 0 0 18 -4,-2.2 4,-0.4 2,-0.2 -1,-0.2 0.869 109.8 50.1 -61.3 -38.0 21.8 20.9 54.9 50 51 A e H >< S+ 0 0 46 -4,-2.1 3,-1.7 2,-0.2 -2,-0.2 0.968 114.5 42.3 -65.1 -54.4 20.4 17.4 54.4 51 52 A Y H >< S+ 0 0 30 -4,-2.4 3,-1.6 1,-0.3 -2,-0.2 0.828 109.2 61.9 -59.4 -33.3 22.0 17.1 50.9 52 53 A G T 3< S+ 0 0 56 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.644 99.6 54.4 -69.0 -14.0 25.1 18.7 52.4 53 54 A N T < S+ 0 0 118 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.122 89.6 78.6-106.6 20.1 25.4 15.8 54.7 54 55 A L X + 0 0 13 -3,-1.6 3,-2.0 1,-0.1 -1,-0.2 -0.463 50.6 151.2-121.1 54.9 25.4 13.3 51.9 55 56 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.820 70.3 57.6 -55.7 -36.5 29.1 13.7 50.8 56 59 A D T 3 S+ 0 0 102 -3,-0.1 2,-0.2 2,-0.0 25,-0.1 0.429 107.1 64.2 -78.0 4.1 29.3 10.2 49.5 57 61 A f S < S- 0 0 16 -3,-2.0 -3,-0.1 -6,-0.2 25,-0.0 -0.578 73.4-128.3-122.9-177.2 26.4 10.8 47.2 58 67 A N >> + 0 0 111 -2,-0.2 4,-2.8 1,-0.1 3,-1.1 -0.687 28.2 177.5-131.7 74.7 25.1 12.7 44.1 59 68 A P T 34 S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -8,-0.0 0.893 75.7 46.3 -43.0 -62.0 21.7 14.2 45.3 60 69 A K T 34 S+ 0 0 91 1,-0.2 -58,-1.1 -59,-0.2 -57,-0.2 0.628 124.9 28.6 -64.7 -16.8 20.7 16.1 42.1 61 70 A S T <4 S+ 0 0 51 -3,-1.1 2,-0.4 -60,-0.2 181,-0.2 0.740 88.7 99.3-116.0 -31.9 21.5 13.3 39.7 62 71 A D < - 0 0 45 -4,-2.8 2,-0.3 1,-0.1 179,-0.0 -0.443 66.3-139.3 -65.2 117.5 21.1 9.9 41.3 63 72 A R + 0 0 122 -2,-0.4 2,-0.3 -60,-0.0 19,-0.1 -0.570 27.0 175.2 -79.3 136.3 17.6 8.5 40.4 64 73 A Y - 0 0 14 -2,-0.3 2,-0.3 -63,-0.1 19,-0.0 -0.842 20.7-128.7-134.0 171.3 15.6 6.8 43.1 65 74 A K + 0 0 147 -2,-0.3 11,-1.3 2,-0.0 2,-0.3 -0.878 27.6 159.0-124.8 156.0 12.2 5.3 43.4 66 75 A Y E -B 75 0B 14 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.968 15.4-156.6-163.5 167.3 9.3 5.7 45.9 67 76 A K E -B 74 0B 121 7,-2.7 7,-2.4 -2,-0.3 2,-0.4 -0.982 22.5-107.8-152.3 162.8 5.6 5.3 46.2 68 77 A R E -B 73 0B 63 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.818 27.0-177.0 -99.7 133.7 2.5 6.4 48.1 69 78 A V E > S-B 72 0B 85 3,-2.3 3,-0.9 -2,-0.4 -2,-0.0 -0.932 77.1 -14.0-131.8 105.6 0.9 4.2 50.7 70 79 A N T 3 S- 0 0 172 -2,-0.4 3,-0.1 1,-0.2 -1,-0.1 0.758 128.8 -56.0 73.3 25.7 -2.3 5.5 52.4 71 80 A G T 3 S+ 0 0 53 1,-0.2 2,-0.4 0, 0.0 -1,-0.2 0.357 115.5 111.2 89.4 -6.3 -1.5 9.0 51.0 72 81 A A E < S-B 69 0B 55 -3,-0.9 -3,-2.3 1,-0.0 -1,-0.2 -0.879 74.0-109.8-108.4 134.6 1.9 9.2 52.6 73 82 A I E -B 68 0B 3 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.283 32.7-166.0 -56.8 136.5 5.2 9.2 50.6 74 83 A V E -B 67 0B 55 -7,-2.4 -7,-2.7 16,-0.0 2,-0.3 -0.940 14.9-138.5-132.6 111.1 7.2 5.9 51.1 75 84 A g E -B 66 0B 16 -2,-0.4 -9,-0.2 -9,-0.2 8,-0.1 -0.519 22.0-138.2 -69.3 125.8 10.8 5.7 49.9 76 85 A E - 0 0 73 -11,-1.3 2,-0.6 -2,-0.3 -1,-0.1 0.111 31.0 -90.1 -66.2-167.9 11.4 2.4 48.2 77 86 A K + 0 0 183 -13,-0.0 2,-0.1 -11,-0.0 3,-0.1 -0.899 64.9 136.3-117.8 105.8 14.6 0.5 49.0 78 88 A G - 0 0 38 -2,-0.6 -14,-0.1 1,-0.5 -3,-0.0 -0.130 62.5 -33.7-117.3-144.0 17.5 1.3 46.7 79 89 A T > - 0 0 73 -2,-0.1 4,-2.2 1,-0.1 -1,-0.5 -0.264 68.5 -98.9 -73.4 168.1 21.2 2.0 47.5 80 90 A S H > S+ 0 0 80 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.938 127.2 48.6 -52.2 -49.1 22.1 3.7 50.7 81 91 A f H > S+ 0 0 19 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.885 108.1 53.8 -59.1 -42.8 22.4 7.0 48.8 82 92 A E H > S+ 0 0 46 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.887 111.2 44.9 -62.0 -40.6 19.1 6.5 47.0 83 93 A N H X S+ 0 0 20 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.858 115.3 47.1 -72.4 -36.1 17.2 6.1 50.3 84 94 A R H X S+ 0 0 75 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.882 113.6 47.4 -72.7 -39.0 18.9 9.0 52.0 85 95 A I H X S+ 0 0 0 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.924 111.6 51.7 -66.7 -43.4 18.4 11.3 49.1 86 96 A g H X S+ 0 0 2 -4,-2.1 4,-2.5 -5,-0.3 -2,-0.2 0.892 109.7 50.0 -59.6 -40.9 14.7 10.2 48.9 87 97 A E H X S+ 0 0 88 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.901 107.5 52.6 -65.8 -42.7 14.3 11.0 52.6 88 98 A e H X S+ 0 0 5 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.933 113.2 45.3 -58.2 -44.4 15.8 14.5 52.3 89 99 A D H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.905 110.4 53.3 -64.9 -43.8 13.4 15.2 49.4 90 100 A K H X S+ 0 0 56 -4,-2.5 4,-2.3 1,-0.2 5,-0.3 0.929 107.7 51.2 -57.5 -47.5 10.4 13.8 51.3 91 101 A A H X S+ 0 0 60 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.879 113.8 44.4 -59.2 -39.7 11.1 16.0 54.3 92 102 A A H X S+ 0 0 4 -4,-1.5 4,-2.7 -5,-0.2 -2,-0.2 0.935 110.6 52.6 -71.5 -46.6 11.2 19.1 52.1 93 103 A A H X S+ 0 0 0 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.899 114.3 43.5 -54.8 -45.3 8.1 18.3 50.1 94 104 A I H X S+ 0 0 36 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.847 110.2 55.9 -70.0 -35.1 6.1 17.8 53.2 95 105 A c H X S+ 0 0 29 -4,-1.6 4,-1.3 -5,-0.3 -2,-0.2 0.922 106.0 52.3 -62.7 -42.6 7.7 20.9 54.8 96 106 A F H < S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.892 111.4 46.1 -59.9 -43.0 6.5 22.9 51.8 97 107 A R H >< S+ 0 0 109 -4,-1.5 3,-1.4 1,-0.2 4,-0.3 0.896 107.6 55.9 -67.6 -42.5 2.9 21.7 52.2 98 108 A Q H 3< S+ 0 0 123 -4,-2.5 -1,-0.2 1,-0.3 3,-0.2 0.772 116.7 38.2 -61.4 -26.4 2.8 22.3 55.9 99 109 A N T >< S+ 0 0 41 -4,-1.3 3,-1.8 -3,-0.2 4,-0.3 0.122 74.6 109.7-113.1 19.4 3.7 25.9 55.3 100 110 A L G X S+ 0 0 57 -3,-1.4 3,-1.6 1,-0.3 -1,-0.1 0.841 71.6 76.6 -58.7 -28.5 1.7 26.6 52.1 101 111 A N G 3 S+ 0 0 153 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.764 104.0 29.6 -49.2 -36.0 -0.2 28.7 54.6 102 112 A T G < S+ 0 0 73 -3,-1.8 -1,-0.3 2,-0.1 2,-0.2 0.192 81.4 136.7-116.4 15.4 2.5 31.3 54.6 103 113 A Y < - 0 0 34 -3,-1.6 2,-0.5 -4,-0.3 3,-0.1 -0.486 39.7-157.3 -64.7 126.0 3.9 31.1 51.1 104 114 A S > - 0 0 31 -2,-0.2 3,-1.7 1,-0.1 4,-0.2 -0.938 21.0-150.1-115.0 128.8 4.3 34.6 49.8 105 115 A K G > S+ 0 0 178 -2,-0.5 3,-2.2 1,-0.3 -1,-0.1 0.821 93.7 72.2 -61.4 -30.3 4.4 35.6 46.1 106 116 A K G 3 S+ 0 0 141 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.632 91.7 57.2 -62.6 -13.9 6.7 38.5 47.0 107 117 A Y G X S+ 0 0 41 -3,-1.7 -82,-2.4 3,-0.1 3,-0.9 0.421 82.9 106.2 -96.8 -0.3 9.6 36.1 47.6 108 118 A M T < S+ 0 0 57 -3,-2.2 -84,-0.2 1,-0.3 -88,-0.1 -0.500 86.5 15.1 -76.0 149.4 9.4 34.6 44.1 109 119 A L T 3 S- 0 0 40 -90,-0.2 -1,-0.3 1,-0.2 -85,-0.2 0.836 91.9-173.6 54.1 35.7 12.1 35.7 41.7 110 120 A Y < - 0 0 40 -87,-2.1 2,-0.2 -3,-0.9 -1,-0.2 -0.426 25.6-117.4 -67.2 125.1 14.1 36.9 44.8 111 121 A P > - 0 0 33 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.450 14.8-143.7 -64.9 125.2 17.3 38.7 43.9 112 122 A D G > S+ 0 0 75 1,-0.3 3,-2.2 -2,-0.2 -80,-0.1 0.789 95.0 69.0 -62.6 -29.0 20.3 36.9 45.4 113 124 A F G 3 S+ 0 0 136 1,-0.3 -1,-0.3 107,-0.1 -3,-0.0 0.753 88.5 66.2 -63.9 -19.8 22.2 40.1 46.2 114 125 A L G < S+ 0 0 85 -3,-1.5 2,-0.5 1,-0.1 -1,-0.3 0.462 92.2 75.3 -78.7 0.3 19.5 40.7 48.9 115 126 A a < + 0 0 6 -3,-2.2 2,-0.3 -81,-0.1 -81,-0.2 -0.944 60.1 156.0-117.9 113.2 20.9 37.6 50.7 116 127 A K + 0 0 133 -2,-0.5 -81,-0.3 -83,-0.1 -83,-0.1 -0.989 30.4 53.0-138.1 146.0 24.2 37.9 52.5 117 128 A G S S- 0 0 49 -2,-0.3 -83,-4.2 -83,-0.1 2,-0.4 0.126 74.2 -96.5 107.1 137.3 25.9 36.1 55.4 118 129 A E - 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