==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-MAY-04 1TDV . COMPND 2 MOLECULE: PHOSPHOLIPASE A2 VRV-PL-VIIIA; . SOURCE 2 ORGANISM_SCIENTIFIC: DABOIA RUSSELLII PULCHELLA; . AUTHOR N.SINGH,T.JABEEN,A.S.ETHAYATHULLA,R.K.SOMVANSHI,S.SHARMA, . 127 2 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8112.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 74 58.3 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 5.5 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 . 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 . 6 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 43 33.9 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,-0.2 0.000 360.0 360.0 360.0 155.1 12.5 15.3 -4.7 2 2 A L H > + 0 0 104 58,-2.4 4,-2.4 2,-0.2 5,-0.1 0.878 360.0 50.9 -47.5 -45.9 9.2 17.1 -5.4 3 3 A L H > S+ 0 0 149 57,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.918 111.5 47.0 -63.0 -42.2 7.2 14.0 -4.5 4 4 A E H > S+ 0 0 36 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.904 111.6 50.9 -62.6 -44.2 9.1 13.5 -1.2 5 5 A F H X S+ 0 0 17 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.913 108.2 54.7 -59.3 -42.7 8.6 17.2 -0.4 6 6 A G H X S+ 0 0 15 -4,-2.4 4,-2.3 1,-0.2 11,-0.4 0.887 109.2 45.3 -58.7 -43.0 4.9 16.7 -1.1 7 7 A K H X S+ 0 0 55 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.899 110.7 53.9 -71.6 -36.3 4.6 13.8 1.3 8 8 A M H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.899 109.2 49.8 -61.3 -41.8 6.6 15.8 3.9 9 9 A I H X S+ 0 0 5 -4,-2.4 4,-3.0 2,-0.2 5,-0.5 0.936 111.5 47.4 -61.5 -49.4 4.1 18.7 3.5 10 10 A L H X S+ 0 0 35 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.946 112.8 49.2 -59.2 -47.3 1.1 16.4 3.9 11 11 A E H < S+ 0 0 63 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.891 117.6 42.1 -56.8 -39.5 2.7 14.7 7.0 12 12 A E H < S+ 0 0 40 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.923 130.9 17.6 -76.4 -45.2 3.4 18.1 8.5 13 13 A T H < S- 0 0 19 -4,-3.0 -3,-0.2 2,-0.3 -2,-0.2 0.638 87.1-123.7-107.3 -22.1 0.2 20.1 7.7 14 14 A G S < S+ 0 0 63 -4,-2.4 2,-0.4 -5,-0.5 -4,-0.2 0.396 77.7 115.2 83.4 -4.6 -2.5 17.6 6.9 15 16 A K S S- 0 0 63 -6,-0.4 -1,-0.3 -5,-0.1 2,-0.3 -0.806 73.5-114.1 -96.2 138.8 -2.9 19.5 3.5 16 17 A L > - 0 0 98 -2,-0.4 4,-2.0 1,-0.1 5,-0.4 -0.583 19.3-133.2 -70.8 133.5 -2.2 17.8 0.1 17 18 A A H >>S+ 0 0 22 -11,-0.4 4,-2.7 -2,-0.3 5,-1.0 0.914 90.4 71.3 -54.4 -47.3 0.8 19.5 -1.5 18 19 A I H 45S+ 0 0 132 1,-0.2 -1,-0.2 3,-0.2 11,-0.0 -0.976 113.5 7.2-106.5 121.5 -1.3 19.6 -4.7 19 20 A P H 45S+ 0 0 64 0, 0.0 4,-0.4 0, 0.0 -1,-0.2 -0.939 127.2 55.7-104.5 12.8 -3.5 21.6 -4.6 20 21 A S H <5S+ 0 0 16 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.825 127.8 12.6 -72.3 -31.7 -2.9 23.4 -1.4 21 22 A Y T <5S+ 0 0 10 -4,-2.7 3,-0.3 -5,-0.4 -3,-0.2 0.374 105.9 84.9-125.1 -1.1 0.7 24.6 -2.1 22 23 A S S -A 108 0A 1 4,-0.4 4,-2.0 -3,-0.3 3,-0.4 -0.645 65.3 -40.9 -93.3 130.9 -0.6 29.4 -3.9 25 26 A G T 4 S- 0 0 10 82,-2.6 85,-0.1 -2,-0.4 90,-0.1 -0.112 101.6 -42.7 57.0-147.2 0.2 33.1 -4.0 26 27 A a T 4 S+ 0 0 12 1,-0.1 6,-0.6 9,-0.1 7,-0.4 0.674 135.7 26.8 -92.5 -18.9 3.2 34.4 -6.0 27 28 A Y T 4 S+ 0 0 6 -3,-0.4 2,-0.8 4,-0.2 -2,-0.2 0.554 86.5 104.0-123.9 -10.4 5.8 31.8 -5.0 28 29 A b S < S- 0 0 3 -4,-2.0 -4,-0.4 1,-0.2 13,-0.1 -0.684 101.8 -11.3 -88.3 112.8 4.2 28.5 -4.1 29 30 A G S S+ 0 0 50 -2,-0.8 -1,-0.2 -6,-0.2 -7,-0.1 0.051 150.1 20.9 94.7 -23.8 4.5 25.9 -6.8 30 31 A W S S+ 0 0 234 -6,-0.2 -2,-0.2 0, 0.0 -3,-0.1 0.469 82.7 165.3-151.8 -10.4 5.8 28.3 -9.5 31 32 A G + 0 0 25 -4,-0.1 -4,-0.2 1,-0.1 3,-0.1 0.554 16.5 130.0 -12.9 155.1 7.2 31.5 -7.9 32 33 A G + 0 0 57 -6,-0.6 2,-0.3 1,-0.4 87,-0.3 0.140 64.8 18.6-178.3 -50.9 9.4 34.1 -9.5 33 34 A K S S+ 0 0 93 -7,-0.4 -1,-0.4 85,-0.1 85,-0.2 -0.903 78.4 56.7-137.9 167.0 8.3 37.8 -9.0 34 35 A G S S- 0 0 1 83,-4.3 83,-0.1 -2,-0.3 85,-0.1 -0.160 82.5 -63.9 102.5 164.9 6.1 39.9 -6.8 35 36 A T - 0 0 103 81,-0.2 -9,-0.1 -2,-0.1 81,-0.1 -0.814 64.0-106.2 -85.1 125.2 5.7 40.7 -3.1 36 37 A P - 0 0 13 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.216 24.4-134.8 -52.9 139.1 4.7 37.5 -1.3 37 38 A K S S- 0 0 66 1,-0.1 2,-0.3 70,-0.1 -12,-0.1 0.792 70.7 -23.5 -70.9 -31.2 1.0 37.6 -0.4 38 39 A D S > S- 0 0 19 1,-0.0 4,-2.2 66,-0.0 5,-0.2 -0.920 83.4 -68.2-165.1 179.6 1.3 36.3 3.2 39 40 A A H > S+ 0 0 13 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.866 128.0 52.9 -51.0 -44.9 3.5 34.2 5.6 40 41 A T H > S+ 0 0 0 59,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.921 110.1 48.4 -57.7 -46.2 2.7 31.0 3.7 41 42 A D H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.891 107.6 55.6 -62.9 -35.6 3.8 32.6 0.4 42 43 A R H X S+ 0 0 134 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.846 100.6 59.6 -66.0 -32.7 6.9 33.8 2.2 43 44 A c H X S+ 0 0 4 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.947 109.0 43.8 -58.1 -47.3 7.7 30.2 3.1 44 45 A b H X S+ 0 0 7 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.882 110.2 55.2 -65.9 -38.7 7.7 29.4 -0.6 45 46 A F H X S+ 0 0 23 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.960 112.0 43.4 -56.1 -50.5 9.8 32.5 -1.4 46 47 A V H X S+ 0 0 94 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.895 111.9 53.8 -65.1 -37.3 12.4 31.4 1.1 47 48 A H H X S+ 0 0 18 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.918 107.8 50.5 -64.2 -40.0 12.2 27.9 -0.2 48 49 A D H X S+ 0 0 57 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.910 111.3 48.3 -60.4 -44.0 12.8 29.1 -3.7 49 50 A d H X S+ 0 0 16 -4,-2.2 4,-1.0 2,-0.2 -2,-0.2 0.879 108.9 55.3 -62.0 -39.9 15.8 31.1 -2.4 50 51 A e H >< S+ 0 0 31 -4,-2.6 3,-0.7 1,-0.2 -2,-0.2 0.926 110.2 43.4 -60.9 -46.6 17.0 28.0 -0.6 51 52 A Y H >< S+ 0 0 43 -4,-2.4 3,-2.1 1,-0.2 -1,-0.2 0.862 108.2 60.8 -65.2 -37.0 17.0 25.9 -3.8 52 53 A G H 3< S+ 0 0 54 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.721 92.9 64.6 -63.2 -22.2 18.6 28.9 -5.6 53 54 A N T << S+ 0 0 112 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.512 99.6 58.9 -71.7 -9.9 21.6 28.5 -3.2 54 55 A L X + 0 0 9 -3,-2.1 3,-2.2 -4,-0.1 -1,-0.2 -0.540 59.0 159.7-125.0 62.9 22.1 25.1 -4.9 55 56 A P T 3 S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.712 77.9 47.4 -58.1 -29.7 22.7 25.8 -8.6 56 59 A D T 3 S+ 0 0 149 2,-0.0 2,-0.2 25,-0.0 25,-0.1 0.163 99.6 84.0-106.1 19.7 24.4 22.4 -9.2 57 61 A f < - 0 0 11 -3,-2.2 -3,-0.1 -6,-0.2 25,-0.0 -0.769 68.5-141.4-111.3 171.1 21.8 20.3 -7.4 58 67 A N >> + 0 0 106 -2,-0.2 4,-2.6 1,-0.1 3,-1.0 -0.694 22.3 173.2-135.3 76.3 18.5 19.0 -8.8 59 68 A P T 34 S+ 0 0 16 0, 0.0 -1,-0.1 0, 0.0 -8,-0.0 0.701 72.1 64.6 -63.8 -20.4 15.8 19.2 -6.1 60 69 A K T 34 S+ 0 0 155 -59,-0.2 -58,-2.4 1,-0.1 -57,-0.4 0.902 122.5 13.9 -70.3 -36.8 12.9 18.2 -8.2 61 70 A S T <4 S+ 0 0 87 -3,-1.0 2,-0.3 -60,-0.2 -1,-0.1 0.699 97.2 100.4-112.4 -26.9 14.3 14.7 -8.8 62 71 A D < - 0 0 39 -4,-2.6 2,-0.4 1,-0.1 -5,-0.0 -0.516 62.6-143.6 -72.7 123.9 17.1 14.0 -6.3 63 72 A R - 0 0 184 -2,-0.3 2,-0.3 -59,-0.0 19,-0.1 -0.742 17.3-173.6 -90.9 136.7 15.8 11.9 -3.4 64 73 A Y - 0 0 7 -2,-0.4 2,-0.4 -63,-0.1 13,-0.1 -0.777 18.9-126.1-119.5 165.0 17.0 12.3 0.2 65 74 A K + 0 0 156 11,-0.4 11,-2.6 -2,-0.3 2,-0.3 -0.912 31.0 164.7-113.1 143.6 16.3 10.3 3.2 66 75 A Y E -B 75 0B 14 -2,-0.4 2,-0.3 9,-0.3 9,-0.2 -0.972 16.3-154.3-149.1 163.9 15.0 11.6 6.5 67 76 A K E -B 74 0B 95 7,-2.1 7,-2.8 -2,-0.3 2,-0.5 -0.847 20.4-116.0-132.6 169.5 13.4 10.2 9.7 68 77 A R E -B 73 0B 53 -2,-0.3 2,-0.7 5,-0.2 5,-0.2 -0.950 17.5-168.3-110.6 126.9 11.1 11.4 12.4 69 78 A V E > S-B 72 0B 67 3,-2.5 3,-2.0 -2,-0.5 -2,-0.0 -0.929 80.4 -41.0-113.6 99.0 12.5 11.7 15.9 70 79 A N T 3 S- 0 0 168 -2,-0.7 2,-1.1 1,-0.3 -1,-0.2 0.939 125.5 -36.3 38.1 75.2 9.3 12.2 18.0 71 80 A G T 3 S+ 0 0 54 1,-0.2 -1,-0.3 -3,-0.0 2,-0.0 -0.090 116.3 116.8 78.1 -40.5 7.7 14.6 15.5 72 81 A A E < -B 69 0B 52 -3,-2.0 -3,-2.5 -2,-1.1 2,-0.5 -0.324 64.6-129.4 -66.9 139.8 11.1 16.2 14.6 73 82 A I E -B 68 0B 5 -5,-0.2 2,-0.5 -3,-0.1 -5,-0.2 -0.803 24.2-172.1 -88.1 124.5 12.4 15.9 11.0 74 83 A V E -B 67 0B 52 -7,-2.8 -7,-2.1 -2,-0.5 2,-0.3 -0.951 16.2-142.3-120.6 111.9 16.0 14.7 10.9 75 84 A g E -B 66 0B 24 -2,-0.5 -9,-0.3 -9,-0.2 2,-0.2 -0.530 20.2-141.5 -71.1 131.3 17.7 14.7 7.5 76 85 A E - 0 0 79 -11,-2.6 -11,-0.4 -2,-0.3 10,-0.1 -0.652 29.8 -85.3 -96.2 156.5 19.9 11.6 7.1 77 86 A K + 0 0 197 -2,-0.2 2,-0.2 -13,-0.1 -1,-0.1 -0.313 65.6 133.9 -72.1 119.4 23.3 11.6 5.5 78 88 A G - 0 0 37 1,-0.4 -14,-0.1 -2,-0.1 2,-0.1 -0.444 65.6 -31.7-126.0-139.4 23.3 11.3 1.7 79 89 A T > - 0 0 67 -2,-0.2 4,-2.5 1,-0.1 -1,-0.4 -0.377 67.2-103.3 -75.9 166.6 25.2 13.3 -0.9 80 90 A S H > S+ 0 0 90 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.922 123.9 50.1 -56.2 -45.2 26.0 16.9 -0.2 81 91 A f H > S+ 0 0 31 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.925 110.0 49.6 -58.4 -48.6 23.2 18.0 -2.6 82 92 A E H > S+ 0 0 43 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.910 110.6 50.6 -59.3 -43.0 20.7 15.6 -1.0 83 93 A N H X S+ 0 0 44 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.927 114.2 43.1 -59.6 -46.1 21.6 16.9 2.5 84 94 A R H X S+ 0 0 131 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.888 113.3 51.5 -71.8 -40.8 21.1 20.5 1.5 85 95 A I H X S+ 0 0 0 -4,-2.9 4,-2.4 -5,-0.2 5,-0.2 0.940 109.2 51.6 -59.4 -46.4 17.9 19.8 -0.4 86 96 A g H X S+ 0 0 1 -4,-2.8 4,-3.3 -5,-0.3 5,-0.2 0.925 107.5 51.9 -57.5 -43.5 16.5 18.0 2.6 87 97 A E H X S+ 0 0 98 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.880 109.2 51.0 -64.9 -35.1 17.3 21.0 4.9 88 98 A e H X S+ 0 0 4 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.912 113.9 43.0 -64.5 -45.6 15.5 23.3 2.5 89 99 A D H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.917 111.3 54.5 -67.2 -44.5 12.4 21.1 2.3 90 100 A K H X S+ 0 0 55 -4,-3.3 4,-2.3 -5,-0.2 5,-0.2 0.929 109.1 49.3 -53.3 -48.0 12.4 20.5 6.1 91 101 A A H X S+ 0 0 57 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.2 0.923 111.4 48.7 -60.8 -43.2 12.4 24.3 6.7 92 102 A A H X S+ 0 0 4 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.915 110.1 50.3 -65.4 -41.5 9.5 24.9 4.3 93 103 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.919 113.6 46.0 -64.0 -42.6 7.4 22.1 5.8 94 104 A I H X S+ 0 0 69 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.906 112.0 52.2 -61.7 -43.5 8.0 23.6 9.3 95 105 A c H X S+ 0 0 32 -4,-2.8 4,-1.1 -5,-0.2 -2,-0.2 0.911 108.4 49.9 -61.9 -41.8 7.3 27.1 7.9 96 106 A F H >< S+ 0 0 4 -4,-2.8 3,-0.8 1,-0.2 4,-0.4 0.946 111.4 49.0 -63.6 -43.2 4.0 25.9 6.4 97 107 A R H >< S+ 0 0 130 -4,-2.2 3,-1.0 1,-0.3 4,-0.3 0.912 109.2 53.0 -60.8 -40.7 3.0 24.3 9.7 98 108 A Q H 3< S+ 0 0 146 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.709 116.1 39.9 -69.4 -19.6 3.9 27.5 11.6 99 109 A N T X< S+ 0 0 33 -4,-1.1 3,-1.9 -3,-0.8 4,-0.4 0.236 76.1 107.3-118.5 15.2 1.7 29.6 9.3 100 110 A L G X S+ 0 0 44 -3,-1.0 3,-1.1 -4,-0.4 -1,-0.1 0.807 72.6 70.8 -58.2 -31.4 -1.4 27.3 8.8 101 111 A N G 3 S+ 0 0 133 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.607 108.2 32.4 -62.1 -18.8 -3.2 29.8 11.1 102 112 A T G < S+ 0 0 63 -3,-1.9 -1,-0.3 2,-0.0 -2,-0.2 0.312 83.1 131.7-119.9 6.9 -3.1 32.4 8.3 103 113 A Y < - 0 0 26 -3,-1.1 2,-0.4 -4,-0.4 3,-0.0 -0.407 40.9-161.0 -59.0 136.2 -3.4 30.1 5.2 104 114 A S > - 0 0 38 1,-0.1 3,-2.2 -2,-0.0 4,-0.2 -0.971 23.1-150.4-130.0 123.0 -6.1 31.6 3.0 105 115 A K G > S+ 0 0 166 -2,-0.4 3,-2.0 1,-0.3 -1,-0.1 0.730 92.5 76.5 -61.6 -19.8 -7.9 29.7 0.2 106 116 A K G 3 S+ 0 0 154 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.0 0.643 90.2 56.5 -65.0 -16.3 -8.3 33.0 -1.7 107 117 A Y G X S+ 0 0 39 -3,-2.2 -82,-2.6 3,-0.1 3,-1.1 0.405 79.3 110.8 -97.4 1.5 -4.6 32.7 -2.7 108 118 A M B < S+A 24 0A 56 -3,-2.0 -84,-0.2 1,-0.3 -88,-0.1 -0.576 90.8 9.5 -72.4 138.5 -5.0 29.3 -4.3 109 119 A L T 3 S- 0 0 138 -86,-0.9 -1,-0.3 -2,-0.2 -85,-0.2 0.862 90.9-173.2 59.2 36.8 -4.6 29.6 -8.2 110 120 A Y < - 0 0 45 -87,-1.4 -1,-0.2 -3,-1.1 2,-0.2 -0.413 26.1-111.0 -64.6 133.0 -3.4 33.2 -7.7 111 121 A P > - 0 0 55 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 -0.442 14.7-129.5 -73.7 139.9 -3.0 34.9 -11.1 112 122 A D G > S+ 0 0 110 1,-0.3 3,-2.4 -2,-0.2 -79,-0.1 0.807 99.6 66.6 -56.1 -34.6 0.4 35.8 -12.3 113 124 A F G 3 S+ 0 0 134 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.701 93.1 61.1 -71.8 -12.4 -0.3 39.4 -13.2 114 125 A L G < S+ 0 0 66 -3,-1.6 2,-0.6 1,-0.1 -1,-0.3 0.329 91.9 77.8 -88.7 8.7 -0.8 40.3 -9.6 115 126 A a < + 0 0 8 -3,-2.4 2,-0.4 -81,-0.1 -81,-0.2 -0.895 64.5 156.2-121.6 96.8 2.8 39.3 -8.9 116 127 A K + 0 0 135 -2,-0.6 -81,-0.2 -83,-0.1 -3,-0.0 -0.948 30.2 32.5-130.3 143.7 5.1 42.0 -10.0 117 128 A G S S- 0 0 42 -2,-0.4 -83,-4.3 -83,-0.1 2,-0.4 0.230 75.2 -91.5 94.8 144.4 8.6 43.1 -9.2 118 129 A E - 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