==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-AUG-05 2ARM . COMPND 2 MOLECULE: PHOSPHOLIPASE A2 VRV-PL-VIIIA; . SOURCE 2 ORGANISM_SCIENTIFIC: DABOIA RUSSELLII PULCHELLA; . AUTHOR N.SINGH,A.PAL,T.JABEEN,S.SHARMA,M.PERBANDT,C.BETZEL,T.P.SING . 121 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7570.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 73 60.3 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 5.8 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 . 5 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 11.6 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,-2.5 0, 0.0 60,-0.2 0.000 360.0 360.0 360.0 153.5 12.6 15.3 4.6 2 2 A L H > + 0 0 112 58,-2.3 4,-2.3 1,-0.2 5,-0.1 0.874 360.0 51.9 -48.0 -44.1 9.3 17.2 4.0 3 3 A L H > S+ 0 0 151 57,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.906 110.4 48.0 -63.9 -40.9 7.3 14.0 4.8 4 4 A E H > S+ 0 0 36 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.900 110.2 51.9 -64.6 -42.4 9.1 13.6 8.1 5 5 A F H X S+ 0 0 18 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.916 108.3 52.6 -59.6 -42.7 8.6 17.3 8.9 6 6 A G H X S+ 0 0 16 -4,-2.3 4,-2.2 2,-0.2 11,-0.4 0.898 109.5 47.8 -61.6 -40.0 4.9 16.8 8.2 7 7 A K H X S+ 0 0 115 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.915 111.3 50.9 -67.8 -40.5 4.7 13.9 10.7 8 8 A M H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.893 109.3 51.2 -61.9 -42.3 6.6 15.9 13.3 9 9 A I H X S+ 0 0 4 -4,-2.6 4,-2.9 2,-0.2 6,-0.5 0.932 111.3 47.0 -60.4 -47.6 4.1 18.8 12.8 10 10 A L H X S+ 0 0 73 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.935 112.5 50.3 -61.8 -45.2 1.1 16.5 13.3 11 11 A E H < S+ 0 0 86 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.901 117.3 40.2 -57.0 -43.3 2.7 14.9 16.4 12 12 A E H < S+ 0 0 40 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.921 131.5 19.4 -75.6 -44.8 3.4 18.3 17.9 13 13 A T H < S- 0 0 20 -4,-2.9 -3,-0.2 2,-0.3 -2,-0.2 0.639 87.4-124.8-105.7 -21.5 0.2 20.2 17.1 14 14 A G S < S+ 0 0 63 -4,-2.3 2,-0.4 -5,-0.5 -4,-0.2 0.463 77.6 115.2 83.8 0.9 -2.5 17.7 16.3 15 16 A K S S- 0 0 60 -6,-0.5 -1,-0.3 -5,-0.1 2,-0.3 -0.851 72.9-115.2-103.9 137.9 -2.9 19.5 12.9 16 17 A L > - 0 0 103 -2,-0.4 4,-2.0 1,-0.1 5,-0.4 -0.572 18.3-135.3 -71.0 132.8 -2.1 17.9 9.5 17 18 A A H >>S+ 0 0 20 -11,-0.4 4,-2.6 -2,-0.3 5,-0.7 0.901 89.5 74.0 -56.5 -45.5 0.8 19.7 7.8 18 19 A I H 45S+ 0 0 134 1,-0.2 -1,-0.2 3,-0.2 11,-0.0 -0.974 113.8 5.4-103.3 118.4 -1.2 19.7 4.6 19 20 A P H 45S+ 0 0 67 0, 0.0 4,-0.4 0, 0.0 -1,-0.2 -0.951 128.6 55.5-104.2 8.0 -3.5 21.7 4.7 20 21 A S H <5S+ 0 0 17 -4,-2.0 -3,-0.2 1,-0.2 -2,-0.2 0.813 127.3 12.7 -69.3 -31.5 -2.9 23.5 8.0 21 22 A Y T <5S+ 0 0 10 -4,-2.6 -1,-0.2 -5,-0.4 -3,-0.2 0.258 106.1 83.5-128.9 8.8 0.7 24.6 7.3 22 23 A S S -A 108 0A 1 4,-0.2 4,-1.9 84,-0.2 3,-0.4 -0.682 65.1 -43.4 -90.8 127.7 -0.4 29.5 5.4 25 26 A G T 4 S- 0 0 9 82,-2.5 85,-0.1 -2,-0.4 90,-0.1 -0.131 100.2 -44.1 57.8-147.4 0.4 33.2 5.2 26 27 A a T 4 S+ 0 0 11 9,-0.1 7,-0.4 1,-0.1 -1,-0.2 0.664 134.9 30.4 -93.8 -17.3 3.3 34.4 3.3 27 28 A Y T 4 S+ 0 0 6 -3,-0.4 2,-0.6 5,-0.1 4,-0.5 0.541 87.5 100.4-124.1 -9.5 6.0 31.9 4.3 28 29 A b S < S- 0 0 4 -4,-1.9 -4,-0.2 1,-0.2 13,-0.1 -0.721 99.9 -10.3 -89.5 121.2 4.4 28.5 5.1 29 30 A G S S+ 0 0 48 -2,-0.6 -1,-0.2 -6,-0.2 -7,-0.1 0.096 143.2 32.1 87.3 -22.9 4.7 25.9 2.4 30 31 A W S S- 0 0 235 -6,-0.2 -2,-0.2 0, 0.0 -1,-0.1 0.472 84.5-164.8-146.7 -3.6 6.0 28.2 -0.3 31 32 A G + 0 0 22 -4,-0.5 2,-0.5 1,-0.1 -3,-0.1 0.200 33.1 109.6 52.3-168.8 8.2 31.0 1.1 32 33 A G - 0 0 48 -5,-0.1 2,-0.3 13,-0.1 -5,-0.1 -0.713 62.3 -0.2 110.8 -90.6 9.4 34.1 -0.5 33 34 A K S S+ 0 0 130 -2,-0.5 85,-0.2 -7,-0.4 83,-0.1 -0.886 70.9 63.3-143.6 172.5 8.3 37.7 0.3 34 35 A G S S- 0 0 1 83,-3.5 83,-0.1 -2,-0.3 81,-0.1 -0.235 81.5 -61.9 100.1 169.3 6.1 39.9 2.5 35 36 A T - 0 0 104 81,-0.2 -9,-0.1 -2,-0.1 81,-0.1 -0.842 64.6-106.1 -88.9 123.3 5.7 40.7 6.1 36 37 A P - 0 0 13 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.242 25.4-134.5 -51.7 140.5 4.8 37.5 8.0 37 38 A K - 0 0 69 70,-0.1 2,-0.3 1,-0.1 -12,-0.1 0.768 69.5 -24.9 -72.2 -30.3 1.1 37.6 8.9 38 39 A D S > S- 0 0 22 1,-0.0 4,-2.1 66,-0.0 5,-0.2 -0.906 84.3 -65.6-165.8-174.9 1.3 36.4 12.5 39 40 A A H > S+ 0 0 14 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.883 128.3 52.2 -57.7 -42.3 3.4 34.3 14.9 40 41 A T H > S+ 0 0 0 59,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.927 109.8 48.9 -60.5 -44.9 2.8 31.1 13.0 41 42 A D H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.865 107.2 56.4 -63.3 -34.8 3.9 32.7 9.7 42 43 A R H X S+ 0 0 134 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.864 100.6 58.1 -65.5 -33.9 7.0 33.9 11.5 43 44 A c H X S+ 0 0 4 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.930 109.5 45.1 -56.4 -45.4 7.7 30.3 12.5 44 45 A b H X S+ 0 0 6 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.875 109.3 54.6 -67.9 -38.9 7.8 29.6 8.8 45 46 A F H X S+ 0 0 23 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.952 112.6 43.4 -55.8 -52.1 9.9 32.6 7.9 46 47 A V H X S+ 0 0 94 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.894 112.5 52.8 -63.7 -39.5 12.5 31.5 10.4 47 48 A H H X S+ 0 0 16 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.909 108.9 50.4 -62.0 -42.0 12.3 27.9 9.2 48 49 A D H X S+ 0 0 54 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.924 112.1 46.9 -61.5 -44.9 12.8 29.1 5.6 49 50 A d H X S+ 0 0 17 -4,-2.4 4,-1.0 2,-0.2 -2,-0.2 0.882 108.9 55.9 -61.2 -40.1 15.9 31.1 6.8 50 51 A e H >< S+ 0 0 30 -4,-2.5 3,-1.0 2,-0.2 4,-0.2 0.939 109.6 44.3 -60.8 -48.8 17.1 28.0 8.7 51 52 A Y H >< S+ 0 0 46 -4,-2.5 3,-1.9 1,-0.3 -1,-0.2 0.875 108.3 60.8 -61.8 -35.3 17.0 25.9 5.5 52 53 A G H 3< S+ 0 0 51 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.713 92.1 64.6 -64.9 -22.3 18.7 28.9 3.8 53 54 A N T << S+ 0 0 110 -4,-1.0 -1,-0.3 -3,-1.0 -2,-0.2 0.592 98.1 62.4 -71.9 -10.2 21.6 28.5 6.2 54 55 A L X + 0 0 10 -3,-1.9 3,-1.8 -4,-0.2 -1,-0.2 -0.571 57.9 162.0-121.3 60.3 22.2 25.1 4.4 55 56 A P T 3 S+ 0 0 104 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.744 79.7 42.4 -42.8 -36.1 23.0 25.8 0.7 56 59 A D T 3 S+ 0 0 153 2,-0.0 2,-0.2 0, 0.0 25,-0.1 0.115 99.6 89.9-110.5 19.8 24.5 22.4 0.0 57 61 A f < - 0 0 10 -3,-1.8 -3,-0.1 -6,-0.2 25,-0.0 -0.699 67.2-142.0-108.4 161.7 21.9 20.5 2.0 58 67 A N >> + 0 0 108 -2,-0.2 4,-2.7 1,-0.1 3,-0.9 -0.678 21.9 174.4-129.2 72.6 18.5 19.0 0.5 59 68 A P T 34 S+ 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -8,-0.0 0.715 72.4 62.1 -49.3 -33.0 15.8 19.4 3.2 60 69 A K T 34 S+ 0 0 170 -59,-0.2 -58,-2.3 1,-0.1 -57,-0.4 0.889 122.6 14.1 -65.9 -38.3 12.9 18.2 1.0 61 70 A S T <4 S+ 0 0 85 -3,-0.9 2,-0.3 -60,-0.2 -1,-0.1 0.730 95.8 100.6-111.5 -29.1 14.3 14.7 0.5 62 71 A D < - 0 0 38 -4,-2.7 2,-0.3 1,-0.1 -5,-0.0 -0.471 62.6-143.0 -69.9 127.0 17.1 14.0 3.0 63 72 A R - 0 0 175 -2,-0.3 2,-0.3 -62,-0.0 19,-0.1 -0.716 17.9-174.2 -93.9 139.7 15.9 11.9 5.9 64 73 A Y - 0 0 8 -2,-0.3 2,-0.4 -63,-0.1 13,-0.1 -0.809 19.2-125.3-123.2 165.6 17.0 12.3 9.5 65 74 A K + 0 0 158 11,-0.5 11,-2.7 -2,-0.3 2,-0.3 -0.908 30.0 167.2-112.7 143.6 16.3 10.3 12.7 66 75 A Y E -B 75 0B 38 -2,-0.4 2,-0.3 9,-0.3 9,-0.2 -0.973 13.9-158.9-147.5 160.5 14.9 11.6 15.9 67 76 A K E -B 74 0B 103 7,-2.2 7,-2.8 -2,-0.3 2,-0.4 -0.827 21.4-114.7-132.1 170.6 13.4 10.3 19.1 68 77 A R E -B 73 0B 85 -2,-0.3 2,-0.7 5,-0.2 5,-0.2 -0.929 14.2-165.9-108.5 131.0 11.2 11.5 22.0 69 78 A V E > S-B 72 0B 70 3,-2.4 3,-1.7 -2,-0.4 -2,-0.0 -0.915 80.9 -48.8-114.9 96.5 12.6 11.8 25.5 70 79 A N T 3 S- 0 0 153 -2,-0.7 -1,-0.1 1,-0.3 0, 0.0 -0.425 124.5 -26.9 56.7-150.0 9.4 12.2 27.3 71 80 A G T 3 S+ 0 0 62 -3,-0.2 -1,-0.3 2,-0.1 2,-0.1 0.650 116.6 107.7 -67.5 -9.6 7.8 15.0 25.1 72 81 A A E < -B 69 0B 55 -3,-1.7 -3,-2.4 1,-0.1 2,-0.4 -0.410 67.8-129.6 -76.1 138.7 11.1 16.4 23.9 73 82 A I E -B 68 0B 4 -5,-0.2 2,-0.5 -2,-0.1 -5,-0.2 -0.724 22.9-170.5 -84.3 129.0 12.5 16.0 20.4 74 83 A V E -B 67 0B 51 -7,-2.8 -7,-2.2 -2,-0.4 2,-0.2 -0.955 15.8-141.7-123.5 109.9 16.0 14.7 20.3 75 84 A g E -B 66 0B 23 -2,-0.5 2,-0.3 -9,-0.2 -9,-0.3 -0.507 20.1-141.5 -67.9 132.8 17.7 14.7 16.9 76 85 A E - 0 0 80 -11,-2.7 -11,-0.5 -2,-0.2 2,-0.2 -0.726 29.8 -85.5 -99.2 150.8 19.9 11.6 16.5 77 86 A K + 0 0 190 -2,-0.3 2,-0.1 -13,-0.1 3,-0.1 -0.364 64.9 133.7 -67.4 125.3 23.3 11.7 14.8 78 88 A G - 0 0 34 1,-0.5 -14,-0.1 -2,-0.2 -1,-0.1 -0.310 66.1 -30.6-132.8-142.9 23.4 11.3 11.0 79 89 A T > - 0 0 68 -2,-0.1 4,-2.6 1,-0.1 -1,-0.5 -0.344 68.0-103.4 -74.0 167.0 25.3 13.3 8.4 80 90 A S H > S+ 0 0 83 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.920 124.1 50.6 -59.3 -43.7 26.0 17.0 9.1 81 91 A f H > S+ 0 0 25 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.926 110.1 50.1 -58.6 -44.5 23.2 18.0 6.7 82 92 A E H > S+ 0 0 42 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.919 110.1 49.8 -62.1 -44.2 20.8 15.6 8.4 83 93 A N H X S+ 0 0 43 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.924 114.4 44.1 -59.0 -46.0 21.6 16.9 11.9 84 94 A R H X S+ 0 0 125 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.885 113.0 50.3 -70.7 -40.1 21.1 20.6 10.8 85 95 A I H X S+ 0 0 0 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.933 109.5 52.5 -61.2 -45.5 17.9 19.9 8.9 86 96 A g H X S+ 0 0 1 -4,-2.5 4,-3.0 -5,-0.2 5,-0.2 0.921 108.0 50.7 -57.7 -43.9 16.5 18.1 11.9 87 97 A E H X S+ 0 0 95 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.878 109.9 50.5 -64.4 -36.3 17.3 21.0 14.2 88 98 A e H X S+ 0 0 5 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.919 114.0 44.2 -62.9 -45.7 15.5 23.4 11.8 89 99 A D H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.912 111.0 53.3 -67.9 -45.0 12.4 21.2 11.7 90 100 A K H X S+ 0 0 53 -4,-3.0 4,-2.4 1,-0.2 5,-0.2 0.921 109.5 49.4 -54.3 -48.0 12.4 20.6 15.5 91 101 A A H X S+ 0 0 55 -4,-2.0 4,-2.7 -5,-0.2 -1,-0.2 0.919 111.3 48.7 -61.0 -45.1 12.5 24.4 16.1 92 102 A A H X S+ 0 0 4 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.907 110.7 50.3 -63.2 -41.4 9.6 25.0 13.6 93 103 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.914 113.2 45.8 -63.9 -43.6 7.4 22.2 15.1 94 104 A I H X S+ 0 0 71 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.912 112.3 52.2 -61.6 -44.1 8.0 23.7 18.6 95 105 A c H X S+ 0 0 33 -4,-2.7 4,-1.1 -5,-0.2 -2,-0.2 0.919 108.4 49.9 -60.4 -44.4 7.3 27.2 17.3 96 106 A F H >< S+ 0 0 4 -4,-2.8 3,-0.6 1,-0.2 4,-0.3 0.932 111.7 49.4 -60.0 -44.2 4.0 26.0 15.7 97 107 A R H >< S+ 0 0 133 -4,-2.0 3,-0.9 1,-0.2 4,-0.3 0.895 109.1 51.9 -60.9 -41.5 3.0 24.4 19.0 98 108 A Q H 3< S+ 0 0 144 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.693 115.4 42.7 -69.0 -19.4 3.9 27.6 21.0 99 109 A N T XX S+ 0 0 33 -4,-1.1 3,-1.7 -3,-0.6 4,-0.6 0.218 74.3 106.4-117.4 15.1 1.7 29.7 18.6 100 110 A L G X4 S+ 0 0 44 -3,-0.9 3,-0.8 -4,-0.3 -1,-0.1 0.824 71.2 73.1 -58.9 -29.6 -1.4 27.5 18.2 101 111 A N G 34 S+ 0 0 132 1,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.669 109.0 29.4 -61.6 -17.2 -3.1 30.0 20.5 102 112 A T G <4 S+ 0 0 69 -3,-1.7 -1,-0.3 2,-0.0 -2,-0.2 0.336 83.1 134.1-124.0 2.8 -3.1 32.5 17.6 103 113 A Y << - 0 0 30 -3,-0.8 2,-0.4 -4,-0.6 -3,-0.0 -0.328 39.4-161.3 -51.2 133.1 -3.3 30.2 14.5 104 114 A S > - 0 0 21 1,-0.1 3,-2.1 0, 0.0 4,-0.1 -0.973 23.5-150.4-129.8 123.3 -6.0 31.7 12.2 105 115 A K G > S+ 0 0 159 -2,-0.4 3,-2.1 1,-0.3 -1,-0.1 0.735 91.8 77.1 -59.4 -24.4 -7.8 29.8 9.4 106 116 A K G 3 S+ 0 0 147 1,-0.3 -1,-0.3 -82,-0.0 -81,-0.0 0.704 89.8 58.5 -59.7 -18.5 -8.2 33.1 7.5 107 117 A Y G X S+ 0 0 43 -3,-2.1 -82,-2.5 3,-0.1 3,-1.1 0.440 78.8 109.8 -93.6 1.5 -4.5 32.7 6.5 108 118 A M B < S+A 24 0A 48 -3,-2.1 -84,-0.2 1,-0.3 -88,-0.1 -0.570 90.9 8.7 -74.8 140.8 -4.9 29.3 4.8 109 119 A L T 3 S- 0 0 144 -86,-0.7 -1,-0.3 -2,-0.2 -85,-0.2 0.855 91.7-171.5 56.0 38.3 -4.5 29.5 1.0 110 120 A Y < - 0 0 45 -87,-1.5 -1,-0.2 -3,-1.1 2,-0.1 -0.393 25.1-111.1 -64.6 128.6 -3.3 33.1 1.5 111 121 A P > - 0 0 59 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.423 14.6-130.8 -70.6 137.4 -3.0 34.9 -1.9 112 122 A D G > S+ 0 0 128 1,-0.3 3,-2.5 2,-0.2 -79,-0.1 0.823 99.8 66.2 -51.8 -43.1 0.5 35.8 -3.1 113 124 A F G 3 S+ 0 0 138 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.726 93.2 61.8 -61.5 -18.4 -0.2 39.5 -4.0 114 125 A L G < S+ 0 0 78 -3,-1.5 2,-0.6 1,-0.2 -1,-0.3 0.400 92.9 75.1 -84.4 5.1 -0.8 40.3 -0.3 115 126 A a < + 0 0 17 -3,-2.5 2,-0.3 -81,-0.1 -1,-0.2 -0.850 64.2 151.1-119.7 94.1 2.8 39.3 0.3 116 127 A K + 0 0 165 -2,-0.6 -81,-0.2 -83,-0.1 -3,-0.0 -0.929 30.4 38.6-126.7 147.9 5.2 42.0 -0.9 117 128 A G S S- 0 0 42 -2,-0.3 -83,-3.5 -83,-0.1 2,-0.3 0.195 75.6 -84.4 98.9 146.6 8.6 43.2 0.1 118 129 A E - 0 0 143 -85,-0.2 2,-0.5 -83,-0.0 -85,-0.1 -0.633 30.1-167.9 -87.9 142.9 11.9 41.6 1.3 119 130 A L - 0 0 61 -2,-0.3 2,-0.2 -85,-0.1 -2,-0.0 -0.986 23.4-131.7-128.5 115.6 12.5 40.8 4.9 120 131 A K 0 0 185 -2,-0.5 -71,-0.0 1,-0.1 -2,-0.0 -0.467 360.0 360.0 -74.5 140.8 16.1 39.9 5.6 121 133 A d 0 0 122 -2,-0.2 -1,-0.1 -72,-0.0 -72,-0.0 0.769 360.0 360.0 -68.0 360.0 16.9 36.7 7.7