==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-AUG-07 2QUE . COMPND 2 MOLECULE: PHOSPHOLIPASE A2 VRV-PL-VIIIA; . SOURCE 2 ORGANISM_SCIENTIFIC: DABOIA RUSSELLII PULCHELLA; . AUTHOR S.KUMAR,N.SINGH,S.SHARMA,P.KAUR,T.P.SINGH . 121 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7448.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 80 66.1 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 8.3 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 . 7 5.8 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 . 43 35.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.7 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 1 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 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 4 0, 0.0 4,-2.0 0, 0.0 3,-0.9 0.000 360.0 360.0 360.0 160.4 11.0 13.5 5.4 2 2 A L H 3> + 0 0 87 58,-1.9 4,-2.6 1,-0.3 5,-0.3 0.783 360.0 64.3 -50.7 -28.7 9.8 17.1 5.7 3 3 A L H 3> S+ 0 0 112 57,-0.4 4,-1.3 2,-0.2 -1,-0.3 0.939 105.7 40.0 -62.3 -49.0 13.3 18.1 4.4 4 4 A E H <> S+ 0 0 26 -3,-0.9 4,-1.8 1,-0.2 -2,-0.2 0.877 116.6 52.8 -67.1 -37.4 12.8 16.4 1.0 5 5 A F H X S+ 0 0 19 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.927 107.7 46.7 -66.8 -48.7 9.2 17.6 0.8 6 6 A G H X S+ 0 0 19 -4,-2.6 4,-1.9 1,-0.2 11,-0.4 0.832 114.1 50.1 -63.9 -30.1 9.7 21.3 1.4 7 7 A K H X S+ 0 0 108 -4,-1.3 4,-2.2 -5,-0.3 -1,-0.2 0.853 109.4 50.9 -73.7 -36.3 12.6 21.3 -1.1 8 8 A M H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.909 111.4 48.3 -65.8 -44.2 10.3 19.5 -3.7 9 9 A I H X>S+ 0 0 3 -4,-2.4 4,-2.9 2,-0.2 5,-0.6 0.884 110.7 50.4 -64.3 -41.9 7.6 22.2 -3.1 10 10 A L H X5S+ 0 0 74 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.926 111.8 47.5 -63.7 -45.6 10.1 25.1 -3.5 11 11 A E H <5S+ 0 0 85 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.890 117.6 43.4 -61.9 -41.3 11.5 23.7 -6.7 12 12 A E H <5S+ 0 0 39 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.948 131.9 14.0 -70.8 -51.9 7.9 23.1 -8.1 13 13 A T H <5S- 0 0 20 -4,-2.9 -3,-0.2 2,-0.3 -2,-0.2 0.678 89.0-122.0-103.1 -23.4 6.2 26.3 -7.1 14 14 A G S <> - 0 0 106 -2,-0.3 4,-1.8 1,-0.1 5,-0.5 -0.709 19.5-126.3 -82.3 137.7 8.6 27.9 0.6 17 18 A A H >5S+ 0 0 25 -11,-0.4 4,-3.1 -2,-0.4 5,-0.2 0.880 91.7 80.2 -43.6 -50.4 6.6 25.1 2.4 18 19 A I H 45S- 0 0 124 1,-0.3 -1,-0.1 2,-0.2 -2,-0.1 -0.937 110.4 -2.2-107.5 125.5 6.7 27.4 5.5 19 20 A P H 45S+ 0 0 72 0, 0.0 4,-0.4 0, 0.0 -1,-0.3 -0.926 129.9 57.4-105.6 19.4 4.7 29.6 5.5 20 21 A S H <5S+ 0 0 21 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.861 126.6 17.1 -71.8 -35.1 2.9 29.2 2.2 21 22 A Y S < -AB 28 108A 0 4,-1.0 4,-1.9 84,-0.2 3,-0.4 -0.686 66.0 -49.0 -90.0 130.0 -3.0 26.8 4.6 25 26 A G T 4 S- 0 0 10 82,-3.8 6,-0.1 -2,-0.4 85,-0.1 -0.079 99.4 -42.8 50.7-142.1 -6.8 26.2 4.7 26 27 A a T 4 S+ 0 0 4 9,-0.1 7,-0.7 5,-0.1 6,-0.3 0.656 135.7 28.8 -95.9 -18.5 -8.0 23.2 6.7 27 28 A Y T 4 S+ 0 0 8 -3,-0.4 2,-1.3 4,-0.1 -2,-0.2 0.644 85.9 95.6-120.2 -17.3 -5.5 20.6 5.6 28 29 A b E < S-A 24 0A 6 -4,-1.9 -4,-1.0 2,-0.1 2,-0.4 -0.640 99.9 -10.2 -80.8 96.8 -2.1 22.1 4.8 29 30 A G E S-A 23 0A 45 -2,-1.3 -6,-0.2 2,-0.2 -7,-0.1 -0.975 136.2 -0.5 126.8-132.5 -0.2 21.7 8.0 30 31 A W S S+ 0 0 253 -8,-0.6 -1,-0.2 -2,-0.4 -7,-0.1 0.785 101.1 126.2 -66.1 -26.0 -1.5 20.6 11.5 31 32 A G + 0 0 24 -3,-0.1 -2,-0.2 -6,-0.1 -4,-0.1 0.134 20.4 149.9 -37.9 139.3 -4.9 20.4 9.7 32 33 A G + 0 0 59 -6,-0.3 2,-0.3 1,-0.1 -5,-0.1 0.208 51.1 56.7-160.7 21.3 -7.0 17.3 9.9 33 34 A K S S+ 0 0 80 -7,-0.7 85,-0.1 85,-0.1 -1,-0.1 -0.966 71.8 30.4-152.1 168.6 -10.7 18.1 9.8 34 35 A G S S- 0 0 0 83,-0.9 83,-0.2 -2,-0.3 85,-0.2 -0.265 88.6 -41.9 83.8-169.1 -13.4 19.8 7.8 35 36 A T - 0 0 76 81,-1.1 81,-0.2 83,-0.1 -9,-0.1 -0.884 64.7-106.7-101.0 122.4 -14.0 20.4 4.1 36 37 A P - 0 0 11 0, 0.0 6,-0.1 0, 0.0 -11,-0.1 -0.237 24.7-141.7 -48.3 133.2 -11.0 21.5 2.0 37 38 A K - 0 0 74 1,-0.1 2,-0.3 70,-0.1 -12,-0.1 0.858 69.1 -17.2 -70.4 -33.8 -11.4 25.2 1.3 38 39 A D S > S- 0 0 17 69,-0.1 4,-2.1 1,-0.0 3,-0.3 -0.911 83.1 -70.8-156.9 179.1 -10.0 25.0 -2.3 39 40 A A H > S+ 0 0 14 -2,-0.3 4,-1.6 1,-0.2 5,-0.1 0.879 127.1 49.9 -44.7 -50.8 -7.9 23.1 -4.8 40 41 A T H > S+ 0 0 0 1,-0.2 4,-1.2 59,-0.2 -1,-0.2 0.904 111.6 49.1 -60.1 -39.8 -4.6 23.7 -3.0 41 42 A D H > S+ 0 0 0 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.832 106.6 56.7 -69.0 -31.3 -6.2 22.6 0.2 42 43 A R H X S+ 0 0 136 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.818 101.2 57.5 -68.9 -30.7 -7.6 19.5 -1.6 43 44 A c H X S+ 0 0 2 -4,-1.6 4,-1.9 -5,-0.2 -1,-0.2 0.886 108.4 46.1 -63.8 -40.2 -4.0 18.6 -2.6 44 45 A b H X S+ 0 0 8 -4,-1.2 4,-2.5 2,-0.2 -2,-0.2 0.817 110.3 53.7 -72.2 -32.6 -3.1 18.6 1.2 45 46 A F H X S+ 0 0 24 -4,-1.7 4,-3.1 2,-0.2 -2,-0.2 0.943 112.3 43.1 -66.2 -49.8 -6.1 16.5 2.0 46 47 A V H X S+ 0 0 89 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.888 113.7 52.5 -64.1 -38.0 -5.2 13.9 -0.5 47 48 A H H X S+ 0 0 17 -4,-1.9 4,-2.2 2,-0.2 5,-0.3 0.931 109.9 49.4 -62.0 -45.5 -1.5 14.1 0.6 48 49 A D H >X S+ 0 0 55 -4,-2.5 4,-2.0 1,-0.2 3,-0.9 0.995 112.0 47.1 -54.8 -63.4 -2.8 13.6 4.1 49 50 A d H 3X S+ 0 0 14 -4,-3.1 4,-0.7 1,-0.3 -2,-0.2 0.836 108.7 56.2 -44.7 -42.9 -4.8 10.5 3.0 50 51 A e H >< S+ 0 0 35 -4,-3.0 3,-1.0 1,-0.3 -1,-0.3 0.895 107.7 46.3 -60.8 -42.6 -1.8 9.2 1.0 51 52 A Y H X< S+ 0 0 37 -4,-2.2 3,-2.0 -3,-0.9 -1,-0.3 0.841 103.6 69.7 -66.7 -29.1 0.3 9.2 4.2 52 53 A G H 3< S+ 0 0 56 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.731 87.8 60.9 -59.5 -25.9 -2.7 7.6 5.7 53 54 A N T << S+ 0 0 109 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.378 97.3 64.9 -82.5 3.4 -2.2 4.4 3.8 54 55 A L X + 0 0 10 -3,-2.0 3,-2.0 1,-0.1 -1,-0.2 -0.412 52.8 157.7-126.2 60.0 1.2 3.9 5.5 55 56 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.749 77.8 50.1 -53.6 -28.4 0.6 3.4 9.2 56 59 A D T 3 S+ 0 0 149 -3,-0.1 2,-0.3 2,-0.0 25,-0.1 0.143 99.4 80.3 -99.9 20.8 3.9 1.6 9.7 57 61 A f S < S- 0 0 11 -3,-2.0 -3,-0.1 -6,-0.2 25,-0.0 -0.826 70.5-139.2-119.1 162.0 6.0 4.3 8.0 58 67 A N >> + 0 0 107 -2,-0.3 4,-2.9 1,-0.1 3,-0.6 -0.735 19.9 179.0-126.3 82.2 7.2 7.6 9.4 59 68 A P T 34 S+ 0 0 17 0, 0.0 -1,-0.1 0, 0.0 -8,-0.0 0.770 76.9 57.3 -50.7 -38.3 6.8 10.3 6.6 60 69 A K T 34 S+ 0 0 145 -59,-0.2 -58,-1.9 1,-0.1 -57,-0.4 0.892 123.0 18.0 -64.7 -43.5 8.1 13.2 8.7 61 70 A S T <4 S+ 0 0 88 -3,-0.6 2,-0.5 -60,-0.2 -1,-0.1 0.690 96.4 97.6-106.1 -23.7 11.5 11.7 9.5 62 71 A D < - 0 0 39 -4,-2.9 2,-0.3 1,-0.0 -5,-0.0 -0.573 65.3-146.9 -72.2 120.4 12.2 8.9 7.0 63 72 A R - 0 0 155 -2,-0.5 2,-0.3 -60,-0.1 19,-0.1 -0.632 17.7-177.0 -89.8 145.1 14.4 10.3 4.3 64 73 A Y - 0 0 6 -2,-0.3 2,-0.4 -63,-0.1 13,-0.1 -0.831 21.3-122.4-131.0 169.2 14.2 9.3 0.6 65 74 A K + 0 0 151 11,-0.4 11,-2.3 -2,-0.3 2,-0.3 -0.887 30.1 169.9-115.1 149.0 16.2 10.2 -2.4 66 75 A Y E -C 75 0B 30 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.984 13.3-154.8-153.4 153.9 14.8 11.6 -5.7 67 76 A K E -C 74 0B 102 7,-2.1 7,-2.6 -2,-0.3 2,-0.5 -0.908 19.3-118.8-132.9 161.9 16.2 13.2 -8.8 68 77 A R E -C 73 0B 75 -2,-0.3 2,-0.6 5,-0.2 5,-0.2 -0.879 19.1-172.5-101.0 125.8 15.1 15.5 -11.6 69 78 A V E > S-C 72 0B 74 3,-2.6 3,-1.0 -2,-0.5 4,-0.0 -0.768 82.3 -40.4-117.8 79.6 15.0 14.1 -15.1 70 79 A N T 3 S- 0 0 173 -2,-0.6 2,-0.5 1,-0.3 3,-0.1 0.959 122.3 -42.0 63.4 53.8 14.3 17.2 -17.1 71 80 A G T 3 S+ 0 0 46 1,-0.2 -1,-0.3 0, 0.0 2,-0.1 -0.192 113.9 116.8 90.2 -43.8 11.8 18.6 -14.5 72 81 A A E < -C 69 0B 55 -3,-1.0 -3,-2.6 -2,-0.5 2,-0.4 -0.377 66.2-127.3 -63.5 131.8 10.1 15.3 -13.9 73 82 A I E -C 68 0B 4 -5,-0.2 2,-0.5 -2,-0.1 -5,-0.2 -0.669 24.7-169.3 -82.6 127.9 10.5 14.0 -10.4 74 83 A V E -C 67 0B 54 -7,-2.6 -7,-2.1 -2,-0.4 2,-0.3 -0.931 15.3-140.9-125.2 109.0 11.8 10.4 -10.1 75 84 A g E -C 66 0B 25 -2,-0.5 -9,-0.2 -9,-0.2 2,-0.2 -0.505 22.3-137.8 -67.5 124.6 11.7 8.7 -6.8 76 85 A E - 0 0 80 -11,-2.3 -11,-0.4 -2,-0.3 2,-0.1 -0.558 28.9 -86.0 -87.2 152.3 14.9 6.7 -6.3 77 86 A K + 0 0 201 -2,-0.2 2,-0.2 -13,-0.1 -1,-0.1 -0.323 65.9 132.8 -60.4 124.1 15.0 3.2 -4.8 78 88 A G - 0 0 33 1,-0.4 -14,-0.1 -2,-0.1 -1,-0.1 -0.460 63.2 -35.0-141.6-145.8 15.1 3.0 -1.1 79 89 A T > - 0 0 74 -2,-0.2 4,-1.8 1,-0.1 -1,-0.4 -0.292 68.6 -98.3 -76.3 172.9 13.2 0.9 1.5 80 90 A S H > S+ 0 0 76 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.893 124.5 48.6 -59.5 -43.0 9.5 0.1 0.8 81 91 A f H > S+ 0 0 27 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.884 109.0 53.2 -65.0 -40.7 8.3 3.0 3.0 82 92 A E H > S+ 0 0 38 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.855 107.2 51.3 -64.6 -37.1 10.6 5.5 1.4 83 93 A N H X S+ 0 0 56 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.945 114.1 43.5 -65.9 -46.4 9.4 4.7 -2.1 84 94 A R H X S+ 0 0 118 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.832 111.6 52.7 -69.0 -34.5 5.8 5.2 -1.1 85 95 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.952 109.4 50.9 -65.2 -47.7 6.4 8.3 0.9 86 96 A g H X S+ 0 0 1 -4,-2.1 4,-3.1 1,-0.2 5,-0.2 0.908 107.5 51.8 -55.9 -45.8 8.2 9.8 -2.0 87 97 A E H X S+ 0 0 102 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.890 109.8 50.9 -59.5 -39.0 5.3 9.0 -4.4 88 98 A e H X S+ 0 0 4 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.912 114.8 41.9 -63.1 -44.5 2.9 10.7 -1.9 89 99 A D H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.846 110.9 55.7 -71.7 -37.8 5.1 13.8 -1.8 90 100 A K H X S+ 0 0 54 -4,-3.1 4,-2.0 -5,-0.2 5,-0.2 0.930 108.5 49.1 -60.1 -45.6 5.7 13.8 -5.5 91 101 A A H X S+ 0 0 58 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.894 110.5 50.0 -61.3 -43.3 2.0 13.9 -6.1 92 102 A A H X S+ 0 0 4 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.901 109.1 51.5 -63.8 -42.2 1.3 16.7 -3.7 93 103 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.926 113.0 44.9 -61.0 -46.5 4.1 18.9 -5.3 94 104 A I H X S+ 0 0 72 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.910 112.2 52.0 -64.4 -42.9 2.7 18.4 -8.7 95 105 A c H X S+ 0 0 36 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.897 109.1 51.4 -59.8 -39.8 -0.8 19.1 -7.4 96 106 A F H < S+ 0 0 5 -4,-2.6 3,-0.4 1,-0.2 -2,-0.2 0.911 111.2 46.9 -62.7 -44.2 0.5 22.3 -5.8 97 107 A R H >< S+ 0 0 132 -4,-2.2 3,-1.3 1,-0.2 4,-0.3 0.904 108.4 55.1 -64.3 -43.0 2.0 23.4 -9.1 98 108 A Q H 3< S+ 0 0 146 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.720 115.3 39.6 -65.6 -20.2 -1.1 22.6 -11.1 99 109 A N T >< S+ 0 0 37 -4,-1.0 3,-1.4 -3,-0.4 4,-0.4 0.173 76.5 111.1-116.3 17.8 -3.2 24.8 -8.8 100 110 A L G X S+ 0 0 43 -3,-1.3 3,-1.2 1,-0.3 -1,-0.1 0.828 70.8 68.0 -58.9 -32.3 -0.8 27.7 -8.2 101 111 A N G 3 S+ 0 0 133 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.773 105.9 39.0 -60.8 -27.3 -3.2 29.9 -10.3 102 112 A T G < S+ 0 0 62 -3,-1.4 -1,-0.3 2,-0.1 2,-0.2 0.338 78.6 133.2-106.2 6.8 -5.9 29.7 -7.5 103 113 A Y < - 0 0 30 -3,-1.2 2,-0.5 -4,-0.4 -3,-0.0 -0.416 40.9-162.0 -59.2 122.1 -3.6 29.9 -4.5 104 114 A S > - 0 0 40 -2,-0.2 3,-1.5 1,-0.1 -2,-0.1 -0.940 27.4-152.4-116.5 129.2 -5.3 32.5 -2.2 105 115 A K G > S+ 0 0 167 -2,-0.5 3,-1.3 1,-0.3 -1,-0.1 0.629 93.7 79.1 -68.2 -10.3 -3.7 34.4 0.7 106 116 A K G 3 S+ 0 0 153 1,-0.3 -1,-0.3 4,-0.0 -3,-0.0 0.806 91.5 49.8 -64.3 -31.8 -7.2 34.5 2.0 107 117 A Y G X S+ 0 0 38 -3,-1.5 -82,-3.8 3,-0.1 3,-0.6 0.098 86.5 111.7 -97.2 20.9 -6.8 30.9 3.2 108 118 A M B < S+B 24 0A 61 -3,-1.3 -84,-0.2 1,-0.2 -88,-0.1 -0.792 87.2 7.4 -96.0 137.6 -3.4 31.5 5.0 109 119 A L T 3 S- 0 0 147 -86,-1.5 -1,-0.2 -2,-0.4 -85,-0.2 0.864 94.8-169.4 58.6 34.3 -3.3 31.2 8.8 110 120 A Y < - 0 0 45 -87,-1.1 -1,-0.2 -3,-0.6 2,-0.1 -0.324 23.5-105.2 -60.9 132.2 -6.9 30.0 8.4 111 121 A P > - 0 0 55 0, 0.0 3,-1.7 0, 0.0 4,-0.2 -0.339 17.5-135.8 -63.1 133.4 -8.9 29.7 11.7 112 122 A D G > S+ 0 0 115 1,-0.3 3,-1.6 2,-0.2 -2,-0.1 0.830 100.7 63.1 -56.8 -36.6 -9.5 26.2 13.1 113 124 A F G 3 S+ 0 0 133 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.546 94.8 61.1 -70.6 -7.2 -13.2 26.8 13.8 114 125 A L G < S+ 0 0 67 -3,-1.7 2,-1.4 1,-0.1 -1,-0.3 0.344 75.8 98.4 -98.7 3.3 -14.0 27.4 10.1 115 126 A a < + 0 0 9 -3,-1.6 2,-0.3 -4,-0.2 -81,-0.2 -0.763 60.5 166.2 -93.9 92.8 -12.9 23.9 9.2 116 127 A K + 0 0 160 -2,-1.4 -81,-1.1 -81,-0.2 2,-0.2 -0.845 26.6 21.4-117.0 147.2 -16.4 22.4 9.2 117 128 A G S S- 0 0 47 -2,-0.3 -83,-0.9 -83,-0.2 2,-0.3 -0.550 74.3 -86.1 101.5-167.9 -17.9 19.2 7.9 118 129 A E + 0 0 133 -2,-0.2 2,-0.3 -85,-0.1 -83,-0.1 -0.999 27.7 179.5-151.3 147.8 -16.4 15.8 7.0 119 130 A L - 0 0 82 -2,-0.3 2,-0.3 -85,-0.2 -85,-0.0 -0.992 17.3-145.1-146.5 134.0 -14.7 13.9 4.3 120 131 A K 0 0 184 -2,-0.3 -71,-0.0 1,-0.1 -2,-0.0 -0.686 360.0 360.0 -98.4 153.1 -13.3 10.4 4.2 121 133 A d 0 0 142 -2,-0.3 -1,-0.1 -72,-0.1 -75,-0.1 -0.480 360.0 360.0 -73.9 360.0 -10.2 9.3 2.3