==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LUMINESCENT PROTEIN 05-MAR-04 1SL8 . COMPND 2 MOLECULE: AEQUORIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: AEQUOREA VICTORIA; . AUTHOR L.DENG,S.V.MARKOVA,E.S.VYSOTSKI,Z.J.LIU,J.LEE,J.ROSE,B.C.WAN . 181 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10575.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 126 69.6 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 . 6 3.3 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 53.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.8 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 0 0 0 0 0 0 1 1 1 1 2 0 0 1 0 0 1 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 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 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 11 A N > 0 0 96 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 55.5 2.2 7.0 57.4 2 12 A P H > + 0 0 99 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.802 360.0 52.0 -62.3 -32.8 0.8 7.3 61.0 3 13 A K H > S+ 0 0 147 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.956 113.1 42.4 -71.7 -47.6 3.1 10.2 62.0 4 14 A W H > S+ 0 0 2 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.931 116.7 49.4 -58.8 -45.9 2.2 12.4 59.0 5 15 A I H X S+ 0 0 57 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.913 110.9 50.4 -61.4 -40.8 -1.5 11.5 59.4 6 16 A G H X S+ 0 0 29 -4,-2.2 4,-2.5 -5,-0.3 5,-0.2 0.915 109.3 49.2 -62.2 -45.2 -1.3 12.2 63.1 7 17 A R H X S+ 0 0 63 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.958 114.6 47.7 -60.3 -46.9 0.2 15.7 62.6 8 18 A H H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.863 109.6 50.8 -65.3 -35.4 -2.5 16.4 60.1 9 19 A K H X S+ 0 0 90 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.933 111.4 48.4 -66.0 -41.3 -5.3 15.1 62.3 10 20 A H H X S+ 0 0 148 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.912 114.1 46.9 -64.7 -37.9 -4.1 17.4 65.2 11 21 A M H X S+ 0 0 28 -4,-2.5 4,-2.2 -5,-0.2 5,-0.2 0.910 109.1 53.0 -71.0 -39.5 -3.9 20.4 62.8 12 22 A F H X S+ 0 0 4 -4,-2.3 4,-1.5 1,-0.2 3,-0.2 0.965 112.3 46.7 -57.5 -50.2 -7.3 19.7 61.2 13 23 A N H < S+ 0 0 99 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.894 110.9 52.5 -56.7 -42.8 -8.7 19.7 64.8 14 24 A F H < S+ 0 0 55 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.857 116.0 38.3 -62.8 -39.3 -6.8 22.9 65.6 15 25 A L H < S+ 0 0 6 -4,-2.2 2,-1.9 -3,-0.2 16,-0.3 0.553 87.8 98.1 -90.1 -11.7 -8.2 24.8 62.6 16 26 A D >< - 0 0 5 -4,-1.5 3,-2.2 -5,-0.2 5,-0.1 -0.588 58.7-173.9 -76.8 79.1 -11.7 23.3 62.9 17 27 A V T 3 S+ 0 0 56 -2,-1.9 -1,-0.2 1,-0.3 6,-0.1 0.772 77.8 42.0 -53.8 -38.7 -12.9 26.4 64.7 18 28 A N T 3 S- 0 0 89 4,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.383 102.2-131.1 -94.3 2.6 -16.4 25.1 65.5 19 29 A H < + 0 0 154 -3,-2.2 -2,-0.1 -6,-0.2 4,-0.1 0.763 65.2 130.8 57.7 35.5 -15.2 21.6 66.4 20 30 A N S S- 0 0 75 2,-0.4 -1,-0.1 0, 0.0 3,-0.1 0.470 76.2-112.1 -99.4 -5.1 -17.7 19.7 64.2 21 31 A G S S+ 0 0 39 1,-0.3 50,-0.5 -5,-0.1 2,-0.3 0.561 90.8 91.5 87.6 7.3 -15.3 17.4 62.5 22 32 A R E -A 70 0A 106 48,-0.1 2,-0.4 -10,-0.1 -2,-0.4 -0.935 62.6-151.0-125.3 151.0 -15.7 19.1 59.1 23 33 A I E -A 69 0A 0 46,-2.9 46,-2.7 -2,-0.3 2,-0.3 -0.973 11.1-168.5-133.4 140.9 -13.5 22.0 57.9 24 34 A S E > -A 68 0A 13 -2,-0.4 4,-2.2 44,-0.2 41,-0.2 -0.828 37.4-115.7-114.4 163.9 -13.8 25.0 55.5 25 35 A L H > S+ 0 0 8 39,-1.7 4,-2.9 42,-0.5 5,-0.4 0.825 118.4 61.1 -62.1 -30.8 -11.2 27.4 54.1 26 36 A D H > S+ 0 0 71 38,-0.4 4,-2.3 41,-0.2 -1,-0.2 0.932 106.3 44.3 -60.8 -46.7 -13.0 30.0 56.1 27 37 A E H > S+ 0 0 19 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.963 115.9 47.1 -60.7 -49.7 -12.2 28.2 59.3 28 38 A M H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.917 117.7 39.5 -63.3 -47.6 -8.6 27.5 58.3 29 39 A V H X S+ 0 0 5 -4,-2.9 4,-2.3 2,-0.2 5,-0.3 0.878 114.3 55.3 -71.8 -37.8 -7.8 31.1 57.1 30 40 A Y H X S+ 0 0 147 -4,-2.3 4,-2.6 -5,-0.4 -2,-0.2 0.962 111.4 42.5 -56.2 -53.0 -9.7 32.6 60.0 31 41 A K H X S+ 0 0 51 -4,-2.8 4,-2.2 -16,-0.3 -2,-0.2 0.922 114.2 50.6 -64.8 -44.5 -7.8 30.8 62.7 32 42 A A H X S+ 0 0 14 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.904 113.6 45.5 -57.7 -42.4 -4.4 31.3 61.0 33 43 A S H X S+ 0 0 20 -4,-2.3 4,-2.6 2,-0.2 5,-0.3 0.933 109.8 55.3 -68.5 -43.0 -5.0 35.1 60.7 34 44 A D H X S+ 0 0 58 -4,-2.6 4,-2.6 -5,-0.3 5,-0.5 0.911 110.0 46.5 -55.8 -40.3 -6.3 35.3 64.2 35 45 A I H X>S+ 0 0 18 -4,-2.2 4,-2.1 3,-0.2 5,-1.5 0.919 112.1 47.7 -70.8 -46.2 -3.1 33.8 65.5 36 46 A V H <5S+ 0 0 5 -4,-2.1 6,-2.5 3,-0.2 4,-0.2 0.905 120.0 39.5 -63.8 -37.6 -0.7 36.0 63.5 37 47 A I H X5S+ 0 0 75 -4,-2.6 4,-0.6 4,-0.2 -2,-0.2 0.959 128.7 27.4 -74.3 -52.3 -2.6 39.2 64.5 38 48 A N H <5S+ 0 0 116 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.769 131.9 30.3 -92.4 -25.2 -3.4 38.4 68.1 39 49 A N T <5S+ 0 0 96 -4,-2.1 -3,-0.2 -5,-0.5 -1,-0.1 0.751 131.2 31.4 -95.7 -33.1 -0.6 36.0 69.3 40 50 A L T 4 - 0 0 68 -2,-0.1 4,-3.4 1,-0.1 5,-0.2 -0.338 32.8 -99.7 -66.3 160.1 1.0 44.6 61.5 44 54 A P H > S+ 0 0 118 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.837 127.3 49.0 -45.7 -43.4 -1.9 45.0 59.0 45 55 A E H > S+ 0 0 173 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.907 113.3 46.9 -65.1 -49.4 0.6 44.8 56.1 46 56 A Q H > S+ 0 0 32 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.924 112.5 49.9 -55.3 -48.3 2.2 41.7 57.6 47 57 A A H X S+ 0 0 10 -4,-3.4 4,-2.4 1,-0.2 -1,-0.2 0.848 109.9 49.6 -65.3 -36.8 -1.3 40.1 58.2 48 58 A K H X S+ 0 0 147 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.922 111.2 48.6 -68.9 -43.4 -2.5 40.8 54.6 49 59 A R H X S+ 0 0 128 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.901 115.5 45.9 -57.4 -44.5 0.7 39.2 53.1 50 60 A H H X S+ 0 0 3 -4,-2.4 4,-3.1 1,-0.2 5,-0.3 0.907 110.6 53.3 -68.4 -38.7 0.3 36.2 55.4 51 61 A K H X S+ 0 0 74 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.904 109.7 47.0 -62.1 -42.7 -3.4 36.0 54.6 52 62 A D H X S+ 0 0 83 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.921 116.7 44.1 -68.0 -45.4 -2.8 35.9 50.8 53 63 A A H X S+ 0 0 16 -4,-2.0 4,-2.0 2,-0.2 47,-0.3 0.878 113.8 48.1 -68.5 -41.6 -0.1 33.3 51.1 54 64 A V H X S+ 0 0 1 -4,-3.1 4,-3.0 1,-0.2 5,-0.4 0.916 110.0 54.2 -68.8 -36.6 -1.9 31.0 53.6 55 65 A E H X S+ 0 0 56 -4,-2.3 4,-1.8 -5,-0.3 -1,-0.2 0.861 111.3 44.6 -56.0 -41.8 -5.1 31.2 51.5 56 66 A A H X S+ 0 0 45 -4,-1.5 4,-1.4 2,-0.2 -1,-0.2 0.839 115.1 49.2 -74.7 -30.7 -3.0 30.0 48.4 57 67 A F H X S+ 0 0 0 -4,-2.0 4,-0.8 2,-0.2 3,-0.3 0.977 117.5 37.7 -72.8 -59.5 -1.3 27.3 50.5 58 68 A F H ><>S+ 0 0 5 -4,-3.0 5,-1.4 1,-0.2 3,-0.7 0.863 114.5 57.1 -60.8 -37.9 -4.5 25.8 52.1 59 69 A G H ><5S+ 0 0 28 -4,-1.8 3,-1.6 -5,-0.4 -1,-0.2 0.853 99.3 60.1 -58.1 -34.9 -6.3 26.4 48.8 60 70 A G H 3<5S+ 0 0 35 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.767 96.3 59.5 -63.0 -29.0 -3.7 24.2 47.1 61 71 A A T <<5S- 0 0 1 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.498 128.5-101.1 -79.3 -4.3 -4.7 21.4 49.4 62 72 A G T < 5S+ 0 0 38 -3,-1.6 2,-0.2 1,-0.3 -3,-0.2 0.547 74.3 142.3 104.3 7.9 -8.2 21.7 47.9 63 73 A M < - 0 0 5 -5,-1.4 2,-0.3 -39,-0.1 -1,-0.3 -0.597 28.8-166.9 -84.5 148.6 -10.0 23.7 50.5 64 74 A K > - 0 0 124 3,-0.3 -39,-1.7 -2,-0.2 3,-1.2 -0.950 27.1-102.0-137.0 152.7 -12.5 26.3 49.4 65 75 A Y T 3 S+ 0 0 99 -2,-0.3 3,-0.1 1,-0.2 -41,-0.0 -0.522 108.1 16.9 -70.2 135.1 -14.4 29.2 50.9 66 76 A G T 3 S+ 0 0 71 -2,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.416 105.9 101.2 85.9 -1.6 -18.1 28.3 51.6 67 77 A V < - 0 0 70 -3,-1.2 -42,-0.5 2,-0.0 2,-0.4 -0.958 61.7-144.7-123.0 133.6 -17.5 24.6 51.3 68 78 A E E -A 24 0A 97 -2,-0.4 2,-0.4 -44,-0.1 -44,-0.2 -0.818 17.0-158.0 -94.3 137.4 -17.1 22.1 54.2 69 79 A T E -A 23 0A 20 -46,-2.7 -46,-2.9 -2,-0.4 2,-0.2 -0.941 6.6-140.1-120.1 136.3 -14.7 19.3 53.7 70 80 A E E > -A 22 0A 82 -2,-0.4 4,-2.4 -48,-0.2 3,-0.5 -0.535 33.3 -98.5 -90.3 164.3 -14.7 16.0 55.5 71 81 A W H > S+ 0 0 50 -50,-0.5 4,-3.0 1,-0.2 5,-0.4 0.858 116.2 54.2 -50.4 -50.4 -11.5 14.3 56.7 72 82 A P H > S+ 0 0 75 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.916 116.1 39.3 -55.5 -42.3 -11.1 11.7 53.8 73 83 A E H > S+ 0 0 115 -3,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.857 114.1 55.3 -74.5 -39.8 -11.2 14.4 51.2 74 84 A Y H X S+ 0 0 0 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.949 112.1 42.0 -54.7 -54.4 -9.2 16.8 53.3 75 85 A I H X S+ 0 0 9 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.870 112.4 53.0 -72.4 -34.3 -6.3 14.4 53.8 76 86 A E H X S+ 0 0 69 -4,-2.0 4,-2.0 -5,-0.4 -1,-0.2 0.914 107.4 54.3 -62.6 -41.0 -6.4 13.2 50.1 77 87 A G H X S+ 0 0 13 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.884 109.3 47.4 -54.3 -44.1 -6.1 16.9 49.1 78 88 A W H X S+ 0 0 0 -4,-1.7 4,-2.9 1,-0.2 5,-0.2 0.890 108.3 55.0 -69.8 -40.9 -3.0 17.3 51.3 79 89 A K H X S+ 0 0 80 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.907 110.7 45.8 -53.4 -41.8 -1.5 14.1 49.9 80 90 A R H X S+ 0 0 167 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.905 114.1 47.0 -71.8 -43.6 -1.8 15.6 46.4 81 91 A L H X S+ 0 0 10 -4,-2.1 4,-3.1 2,-0.2 5,-0.3 0.930 111.6 51.1 -61.2 -47.1 -0.5 18.9 47.2 82 92 A A H X S+ 0 0 2 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.915 109.4 50.7 -59.4 -46.9 2.5 17.4 49.1 83 93 A S H X S+ 0 0 59 -4,-2.2 4,-1.3 -5,-0.2 -1,-0.2 0.946 114.8 42.7 -61.1 -42.2 3.3 15.2 46.1 84 94 A E H X S+ 0 0 81 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.891 115.6 48.2 -68.8 -42.7 3.3 18.2 43.6 85 95 A E H X S+ 0 0 0 -4,-3.1 4,-2.7 1,-0.2 5,-0.2 0.863 107.2 55.0 -70.4 -35.8 5.1 20.6 45.9 86 96 A L H X S+ 0 0 58 -4,-2.8 4,-2.2 -5,-0.3 -1,-0.2 0.853 107.0 52.5 -68.0 -28.6 7.9 18.1 46.8 87 97 A K H X S+ 0 0 110 -4,-1.3 4,-1.6 -5,-0.2 -2,-0.2 0.939 111.0 46.6 -64.2 -46.8 8.5 17.7 43.0 88 98 A R H <>S+ 0 0 74 -4,-1.9 5,-2.7 1,-0.2 3,-0.3 0.931 113.4 48.3 -60.5 -45.4 8.8 21.5 42.7 89 99 A Y H ><5S+ 0 0 83 -4,-2.7 3,-1.9 1,-0.2 -1,-0.2 0.890 106.9 56.4 -61.7 -38.7 11.1 21.6 45.7 90 100 A S H 3<5S+ 0 0 103 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.840 107.6 49.4 -63.0 -29.6 13.2 18.8 44.3 91 101 A K T 3<5S- 0 0 135 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.267 120.3-111.8 -92.7 10.2 13.7 20.9 41.1 92 102 A N T < 5S+ 0 0 156 -3,-1.9 -3,-0.2 1,-0.2 2,-0.2 0.805 71.2 142.9 63.8 33.8 14.7 23.9 43.3 93 103 A Q < - 0 0 106 -5,-2.7 -1,-0.2 -6,-0.2 2,-0.1 -0.648 57.9 -88.4-102.4 161.9 11.5 25.8 42.3 94 104 A I - 0 0 113 -2,-0.2 2,-0.3 4,-0.0 -1,-0.1 -0.393 44.9-163.0 -64.1 140.5 9.2 28.0 44.3 95 105 A T > - 0 0 5 -2,-0.1 4,-1.9 1,-0.1 5,-0.2 -0.854 31.7-117.2-121.0 161.3 6.4 26.4 46.3 96 106 A L H > S+ 0 0 46 -2,-0.3 4,-2.4 1,-0.2 -39,-0.2 0.894 117.8 52.3 -59.3 -39.3 3.2 27.5 47.9 97 107 A I H > S+ 0 0 1 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.866 106.4 52.4 -69.3 -32.1 4.5 26.5 51.2 98 108 A R H > S+ 0 0 68 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.912 109.9 49.2 -67.4 -41.5 7.7 28.5 50.7 99 109 A L H X S+ 0 0 85 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.893 114.1 46.1 -63.0 -44.7 5.6 31.6 49.9 100 110 A W H X S+ 0 0 15 -4,-2.4 4,-2.7 -47,-0.3 5,-0.2 0.957 111.8 50.8 -57.2 -48.9 3.6 31.0 53.0 101 111 A G H X S+ 0 0 4 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.825 106.9 55.4 -62.6 -32.9 6.7 30.4 55.1 102 112 A D H X S+ 0 0 41 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.922 110.0 44.4 -65.0 -45.8 8.2 33.6 53.8 103 113 A A H X S+ 0 0 2 -4,-1.8 4,-1.0 1,-0.2 -2,-0.2 0.918 116.5 47.1 -66.3 -42.9 5.2 35.7 55.0 104 114 A L H X S+ 0 0 4 -4,-2.7 4,-2.5 1,-0.2 3,-0.4 0.902 106.4 59.0 -59.6 -44.9 5.1 33.9 58.3 105 115 A F H X S+ 0 0 13 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.922 100.8 54.5 -53.9 -49.5 8.9 34.3 58.8 106 116 A D H < S+ 0 0 44 -4,-1.8 -1,-0.2 1,-0.2 6,-0.2 0.861 110.8 47.5 -53.2 -36.5 8.6 38.1 58.6 107 117 A I H < S+ 0 0 3 -4,-1.0 -2,-0.2 -3,-0.4 -1,-0.2 0.920 113.0 44.8 -74.7 -45.0 6.1 38.0 61.4 108 118 A I H < S+ 0 0 4 -4,-2.5 2,-2.4 1,-0.2 3,-0.2 0.801 95.0 81.8 -74.6 -22.5 7.9 35.6 63.8 109 119 A D >< + 0 0 5 -4,-2.4 3,-1.7 -5,-0.3 -1,-0.2 -0.457 59.1 169.2 -75.7 73.6 11.1 37.6 63.2 110 120 A K T 3 S+ 0 0 140 -2,-2.4 -1,-0.2 1,-0.3 -2,-0.1 0.860 71.9 49.2 -57.2 -40.2 10.2 40.2 65.7 111 121 A D T 3 S- 0 0 99 -3,-0.2 -1,-0.3 4,-0.2 -2,-0.1 0.357 101.2-133.3 -87.4 10.5 13.7 41.9 65.8 112 122 A Q < + 0 0 113 -3,-1.7 -2,-0.1 -6,-0.2 -1,-0.1 0.726 66.8 129.2 45.0 32.6 13.8 42.1 62.0 113 123 A N S S- 0 0 77 2,-0.3 -1,-0.1 0, 0.0 3,-0.1 0.315 79.5-112.4 -90.4 1.4 17.4 40.7 61.9 114 124 A G S S+ 0 0 41 1,-0.2 40,-0.3 -5,-0.2 2,-0.3 0.711 88.5 83.2 76.2 22.9 16.4 38.0 59.3 115 125 A A S S- 0 0 14 38,-0.1 2,-0.7 -10,-0.1 -2,-0.3 -0.986 77.1-118.4-152.3 151.3 16.9 35.0 61.6 116 126 A I B -B 152 0B 0 36,-2.6 36,-2.6 -2,-0.3 -7,-0.1 -0.847 26.5-155.8-100.3 118.0 14.8 33.4 64.3 117 127 A S > - 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