==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LUMINESCENT PROTEIN 05-MAR-04 1SL9 . COMPND 2 MOLECULE: OBELIN; . SOURCE 2 ORGANISM_SCIENTIFIC: OBELIA LONGISSIMA; . AUTHOR L.DENG,S.MARKOVA,E.VYSOTSKI,Z.-J.LIU,J.LEE,J.ROSE,B.-C.WANG, . 186 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9084.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 133 71.5 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 . 5 2.7 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 0.5 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 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 49.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 5.9 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 2 1 2 0 1 0 1 0 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 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 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 5 A Y 0 0 122 0, 0.0 2,-0.6 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 137.1 3.5 9.0 55.7 2 6 A A - 0 0 93 1,-0.0 175,-0.1 0, 0.0 3,-0.1 -0.793 360.0-115.4 -79.4 118.1 2.7 5.3 55.6 3 7 A V - 0 0 19 -2,-0.6 2,-0.5 1,-0.1 163,-0.1 -0.261 31.3-109.5 -51.9 137.4 2.2 4.3 52.0 4 8 A K - 0 0 57 1,-0.2 171,-0.2 2,-0.0 169,-0.1 -0.659 38.2-179.6 -68.5 119.0 -1.4 3.2 51.4 5 9 A L + 0 0 95 -2,-0.5 2,-0.2 2,-0.1 -1,-0.2 0.692 48.2 96.7 -97.9 -23.5 -1.2 -0.6 50.8 6 10 A K S S- 0 0 167 1,-0.1 2,-0.1 167,-0.1 -2,-0.0 -0.479 73.5-126.2 -70.9 134.8 -4.8 -1.4 50.2 7 11 A T - 0 0 48 -2,-0.2 166,-0.2 1,-0.1 3,-0.1 -0.375 18.5-167.7 -77.2 162.3 -5.8 -1.6 46.6 8 12 A D > + 0 0 56 164,-0.5 3,-1.6 3,-0.1 6,-0.3 -0.402 25.1 154.3-145.3 56.8 -8.7 0.4 45.1 9 13 A F T 3 S+ 0 0 30 1,-0.3 -1,-0.1 5,-0.1 80,-0.1 0.646 70.4 50.8 -76.3 -17.1 -9.1 -1.2 41.7 10 14 A D T 3 S+ 0 0 135 -3,-0.1 -1,-0.3 4,-0.1 3,-0.0 0.406 79.8 115.0 -93.4 -1.9 -12.8 -0.4 41.2 11 15 A N X> - 0 0 41 -3,-1.6 4,-2.0 1,-0.2 3,-1.3 -0.559 68.7-137.5 -68.4 126.5 -12.3 3.3 42.0 12 16 A P H 3> S+ 0 0 98 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.814 102.7 59.8 -52.1 -32.1 -13.0 5.2 38.8 13 17 A R H 3> S+ 0 0 103 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.863 105.6 47.1 -63.3 -35.9 -10.0 7.4 39.5 14 18 A W H <> S+ 0 0 0 -3,-1.3 4,-1.9 -6,-0.3 5,-0.2 0.911 113.5 48.2 -74.7 -40.1 -7.7 4.4 39.4 15 19 A I H X S+ 0 0 58 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.940 112.4 49.2 -57.1 -47.8 -9.3 3.2 36.2 16 20 A K H X S+ 0 0 133 -4,-2.9 4,-2.9 -5,-0.2 5,-0.2 0.866 105.6 57.1 -65.2 -38.0 -9.0 6.7 34.7 17 21 A R H X S+ 0 0 0 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.946 114.1 38.4 -56.0 -50.6 -5.3 7.0 35.6 18 22 A H H X S+ 0 0 0 -4,-1.9 4,-3.2 2,-0.2 -2,-0.2 0.821 113.2 56.3 -73.4 -30.3 -4.5 3.8 33.7 19 23 A K H X S+ 0 0 81 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.920 106.4 51.1 -63.6 -42.4 -6.9 4.7 30.9 20 24 A H H X S+ 0 0 69 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.932 113.6 44.9 -55.2 -47.1 -5.1 7.9 30.5 21 25 A M H X S+ 0 0 22 -4,-1.6 4,-2.2 -5,-0.2 -2,-0.2 0.926 112.5 50.6 -66.7 -42.8 -1.8 6.0 30.3 22 26 A F H X S+ 0 0 3 -4,-3.2 4,-2.0 1,-0.2 -1,-0.2 0.920 111.2 47.7 -57.9 -50.7 -3.1 3.4 28.0 23 27 A D H < S+ 0 0 73 -4,-2.9 -1,-0.2 1,-0.2 6,-0.2 0.863 109.5 54.5 -65.9 -31.9 -4.5 6.0 25.6 24 28 A F H < S+ 0 0 51 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.880 111.4 44.9 -62.7 -39.2 -1.1 7.8 25.7 25 29 A L H < S+ 0 0 24 -4,-2.2 2,-2.0 1,-0.2 -2,-0.2 0.763 96.9 76.9 -73.1 -27.5 0.6 4.6 24.7 26 30 A D >< + 0 0 15 -4,-2.0 3,-1.7 1,-0.2 -1,-0.2 -0.528 60.3 164.9 -81.8 70.1 -2.0 3.9 22.0 27 31 A I T 3 S+ 0 0 149 -2,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.837 70.9 49.4 -64.2 -33.3 -0.4 6.5 19.7 28 32 A N T 3 S- 0 0 100 -3,-0.2 -1,-0.3 4,-0.2 -2,-0.1 0.348 105.2-126.8 -89.8 5.3 -2.2 5.3 16.6 29 33 A G S < S+ 0 0 58 -3,-1.7 -2,-0.1 -6,-0.2 -3,-0.0 0.799 70.1 126.0 65.0 29.7 -5.6 5.2 18.3 30 34 A N S S- 0 0 75 2,-0.3 -1,-0.1 0, 0.0 3,-0.1 0.326 77.1-114.4-107.6 11.7 -6.5 1.6 17.5 31 35 A G S S+ 0 0 32 -5,-0.2 50,-0.5 1,-0.1 2,-0.3 0.550 83.6 85.5 78.8 6.3 -7.2 0.5 21.0 32 36 A K - 0 0 70 48,-0.2 2,-0.3 49,-0.1 -2,-0.3 -0.993 49.1-171.9-144.0 147.0 -4.4 -1.9 21.4 33 37 A I B -A 79 0A 0 46,-2.1 46,-2.8 -2,-0.3 2,-0.3 -0.935 9.2-150.1-135.4 160.0 -0.7 -1.8 22.4 34 38 A T > - 0 0 14 -2,-0.3 4,-1.8 44,-0.2 3,-0.2 -0.897 29.1-118.1-127.7 157.9 2.1 -4.3 22.4 35 39 A L H > S+ 0 0 0 39,-1.3 4,-3.1 42,-0.4 5,-0.3 0.871 114.1 64.0 -59.6 -32.8 5.2 -4.9 24.4 36 40 A D H > S+ 0 0 72 38,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.925 104.2 45.2 -56.2 -46.3 7.1 -4.3 21.2 37 41 A E H > S+ 0 0 73 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.876 112.8 50.2 -66.1 -39.0 5.9 -0.7 21.2 38 42 A I H X S+ 0 0 10 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.921 113.1 45.8 -66.7 -43.0 6.6 -0.2 24.8 39 43 A V H X S+ 0 0 12 -4,-3.1 4,-3.0 2,-0.2 5,-0.5 0.890 111.0 52.8 -71.7 -34.8 10.1 -1.5 24.6 40 44 A S H X>S+ 0 0 51 -4,-2.4 4,-1.7 -5,-0.3 5,-1.3 0.936 109.2 49.4 -64.6 -41.5 10.8 0.5 21.5 41 45 A K H X>S+ 0 0 55 -4,-2.2 5,-2.9 1,-0.2 4,-0.5 0.934 115.5 45.5 -59.6 -45.1 9.6 3.6 23.3 42 46 A A H <>S+ 0 0 5 -4,-2.3 5,-2.3 3,-0.2 -2,-0.2 0.929 128.4 21.1 -60.1 -52.5 11.9 2.7 26.2 43 47 A S H <>S+ 0 0 12 -4,-3.0 5,-0.6 3,-0.2 -3,-0.2 0.901 128.1 38.0 -92.6 -49.6 15.0 1.8 24.2 44 48 A D H <5S+ 0 0 112 -4,-1.7 -3,-0.2 -5,-0.5 -2,-0.1 0.780 131.6 22.1 -79.6 -26.7 14.9 3.4 20.8 45 49 A D T X4 - 0 0 65 1,-0.1 4,-2.7 4,-0.0 5,-0.2 -0.292 32.9-104.1 -67.3 161.4 25.1 3.8 27.5 54 58 A P H > S+ 0 0 92 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.930 124.3 48.0 -53.1 -43.9 24.5 0.5 25.8 55 59 A E H > S+ 0 0 124 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.870 111.0 49.7 -65.8 -39.7 24.6 -1.2 29.1 56 60 A Q H > S+ 0 0 35 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.851 110.4 51.2 -67.3 -36.7 22.2 1.2 30.7 57 61 A T H X S+ 0 0 27 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.907 111.5 47.4 -63.7 -42.5 19.8 0.9 27.8 58 62 A K H X S+ 0 0 114 -4,-2.2 4,-2.6 -5,-0.2 5,-0.2 0.929 112.5 48.4 -65.6 -46.0 19.9 -2.9 28.1 59 63 A R H X S+ 0 0 98 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.939 112.6 48.8 -60.8 -45.3 19.4 -2.8 31.8 60 64 A H H X S+ 0 0 2 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.928 110.2 52.7 -60.8 -40.7 16.5 -0.4 31.4 61 65 A Q H X S+ 0 0 60 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.936 106.9 50.8 -60.2 -46.2 15.0 -2.6 28.7 62 66 A V H X S+ 0 0 87 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.913 112.1 48.5 -57.9 -39.5 15.1 -5.7 30.9 63 67 A C H X S+ 0 0 16 -4,-1.9 4,-2.5 -5,-0.2 -1,-0.2 0.901 112.1 47.2 -69.5 -41.5 13.3 -3.7 33.6 64 68 A V H X S+ 0 0 2 -4,-2.6 4,-2.7 2,-0.2 5,-0.4 0.920 112.1 51.6 -65.3 -44.5 10.6 -2.4 31.2 65 69 A E H X S+ 0 0 33 -4,-2.9 4,-2.2 -5,-0.3 5,-0.2 0.938 113.0 43.9 -55.6 -48.2 10.2 -5.9 29.9 66 70 A A H X S+ 0 0 38 -4,-2.4 4,-1.6 -5,-0.2 -2,-0.2 0.917 114.1 51.2 -66.6 -40.1 9.7 -7.4 33.3 67 71 A F H < S+ 0 0 2 -4,-2.5 4,-0.5 2,-0.2 -2,-0.2 0.957 115.8 38.4 -61.4 -52.5 7.4 -4.5 34.4 68 72 A F H ><>S+ 0 0 17 -4,-2.7 5,-2.5 1,-0.3 3,-0.9 0.826 111.0 58.0 -76.3 -29.3 5.1 -4.7 31.5 69 73 A R H ><5S+ 0 0 107 -4,-2.2 3,-2.1 -5,-0.4 -1,-0.3 0.883 99.7 62.6 -58.8 -33.6 5.1 -8.5 31.3 70 74 A G T 3<5S+ 0 0 29 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.756 102.8 48.2 -64.6 -23.2 3.9 -8.2 34.9 71 75 A C T < 5S- 0 0 1 -3,-0.9 16,-0.3 -4,-0.5 17,-0.3 0.110 131.0 -94.4-102.7 19.8 0.8 -6.5 33.6 72 76 A G T < 5S+ 0 0 27 -3,-2.1 -3,-0.2 1,-0.3 -2,-0.1 0.526 77.9 140.8 91.7 2.1 0.3 -9.1 31.0 73 77 A M < + 0 0 4 -5,-2.5 2,-0.3 -6,-0.1 -1,-0.3 -0.429 20.6 170.2 -76.7 155.9 2.1 -7.6 28.0 74 78 A E > - 0 0 70 3,-0.4 3,-2.0 -2,-0.1 -39,-1.3 -0.977 43.1 -80.8-160.1 154.9 4.1 -9.7 25.7 75 79 A Y T 3 S+ 0 0 74 -2,-0.3 3,-0.1 1,-0.3 -41,-0.0 -0.373 117.8 10.1 -61.4 136.2 5.9 -9.3 22.3 76 80 A G T 3 S+ 0 0 62 1,-0.2 2,-0.6 -2,-0.1 -1,-0.3 0.406 98.5 123.4 76.3 -0.7 3.4 -9.7 19.5 77 81 A K < - 0 0 75 -3,-2.0 2,-0.8 2,-0.0 -3,-0.4 -0.823 52.6-150.8-100.2 118.3 0.5 -9.6 22.0 78 82 A E - 0 0 114 -2,-0.6 2,-0.5 -44,-0.1 -44,-0.2 -0.790 19.1-168.7 -92.7 108.1 -2.0 -6.9 21.1 79 83 A I B -A 33 0A 6 -46,-2.8 -46,-2.1 -2,-0.8 2,-0.2 -0.891 9.4-155.1-109.2 132.8 -3.7 -5.8 24.4 80 84 A A > - 0 0 41 -2,-0.5 4,-2.4 -48,-0.2 3,-0.3 -0.482 38.2 -93.2 -97.0 169.5 -6.7 -3.6 24.8 81 85 A F H > S+ 0 0 26 -50,-0.5 4,-3.1 1,-0.2 5,-0.3 0.860 117.5 53.9 -60.4 -46.1 -7.4 -1.6 27.8 82 86 A P H > S+ 0 0 91 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.941 115.0 41.8 -58.2 -41.3 -9.7 -4.0 29.8 83 87 A Q H > S+ 0 0 93 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.871 113.5 54.3 -68.2 -38.5 -7.1 -6.7 29.7 84 88 A F H X S+ 0 0 2 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.930 109.5 46.9 -58.2 -46.0 -4.3 -4.2 30.3 85 89 A L H X S+ 0 0 13 -4,-3.1 4,-1.9 1,-0.2 -2,-0.2 0.912 108.8 54.2 -66.4 -40.0 -6.1 -3.0 33.4 86 90 A D H X S+ 0 0 97 -4,-2.3 4,-1.7 -5,-0.3 -1,-0.2 0.901 107.6 52.7 -56.9 -39.8 -6.6 -6.6 34.6 87 91 A G H X S+ 0 0 9 -4,-2.2 4,-3.0 -16,-0.3 -2,-0.2 0.894 105.0 53.8 -60.1 -40.5 -2.9 -7.0 34.2 88 92 A W H X S+ 0 0 12 -4,-1.9 4,-3.1 -17,-0.3 -1,-0.2 0.871 104.0 55.6 -63.6 -35.7 -2.3 -3.9 36.3 89 93 A K H X S+ 0 0 52 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.912 111.7 44.1 -62.7 -43.5 -4.4 -5.5 39.1 90 94 A Q H X S+ 0 0 130 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.926 114.4 48.9 -66.6 -43.4 -2.1 -8.5 39.0 91 95 A L H X S+ 0 0 2 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.946 111.2 49.5 -59.9 -49.5 1.0 -6.5 38.8 92 96 A A H X S+ 0 0 0 -4,-3.1 4,-2.6 1,-0.2 -2,-0.2 0.925 111.8 48.8 -57.9 -44.3 -0.1 -4.3 41.7 93 97 A T H X S+ 0 0 55 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.922 113.8 46.1 -60.0 -44.8 -0.9 -7.4 43.8 94 98 A S H X S+ 0 0 52 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.933 112.7 50.0 -66.2 -44.1 2.4 -9.0 43.1 95 99 A E H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.869 108.4 52.4 -61.0 -41.2 4.3 -5.8 43.8 96 100 A L H X S+ 0 0 26 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.872 107.2 52.7 -66.4 -32.5 2.6 -5.3 47.1 97 101 A K H X S+ 0 0 147 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.914 110.9 47.3 -67.3 -40.0 3.5 -8.8 48.1 98 102 A K H <>S+ 0 0 40 -4,-2.0 5,-2.5 2,-0.2 3,-0.5 0.947 110.2 52.4 -63.5 -44.9 7.1 -8.1 47.3 99 103 A W H ><5S+ 0 0 85 -4,-2.8 3,-1.2 1,-0.2 -2,-0.2 0.908 107.9 51.4 -54.8 -42.5 6.9 -4.8 49.2 100 104 A A H 3<5S+ 0 0 87 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.808 111.7 47.2 -62.6 -32.9 5.6 -6.7 52.2 101 105 A R T 3<5S- 0 0 194 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 0.308 114.2-117.8 -86.5 -4.5 8.5 -9.1 52.0 102 106 A N T < 5 + 0 0 153 -3,-1.2 -3,-0.2 -4,-0.4 -2,-0.1 0.880 68.0 142.5 59.4 36.5 11.0 -6.2 51.6 103 107 A E < - 0 0 82 -5,-2.5 -1,-0.3 -6,-0.2 -2,-0.1 -0.918 62.3 -98.1-101.1 132.6 11.9 -7.5 48.1 104 108 A P - 0 0 76 0, 0.0 2,-0.1 0, 0.0 -5,-0.1 -0.203 40.9-133.4 -55.0 134.8 12.6 -4.9 45.5 105 109 A T > - 0 0 1 1,-0.1 4,-2.4 -7,-0.1 5,-0.2 -0.413 18.0-113.1 -83.4 165.3 9.6 -4.3 43.3 106 110 A L H > S+ 0 0 23 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.875 119.4 54.3 -64.8 -32.7 9.6 -4.1 39.5 107 111 A I H > S+ 0 0 3 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.867 108.8 48.9 -71.1 -35.2 8.7 -0.4 39.8 108 112 A R H > S+ 0 0 64 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.928 111.3 49.1 -63.7 -46.6 11.7 0.2 42.0 109 113 A E H X S+ 0 0 77 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.913 110.4 50.6 -64.5 -39.9 14.0 -1.7 39.6 110 114 A W H X S+ 0 0 47 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.950 110.6 50.3 -57.7 -47.5 12.7 0.3 36.7 111 115 A G H X S+ 0 0 11 -4,-2.2 4,-3.3 1,-0.2 5,-0.3 0.914 106.7 54.5 -56.6 -43.6 13.3 3.4 38.8 112 116 A D H X S+ 0 0 40 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.920 109.9 47.6 -55.8 -42.3 16.9 2.2 39.5 113 117 A A H X S+ 0 0 1 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.879 114.5 45.2 -70.0 -37.1 17.5 1.9 35.8 114 118 A V H X S+ 0 0 14 -4,-2.3 4,-1.5 2,-0.2 3,-0.2 0.933 113.8 48.8 -68.6 -46.1 16.1 5.3 35.0 115 119 A F H < S+ 0 0 15 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.870 106.3 57.3 -62.9 -36.6 17.9 7.0 37.8 116 120 A D H < S+ 0 0 86 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.886 101.0 56.7 -64.8 -37.0 21.1 5.4 36.8 117 121 A I H < 0 0 20 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.919 360.0 360.0 -59.9 -36.7 20.8 6.9 33.3 118 122 A F < 0 0 58 -4,-1.5 -2,-0.2 -66,-0.0 -1,-0.2 0.969 360.0 360.0 -75.2 360.0 20.6 10.3 35.0 119 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 120 128 A G 0 0 80 0, 0.0 40,-2.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 19.0 20.1 7.3 43.2 121 129 A T E -B 159 0B 56 38,-0.2 2,-0.4 -6,-0.2 38,-0.2 -0.911 360.0-161.2-126.5 148.0 18.9 10.9 42.9 122 130 A I E -B 158 0B 1 36,-2.6 36,-2.7 -2,-0.3 2,-0.2 -0.965 18.1-128.6-122.6 148.4 17.6 13.0 40.0 123 131 A T > - 0 0 40 -2,-0.4 4,-2.7 34,-0.2 5,-0.2 -0.475 27.1-108.9 -88.8 162.8 17.3 16.7 39.7 124 132 A L H > S+ 0 0 46 1,-0.2 4,-2.9 32,-0.2 5,-0.2 0.925 121.7 53.0 -55.8 -43.0 14.3 18.7 38.7 125 133 A D H > S+ 0 0 117 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.912 109.3 48.6 -64.3 -37.7 15.9 19.6 35.4 126 134 A E H > S+ 0 0 55 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.944 111.9 49.2 -64.0 -43.2 16.5 15.8 34.7 127 135 A W H X S+ 0 0 10 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.914 108.4 53.4 -64.2 -41.2 12.9 15.1 35.6 128 136 A K H X S+ 0 0 27 -4,-2.9 4,-1.8 -5,-0.2 -1,-0.2 0.923 110.2 48.3 -59.1 -42.7 11.7 17.9 33.3 129 137 A A H X S+ 0 0 39 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.943 111.1 50.1 -61.3 -44.3 13.7 16.3 30.5 130 138 A Y H X>S+ 0 0 23 -4,-2.6 4,-2.8 1,-0.2 5,-0.5 0.916 107.1 55.5 -58.6 -43.0 12.3 12.8 31.3 131 139 A G H X5S+ 0 0 0 -4,-2.7 6,-1.6 1,-0.2 4,-0.7 0.893 114.2 39.0 -61.2 -39.5 8.8 14.3 31.3 132 140 A K H <5S+ 0 0 110 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.894 118.5 46.6 -72.6 -44.7 9.3 15.6 27.7 133 141 A I H <5S+ 0 0 37 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.949 120.9 36.0 -72.9 -43.5 11.2 12.7 26.4 134 142 A S H <5S- 0 0 4 -4,-2.8 -1,-0.2 -5,-0.3 -3,-0.2 0.758 102.4-137.7 -72.1 -26.3 8.9 10.0 27.7 135 143 A G S < - 0 0 40 1,-0.2 4,-1.6 -8,-0.1 3,-0.4 -0.715 67.9-151.8 -81.3 123.1 4.8 20.5 31.0 140 148 A Q H > S+ 0 0 100 -2,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.835 96.2 61.3 -63.0 -29.3 7.6 21.7 33.0 141 149 A E H > S+ 0 0 136 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.858 102.5 53.1 -62.0 -35.6 5.1 23.0 35.6 142 150 A D H > S+ 0 0 21 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.876 107.9 49.3 -66.3 -39.3 3.9 19.5 36.1 143 151 A C H X S+ 0 0 0 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.917 108.5 52.6 -68.6 -36.5 7.4 18.4 36.7 144 152 A E H X S+ 0 0 56 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.898 106.4 55.6 -61.3 -38.6 7.8 21.2 39.2 145 153 A A H X S+ 0 0 14 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.914 102.4 55.6 -62.2 -42.1 4.6 19.9 40.8 146 154 A T H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.931 109.8 45.4 -53.6 -47.9 6.2 16.4 41.2 147 155 A F H < S+ 0 0 10 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.884 113.0 49.7 -68.3 -38.6 9.1 17.9 43.1 148 156 A R H < S+ 0 0 180 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.914 113.6 48.7 -58.9 -40.9 6.8 20.1 45.3 149 157 A H H < S+ 0 0 57 -4,-2.7 -2,-0.2 31,-0.2 -1,-0.2 0.853 102.8 68.6 -69.3 -41.9 4.8 17.0 46.0 150 158 A C S < S- 0 0 9 -4,-2.3 2,-0.7 -5,-0.2 13,-0.0 -0.389 89.4-107.3 -82.3 160.4 7.5 14.6 46.9 151 159 A D - 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0 0 6 -6,-2.1 3,-2.1 -171,-0.2 4,-0.7 -0.520 24.6-140.4 -66.8 124.2 -3.0 6.5 47.7 176 184 A P G >4 S+ 0 0 85 0, 0.0 3,-0.9 0, 0.0 -1,-0.2 0.832 103.4 63.2 -56.6 -28.8 -4.3 10.0 48.4 177 185 A E G 34 S+ 0 0 103 1,-0.2 -7,-0.1 -175,-0.1 -2,-0.1 0.652 103.5 48.9 -68.9 -16.3 -0.7 10.9 49.5 178 186 A A G X4 S+ 0 0 0 -3,-2.1 3,-1.5 -9,-0.2 -1,-0.2 0.529 80.8 120.1 -98.9 -8.4 0.4 10.2 45.9 179 187 A D T << S+ 0 0 49 -3,-0.9 -9,-0.1 -4,-0.7 4,-0.0 -0.279 77.2 24.1 -56.1 140.7 -2.2 12.2 44.2 180 188 A G T > S+ 0 0 32 6,-0.2 3,-2.0 3,-0.2 -1,-0.3 0.602 76.1 137.0 80.3 12.0 -0.7 14.9 42.1 181 189 A L T < S+ 0 0 0 -3,-1.5 -31,-0.1 1,-0.3 -32,-0.1 0.849 83.8 33.3 -58.3 -34.1 2.6 13.1 41.7 182 190 A Y T > S- 0 0 8 1,-0.5 3,-2.4 4,-0.4 4,-0.3 -0.033 108.5-130.9-109.4 27.7 2.7 14.1 38.0 183 191 A G T < S- 0 0 14 -3,-2.0 -1,-0.5 1,-0.3 3,-0.4 -0.405 71.9 -30.7 61.0-139.0 1.0 17.4 38.5 184 192 A N T 3 S+ 0 0 150 1,-0.2 -1,-0.3 -3,-0.1 -42,-0.0 0.308 122.7 92.3 -89.2 7.1 -1.9 17.6 36.0 185 193 A G S < S+ 0 0 14 -3,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.816 96.5 22.4 -73.4 -30.8 0.0 15.5 33.6 186 194 A V 0 0 2 -3,-0.4 -4,-0.4 -4,-0.3 -6,-0.2 -0.985 360.0 360.0-134.5 126.2 -1.5 12.3 34.7 187 195 A P 0 0 54 0, 0.0 -167,-0.1 0, 0.0 -3,-0.1 -0.359 360.0 360.0 -73.5 360.0 -4.9 12.2 36.6