==== 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 17-JUL-06 2HPS . COMPND 2 MOLECULE: COELENTERAZINE-BINDING PROTEIN WITH BOUND COELENT . SOURCE 2 ORGANISM_SCIENTIFIC: RENILLA MUELLERI; . AUTHOR G.STEPANYUK,Z.J.LIU,E.S.VYSOTSKI,J.LEE,J.P.ROSE,B.C.WANG,SOU . 184 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9448.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 136 73.9 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 . 8 4.3 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 . 5 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 100 54.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.6 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 1 1 0 0 0 1 2 0 1 1 1 1 0 1 0 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 . 0 0 2 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 . 2 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 3 A E 0 0 146 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 129.3 -12.1 22.8 23.0 2 4 A I - 0 0 83 1,-0.1 2,-0.0 4,-0.1 86,-0.0 -0.517 360.0-132.1 -72.5 127.8 -15.2 21.1 24.3 3 5 A T > - 0 0 65 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.270 19.2-108.4 -78.2 165.9 -16.5 18.6 21.7 4 6 A E H > S+ 0 0 165 1,-0.2 4,-2.3 2,-0.2 -1,-0.1 0.874 120.5 47.8 -61.2 -38.0 -20.1 18.2 20.5 5 7 A S H > S+ 0 0 87 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.872 111.0 50.1 -74.9 -36.0 -20.5 15.0 22.4 6 8 A E H > S+ 0 0 35 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.934 113.6 46.4 -63.6 -44.9 -19.1 16.4 25.7 7 9 A R H X S+ 0 0 79 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.924 111.5 52.9 -62.6 -41.8 -21.4 19.4 25.3 8 10 A A H X S+ 0 0 58 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.934 111.9 44.6 -57.3 -47.3 -24.3 17.0 24.6 9 11 A Y H X S+ 0 0 25 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.919 113.0 50.0 -67.1 -44.4 -23.6 15.0 27.7 10 12 A H H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.938 111.5 48.7 -61.7 -43.2 -23.2 18.0 29.9 11 13 A L H X S+ 0 0 23 -4,-2.8 4,-2.8 2,-0.2 -1,-0.2 0.848 108.1 55.2 -62.5 -37.2 -26.4 19.6 28.7 12 14 A R H X S+ 0 0 95 -4,-1.9 4,-1.6 -5,-0.2 171,-0.5 0.923 109.6 46.9 -60.4 -42.7 -28.2 16.2 29.3 13 15 A K H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.942 113.4 48.1 -61.2 -48.1 -27.0 16.4 32.9 14 16 A X H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.873 108.7 53.0 -66.6 -37.1 -28.1 20.0 33.3 15 17 A K H X S+ 0 0 43 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.874 107.3 52.7 -63.8 -34.7 -31.5 19.3 31.7 16 18 A T H X S+ 0 0 4 -4,-1.6 4,-0.8 2,-0.2 -2,-0.2 0.943 111.9 46.4 -64.9 -43.3 -32.0 16.5 34.3 17 19 A R H >< S+ 0 0 15 -4,-2.1 3,-0.9 1,-0.2 4,-0.5 0.919 112.7 49.2 -63.0 -45.4 -31.1 18.9 37.1 18 20 A X H >X S+ 0 0 0 -4,-2.7 3,-1.5 1,-0.3 4,-1.0 0.842 100.7 63.3 -69.9 -29.9 -33.4 21.6 35.7 19 21 A Q H 3< S+ 0 0 77 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.787 94.5 63.2 -64.6 -25.1 -36.3 19.2 35.3 20 22 A R T << S+ 0 0 81 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.733 100.2 52.4 -68.2 -22.6 -36.2 18.9 39.1 21 23 A V T <4 S+ 0 0 5 -3,-1.5 2,-2.0 -4,-0.5 -1,-0.2 0.761 89.7 85.0 -80.9 -25.3 -37.1 22.6 39.3 22 24 A D >< + 0 0 16 -4,-1.0 3,-1.1 1,-0.2 -1,-0.2 -0.477 55.7 170.2 -79.8 76.7 -40.1 22.0 37.0 23 25 A V T 3 S+ 0 0 72 -2,-2.0 -1,-0.2 1,-0.3 6,-0.1 0.723 74.3 43.5 -71.7 -21.9 -42.5 21.0 39.7 24 26 A T T 3 S- 0 0 113 4,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.479 103.9-126.8 -98.4 -3.0 -45.6 21.0 37.5 25 27 A G < + 0 0 62 -3,-1.1 -2,-0.1 -6,-0.2 -3,-0.1 0.777 69.1 130.4 66.6 29.7 -44.0 19.3 34.6 26 28 A D S S- 0 0 76 2,-0.3 3,-0.1 49,-0.0 -1,-0.1 0.407 79.4-109.7 -93.0 0.6 -45.0 22.0 32.1 27 29 A G S S+ 0 0 24 1,-0.2 49,-2.2 -5,-0.1 2,-0.3 0.506 87.5 95.4 85.0 6.7 -41.4 22.3 30.7 28 30 A F E -A 75 0A 75 47,-0.3 -2,-0.3 48,-0.1 2,-0.3 -0.945 49.1-171.3-131.6 150.1 -40.9 25.8 32.2 29 31 A I E -A 74 0A 1 45,-2.9 45,-2.2 -2,-0.3 2,-0.3 -0.935 0.8-168.8-137.9 161.9 -39.3 27.1 35.4 30 32 A S E > -A 73 0A 11 -2,-0.3 4,-1.6 43,-0.2 3,-0.4 -0.905 41.7 -92.6-143.7 171.4 -39.0 30.4 37.2 31 33 A R H > S+ 0 0 37 41,-0.5 4,-2.3 38,-0.5 3,-0.3 0.901 123.5 50.8 -51.9 -48.1 -37.1 32.1 40.1 32 34 A E H > S+ 0 0 116 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.837 103.7 58.3 -68.0 -29.9 -39.8 31.2 42.6 33 35 A D H > S+ 0 0 42 -3,-0.4 4,-0.9 2,-0.2 -1,-0.2 0.886 109.0 46.9 -58.4 -40.4 -39.8 27.5 41.5 34 36 A Y H >X S+ 0 0 9 -4,-1.6 4,-1.4 -3,-0.3 3,-0.7 0.924 109.0 53.4 -68.0 -43.3 -36.1 27.6 42.5 35 37 A E H 3X S+ 0 0 46 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.822 98.5 65.7 -59.6 -32.3 -36.8 29.3 45.8 36 38 A L H 3X S+ 0 0 62 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.890 98.6 52.5 -58.4 -40.6 -39.3 26.6 46.5 37 39 A I H S+ 0 0 18 -4,-2.5 5,-2.0 1,-0.2 4,-0.7 0.872 111.1 51.3 -60.7 -39.2 -35.0 24.9 55.3 43 45 A K H ><5S+ 0 0 172 -4,-2.0 3,-0.7 3,-0.2 -1,-0.2 0.954 111.9 42.8 -65.7 -50.6 -38.1 23.0 56.5 44 46 A I H 3<5S+ 0 0 72 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.893 119.0 44.9 -67.4 -36.4 -36.6 19.5 56.6 45 47 A A H 3<5S- 0 0 29 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.568 103.3-132.9 -80.9 -8.8 -33.3 20.8 58.2 46 48 A K T <<5 - 0 0 134 -4,-0.7 -3,-0.2 -3,-0.7 -4,-0.1 0.912 37.3-168.0 53.1 46.6 -35.3 22.9 60.7 47 49 A L < - 0 0 47 -5,-2.0 -1,-0.1 -6,-0.2 -5,-0.0 -0.308 21.2-110.5 -66.5 145.4 -33.0 25.9 59.8 48 50 A S > - 0 0 63 1,-0.1 4,-3.2 4,-0.0 5,-0.2 -0.259 37.7-100.8 -61.7 162.1 -32.9 29.0 61.9 49 51 A A H > S+ 0 0 89 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.896 125.4 49.8 -55.0 -41.5 -34.3 32.2 60.2 50 52 A E H > S+ 0 0 133 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.916 113.7 42.6 -64.3 -48.5 -30.7 33.3 59.5 51 53 A K H > S+ 0 0 105 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.885 112.6 54.6 -66.8 -39.8 -29.6 29.9 58.0 52 54 A A H X S+ 0 0 27 -4,-3.2 4,-2.6 1,-0.2 -2,-0.2 0.913 110.2 46.7 -59.0 -42.1 -32.8 29.6 56.0 53 55 A E H X S+ 0 0 79 -4,-2.1 4,-3.0 -5,-0.2 -2,-0.2 0.883 109.1 53.4 -70.0 -38.1 -32.2 33.1 54.5 54 56 A E H X S+ 0 0 77 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.919 110.3 49.1 -59.9 -41.5 -28.6 32.3 53.7 55 57 A T H X S+ 0 0 4 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.952 112.3 47.5 -62.5 -49.4 -29.9 29.1 51.9 56 58 A R H X S+ 0 0 73 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.922 111.0 51.5 -55.8 -46.5 -32.4 31.2 50.0 57 59 A Q H X S+ 0 0 96 -4,-3.0 4,-2.2 2,-0.2 -1,-0.2 0.881 108.7 50.6 -62.2 -36.3 -29.8 33.9 49.1 58 60 A E H X S+ 0 0 20 -4,-2.1 4,-2.2 2,-0.2 5,-0.2 0.939 110.4 49.8 -69.4 -43.0 -27.4 31.2 47.7 59 61 A F H X S+ 0 0 5 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.890 110.6 50.2 -58.7 -39.0 -30.3 29.8 45.6 60 62 A L H X S+ 0 0 15 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.896 107.5 53.9 -66.3 -38.1 -31.0 33.3 44.3 61 63 A R H X S+ 0 0 82 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.927 113.3 42.0 -60.3 -46.7 -27.3 33.8 43.4 62 64 A V H X S+ 0 0 8 -4,-2.2 4,-2.0 2,-0.2 3,-0.3 0.902 107.9 61.5 -66.4 -40.4 -27.4 30.6 41.3 63 65 A A H X>S+ 0 0 0 -4,-2.9 5,-2.8 1,-0.2 4,-0.6 0.890 100.5 55.4 -53.5 -40.1 -30.8 31.5 39.9 64 66 A D H ><5S+ 0 0 94 -4,-2.0 3,-1.0 1,-0.2 -1,-0.2 0.925 108.1 47.1 -58.7 -44.4 -29.1 34.6 38.4 65 67 A Q H 3<5S+ 0 0 67 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.841 109.1 54.9 -64.4 -34.2 -26.6 32.4 36.7 66 68 A L H 3<5S- 0 0 1 -4,-2.0 -1,-0.2 2,-0.1 16,-0.2 0.546 117.7-111.8 -77.6 -6.4 -29.4 30.1 35.4 67 69 A G T <<5S+ 0 0 26 -3,-1.0 2,-1.6 -4,-0.6 -3,-0.2 0.656 71.4 143.1 80.6 17.1 -31.2 33.1 33.8 68 70 A L < + 0 0 0 -5,-2.8 -1,-0.1 -6,-0.2 3,-0.1 -0.471 28.4 172.7 -88.9 63.5 -34.0 32.8 36.3 69 71 A A > - 0 0 42 -2,-1.6 3,-1.6 1,-0.2 -38,-0.5 -0.270 45.1 -76.9 -68.5 153.6 -34.5 36.5 36.5 70 72 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.285 116.6 9.0 -52.1 134.8 -37.4 38.0 38.5 71 73 A G T 3 S+ 0 0 81 1,-0.2 2,-0.2 -3,-0.1 -2,-0.0 0.205 101.5 115.4 83.5 -15.9 -40.6 37.8 36.5 72 74 A V < - 0 0 55 -3,-1.6 -41,-0.5 -5,-0.0 2,-0.4 -0.511 46.7-160.5 -90.9 157.4 -39.3 35.5 33.7 73 75 A R E +A 30 0A 145 -2,-0.2 2,-0.3 -43,-0.1 -43,-0.2 -0.992 19.2 179.0-133.7 120.0 -40.4 32.0 32.8 74 76 A I E -A 29 0A 14 -45,-2.2 -45,-2.9 -2,-0.4 -6,-0.0 -0.890 31.2 -96.6-125.0 157.9 -37.9 30.1 30.7 75 77 A S E > -A 28 0A 37 -2,-0.3 4,-2.2 -47,-0.2 -47,-0.3 -0.289 31.7-116.6 -65.9 155.0 -37.8 26.5 29.3 76 78 A V H > S+ 0 0 9 -49,-2.2 4,-2.0 1,-0.2 -58,-0.1 0.877 117.4 50.4 -59.6 -35.4 -36.0 23.7 31.1 77 79 A E H > S+ 0 0 69 -50,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.878 107.8 52.2 -74.2 -32.8 -33.6 23.4 28.1 78 80 A E H > S+ 0 0 102 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.927 112.0 46.6 -63.7 -43.7 -32.9 27.2 28.0 79 81 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.881 110.1 54.4 -63.2 -38.9 -32.0 27.0 31.7 80 82 A A H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.918 107.2 49.7 -60.6 -44.3 -29.9 23.9 31.0 81 83 A V H X S+ 0 0 40 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.923 109.8 51.4 -59.7 -43.6 -27.9 25.8 28.4 82 84 A N H X S+ 0 0 44 -4,-2.1 4,-2.4 -16,-0.2 -2,-0.2 0.906 111.0 49.0 -60.6 -41.1 -27.4 28.7 30.9 83 85 A A H X S+ 0 0 0 -4,-2.4 4,-3.0 -17,-0.2 5,-0.3 0.935 114.1 44.0 -61.0 -51.3 -26.1 26.1 33.4 84 86 A T H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.941 114.8 49.0 -62.4 -46.3 -23.7 24.5 31.0 85 87 A D H X S+ 0 0 80 -4,-3.0 4,-0.7 -5,-0.2 -2,-0.2 0.922 117.0 42.1 -60.1 -46.3 -22.4 27.8 29.6 86 88 A S H >X S+ 0 0 29 -4,-2.4 4,-0.6 -5,-0.2 3,-0.6 0.943 117.4 44.3 -65.6 -51.9 -21.8 29.2 33.1 87 89 A L H >< S+ 0 0 9 -4,-3.0 3,-0.9 1,-0.2 -2,-0.2 0.876 111.3 50.9 -64.6 -41.1 -20.3 26.1 34.7 88 90 A L H 3< S+ 0 0 42 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.641 105.1 58.5 -78.0 -11.9 -17.9 25.1 31.9 89 91 A K H << S+ 0 0 122 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.671 85.6 107.1 -79.8 -23.1 -16.5 28.7 31.7 90 92 A X << - 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0 0 30 -3,-2.2 -3,-0.1 -7,-0.2 5,-0.0 -0.591 70.0-132.1 -79.7 122.7 -39.4 10.4 44.6 134 136 A T > - 0 0 71 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.222 23.8-110.7 -62.8 157.6 -40.1 6.8 45.5 135 137 A D H > S+ 0 0 89 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.910 120.8 57.5 -54.0 -42.5 -38.2 5.0 48.3 136 138 A D H > S+ 0 0 108 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.944 108.0 45.3 -54.6 -50.7 -36.6 2.9 45.5 137 139 A K H > S+ 0 0 112 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.903 114.8 46.9 -61.3 -42.5 -35.3 6.0 43.8 138 140 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.910 116.0 44.3 -67.4 -39.7 -34.0 7.7 47.0 139 141 A I H X S+ 0 0 69 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.878 110.8 53.6 -75.9 -38.4 -32.3 4.5 48.2 140 142 A T H X S+ 0 0 70 -4,-2.7 4,-2.0 -5,-0.3 -1,-0.2 0.920 109.4 50.5 -55.8 -45.0 -30.8 3.7 44.8 141 143 A C H X S+ 0 0 13 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.940 111.4 46.7 -60.7 -50.2 -29.3 7.2 44.8 142 144 A F H X S+ 0 0 11 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.929 110.0 54.2 -54.8 -51.0 -27.8 6.8 48.2 143 145 A N H < S+ 0 0 82 -4,-2.8 6,-0.2 1,-0.2 -1,-0.2 0.886 111.7 43.7 -56.8 -41.5 -26.4 3.3 47.4 144 146 A T H < S+ 0 0 41 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.920 112.9 50.0 -69.3 -43.8 -24.5 4.7 44.3 145 147 A L H < S+ 0 0 1 -4,-2.5 2,-2.0 1,-0.2 3,-0.2 0.757 94.4 75.9 -70.0 -23.1 -23.2 7.8 46.0 146 148 A D >< + 0 0 6 -4,-2.1 3,-1.6 -5,-0.2 -1,-0.2 -0.546 64.7 162.4 -78.2 66.8 -21.9 5.6 48.8 147 149 A F T 3 S+ 0 0 75 -2,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.704 70.5 51.0 -75.3 -18.2 -19.2 4.6 46.4 148 150 A N T 3 S- 0 0 91 -3,-0.2 -1,-0.3 4,-0.2 -2,-0.1 0.444 107.0-131.7 -89.8 -1.5 -17.0 3.2 49.2 149 151 A K < + 0 0 114 -3,-1.6 -2,-0.1 -6,-0.2 4,-0.1 0.901 61.3 136.9 52.5 52.4 -20.0 1.1 50.3 150 152 A N S S- 0 0 103 2,-0.4 -1,-0.1 0, 0.0 3,-0.1 0.333 74.9-111.3-103.1 -0.4 -19.7 2.1 54.0 151 153 A G S S+ 0 0 44 -5,-0.2 -32,-0.6 1,-0.1 2,-0.3 0.619 97.4 67.0 73.8 10.4 -23.5 2.6 54.6 152 154 A Q E S-B 118 0B 80 -34,-0.2 2,-0.5 -33,-0.1 -2,-0.4 -0.966 75.1-133.6-157.7 150.2 -22.7 6.3 55.0 153 155 A I E -B 117 0B 0 -36,-2.4 -36,-1.7 -2,-0.3 -7,-0.1 -0.933 19.9-143.9-112.7 123.9 -21.4 9.1 52.7 154 156 A S E > -B 116 0B 17 -2,-0.5 4,-2.5 -38,-0.2 -38,-0.2 -0.340 26.7-110.2 -77.4 162.1 -18.7 11.4 53.9 155 157 A R H > S+ 0 0 100 -40,-1.8 4,-2.5 1,-0.2 5,-0.2 0.937 120.4 48.9 -56.5 -48.0 -18.5 15.1 53.0 156 158 A D H > S+ 0 0 118 -41,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.876 110.6 50.6 -61.2 -39.4 -15.5 14.6 50.8 157 159 A E H > S+ 0 0 25 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.925 110.0 50.0 -65.7 -42.5 -17.2 11.6 49.0 158 160 A F H X S+ 0 0 10 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.935 108.2 53.8 -59.7 -45.0 -20.3 13.8 48.4 159 161 A L H X S+ 0 0 42 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.823 101.7 58.7 -61.4 -32.8 -18.1 16.5 47.0 160 162 A V H X S+ 0 0 77 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.955 109.7 44.1 -58.6 -48.0 -16.5 14.1 44.5 161 163 A T H X S+ 0 0 0 -4,-1.6 4,-2.9 2,-0.2 5,-0.2 0.924 112.5 51.9 -63.1 -46.3 -20.0 13.4 43.1 162 164 A V H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.3 0.941 112.0 45.8 -58.3 -49.6 -21.0 17.1 43.0 163 165 A N H X>S+ 0 0 58 -4,-2.7 4,-2.5 2,-0.2 5,-0.5 0.908 113.1 49.7 -60.4 -41.2 -17.8 18.0 41.1 164 166 A D H X5S+ 0 0 25 -4,-2.3 4,-1.7 -5,-0.2 -2,-0.2 0.935 114.6 44.4 -66.5 -42.3 -18.2 15.2 38.7 165 167 A F H <5S+ 0 0 0 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.949 119.6 40.8 -63.8 -48.7 -21.9 16.1 38.0 166 168 A L H <5S+ 0 0 13 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.841 133.8 15.5 -73.2 -34.2 -21.2 19.9 37.7 167 169 A F H <5S+ 0 0 25 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.519 89.2 119.3-120.2 -10.6 -18.0 19.9 35.7 168 170 A G << - 0 0 19 -4,-1.7 4,-0.1 -5,-0.5 -4,-0.0 -0.377 34.0-175.7 -66.2 134.9 -17.5 16.4 34.2 169 171 A L S S+ 0 0 45 -2,-0.1 2,-0.4 2,-0.1 -160,-0.2 0.540 70.4 64.0-101.2 -17.0 -17.4 16.2 30.4 170 172 A E S S- 0 0 121 -6,-0.1 2,-0.1 -161,-0.1 -164,-0.0 -0.872 94.0-101.2-111.9 146.4 -17.2 12.4 30.4 171 173 A E + 0 0 131 -2,-0.4 2,-0.3 4,-0.1 -2,-0.1 -0.333 43.0 172.8 -66.0 138.3 -19.9 10.1 31.6 172 174 A T > - 0 0 66 1,-0.1 4,-2.3 -4,-0.1 5,-0.1 -0.974 43.8-115.6-140.3 160.7 -19.6 8.4 35.1 173 175 A A H > S+ 0 0 73 -2,-0.3 4,-0.6 1,-0.2 5,-0.1 0.884 116.2 51.2 -58.8 -39.5 -21.8 6.3 37.3 174 176 A L H >> S+ 0 0 31 1,-0.2 4,-2.1 2,-0.2 3,-1.2 0.944 111.7 44.7 -67.9 -46.0 -21.9 9.0 39.9 175 177 A A H 3> S+ 0 0 0 1,-0.3 4,-0.5 2,-0.2 -1,-0.2 0.866 111.2 55.2 -67.2 -34.2 -22.9 11.8 37.5 176 178 A N H 3< S+ 0 0 44 -4,-2.3 6,-0.3 1,-0.2 -1,-0.3 0.626 117.6 35.7 -68.7 -12.8 -25.5 9.4 36.0 177 179 A A H X< S+ 0 0 17 -3,-1.2 3,-2.1 -4,-0.6 -2,-0.2 0.689 91.6 84.0-112.5 -27.2 -27.0 8.8 39.4 178 180 A F H 3< S+ 0 0 30 -4,-2.1 -2,-0.1 1,-0.3 -3,-0.1 0.827 111.1 21.8 -53.3 -45.2 -26.8 12.2 41.3 179 181 A Y T 3< S- 0 0 69 -4,-0.5 -1,-0.3 1,-0.5 -2,-0.1 -0.059 120.7-108.3-109.8 27.7 -30.0 13.6 39.8 180 182 A G S < S- 0 0 32 -3,-2.1 -1,-0.5 -43,-0.1 3,-0.1 -0.186 74.2 -6.0 71.8-168.9 -31.5 10.2 38.9 181 183 A D S S- 0 0 144 1,-0.1 -4,-0.1 -3,-0.1 -5,-0.1 -0.335 85.7-108.3 -62.6 129.8 -31.8 8.7 35.4 182 184 A L - 0 0 26 -6,-0.3 2,-0.2 1,-0.1 -169,-0.1 -0.284 34.9-128.9 -65.3 143.0 -30.8 11.4 32.8 183 185 A V 0 0 36 -171,-0.5 -167,-0.2 1,-0.1 -168,-0.1 -0.651 360.0 360.0 -96.0 150.3 -33.6 12.8 30.8 184 186 A D 0 0 151 -2,-0.2 -1,-0.1 -169,-0.1 -2,-0.0 0.851 360.0 360.0 -74.6 360.0 -34.1 13.3 26.9