==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN TRANSPORT 14-FEB-05 2BK9 . COMPND 2 MOLECULE: CG9734-PA; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR D.DE SANCTIS,S.DEWILDE,A.PESCE,L.MOENS,P.ASCENZI,T.HANKELN, . 153 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8475.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 123 80.4 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 . 2 1.3 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 0.7 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 . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 17.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 58.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 0 0 0 0 0 2 1 0 1 1 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 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 . 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 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 M 0 0 98 0, 0.0 76,-0.1 0, 0.0 129,-0.0 0.000 360.0 360.0 360.0 124.3 -12.8 12.5 5.7 2 2 A N > - 0 0 82 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.155 360.0-100.7 -80.3 172.5 -16.2 12.2 4.0 3 3 A S H > S+ 0 0 105 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.868 121.8 54.2 -66.8 -34.0 -18.1 9.0 3.5 4 4 A D H > S+ 0 0 131 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.894 108.4 50.7 -60.8 -41.4 -17.1 8.7 -0.2 5 5 A E H > S+ 0 0 40 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.896 108.9 49.8 -67.6 -44.7 -13.4 9.0 0.9 6 6 A V H X S+ 0 0 18 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.936 112.3 48.3 -57.1 -46.8 -13.7 6.3 3.5 7 7 A Q H X S+ 0 0 107 -4,-2.1 4,-2.7 1,-0.2 5,-0.3 0.893 109.2 53.1 -63.0 -41.5 -15.4 4.0 1.0 8 8 A L H X S+ 0 0 39 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.925 109.8 48.1 -59.8 -45.2 -12.7 4.7 -1.6 9 9 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.959 113.8 47.8 -59.7 -49.0 -9.9 3.7 0.9 10 10 A K H X S+ 0 0 71 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.929 115.1 43.1 -58.8 -48.7 -11.7 0.6 1.9 11 11 A K H >< S+ 0 0 98 -4,-2.7 3,-0.6 1,-0.2 4,-0.4 0.915 115.7 46.6 -69.3 -43.4 -12.5 -0.6 -1.6 12 12 A T H >< S+ 0 0 19 -4,-2.5 3,-1.0 -5,-0.3 -1,-0.2 0.835 105.9 61.3 -69.8 -27.6 -9.0 0.2 -3.1 13 13 A W H 3X S+ 0 0 9 -4,-2.3 4,-2.3 -5,-0.3 5,-0.3 0.785 85.8 76.9 -65.5 -26.9 -7.3 -1.4 -0.1 14 14 A E H 4 S+ 0 0 3 0, 0.0 3,-1.3 0, 0.0 7,-0.3 0.865 115.8 57.5 -65.8 -33.7 -3.0 -4.9 -2.0 17 17 A V H 3< S+ 0 0 36 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.2 0.715 90.2 73.2 -72.0 -15.8 -4.3 -6.4 1.2 18 18 A A T << S+ 0 0 75 -3,-1.0 -1,-0.3 -4,-0.7 -3,-0.1 0.771 107.6 35.1 -63.0 -25.3 -5.2 -9.6 -0.7 19 19 A T <> + 0 0 65 -3,-1.3 4,-2.8 -4,-0.4 5,-0.4 -0.628 67.3 167.7-128.7 72.4 -1.5 -10.3 -0.9 20 20 A P H > S+ 0 0 40 0, 0.0 4,-2.6 0, 0.0 5,-0.3 0.881 76.9 55.5 -56.4 -37.4 0.2 -9.1 2.3 21 21 A T H > S+ 0 0 93 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.974 116.3 33.6 -61.5 -55.7 3.4 -11.0 1.6 22 22 A D H > S+ 0 0 115 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.890 120.2 50.0 -67.7 -41.2 4.0 -9.4 -1.8 23 23 A S H X S+ 0 0 12 -4,-2.8 4,-1.8 -7,-0.3 -2,-0.2 0.933 113.9 44.7 -66.2 -46.4 2.5 -6.0 -1.0 24 24 A G H X S+ 0 0 0 -4,-2.6 4,-2.7 -5,-0.4 5,-0.2 0.889 112.3 52.6 -63.3 -38.2 4.6 -5.7 2.2 25 25 A A H X S+ 0 0 15 -4,-2.2 4,-2.8 -5,-0.3 5,-0.3 0.866 106.0 54.2 -67.4 -33.6 7.7 -6.9 0.4 26 26 A A H X S+ 0 0 39 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.921 112.1 45.1 -63.5 -43.9 7.2 -4.2 -2.2 27 27 A I H X S+ 0 0 3 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.965 118.4 40.5 -60.5 -54.2 7.0 -1.6 0.4 28 28 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.898 113.4 51.1 -76.0 -36.0 10.0 -2.8 2.4 29 29 A T H X S+ 0 0 46 -4,-2.8 4,-2.5 -5,-0.2 -1,-0.2 0.922 112.8 48.3 -61.0 -39.7 12.3 -3.7 -0.4 30 30 A Q H X S+ 0 0 27 -4,-1.6 4,-2.6 -5,-0.3 5,-0.3 0.906 109.2 53.4 -66.8 -41.4 11.7 -0.2 -1.9 31 31 A F H X S+ 0 0 11 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.941 114.9 40.1 -54.0 -50.5 12.4 1.4 1.4 32 32 A F H < S+ 0 0 1 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.812 113.4 54.2 -74.7 -30.3 15.7 -0.3 1.7 33 33 A N H < S+ 0 0 104 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.933 119.8 32.1 -65.9 -47.3 16.6 0.1 -1.9 34 34 A R H < S+ 0 0 151 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.847 134.9 28.5 -74.7 -36.2 16.1 3.9 -1.8 35 35 A F >< + 0 0 58 -4,-2.4 3,-1.7 -5,-0.3 4,-0.3 -0.639 67.6 169.0-131.4 67.3 17.2 4.4 1.8 36 36 A P G > + 0 0 70 0, 0.0 3,-1.6 0, 0.0 4,-0.5 0.695 65.6 77.7 -62.3 -20.1 19.7 1.6 2.7 37 37 A S G > S+ 0 0 82 1,-0.3 3,-1.4 2,-0.2 4,-0.2 0.849 85.2 66.0 -57.4 -30.3 20.8 3.1 6.0 38 38 A N G X S+ 0 0 10 -3,-1.7 3,-1.5 1,-0.3 4,-0.3 0.749 85.2 71.5 -65.4 -25.3 17.5 1.8 7.4 39 39 A L G X S+ 0 0 20 -3,-1.6 3,-2.0 -4,-0.3 -1,-0.3 0.832 85.1 68.2 -54.3 -35.8 18.7 -1.8 6.9 40 40 A E G < S+ 0 0 106 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.676 88.0 64.9 -64.6 -18.3 21.2 -1.4 9.7 41 41 A K G < S+ 0 0 81 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.649 97.4 68.4 -74.3 -16.8 18.4 -1.2 12.3 42 42 A F S X S- 0 0 40 -3,-2.0 3,-1.8 -4,-0.3 16,-0.0 -0.747 85.1-121.9-108.9 156.7 17.3 -4.8 11.6 43 43 A P T 3 S+ 0 0 86 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.769 112.5 61.7 -66.6 -21.0 19.0 -8.2 12.2 44 44 A F T > + 0 0 6 1,-0.2 3,-2.3 2,-0.1 -4,-0.1 0.155 66.8 126.2 -88.5 19.6 18.9 -8.9 8.5 45 45 A R T < S+ 0 0 95 -3,-1.8 -1,-0.2 1,-0.3 -5,-0.1 0.719 73.6 44.7 -50.2 -32.6 21.1 -5.9 7.8 46 46 A D T 3 S+ 0 0 137 -3,-0.4 -1,-0.3 -7,-0.1 -2,-0.1 0.267 81.6 117.3-100.3 9.7 23.6 -7.9 5.8 47 47 A V S < S- 0 0 35 -3,-2.3 5,-0.1 1,-0.1 -3,-0.0 -0.636 76.4-104.9 -74.9 130.5 21.1 -9.9 3.7 48 48 A P >> - 0 0 55 0, 0.0 3,-2.1 0, 0.0 4,-0.7 -0.228 28.7-114.0 -53.2 144.9 21.6 -9.2 0.0 49 49 A L G >4 S+ 0 0 74 1,-0.3 3,-1.1 2,-0.2 4,-0.4 0.862 116.2 51.5 -50.1 -45.8 18.8 -6.9 -1.4 50 50 A E G 34 S+ 0 0 149 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.606 111.9 48.5 -67.6 -16.4 17.5 -9.7 -3.7 51 51 A E G X4 S+ 0 0 111 -3,-2.1 3,-1.4 1,-0.1 4,-0.4 0.419 81.9 96.0-101.0 -4.8 17.3 -12.1 -0.8 52 52 A L G X< S+ 0 0 0 -3,-1.1 3,-2.1 -4,-0.7 6,-0.2 0.890 78.9 56.7 -55.9 -43.9 15.5 -9.8 1.7 53 53 A S G 3 S+ 0 0 59 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.693 101.7 59.1 -68.2 -14.2 12.0 -11.1 0.9 54 54 A G G < S+ 0 0 54 -3,-1.4 2,-0.4 4,-0.0 -1,-0.3 0.517 84.0 99.4 -83.5 -5.6 13.2 -14.6 1.8 55 55 A N <> - 0 0 44 -3,-2.1 4,-2.6 -4,-0.4 5,-0.2 -0.673 69.2-143.3 -89.6 132.1 14.2 -13.6 5.3 56 56 A A H > S+ 0 0 60 -2,-0.4 4,-2.1 1,-0.2 -1,-0.1 0.863 99.8 48.7 -64.2 -37.3 11.7 -14.5 8.0 57 57 A R H > S+ 0 0 170 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.866 110.2 51.8 -73.0 -36.4 12.2 -11.3 10.0 58 58 A F H > S+ 0 0 0 -6,-0.2 4,-2.8 2,-0.2 5,-0.2 0.949 110.5 49.9 -56.6 -47.7 11.9 -9.2 6.9 59 59 A R H X S+ 0 0 108 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.886 107.6 53.9 -61.0 -37.3 8.6 -11.0 6.2 60 60 A A H X S+ 0 0 35 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.911 112.2 42.7 -64.7 -44.6 7.4 -10.4 9.7 61 61 A H H X S+ 0 0 37 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.907 113.1 52.7 -69.1 -40.1 8.0 -6.6 9.5 62 62 A A H X S+ 0 0 3 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.915 111.2 47.4 -56.7 -46.4 6.6 -6.4 6.0 63 63 A G H X S+ 0 0 5 -4,-2.3 4,-2.9 -5,-0.2 -1,-0.2 0.868 107.0 57.8 -65.9 -35.0 3.4 -8.2 7.2 64 64 A R H X S+ 0 0 156 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.887 103.4 52.2 -61.5 -44.1 3.2 -5.9 10.2 65 65 A I H X S+ 0 0 17 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.950 113.3 44.4 -59.3 -48.3 3.0 -2.8 8.1 66 66 A I H X S+ 0 0 3 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.938 115.2 47.7 -60.7 -45.2 0.2 -4.3 6.1 67 67 A R H X S+ 0 0 133 -4,-2.9 4,-2.6 2,-0.2 -1,-0.2 0.864 110.1 51.1 -67.9 -37.3 -1.7 -5.6 9.1 68 68 A V H X S+ 0 0 29 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.906 111.7 47.6 -68.4 -41.0 -1.4 -2.3 11.0 69 69 A F H X S+ 0 0 8 -4,-2.0 4,-2.7 -5,-0.3 5,-0.2 0.919 111.1 52.5 -60.9 -39.0 -2.8 -0.4 8.0 70 70 A D H X S+ 0 0 42 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.936 108.8 49.2 -63.0 -43.7 -5.6 -3.0 7.8 71 71 A E H X S+ 0 0 103 -4,-2.6 4,-0.6 1,-0.2 -1,-0.2 0.880 112.3 49.6 -58.2 -39.4 -6.5 -2.5 11.4 72 72 A S H >X S+ 0 0 0 -4,-1.9 3,-1.0 1,-0.2 4,-0.5 0.909 109.5 49.2 -67.1 -45.5 -6.5 1.2 10.8 73 73 A I H >< S+ 0 0 6 -4,-2.7 3,-1.1 1,-0.3 -1,-0.2 0.859 101.4 65.8 -67.3 -32.8 -8.7 1.1 7.8 74 74 A Q H 3< S+ 0 0 107 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.751 100.7 49.6 -58.1 -29.9 -11.2 -1.2 9.6 75 75 A V H X< S+ 0 0 24 -3,-1.0 3,-1.3 -4,-0.6 -1,-0.2 0.598 83.1 122.7 -87.6 -11.0 -12.1 1.6 12.0 76 76 A L T << S+ 0 0 10 -3,-1.1 3,-0.1 -4,-0.5 -3,-0.0 -0.265 73.6 9.2 -62.4 143.2 -12.7 4.3 9.5 77 77 A G T 3 S+ 0 0 44 1,-0.2 2,-0.3 -76,-0.1 -1,-0.2 0.349 107.1 97.9 76.3 -0.8 -16.1 6.2 9.3 78 78 A Q S X S- 0 0 129 -3,-1.3 3,-1.7 1,-0.1 -1,-0.2 -0.784 86.6 -74.6-117.8 165.6 -17.4 4.7 12.5 79 79 A D T 3 S+ 0 0 155 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 -0.187 116.7 25.8 -60.3 143.1 -17.7 5.8 16.0 80 80 A G T 3> S+ 0 0 24 -3,-0.1 4,-2.8 3,-0.0 -1,-0.3 0.435 80.5 129.9 84.3 4.2 -14.4 5.7 17.9 81 81 A D H <> S+ 0 0 47 -3,-1.7 4,-2.6 1,-0.2 5,-0.2 0.918 71.6 44.7 -56.7 -52.7 -12.3 6.1 14.7 82 82 A L H > S+ 0 0 101 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.923 116.1 48.0 -62.1 -41.5 -10.1 8.9 15.9 83 83 A E H > S+ 0 0 128 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.906 112.1 48.3 -62.8 -46.3 -9.5 7.3 19.3 84 84 A K H X S+ 0 0 101 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.901 111.9 49.3 -68.4 -37.3 -8.7 3.9 17.8 85 85 A L H X S+ 0 0 5 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.913 109.8 51.9 -63.5 -43.1 -6.3 5.4 15.3 86 86 A D H X S+ 0 0 60 -4,-2.3 4,-2.1 -5,-0.2 5,-0.3 0.924 112.1 47.2 -60.0 -42.8 -4.6 7.4 18.1 87 87 A E H X S+ 0 0 137 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.945 113.6 46.6 -61.7 -53.3 -4.2 4.2 20.1 88 88 A I H X S+ 0 0 34 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.936 118.9 38.8 -53.7 -54.0 -2.9 2.1 17.2 89 89 A W H X S+ 0 0 15 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.779 110.1 57.2 -82.5 -25.4 -0.3 4.7 16.0 90 90 A T H X S+ 0 0 41 -4,-2.1 4,-2.8 -5,-0.3 5,-0.2 0.925 109.2 49.1 -63.7 -40.6 0.8 5.9 19.4 91 91 A K H X S+ 0 0 149 -4,-1.8 4,-2.6 -5,-0.3 -2,-0.2 0.939 110.1 50.0 -66.3 -42.2 1.7 2.3 20.1 92 92 A I H X S+ 0 0 36 -4,-1.9 4,-1.0 2,-0.2 -1,-0.2 0.947 111.8 49.5 -58.6 -46.0 3.6 2.0 16.9 93 93 A A H >X S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.2 4,-0.6 0.953 112.5 45.5 -59.9 -49.1 5.5 5.2 17.6 94 94 A V H >< S+ 0 0 77 -4,-2.8 3,-1.3 1,-0.3 -1,-0.2 0.899 105.2 62.6 -66.3 -34.1 6.5 4.1 21.1 95 95 A S H 3< S+ 0 0 69 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.732 104.5 48.2 -60.7 -25.1 7.5 0.7 19.9 96 96 A H H X<>S+ 0 0 47 -3,-1.1 3,-2.4 -4,-1.0 5,-0.8 0.555 82.3 92.8 -94.1 -9.1 10.2 2.2 17.6 97 97 A I G X<5S+ 0 0 36 -3,-1.3 3,-1.7 -4,-0.6 -1,-0.2 0.898 83.2 56.6 -52.5 -40.8 11.8 4.5 20.3 98 98 A P G 3 5S+ 0 0 90 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.474 109.7 46.6 -68.5 -5.5 14.3 1.7 21.2 99 99 A R G < 5S- 0 0 142 -3,-2.4 -2,-0.2 51,-0.2 3,-0.2 0.244 104.9-129.0-115.2 7.8 15.4 1.7 17.6 100 100 A T T < 5 - 0 0 59 -3,-1.7 2,-0.7 50,-0.3 -3,-0.2 0.882 33.0-176.2 39.1 58.7 15.7 5.5 17.1 101 101 A V < - 0 0 18 -5,-0.8 -1,-0.2 49,-0.4 -5,-0.1 -0.749 18.8-142.7 -80.5 111.0 13.6 5.5 14.0 102 102 A S > - 0 0 26 -2,-0.7 4,-2.5 -3,-0.2 47,-0.2 -0.242 20.8-110.9 -77.0 166.6 13.8 9.2 13.0 103 103 A K H > S+ 0 0 33 45,-2.4 4,-2.7 1,-0.2 5,-0.2 0.898 121.9 55.8 -62.2 -36.1 11.1 11.3 11.5 104 104 A E H > S+ 0 0 134 44,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.923 106.4 50.0 -58.6 -45.0 13.2 11.3 8.3 105 105 A S H > S+ 0 0 8 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.925 111.4 47.7 -60.4 -47.5 13.1 7.5 8.3 106 106 A Y H X S+ 0 0 14 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.923 112.0 50.2 -56.0 -44.8 9.3 7.5 8.8 107 107 A N H X S+ 0 0 72 -4,-2.7 4,-1.7 2,-0.2 -2,-0.2 0.872 106.9 55.3 -66.4 -33.5 9.0 10.1 5.9 108 108 A Q H X S+ 0 0 28 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.942 111.6 43.7 -58.2 -48.1 11.2 7.9 3.7 109 109 A L H X S+ 0 0 21 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.873 106.6 63.0 -66.1 -36.0 8.7 5.0 4.3 110 110 A K H X S+ 0 0 46 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.920 103.6 45.6 -56.8 -49.7 5.7 7.3 3.8 111 111 A G H X S+ 0 0 43 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.883 113.0 51.4 -65.0 -33.3 6.5 8.1 0.3 112 112 A V H X S+ 0 0 3 -4,-1.3 4,-2.6 2,-0.2 -2,-0.2 0.916 108.1 51.2 -71.2 -41.4 7.2 4.4 -0.5 113 113 A I H X S+ 0 0 4 -4,-2.9 4,-2.5 2,-0.2 5,-0.2 0.950 112.5 46.3 -58.5 -49.1 3.9 3.2 1.0 114 114 A L H X S+ 0 0 31 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.907 112.1 51.7 -63.8 -36.7 2.0 5.8 -1.1 115 115 A D H X S+ 0 0 81 -4,-2.1 4,-1.9 -5,-0.2 -1,-0.2 0.926 111.5 46.3 -62.0 -47.6 4.0 4.8 -4.2 116 116 A V H X S+ 0 0 15 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.926 115.1 45.7 -63.7 -45.9 3.3 1.1 -3.7 117 117 A L H X S+ 0 0 4 -4,-2.5 4,-2.5 2,-0.2 6,-0.3 0.887 108.8 56.2 -66.5 -39.2 -0.5 1.6 -3.1 118 118 A T H <>S+ 0 0 45 -4,-2.4 5,-2.0 -5,-0.2 4,-0.4 0.924 115.2 38.4 -59.0 -45.0 -0.8 4.0 -6.0 119 119 A A H ><5S+ 0 0 72 -4,-1.9 3,-0.9 3,-0.2 -2,-0.2 0.936 114.4 53.0 -69.8 -48.0 0.6 1.4 -8.3 120 120 A A H 3<5S+ 0 0 41 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.890 122.9 28.0 -61.3 -40.2 -1.1 -1.6 -6.8 121 121 A S T 3<5S- 0 0 16 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.288 104.6-121.7-104.8 9.1 -4.6 -0.1 -6.9 122 122 A S T < 5 - 0 0 105 -3,-0.9 2,-0.3 -4,-0.4 -3,-0.2 0.930 41.0-166.0 50.6 54.0 -4.1 2.1 -9.9 123 123 A L < - 0 0 15 -5,-2.0 -1,-0.2 -6,-0.3 2,-0.0 -0.530 11.1-140.7 -75.9 131.9 -5.0 5.2 -8.0 124 124 A D > - 0 0 82 -2,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.223 38.8 -90.2 -76.1 176.6 -5.7 8.4 -9.9 125 125 A E H > S+ 0 0 179 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.887 127.8 47.7 -61.4 -40.7 -4.4 11.6 -8.4 126 126 A S H > S+ 0 0 90 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.897 114.0 47.1 -65.9 -42.1 -7.6 12.3 -6.4 127 127 A Q H > S+ 0 0 56 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.900 111.4 51.1 -66.1 -40.8 -7.7 8.8 -5.0 128 128 A A H X S+ 0 0 23 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.886 107.5 54.6 -62.9 -37.9 -4.0 9.0 -4.1 129 129 A A H X S+ 0 0 53 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.887 104.9 52.8 -63.8 -37.0 -4.7 12.3 -2.4 130 130 A T H X S+ 0 0 15 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.932 110.7 47.6 -63.0 -45.3 -7.3 10.6 -0.3 131 131 A W H X S+ 0 0 3 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.899 108.5 54.5 -59.4 -43.7 -4.8 8.0 0.7 132 132 A A H X S+ 0 0 25 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.848 103.9 56.4 -62.3 -32.7 -2.2 10.6 1.5 133 133 A K H X S+ 0 0 93 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.908 109.1 45.8 -63.4 -41.8 -4.8 12.3 3.8 134 134 A L H X S+ 0 0 6 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.943 114.9 46.7 -63.2 -49.1 -5.1 9.0 5.8 135 135 A V H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.906 110.7 51.7 -63.6 -41.3 -1.4 8.5 5.9 136 136 A D H X S+ 0 0 78 -4,-2.8 4,-2.0 -5,-0.2 -1,-0.2 0.891 108.3 53.7 -62.0 -37.1 -0.7 12.1 7.0 137 137 A H H X S+ 0 0 83 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.955 110.6 44.2 -59.7 -50.1 -3.2 11.7 9.8 138 138 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.886 110.6 55.3 -68.4 -32.8 -1.6 8.7 11.2 139 139 A Y H X S+ 0 0 8 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.852 101.6 58.7 -64.8 -34.7 1.9 10.3 10.8 140 140 A A H X S+ 0 0 43 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.905 106.7 49.0 -56.9 -40.4 0.6 13.2 12.9 141 141 A I H < S+ 0 0 8 -4,-1.4 3,-0.4 1,-0.2 -2,-0.2 0.937 112.4 46.0 -66.3 -47.7 -0.1 10.7 15.6 142 142 A I H >< S+ 0 0 1 -4,-2.1 3,-2.0 1,-0.2 4,-0.4 0.936 111.1 53.3 -55.8 -48.3 3.4 9.1 15.3 143 143 A F H 3< S+ 0 0 41 -4,-2.8 3,-0.5 1,-0.3 -1,-0.2 0.716 98.6 60.8 -75.8 -14.3 5.1 12.5 15.3 144 144 A K T 3< S+ 0 0 120 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.425 105.4 52.9 -84.1 2.4 3.5 13.8 18.5 145 145 A A S < S+ 0 0 21 -3,-2.0 8,-0.6 -4,-0.2 2,-0.3 0.467 109.7 41.0-110.9 -6.1 5.1 10.9 20.3 146 146 A I B S-A 152 0A 2 -3,-0.5 6,-0.2 -4,-0.4 2,-0.1 -0.935 71.9-118.4-139.4 158.2 8.8 11.3 19.2 147 147 A D > - 0 0 45 4,-2.2 3,-1.5 -2,-0.3 -44,-0.2 -0.276 53.6 -84.9 -80.6 178.3 11.5 13.8 18.7 148 148 A D T 3 S+ 0 0 113 1,-0.3 -45,-2.4 -46,-0.1 -44,-0.5 0.776 130.5 48.2 -59.8 -30.9 13.1 14.3 15.3 149 149 A D T 3 S- 0 0 102 -47,-0.2 -1,-0.3 -46,-0.1 -47,-0.1 0.497 121.8-101.4 -90.2 -0.8 15.6 11.5 15.9 150 150 A G S < S+ 0 0 1 -3,-1.5 -49,-0.4 1,-0.3 -50,-0.3 0.552 78.8 128.8 91.1 9.5 13.0 9.0 17.2 151 151 A N S S- 0 0 65 -51,-0.2 -4,-2.2 1,-0.2 -1,-0.3 -0.443 72.2 -83.1 -82.1 167.2 13.5 9.3 20.9 152 152 A A B A 146 0A 56 -6,-0.2 -6,-0.2 1,-0.1 -1,-0.2 -0.347 360.0 360.0 -59.6 151.0 10.8 9.9 23.4 153 153 A K 0 0 178 -8,-0.6 -1,-0.1 -6,-0.1 -9,-0.0 -0.206 360.0 360.0 -57.6 360.0 10.0 13.6 23.6