==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN STORAGE 25-AUG-93 2SPN . COMPND 2 MOLECULE: MYOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSETER CATODON; . AUTHOR M.L.QUILLIN,R.M.ARDUINI,G.N.PHILLIPS JR. . 154 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8148.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 127 82.5 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 . 0 0.0 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 . 3 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 63.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 3.2 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 1 0 0 0 0 0 0 1 1 1 0 0 1 1 0 0 0 0 0 1 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 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 0 A M 0 0 76 0, 0.0 2,-0.5 0, 0.0 140,-0.0 0.000 360.0 360.0 360.0 148.4 24.5 9.9 -9.4 2 1 A V - 0 0 130 136,-0.0 2,-0.3 0, 0.0 79,-0.1 -0.974 360.0-147.8-121.6 134.9 27.0 11.9 -11.4 3 2 A L - 0 0 10 -2,-0.5 2,-0.1 77,-0.1 128,-0.0 -0.682 19.9-124.1 -92.4 143.6 28.6 15.1 -10.3 4 3 A S > - 0 0 63 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.413 27.4-109.6 -76.2 163.1 29.6 17.7 -12.9 5 4 A E H > S+ 0 0 98 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.878 121.7 58.1 -62.0 -32.3 33.3 18.9 -12.9 6 5 A G H > S+ 0 0 47 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.922 106.4 47.5 -67.9 -32.8 32.0 22.3 -11.6 7 6 A E H > S+ 0 0 50 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.929 110.1 51.4 -72.6 -42.4 30.5 20.4 -8.5 8 7 A W H X S+ 0 0 14 -4,-2.3 4,-3.1 2,-0.2 5,-0.2 0.874 106.6 56.2 -59.0 -39.9 33.7 18.5 -8.0 9 8 A Q H X S+ 0 0 93 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.877 106.2 49.2 -83.8 14.4 35.6 21.8 -8.1 10 9 A L H X S+ 0 0 66 -4,-1.5 4,-1.7 -5,-0.3 5,-0.2 0.980 113.3 47.9 -94.1 -43.5 33.4 23.2 -5.2 11 10 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.928 114.5 43.8 -60.1 -54.8 34.1 20.1 -3.2 12 11 A L H X S+ 0 0 32 -4,-3.1 4,-1.8 1,-0.2 -1,-0.2 0.851 108.4 60.0 -71.2 -21.5 37.9 20.0 -3.8 13 12 A H H X S+ 0 0 89 -4,-1.3 4,-0.9 -5,-0.2 -1,-0.2 0.915 111.9 36.9 -69.1 -48.9 38.1 23.8 -3.1 14 13 A V H X S+ 0 0 2 -4,-1.7 4,-2.1 1,-0.2 3,-0.4 0.873 112.7 59.9 -70.2 -36.1 36.7 23.6 0.4 15 14 A W H X S+ 0 0 7 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.892 97.9 59.6 -59.2 -34.9 38.5 20.2 1.0 16 15 A A H < S+ 0 0 53 -4,-1.8 4,-0.3 1,-0.2 -1,-0.2 0.912 105.4 49.2 -60.4 -30.1 41.9 22.0 0.3 17 16 A K H >< S+ 0 0 87 -4,-0.9 3,-1.5 -3,-0.4 4,-0.4 0.912 108.2 52.4 -76.3 -44.7 41.1 24.3 3.3 18 17 A V H >< S+ 0 0 2 -4,-2.1 3,-1.9 1,-0.3 7,-0.3 0.887 101.9 61.5 -52.7 -46.1 40.2 21.3 5.5 19 18 A E G >< S+ 0 0 86 -4,-2.5 3,-0.6 1,-0.3 -1,-0.3 0.650 85.8 74.3 -64.0 -8.8 43.6 19.8 4.6 20 19 A A G < S+ 0 0 93 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.718 118.4 15.8 -70.6 -26.5 45.4 22.8 6.2 21 20 A D G <> S+ 0 0 66 -3,-1.9 4,-2.3 -4,-0.4 -1,-0.3 -0.424 72.4 163.9-142.4 75.9 44.4 21.3 9.6 22 21 A V H <> S+ 0 0 38 -3,-0.6 4,-2.9 1,-0.2 5,-0.2 0.938 78.7 48.8 -66.0 -39.0 43.4 17.6 9.2 23 22 A A H > S+ 0 0 29 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.877 111.1 49.8 -67.0 -42.8 43.6 16.7 12.9 24 23 A G H > S+ 0 0 9 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.904 113.7 45.7 -59.4 -45.9 41.7 19.8 14.0 25 24 A H H X S+ 0 0 2 -4,-2.3 4,-2.4 -7,-0.3 -2,-0.2 0.935 110.4 54.1 -67.0 -37.3 38.9 19.1 11.5 26 25 A G H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.875 110.1 47.6 -60.5 -45.3 38.9 15.3 12.5 27 26 A Q H X S+ 0 0 36 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.936 112.0 49.0 -60.9 -49.9 38.4 16.3 16.2 28 27 A D H X S+ 0 0 62 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.879 112.2 49.2 -55.9 -48.3 35.6 18.8 15.4 29 28 A I H X S+ 0 0 4 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.914 112.8 44.8 -59.8 -45.7 33.7 16.2 13.3 30 29 A F H X S+ 0 0 4 -4,-2.4 4,-3.4 2,-0.2 5,-0.2 0.885 113.3 49.9 -71.5 -34.3 33.9 13.3 15.8 31 30 A I H X S+ 0 0 9 -4,-2.4 4,-2.8 -5,-0.2 -1,-0.2 0.947 111.1 49.5 -66.3 -42.1 32.9 15.5 18.7 32 31 A R H X S+ 0 0 80 -4,-2.0 4,-2.5 -5,-0.2 5,-0.3 0.903 114.3 46.3 -60.2 -46.0 29.9 16.9 16.8 33 32 A L H X S+ 0 0 8 -4,-2.4 4,-2.8 1,-0.2 7,-0.2 0.958 113.6 47.1 -63.6 -47.8 28.9 13.3 15.8 34 33 A F H < S+ 0 0 5 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.842 117.2 44.2 -67.9 -31.4 29.3 11.9 19.4 35 34 A K H < S+ 0 0 112 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.881 118.5 40.7 -77.1 -44.5 27.4 14.8 20.8 36 35 A S H < S+ 0 0 46 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.792 133.1 22.6 -71.3 -33.1 24.5 14.9 18.2 37 36 A H >< + 0 0 28 -4,-2.8 3,-2.3 -5,-0.3 4,-0.5 -0.602 64.1 175.3-141.8 78.8 24.3 11.1 18.1 38 37 A P G >> S+ 0 0 77 0, 0.0 3,-1.0 0, 0.0 4,-0.7 0.717 74.9 73.8 -59.5 -23.7 25.6 9.4 21.2 39 38 A E G >4 S+ 0 0 71 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.853 88.5 62.6 -61.6 -28.4 24.5 6.0 20.0 40 39 A T G X4 S+ 0 0 4 -3,-2.3 3,-1.5 1,-0.3 4,-0.3 0.827 91.4 64.0 -66.5 -30.3 27.4 6.2 17.5 41 40 A L G X4 S+ 0 0 21 -3,-1.0 3,-1.9 -4,-0.5 6,-0.3 0.827 90.5 67.9 -60.5 -32.8 30.0 6.3 20.3 42 41 A E G << S+ 0 0 143 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.719 89.2 64.5 -59.7 -25.5 28.8 2.8 21.3 43 42 A K G < S+ 0 0 81 -3,-1.5 2,-0.8 -4,-0.4 -1,-0.3 0.608 89.7 74.7 -76.1 -10.9 30.3 1.4 18.1 44 43 A F X> - 0 0 46 -3,-1.9 4,-1.6 -4,-0.3 3,-1.1 -0.830 56.0-175.5-107.2 102.9 33.8 2.4 19.2 45 44 A D T 34 S+ 0 0 132 -2,-0.8 4,-0.2 1,-0.3 -1,-0.2 0.844 88.5 58.7 -59.3 -31.6 35.1 -0.0 21.9 46 45 A R T 34 S+ 0 0 122 1,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.763 118.7 23.3 -69.8 -30.3 38.1 2.3 21.9 47 46 A F T X4 S+ 0 0 2 -3,-1.1 3,-2.0 -6,-0.3 -2,-0.2 0.406 85.7 107.0-120.9 1.5 36.3 5.5 22.8 48 47 A K T 3< S+ 0 0 113 -4,-1.6 -3,-0.1 1,-0.3 -1,-0.1 0.631 76.0 61.1 -56.1 -28.9 33.0 4.3 24.5 49 48 A H T 3 S+ 0 0 123 -4,-0.2 -1,-0.3 -3,-0.1 2,-0.1 0.676 73.0 113.1 -77.2 -11.7 34.3 5.4 27.9 50 49 A L < - 0 0 14 -3,-2.0 3,-0.1 1,-0.2 -3,-0.0 -0.362 41.4-179.1 -65.1 128.5 34.6 9.1 27.0 51 50 A K + 0 0 175 -2,-0.1 2,-0.3 1,-0.1 -1,-0.2 0.790 54.8 26.2-100.3 -30.3 32.1 11.0 29.1 52 51 A T S > S- 0 0 69 1,-0.1 4,-1.9 0, 0.0 5,-0.2 -0.851 76.2-108.6-132.2 170.6 32.4 14.6 28.1 53 52 A E H > S+ 0 0 67 -2,-0.3 4,-3.0 1,-0.3 5,-0.2 0.892 117.7 59.4 -68.1 -31.5 33.6 16.9 25.3 54 53 A A H > S+ 0 0 70 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.928 106.5 45.7 -59.4 -45.0 36.6 17.8 27.4 55 54 A E H > S+ 0 0 82 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.885 111.7 52.5 -67.0 -34.0 37.7 14.2 27.5 56 55 A M H >< S+ 0 0 12 -4,-1.9 3,-0.8 1,-0.2 -2,-0.2 0.937 110.2 48.2 -64.7 -42.5 37.1 13.8 23.8 57 56 A K H 3< S+ 0 0 115 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.826 112.1 51.0 -65.9 -32.1 39.2 16.9 23.1 58 57 A A H 3< S+ 0 0 75 -4,-1.7 2,-0.6 -5,-0.2 -1,-0.3 0.635 85.1 103.2 -83.9 -13.2 41.9 15.5 25.3 59 58 A S S+ 0 0 106 -2,-0.6 4,-2.2 1,-0.2 -1,-0.2 0.782 87.6 59.5 -79.4 -29.7 45.1 11.7 21.5 61 60 A D H > S+ 0 0 72 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.881 105.8 47.0 -62.5 -45.0 43.7 8.3 20.3 62 61 A L H > S+ 0 0 1 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.867 110.4 53.7 -63.7 -41.2 40.5 10.0 19.0 63 62 A K H X S+ 0 0 48 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.910 109.1 48.3 -57.2 -45.6 42.6 12.7 17.3 64 63 A K H X S+ 0 0 94 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.860 111.3 50.4 -62.2 -41.1 44.7 10.0 15.5 65 64 A H H X S+ 0 0 36 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.925 105.9 54.5 -63.6 -41.5 41.5 8.3 14.4 66 65 A G H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.855 108.1 51.6 -59.8 -39.0 40.0 11.5 13.0 67 66 A V H X S+ 0 0 49 -4,-1.7 4,-2.5 2,-0.2 5,-0.2 0.937 110.4 47.5 -63.9 -46.3 43.2 11.9 10.9 68 67 A T H X S+ 0 0 94 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.932 113.7 48.8 -58.2 -47.0 42.9 8.4 9.5 69 68 A V H X S+ 0 0 40 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.914 114.2 43.1 -57.9 -59.3 39.2 8.9 8.7 70 69 A L H X S+ 0 0 3 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.836 112.0 54.3 -63.6 -34.0 39.6 12.3 6.9 71 70 A T H X S+ 0 0 87 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.912 110.8 46.3 -62.3 -47.2 42.7 11.0 5.0 72 71 A A H X S+ 0 0 45 -4,-2.1 4,-1.7 -5,-0.2 -2,-0.2 0.903 114.9 46.2 -61.8 -45.7 40.7 8.1 3.7 73 72 A L H X S+ 0 0 16 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.894 110.4 53.6 -66.0 -35.7 37.7 10.3 2.8 74 73 A G H X S+ 0 0 3 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.888 105.7 53.5 -68.9 -35.4 39.9 12.8 1.1 75 74 A A H X S+ 0 0 45 -4,-1.9 4,-0.6 1,-0.2 -1,-0.2 0.932 111.5 47.4 -64.6 -35.2 41.5 10.0 -1.0 76 75 A I H ><>S+ 0 0 8 -4,-1.7 3,-1.4 1,-0.2 5,-0.5 0.933 110.5 49.0 -70.3 -52.2 38.0 9.1 -2.1 77 76 A L H ><5S+ 0 0 4 -4,-2.9 3,-2.0 1,-0.3 -1,-0.2 0.868 105.1 60.2 -57.3 -38.1 36.8 12.7 -2.9 78 77 A K H 3<5S+ 0 0 105 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.678 92.7 65.8 -68.3 -15.5 40.0 13.2 -5.0 79 78 A K T X<5S- 0 0 80 -3,-1.4 3,-1.8 -4,-0.6 -1,-0.3 0.499 97.2-140.7 -78.2 -12.7 39.0 10.4 -7.3 80 79 A K T < 5S- 0 0 62 -3,-2.0 -3,-0.1 1,-0.3 -2,-0.1 0.866 75.3 -35.4 56.5 36.3 36.0 12.4 -8.5 81 80 A G T 3 + 0 0 5 -2,-1.0 4,-2.2 1,-0.2 3,-0.4 0.223 18.6 119.1-119.0 20.8 36.6 5.3 -6.3 84 83 A E H > S+ 0 0 103 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.899 80.6 47.5 -54.8 -43.9 35.6 1.7 -6.7 85 84 A A H 4 S+ 0 0 72 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.863 112.4 48.3 -66.8 -43.4 39.1 0.5 -5.5 86 85 A E H > S+ 0 0 64 -3,-0.4 4,-0.9 1,-0.2 -1,-0.2 0.810 109.7 54.2 -64.4 -34.1 39.2 2.7 -2.5 87 86 A L H X S+ 0 0 1 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.819 91.5 73.2 -74.2 -32.0 35.7 1.8 -1.4 88 87 A K H X S+ 0 0 154 -4,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.928 101.1 38.3 -51.3 -53.2 36.2 -2.0 -1.4 89 88 A P H > S+ 0 0 79 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.867 117.2 51.8 -69.6 -33.6 38.2 -2.4 1.8 90 89 A L H X S+ 0 0 42 -4,-0.9 4,-2.5 2,-0.2 5,-0.2 0.912 111.0 47.5 -67.8 -45.9 36.3 0.4 3.6 91 90 A A H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 5,-0.3 0.922 112.0 51.2 -56.9 -47.1 33.0 -1.3 2.8 92 91 A Q H X>S+ 0 0 116 -4,-2.5 4,-2.7 -5,-0.3 5,-0.7 0.939 114.3 41.2 -60.8 -46.7 34.3 -4.7 3.9 93 92 A S H X>S+ 0 0 37 -4,-2.5 5,-2.9 1,-0.2 4,-1.2 0.927 117.8 46.5 -70.6 -35.6 35.6 -3.5 7.3 94 93 A H H <>S+ 0 0 52 -4,-2.5 6,-2.6 -5,-0.2 5,-0.5 0.862 118.9 41.6 -76.3 -26.7 32.5 -1.3 8.1 95 94 A A H <5S+ 0 0 3 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.927 130.1 20.5 -80.6 -46.5 30.1 -4.0 7.0 96 95 A T H <5S+ 0 0 81 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.851 131.5 30.1-102.2 -32.9 31.7 -7.1 8.6 97 96 A K T <> - 0 0 29 0, 0.0 3,-1.1 0, 0.0 4,-1.1 -0.195 23.2-115.2 -62.5 151.3 24.5 0.9 9.4 102 101 A I H >> S+ 0 0 22 52,-1.8 4,-2.0 1,-0.3 3,-0.6 0.879 114.0 68.3 -53.0 -42.4 24.1 3.3 6.6 103 102 A K H 3> S+ 0 0 111 51,-0.6 4,-1.9 1,-0.2 -1,-0.3 0.877 97.2 52.3 -47.2 -40.2 22.1 5.5 8.9 104 103 A Y H <> S+ 0 0 51 -3,-1.1 4,-2.0 1,-0.2 -1,-0.2 0.821 104.6 54.8 -72.3 -25.4 25.3 6.2 10.9 105 104 A L H < + 0 0 29 -4,-2.6 3,-1.4 -5,-0.3 4,-0.2 -0.303 59.8 149.8-129.8 59.0 34.6 27.9 6.1 121 120 A P G > S+ 0 0 85 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.813 76.4 55.6 -60.2 -37.1 31.5 30.1 5.5 122 121 A G G 3 S+ 0 0 75 1,-0.3 3,-0.3 -3,-0.1 -2,-0.1 0.748 117.1 34.7 -68.2 -31.0 33.2 31.9 2.7 123 122 A N G < S+ 0 0 57 -3,-1.4 -1,-0.3 1,-0.2 -109,-0.1 0.078 114.6 59.7-107.9 11.0 34.0 28.7 0.8 124 123 A F < + 0 0 4 -3,-1.1 -1,-0.2 -4,-0.2 -2,-0.1 -0.274 65.2 145.8-141.0 55.6 30.8 26.9 1.8 125 124 A G S > S- 0 0 42 -3,-0.3 4,-2.8 4,-0.0 5,-0.3 0.062 71.1 -75.0 -71.2-176.1 27.9 28.9 0.5 126 125 A A H > S+ 0 0 84 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.891 132.3 50.0 -58.1 -45.5 24.7 27.1 -0.7 127 126 A D H > S+ 0 0 134 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.918 113.2 46.7 -63.6 -42.8 26.2 25.9 -4.0 128 127 A A H > S+ 0 0 7 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.885 112.8 49.3 -67.8 -38.8 29.3 24.5 -2.3 129 128 A Q H X S+ 0 0 73 -4,-2.8 4,-3.0 1,-0.2 -1,-0.2 0.909 110.2 51.0 -66.4 -38.5 27.2 22.7 0.4 130 129 A G H X S+ 0 0 36 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.897 111.0 49.1 -63.1 -39.4 24.9 21.2 -2.3 131 130 A A H X S+ 0 0 2 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.932 112.7 46.9 -65.5 -48.0 28.0 20.0 -4.1 132 131 A M H X S+ 0 0 1 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.914 110.6 52.9 -60.4 -42.8 29.4 18.4 -0.9 133 132 A N H X S+ 0 0 55 -4,-3.0 4,-2.2 -5,-0.2 -1,-0.2 0.930 109.7 47.8 -57.8 -46.5 26.1 16.9 -0.1 134 133 A K H X S+ 0 0 56 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.893 110.8 52.1 -62.3 -40.7 26.0 15.3 -3.6 135 134 A A H X S+ 0 0 3 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.873 113.3 43.4 -63.1 -38.6 29.5 14.0 -3.2 136 135 A L H X S+ 0 0 2 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.832 112.4 53.2 -77.0 -33.2 28.7 12.4 0.2 137 136 A E H X S+ 0 0 79 -4,-2.2 4,-3.0 -5,-0.2 -2,-0.2 0.927 108.5 50.4 -62.6 -44.7 25.4 11.0 -1.2 138 137 A L H X S+ 0 0 9 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.910 111.1 49.4 -57.1 -51.9 27.4 9.4 -4.0 139 138 A F H X S+ 0 0 22 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.937 113.2 46.0 -51.8 -53.9 29.7 7.9 -1.4 140 139 A R H X S+ 0 0 35 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.900 112.2 50.1 -61.4 -38.8 26.8 6.6 0.7 141 140 A K H X S+ 0 0 84 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.917 113.6 46.2 -69.7 -37.1 24.9 5.1 -2.3 142 141 A D H X S+ 0 0 26 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.887 113.9 47.2 -71.4 -37.9 28.1 3.3 -3.5 143 142 A I H X S+ 0 0 3 -4,-2.7 4,-2.9 -5,-0.2 -1,-0.2 0.894 109.7 55.0 -70.4 -34.6 28.9 2.0 -0.1 144 143 A A H X S+ 0 0 19 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.893 107.1 50.1 -62.9 -40.1 25.3 0.8 0.3 145 144 A A H X S+ 0 0 40 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.873 112.1 47.5 -66.4 -35.5 25.6 -1.1 -2.9 146 145 A K H X S+ 0 0 49 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.901 106.5 57.7 -75.1 -35.9 28.8 -2.8 -1.7 147 146 A Y H X>S+ 0 0 0 -4,-2.9 5,-2.9 1,-0.2 4,-0.6 0.907 107.5 48.9 -54.3 -41.3 27.2 -3.6 1.7 148 147 A K H ><5S+ 0 0 147 -4,-1.7 3,-1.4 4,-0.2 -1,-0.2 0.913 109.4 49.7 -66.6 -46.1 24.5 -5.5 -0.2 149 148 A E H 3<5S+ 0 0 154 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.764 110.9 52.3 -63.3 -30.7 27.0 -7.4 -2.3 150 149 A L H 3<5S- 0 0 78 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.559 120.7-106.7 -82.6 -15.2 28.9 -8.3 0.9 151 150 A G T <<5S+ 0 0 74 -3,-1.4 -3,-0.2 -4,-0.6 -2,-0.1 0.534 97.1 87.8 99.5 15.4 25.8 -9.6 2.7 152 151 A Y < + 0 0 68 -5,-2.9 -4,-0.2 -6,-0.2 -5,-0.1 0.825 40.9 160.1-112.2 -48.0 25.2 -6.8 5.1 153 152 A Q 0 0 95 -6,-0.4 -9,-0.1 1,-0.2 -8,-0.1 0.690 360.0 360.0 13.8 107.7 23.0 -4.1 3.5 154 153 A G 0 0 48 -54,-0.1 -52,-1.8 -10,-0.1 -51,-0.6 -0.303 360.0 360.0 167.5 360.0 21.6 -2.3 6.6