==== 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 2SPO . 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) . 8052.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 126 81.8 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 . 4 2.6 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 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 90 0, 0.0 2,-0.4 0, 0.0 140,-0.0 0.000 360.0 360.0 360.0 162.9 24.5 9.6 -9.8 2 1 A V - 0 0 124 0, 0.0 2,-0.3 0, 0.0 79,-0.1 -0.999 360.0-144.3-143.3 125.7 27.2 11.7 -11.4 3 2 A L - 0 0 9 -2,-0.4 2,-0.1 77,-0.1 128,-0.0 -0.697 23.2-122.6 -83.4 153.2 28.6 15.0 -10.3 4 3 A S > - 0 0 63 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.477 28.0-106.4 -85.5 168.4 29.6 17.6 -12.9 5 4 A E H > S+ 0 0 106 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.917 121.5 56.6 -62.3 -32.9 33.2 18.9 -13.0 6 5 A G H > S+ 0 0 44 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.917 106.9 47.9 -67.4 -35.5 31.9 22.2 -11.5 7 6 A E H > S+ 0 0 55 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.917 111.1 50.8 -69.5 -42.7 30.4 20.4 -8.5 8 7 A W H X S+ 0 0 15 -4,-2.4 4,-3.2 1,-0.2 5,-0.3 0.933 107.1 55.3 -61.7 -35.5 33.7 18.5 -8.0 9 8 A Q H X S+ 0 0 98 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.909 107.1 49.2 -65.0 -37.0 35.6 21.8 -8.1 10 9 A L H X S+ 0 0 66 -4,-1.7 4,-1.8 2,-0.2 5,-0.2 0.928 113.3 47.0 -67.6 -33.9 33.4 23.2 -5.3 11 10 A V H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.957 115.6 43.9 -74.0 -43.5 34.0 20.1 -3.2 12 11 A L H X S+ 0 0 38 -4,-3.2 4,-1.9 1,-0.2 -2,-0.2 0.876 108.1 59.4 -78.4 -15.3 37.8 20.0 -3.8 13 12 A H H X S+ 0 0 91 -4,-2.4 4,-1.0 -5,-0.3 -1,-0.2 0.960 112.0 38.8 -75.8 -38.8 38.1 23.7 -3.3 14 13 A V H X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 3,-0.4 0.896 112.0 58.0 -77.7 -32.0 36.7 23.5 0.2 15 14 A W H X S+ 0 0 5 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.872 97.6 61.7 -64.1 -30.9 38.5 20.2 0.9 16 15 A A H < S+ 0 0 56 -4,-1.9 4,-0.4 1,-0.3 -1,-0.2 0.872 105.7 47.8 -65.8 -26.8 41.9 22.0 0.2 17 16 A K H >< S+ 0 0 88 -4,-1.0 3,-1.0 -3,-0.4 4,-0.3 0.869 107.8 53.5 -75.4 -46.7 41.1 24.3 3.1 18 17 A V H >< S+ 0 0 1 -4,-1.8 3,-1.9 1,-0.2 7,-0.3 0.875 102.3 61.1 -51.6 -45.1 40.2 21.4 5.4 19 18 A E G >< S+ 0 0 79 -4,-2.2 3,-0.6 1,-0.3 -1,-0.2 0.720 85.9 73.8 -64.6 -5.9 43.6 19.8 4.5 20 19 A A G < S+ 0 0 89 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.754 117.2 17.6 -77.4 -17.2 45.4 22.8 6.0 21 20 A D G <> S+ 0 0 65 -3,-1.9 4,-2.4 -4,-0.3 -1,-0.3 -0.456 71.8 163.4-149.7 73.9 44.4 21.3 9.4 22 21 A V H <> S+ 0 0 38 -3,-0.6 4,-2.8 1,-0.2 5,-0.2 0.926 78.0 48.6 -63.0 -43.4 43.5 17.7 9.1 23 22 A A H > S+ 0 0 32 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.899 111.6 49.0 -66.2 -40.6 43.8 16.8 12.7 24 23 A G H > S+ 0 0 12 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.928 115.2 44.1 -64.8 -42.7 41.7 19.8 13.9 25 24 A H H X S+ 0 0 2 -4,-2.4 4,-2.3 -7,-0.3 -2,-0.2 0.904 112.1 52.8 -69.5 -39.1 38.9 19.1 11.4 26 25 A G H X S+ 0 0 0 -4,-2.8 4,-2.1 -5,-0.3 5,-0.3 0.893 110.6 48.2 -64.2 -39.2 38.9 15.4 12.2 27 26 A Q H X S+ 0 0 40 -4,-2.1 4,-2.3 -5,-0.2 5,-0.3 0.966 111.6 48.5 -64.4 -49.2 38.6 16.1 15.9 28 27 A D H X S+ 0 0 62 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.909 113.3 48.3 -57.0 -44.4 35.7 18.6 15.4 29 28 A I H X S+ 0 0 2 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.924 112.6 45.1 -64.3 -49.6 33.8 16.2 13.1 30 29 A V H X S+ 0 0 5 -4,-2.1 4,-2.4 1,-0.2 5,-0.2 0.917 115.8 47.3 -65.6 -35.5 34.1 13.0 15.3 31 30 A I H X S+ 0 0 5 -4,-2.3 4,-2.9 -5,-0.3 5,-0.3 0.916 109.9 53.0 -70.1 -40.3 33.1 14.9 18.4 32 31 A R H X S+ 0 0 66 -4,-2.1 4,-2.6 -5,-0.3 5,-0.3 0.956 110.3 49.3 -58.1 -44.0 30.2 16.6 16.6 33 32 A L H X S+ 0 0 11 -4,-2.6 4,-1.8 1,-0.2 7,-0.3 0.916 113.3 44.9 -60.2 -52.9 29.1 13.1 15.6 34 33 A F H < S+ 0 0 4 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.858 115.0 47.8 -62.7 -34.6 29.3 11.7 19.2 35 34 A K H < S+ 0 0 90 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.909 118.6 39.2 -70.8 -50.7 27.7 14.7 20.7 36 35 A S H < S+ 0 0 40 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.670 132.3 23.4 -60.5 -51.7 24.8 14.8 18.3 37 36 A H >< + 0 0 28 -4,-1.8 3,-2.7 -5,-0.3 4,-0.4 -0.438 68.0 176.8-121.3 85.9 24.2 11.1 18.0 38 37 A P G >> S+ 0 0 75 0, 0.0 3,-1.3 0, 0.0 4,-0.8 0.719 73.0 73.5 -64.6 -25.0 25.6 9.6 21.1 39 38 A E G >4 S+ 0 0 78 1,-0.3 3,-0.7 2,-0.2 4,-0.3 0.884 87.0 64.5 -62.3 -20.6 24.5 6.1 20.1 40 39 A T G X4 S+ 0 0 4 -3,-2.7 3,-1.6 -7,-0.3 4,-0.3 0.826 89.5 66.5 -72.3 -24.0 27.3 6.1 17.5 41 40 A L G X4 S+ 0 0 16 -3,-1.3 3,-2.5 -4,-0.4 6,-0.3 0.905 87.8 67.6 -63.9 -29.2 29.9 6.2 20.3 42 41 A E G << S+ 0 0 117 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.574 89.2 66.0 -63.5 -24.0 28.8 2.7 21.4 43 42 A K G < S+ 0 0 82 -3,-1.6 2,-0.9 -4,-0.3 -1,-0.3 0.617 89.5 72.8 -72.7 -13.6 30.2 1.3 18.1 44 43 A F X> - 0 0 54 -3,-2.5 4,-1.7 -4,-0.3 3,-1.5 -0.792 56.5-176.6-103.9 99.1 33.7 2.3 19.2 45 44 A D T 34 S+ 0 0 121 -2,-0.9 3,-0.3 1,-0.3 4,-0.3 0.932 86.3 60.4 -61.1 -23.1 35.0 -0.0 21.9 46 45 A R T 34 S+ 0 0 116 1,-0.2 -1,-0.3 -3,-0.2 15,-0.1 0.594 118.5 21.9 -67.6 -41.3 38.0 2.2 21.9 47 46 A F T X4 S+ 0 0 1 -3,-1.5 3,-2.0 -6,-0.3 -1,-0.2 0.359 88.5 103.1-110.9 3.0 36.3 5.4 22.8 48 47 A K T 3< S+ 0 0 88 -4,-1.7 -2,-0.1 -3,-0.3 -3,-0.1 0.632 74.4 64.2 -68.7 -14.9 33.0 4.4 24.5 49 48 A H T 3 S+ 0 0 125 -4,-0.3 2,-0.5 -8,-0.1 -1,-0.3 0.493 75.1 110.5 -74.4 -21.3 34.3 5.2 28.0 50 49 A L < - 0 0 16 -3,-2.0 -3,-0.1 1,-0.2 3,-0.0 -0.578 44.2-179.9 -57.7 127.3 34.6 8.9 27.1 51 50 A K + 0 0 171 -2,-0.5 2,-0.3 1,-0.1 -1,-0.2 0.725 53.7 31.6-102.4 -35.1 32.0 10.7 29.0 52 51 A T S > S- 0 0 70 1,-0.1 4,-2.1 0, 0.0 3,-0.2 -0.937 74.9-112.9-123.5 172.0 32.3 14.4 28.2 53 52 A E H > S+ 0 0 73 -2,-0.3 4,-2.9 1,-0.3 5,-0.2 0.888 117.8 57.3 -71.7 -27.0 33.3 16.6 25.3 54 53 A A H > S+ 0 0 68 1,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.919 106.3 48.0 -71.6 -38.0 36.3 17.7 27.3 55 54 A E H > S+ 0 0 83 2,-0.2 4,-0.7 -3,-0.2 -1,-0.3 0.888 111.5 51.7 -65.3 -39.1 37.5 14.1 27.6 56 55 A M H >< S+ 0 0 12 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.959 109.3 49.8 -60.9 -40.6 37.0 13.7 23.9 57 56 A K H 3< S+ 0 0 117 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.841 110.2 51.1 -67.1 -33.9 39.0 16.8 23.1 58 57 A A H 3< S+ 0 0 79 -4,-1.8 2,-0.8 -5,-0.2 -1,-0.3 0.612 84.8 103.7 -83.4 -4.0 41.8 15.6 25.3 59 58 A S S+ 0 0 134 -2,-0.8 4,-2.1 1,-0.2 -1,-0.2 0.796 88.6 57.5 -68.8 -41.4 45.1 11.9 21.5 61 60 A D H > S+ 0 0 70 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.845 105.2 49.1 -51.4 -52.2 43.8 8.6 20.3 62 61 A L H > S+ 0 0 0 2,-0.2 4,-2.3 -6,-0.2 -2,-0.2 0.896 110.8 50.7 -57.1 -40.2 40.5 10.1 19.1 63 62 A K H X S+ 0 0 46 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.930 109.1 51.5 -66.3 -37.9 42.3 12.8 17.3 64 63 A K H X S+ 0 0 123 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.942 109.3 49.8 -66.7 -38.4 44.5 10.2 15.6 65 64 A H H X S+ 0 0 43 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.873 106.3 56.1 -66.7 -36.4 41.4 8.3 14.5 66 65 A G H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.887 106.1 51.3 -62.1 -38.3 39.8 11.5 13.1 67 66 A V H X S+ 0 0 46 -4,-1.7 4,-2.5 2,-0.2 5,-0.2 0.919 109.2 50.3 -64.3 -44.1 42.9 12.0 10.9 68 67 A T H X S+ 0 0 66 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.913 111.3 49.5 -57.6 -44.5 42.6 8.4 9.6 69 68 A V H X S+ 0 0 40 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.969 114.4 42.6 -61.5 -49.1 38.9 9.0 8.8 70 69 A L H X S+ 0 0 2 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.827 111.4 54.2 -71.0 -34.6 39.5 12.3 6.9 71 70 A T H X S+ 0 0 87 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.906 111.4 45.6 -61.4 -46.1 42.6 11.0 5.1 72 71 A A H X S+ 0 0 43 -4,-2.0 4,-1.5 -5,-0.2 -2,-0.2 0.908 115.7 46.7 -63.7 -38.7 40.6 8.0 3.8 73 72 A L H X S+ 0 0 15 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.921 110.1 53.2 -68.7 -41.0 37.6 10.3 2.8 74 73 A G H X S+ 0 0 1 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.893 106.3 53.8 -58.5 -43.3 39.9 12.8 1.2 75 74 A A H X S+ 0 0 46 -4,-2.0 4,-0.6 2,-0.2 -1,-0.2 0.921 111.0 46.6 -62.9 -30.0 41.4 10.0 -0.9 76 75 A I H ><>S+ 0 0 8 -4,-1.5 3,-1.5 1,-0.2 5,-0.5 0.964 110.9 49.6 -78.9 -43.4 37.9 9.0 -2.1 77 76 A L H ><5S+ 0 0 3 -4,-2.8 3,-2.1 1,-0.3 -1,-0.2 0.902 104.4 59.5 -65.3 -32.7 36.8 12.5 -2.9 78 77 A K H 3<5S+ 0 0 103 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.686 93.6 66.2 -71.7 -12.1 39.9 13.2 -4.9 79 78 A K T X<5S- 0 0 76 -3,-1.5 3,-2.0 -4,-0.6 -1,-0.3 0.458 98.8-140.8 -76.9 -18.1 39.0 10.3 -7.3 80 79 A K T < 5S- 0 0 63 -3,-2.1 -3,-0.1 1,-0.3 -2,-0.1 0.878 73.4 -35.0 60.8 40.9 36.0 12.4 -8.4 81 80 A G T 3 + 0 0 4 -2,-1.3 4,-2.1 1,-0.2 3,-0.4 0.085 17.0 122.8-122.0 10.9 36.6 5.3 -6.3 84 83 A E H > S+ 0 0 119 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.913 79.6 47.1 -40.2 -43.9 35.6 1.7 -6.7 85 84 A A H 4 S+ 0 0 67 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.829 111.3 49.3 -71.3 -43.3 39.0 0.4 -5.4 86 85 A E H > S+ 0 0 63 -3,-0.4 4,-0.7 1,-0.2 -1,-0.2 0.767 109.7 54.0 -62.4 -34.4 39.2 2.7 -2.4 87 86 A L H X S+ 0 0 6 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.801 92.4 72.0 -71.1 -31.5 35.6 1.8 -1.4 88 87 A K H X S+ 0 0 128 -4,-1.4 4,-2.2 1,-0.2 5,-0.2 0.931 101.2 38.9 -54.4 -55.6 36.1 -2.0 -1.3 89 88 A P H > S+ 0 0 80 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.834 117.6 52.2 -64.9 -32.3 38.2 -2.4 1.8 90 89 A L H X S+ 0 0 41 -4,-0.7 4,-2.5 2,-0.2 5,-0.2 0.931 110.5 46.1 -70.6 -40.8 36.2 0.3 3.6 91 90 A A H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 5,-0.4 0.944 112.5 52.3 -69.1 -38.0 32.9 -1.3 2.9 92 91 A Q H X>S+ 0 0 116 -4,-2.2 4,-2.5 -5,-0.3 5,-0.6 0.954 113.2 41.7 -67.5 -43.2 34.2 -4.7 4.0 93 92 A S H X>S+ 0 0 25 -4,-2.2 5,-2.3 1,-0.2 4,-1.4 0.940 117.8 46.0 -72.2 -34.5 35.5 -3.5 7.3 94 93 A H H <5S+ 0 0 52 -4,-2.5 6,-2.9 -5,-0.2 -1,-0.2 0.827 119.8 39.9 -79.3 -26.1 32.6 -1.3 8.2 95 94 A A H <5S+ 0 0 2 -4,-2.4 4,-0.2 -5,-0.2 -3,-0.2 0.953 129.8 24.6 -85.7 -33.6 30.0 -4.0 7.1 96 95 A T H <5S+ 0 0 79 -4,-2.5 -3,-0.2 -5,-0.4 -2,-0.2 0.825 131.7 26.9-101.3 -43.7 31.7 -7.1 8.5 97 96 A K T <> - 0 0 27 0, 0.0 3,-1.1 0, 0.0 4,-0.9 -0.267 21.2-116.9 -71.3 149.2 24.5 0.9 9.5 102 101 A I H >> S+ 0 0 21 52,-1.3 4,-1.9 1,-0.3 3,-0.8 0.850 113.9 66.8 -53.3 -36.4 24.1 3.2 6.6 103 102 A K H 3> S+ 0 0 116 51,-0.6 4,-1.9 1,-0.3 -1,-0.3 0.896 97.9 53.2 -56.1 -33.2 22.1 5.5 8.9 104 103 A Y H <> S+ 0 0 46 -3,-1.1 4,-1.9 1,-0.2 -1,-0.3 0.768 103.8 55.0 -73.0 -28.0 25.3 6.2 10.8 105 104 A L H < + 0 0 28 -4,-2.3 3,-1.3 -5,-0.2 4,-0.3 -0.313 61.8 152.1-126.4 53.9 34.6 27.9 6.1 121 120 A P G > S+ 0 0 87 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.908 76.5 52.4 -53.8 -39.0 31.5 30.1 5.6 122 121 A G G 3 S+ 0 0 73 1,-0.3 3,-0.3 -3,-0.1 -5,-0.1 0.767 117.8 35.4 -72.3 -27.6 33.0 32.0 2.7 123 122 A N G < S+ 0 0 61 -3,-1.3 -1,-0.3 1,-0.2 -109,-0.1 0.094 113.6 60.9-103.8 4.4 33.9 28.8 0.8 124 123 A F < + 0 0 3 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.1 -0.355 66.9 145.4-128.8 52.6 30.9 26.9 1.8 125 124 A G S > S- 0 0 43 -3,-0.3 4,-2.4 1,-0.0 5,-0.3 -0.192 70.0 -74.3 -69.8-167.3 27.9 28.8 0.6 126 125 A A H > S+ 0 0 84 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.883 130.7 48.3 -64.5 -44.1 24.7 27.0 -0.6 127 126 A D H > S+ 0 0 133 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.918 113.0 47.1 -65.2 -43.7 26.1 25.8 -3.9 128 127 A A H > S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.856 112.9 50.8 -63.4 -39.3 29.3 24.4 -2.4 129 128 A Q H X S+ 0 0 71 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.887 108.7 51.2 -64.4 -41.6 27.2 22.7 0.3 130 129 A G H X S+ 0 0 35 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.895 110.7 48.7 -59.5 -44.5 24.9 21.2 -2.2 131 130 A A H X S+ 0 0 3 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.930 112.4 47.7 -63.2 -38.9 27.9 19.8 -4.1 132 131 A M H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.886 111.7 51.0 -65.2 -42.7 29.5 18.4 -0.9 133 132 A N H X S+ 0 0 52 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.935 110.2 49.1 -61.1 -41.3 26.1 16.9 -0.0 134 133 A K H X S+ 0 0 56 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.901 110.9 50.8 -62.7 -43.0 25.9 15.3 -3.5 135 134 A A H X S+ 0 0 3 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.948 113.3 44.6 -63.6 -38.1 29.5 13.9 -3.2 136 135 A L H X S+ 0 0 2 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.841 111.7 52.6 -76.4 -33.1 28.6 12.4 0.2 137 136 A E H X S+ 0 0 77 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.901 109.3 50.1 -63.7 -41.1 25.3 11.0 -1.0 138 137 A L H X S+ 0 0 10 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.920 110.9 49.8 -58.4 -51.3 27.2 9.4 -3.9 139 138 A F H X S+ 0 0 22 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.930 112.7 46.4 -51.4 -53.7 29.7 7.9 -1.4 140 139 A R H X S+ 0 0 34 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.845 112.0 50.7 -60.3 -40.3 26.8 6.5 0.8 141 140 A K H X S+ 0 0 84 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.921 112.7 45.2 -66.0 -43.6 25.0 5.1 -2.2 142 141 A D H X S+ 0 0 45 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.892 114.5 48.9 -68.4 -36.2 28.1 3.3 -3.5 143 142 A I H X S+ 0 0 3 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 0.873 109.9 51.9 -68.2 -43.2 28.9 2.0 -0.1 144 143 A A H X S+ 0 0 21 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.884 108.0 51.7 -60.3 -37.6 25.3 0.8 0.4 145 144 A A H X S+ 0 0 46 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.925 111.5 47.3 -66.2 -36.5 25.5 -1.1 -2.8 146 145 A K H X S+ 0 0 48 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.906 106.4 57.1 -70.2 -39.4 28.7 -2.8 -1.7 147 146 A Y H X>S+ 0 0 1 -4,-2.6 5,-2.7 1,-0.2 4,-0.6 0.920 107.0 50.8 -53.9 -46.8 27.2 -3.6 1.7 148 147 A K H ><5S+ 0 0 101 -4,-2.0 3,-1.4 1,-0.2 -1,-0.2 0.945 109.3 48.2 -53.9 -54.7 24.5 -5.5 -0.2 149 148 A E H 3<5S+ 0 0 127 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.849 111.9 52.0 -57.5 -30.5 27.0 -7.5 -2.3 150 149 A L H 3<5S- 0 0 71 -4,-2.3 -1,-0.3 2,-0.1 -2,-0.2 0.480 119.7-109.7 -82.5 -18.1 28.9 -8.3 1.0 151 150 A G T <<5S+ 0 0 70 -3,-1.4 2,-0.4 -4,-0.6 -3,-0.2 0.571 76.7 122.2 100.0 21.9 25.7 -9.5 2.7 152 151 A Y < - 0 0 51 -5,-2.7 2,-0.4 -6,-0.2 -1,-0.3 -0.842 58.2-134.3-120.7 124.1 25.2 -6.8 5.2 153 152 A Q 0 0 121 -2,-0.4 -9,-0.0 -58,-0.1 -5,-0.0 -0.722 360.0 360.0 -71.7 128.3 22.1 -4.8 5.4 154 153 A G 0 0 30 -2,-0.4 -52,-1.3 -53,-0.1 -51,-0.6 -0.226 360.0 360.0 -59.7 360.0 23.1 -1.2 5.8