==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN TRANSPORT 20-JUN-96 2MBW . COMPND 2 MOLECULE: MYOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSETER CATODON; . AUTHOR E.A.BRUCKER,G.N.PHILLIPS JR. . 154 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8206.0 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 . 4 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 13.0 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 88 0, 0.0 2,-0.4 0, 0.0 140,-0.0 0.000 360.0 360.0 360.0 161.8 24.4 9.8 -9.8 2 1 A V - 0 0 124 0, 0.0 2,-0.3 0, 0.0 79,-0.1 -0.998 360.0-143.6-136.4 133.3 27.1 11.8 -11.4 3 2 A L - 0 0 10 -2,-0.4 2,-0.1 77,-0.1 128,-0.0 -0.741 22.7-124.3 -91.3 148.6 28.7 15.1 -10.2 4 3 A S > - 0 0 63 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.413 26.9-108.7 -81.8 165.5 29.7 17.7 -12.8 5 4 A E H > S+ 0 0 108 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.858 121.9 58.3 -62.6 -34.2 33.3 19.0 -12.8 6 5 A G H > S+ 0 0 36 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.913 106.4 47.7 -61.9 -39.9 31.9 22.3 -11.4 7 6 A E H > S+ 0 0 51 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.945 111.2 49.8 -67.6 -45.5 30.5 20.4 -8.5 8 7 A W H X S+ 0 0 15 -4,-2.3 4,-3.2 1,-0.2 5,-0.3 0.882 107.4 56.4 -59.8 -37.7 33.8 18.5 -7.9 9 8 A Q H X S+ 0 0 129 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.911 106.9 48.0 -60.6 -43.6 35.7 21.9 -8.1 10 9 A L H X S+ 0 0 66 -4,-1.7 4,-1.7 2,-0.2 5,-0.2 0.911 114.3 47.5 -61.7 -40.5 33.5 23.3 -5.3 11 10 A V H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.954 114.7 44.0 -66.9 -50.1 34.1 20.2 -3.2 12 11 A L H X S+ 0 0 46 -4,-3.2 4,-1.8 1,-0.2 -2,-0.2 0.828 108.8 59.1 -69.8 -25.4 37.9 20.1 -3.8 13 12 A H H X S+ 0 0 94 -4,-2.4 4,-0.8 -5,-0.3 -1,-0.2 0.931 111.9 38.1 -68.2 -45.0 38.3 23.8 -3.2 14 13 A V H >X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 3,-0.7 0.895 112.9 58.1 -74.9 -30.4 36.8 23.6 0.4 15 14 A W H 3X S+ 0 0 5 -4,-2.2 4,-2.5 1,-0.3 -2,-0.2 0.869 97.6 61.2 -65.6 -31.3 38.6 20.3 1.0 16 15 A A H 3< S+ 0 0 53 -4,-1.8 4,-0.3 1,-0.2 -1,-0.3 0.848 105.9 47.7 -63.2 -31.3 42.0 22.1 0.2 17 16 A K H X< S+ 0 0 91 -4,-0.8 3,-1.5 -3,-0.7 4,-0.4 0.893 107.9 54.3 -74.7 -43.5 41.2 24.3 3.2 18 17 A V H >< S+ 0 0 1 -4,-1.9 3,-2.0 1,-0.3 7,-0.3 0.905 101.5 60.8 -54.1 -42.5 40.3 21.3 5.4 19 18 A E G >< S+ 0 0 82 -4,-2.5 3,-0.6 1,-0.3 -1,-0.3 0.635 86.1 74.2 -64.7 -11.3 43.7 19.9 4.5 20 19 A A G < S+ 0 0 91 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.760 118.1 15.3 -71.6 -19.8 45.5 22.9 6.1 21 20 A D G <> S+ 0 0 66 -3,-2.0 4,-2.1 -4,-0.4 -1,-0.3 -0.516 71.8 163.7-152.0 74.6 44.5 21.3 9.5 22 21 A V H <> S+ 0 0 37 -3,-0.6 4,-2.7 1,-0.2 5,-0.2 0.915 77.8 50.1 -63.8 -43.3 43.5 17.7 9.1 23 22 A A H > S+ 0 0 26 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.917 111.2 48.7 -64.4 -42.8 43.8 16.8 12.8 24 23 A G H > S+ 0 0 10 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.894 114.5 44.5 -63.4 -43.2 41.7 19.8 14.0 25 24 A H H X S+ 0 0 2 -4,-2.1 4,-2.3 -7,-0.3 -1,-0.2 0.898 111.8 54.2 -67.7 -39.5 38.9 19.1 11.5 26 25 A G H X S+ 0 0 1 -4,-2.7 4,-2.2 -5,-0.2 5,-0.2 0.907 110.1 47.0 -62.2 -39.6 39.0 15.4 12.3 27 26 A Q H X S+ 0 0 34 -4,-2.2 4,-2.7 -5,-0.2 5,-0.3 0.962 111.5 49.2 -66.1 -50.9 38.5 16.1 15.9 28 27 A D H X S+ 0 0 64 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.884 112.8 49.1 -57.3 -40.0 35.7 18.6 15.4 29 28 A I H X S+ 0 0 3 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.921 112.2 44.8 -67.3 -47.6 33.9 16.2 13.2 30 29 A L H X S+ 0 0 3 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.905 115.1 49.5 -66.6 -37.0 34.1 13.2 15.4 31 30 A I H X S+ 0 0 6 -4,-2.7 4,-2.4 -5,-0.2 5,-0.3 0.937 110.2 49.8 -67.1 -43.1 33.1 15.2 18.5 32 31 A R H X S+ 0 0 68 -4,-2.3 4,-2.7 -5,-0.3 5,-0.3 0.959 112.2 49.3 -59.0 -46.3 30.1 16.8 16.6 33 32 A L H X S+ 0 0 10 -4,-2.7 4,-2.3 1,-0.2 7,-0.2 0.929 113.0 46.4 -58.2 -47.4 29.0 13.2 15.6 34 33 A F H < S+ 0 0 4 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.793 115.6 45.4 -67.8 -31.9 29.3 11.9 19.2 35 34 A K H < S+ 0 0 107 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.892 118.2 41.6 -77.0 -45.1 27.5 14.8 20.8 36 35 A S H < S+ 0 0 44 -4,-2.7 -2,-0.2 -5,-0.3 -3,-0.2 0.760 132.3 21.4 -69.2 -35.7 24.7 14.9 18.2 37 36 A H >< + 0 0 32 -4,-2.3 3,-2.1 -5,-0.3 4,-0.4 -0.615 68.3 178.0-138.2 78.3 24.2 11.1 18.0 38 37 A P G >> S+ 0 0 76 0, 0.0 3,-1.3 0, 0.0 4,-0.6 0.721 74.3 72.2 -55.9 -25.4 25.6 9.6 21.2 39 38 A E G >4 S+ 0 0 65 1,-0.3 3,-1.1 2,-0.2 4,-0.4 0.853 87.3 64.9 -62.8 -29.5 24.6 6.1 20.1 40 39 A T G X4 S+ 0 0 4 -3,-2.1 3,-1.4 1,-0.3 4,-0.3 0.813 89.8 65.6 -65.5 -24.2 27.4 6.2 17.5 41 40 A L G X4 S+ 0 0 14 -3,-1.3 3,-1.8 -4,-0.4 6,-0.3 0.842 87.7 69.3 -66.4 -27.3 29.9 6.3 20.3 42 41 A E G << S+ 0 0 117 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.691 88.6 64.7 -62.7 -23.3 28.9 2.8 21.3 43 42 A K G < S+ 0 0 77 -3,-1.4 2,-0.9 -4,-0.4 -1,-0.3 0.661 89.9 72.9 -74.5 -16.7 30.5 1.4 18.1 44 43 A F X> - 0 0 49 -3,-1.8 4,-2.2 -4,-0.3 3,-2.0 -0.752 54.3-179.9-102.8 95.1 33.9 2.4 19.2 45 44 A D T 34 S+ 0 0 143 -2,-0.9 4,-0.2 1,-0.3 -1,-0.2 0.853 86.3 61.8 -62.5 -19.9 35.1 0.2 21.9 46 45 A R T 34 S+ 0 0 118 1,-0.2 -1,-0.3 -3,-0.1 15,-0.1 0.731 119.7 20.5 -75.4 -24.7 38.2 2.3 21.8 47 46 A F T X4 S+ 0 0 0 -3,-2.0 3,-2.5 -6,-0.3 -2,-0.2 0.450 86.9 108.5-123.9 -6.5 36.3 5.5 22.8 48 47 A K T 3< S+ 0 0 95 -4,-2.2 -3,-0.1 1,-0.3 -2,-0.1 0.640 76.8 60.5 -48.6 -20.2 33.1 4.3 24.4 49 48 A H T 3 S+ 0 0 123 -4,-0.2 2,-0.6 -3,-0.1 -1,-0.3 0.382 73.0 111.1 -90.9 -3.5 34.5 5.4 27.8 50 49 A L < + 0 0 14 -3,-2.5 3,-0.1 1,-0.2 -3,-0.0 -0.696 43.1 180.0 -76.0 118.9 34.8 9.1 26.9 51 50 A K + 0 0 174 -2,-0.6 2,-0.3 1,-0.1 -1,-0.2 0.766 54.4 26.4 -92.9 -33.0 32.1 10.9 28.9 52 51 A T S > S- 0 0 70 1,-0.1 4,-2.2 0, 0.0 5,-0.1 -0.880 76.9-109.2-130.4 170.1 32.3 14.6 28.1 53 52 A E H > S+ 0 0 67 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.857 118.8 59.6 -66.9 -31.8 33.5 16.8 25.3 54 53 A A H > S+ 0 0 72 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.929 106.5 46.1 -61.8 -44.0 36.4 17.8 27.4 55 54 A E H > S+ 0 0 79 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.897 111.6 52.4 -65.2 -40.3 37.5 14.2 27.6 56 55 A M H >< S+ 0 0 13 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.935 108.5 50.0 -60.2 -44.7 37.0 13.8 23.8 57 56 A K H 3< S+ 0 0 112 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.835 110.3 51.4 -63.8 -31.6 39.2 16.9 23.1 58 57 A A H 3< S+ 0 0 73 -4,-1.5 2,-0.6 -5,-0.2 -1,-0.3 0.611 84.3 107.1 -82.8 -10.4 41.9 15.6 25.3 59 58 A S S+ 0 0 113 -2,-0.6 4,-2.2 1,-0.2 -1,-0.2 0.826 89.8 55.9 -68.4 -34.7 45.2 11.8 21.5 61 60 A D H > S+ 0 0 69 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.888 105.5 48.2 -64.1 -46.8 43.7 8.6 20.2 62 61 A L H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.881 112.0 51.9 -61.7 -39.9 40.4 10.2 19.0 63 62 A K H X S+ 0 0 45 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.918 108.7 49.1 -64.1 -43.8 42.5 12.9 17.3 64 63 A K H X S+ 0 0 122 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.911 111.6 50.2 -62.3 -42.5 44.6 10.3 15.5 65 64 A H H X S+ 0 0 38 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.874 105.1 56.2 -64.0 -39.7 41.5 8.4 14.4 66 65 A G H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.884 107.1 50.4 -58.2 -39.1 40.0 11.6 13.0 67 66 A V H X S+ 0 0 47 -4,-1.6 4,-2.5 2,-0.2 5,-0.2 0.925 109.8 50.5 -64.6 -43.9 43.1 12.1 10.9 68 67 A T H X S+ 0 0 86 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.922 111.8 48.0 -58.8 -43.9 42.7 8.5 9.6 69 68 A V H X S+ 0 0 38 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.943 115.1 43.3 -63.6 -48.1 39.0 9.1 8.8 70 69 A L H X S+ 0 0 4 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.839 111.5 53.4 -71.3 -32.5 39.6 12.3 6.9 71 70 A T H X S+ 0 0 86 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.926 112.1 45.9 -65.6 -44.6 42.7 11.0 5.1 72 71 A A H X S+ 0 0 42 -4,-2.2 4,-1.6 -5,-0.2 -2,-0.2 0.919 115.6 46.0 -63.0 -42.1 40.6 8.1 3.8 73 72 A L H X S+ 0 0 16 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.911 110.7 53.3 -67.8 -40.7 37.7 10.3 2.8 74 73 A G H X S+ 0 0 3 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.900 105.9 53.1 -61.4 -39.8 40.0 12.8 1.2 75 74 A A H X S+ 0 0 47 -4,-2.0 4,-0.5 2,-0.2 -1,-0.2 0.898 111.4 47.4 -63.6 -36.9 41.5 10.0 -1.0 76 75 A I H ><>S+ 0 0 7 -4,-1.6 3,-1.5 1,-0.2 5,-0.5 0.960 111.4 49.0 -70.1 -48.2 38.0 9.1 -2.1 77 76 A L H ><5S+ 0 0 4 -4,-2.9 3,-2.1 1,-0.3 -2,-0.2 0.881 104.7 58.9 -60.6 -37.1 36.9 12.6 -2.9 78 77 A K H 3<5S+ 0 0 105 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.659 94.1 66.3 -68.3 -15.3 40.1 13.3 -4.9 79 78 A K T X<5S- 0 0 79 -3,-1.5 3,-1.8 -4,-0.5 -1,-0.3 0.531 97.9-141.9 -77.8 -13.3 39.1 10.4 -7.2 80 79 A K T < 5S- 0 0 65 -3,-2.1 -3,-0.1 1,-0.3 -2,-0.1 0.872 74.0 -35.1 53.6 43.8 36.1 12.4 -8.3 81 80 A G T 3 + 0 0 4 -2,-1.1 4,-2.1 1,-0.2 3,-0.4 0.166 18.4 118.0-117.9 16.2 36.6 5.4 -6.2 84 83 A E H > S+ 0 0 113 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.911 79.6 49.9 -51.6 -44.5 35.7 1.7 -6.5 85 84 A A H 4 S+ 0 0 68 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.865 112.9 45.9 -63.4 -40.2 39.1 0.5 -5.5 86 85 A E H > S+ 0 0 63 -3,-0.4 4,-0.7 1,-0.2 -1,-0.2 0.781 110.3 55.2 -70.9 -32.5 39.3 2.7 -2.4 87 86 A L H X S+ 0 0 4 -4,-2.1 4,-3.0 1,-0.2 5,-0.3 0.813 92.8 71.7 -71.4 -33.3 35.7 1.8 -1.4 88 87 A K H X S+ 0 0 123 -4,-1.7 4,-2.3 1,-0.2 5,-0.2 0.925 101.1 38.1 -52.8 -55.4 36.2 -2.0 -1.3 89 88 A P H > S+ 0 0 81 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.862 117.7 52.6 -69.0 -28.1 38.3 -2.4 1.8 90 89 A L H X S+ 0 0 39 -4,-0.7 4,-2.3 2,-0.2 5,-0.2 0.911 110.2 46.8 -70.9 -43.4 36.4 0.3 3.6 91 90 A A H X S+ 0 0 0 -4,-3.0 4,-2.3 2,-0.2 5,-0.3 0.922 112.1 52.3 -65.0 -39.7 33.0 -1.3 2.8 92 91 A Q H X>S+ 0 0 114 -4,-2.3 4,-2.5 -5,-0.3 5,-0.6 0.947 112.8 41.9 -64.7 -47.1 34.3 -4.7 3.9 93 92 A S H X>S+ 0 0 33 -4,-2.4 5,-2.6 1,-0.2 4,-1.4 0.918 117.9 45.9 -68.3 -38.9 35.6 -3.6 7.3 94 93 A H H <5S+ 0 0 54 -4,-2.3 6,-2.7 -5,-0.2 5,-0.3 0.808 119.0 41.2 -75.4 -27.3 32.6 -1.4 8.1 95 94 A A H <5S+ 0 0 3 -4,-2.3 -2,-0.2 4,-0.2 -3,-0.2 0.915 130.3 22.8 -81.6 -41.9 30.1 -4.0 7.0 96 95 A T H <5S+ 0 0 79 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.836 132.2 27.1 -98.2 -41.1 31.8 -7.1 8.5 97 96 A K T <> - 0 0 27 0, 0.0 3,-1.2 0, 0.0 4,-1.0 -0.261 21.2-117.1 -67.1 150.7 24.7 0.9 9.5 102 101 A I H >> S+ 0 0 22 1,-0.3 4,-1.8 2,-0.2 3,-0.8 0.863 114.2 68.1 -52.9 -36.6 24.2 3.3 6.6 103 102 A K H 3> S+ 0 0 116 51,-0.4 4,-1.9 1,-0.3 -1,-0.3 0.880 97.8 51.4 -52.1 -39.5 22.2 5.5 9.0 104 103 A Y H <> S+ 0 0 48 -3,-1.2 4,-2.0 1,-0.2 -1,-0.3 0.776 104.5 55.8 -71.8 -27.3 25.4 6.3 10.9 105 104 A L H < + 0 0 29 -4,-2.6 3,-1.7 -5,-0.3 4,-0.4 -0.327 60.9 152.2-130.6 55.8 34.7 27.9 6.1 121 120 A P G > S+ 0 0 89 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.863 76.2 52.9 -55.7 -36.5 31.7 30.2 5.6 122 121 A G G 3 S+ 0 0 73 1,-0.3 3,-0.2 -3,-0.1 -5,-0.1 0.655 117.5 35.8 -74.3 -19.3 33.2 32.0 2.7 123 122 A N G < S+ 0 0 57 -3,-1.7 -1,-0.3 -7,-0.2 -109,-0.1 0.125 113.0 62.1-114.5 12.1 34.0 28.8 0.8 124 123 A F < + 0 0 4 -3,-1.0 -1,-0.1 -4,-0.4 -2,-0.1 -0.294 66.1 146.1-138.0 56.5 30.9 27.0 1.9 125 124 A G > - 0 0 41 -3,-0.2 4,-2.5 1,-0.0 5,-0.2 -0.016 69.6 -76.0 -74.1-172.1 28.0 28.9 0.5 126 125 A A H > S+ 0 0 85 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.903 131.4 47.7 -58.2 -45.0 24.8 27.2 -0.7 127 126 A D H > S+ 0 0 136 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.920 112.9 47.8 -66.2 -43.8 26.2 25.9 -3.9 128 127 A A H > S+ 0 0 8 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.895 112.8 49.7 -63.9 -38.7 29.4 24.5 -2.4 129 128 A Q H X S+ 0 0 72 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.893 109.1 52.1 -66.4 -40.4 27.3 22.8 0.4 130 129 A G H X S+ 0 0 37 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.914 111.2 47.8 -60.6 -39.9 25.0 21.3 -2.3 131 130 A A H X S+ 0 0 3 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.915 112.5 47.9 -67.7 -43.6 28.0 19.9 -4.1 132 131 A M H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.914 111.1 50.6 -63.3 -42.2 29.5 18.5 -0.9 133 132 A N H X S+ 0 0 53 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.923 110.3 50.3 -62.0 -39.9 26.2 16.9 0.1 134 133 A K H X S+ 0 0 56 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.903 109.9 50.5 -64.2 -40.0 26.0 15.4 -3.5 135 134 A A H X S+ 0 0 3 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.899 113.3 45.1 -66.4 -39.1 29.5 13.9 -3.1 136 135 A L H X S+ 0 0 2 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.822 110.8 53.2 -73.5 -34.3 28.7 12.4 0.3 137 136 A E H X S+ 0 0 79 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.895 109.6 49.5 -64.0 -41.2 25.4 11.0 -1.0 138 137 A L H X S+ 0 0 10 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.948 110.5 50.5 -61.3 -47.8 27.3 9.4 -3.9 139 138 A F H X S+ 0 0 21 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.931 113.2 45.5 -53.7 -49.1 29.8 7.9 -1.4 140 139 A R H X S+ 0 0 36 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.868 111.7 51.4 -64.5 -39.7 26.9 6.5 0.8 141 140 A K H X S+ 0 0 84 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.931 112.9 45.1 -65.1 -44.6 25.0 5.1 -2.2 142 141 A D H X S+ 0 0 46 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.883 113.8 48.9 -68.1 -36.5 28.1 3.3 -3.4 143 142 A I H X S+ 0 0 4 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.907 109.9 53.0 -68.3 -40.7 29.0 2.0 0.0 144 143 A A H X S+ 0 0 22 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.908 107.9 50.4 -60.4 -41.4 25.4 0.8 0.5 145 144 A A H X S+ 0 0 48 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.891 111.5 48.4 -65.6 -38.2 25.6 -1.1 -2.8 146 145 A K H X S+ 0 0 50 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.886 106.0 57.3 -68.2 -39.3 28.8 -2.7 -1.6 147 146 A Y H X>S+ 0 0 1 -4,-2.6 5,-2.5 1,-0.2 4,-0.6 0.938 106.3 50.8 -54.4 -44.6 27.3 -3.6 1.7 148 147 A K H ><5S+ 0 0 154 -4,-1.9 3,-1.4 1,-0.2 -1,-0.2 0.929 109.1 49.0 -61.4 -45.2 24.6 -5.5 -0.2 149 148 A E H 3<5S+ 0 0 136 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.831 111.4 51.6 -64.3 -31.5 27.1 -7.5 -2.2 150 149 A L H 3<5S- 0 0 73 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.482 121.3-106.5 -84.6 -6.7 29.0 -8.3 1.0 151 150 A G T <<5S+ 0 0 72 -3,-1.4 -3,-0.2 -4,-0.6 -2,-0.1 0.580 98.0 81.1 95.3 14.3 25.9 -9.6 2.7 152 151 A Y < + 0 0 72 -5,-2.5 -4,-0.2 -6,-0.2 -5,-0.1 0.779 41.2 173.5-113.8 -55.5 25.2 -6.8 5.2 153 152 A Q 0 0 86 -6,-0.2 -5,-0.1 1,-0.2 -51,-0.1 0.820 360.0 360.0 43.6 29.2 23.3 -3.9 3.6 154 153 A G 0 0 36 -54,-0.1 -51,-0.4 -53,-0.1 -1,-0.2 0.723 360.0 360.0 -57.7 360.0 23.2 -2.7 7.2