==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN TRANSPORT 13-DEC-97 101M . COMPND 2 MOLECULE: MYOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSETER CATODON; . AUTHOR R.D.SMITH,J.S.OLSON,G.N.PHILLIPS JR. . 154 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8287.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 122 79.2 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 . 2 1.3 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 . 95 61.7 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 2 0 0 0 0 0 1 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 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,-0.3 0, 0.0 140,-0.0 0.000 360.0 360.0 360.0 158.1 24.4 9.9 -9.9 2 1 A V - 0 0 122 0, 0.0 2,-0.3 0, 0.0 79,-0.1 -0.999 360.0-139.4-144.9 137.5 27.3 11.9 -11.4 3 2 A L - 0 0 12 -2,-0.3 2,-0.1 77,-0.1 128,-0.0 -0.700 21.5-123.2 -95.0 149.8 28.8 15.3 -10.4 4 3 A S > - 0 0 62 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.395 28.4-108.3 -82.7 166.7 29.9 17.9 -12.9 5 4 A E H > S+ 0 0 101 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.881 121.5 58.3 -62.5 -36.3 33.5 19.2 -12.9 6 5 A G H > S+ 0 0 47 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.907 106.9 46.3 -59.6 -42.0 32.1 22.5 -11.5 7 6 A E H > S+ 0 0 49 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.910 111.4 51.2 -68.7 -40.2 30.7 20.6 -8.5 8 7 A W H X S+ 0 0 15 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.872 107.4 54.7 -63.5 -36.8 34.0 18.7 -8.0 9 8 A Q H X S+ 0 0 96 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.897 107.3 49.3 -64.8 -38.5 35.9 22.0 -8.1 10 9 A L H X S+ 0 0 65 -4,-1.6 4,-1.6 2,-0.2 5,-0.2 0.926 113.6 47.0 -64.8 -42.1 33.7 23.4 -5.3 11 10 A V H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.952 115.2 44.2 -63.8 -50.5 34.2 20.3 -3.2 12 11 A L H X S+ 0 0 39 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.790 108.1 59.1 -69.7 -25.7 38.0 20.2 -3.7 13 12 A H H X S+ 0 0 93 -4,-2.0 4,-0.6 -5,-0.2 -1,-0.2 0.899 111.7 39.2 -70.9 -41.8 38.4 24.0 -3.1 14 13 A V H >X S+ 0 0 0 -4,-1.6 4,-1.6 1,-0.2 3,-0.9 0.879 112.2 58.2 -75.0 -33.3 36.9 23.8 0.4 15 14 A W H 3X S+ 0 0 5 -4,-2.1 4,-2.3 1,-0.3 -2,-0.2 0.843 96.1 63.1 -63.2 -32.7 38.8 20.5 1.0 16 15 A A H 3< S+ 0 0 53 -4,-1.5 -1,-0.3 1,-0.2 4,-0.2 0.838 104.4 48.2 -61.1 -30.0 42.1 22.2 0.3 17 16 A K H X< S+ 0 0 84 -3,-0.9 3,-1.5 -4,-0.6 4,-0.4 0.894 106.8 54.8 -75.9 -43.3 41.3 24.4 3.4 18 17 A V H >< S+ 0 0 1 -4,-1.6 3,-1.9 1,-0.3 7,-0.3 0.906 102.2 59.8 -54.8 -43.2 40.5 21.4 5.5 19 18 A E G >< S+ 0 0 80 -4,-2.3 3,-0.6 1,-0.3 -1,-0.3 0.618 86.4 73.5 -64.3 -12.6 43.9 19.9 4.6 20 19 A A G < S+ 0 0 92 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.763 119.4 15.3 -70.4 -22.5 45.7 22.9 6.2 21 20 A D G <> S+ 0 0 68 -3,-1.9 4,-2.1 -4,-0.4 -1,-0.3 -0.492 70.6 164.4-151.7 76.0 44.7 21.4 9.5 22 21 A V H <> S+ 0 0 39 -3,-0.6 4,-2.2 1,-0.2 5,-0.1 0.897 79.4 49.5 -63.2 -43.0 43.6 17.7 9.2 23 22 A A H > S+ 0 0 29 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.920 110.9 49.0 -64.3 -44.7 43.9 16.9 12.9 24 23 A G H > S+ 0 0 11 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.900 114.0 45.4 -61.9 -43.9 41.9 20.0 14.0 25 24 A H H X S+ 0 0 2 -4,-2.1 4,-2.3 -7,-0.3 -1,-0.2 0.881 110.5 55.0 -67.8 -38.3 39.1 19.3 11.6 26 25 A G H X S+ 0 0 1 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.870 108.7 47.8 -61.6 -41.2 39.0 15.6 12.5 27 26 A Q H X S+ 0 0 36 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.940 112.3 48.5 -63.7 -51.7 38.5 16.4 16.2 28 27 A D H X S+ 0 0 66 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.890 113.2 48.0 -55.1 -46.0 35.7 18.9 15.5 29 28 A I H X S+ 0 0 5 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.928 114.4 43.8 -62.9 -47.2 33.9 16.5 13.2 30 29 A L H X S+ 0 0 4 -4,-2.1 4,-3.0 2,-0.2 5,-0.2 0.892 113.9 50.2 -68.6 -38.8 34.1 13.4 15.6 31 30 A I H X S+ 0 0 7 -4,-2.7 4,-2.4 2,-0.2 5,-0.3 0.933 111.2 49.6 -64.6 -42.6 33.2 15.5 18.6 32 31 A R H X S+ 0 0 76 -4,-2.2 4,-2.6 -5,-0.3 5,-0.3 0.948 112.9 47.8 -59.6 -46.5 30.2 16.9 16.7 33 32 A L H X S+ 0 0 9 -4,-2.6 4,-2.5 1,-0.2 7,-0.2 0.933 113.6 46.2 -58.8 -51.2 29.2 13.3 15.7 34 33 A F H < S+ 0 0 4 -4,-3.0 -1,-0.2 1,-0.2 7,-0.2 0.801 115.7 45.5 -64.2 -33.4 29.6 11.9 19.3 35 34 A K H < S+ 0 0 111 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.883 117.2 43.0 -77.9 -40.7 27.6 14.8 20.9 36 35 A S H < S+ 0 0 46 -4,-2.6 -2,-0.2 -5,-0.3 -3,-0.2 0.821 132.8 20.4 -72.9 -34.6 24.8 14.8 18.3 37 36 A H >< + 0 0 33 -4,-2.5 3,-2.1 -5,-0.3 4,-0.3 -0.581 66.2 178.4-139.9 78.9 24.5 11.0 18.2 38 37 A P G >> S+ 0 0 80 0, 0.0 3,-1.1 0, 0.0 4,-0.6 0.684 75.3 73.4 -52.0 -28.3 26.1 9.3 21.4 39 38 A E G >4 S+ 0 0 77 1,-0.3 3,-0.9 2,-0.2 4,-0.3 0.848 88.8 62.2 -60.4 -30.0 25.1 5.8 20.2 40 39 A T G X4 S+ 0 0 3 -3,-2.1 3,-1.5 1,-0.2 4,-0.4 0.801 89.4 67.8 -66.0 -29.2 27.9 6.1 17.6 41 40 A L G X4 S+ 0 0 21 -3,-1.1 3,-1.5 -4,-0.3 -1,-0.2 0.816 86.7 69.8 -61.2 -29.3 30.6 6.4 20.3 42 41 A E G << S+ 0 0 136 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.734 88.1 64.4 -59.8 -27.1 29.9 2.8 21.4 43 42 A K G < S+ 0 0 83 -3,-1.5 2,-1.0 -4,-0.3 -1,-0.3 0.714 89.1 74.4 -71.0 -21.2 31.4 1.5 18.1 44 43 A F X> - 0 0 64 -3,-1.5 3,-2.2 -4,-0.4 4,-2.0 -0.708 58.1-178.0-100.8 90.3 34.8 2.9 19.1 45 44 A D T 34 S+ 0 0 118 -2,-1.0 4,-0.2 1,-0.3 -1,-0.2 0.814 81.9 57.2 -53.7 -35.3 36.3 0.6 21.8 46 45 A R T 34 S+ 0 0 140 1,-0.2 -1,-0.3 -3,-0.1 15,-0.1 0.664 124.3 19.9 -74.5 -10.2 39.4 2.7 22.1 47 46 A V T X4 S+ 0 0 0 -3,-2.2 3,-1.8 -6,-0.2 -2,-0.2 0.411 87.2 105.5-140.5 1.8 37.4 5.9 23.0 48 47 A K T 3< S+ 0 0 106 -4,-2.0 -3,-0.1 1,-0.3 -2,-0.1 0.624 74.6 65.8 -63.9 -16.6 33.9 4.8 24.2 49 48 A H T 3 S+ 0 0 125 -4,-0.2 2,-0.3 -8,-0.1 -1,-0.3 0.507 71.1 114.2 -83.7 -10.9 34.7 5.6 27.8 50 49 A L < - 0 0 17 -3,-1.8 3,-0.1 1,-0.1 -3,-0.0 -0.525 41.6-177.9 -65.9 125.3 35.0 9.4 27.2 51 50 A K + 0 0 177 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.746 56.2 35.3 -97.7 -32.0 32.2 11.2 29.1 52 51 A T S > S- 0 0 71 1,-0.1 4,-2.3 0, 0.0 3,-0.3 -0.865 76.5-113.8-126.7 164.9 32.7 14.8 28.2 53 52 A E H > S+ 0 0 64 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.827 117.5 57.7 -61.6 -33.9 33.8 17.1 25.4 54 53 A A H > S+ 0 0 71 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.887 107.3 46.8 -64.6 -39.7 36.8 18.1 27.5 55 54 A E H > S+ 0 0 82 -3,-0.3 4,-1.1 2,-0.2 3,-0.4 0.910 112.8 50.8 -67.4 -38.6 37.9 14.5 27.7 56 55 A M H >< S+ 0 0 12 -4,-2.3 3,-0.7 1,-0.2 -2,-0.2 0.927 107.7 51.7 -63.9 -44.1 37.3 14.2 24.0 57 56 A K H 3< S+ 0 0 121 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.718 113.0 45.9 -66.0 -24.1 39.4 17.2 23.2 58 57 A A H 3< S+ 0 0 74 -4,-1.0 2,-0.3 -3,-0.4 -1,-0.2 0.607 86.1 111.6 -94.7 -13.6 42.2 15.9 25.2 59 58 A S S+ 0 0 112 -2,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.829 91.0 54.2 -75.7 -33.2 45.1 11.5 21.6 61 60 A D H > S+ 0 0 53 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.877 105.6 51.9 -68.1 -38.7 43.3 8.4 20.3 62 61 A L H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.931 109.2 50.9 -64.7 -39.6 40.3 10.5 19.2 63 62 A K H X S+ 0 0 67 -4,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.890 109.8 49.2 -64.6 -41.3 42.7 12.9 17.3 64 63 A K H X S+ 0 0 116 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.918 110.0 51.9 -63.7 -42.7 44.4 10.0 15.5 65 64 A H H X S+ 0 0 26 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.863 108.2 52.2 -59.7 -40.9 40.9 8.5 14.5 66 65 A G H X S+ 0 0 1 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.910 108.6 49.0 -63.1 -44.1 40.0 11.9 13.1 67 66 A V H X S+ 0 0 51 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.925 111.3 51.4 -61.8 -42.7 43.1 12.1 11.0 68 67 A T H X S+ 0 0 95 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.914 111.0 45.9 -61.0 -47.5 42.5 8.6 9.7 69 68 A V H X S+ 0 0 54 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.912 116.1 45.2 -63.0 -46.9 38.9 9.2 8.6 70 69 A L H X S+ 0 0 6 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.842 111.7 51.9 -68.0 -35.2 39.7 12.5 6.9 71 70 A T H X S+ 0 0 84 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.942 113.8 43.4 -66.9 -45.3 42.7 11.2 5.1 72 71 A A H X S+ 0 0 40 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.924 116.2 48.1 -65.7 -42.5 40.7 8.2 3.7 73 72 A L H X S+ 0 0 14 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.928 110.5 51.5 -64.5 -43.6 37.8 10.4 2.8 74 73 A G H X S+ 0 0 2 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.894 106.6 53.3 -59.9 -40.6 40.0 13.0 1.2 75 74 A A H < S+ 0 0 48 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.904 111.3 48.0 -62.4 -36.6 41.7 10.2 -1.0 76 75 A I H ><>S+ 0 0 7 -4,-1.7 3,-1.4 1,-0.2 5,-0.5 0.941 110.6 49.3 -69.6 -47.2 38.2 9.2 -2.1 77 76 A L H ><5S+ 0 0 5 -4,-2.6 3,-1.9 1,-0.3 -2,-0.2 0.878 103.8 60.4 -61.2 -38.4 37.0 12.7 -3.0 78 77 A K T 3<5S+ 0 0 107 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.640 93.8 65.2 -65.2 -14.7 40.2 13.4 -5.0 79 78 A K T X 5S- 0 0 74 -3,-1.4 3,-1.6 -4,-0.4 -1,-0.3 0.547 97.8-141.7 -81.0 -13.1 39.3 10.5 -7.3 80 79 A K T < 5S- 0 0 63 -3,-1.9 -3,-0.1 -4,-0.3 -77,-0.1 0.865 73.2 -34.9 52.6 46.4 36.2 12.5 -8.4 81 80 A G T 3 + 0 0 5 -2,-1.1 4,-2.1 1,-0.1 3,-0.4 0.185 19.1 117.5-118.4 13.8 36.8 5.4 -6.4 84 83 A E H > S+ 0 0 114 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.892 80.7 50.2 -48.8 -44.5 35.7 1.8 -6.7 85 84 A A H 4 S+ 0 0 67 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.869 111.8 47.3 -64.2 -39.6 39.2 0.5 -5.7 86 85 A E H > S+ 0 0 64 -3,-0.4 4,-0.7 1,-0.2 -1,-0.2 0.788 109.6 55.4 -72.1 -28.6 39.3 2.7 -2.6 87 86 A L H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.1 5,-0.2 0.775 92.3 70.4 -76.4 -30.3 35.8 1.7 -1.6 88 87 A K H X S+ 0 0 143 -4,-1.4 4,-2.1 2,-0.2 5,-0.2 0.951 102.8 37.6 -56.3 -58.0 36.3 -2.1 -1.5 89 88 A P H > S+ 0 0 78 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.851 118.5 53.7 -64.2 -31.0 38.5 -2.5 1.5 90 89 A L H X S+ 0 0 42 -4,-0.7 4,-2.1 2,-0.2 -2,-0.2 0.906 108.5 46.8 -67.3 -46.2 36.6 0.3 3.3 91 90 A A H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 5,-0.3 0.880 111.5 53.2 -65.8 -37.7 33.2 -1.4 2.7 92 91 A Q H X>S+ 0 0 112 -4,-2.1 4,-2.4 -5,-0.2 5,-0.8 0.929 110.3 44.5 -65.8 -47.3 34.5 -4.7 3.9 93 92 A S H X>S+ 0 0 35 -4,-2.0 5,-2.9 1,-0.2 4,-0.8 0.919 117.6 44.4 -67.6 -37.2 35.9 -3.5 7.2 94 93 A H H <5S+ 0 0 56 -4,-2.1 6,-2.8 3,-0.2 5,-0.2 0.808 120.9 39.7 -76.0 -27.2 32.8 -1.4 8.1 95 94 A A H <5S+ 0 0 3 -4,-2.0 -3,-0.2 4,-0.2 -2,-0.2 0.941 130.9 22.4 -83.3 -50.9 30.3 -4.1 7.0 96 95 A T H <5S+ 0 0 82 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.1 0.872 132.7 28.2 -88.3 -45.8 32.1 -7.2 8.4 97 96 A K T <> - 0 0 27 0, 0.0 3,-1.8 0, 0.0 4,-0.8 -0.340 22.1-115.2 -70.2 149.7 24.9 0.9 9.5 102 101 A I H >> S+ 0 0 23 1,-0.3 4,-1.7 2,-0.2 3,-1.2 0.855 113.6 69.1 -48.3 -39.4 24.4 3.4 6.6 103 102 A K H 3> S+ 0 0 119 51,-0.3 4,-1.8 1,-0.3 -1,-0.3 0.817 96.1 52.4 -49.9 -38.5 22.5 5.6 9.0 104 103 A Y H <> S+ 0 0 49 -3,-1.8 4,-2.0 2,-0.2 -1,-0.3 0.784 104.7 55.0 -71.2 -29.0 25.8 6.3 10.9 105 104 A L H < + 0 0 29 -4,-2.5 3,-1.1 -5,-0.3 4,-0.5 -0.272 60.6 149.1-130.5 53.9 34.8 28.0 6.2 121 120 A P G > S+ 0 0 85 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.876 77.4 53.8 -53.5 -39.5 31.8 30.3 5.7 122 121 A G G 3 S+ 0 0 73 1,-0.3 3,-0.2 -3,-0.1 -2,-0.1 0.782 117.1 35.2 -68.1 -29.2 33.5 32.1 2.8 123 122 A N G < S+ 0 0 55 -3,-1.1 -1,-0.3 -7,-0.2 -109,-0.1 0.189 113.1 63.0-107.9 15.5 34.2 28.9 0.9 124 123 A F < + 0 0 4 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.1 -0.365 63.7 145.0-138.7 55.8 31.0 27.1 1.9 125 124 A G S > S- 0 0 43 -3,-0.2 4,-2.5 1,-0.0 5,-0.2 -0.104 70.4 -76.1 -75.8-171.6 28.1 29.0 0.5 126 125 A A H > S+ 0 0 85 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.856 131.1 49.8 -58.6 -43.3 24.9 27.3 -0.7 127 126 A D H > S+ 0 0 137 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.941 113.4 45.8 -63.3 -48.8 26.4 26.1 -4.1 128 127 A A H > S+ 0 0 7 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.867 113.2 50.0 -62.5 -38.9 29.5 24.6 -2.4 129 128 A Q H X S+ 0 0 74 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.901 109.3 51.9 -67.0 -39.4 27.4 22.9 0.3 130 129 A G H X S+ 0 0 37 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.904 110.8 48.3 -62.3 -40.3 25.1 21.4 -2.4 131 130 A A H X S+ 0 0 3 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.916 112.2 48.2 -65.6 -43.6 28.1 20.0 -4.2 132 131 A M H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.918 111.2 50.1 -63.2 -45.5 29.6 18.6 -0.9 133 132 A N H X S+ 0 0 58 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.906 111.1 50.2 -59.0 -41.4 26.3 17.0 -0.0 134 133 A K H X S+ 0 0 56 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.899 110.7 49.1 -64.7 -39.8 26.1 15.5 -3.5 135 134 A A H X S+ 0 0 3 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.910 113.4 46.1 -67.6 -40.6 29.6 14.1 -3.2 136 135 A L H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.815 111.1 52.2 -72.5 -33.0 28.9 12.5 0.2 137 136 A E H X S+ 0 0 74 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.881 108.2 51.7 -67.3 -40.1 25.6 11.1 -1.1 138 137 A L H X S+ 0 0 11 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.943 110.2 49.7 -59.2 -47.6 27.5 9.5 -4.0 139 138 A F H X S+ 0 0 26 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.924 112.5 46.6 -56.3 -49.8 29.9 8.0 -1.4 140 139 A R H X S+ 0 0 37 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.825 110.9 52.3 -62.6 -38.3 27.0 6.6 0.7 141 140 A K H X S+ 0 0 89 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.922 113.0 43.5 -64.4 -47.8 25.2 5.2 -2.4 142 141 A D H X S+ 0 0 32 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.917 113.7 51.0 -66.8 -41.0 28.3 3.3 -3.6 143 142 A I H X S+ 0 0 4 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.910 110.4 49.0 -62.3 -44.3 29.2 2.1 -0.1 144 143 A A H X S+ 0 0 20 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.862 108.3 53.5 -66.5 -32.7 25.6 0.7 0.5 145 144 A A H X S+ 0 0 41 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.922 111.2 47.0 -65.7 -40.6 25.7 -1.1 -2.9 146 145 A K H X S+ 0 0 46 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.874 106.5 58.1 -66.9 -37.7 29.0 -2.7 -1.7 147 146 A Y H <>S+ 0 0 0 -4,-2.3 5,-2.9 2,-0.2 4,-0.4 0.920 107.0 48.3 -56.3 -47.0 27.4 -3.6 1.7 148 147 A K H ><5S+ 0 0 152 -4,-1.9 3,-1.6 4,-0.2 -2,-0.2 0.937 109.3 51.1 -61.0 -46.3 24.7 -5.5 -0.1 149 148 A E H 3<5S+ 0 0 155 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.863 111.1 50.7 -60.2 -33.9 27.2 -7.4 -2.3 150 149 A L T 3<5S- 0 0 79 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.480 122.1-106.9 -83.3 -5.1 29.1 -8.3 0.9 151 150 A G T < 5S+ 0 0 71 -3,-1.6 -3,-0.2 -4,-0.4 -2,-0.1 0.582 97.8 82.1 92.4 10.7 26.0 -9.6 2.6 152 151 A Y < + 0 0 70 -5,-2.9 -4,-0.2 -6,-0.2 -5,-0.1 0.792 35.5 161.3-108.1 -71.3 25.4 -6.8 5.1 153 152 A Q 0 0 78 -10,-0.2 -5,-0.1 1,-0.1 -9,-0.1 0.852 360.0 360.0 45.3 38.0 23.6 -3.8 3.6 154 153 A G 0 0 44 -54,-0.1 -51,-0.3 -7,-0.1 -1,-0.1 0.691 360.0 360.0 -80.5 360.0 22.8 -2.8 7.2