==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN TRANSPORT 19-DEC-97 1OBM . COMPND 2 MOLECULE: MYOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSETER CATODON; . AUTHOR E.A.BRUCKER,R.A.LILE,G.N.PHILLIPS JR. . 154 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8186.0 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 88 0, 0.0 2,-0.4 0, 0.0 133,-0.0 0.000 360.0 360.0 360.0 158.4 24.4 9.8 -9.9 2 1 A V - 0 0 124 0, 0.0 2,-0.3 0, 0.0 79,-0.1 -0.988 360.0-146.1-142.9 128.3 27.1 12.0 -11.4 3 2 A L - 0 0 9 -2,-0.4 2,-0.1 77,-0.1 128,-0.0 -0.663 24.2-122.0 -87.7 148.6 28.6 15.3 -10.3 4 3 A S > - 0 0 63 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.424 28.2-107.4 -80.8 164.1 29.6 17.9 -12.9 5 4 A E H > S+ 0 0 92 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.871 121.8 57.2 -59.9 -35.6 33.2 19.1 -12.9 6 5 A G H > S+ 0 0 37 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.885 106.0 48.8 -62.9 -38.6 32.0 22.4 -11.5 7 6 A E H > S+ 0 0 51 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.918 110.4 50.6 -67.0 -43.8 30.5 20.6 -8.5 8 7 A W H X S+ 0 0 15 -4,-2.2 4,-3.1 1,-0.2 5,-0.2 0.875 107.6 55.2 -60.0 -38.3 33.7 18.7 -7.9 9 8 A Q H X S+ 0 0 115 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.904 106.5 49.7 -60.9 -40.4 35.6 22.0 -8.0 10 9 A L H X S+ 0 0 65 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.916 113.5 46.8 -65.0 -40.8 33.4 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 0.940 114.6 44.7 -66.4 -49.5 34.1 20.3 -3.2 12 11 A L H X S+ 0 0 46 -4,-3.1 4,-1.7 1,-0.2 -1,-0.2 0.799 107.3 61.1 -70.3 -22.3 37.9 20.2 -3.7 13 12 A H H X S+ 0 0 89 -4,-2.1 4,-0.9 -5,-0.2 -1,-0.2 0.947 110.8 37.4 -70.3 -47.8 38.1 23.9 -3.1 14 13 A V H >X S+ 0 0 0 -4,-1.6 4,-2.0 1,-0.2 3,-0.6 0.886 112.8 59.1 -72.4 -30.7 36.8 23.7 0.4 15 14 A W H 3X S+ 0 0 5 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.860 97.2 60.7 -63.8 -32.9 38.6 20.4 1.0 16 15 A A H 3< S+ 0 0 56 -4,-1.7 -1,-0.2 1,-0.2 4,-0.2 0.865 106.8 47.3 -61.3 -32.3 42.0 22.2 0.2 17 16 A K H X< S+ 0 0 89 -4,-0.9 3,-1.5 -3,-0.6 4,-0.3 0.898 108.2 53.6 -76.2 -43.3 41.2 24.5 3.2 18 17 A V H >< S+ 0 0 2 -4,-2.0 3,-2.0 1,-0.3 7,-0.3 0.903 101.8 61.0 -56.7 -40.9 40.3 21.5 5.4 19 18 A E G >< S+ 0 0 78 -4,-2.5 3,-0.5 1,-0.3 -1,-0.3 0.592 85.6 74.5 -66.1 -10.4 43.7 19.9 4.6 20 19 A A G < S+ 0 0 91 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.730 115.5 20.3 -72.1 -19.7 45.5 22.9 6.2 21 20 A D G <> S+ 0 0 64 -3,-2.0 4,-2.2 -4,-0.3 -1,-0.3 -0.507 71.3 163.4-147.7 74.7 44.4 21.3 9.5 22 21 A V H <> S+ 0 0 40 -3,-0.5 4,-2.5 1,-0.2 5,-0.2 0.945 77.8 47.7 -62.1 -47.6 43.6 17.6 9.2 23 22 A A H > S+ 0 0 31 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.893 112.3 49.3 -63.4 -41.2 43.8 16.8 12.9 24 23 A G H > S+ 0 0 9 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.892 112.8 45.4 -65.6 -43.1 41.7 19.7 14.0 25 24 A H H X S+ 0 0 2 -4,-2.2 4,-2.4 -7,-0.3 -1,-0.2 0.876 111.1 54.7 -67.9 -39.3 38.9 19.1 11.5 26 25 A G H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.3 5,-0.2 0.927 111.4 44.9 -58.7 -44.2 39.0 15.3 12.3 27 26 A Q H X S+ 0 0 39 -4,-2.2 4,-2.6 -5,-0.2 5,-0.2 0.944 112.8 50.4 -63.7 -49.8 38.5 16.1 16.0 28 27 A D H X S+ 0 0 63 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.884 112.0 47.5 -55.0 -46.5 35.7 18.7 15.3 29 28 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.934 113.4 46.4 -63.4 -47.9 33.7 16.3 13.1 30 29 A F H X S+ 0 0 2 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.919 113.8 48.5 -62.7 -43.4 33.9 13.3 15.6 31 30 A I H X S+ 0 0 9 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.938 111.2 50.0 -64.0 -42.4 33.0 15.4 18.6 32 31 A R H X S+ 0 0 78 -4,-2.1 4,-2.3 -5,-0.2 5,-0.2 0.948 113.2 47.6 -60.1 -44.5 30.0 16.9 16.6 33 32 A L H X S+ 0 0 8 -4,-2.6 4,-2.8 1,-0.2 7,-0.2 0.927 113.5 46.7 -61.7 -48.7 28.9 13.4 15.7 34 33 A F H < S+ 0 0 4 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.820 114.2 47.0 -67.5 -33.2 29.3 12.0 19.3 35 34 A K H < S+ 0 0 116 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.887 118.9 40.3 -74.9 -39.1 27.4 15.0 20.8 36 35 A S H < S+ 0 0 45 -4,-2.3 -2,-0.2 -5,-0.3 -3,-0.2 0.804 132.6 21.5 -76.7 -35.4 24.6 14.8 18.2 37 36 A H >< + 0 0 34 -4,-2.8 3,-2.3 -5,-0.2 4,-0.3 -0.592 68.1 179.4-138.5 75.5 24.2 11.0 18.0 38 37 A P G >> S+ 0 0 77 0, 0.0 3,-1.0 0, 0.0 4,-0.5 0.677 75.2 71.9 -48.6 -28.4 25.8 9.6 21.2 39 38 A E G >4 S+ 0 0 75 1,-0.2 3,-0.9 2,-0.2 4,-0.4 0.829 87.3 65.0 -62.9 -28.4 24.9 6.0 20.1 40 39 A T G X4 S+ 0 0 4 -3,-2.3 3,-1.2 1,-0.2 4,-0.3 0.809 89.4 65.1 -66.7 -28.9 27.7 6.3 17.5 41 40 A L G X4 S+ 0 0 13 -3,-1.0 3,-1.7 -4,-0.3 -1,-0.2 0.813 87.9 69.6 -64.6 -28.1 30.4 6.5 20.2 42 41 A E G << S+ 0 0 122 -3,-0.9 -1,-0.2 -4,-0.5 -2,-0.2 0.780 87.9 66.4 -61.1 -23.1 29.5 2.9 21.3 43 42 A K G < S+ 0 0 80 -3,-1.2 2,-1.0 -4,-0.4 -1,-0.3 0.664 86.5 76.8 -72.4 -17.8 31.0 1.6 18.0 44 43 A F X> - 0 0 51 -3,-1.7 4,-1.3 -4,-0.3 3,-1.2 -0.712 58.9-177.1 -99.6 91.4 34.5 2.8 19.1 45 44 A D T 34 S+ 0 0 147 -2,-1.0 3,-0.3 1,-0.3 4,-0.2 0.830 78.0 63.2 -54.8 -34.1 35.8 0.3 21.6 46 45 A R T 34 S+ 0 0 117 1,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.846 124.8 7.8 -61.9 -37.2 39.0 2.3 22.1 47 46 A F T X4 S+ 0 0 1 -3,-1.2 3,-1.7 -6,-0.2 -1,-0.2 0.169 81.7 119.1-139.3 28.4 37.3 5.3 23.5 48 47 A K T 3< S+ 0 0 91 -4,-1.3 -3,-0.1 -3,-0.3 -2,-0.1 0.574 72.0 71.1 -70.0 -7.5 33.6 4.7 24.1 49 48 A H T 3 + 0 0 119 -4,-0.2 -1,-0.3 -3,-0.1 2,-0.1 0.549 67.8 117.6 -82.8 -12.7 34.2 5.4 27.8 50 49 A L < - 0 0 20 -3,-1.7 3,-0.1 1,-0.1 -3,-0.0 -0.377 41.1-175.9 -57.4 132.1 34.7 9.2 27.2 51 50 A K + 0 0 176 -2,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.756 55.2 35.3-105.6 -28.8 32.0 11.1 29.0 52 51 A T S > S- 0 0 68 1,-0.1 4,-2.2 0, 0.0 5,-0.1 -0.823 75.0-114.2-128.5 167.1 32.6 14.7 28.1 53 52 A E H > S+ 0 0 64 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.869 117.5 57.4 -64.5 -35.4 33.6 17.0 25.3 54 53 A A H > S+ 0 0 70 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.915 107.6 46.3 -60.7 -45.4 36.7 18.0 27.3 55 54 A E H > S+ 0 0 85 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.897 112.4 51.7 -63.5 -39.2 37.8 14.3 27.6 56 55 A M H >< S+ 0 0 13 -4,-2.2 3,-0.9 1,-0.2 -2,-0.2 0.926 109.1 49.3 -63.3 -43.1 37.1 13.9 23.8 57 56 A K H 3< S+ 0 0 116 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.817 112.9 49.0 -65.4 -31.3 39.3 17.0 23.0 58 57 A A H 3< S+ 0 0 72 -4,-1.6 2,-0.5 -5,-0.2 -1,-0.3 0.565 85.4 109.8 -85.9 -8.7 42.0 15.6 25.2 59 58 A S S+ 0 0 108 -2,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.874 90.1 53.3 -71.0 -36.1 45.0 11.2 21.6 61 60 A D H > S+ 0 0 69 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.866 108.0 49.2 -65.7 -41.1 43.3 8.0 20.2 62 61 A L H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.919 111.6 49.8 -64.6 -44.1 40.2 10.0 19.1 63 62 A K H X S+ 0 0 54 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.916 110.0 50.6 -60.6 -44.1 42.5 12.5 17.3 64 63 A K H X S+ 0 0 122 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.923 111.4 47.7 -60.4 -44.4 44.4 9.7 15.6 65 64 A Q H X S+ 0 0 52 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.830 107.8 56.7 -64.7 -36.6 41.2 8.1 14.4 66 65 A G H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.897 108.8 46.0 -60.7 -42.4 39.9 11.5 13.1 67 66 A V H X S+ 0 0 47 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.912 112.8 49.7 -66.3 -46.2 43.1 11.9 11.0 68 67 A T H X S+ 0 0 88 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.935 113.8 47.3 -57.3 -47.3 42.8 8.3 9.6 69 68 A F H X S+ 0 0 37 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.944 114.4 44.6 -59.5 -50.5 39.1 8.9 8.8 70 69 A L H X S+ 0 0 3 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.845 110.8 52.9 -67.0 -37.9 39.7 12.3 7.1 71 70 A T H X S+ 0 0 83 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.895 111.2 47.7 -63.4 -42.6 42.7 11.1 5.1 72 71 A A H X S+ 0 0 44 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.919 113.9 46.9 -64.2 -43.5 40.6 8.2 3.7 73 72 A L H X S+ 0 0 11 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.922 110.1 53.5 -65.1 -41.7 37.7 10.4 2.9 74 73 A G H X S+ 0 0 2 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.904 106.9 51.9 -58.2 -41.7 40.0 13.0 1.2 75 74 A A H X S+ 0 0 47 -4,-1.9 4,-0.6 2,-0.2 -1,-0.2 0.891 111.0 48.2 -66.1 -35.9 41.4 10.2 -1.0 76 75 A I H ><>S+ 0 0 9 -4,-1.7 3,-1.3 2,-0.2 5,-0.5 0.953 111.2 48.6 -68.3 -49.1 37.9 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 0.881 105.4 58.9 -59.9 -38.1 36.8 12.8 -2.9 78 77 A K H 3<5S+ 0 0 107 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.695 94.0 66.4 -67.5 -17.7 39.9 13.4 -4.9 79 78 A K T X<5S- 0 0 75 -3,-1.3 3,-1.8 -4,-0.6 -1,-0.3 0.566 97.6-141.2 -75.1 -15.5 39.0 10.5 -7.2 80 79 A K T < 5S- 0 0 70 -3,-1.9 -3,-0.1 -4,-0.3 -2,-0.1 0.873 73.6 -36.1 54.2 45.9 35.9 12.5 -8.4 81 80 A G T 3 + 0 0 7 -2,-1.1 4,-2.3 1,-0.2 5,-0.2 0.086 20.2 120.3-113.3 19.2 36.6 5.4 -6.2 84 83 A E H > S+ 0 0 116 1,-0.2 4,-1.3 2,-0.2 3,-0.2 0.929 79.0 46.2 -51.0 -50.9 35.7 1.8 -6.8 85 84 A A H 4 S+ 0 0 61 1,-0.2 3,-0.3 -3,-0.2 -1,-0.2 0.888 113.9 48.0 -64.6 -38.2 39.1 0.5 -5.6 86 85 A E H > S+ 0 0 60 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.776 107.5 56.7 -71.2 -31.7 39.1 2.7 -2.5 87 86 A L H X S+ 0 0 6 -4,-2.3 4,-3.0 -3,-0.2 5,-0.3 0.782 93.0 70.9 -70.7 -29.9 35.6 1.8 -1.5 88 87 A K H X S+ 0 0 123 -4,-1.3 4,-2.4 -3,-0.3 5,-0.2 0.948 102.3 36.6 -55.9 -57.6 36.3 -2.0 -1.4 89 88 A P H > S+ 0 0 83 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.873 119.0 52.9 -67.7 -28.0 38.4 -2.4 1.7 90 89 A L H X S+ 0 0 36 -4,-0.8 4,-2.4 2,-0.2 5,-0.2 0.921 109.6 46.8 -70.1 -43.9 36.4 0.4 3.4 91 90 A A H X S+ 0 0 0 -4,-3.0 4,-2.2 2,-0.2 5,-0.4 0.921 112.0 52.0 -65.1 -44.3 33.0 -1.3 2.7 92 91 A Q H X>S+ 0 0 118 -4,-2.4 4,-2.3 -5,-0.3 5,-0.6 0.945 113.1 41.8 -60.9 -48.0 34.4 -4.7 3.9 93 92 A S H X>S+ 0 0 33 -4,-2.3 5,-2.5 1,-0.2 4,-1.7 0.933 117.0 46.7 -68.7 -42.3 35.7 -3.4 7.3 94 93 A H H <5S+ 0 0 52 -4,-2.4 6,-2.9 -5,-0.2 5,-0.2 0.798 120.1 38.6 -71.7 -26.6 32.8 -1.2 8.1 95 94 A A H <5S+ 0 0 2 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.945 130.4 25.2 -83.7 -47.8 30.2 -3.8 7.2 96 95 A T H <5S+ 0 0 81 -4,-2.3 -3,-0.2 -5,-0.4 -2,-0.2 0.810 132.8 26.1 -88.1 -38.2 31.9 -7.0 8.6 97 96 A K T <> - 0 0 30 0, 0.0 3,-1.5 0, 0.0 4,-1.0 -0.300 22.0-114.2 -67.3 153.5 24.8 0.9 9.6 102 101 A I H 3> S+ 0 0 21 52,-1.1 4,-1.7 1,-0.3 3,-0.5 0.823 115.6 65.5 -54.8 -30.5 24.1 3.2 6.7 103 102 A K H 3> S+ 0 0 115 51,-0.5 4,-2.0 1,-0.2 -1,-0.3 0.841 97.6 53.9 -63.8 -30.0 22.2 5.5 9.0 104 103 A Y H <> S+ 0 0 50 -3,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.786 104.3 54.1 -73.6 -28.2 25.5 6.2 10.9 105 104 A L H X S+ 0 0 18 -4,-1.0 4,-1.5 -3,-0.5 -1,-0.2 0.846 107.8 50.9 -72.5 -34.5 27.2 7.2 7.6 106 105 A E H X S+ 0 0 79 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.932 108.9 51.9 -65.3 -43.3 24.3 9.7 7.1 107 106 A F H X S+ 0 0 20 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.891 110.4 46.9 -59.9 -43.0 24.9 11.1 10.7 108 107 A I H X S+ 0 0 25 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.847 107.7 56.7 -71.0 -28.3 28.7 11.7 10.0 109 108 A S H X S+ 0 0 6 -4,-1.5 4,-2.4 1,-0.2 -1,-0.2 0.898 107.0 50.6 -65.0 -42.0 27.8 13.4 6.7 110 109 A E H X S+ 0 0 107 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.885 109.8 49.7 -61.3 -41.6 25.7 15.8 8.7 111 110 A A H X S+ 0 0 2 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.873 109.0 51.7 -67.3 -37.6 28.6 16.4 11.1 112 111 A I H X S+ 0 0 3 -4,-2.2 4,-2.4 2,-0.2 5,-0.3 0.942 111.5 47.8 -64.1 -45.8 31.0 17.1 8.1 113 112 A I H X S+ 0 0 23 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.919 110.7 51.3 -62.1 -39.2 28.6 19.6 6.7 114 113 A H H X S+ 0 0 71 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.907 112.1 46.3 -62.5 -47.6 28.1 21.3 10.1 115 114 A V H X S+ 0 0 7 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.890 112.5 47.6 -66.6 -41.7 31.8 21.7 10.7 116 115 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.883 111.4 52.6 -67.6 -38.3 32.7 23.0 7.2 117 116 A H H < S+ 0 0 104 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.906 114.2 42.8 -61.9 -41.7 29.8 25.5 7.5 118 117 A S H < S+ 0 0 71 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.930 123.5 34.7 -70.5 -45.9 31.1 26.7 10.9 119 118 A R H < S+ 0 0 92 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.760 127.0 31.8 -82.2 -26.5 34.8 26.9 9.9 120 119 A H >< + 0 0 28 -4,-2.5 3,-1.4 -5,-0.2 4,-0.4 -0.322 62.4 152.7-130.6 54.4 34.7 27.9 6.2 121 120 A P G > S+ 0 0 88 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.860 76.1 52.6 -54.2 -38.7 31.6 30.2 5.7 122 121 A G G 3 S+ 0 0 74 1,-0.3 3,-0.2 -3,-0.1 -5,-0.1 0.735 117.6 36.3 -70.7 -24.7 33.1 32.1 2.8 123 122 A N G < S+ 0 0 60 -3,-1.4 -1,-0.3 -7,-0.2 -109,-0.1 0.130 112.9 62.2-109.8 11.9 34.0 28.9 0.8 124 123 A F < + 0 0 3 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.1 -0.344 67.6 145.9-137.0 58.0 30.9 27.0 1.9 125 124 A G > - 0 0 41 -3,-0.2 4,-2.6 4,-0.0 5,-0.2 -0.076 69.7 -75.6 -77.6-174.9 27.9 28.9 0.5 126 125 A A H > S+ 0 0 86 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.886 131.9 47.1 -54.9 -47.8 24.7 27.3 -0.7 127 126 A D H > S+ 0 0 132 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.926 113.2 48.1 -63.4 -42.2 26.2 26.0 -3.9 128 127 A A H > S+ 0 0 7 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.899 112.6 49.2 -65.2 -39.2 29.3 24.6 -2.3 129 128 A Q H X S+ 0 0 71 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.906 110.0 51.6 -67.4 -40.6 27.2 22.9 0.4 130 129 A G H X S+ 0 0 40 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.907 111.1 48.0 -60.8 -41.3 24.9 21.4 -2.3 131 130 A A H X S+ 0 0 2 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.913 112.7 47.8 -66.6 -42.5 28.0 20.1 -4.1 132 131 A M H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.917 112.0 50.0 -64.9 -43.2 29.4 18.5 -0.9 133 132 A N H X S+ 0 0 54 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.915 110.1 50.5 -61.9 -42.3 26.1 17.0 -0.0 134 133 A K H X S+ 0 0 57 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.903 110.7 49.5 -60.4 -42.4 25.9 15.5 -3.5 135 134 A A H X S+ 0 0 3 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.912 113.5 46.0 -64.3 -42.0 29.4 14.0 -3.2 136 135 A L H X S+ 0 0 3 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.841 110.7 52.1 -71.7 -34.4 28.6 12.5 0.2 137 136 A E H X S+ 0 0 78 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.882 109.6 50.8 -64.7 -40.0 25.3 11.1 -1.1 138 137 A L H X S+ 0 0 10 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.944 110.6 48.9 -61.2 -50.4 27.2 9.5 -4.0 139 138 A F H X S+ 0 0 22 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.928 112.9 47.4 -54.6 -48.8 29.6 8.0 -1.5 140 139 A R H X S+ 0 0 38 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.865 111.0 51.4 -60.7 -39.6 26.8 6.6 0.6 141 140 A K H X S+ 0 0 82 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.943 113.5 44.1 -65.3 -45.9 24.9 5.2 -2.4 142 141 A D H X S+ 0 0 51 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.895 114.6 47.6 -66.8 -42.4 28.0 3.3 -3.6 143 142 A I H X S+ 0 0 2 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.884 109.4 54.1 -69.5 -33.4 29.0 2.0 -0.2 144 143 A A H X S+ 0 0 19 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.909 108.9 49.5 -62.8 -41.9 25.3 0.9 0.5 145 144 A A H X S+ 0 0 47 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.867 111.4 49.2 -63.6 -37.4 25.5 -1.1 -2.8 146 145 A K H X S+ 0 0 51 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.894 106.6 55.2 -70.6 -38.8 28.8 -2.6 -1.7 147 146 A Y H X>S+ 0 0 0 -4,-2.6 5,-2.8 1,-0.2 4,-0.5 0.902 107.1 52.2 -57.9 -43.8 27.4 -3.5 1.7 148 147 A K H ><5S+ 0 0 147 -4,-1.9 3,-1.2 1,-0.2 -1,-0.2 0.920 108.2 49.0 -61.0 -45.0 24.6 -5.4 -0.1 149 148 A E H 3<5S+ 0 0 138 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.813 110.4 52.9 -63.8 -31.8 27.1 -7.4 -2.2 150 149 A L H 3<5S- 0 0 71 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.503 121.2-107.0 -81.9 -9.6 29.0 -8.2 1.0 151 150 A G T <<5S+ 0 0 73 -3,-1.2 -3,-0.2 -4,-0.5 -2,-0.1 0.582 98.7 84.9 94.9 15.4 25.9 -9.6 2.7 152 151 A Y < + 0 0 75 -5,-2.8 -4,-0.2 -6,-0.2 -5,-0.1 0.803 40.6 163.0-111.2 -56.0 25.2 -6.7 5.2 153 152 A Q 0 0 75 -6,-0.3 -5,-0.1 1,-0.2 -9,-0.1 0.676 360.0 360.0 38.6 31.1 23.2 -3.9 3.5 154 153 A G 0 0 44 -54,-0.1 -52,-1.1 -7,-0.1 -51,-0.5 0.694 360.0 360.0-110.2 360.0 22.2 -2.3 6.8