==== 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 19-DEC-08 2W6X . COMPND 2 MOLECULE: MYOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSETER CATODON; . AUTHOR A.E.MIELE,F.DRAGHI,F.RENZI,G.SCIARA,K.A.JOHNSON,B.VALLONE, . 154 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8604.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 81.2 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 . 5 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 11.0 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 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 82 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 145.6 24.3 9.6 -10.0 2 1 A V - 0 0 124 0, 0.0 2,-0.2 0, 0.0 79,-0.1 -0.978 360.0-141.2-140.7 122.8 27.2 11.6 -11.4 3 2 A L - 0 0 10 -2,-0.4 2,-0.1 1,-0.1 128,-0.0 -0.537 24.2-121.3 -77.5 147.2 28.8 14.9 -10.2 4 3 A S > - 0 0 56 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.400 26.1-110.1 -75.7 162.2 30.0 17.5 -12.7 5 4 A E H > S+ 0 0 98 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.894 122.3 55.7 -57.8 -40.5 33.6 18.6 -12.7 6 5 A G H > S+ 0 0 45 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.903 107.2 48.9 -58.8 -41.6 32.5 21.9 -11.3 7 6 A E H > S+ 0 0 54 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.928 109.8 51.4 -63.5 -46.3 30.8 20.1 -8.4 8 7 A W H X S+ 0 0 15 -4,-2.4 4,-3.0 1,-0.2 -2,-0.2 0.890 107.1 54.4 -57.8 -39.6 34.0 18.1 -7.8 9 8 A Q H X S+ 0 0 66 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.892 105.8 51.2 -65.5 -37.2 36.0 21.3 -7.7 10 9 A L H X S+ 0 0 67 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.909 112.7 47.6 -61.6 -40.6 33.7 22.8 -5.0 11 10 A V H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.951 114.1 45.5 -62.9 -49.7 34.3 19.6 -3.0 12 11 A L H X S+ 0 0 36 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.841 107.7 58.0 -67.8 -29.8 38.1 19.6 -3.5 13 12 A H H X S+ 0 0 102 -4,-2.3 4,-0.5 2,-0.2 -1,-0.2 0.870 110.0 42.4 -73.4 -33.7 38.4 23.4 -2.7 14 13 A V H >X S+ 0 0 0 -4,-1.5 4,-1.7 -3,-0.2 3,-1.0 0.882 111.0 56.9 -75.2 -34.7 36.8 23.0 0.7 15 14 A W H 3X S+ 0 0 6 -4,-2.1 4,-2.2 1,-0.3 -2,-0.2 0.860 96.8 63.9 -61.8 -33.5 38.9 19.8 1.3 16 15 A A H 3< S+ 0 0 46 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.824 104.1 47.4 -56.9 -32.4 42.0 21.9 0.6 17 16 A K H X< S+ 0 0 94 -3,-1.0 3,-1.6 -4,-0.5 4,-0.4 0.882 106.3 55.6 -78.8 -41.1 41.1 23.8 3.8 18 17 A V H >< S+ 0 0 1 -4,-1.7 3,-1.7 1,-0.3 7,-0.3 0.897 101.5 61.5 -51.2 -41.3 40.5 20.7 5.8 19 18 A E T 3< S+ 0 0 98 -4,-2.2 3,-0.4 1,-0.3 -1,-0.3 0.559 83.3 76.1 -71.0 -8.3 44.0 19.7 4.9 20 19 A A T < S- 0 0 91 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.835 126.0 -2.0 -62.7 -29.7 45.5 22.7 6.6 21 20 A D S <> S+ 0 0 79 -3,-1.7 4,-1.9 -4,-0.4 -1,-0.2 -0.485 70.5 171.1-162.2 74.5 44.8 20.8 9.9 22 21 A V H > S+ 0 0 33 -3,-0.4 4,-2.7 1,-0.2 5,-0.2 0.897 80.2 57.9 -64.2 -36.3 43.2 17.4 9.3 23 22 A A H > S+ 0 0 18 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.930 107.6 46.2 -58.5 -47.5 43.7 16.4 12.9 24 23 A G H > S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.901 113.4 48.9 -62.0 -42.5 41.7 19.4 14.3 25 24 A H H X S+ 0 0 4 -4,-1.9 4,-2.5 -7,-0.3 -1,-0.2 0.910 109.7 52.9 -64.2 -41.5 38.9 18.9 11.7 26 25 A G H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.901 108.0 50.3 -60.7 -44.5 38.7 15.2 12.6 27 26 A Q H X S+ 0 0 21 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.944 112.0 47.7 -57.1 -48.0 38.3 16.0 16.4 28 27 A D H X S+ 0 0 51 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.903 112.9 48.5 -60.6 -43.3 35.5 18.5 15.6 29 28 A I H X S+ 0 0 2 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.932 113.7 45.1 -66.2 -46.3 33.7 16.0 13.3 30 29 A Y H X S+ 0 0 11 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.909 113.2 50.9 -63.1 -42.9 33.9 13.1 15.8 31 30 A I H X S+ 0 0 6 -4,-2.6 4,-2.1 -5,-0.2 5,-0.2 0.934 111.9 47.2 -61.3 -44.1 32.8 15.3 18.7 32 31 A R H X S+ 0 0 84 -4,-2.5 4,-2.7 -5,-0.2 5,-0.3 0.923 113.4 48.9 -62.2 -45.5 29.8 16.5 16.7 33 32 A L H X S+ 0 0 8 -4,-2.6 4,-2.3 1,-0.2 7,-0.2 0.929 113.2 45.7 -57.7 -49.5 28.9 13.0 15.7 34 33 A F H < S+ 0 0 7 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.798 116.3 45.7 -71.4 -30.1 29.1 11.6 19.2 35 34 A K H < S+ 0 0 109 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.894 117.9 41.6 -75.9 -42.2 27.1 14.5 20.7 36 35 A S H < S+ 0 0 47 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.812 134.4 18.8 -73.0 -33.8 24.4 14.5 18.0 37 36 A H >< + 0 0 29 -4,-2.3 3,-2.2 -5,-0.3 4,-0.4 -0.644 67.5 178.0-141.8 74.5 24.1 10.7 17.9 38 37 A P G >> S+ 0 0 78 0, 0.0 3,-1.0 0, 0.0 4,-0.6 0.722 75.4 72.5 -56.3 -25.7 25.6 9.2 21.1 39 38 A E G >4 S+ 0 0 67 1,-0.2 3,-0.9 2,-0.2 4,-0.4 0.805 87.6 63.5 -59.8 -29.8 24.6 5.6 19.9 40 39 A T G X4 S+ 0 0 6 -3,-2.2 3,-1.4 1,-0.3 4,-0.3 0.830 91.4 63.8 -66.1 -30.9 27.4 5.8 17.3 41 40 A L G X4 S+ 0 0 20 -3,-1.0 3,-1.7 -4,-0.4 -1,-0.3 0.830 89.5 69.3 -61.7 -28.9 30.0 6.0 20.0 42 41 A E G << S+ 0 0 138 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.702 88.6 64.2 -62.7 -22.4 28.9 2.5 21.1 43 42 A K G < S+ 0 0 75 -3,-1.4 2,-1.0 -4,-0.4 -1,-0.3 0.661 85.9 81.3 -75.3 -16.9 30.4 1.0 17.9 44 43 A F X> - 0 0 50 -3,-1.7 4,-2.4 -4,-0.3 3,-1.1 -0.780 57.2-174.3 -96.1 97.0 33.9 2.1 19.0 45 44 A D T 34 S+ 0 0 128 -2,-1.0 4,-0.2 1,-0.3 -1,-0.2 0.859 88.0 49.2 -55.8 -36.6 35.3 -0.5 21.4 46 45 A R T 34 S+ 0 0 144 1,-0.2 -1,-0.3 -3,-0.1 16,-0.1 0.679 123.9 27.5 -78.2 -16.9 38.4 1.7 21.9 47 46 A F T X4 S+ 0 0 3 -3,-1.1 3,-2.5 -6,-0.2 -2,-0.2 0.494 84.7 99.3-123.4 -10.2 36.4 5.0 22.6 48 47 A K T 3< S+ 0 0 121 -4,-2.4 -3,-0.1 1,-0.3 -2,-0.1 0.683 78.5 65.1 -61.0 -16.6 33.0 4.1 24.0 49 48 A H T 3 S+ 0 0 121 -4,-0.2 -1,-0.3 -8,-0.1 2,-0.2 0.644 72.6 112.4 -76.0 -17.5 34.3 4.9 27.5 50 49 A L < - 0 0 15 -3,-2.5 3,-0.0 1,-0.1 -3,-0.0 -0.411 44.2-176.3 -66.3 127.3 34.8 8.6 26.7 51 50 A K + 0 0 174 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.687 54.6 25.1 -99.8 -25.4 32.2 10.6 28.8 52 51 A T S > S- 0 0 66 1,-0.1 4,-2.3 0, 0.0 5,-0.1 -0.906 75.9-107.0-140.8 163.1 32.6 14.2 27.8 53 52 A E H > S+ 0 0 96 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.897 120.5 57.0 -57.8 -40.6 33.8 16.6 25.0 54 53 A A H > S+ 0 0 75 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.919 107.7 46.4 -55.1 -47.3 36.8 17.3 27.1 55 54 A E H > S+ 0 0 81 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.905 112.8 50.2 -64.5 -41.1 37.7 13.6 27.3 56 55 A M H >< S+ 0 0 12 -4,-2.3 3,-0.9 1,-0.2 -2,-0.2 0.929 110.6 48.8 -61.4 -45.3 37.2 13.3 23.5 57 56 A K H 3< S+ 0 0 99 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.836 111.7 50.5 -64.3 -32.6 39.4 16.3 22.8 58 57 A A H 3< S+ 0 0 79 -4,-1.7 2,-0.8 -5,-0.2 -1,-0.2 0.572 84.5 107.5 -81.2 -12.3 42.1 15.0 25.1 59 58 A S S+ 0 0 146 -2,-0.8 4,-2.4 1,-0.2 -1,-0.2 0.902 88.8 52.2 -63.5 -40.3 45.3 11.0 21.4 61 60 A D H > S+ 0 0 77 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.885 108.2 50.0 -65.3 -38.6 43.9 7.8 19.9 62 61 A L H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.908 110.3 51.5 -63.3 -42.8 40.6 9.5 18.8 63 62 A K H X S+ 0 0 90 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.935 110.7 47.7 -55.8 -49.1 42.7 12.2 17.2 64 63 A K H X S+ 0 0 138 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.879 110.2 52.5 -60.3 -40.1 44.7 9.6 15.3 65 64 A Q H X S+ 0 0 48 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.909 107.0 52.8 -62.4 -42.7 41.6 7.8 14.2 66 65 A G H X S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.2 5,-0.3 0.899 108.3 50.3 -61.2 -40.8 40.1 11.1 12.9 67 66 A V H X S+ 0 0 46 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.929 111.6 48.7 -62.6 -44.0 43.2 11.7 10.8 68 67 A R H X S+ 0 0 183 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.933 114.3 44.9 -61.3 -47.0 43.0 8.1 9.4 69 68 A V H X S+ 0 0 35 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.941 115.2 45.3 -66.4 -49.3 39.3 8.4 8.5 70 69 A L H X S+ 0 0 2 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.850 112.4 52.3 -67.5 -31.6 39.5 11.9 6.9 71 70 A T H X S+ 0 0 86 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.921 110.9 47.1 -67.6 -44.1 42.6 10.9 4.9 72 71 A A H X S+ 0 0 32 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.920 114.6 46.8 -62.3 -43.2 40.9 7.8 3.6 73 72 A L H X S+ 0 0 14 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.929 110.3 53.1 -63.6 -45.7 37.8 9.9 2.7 74 73 A G H X S+ 0 0 1 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.899 107.2 51.8 -54.3 -42.9 40.0 12.6 1.1 75 74 A A H X S+ 0 0 47 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.900 111.1 48.6 -62.5 -39.2 41.6 9.9 -1.1 76 75 A I H ><>S+ 0 0 5 -4,-1.8 3,-1.2 1,-0.2 5,-0.5 0.948 110.8 49.1 -64.6 -50.0 38.1 8.8 -2.2 77 76 A L H ><5S+ 0 0 3 -4,-2.9 3,-1.9 1,-0.3 -2,-0.2 0.879 104.5 59.5 -59.7 -37.2 37.0 12.3 -3.0 78 77 A K H 3<5S+ 0 0 111 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.719 95.3 64.1 -66.6 -19.7 40.1 13.0 -5.0 79 78 A K T X<5S- 0 0 91 -3,-1.2 3,-1.9 -4,-0.7 -1,-0.3 0.595 98.0-143.2 -74.7 -13.2 39.1 10.0 -7.3 80 79 A K T < 5S- 0 0 73 -3,-1.9 -3,-0.1 -4,-0.4 -2,-0.1 0.890 74.8 -33.5 49.6 48.9 36.0 12.1 -8.3 81 80 A G T 3 + 0 0 8 -2,-1.4 4,-2.3 1,-0.2 5,-0.2 0.074 17.4 121.0-120.1 21.6 36.7 5.0 -6.2 84 83 A E H > S+ 0 0 107 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.901 80.4 46.7 -51.6 -48.4 35.9 1.3 -6.6 85 84 A A H 4 S+ 0 0 69 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.865 113.6 48.0 -66.3 -38.1 39.3 0.1 -5.4 86 85 A E H > S+ 0 0 48 1,-0.2 4,-0.8 2,-0.1 -1,-0.2 0.836 110.6 52.2 -70.4 -35.9 39.2 2.4 -2.3 87 86 A L H X S+ 0 0 4 -4,-2.3 4,-3.1 1,-0.2 5,-0.3 0.792 93.7 73.0 -74.2 -29.2 35.7 1.4 -1.4 88 87 A K H X S+ 0 0 116 -4,-1.4 4,-2.2 1,-0.2 5,-0.2 0.936 101.6 37.4 -55.0 -56.9 36.2 -2.4 -1.4 89 88 A P H > S+ 0 0 79 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.871 118.5 51.5 -66.9 -32.8 38.3 -2.8 1.8 90 89 A L H X S+ 0 0 46 -4,-0.8 4,-2.7 2,-0.2 5,-0.3 0.926 110.2 47.7 -66.3 -48.3 36.2 -0.1 3.6 91 90 A A H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 5,-0.3 0.931 113.4 49.1 -58.3 -45.1 32.9 -1.7 2.8 92 91 A Q H X>S+ 0 0 116 -4,-2.2 4,-2.4 -5,-0.3 5,-0.6 0.943 114.9 42.4 -63.7 -46.0 34.2 -5.1 3.9 93 92 A S H X>S+ 0 0 36 -4,-2.4 5,-2.6 1,-0.2 4,-1.6 0.921 117.6 45.9 -67.3 -42.6 35.5 -3.9 7.2 94 93 A H H <5S+ 0 0 57 -4,-2.7 6,-2.7 3,-0.2 5,-0.4 0.817 118.2 42.8 -73.5 -27.4 32.6 -1.7 8.0 95 94 A A H <5S+ 0 0 3 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.912 129.5 22.6 -76.9 -44.4 30.0 -4.3 7.0 96 95 A T H <5S+ 0 0 91 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.2 0.843 132.5 25.9-102.6 -39.9 31.6 -7.4 8.6 97 96 A K T <> - 0 0 29 0, 0.0 4,-1.3 0, 0.0 3,-1.2 -0.292 22.7-114.3 -67.6 156.3 24.6 0.7 9.3 102 101 A I H 3> S+ 0 0 27 1,-0.3 4,-2.0 52,-0.3 3,-0.3 0.870 116.9 63.6 -55.8 -37.9 24.1 3.1 6.4 103 102 A K H 3> S+ 0 0 104 51,-0.6 4,-2.2 1,-0.2 -1,-0.3 0.838 100.5 51.5 -55.9 -34.8 22.1 5.3 8.8 104 103 A Y H <> S+ 0 0 50 -3,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.838 106.2 53.6 -72.3 -32.5 25.3 5.9 10.8 105 104 A L H X S+ 0 0 23 -4,-1.3 4,-2.2 -3,-0.3 -2,-0.2 0.857 107.6 52.3 -67.2 -32.7 27.1 6.8 7.6 106 105 A E H X S+ 0 0 90 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.936 108.6 49.3 -65.2 -46.7 24.3 9.4 7.1 107 106 A F H X S+ 0 0 11 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.907 110.9 50.2 -57.6 -42.2 24.9 10.7 10.6 108 107 A F H X S+ 0 0 36 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.903 109.2 51.0 -64.0 -42.2 28.7 11.0 9.9 109 108 A S H X S+ 0 0 8 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.906 108.7 52.2 -59.4 -43.9 27.9 12.8 6.6 110 109 A E H X S+ 0 0 98 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.887 109.0 50.7 -59.1 -42.3 25.7 15.3 8.6 111 110 A A H X S+ 0 0 2 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.906 109.6 49.6 -64.1 -43.7 28.6 15.8 11.1 112 111 A I H X S+ 0 0 1 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.953 112.3 47.6 -59.1 -49.2 31.1 16.6 8.2 113 112 A I H X S+ 0 0 22 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.902 111.1 51.6 -61.9 -41.4 28.7 19.1 6.6 114 113 A H H X S+ 0 0 67 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.930 112.5 45.0 -61.7 -47.1 28.0 20.8 10.0 115 114 A V H X S+ 0 0 7 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.923 113.9 48.2 -65.2 -45.0 31.7 21.2 10.7 116 115 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.912 111.8 50.7 -62.4 -40.8 32.6 22.5 7.2 117 116 A H H < S+ 0 0 104 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.912 115.3 43.5 -62.0 -40.1 29.7 24.9 7.4 118 117 A S H < S+ 0 0 74 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.917 124.4 32.0 -68.6 -49.2 30.9 26.2 10.8 119 118 A R H < S+ 0 0 91 -4,-3.1 -2,-0.2 1,-0.2 3,-0.2 0.783 123.3 39.8 -82.3 -31.7 34.6 26.4 10.0 120 119 A H >X + 0 0 32 -4,-2.6 3,-1.6 -5,-0.3 4,-0.9 -0.381 50.9 146.8-127.9 54.4 34.6 27.3 6.2 121 120 A P T 34 S+ 0 0 98 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.812 77.9 63.2 -60.2 -26.3 31.9 29.8 5.2 122 121 A G T 34 S+ 0 0 71 1,-0.2 3,-0.1 -3,-0.2 -2,-0.1 0.708 120.5 20.5 -67.9 -24.9 34.4 31.1 2.6 123 122 A D T <4 S+ 0 0 62 -3,-1.6 -1,-0.2 -7,-0.2 -109,-0.1 0.168 119.0 63.8-127.3 14.8 34.5 27.8 0.8 124 123 A F < + 0 0 3 -4,-0.9 -2,-0.1 -3,-0.3 -1,-0.1 -0.289 63.0 140.6-139.7 51.5 31.2 26.2 2.0 125 124 A G S > S- 0 0 42 -3,-0.1 4,-2.7 4,-0.0 5,-0.2 -0.073 73.7 -73.5 -73.0-170.2 28.4 28.4 0.7 126 125 A A H > S+ 0 0 88 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.891 132.4 47.5 -60.3 -43.5 25.2 26.9 -0.6 127 126 A D H > S+ 0 0 135 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.932 114.5 47.0 -64.5 -44.3 26.6 25.6 -3.9 128 127 A A H > S+ 0 0 7 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.897 111.5 50.3 -63.8 -41.8 29.6 24.0 -2.2 129 128 A Q H X S+ 0 0 67 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.914 110.1 51.4 -64.1 -41.0 27.5 22.4 0.5 130 129 A G H X S+ 0 0 38 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.910 110.5 48.9 -60.0 -42.1 25.2 20.9 -2.2 131 130 A A H X S+ 0 0 3 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.917 112.1 47.6 -64.7 -44.2 28.3 19.5 -4.0 132 131 A M H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.915 110.5 52.5 -63.9 -42.2 29.6 18.0 -0.8 133 132 A N H X S+ 0 0 68 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.934 110.2 48.5 -57.0 -45.6 26.2 16.5 -0.1 134 133 A K H X S+ 0 0 60 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.915 111.9 49.2 -60.2 -44.6 26.1 15.0 -3.6 135 134 A A H X S+ 0 0 3 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.905 114.1 44.5 -62.6 -44.0 29.7 13.5 -3.1 136 135 A L H X S+ 0 0 2 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.878 112.0 52.6 -71.1 -36.2 28.8 12.0 0.2 137 136 A E H X S+ 0 0 85 -4,-2.6 4,-2.6 -5,-0.3 -2,-0.2 0.915 109.6 49.7 -60.6 -44.3 25.5 10.6 -1.0 138 137 A L H X S+ 0 0 11 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.932 110.8 49.9 -59.7 -46.4 27.4 9.0 -4.0 139 138 A F H X S+ 0 0 30 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.940 113.0 45.9 -58.2 -50.0 29.8 7.5 -1.5 140 139 A R H X S+ 0 0 32 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.870 111.1 52.7 -63.4 -37.9 27.0 6.1 0.7 141 140 A K H X S+ 0 0 93 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.928 112.3 45.0 -63.0 -45.1 25.1 4.8 -2.3 142 141 A D H X S+ 0 0 49 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.880 113.6 49.6 -68.4 -38.4 28.2 2.9 -3.5 143 142 A I H X S+ 0 0 4 -4,-2.5 4,-3.2 2,-0.2 -2,-0.2 0.917 109.7 52.2 -63.1 -43.6 28.9 1.6 -0.0 144 143 A A H X S+ 0 0 20 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.899 108.2 50.7 -61.9 -41.6 25.3 0.4 0.4 145 144 A A H X S+ 0 0 46 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.897 113.0 46.3 -62.8 -39.6 25.5 -1.5 -2.9 146 145 A K H X S+ 0 0 37 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.907 107.0 57.2 -70.3 -41.9 28.8 -3.2 -1.7 147 146 A Y H <>S+ 0 0 2 -4,-3.2 5,-2.9 1,-0.2 4,-0.5 0.904 107.9 49.2 -48.9 -44.7 27.2 -3.9 1.7 148 147 A K H ><5S+ 0 0 164 -4,-1.9 3,-1.2 1,-0.2 -1,-0.2 0.926 109.8 49.5 -66.8 -43.4 24.5 -5.8 -0.2 149 148 A E H 3<5S+ 0 0 136 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.850 110.5 52.7 -60.5 -35.0 27.0 -7.8 -2.3 150 149 A L T 3<5S- 0 0 65 -4,-2.3 -1,-0.3 2,-0.2 -2,-0.2 0.487 121.8-105.4 -82.0 -8.3 28.9 -8.6 1.0 151 150 A G T < 5S+ 0 0 73 -3,-1.2 2,-0.5 -4,-0.5 -3,-0.2 0.631 78.0 127.3 93.0 19.3 25.7 -10.0 2.7 152 151 A Y < - 0 0 52 -5,-2.9 2,-0.9 -6,-0.2 -1,-0.2 -0.940 42.3-165.1-114.1 119.0 25.1 -7.1 5.1 153 152 A Q 0 0 192 -2,-0.5 -9,-0.0 1,-0.1 -5,-0.0 -0.909 360.0 360.0 -93.4 103.2 21.7 -5.4 5.3 154 153 A G 0 0 39 -2,-0.9 -51,-0.6 -10,-0.1 -52,-0.3 0.290 360.0 360.0-150.7 360.0 22.9 -2.3 7.2