==== 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 STORAGE 10-MAY-93 2MGE . 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) . 8211.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 128 83.1 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 . 21 13.6 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 86 0, 0.0 2,-0.4 0, 0.0 140,-0.0 0.000 360.0 360.0 360.0 168.7 24.5 9.8 -9.8 2 1 A V - 0 0 122 136,-0.0 2,-0.4 0, 0.0 79,-0.1 -0.988 360.0-145.9-148.9 123.8 27.1 11.9 -11.4 3 2 A L - 0 0 12 -2,-0.4 2,-0.1 77,-0.1 128,-0.0 -0.787 22.4-122.4 -83.9 154.8 28.5 15.2 -10.4 4 3 A S > - 0 0 62 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.299 28.5-107.8 -84.1 169.1 29.6 17.7 -12.9 5 4 A E H > S+ 0 0 103 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.851 121.2 57.3 -65.1 -44.6 33.2 19.0 -12.9 6 5 A G H > S+ 0 0 45 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.857 106.7 49.0 -50.2 -43.8 32.0 22.3 -11.5 7 6 A E H > S+ 0 0 55 2,-0.2 4,-2.3 1,-0.2 3,-0.4 0.947 110.4 50.0 -63.6 -46.3 30.4 20.5 -8.5 8 7 A W H X S+ 0 0 15 -4,-2.6 4,-3.2 1,-0.2 5,-0.2 0.860 107.4 55.8 -59.3 -35.6 33.7 18.5 -8.0 9 8 A Q H X S+ 0 0 93 -4,-1.9 4,-1.8 -5,-0.2 -1,-0.2 0.873 106.7 48.6 -65.2 -40.6 35.6 21.8 -8.1 10 9 A L H X S+ 0 0 66 -4,-1.5 4,-1.9 -3,-0.4 5,-0.3 0.951 114.1 48.1 -64.3 -36.7 33.4 23.3 -5.3 11 10 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.945 115.0 42.6 -72.5 -43.2 34.0 20.1 -3.2 12 11 A L H X S+ 0 0 36 -4,-3.2 4,-1.8 1,-0.2 -1,-0.2 0.820 108.0 61.2 -79.8 -17.5 37.7 20.0 -3.7 13 12 A H H X S+ 0 0 90 -4,-1.8 4,-0.8 -5,-0.2 -1,-0.2 0.937 111.1 37.5 -70.7 -49.8 38.1 23.7 -3.2 14 13 A V H >X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 3,-0.7 0.890 112.5 60.2 -68.7 -32.9 36.8 23.6 0.4 15 14 A W H 3X S+ 0 0 6 -4,-2.2 4,-2.6 -5,-0.3 -2,-0.2 0.877 97.0 59.3 -59.4 -37.1 38.5 20.3 1.0 16 15 A A H 3< S+ 0 0 55 -4,-1.8 4,-0.3 1,-0.2 -1,-0.2 0.866 105.7 49.5 -61.1 -27.8 41.9 22.0 0.3 17 16 A K H X< S+ 0 0 82 -4,-0.8 3,-1.2 -3,-0.7 4,-0.3 0.905 108.4 52.4 -75.5 -43.4 41.1 24.4 3.2 18 17 A V H >< S+ 0 0 1 -4,-2.0 3,-2.2 1,-0.2 7,-0.3 0.914 103.1 60.4 -54.7 -41.1 40.2 21.3 5.5 19 18 A E G >< S+ 0 0 78 -4,-2.6 3,-0.5 1,-0.3 -1,-0.2 0.682 85.4 74.2 -66.7 -11.5 43.6 19.8 4.5 20 19 A A G < S+ 0 0 90 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.776 118.7 14.6 -72.0 -18.4 45.4 22.8 6.0 21 20 A D G <> S+ 0 0 66 -3,-2.2 4,-1.9 -4,-0.3 -1,-0.3 -0.525 72.0 165.6-151.4 80.1 44.5 21.2 9.5 22 21 A V H <> S+ 0 0 34 -3,-0.5 4,-2.5 1,-0.2 5,-0.2 0.941 76.2 50.5 -71.5 -36.4 43.3 17.7 9.2 23 22 A A H > S+ 0 0 26 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.935 110.3 48.9 -69.3 -36.9 43.6 16.7 12.8 24 23 A G H > S+ 0 0 8 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.881 114.0 45.5 -67.3 -43.3 41.6 19.7 14.1 25 24 A H H X S+ 0 0 3 -4,-1.9 4,-2.2 -7,-0.3 -1,-0.3 0.846 110.5 54.5 -64.9 -43.9 38.8 19.1 11.6 26 25 A G H X S+ 0 0 1 -4,-2.5 4,-2.2 -5,-0.2 5,-0.3 0.927 111.0 46.5 -58.5 -37.1 38.8 15.4 12.4 27 26 A Q H X S+ 0 0 39 -4,-2.5 4,-2.4 1,-0.2 5,-0.3 0.955 111.9 49.4 -69.1 -51.8 38.3 16.2 16.1 28 27 A D H X S+ 0 0 65 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.913 113.3 46.8 -52.1 -44.9 35.6 18.7 15.5 29 28 A I H X S+ 0 0 3 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.925 113.2 46.0 -67.0 -46.3 33.7 16.4 13.2 30 29 A L H X S+ 0 0 4 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.903 114.4 48.9 -66.6 -37.1 33.9 13.2 15.5 31 30 A I H X S+ 0 0 7 -4,-2.4 4,-3.0 -5,-0.3 5,-0.3 0.927 110.8 50.0 -69.0 -38.4 32.9 15.2 18.6 32 31 A R H X S+ 0 0 70 -4,-2.2 4,-2.4 -5,-0.3 5,-0.3 0.948 112.1 49.8 -62.6 -38.8 30.0 16.9 16.7 33 32 A L H X S+ 0 0 8 -4,-2.4 4,-2.4 1,-0.2 7,-0.2 0.945 113.5 43.3 -63.2 -54.2 28.9 13.4 15.7 34 33 A F H < S+ 0 0 5 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.871 116.1 48.8 -63.9 -34.5 29.1 11.9 19.2 35 34 A K H < S+ 0 0 103 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.942 118.2 38.6 -70.1 -48.3 27.4 14.9 20.8 36 35 A S H < S+ 0 0 41 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.733 133.4 22.4 -65.0 -40.4 24.6 14.9 18.3 37 36 A H >< + 0 0 27 -4,-2.4 3,-2.3 -5,-0.3 4,-0.5 -0.518 68.7 176.3-132.9 84.4 24.1 11.2 18.0 38 37 A P G >> S+ 0 0 78 0, 0.0 3,-1.0 0, 0.0 4,-0.6 0.720 73.0 71.8 -64.4 -30.3 25.5 9.6 21.1 39 38 A E G >4 S+ 0 0 76 1,-0.2 3,-1.1 2,-0.2 4,-0.2 0.856 88.6 65.2 -56.5 -24.6 24.5 6.1 20.1 40 39 A T G X4 S+ 0 0 4 -3,-2.3 3,-2.1 1,-0.3 4,-0.4 0.878 88.5 66.6 -67.4 -26.6 27.2 6.2 17.5 41 40 A L G X4 S+ 0 0 21 -3,-1.0 3,-1.6 -4,-0.5 -1,-0.3 0.825 87.6 69.5 -64.8 -23.1 29.9 6.4 20.2 42 41 A E G << S+ 0 0 135 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.617 86.6 65.8 -66.7 -21.9 29.0 2.9 21.2 43 42 A K G < S+ 0 0 79 -3,-2.1 2,-1.1 -4,-0.2 -1,-0.3 0.640 86.6 79.4 -76.6 -12.2 30.4 1.5 18.1 44 43 A F X> - 0 0 57 -3,-1.6 3,-3.2 -4,-0.4 4,-1.8 -0.556 59.1-174.5 -97.1 98.5 33.8 2.6 19.1 45 44 A D T 34 S+ 0 0 120 -2,-1.1 4,-0.2 1,-0.3 -1,-0.2 0.797 84.3 52.6 -55.9 -38.1 35.1 0.0 21.6 46 45 A R T 34 S+ 0 0 140 1,-0.2 -1,-0.3 -3,-0.1 15,-0.1 0.531 122.4 26.3 -71.3 -23.3 38.2 2.1 22.3 47 46 A F T X4 S+ 0 0 3 -3,-3.2 3,-2.2 -6,-0.2 -2,-0.2 0.454 81.1 104.2-122.2 1.2 36.4 5.2 23.1 48 47 A K T 3< S+ 0 0 114 -4,-1.8 -3,-0.1 1,-0.3 -2,-0.1 0.671 76.6 68.1 -66.6 -6.7 32.9 4.5 24.3 49 48 A H T 3 + 0 0 124 -4,-0.2 -1,-0.3 -8,-0.1 2,-0.1 0.627 69.7 113.3 -85.1 -4.5 34.0 5.3 27.9 50 49 A L < - 0 0 19 -3,-2.2 3,-0.1 1,-0.1 -3,-0.0 -0.362 43.3-176.4 -71.7 124.9 34.5 9.0 27.1 51 50 A K + 0 0 173 1,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.746 55.3 27.7 -95.2 -32.2 32.0 11.0 29.1 52 51 A T S >> S- 0 0 71 1,-0.1 4,-2.0 0, 0.0 3,-0.6 -0.948 75.3-110.7-128.2 171.5 32.4 14.6 28.2 53 52 A E H 3> S+ 0 0 71 -2,-0.3 4,-3.0 1,-0.3 5,-0.2 0.896 117.3 58.4 -72.0 -19.7 33.5 16.8 25.3 54 53 A A H 3> S+ 0 0 69 1,-0.3 4,-1.0 2,-0.2 -1,-0.3 0.907 106.2 47.9 -74.0 -37.4 36.5 17.8 27.3 55 54 A E H <> S+ 0 0 84 -3,-0.6 4,-0.7 1,-0.2 -1,-0.3 0.856 111.4 51.0 -65.6 -43.5 37.6 14.2 27.6 56 55 A M H >< S+ 0 0 13 -4,-2.0 3,-0.8 1,-0.2 -2,-0.2 0.911 109.2 50.9 -58.6 -44.8 37.0 13.7 23.9 57 56 A K H 3< S+ 0 0 115 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.728 110.0 50.2 -62.8 -35.1 39.1 16.7 23.0 58 57 A A H 3< S+ 0 0 77 -4,-1.0 2,-0.6 -5,-0.2 -1,-0.2 0.562 84.3 107.8 -80.8 -4.6 41.9 15.5 25.2 59 58 A S S+ 0 0 113 -2,-0.6 4,-1.8 1,-0.3 -1,-0.2 0.796 89.6 53.6 -67.4 -40.0 45.0 11.6 21.6 61 60 A D H > S+ 0 0 60 2,-0.2 4,-1.7 3,-0.1 -1,-0.3 0.729 105.7 52.3 -61.5 -48.4 43.6 8.4 20.1 62 61 A L H > S+ 0 0 1 -3,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.871 109.6 50.1 -54.3 -40.1 40.4 10.1 19.1 63 62 A K H X S+ 0 0 68 -4,-1.8 4,-1.7 1,-0.2 -2,-0.2 0.930 109.7 51.0 -67.7 -38.0 42.4 12.7 17.3 64 63 A K H X S+ 0 0 105 -4,-1.8 4,-2.5 1,-0.3 -1,-0.2 0.919 110.0 49.1 -67.2 -39.8 44.4 10.0 15.5 65 64 A L H X S+ 0 0 34 -4,-1.7 4,-2.5 1,-0.2 -1,-0.3 0.840 106.6 56.9 -64.5 -41.4 41.3 8.3 14.4 66 65 A G H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.875 107.6 47.3 -53.8 -46.2 39.9 11.6 13.1 67 66 A V H X S+ 0 0 49 -4,-1.7 4,-2.6 2,-0.2 5,-0.2 0.910 111.8 51.2 -64.0 -43.3 43.0 12.0 10.8 68 67 A T H X S+ 0 0 91 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.903 112.5 46.0 -57.9 -46.1 42.6 8.4 9.6 69 68 A V H X S+ 0 0 51 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.941 116.1 44.2 -63.0 -45.1 38.9 8.9 8.8 70 69 A L H X S+ 0 0 3 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.882 111.0 54.1 -73.4 -29.4 39.4 12.3 7.0 71 70 A T H X S+ 0 0 83 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.932 110.2 46.1 -71.5 -38.0 42.4 11.1 5.1 72 71 A A H X S+ 0 0 46 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.2 0.872 114.3 48.8 -70.7 -37.0 40.5 8.1 3.7 73 72 A L H X S+ 0 0 18 -4,-2.0 4,-3.0 2,-0.2 -1,-0.2 0.912 109.6 52.0 -65.9 -44.5 37.5 10.3 2.8 74 73 A G H X S+ 0 0 2 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.902 107.2 53.0 -58.7 -40.5 39.8 12.9 1.1 75 74 A A H X S+ 0 0 46 -4,-2.0 4,-0.6 2,-0.2 -1,-0.2 0.921 111.3 47.2 -65.9 -32.3 41.4 10.2 -1.0 76 75 A I H ><>S+ 0 0 9 -4,-1.6 3,-1.4 1,-0.2 5,-0.5 0.962 111.9 48.4 -76.6 -41.6 37.9 9.1 -2.1 77 76 A L H ><5S+ 0 0 2 -4,-3.0 3,-1.9 1,-0.3 -1,-0.2 0.896 104.2 60.4 -68.9 -30.3 36.7 12.6 -3.0 78 77 A K H 3<5S+ 0 0 106 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.708 94.2 65.5 -70.9 -17.3 39.9 13.3 -4.9 79 78 A K T X<5S- 0 0 76 -3,-1.4 3,-2.5 -4,-0.6 -1,-0.3 0.352 98.0-141.2 -69.4 -25.6 39.0 10.4 -7.3 80 79 A K T < 5S- 0 0 62 -3,-1.9 -3,-0.1 1,-0.3 -77,-0.1 0.768 72.9 -34.1 61.6 47.8 35.9 12.4 -8.4 81 80 A G T 3 + 0 0 6 -2,-1.4 4,-2.5 1,-0.2 3,-0.4 0.149 17.6 122.1-125.3 20.4 36.6 5.4 -6.3 84 83 A E H > S+ 0 0 117 1,-0.3 4,-1.1 2,-0.2 -1,-0.2 0.921 79.8 46.8 -48.5 -46.1 35.7 1.7 -6.7 85 84 A A H 4 S+ 0 0 69 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.821 111.2 49.8 -67.9 -45.7 39.0 0.5 -5.5 86 85 A E H > S+ 0 0 64 -3,-0.4 4,-0.8 1,-0.2 -1,-0.2 0.826 109.5 53.6 -57.4 -38.6 39.2 2.8 -2.5 87 86 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.1 5,-0.3 0.714 91.9 74.1 -69.5 -32.1 35.7 1.8 -1.4 88 87 A K H X S+ 0 0 151 -4,-1.1 4,-2.3 2,-0.2 5,-0.2 0.974 102.2 35.8 -53.3 -53.8 36.2 -2.0 -1.4 89 88 A P H > S+ 0 0 80 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.900 118.7 53.9 -69.8 -28.9 38.3 -2.4 1.8 90 89 A L H X S+ 0 0 33 -4,-0.8 4,-2.4 1,-0.2 5,-0.2 0.929 110.1 45.6 -70.1 -43.8 36.3 0.4 3.5 91 90 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 5,-0.3 0.905 112.4 52.1 -66.6 -41.6 33.0 -1.3 2.8 92 91 A Q H X>S+ 0 0 116 -4,-2.3 4,-2.5 -5,-0.3 5,-0.7 0.963 112.9 42.4 -63.7 -45.7 34.3 -4.6 3.9 93 92 A S H X>S+ 0 0 36 -4,-2.8 5,-2.2 1,-0.2 4,-1.4 0.957 116.7 47.1 -70.8 -34.4 35.6 -3.4 7.3 94 93 A H H <5S+ 0 0 51 -4,-2.4 6,-2.7 -5,-0.3 -1,-0.2 0.800 119.3 40.0 -78.8 -21.5 32.6 -1.3 8.0 95 94 A A H <5S+ 0 0 3 -4,-2.1 -2,-0.2 4,-0.2 -3,-0.2 0.945 129.8 23.2 -90.1 -36.9 30.1 -4.0 7.1 96 95 A T H <5S+ 0 0 84 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.819 131.6 28.8 -99.8 -40.7 31.8 -7.1 8.6 97 96 A K T <> - 0 0 27 0, 0.0 3,-1.5 0, 0.0 4,-1.0 -0.261 22.3-113.8 -74.3 155.9 24.7 1.0 9.5 102 101 A I H >> S+ 0 0 20 52,-0.7 4,-2.1 1,-0.3 3,-1.0 0.879 115.7 66.3 -58.2 -33.2 24.0 3.4 6.5 103 102 A K H 3> S+ 0 0 112 51,-0.5 4,-1.9 1,-0.3 -1,-0.3 0.866 97.9 51.8 -58.2 -33.5 22.1 5.6 8.9 104 103 A Y H <> S+ 0 0 50 -3,-1.5 4,-2.0 2,-0.2 -1,-0.3 0.724 105.5 54.7 -74.4 -30.4 25.4 6.3 10.8 105 104 A L H < + 0 0 28 -4,-2.7 3,-1.7 -5,-0.3 4,-0.4 -0.315 62.6 150.5-137.1 57.5 34.6 27.9 6.1 121 120 A P G > S+ 0 0 88 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.858 76.6 54.0 -65.2 -31.6 31.5 30.1 5.5 122 121 A G G 3 S+ 0 0 73 1,-0.3 3,-0.2 -3,-0.1 -2,-0.1 0.733 116.7 35.9 -73.6 -26.3 33.1 31.9 2.7 123 122 A N G < S+ 0 0 56 -3,-1.7 -1,-0.3 -7,-0.2 -109,-0.1 0.102 114.6 60.7-107.6 15.5 34.0 28.8 0.8 124 123 A F < + 0 0 3 -3,-1.0 -1,-0.1 -4,-0.4 -2,-0.1 -0.235 65.4 144.7-143.3 58.6 30.8 27.0 1.8 125 124 A G S > S- 0 0 43 -3,-0.2 4,-2.5 4,-0.0 5,-0.3 -0.068 71.0 -75.0 -77.1-168.8 27.9 28.9 0.5 126 125 A A H > S+ 0 0 82 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.874 131.2 49.6 -66.1 -38.7 24.7 27.2 -0.7 127 126 A D H > S+ 0 0 136 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.941 113.0 47.0 -67.2 -40.6 26.1 26.0 -4.0 128 127 A A H > S+ 0 0 9 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.869 112.6 50.2 -67.4 -33.5 29.2 24.5 -2.4 129 128 A Q H X S+ 0 0 71 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.911 108.8 51.6 -70.9 -39.8 27.1 22.8 0.3 130 129 A G H X S+ 0 0 40 -4,-2.3 4,-2.0 -5,-0.3 -2,-0.2 0.918 111.2 48.4 -61.7 -42.2 24.9 21.3 -2.3 131 130 A A H X S+ 0 0 3 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.910 112.2 47.6 -65.6 -42.6 27.9 19.9 -4.1 132 131 A M H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.920 111.3 51.1 -64.2 -42.0 29.4 18.5 -0.9 133 132 A N H X S+ 0 0 56 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.895 110.1 49.5 -59.2 -48.8 26.1 16.9 -0.0 134 133 A K H X S+ 0 0 58 -4,-2.0 4,-2.5 -5,-0.2 5,-0.2 0.896 111.1 50.6 -53.7 -44.4 25.8 15.3 -3.6 135 134 A A H X S+ 0 0 2 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.945 113.1 44.3 -64.7 -36.7 29.4 14.0 -3.2 136 135 A L H X S+ 0 0 2 -4,-2.4 4,-3.1 2,-0.2 -2,-0.2 0.884 111.9 52.6 -76.6 -32.1 28.6 12.4 0.2 137 136 A E H X S+ 0 0 78 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.900 110.1 49.5 -66.4 -36.7 25.3 11.0 -1.1 138 137 A L H X S+ 0 0 10 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.920 111.1 49.8 -64.6 -48.0 27.2 9.4 -4.0 139 138 A F H X S+ 0 0 22 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.968 113.3 45.0 -53.1 -49.2 29.7 8.0 -1.4 140 139 A R H X S+ 0 0 34 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.875 112.2 52.5 -64.1 -39.3 26.9 6.6 0.7 141 140 A K H X S+ 0 0 82 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.948 112.2 44.7 -62.8 -42.7 25.0 5.2 -2.4 142 141 A D H X S+ 0 0 32 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.905 114.5 48.2 -70.8 -38.8 28.0 3.4 -3.6 143 142 A I H X S+ 0 0 2 -4,-2.7 4,-2.7 -5,-0.3 -1,-0.2 0.914 108.9 53.8 -67.3 -38.3 28.9 2.0 -0.1 144 143 A A H X S+ 0 0 19 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.925 108.7 50.2 -61.0 -34.8 25.3 0.9 0.5 145 144 A A H X S+ 0 0 41 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.921 111.3 47.6 -70.0 -39.0 25.5 -1.1 -2.8 146 145 A K H X S+ 0 0 50 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.888 107.1 57.0 -67.0 -39.5 28.8 -2.7 -1.8 147 146 A Y H X>S+ 0 0 0 -4,-2.7 5,-2.4 1,-0.2 4,-0.6 0.918 106.6 51.2 -55.1 -45.1 27.3 -3.5 1.7 148 147 A K H ><5S+ 0 0 145 -4,-1.9 3,-1.3 1,-0.2 -2,-0.2 0.954 108.7 48.2 -60.2 -45.5 24.6 -5.4 -0.2 149 148 A E H 3<5S+ 0 0 155 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.801 111.6 52.7 -62.3 -35.8 27.0 -7.5 -2.3 150 149 A L H 3<5S- 0 0 78 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.537 120.1-109.1 -78.1 -12.7 28.9 -8.2 0.9 151 150 A G T <<5S+ 0 0 70 -3,-1.3 -3,-0.2 -4,-0.6 -2,-0.1 0.546 93.9 88.5 100.1 15.7 25.8 -9.5 2.7 152 151 A Y < + 0 0 65 -5,-2.4 -4,-0.2 -6,-0.2 -5,-0.1 0.848 40.9 167.9-115.2 -48.6 25.2 -6.7 5.2 153 152 A Q 0 0 94 -6,-0.5 -9,-0.1 -9,-0.2 -8,-0.0 0.815 360.0 360.0 25.7 92.9 23.0 -4.0 3.8 154 153 A G 0 0 41 -54,-0.2 -52,-0.7 -10,-0.0 -51,-0.5 -0.038 360.0 360.0-161.8 360.0 22.2 -2.1 7.0