==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 03-FEB-11 3QM6 . COMPND 2 MOLECULE: MYOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: THUNNUS ATLANTICUS; . AUTHOR V.S.DE SERRANO,E.R.SCHREITER,M.M.RODRIGUEZ . 145 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7632.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 79.3 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 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 15.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 57.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.1 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 1 0 1 0 0 0 0 0 0 1 0 1 0 1 1 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 2 A A > 0 0 106 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -36.5 19.2 14.2 5.3 2 3 A D H > + 0 0 61 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.867 360.0 52.6 -68.8 -31.7 18.4 10.8 6.7 3 4 A F H > S+ 0 0 23 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.934 109.9 48.9 -64.4 -44.1 14.7 11.2 5.8 4 5 A D H > S+ 0 0 60 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.895 107.5 55.6 -61.2 -39.9 15.7 12.1 2.2 5 6 A A H < S+ 0 0 32 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.905 111.8 42.7 -60.9 -41.7 17.9 9.0 2.1 6 7 A V H >< S+ 0 0 0 -4,-1.8 3,-2.2 1,-0.2 -2,-0.2 0.920 111.0 54.9 -69.9 -43.0 15.0 6.7 3.1 7 8 A L H >< S+ 0 0 42 -4,-2.6 3,-1.2 1,-0.3 4,-0.4 0.784 95.4 67.1 -65.3 -26.2 12.5 8.5 0.7 8 9 A K T 3< S+ 0 0 177 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.621 111.6 35.5 -68.8 -5.3 14.9 7.9 -2.2 9 10 A C T < S+ 0 0 22 -3,-2.2 4,-0.3 -4,-0.2 -1,-0.2 0.210 92.0 92.2-125.0 9.7 14.0 4.2 -1.7 10 11 A W X> + 0 0 4 -3,-1.2 4,-2.6 1,-0.2 3,-1.0 0.665 61.0 88.6 -81.4 -15.9 10.4 4.5 -0.7 11 12 A G H 3> S+ 0 0 51 -4,-0.4 4,-2.1 1,-0.3 -1,-0.2 0.888 87.5 47.4 -49.7 -49.8 9.0 4.1 -4.2 12 13 A P H 34 S+ 0 0 59 0, 0.0 4,-0.4 0, 0.0 -1,-0.3 0.740 113.8 49.9 -66.0 -25.1 8.8 0.3 -4.1 13 14 A V H X4 S+ 0 0 1 -3,-1.0 3,-1.4 -4,-0.3 7,-0.3 0.950 114.1 42.0 -73.8 -55.5 7.1 0.4 -0.7 14 15 A E H >< S+ 0 0 85 -4,-2.6 3,-0.6 1,-0.3 -3,-0.2 0.769 104.3 68.6 -61.0 -29.9 4.4 3.0 -1.7 15 16 A A T 3< S+ 0 0 84 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.751 122.5 9.4 -61.2 -31.0 3.9 1.2 -5.1 16 17 A D T <> + 0 0 72 -3,-1.4 4,-2.7 -4,-0.4 5,-0.4 -0.422 65.4 168.5-154.8 79.4 2.4 -1.8 -3.2 17 18 A Y H <> S+ 0 0 28 -3,-0.6 4,-2.2 1,-0.2 5,-0.2 0.806 80.5 56.3 -61.8 -33.7 1.7 -1.1 0.4 18 19 A T H > S+ 0 0 72 2,-0.2 4,-2.4 3,-0.2 -1,-0.2 0.951 111.2 40.1 -62.8 -52.6 -0.4 -4.3 0.6 19 20 A T H > S+ 0 0 72 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.949 122.4 40.7 -65.5 -47.7 2.3 -6.7 -0.6 20 21 A I H X S+ 0 0 16 -4,-2.7 4,-2.5 -7,-0.3 -1,-0.2 0.907 114.4 53.2 -69.3 -36.7 5.1 -5.0 1.3 21 22 A G H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.4 5,-0.2 0.913 109.9 48.3 -60.9 -42.3 2.9 -4.5 4.4 22 23 A G H X S+ 0 0 3 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.898 109.5 52.9 -64.4 -40.4 2.1 -8.2 4.4 23 24 A L H X S+ 0 0 67 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.925 110.5 48.3 -57.5 -46.5 5.8 -9.0 4.0 24 25 A V H X S+ 0 0 3 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.947 115.4 41.4 -62.7 -51.5 6.6 -6.9 7.0 25 26 A L H X S+ 0 0 2 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.898 114.4 52.2 -67.3 -38.2 3.9 -8.3 9.3 26 27 A T H X S+ 0 0 23 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.936 113.4 44.6 -59.6 -46.2 4.5 -11.9 8.2 27 28 A R H X S+ 0 0 60 -4,-2.3 4,-2.8 -5,-0.3 5,-0.3 0.878 111.1 53.9 -64.1 -41.1 8.2 -11.5 8.9 28 29 A L H X S+ 0 0 6 -4,-2.5 4,-2.3 -5,-0.2 7,-0.3 0.935 112.3 43.6 -57.9 -48.1 7.6 -9.8 12.2 29 30 A F H < S+ 0 0 1 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.838 115.7 49.0 -69.1 -32.7 5.3 -12.7 13.4 30 31 A K H < S+ 0 0 144 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.920 122.2 31.8 -68.6 -50.4 7.8 -15.3 12.0 31 32 A E H < S+ 0 0 89 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.708 133.4 29.2 -85.9 -21.6 10.9 -13.8 13.7 32 33 A H >< + 0 0 34 -4,-2.3 3,-2.3 -5,-0.3 4,-0.4 -0.673 69.3 174.5-137.9 70.6 9.3 -12.3 16.8 33 34 A P G > S+ 0 0 80 0, 0.0 3,-1.3 0, 0.0 4,-0.5 0.752 72.2 68.4 -62.4 -25.5 6.3 -14.6 17.5 34 35 A E G 3 S+ 0 0 103 1,-0.3 3,-0.5 2,-0.2 4,-0.3 0.697 89.2 66.5 -65.8 -19.9 5.4 -12.9 20.7 35 36 A T G X S+ 0 0 2 -3,-2.3 3,-1.5 -7,-0.3 -1,-0.3 0.773 85.5 70.4 -69.4 -25.1 4.4 -9.8 18.8 36 37 A Q G X S+ 0 0 18 -3,-1.3 3,-1.8 -4,-0.4 6,-0.3 0.844 88.1 63.1 -67.3 -29.5 1.5 -11.7 17.2 37 38 A K G 3 S+ 0 0 171 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.2 0.690 91.4 67.9 -61.5 -22.5 -0.4 -11.8 20.5 38 39 A L G < S+ 0 0 48 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.505 92.1 62.4 -78.4 -4.8 -0.5 -8.0 20.4 39 40 A F X> - 0 0 43 -3,-1.8 4,-2.3 -4,-0.2 3,-2.1 -0.855 68.9-171.1-116.6 89.3 -2.9 -8.1 17.4 40 41 A P T 34 S+ 0 0 117 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.816 84.9 58.9 -57.8 -27.1 -6.0 -9.9 18.8 41 42 A K T 34 S+ 0 0 191 1,-0.2 -4,-0.1 -3,-0.1 15,-0.1 0.764 119.7 27.3 -69.5 -23.7 -7.4 -10.1 15.3 42 43 A F T X4 S+ 0 0 17 -3,-2.1 3,-2.1 -6,-0.3 -1,-0.2 0.543 88.4 118.8-112.6 -15.8 -4.4 -12.1 14.1 43 44 A A T 3< S+ 0 0 44 -4,-2.3 3,-0.1 1,-0.3 -6,-0.1 -0.309 80.2 23.1 -57.5 134.4 -3.2 -13.9 17.3 44 45 A G T 3 S+ 0 0 80 1,-0.3 2,-0.5 0, 0.0 -1,-0.3 0.335 82.5 136.1 91.4 -8.1 -3.3 -17.7 17.0 45 46 A I < - 0 0 45 -3,-2.1 -1,-0.3 -9,-0.1 5,-0.1 -0.633 65.6-108.8 -72.8 125.4 -3.2 -17.8 13.1 46 47 A A > - 0 0 55 -2,-0.5 3,-2.1 1,-0.1 4,-0.2 -0.238 25.1-122.2 -52.2 137.3 -0.8 -20.5 12.2 47 48 A Q G >> S+ 0 0 57 1,-0.3 3,-1.9 2,-0.2 4,-0.6 0.849 109.3 59.6 -55.3 -40.6 2.4 -19.0 10.7 48 49 A A G 34 S+ 0 0 95 1,-0.3 -1,-0.3 2,-0.1 4,-0.2 0.704 104.3 52.5 -64.4 -13.4 2.1 -20.8 7.5 49 50 A D G <4 S+ 0 0 98 -3,-2.1 -1,-0.3 1,-0.1 -2,-0.2 0.349 91.2 76.5-105.3 8.1 -1.2 -19.2 6.9 50 51 A I T X4 S+ 0 0 0 -3,-1.9 3,-1.9 -4,-0.2 7,-0.2 0.868 82.2 61.2 -87.6 -42.0 -0.1 -15.5 7.4 51 52 A A T 3< S+ 0 0 70 -4,-0.6 -1,-0.1 1,-0.3 -2,-0.1 0.821 110.7 42.8 -58.0 -33.1 1.7 -14.7 4.1 52 53 A G T 3 S+ 0 0 75 -4,-0.2 2,-0.7 4,-0.0 -1,-0.3 0.355 86.3 115.0 -91.2 5.9 -1.5 -15.3 2.2 53 54 A N <> - 0 0 49 -3,-1.9 4,-2.2 1,-0.2 5,-0.2 -0.649 49.4-162.3 -90.0 114.6 -3.8 -13.5 4.6 54 55 A A H > S+ 0 0 81 -2,-0.7 4,-2.4 1,-0.2 -1,-0.2 0.832 89.7 54.1 -63.0 -36.1 -5.4 -10.4 3.0 55 56 A A H > S+ 0 0 56 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.892 107.5 50.4 -69.9 -36.9 -6.4 -8.9 6.3 56 57 A V H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.949 112.5 47.6 -60.0 -48.0 -2.8 -9.1 7.6 57 58 A S H X S+ 0 0 13 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.898 108.5 55.1 -63.2 -37.1 -1.6 -7.4 4.5 58 59 A A H X S+ 0 0 51 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.892 109.1 46.3 -63.5 -39.8 -4.2 -4.8 4.7 59 60 A H H X S+ 0 0 69 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.915 109.4 54.6 -70.9 -36.3 -3.1 -3.8 8.2 60 61 A G H X S+ 0 0 3 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.905 106.7 52.6 -58.4 -38.0 0.5 -3.8 7.2 61 62 A A H X S+ 0 0 4 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.902 106.9 52.1 -62.3 -42.1 -0.5 -1.4 4.4 62 63 A T H X S+ 0 0 84 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.926 111.9 46.9 -57.2 -47.3 -2.2 0.9 7.1 63 64 A V H X S+ 0 0 48 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.944 114.9 44.3 -60.0 -51.3 1.1 0.8 9.1 64 65 A L H X S+ 0 0 5 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.864 110.1 55.4 -68.9 -34.6 3.3 1.6 6.2 65 66 A K H X S+ 0 0 117 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.911 110.6 46.2 -58.6 -48.0 1.0 4.3 4.7 66 67 A K H X S+ 0 0 79 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.925 111.4 51.0 -64.2 -40.7 1.2 6.1 8.1 67 68 A L H X S+ 0 0 22 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.904 111.2 49.1 -62.9 -39.0 4.9 5.6 8.2 68 69 A G H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.904 110.2 50.6 -59.5 -49.1 5.2 7.1 4.7 69 70 A E H < S+ 0 0 90 -4,-2.5 4,-0.2 2,-0.2 -1,-0.2 0.888 109.7 50.9 -56.5 -43.2 3.0 10.1 5.6 70 71 A L H >< S+ 0 0 4 -4,-2.4 3,-2.0 1,-0.2 4,-0.4 0.951 109.8 49.7 -59.8 -45.5 5.2 10.7 8.6 71 72 A L H >< S+ 0 0 2 -4,-2.3 3,-1.1 1,-0.3 -2,-0.2 0.828 101.2 62.0 -62.2 -36.0 8.4 10.6 6.4 72 73 A K T 3< S+ 0 0 114 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.553 102.6 55.8 -79.2 4.0 6.9 13.1 3.9 73 74 A A T X S- 0 0 21 -3,-2.0 3,-1.1 -4,-0.2 -1,-0.3 0.577 94.9-149.3 -97.1 -21.8 7.0 15.2 7.0 74 75 A K T < S- 0 0 107 -3,-1.1 -3,-0.1 -4,-0.4 -71,-0.1 0.855 71.6 -43.3 48.0 45.0 10.9 14.9 7.8 75 76 A G T 3 S+ 0 0 30 -5,-0.4 2,-1.9 1,-0.1 -1,-0.2 -0.063 114.6 103.9 100.9 -27.8 10.6 15.2 11.6 76 77 A S < + 0 0 101 -3,-1.1 -1,-0.1 1,-0.2 3,-0.1 -0.618 51.4 125.4 -74.4 75.9 8.1 18.1 12.0 77 78 A H >> + 0 0 18 -2,-1.9 4,-3.2 1,-0.1 3,-1.7 0.268 7.3 122.8-131.5 21.3 5.5 15.5 12.9 78 79 A A H 3> S+ 0 0 54 1,-0.3 4,-2.4 2,-0.3 -1,-0.1 0.867 79.0 55.0 -59.4 -41.4 3.7 16.1 16.2 79 80 A A H 34 S+ 0 0 97 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.756 118.3 41.1 -65.5 -10.2 0.2 16.2 14.8 80 81 A I H <> S+ 0 0 26 -3,-1.7 4,-1.2 2,-0.1 -2,-0.3 0.834 118.2 38.3-100.6 -59.2 1.2 12.9 13.5 81 82 A L H X S+ 0 0 0 -4,-3.2 4,-2.3 1,-0.2 5,-0.2 0.831 106.1 63.6 -77.5 -26.1 3.1 11.1 16.2 82 83 A K H X S+ 0 0 96 -4,-2.4 4,-2.6 -5,-0.3 -1,-0.2 0.953 105.5 44.6 -63.7 -48.8 1.1 12.2 19.3 83 84 A P H > S+ 0 0 71 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.875 112.6 53.0 -60.6 -35.9 -2.1 10.5 18.2 84 85 A L H X S+ 0 0 41 -4,-1.2 4,-2.4 2,-0.2 5,-0.2 0.920 109.8 47.2 -66.3 -42.1 -0.2 7.4 17.3 85 86 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.931 112.2 52.0 -59.5 -47.0 1.5 7.2 20.7 86 87 A N H X S+ 0 0 70 -4,-2.6 4,-2.3 1,-0.2 5,-0.4 0.945 113.7 40.7 -58.2 -48.7 -1.9 7.8 22.4 87 88 A S H X>S+ 0 0 28 -4,-2.6 5,-2.7 1,-0.2 4,-2.0 0.885 117.1 49.1 -71.1 -37.0 -3.7 4.9 20.5 88 89 A H H <>S+ 0 0 37 -4,-2.4 6,-2.6 -5,-0.2 5,-0.6 0.894 117.6 39.3 -73.9 -33.9 -0.7 2.5 20.8 89 90 A A H <5S+ 0 0 2 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.901 130.9 25.2 -74.4 -43.3 -0.2 3.1 24.5 90 91 A T H <5S+ 0 0 62 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.2 0.718 132.1 25.8-102.1 -27.4 -3.8 3.2 25.6 91 92 A K T <5S+ 0 0 154 -4,-2.0 -3,-0.2 -5,-0.4 -4,-0.1 0.808 132.7 27.4-101.8 -57.0 -5.9 1.3 23.0 92 93 A H T - 0 0 74 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.355 25.9-116.8 -61.3 144.3 5.1 -2.1 24.7 96 97 A I T >> S+ 0 0 23 1,-0.3 3,-2.0 2,-0.2 4,-0.8 0.810 107.5 68.1 -53.2 -39.9 7.8 0.3 23.1 97 98 A N H >> S+ 0 0 89 1,-0.3 4,-1.6 2,-0.2 3,-0.7 0.810 87.3 68.0 -58.4 -27.6 10.3 -2.3 22.4 98 99 A N H <> S+ 0 0 25 -3,-1.9 4,-2.3 1,-0.3 -1,-0.3 0.801 92.0 60.2 -62.5 -27.9 8.0 -3.8 19.7 99 100 A F H <> S+ 0 0 26 -3,-2.0 4,-1.7 -4,-0.4 -1,-0.3 0.857 102.7 52.3 -66.3 -34.8 8.5 -0.7 17.6 100 101 A K H - 0 0 109 -2,-0.6 4,-2.6 4,-0.0 5,-0.2 -0.082 36.6 -76.6 -87.2-172.7 21.9 0.3 0.6 118 119 A A H > S+ 0 0 70 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.911 131.0 43.1 -56.8 -47.1 24.2 0.5 3.5 119 120 A G H > S+ 0 0 49 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.875 114.1 52.3 -67.7 -32.0 23.9 4.2 4.0 120 121 A G H > S+ 0 0 4 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.844 104.9 54.7 -68.8 -35.9 20.2 3.9 3.6 121 122 A Q H X S+ 0 0 30 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.929 111.6 46.1 -60.1 -47.7 19.9 1.1 6.2 122 123 A T H X S+ 0 0 64 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.915 111.6 51.3 -60.8 -45.9 21.7 3.5 8.7 123 124 A A H X S+ 0 0 1 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.913 110.6 48.0 -58.9 -43.8 19.5 6.4 7.7 124 125 A L H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.3 0.915 110.4 52.0 -66.7 -40.9 16.4 4.3 8.2 125 126 A R H X S+ 0 0 128 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.903 111.7 48.1 -55.2 -44.6 17.7 3.1 11.6 126 127 A N H X S+ 0 0 74 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.936 112.6 46.2 -66.1 -45.3 18.2 6.7 12.6 127 128 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.927 112.6 50.1 -65.5 -41.9 14.8 7.9 11.4 128 129 A M H X S+ 0 0 18 -4,-3.0 4,-3.1 1,-0.2 -1,-0.2 0.879 107.8 55.2 -63.5 -35.0 13.1 5.0 13.2 129 130 A G H X S+ 0 0 39 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.887 107.3 49.6 -62.8 -38.4 15.1 5.9 16.3 130 131 A I H X S+ 0 0 80 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.938 113.8 45.3 -60.3 -49.0 13.7 9.4 16.1 131 132 A I H X S+ 0 0 9 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.930 114.4 47.5 -62.8 -46.9 10.2 8.1 15.8 132 133 A I H X S+ 0 0 11 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.885 110.3 52.3 -65.8 -38.9 10.5 5.5 18.6 133 134 A A H X S+ 0 0 58 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.882 111.2 47.6 -65.8 -37.4 12.1 8.1 21.0 134 135 A D H X S+ 0 0 46 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.926 111.5 49.6 -68.7 -43.3 9.2 10.4 20.3 135 136 A L H X S+ 0 0 1 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.921 112.2 49.6 -55.4 -45.1 6.7 7.6 20.9 136 137 A E H X S+ 0 0 87 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.895 108.5 51.2 -62.6 -42.9 8.5 6.7 24.1 137 138 A A H X S+ 0 0 49 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.910 113.3 45.8 -63.0 -40.4 8.5 10.3 25.4 138 139 A N H X S+ 0 0 7 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.890 109.0 55.7 -70.4 -40.2 4.6 10.5 24.7 139 140 A Y H ><>S+ 0 0 7 -4,-2.8 5,-2.7 1,-0.2 3,-0.7 0.925 106.8 51.0 -54.1 -46.3 4.1 7.1 26.4 140 141 A K H ><5S+ 0 0 119 -4,-2.3 3,-1.5 1,-0.3 5,-0.3 0.896 104.7 55.7 -59.6 -41.5 5.8 8.6 29.5 141 142 A E H 3<5S+ 0 0 126 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.763 109.6 48.5 -58.8 -31.7 3.5 11.6 29.4 142 143 A L T <<5S- 0 0 67 -4,-1.3 -1,-0.3 -3,-0.7 -2,-0.2 0.418 127.3 -99.3 -85.4 -5.9 0.6 9.1 29.5 143 144 A G T < 5S+ 0 0 66 -3,-1.5 -3,-0.2 -4,-0.4 -2,-0.1 0.666 91.8 114.9 94.7 23.6 2.1 7.1 32.4 144 145 A F < 0 0 93 -5,-2.7 -4,-0.2 1,-0.2 -3,-0.1 -0.414 360.0 360.0-125.2 45.3 3.7 4.3 30.3 145 146 A S 0 0 143 -5,-0.3 -1,-0.2 -6,-0.2 -5,-0.1 0.698 360.0 360.0 -75.3 360.0 7.4 4.8 30.9