==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN STORAGE 27-FEB-92 1MYJ . COMPND 2 MOLECULE: MYOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR S.J.SMERDON,T.J.OLDFIELD,A.J.WILKINSON,Z.DAUTER,K.PETRATOS, . 306 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16251.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 248 81.0 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 . 6 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 194 63.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 2 0 0 0 0 0 0 2 0 4 0 0 3 1 0 0 0 0 2 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 1 A G 0 0 88 0, 0.0 2,-0.2 0, 0.0 79,-0.1 0.000 360.0 360.0 360.0 -19.3 48.8 -12.4 28.4 2 2 A L - 0 0 18 1,-0.2 2,-0.1 77,-0.1 128,-0.0 -0.609 360.0 -90.9 -93.5 171.8 52.5 -12.0 28.8 3 3 A S > - 0 0 63 -2,-0.2 4,-2.6 1,-0.1 3,-0.4 -0.255 38.2-103.7 -81.4 170.6 54.8 -13.1 26.0 4 4 A D H > S+ 0 0 146 1,-0.3 4,-1.7 2,-0.2 -1,-0.1 0.907 126.6 54.9 -54.1 -42.3 56.1 -16.6 26.0 5 5 A G H > S+ 0 0 43 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.821 103.9 50.5 -61.5 -37.7 59.3 -14.9 27.1 6 6 A E H > S+ 0 0 53 -3,-0.4 4,-1.7 2,-0.2 3,-0.3 0.864 108.5 53.6 -72.1 -41.5 57.7 -13.2 30.1 7 7 A W H X S+ 0 0 13 -4,-2.6 4,-2.9 1,-0.3 5,-0.3 0.862 105.7 55.0 -62.0 -34.0 56.2 -16.5 31.2 8 8 A Q H X S+ 0 0 95 -4,-1.7 4,-1.9 -5,-0.2 -1,-0.3 0.903 107.1 47.4 -63.9 -45.4 59.6 -18.0 31.1 9 9 A L H X S+ 0 0 65 -4,-1.3 4,-2.4 -3,-0.3 -1,-0.2 0.875 112.7 51.7 -55.7 -48.9 61.0 -15.3 33.4 10 10 A V H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.930 112.6 43.5 -53.5 -58.2 58.0 -15.8 35.8 11 11 A L H X S+ 0 0 36 -4,-2.9 4,-1.2 1,-0.2 -2,-0.2 0.825 111.7 55.6 -65.2 -34.4 58.5 -19.7 35.9 12 12 A N H X S+ 0 0 99 -4,-1.9 4,-0.8 -5,-0.3 3,-0.4 0.945 111.1 41.6 -67.9 -44.8 62.2 -19.2 36.3 13 13 A V H >X S+ 0 0 8 -4,-2.4 4,-1.2 1,-0.2 3,-0.8 0.885 111.0 57.0 -71.7 -31.7 61.9 -16.9 39.4 14 14 A W H 3X S+ 0 0 6 -4,-2.2 4,-2.5 1,-0.3 -1,-0.2 0.775 93.4 68.2 -64.1 -26.6 59.1 -19.2 40.8 15 15 A G H 3X S+ 0 0 33 -4,-1.2 4,-1.0 -3,-0.4 -1,-0.3 0.923 99.4 52.7 -59.2 -38.1 61.7 -22.1 40.6 16 16 A K H << S+ 0 0 85 -4,-0.8 3,-0.4 -3,-0.8 -1,-0.2 0.904 107.9 48.3 -66.4 -36.9 63.5 -20.1 43.4 17 17 A V H >< S+ 0 0 1 -4,-1.2 3,-3.5 1,-0.2 7,-0.3 0.948 104.4 60.9 -69.1 -37.9 60.3 -20.0 45.5 18 18 A E H >< S+ 0 0 99 -4,-2.5 3,-0.5 1,-0.3 -1,-0.2 0.723 94.6 62.3 -60.3 -24.1 59.7 -23.8 45.0 19 19 A A T 3< S+ 0 0 87 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.560 126.5 13.5 -79.2 -7.1 63.1 -24.5 46.7 20 20 A D T <> S+ 0 0 73 -3,-3.5 4,-2.0 -4,-0.2 -1,-0.3 -0.379 72.8 158.8-163.3 65.8 61.5 -22.9 49.9 21 21 A V H <> S+ 0 0 29 -3,-0.5 4,-2.3 1,-0.2 48,-0.1 0.885 76.9 46.1 -64.1 -49.1 57.8 -22.5 49.5 22 22 A A H > S+ 0 0 28 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.881 112.7 48.6 -69.8 -33.8 57.0 -22.2 53.3 23 23 A G H > S+ 0 0 5 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.927 116.8 44.0 -72.5 -35.7 59.8 -19.7 54.2 24 24 A H H X S+ 0 0 5 -4,-2.0 4,-2.2 -7,-0.3 -1,-0.2 0.906 114.2 50.9 -67.7 -38.9 58.8 -17.5 51.2 25 25 A G H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.923 109.8 49.9 -66.3 -44.3 55.0 -18.0 52.2 26 26 A Q H X S+ 0 0 20 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.915 111.7 47.2 -60.8 -53.5 55.7 -17.0 55.8 27 27 A E H X S+ 0 0 50 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.825 109.2 54.8 -57.6 -39.5 57.6 -13.8 54.8 28 28 A V H X S+ 0 0 3 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.916 110.9 44.6 -61.4 -48.2 54.8 -12.8 52.3 29 29 A L H X S+ 0 0 2 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.890 112.9 51.7 -71.2 -35.5 52.1 -13.0 55.0 30 30 A I H X S+ 0 0 3 -4,-2.5 4,-2.5 1,-0.2 5,-0.4 0.962 111.3 47.2 -62.4 -48.2 54.3 -11.1 57.5 31 31 A R H X S+ 0 0 84 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.882 113.9 47.8 -56.5 -42.5 54.9 -8.3 54.8 32 32 A L H X S+ 0 0 10 -4,-1.9 4,-2.7 2,-0.2 7,-0.3 0.855 114.6 45.4 -65.4 -43.8 51.2 -8.1 54.1 33 33 A F H < S+ 0 0 2 -4,-2.3 7,-0.2 2,-0.2 -2,-0.2 0.804 117.9 43.4 -72.3 -32.5 50.2 -8.0 57.8 34 34 A K H < S+ 0 0 124 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.821 118.8 44.6 -79.8 -39.2 52.8 -5.4 58.6 35 35 A G H < S+ 0 0 44 -4,-1.8 -2,-0.2 -5,-0.4 -3,-0.2 0.918 131.7 17.3 -74.3 -44.9 52.0 -3.5 55.5 36 36 A H >< - 0 0 35 -4,-2.7 3,-2.5 1,-0.1 4,-0.4 -0.801 65.8-175.4-136.6 81.0 48.2 -3.6 55.8 37 37 A P G > S+ 0 0 74 0, 0.0 3,-0.9 0, 0.0 4,-0.4 0.661 77.9 72.5 -49.8 -28.5 47.2 -4.5 59.3 38 38 A E G > S+ 0 0 82 1,-0.2 3,-0.6 2,-0.2 4,-0.2 0.680 88.0 64.1 -63.0 -23.7 43.6 -4.6 58.3 39 39 A T G X S+ 0 0 3 -3,-2.5 3,-1.5 -7,-0.3 -1,-0.2 0.797 90.5 66.2 -69.6 -32.2 44.2 -7.8 56.4 40 40 A L G X S+ 0 0 12 -3,-0.9 3,-1.6 -4,-0.4 6,-0.4 0.756 88.4 65.9 -56.3 -36.6 45.1 -9.6 59.6 41 41 A E G < S+ 0 0 110 -3,-0.6 -1,-0.3 -4,-0.4 -2,-0.2 0.638 88.5 68.2 -60.9 -26.6 41.5 -9.2 60.9 42 42 A K G < S+ 0 0 73 -3,-1.5 2,-0.6 -4,-0.2 -1,-0.3 0.635 91.3 74.4 -72.9 -14.8 40.4 -11.6 58.1 43 43 A F X> - 0 0 48 -3,-1.6 4,-1.8 -4,-0.2 3,-1.6 -0.870 61.0-166.3-111.6 113.4 42.3 -14.4 59.9 44 44 A D T 34 S+ 0 0 134 -2,-0.6 4,-0.3 1,-0.3 3,-0.2 0.865 90.5 45.5 -67.0 -36.8 40.8 -15.9 63.0 45 45 A K T 34 S+ 0 0 135 1,-0.2 -1,-0.3 2,-0.1 15,-0.1 0.459 122.0 36.6 -86.2 0.8 43.9 -17.8 64.1 46 46 A F T X4 S+ 0 0 5 -3,-1.6 3,-2.9 -6,-0.4 -2,-0.2 0.242 84.2 98.9-117.9 -7.6 46.3 -14.8 63.5 47 47 A K T 3< S+ 0 0 80 -4,-1.8 -3,-0.1 1,-0.3 -2,-0.1 0.757 85.7 52.1 -56.7 -26.2 44.1 -11.9 64.5 48 48 A H T 3 S+ 0 0 135 -4,-0.3 2,-0.4 -8,-0.1 -1,-0.3 0.326 73.9 115.1 -91.9 3.3 45.9 -12.0 67.9 49 49 A L < - 0 0 33 -3,-2.9 3,-0.1 1,-0.1 -3,-0.1 -0.642 41.0-177.5 -73.8 129.8 49.5 -11.8 66.7 50 50 A K + 0 0 154 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.518 57.3 22.9-108.6 -5.6 50.7 -8.4 68.0 51 51 A S S > S- 0 0 46 1,-0.1 4,-2.1 0, 0.0 -1,-0.1 -0.924 77.5-107.3-152.0 166.6 54.2 -8.2 66.6 52 52 A E H > S+ 0 0 72 -2,-0.3 4,-3.5 2,-0.2 5,-0.2 0.799 118.0 61.1 -68.7 -28.4 56.4 -9.6 63.9 53 53 A D H > S+ 0 0 131 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.940 107.4 43.5 -63.3 -44.7 58.2 -11.7 66.6 54 54 A E H > S+ 0 0 78 2,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.893 113.8 51.8 -67.2 -46.8 54.9 -13.5 67.3 55 55 A M H >< S+ 0 0 10 -4,-2.1 3,-0.6 1,-0.2 -2,-0.2 0.932 110.1 49.0 -58.0 -39.7 54.2 -13.8 63.5 56 56 A K H 3< S+ 0 0 99 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.824 111.4 49.4 -69.4 -35.4 57.7 -15.3 62.9 57 57 A A H 3< S+ 0 0 77 -4,-1.6 2,-0.3 -5,-0.2 -1,-0.3 0.715 86.0 108.5 -74.0 -20.0 57.2 -17.8 65.7 58 58 A S S+ 0 0 144 -2,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.887 92.3 53.4 -65.6 -44.5 53.6 -22.5 63.1 60 60 A D H > S+ 0 0 71 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.794 104.1 53.0 -64.5 -35.0 50.2 -21.9 61.8 61 61 A L H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.890 110.1 49.0 -63.1 -49.2 51.2 -18.7 60.0 62 62 A K H X S+ 0 0 82 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.858 111.4 49.8 -57.0 -41.7 54.1 -20.6 58.2 63 63 A K H X S+ 0 0 119 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.909 111.2 47.6 -59.8 -55.8 51.6 -23.4 57.2 64 64 A H H X S+ 0 0 61 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.873 109.8 53.7 -60.2 -35.4 49.1 -21.0 55.8 65 65 A G H X S+ 0 0 1 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.917 109.1 49.0 -64.7 -43.3 51.9 -19.2 53.9 66 66 A N H X S+ 0 0 58 -4,-2.0 4,-3.1 1,-0.2 5,-0.2 0.918 112.1 49.7 -60.1 -46.4 52.9 -22.6 52.3 67 67 A T H X S+ 0 0 82 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.853 111.2 48.1 -58.2 -43.5 49.2 -23.2 51.4 68 68 A T H X S+ 0 0 38 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.972 116.5 40.5 -64.6 -50.0 48.8 -19.8 49.8 69 69 A L H X S+ 0 0 4 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.812 110.2 58.7 -72.1 -34.0 52.0 -19.9 47.7 70 70 A T H X S+ 0 0 81 -4,-3.1 4,-1.6 1,-0.2 -1,-0.2 0.921 109.9 44.7 -58.9 -43.8 51.5 -23.5 46.8 71 71 A A H X S+ 0 0 45 -4,-1.7 4,-1.3 -5,-0.2 -2,-0.2 0.884 112.1 50.8 -66.2 -40.0 48.1 -22.5 45.3 72 72 A L H X S+ 0 0 12 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.873 106.7 54.2 -69.3 -37.6 49.5 -19.5 43.5 73 73 A G H X S+ 0 0 2 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.845 104.9 55.7 -62.6 -33.7 52.4 -21.6 41.9 74 74 A G H < S+ 0 0 30 -4,-1.6 4,-0.4 1,-0.2 -1,-0.2 0.863 111.9 43.3 -65.1 -34.3 49.7 -24.0 40.5 75 75 A I H ><>S+ 0 0 3 -4,-1.3 3,-1.3 1,-0.2 5,-0.8 0.927 112.6 50.6 -74.5 -46.6 48.0 -21.0 38.8 76 76 A L H ><5S+ 0 0 2 -4,-2.4 3,-1.5 1,-0.3 -2,-0.2 0.835 103.3 61.5 -63.0 -38.8 51.3 -19.4 37.5 77 77 A K T 3<5S+ 0 0 100 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.622 97.0 58.6 -63.1 -20.2 52.3 -22.8 36.0 78 78 A K T X 5S- 0 0 94 -3,-1.3 3,-2.9 -4,-0.4 -1,-0.3 0.129 98.7-144.9 -89.7 11.4 49.3 -22.7 33.8 79 79 A K T < 5 - 0 0 71 -3,-1.5 -3,-0.2 1,-0.3 -77,-0.1 0.777 67.1 -37.8 42.4 46.4 50.5 -19.4 32.3 80 80 A G T 3 > + 0 0 4 -2,-0.2 4,-2.2 -3,-0.1 3,-1.2 0.341 20.4 114.3-112.0 6.8 44.5 -20.7 34.4 83 83 A E H 3> S+ 0 0 132 1,-0.3 4,-2.7 2,-0.2 3,-0.4 0.944 75.9 54.1 -45.0 -59.3 40.7 -20.3 34.5 84 84 A A H 34 S+ 0 0 72 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.777 113.5 40.1 -51.8 -37.8 40.0 -23.7 36.0 85 85 A E H <> S+ 0 0 57 -3,-1.2 4,-0.5 2,-0.1 -1,-0.2 0.778 114.2 52.8 -85.9 -25.5 42.4 -23.2 38.9 86 86 A L H >X S+ 0 0 5 -4,-2.2 4,-2.6 -3,-0.4 3,-0.7 0.854 96.0 71.7 -72.8 -37.0 41.4 -19.6 39.6 87 87 A T H 3X S+ 0 0 42 -4,-2.7 4,-2.9 1,-0.3 -1,-0.2 0.831 97.7 43.3 -47.3 -64.5 37.7 -20.4 39.8 88 88 A P H 3> S+ 0 0 67 0, 0.0 4,-2.6 0, 0.0 -1,-0.3 0.721 114.8 52.5 -50.3 -35.7 37.6 -22.3 43.1 89 89 A L H S+ 0 0 36 -4,-2.6 5,-2.9 1,-0.2 4,-1.7 0.811 119.4 48.3 -68.5 -28.7 36.1 -19.3 48.3 93 93 A H H <5S+ 0 0 47 -4,-2.2 6,-2.1 3,-0.2 5,-0.4 0.867 116.8 39.5 -78.8 -38.8 37.6 -15.9 48.6 94 94 A A H <5S+ 0 0 4 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.940 129.8 27.2 -72.6 -47.2 34.6 -13.9 47.4 95 95 A T H <5S+ 0 0 92 -4,-2.1 -3,-0.2 -5,-0.3 -2,-0.2 0.670 131.6 23.2 -93.3 -33.8 32.0 -16.0 49.2 96 96 A K T <5S+ 0 0 164 -4,-1.7 -3,-0.2 -5,-0.3 -4,-0.1 0.776 133.4 29.1-107.6 -37.8 33.5 -17.7 52.3 97 97 A H S > - 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0 0 24 77,-0.1 128,-0.0 1,-0.1 5,-0.0 -0.726 360.0-122.4 -96.4 158.7 52.9 21.6 16.7 157 3 B S > - 0 0 60 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.181 30.8-108.2 -72.7 167.2 55.1 22.6 19.5 158 4 B D H > S+ 0 0 146 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.855 124.5 53.0 -57.5 -38.5 56.4 26.1 19.6 159 5 B G H > S+ 0 0 40 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.879 105.8 51.2 -66.1 -38.6 59.7 24.6 18.7 160 6 B E H > S+ 0 0 48 2,-0.2 4,-2.2 1,-0.2 3,-0.4 0.891 109.5 50.4 -71.4 -43.1 58.3 22.8 15.7 161 7 B W H X S+ 0 0 16 -4,-2.4 4,-2.7 1,-0.3 5,-0.3 0.847 107.7 56.0 -60.2 -37.0 56.7 26.0 14.4 162 8 B Q H X S+ 0 0 97 -4,-1.8 4,-1.4 -5,-0.2 -1,-0.3 0.900 107.3 45.8 -60.4 -44.7 60.1 27.6 14.9 163 9 B L H X S+ 0 0 58 -4,-1.3 4,-2.3 -3,-0.4 -2,-0.2 0.927 114.3 51.6 -63.7 -44.5 61.8 24.9 12.6 164 10 B V H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.883 111.4 44.5 -56.7 -48.4 59.0 25.5 10.1 165 11 B L H X S+ 0 0 41 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.865 112.4 53.5 -69.2 -34.8 59.4 29.2 10.0 166 12 B N H X S+ 0 0 101 -4,-1.4 4,-0.6 -5,-0.3 -1,-0.2 0.954 110.2 44.2 -66.7 -47.3 63.0 28.9 9.8 167 13 B V H >X S+ 0 0 8 -4,-2.3 3,-1.3 1,-0.2 4,-0.9 0.903 108.9 59.6 -62.4 -40.6 63.0 26.6 6.7 168 14 B W H 3X S+ 0 0 6 -4,-2.6 4,-2.6 1,-0.3 3,-0.4 0.816 91.1 69.2 -59.7 -33.5 60.3 28.9 5.2 169 15 B G H 3X S+ 0 0 35 -4,-1.5 4,-0.8 1,-0.3 -1,-0.3 0.892 98.1 52.9 -53.3 -38.0 62.9 31.8 5.4 170 16 B K H << S+ 0 0 89 -3,-1.3 3,-0.3 -4,-0.6 4,-0.3 0.815 107.6 48.7 -64.5 -41.5 64.8 29.8 2.6 171 17 B V H >< S+ 0 0 2 -4,-0.9 3,-2.3 -3,-0.4 7,-0.3 0.893 105.9 58.2 -73.6 -31.0 61.8 29.7 0.4 172 18 B E H >< S+ 0 0 91 -4,-2.6 3,-0.5 1,-0.3 -2,-0.2 0.710 95.2 63.5 -68.4 -17.2 61.2 33.5 1.0 173 19 B A T 3< S+ 0 0 85 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.2 0.560 127.1 12.4 -79.2 -10.3 64.7 34.3 -0.4 174 20 B D T <> S+ 0 0 72 -3,-2.3 4,-2.2 -4,-0.3 -1,-0.3 -0.397 71.8 159.3-160.8 72.4 63.3 32.8 -3.7 175 21 B V H <> S+ 0 0 29 -3,-0.5 4,-2.5 1,-0.2 5,-0.2 0.900 77.7 47.0 -66.3 -48.2 59.6 32.2 -3.7 176 22 B A H > S+ 0 0 29 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.852 113.2 49.0 -65.6 -37.8 59.0 32.1 -7.5 177 23 B G H > S+ 0 0 16 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.909 114.1 44.0 -65.6 -46.2 61.9 29.7 -8.0 178 24 B H H X S+ 0 0 4 -4,-2.2 4,-2.2 -7,-0.3 -2,-0.2 0.883 114.8 52.2 -66.7 -36.3 60.8 27.3 -5.3 179 25 B G H X S+ 0 0 1 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.891 107.4 50.0 -66.3 -44.9 57.1 27.7 -6.6 180 26 B Q H X S+ 0 0 28 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.959 113.0 47.1 -57.5 -55.1 58.0 26.8 -10.2 181 27 B E H X S+ 0 0 45 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.924 109.6 54.2 -59.3 -39.9 60.0 23.6 -9.0 182 28 B V H X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.932 111.3 45.1 -59.6 -44.8 57.0 22.5 -6.6 183 29 B L H X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.876 112.6 50.6 -74.4 -31.4 54.6 22.7 -9.5 184 30 B I H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 5,-0.3 0.906 111.9 48.2 -65.0 -45.8 57.0 20.8 -11.9 185 31 B R H X S+ 0 0 86 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.2 0.907 113.7 47.1 -57.2 -45.0 57.5 18.1 -9.2 186 32 B L H X S+ 0 0 10 -4,-2.3 4,-2.7 -5,-0.2 7,-0.3 0.953 115.8 44.1 -62.4 -48.6 53.7 17.8 -8.8 187 33 B F H < S+ 0 0 3 -4,-2.5 7,-0.2 2,-0.2 -2,-0.2 0.791 116.9 45.6 -71.3 -28.8 53.0 17.7 -12.5 188 34 B K H < S+ 0 0 84 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.796 118.6 43.3 -82.5 -33.6 55.8 15.2 -13.2 189 35 B G H < S+ 0 0 45 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.812 130.3 20.1 -79.3 -32.7 54.7 13.1 -10.2 190 36 B H >X - 0 0 35 -4,-2.7 3,-2.9 -5,-0.1 4,-0.5 -0.743 66.2-176.3-145.5 79.9 51.0 13.1 -10.7 191 37 B P G >4 S+ 0 0 83 0, 0.0 3,-0.9 0, 0.0 4,-0.5 0.709 78.4 73.3 -50.6 -30.7 50.2 14.0 -14.3 192 38 B E G >4 S+ 0 0 71 1,-0.2 3,-0.9 2,-0.2 4,-0.3 0.740 88.7 61.0 -57.1 -33.3 46.6 13.9 -13.5 193 39 B T G X4 S+ 0 0 2 -3,-2.9 3,-1.4 -7,-0.3 -1,-0.2 0.802 90.8 66.1 -65.6 -32.8 47.0 17.2 -11.6 194 40 B L G X< S+ 0 0 20 -3,-0.9 3,-1.8 -4,-0.5 6,-0.3 0.827 88.7 69.0 -54.6 -35.8 48.1 19.1 -14.7 195 41 B E G < S+ 0 0 142 -3,-0.9 -1,-0.2 -4,-0.5 -2,-0.2 0.793 87.6 65.4 -57.6 -33.2 44.6 18.5 -16.2 196 42 B K G < S+ 0 0 79 -3,-1.4 2,-0.7 -4,-0.3 -1,-0.3 0.550 90.2 79.1 -71.2 -6.3 43.1 21.0 -13.5 197 43 B F X> - 0 0 51 -3,-1.8 4,-1.7 -4,-0.2 3,-1.0 -0.919 59.0-169.0-108.7 109.1 45.0 23.9 -15.1 198 44 B D T 34 S+ 0 0 116 -2,-0.7 4,-0.2 1,-0.2 -1,-0.2 0.796 90.2 49.0 -67.9 -27.4 43.7 25.3 -18.2 199 45 B K T 34 S+ 0 0 157 1,-0.2 -1,-0.2 2,-0.1 15,-0.1 0.580 122.6 34.1 -76.9 -13.5 46.9 27.4 -19.0 200 46 B F T X4 S+ 0 0 4 -3,-1.0 3,-1.9 -6,-0.3 -2,-0.2 0.401 83.2 103.2-121.0 -14.8 49.2 24.3 -18.4 201 47 B K T 3< S+ 0 0 114 -4,-1.7 -3,-0.1 1,-0.3 -2,-0.1 0.715 88.8 49.1 -17.9 -62.8 46.9 21.4 -19.8 202 48 B H T 3 S+ 0 0 128 -4,-0.2 -1,-0.3 -5,-0.1 2,-0.1 0.544 73.5 114.6 -73.7 -6.3 49.1 21.5 -22.8 203 49 B L < - 0 0 31 -3,-1.9 3,-0.1 1,-0.1 -3,-0.0 -0.461 40.4-175.2 -64.8 132.0 52.8 21.5 -21.4 204 50 B K + 0 0 160 -2,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.528 55.9 23.6-108.6 -7.5 54.1 18.2 -22.7 205 51 B S S > S- 0 0 39 1,-0.1 4,-2.2 0, 0.0 5,-0.1 -0.931 76.7-104.6-150.5 172.6 57.5 18.2 -21.1 206 52 B E H > S+ 0 0 66 -2,-0.3 4,-3.4 1,-0.2 5,-0.3 0.896 119.3 55.4 -70.7 -36.1 59.7 19.4 -18.3 207 53 B D H > S+ 0 0 120 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.855 108.2 48.3 -68.5 -32.8 61.4 21.8 -20.8 208 54 B E H > S+ 0 0 82 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.875 112.7 47.8 -69.0 -44.4 58.1 23.3 -21.6 209 55 B M H < S+ 0 0 6 -4,-2.2 3,-0.4 1,-0.2 -2,-0.2 0.908 112.2 50.0 -60.2 -43.3 57.2 23.7 -17.8 210 56 B K H < S+ 0 0 103 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.888 111.8 48.0 -65.0 -35.7 60.6 25.3 -17.0 211 57 B A H < S+ 0 0 86 -4,-1.5 2,-0.3 -5,-0.3 -1,-0.2 0.749 86.8 110.5 -74.8 -23.8 60.2 27.7 -19.9 212 58 B S X - 0 0 25 -4,-1.1 4,-1.6 -3,-0.4 5,-0.1 -0.401 47.8-168.2 -59.9 114.5 56.6 28.7 -18.9 213 59 B E H > S+ 0 0 134 -2,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.920 91.3 48.3 -71.8 -43.7 56.4 32.3 -17.5 214 60 B D H > S+ 0 0 53 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.750 106.5 57.5 -70.1 -25.9 52.8 31.7 -16.3 215 61 B L H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.902 108.6 46.4 -64.8 -49.8 53.9 28.5 -14.6 216 62 B K H X S+ 0 0 69 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.909 112.6 50.1 -61.3 -40.4 56.5 30.4 -12.6 217 63 B K H X S+ 0 0 109 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.922 111.6 47.9 -66.1 -41.4 53.9 33.2 -11.7 218 64 B H H X S+ 0 0 63 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.835 109.3 52.9 -70.9 -34.9 51.3 30.7 -10.5 219 65 B G H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.916 110.6 49.8 -64.9 -42.4 54.1 28.8 -8.4 220 66 B N H X S+ 0 0 59 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.914 111.9 46.5 -56.8 -48.5 54.8 32.3 -6.9 221 67 B T H X S+ 0 0 82 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.904 113.0 50.8 -62.9 -44.3 51.0 32.8 -6.1 222 68 B T H X S+ 0 0 38 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.940 115.8 38.0 -64.6 -49.5 50.7 29.3 -4.6 223 69 B L H X S+ 0 0 5 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.806 111.4 59.8 -80.1 -23.9 53.7 29.5 -2.2 224 70 B T H X S+ 0 0 80 -4,-3.0 4,-1.5 2,-0.2 -1,-0.2 0.927 109.1 44.0 -65.6 -42.7 53.0 33.2 -1.4 225 71 B A H X S+ 0 0 48 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.885 113.8 50.4 -63.3 -41.7 49.5 32.1 -0.1 226 72 B L H X S+ 0 0 14 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.883 106.6 55.1 -65.7 -38.6 50.9 29.0 1.8 227 73 B G H X S+ 0 0 4 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.877 106.4 52.1 -59.8 -42.7 53.6 31.2 3.5 228 74 B G H X S+ 0 0 25 -4,-1.5 4,-0.7 1,-0.2 -1,-0.2 0.914 112.1 46.4 -64.7 -42.4 50.8 33.5 4.8 229 75 B I H ><>S+ 0 0 5 -4,-1.5 3,-1.3 1,-0.2 5,-0.6 0.953 111.9 48.0 -69.5 -45.5 49.1 30.4 6.2 230 76 B L H ><5S+ 0 0 2 -4,-2.4 3,-1.8 1,-0.3 -1,-0.2 0.785 105.0 61.6 -64.0 -38.2 52.3 28.9 7.9 231 77 B K H 3<5S+ 0 0 98 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.715 95.7 60.3 -60.9 -25.8 53.1 32.3 9.4 232 78 B K T X<5S- 0 0 70 -3,-1.3 3,-2.2 -4,-0.7 -1,-0.3 0.277 97.6-148.5 -79.5 -2.5 49.7 32.0 11.3 233 79 B K T < 5 - 0 0 62 -3,-1.8 -3,-0.2 1,-0.3 -77,-0.1 0.759 68.5 -35.7 42.4 46.7 51.1 28.9 12.9 234 80 B G T 3 > + 0 0 4 -2,-2.3 4,-2.6 1,-0.1 3,-1.3 0.249 21.2 116.5-118.6 1.6 45.1 29.9 10.3 237 83 B E H 3> S+ 0 0 121 -3,-0.4 4,-1.6 1,-0.3 -1,-0.1 0.784 76.4 49.1 -42.2 -45.6 41.4 29.2 10.1 238 84 B A H 34 S+ 0 0 65 2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.636 109.6 50.6 -76.6 -22.5 40.5 32.5 8.3 239 85 B E H <> S+ 0 0 65 -3,-1.3 4,-0.8 2,-0.1 -2,-0.2 0.869 110.6 51.2 -80.5 -37.0 43.2 32.2 5.7 240 86 B L H >X S+ 0 0 2 -4,-2.6 4,-2.9 1,-0.2 3,-0.5 0.855 95.9 70.0 -69.6 -40.1 42.1 28.7 4.9 241 87 B T H 3X S+ 0 0 55 -4,-1.6 4,-2.3 1,-0.3 -1,-0.2 0.769 101.0 42.7 -40.6 -59.0 38.4 29.6 4.4 242 88 B P H 3> S+ 0 0 69 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.776 117.3 50.0 -56.2 -34.2 38.7 31.5 1.2 243 89 B L H S+ 0 0 0 -4,-2.9 4,-3.1 1,-0.2 5,-0.5 0.945 110.8 55.8 -59.3 -49.5 39.0 25.9 0.8 245 91 B Q H X>S+ 0 0 109 -4,-2.3 4,-1.4 -5,-0.3 5,-0.6 0.961 112.9 37.9 -50.1 -50.0 36.1 27.7 -0.8 246 92 B S H X>S+ 0 0 28 -4,-2.0 5,-3.7 1,-0.2 4,-1.0 0.895 119.4 46.7 -81.0 -31.7 37.8 28.3 -4.3 247 93 B H H <5S+ 0 0 49 -4,-1.9 6,-2.9 3,-0.2 -1,-0.2 0.839 120.8 37.5 -81.9 -31.0 39.5 25.0 -4.5 248 94 B A H <5S+ 0 0 2 -4,-3.1 -3,-0.2 4,-0.2 -2,-0.2 0.924 131.3 24.9 -74.6 -59.6 36.5 23.0 -3.4 249 95 B T H <> - 0 0 26 0, 0.0 3,-1.2 0, 0.0 4,-0.7 -0.206 22.5-115.7 -56.7 154.2 40.2 16.8 -4.5 255 101 B V H >> S+ 0 0 28 51,-1.2 4,-1.3 1,-0.3 3,-0.9 0.850 114.1 65.5 -67.3 -19.9 41.8 16.7 -1.0 256 102 B K H 3> S+ 0 0 99 1,-0.3 4,-2.1 2,-0.2 3,-0.3 0.870 92.9 58.8 -69.1 -27.2 44.3 14.0 -2.3 257 103 B Y H <> S+ 0 0 34 -3,-1.2 4,-2.0 1,-0.2 -1,-0.3 0.716 100.7 59.3 -67.4 -26.9 45.8 16.5 -4.7 258 104 B L H X + 0 0 24 -4,-3.2 4,-2.6 -5,-0.2 3,-0.7 -0.406 62.7 153.0-137.8 56.4 68.4 22.6 0.9 274 120 B P T 34 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.835 77.1 52.5 -54.7 -34.5 69.6 19.2 2.0 275 121 B G T 34 S+ 0 0 75 1,-0.2 3,-0.2 -3,-0.1 -5,-0.1 0.832 117.4 35.2 -78.7 -32.6 71.9 20.8 4.6 276 122 B D T <4 S+ 0 0 84 -3,-0.7 2,-1.3 1,-0.2 -1,-0.2 0.748 107.1 70.3 -90.8 -23.8 69.2 22.9 6.2 277 123 B F S < S+ 0 0 1 -4,-2.6 -1,-0.2 -8,-0.2 -4,-0.1 -0.529 71.1 153.5 -97.5 66.8 66.4 20.3 5.8 278 124 B G > - 0 0 33 -2,-1.3 4,-3.1 -3,-0.2 5,-0.3 0.033 62.2 -73.4 -82.8-167.1 67.4 17.7 8.3 279 125 B A H > S+ 0 0 80 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.910 130.9 45.1 -58.9 -48.6 65.5 15.1 10.3 280 126 B D H > S+ 0 0 125 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.925 114.3 44.3 -67.7 -46.3 64.0 17.7 12.6 281 127 B A H > S+ 0 0 7 1,-0.2 4,-2.9 -5,-0.2 5,-0.2 0.892 113.6 54.4 -62.8 -38.1 63.0 20.3 10.0 282 128 B Q H X S+ 0 0 68 -4,-3.1 4,-2.6 1,-0.2 -1,-0.2 0.928 108.9 45.5 -60.3 -50.7 61.6 17.6 7.9 283 129 B G H X S+ 0 0 36 -4,-2.2 4,-2.2 -5,-0.3 5,-0.2 0.933 114.3 48.6 -60.4 -38.7 59.4 16.3 10.6 284 130 B A H X S+ 0 0 1 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.950 112.3 48.5 -65.6 -46.5 58.2 19.7 11.6 285 131 B M H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 5,-0.3 0.905 111.0 51.1 -64.8 -40.8 57.4 20.7 8.0 286 132 B S H X S+ 0 0 46 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.867 109.7 49.8 -65.0 -37.0 55.5 17.4 7.5 287 133 B K H X S+ 0 0 75 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.820 111.4 50.8 -63.7 -36.3 53.4 18.0 10.6 288 134 B A H X S+ 0 0 2 -4,-1.8 4,-1.7 -5,-0.2 -2,-0.2 0.885 112.3 42.5 -68.1 -40.5 52.7 21.5 9.3 289 135 B L H X S+ 0 0 1 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.777 112.7 56.4 -78.8 -31.1 51.5 20.5 5.9 290 136 B E H X S+ 0 0 86 -4,-1.9 4,-2.2 -5,-0.3 -2,-0.2 0.922 109.0 44.7 -67.5 -38.0 49.6 17.7 7.4 291 137 B L H X S+ 0 0 35 -4,-2.4 4,-3.1 2,-0.2 5,-0.2 0.920 111.6 53.5 -66.6 -45.2 47.7 20.1 9.7 292 138 B F H X S+ 0 0 16 -4,-1.7 4,-2.6 1,-0.2 5,-0.2 0.982 113.1 43.8 -53.7 -51.5 47.1 22.5 6.7 293 139 B R H X S+ 0 0 46 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.913 113.0 50.9 -67.5 -36.5 45.6 19.6 4.7 294 140 B N H X S+ 0 0 84 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.937 112.2 47.7 -65.7 -47.4 43.5 18.3 7.7 295 141 B D H X S+ 0 0 53 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.861 112.3 49.4 -60.2 -43.2 42.2 21.8 8.2 296 142 B M H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.2 -1,-0.2 0.896 110.0 49.6 -60.8 -46.4 41.4 22.1 4.5 297 143 B A H X S+ 0 0 12 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.884 108.6 52.9 -64.3 -38.8 39.6 18.7 4.3 298 144 B A H X S+ 0 0 51 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.902 110.9 47.9 -62.0 -44.7 37.4 19.7 7.4 299 145 B K H X S+ 0 0 48 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.905 109.3 53.4 -64.7 -41.6 36.5 22.9 5.5 300 146 B Y H <>S+ 0 0 3 -4,-2.4 5,-4.2 2,-0.2 -1,-0.2 0.844 108.0 52.3 -55.0 -39.2 35.7 20.8 2.3 301 147 B K H ><5S+ 0 0 133 -4,-1.7 3,-1.1 3,-0.3 -1,-0.2 0.912 106.9 50.3 -62.4 -50.5 33.4 18.7 4.4 302 148 B E H 3<5S+ 0 0 131 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.753 109.6 51.8 -65.8 -24.7 31.5 21.7 5.8 303 149 B L T 3<5S- 0 0 64 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.406 125.3-103.1 -84.8 -9.7 31.0 23.0 2.2 304 150 B G T < 5S+ 0 0 62 -3,-1.1 -3,-0.3 1,-0.2 2,-0.2 0.711 75.0 133.7 93.9 18.1 29.6 19.7 1.2 305 151 B F < - 0 0 76 -5,-4.2 2,-1.1 -6,-0.2 -1,-0.2 -0.481 66.3 -84.5-106.2 175.8 32.6 18.1 -0.7 306 152 B Q 0 0 159 -2,-0.2 -51,-1.2 -58,-0.1 -5,-0.1 -0.578 360.0 360.0 -72.7 72.7 34.7 15.0 -1.0 307 153 B G 0 0 41 -2,-1.1 -3,-0.1 -53,-0.1 -2,-0.0 -0.842 360.0 360.0 178.3 360.0 37.2 15.4 1.8