==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN STORAGE/TRANSPORT 29-AUG-05 2AV0 . COMPND 2 MOLECULE: GLOBIN I; . SOURCE 2 ORGANISM_SCIENTIFIC: SCAPHARCA INAEQUIVALVIS; . AUTHOR J.E.KNAPP,M.A.BONHAM,Q.H.GIBSON,J.C.NICHOLS,W.E.ROYER JR. . 290 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13422.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 85.9 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 . 10 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 23.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 166 57.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 2 2 0 0 0 0 2 0 0 0 2 3 3 0 0 2 0 0 0 0 0 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 S > 0 0 92 0, 0.0 4,-2.2 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 123.1 38.3 -21.7 23.7 2 3 A V H > + 0 0 11 141,-0.3 4,-2.2 1,-0.2 5,-0.1 0.831 360.0 55.7 -61.5 -30.9 36.5 -18.4 23.9 3 4 A Y H > S+ 0 0 108 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.874 108.1 45.4 -70.6 -37.2 33.5 -20.3 25.3 4 5 A D H 4 S+ 0 0 111 -3,-0.2 4,-0.4 2,-0.2 -2,-0.2 0.852 112.9 52.3 -73.3 -33.1 35.5 -21.9 28.1 5 6 A A H >< S+ 0 0 18 -4,-2.2 3,-1.4 1,-0.2 4,-0.2 0.908 106.7 51.7 -67.6 -41.9 37.1 -18.5 28.9 6 7 A A H >< S+ 0 0 8 -4,-2.2 3,-1.4 1,-0.3 -1,-0.2 0.804 101.9 62.3 -64.0 -28.9 33.7 -16.9 29.1 7 8 A A T 3< S+ 0 0 68 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.657 89.5 69.8 -70.8 -16.1 32.7 -19.6 31.6 8 9 A Q T < S+ 0 0 109 -3,-1.4 2,-1.7 -4,-0.4 -1,-0.3 0.596 73.5 94.7 -77.0 -11.3 35.4 -18.3 33.9 9 10 A L < + 0 0 10 -3,-1.4 -1,-0.1 -4,-0.2 -3,-0.0 -0.606 63.2 178.7 -84.5 83.7 33.4 -15.2 34.5 10 11 A T > - 0 0 64 -2,-1.7 4,-2.8 1,-0.1 5,-0.2 -0.148 45.9 -88.2 -77.9 175.9 31.6 -16.3 37.7 11 12 A A H > S+ 0 0 82 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.902 128.0 47.4 -51.8 -47.9 29.1 -14.4 39.8 12 13 A D H > S+ 0 0 102 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.874 112.1 49.4 -65.2 -38.2 31.9 -12.8 41.9 13 14 A V H > S+ 0 0 8 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.927 110.7 50.0 -67.2 -44.4 34.0 -11.8 38.9 14 15 A K H X S+ 0 0 58 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.905 109.9 51.7 -60.2 -41.4 31.0 -10.2 37.2 15 16 A K H X S+ 0 0 111 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.916 109.7 48.2 -62.6 -44.5 30.2 -8.2 40.3 16 17 A D H X S+ 0 0 21 -4,-2.0 4,-2.0 2,-0.2 5,-0.2 0.862 111.2 51.2 -65.3 -35.7 33.7 -6.9 40.6 17 18 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.941 113.5 44.2 -65.8 -46.8 33.7 -5.9 36.9 18 19 A R H X S+ 0 0 78 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.924 113.2 50.2 -63.7 -46.9 30.4 -4.0 37.3 19 20 A D H X S+ 0 0 47 -4,-2.7 4,-0.6 1,-0.2 -1,-0.2 0.895 115.9 41.5 -60.5 -42.9 31.3 -2.3 40.5 20 21 A S H >X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.2 3,-0.7 0.866 111.1 56.6 -74.5 -34.9 34.6 -1.1 39.2 21 22 A W H 3X S+ 0 0 14 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.844 94.1 67.4 -64.7 -32.4 33.2 -0.1 35.8 22 23 A K H 3< S+ 0 0 144 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.890 112.4 34.2 -54.0 -36.6 30.6 2.1 37.5 23 24 A V H X< S+ 0 0 56 -3,-0.7 3,-1.2 -4,-0.6 4,-0.3 0.950 122.7 39.3 -84.5 -56.0 33.6 4.3 38.4 24 25 A I H >< S+ 0 0 14 -4,-2.3 3,-0.9 1,-0.2 7,-0.2 0.823 113.4 56.9 -67.7 -28.6 36.1 4.0 35.5 25 26 A G T 3< S+ 0 0 5 -4,-2.5 3,-0.5 -5,-0.3 -1,-0.2 0.563 88.1 77.8 -78.5 -7.0 33.3 4.1 32.9 26 27 A S T < S+ 0 0 98 -3,-1.2 2,-0.3 1,-0.3 -1,-0.2 0.702 102.2 36.7 -74.4 -20.2 32.1 7.5 34.3 27 28 A D <> + 0 0 75 -3,-0.9 4,-2.5 -4,-0.3 5,-0.4 -0.688 67.9 164.6-132.5 78.7 34.9 9.3 32.5 28 29 A K H > S+ 0 0 37 -3,-0.5 4,-1.7 -2,-0.3 5,-0.2 0.883 76.7 48.0 -64.4 -39.9 35.4 7.6 29.2 29 30 A K H > S+ 0 0 64 2,-0.2 4,-2.0 3,-0.2 5,-0.2 0.971 117.7 39.8 -66.1 -52.9 37.5 10.4 27.7 30 31 A G H > S+ 0 0 20 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.936 122.9 38.3 -63.1 -49.9 39.8 10.8 30.6 31 32 A N H X S+ 0 0 10 -4,-2.5 4,-2.1 -7,-0.2 -1,-0.2 0.806 113.8 56.6 -74.0 -28.4 40.3 7.2 31.6 32 33 A G H X S+ 0 0 0 -4,-1.7 4,-1.9 -5,-0.4 -1,-0.2 0.926 111.1 42.4 -68.0 -44.1 40.4 6.0 28.0 33 34 A V H X S+ 0 0 10 -4,-2.0 4,-3.0 -5,-0.2 5,-0.3 0.883 112.0 55.7 -68.9 -36.6 43.2 8.4 27.1 34 35 A A H X S+ 0 0 31 -4,-1.8 4,-2.0 -5,-0.2 -2,-0.2 0.900 106.5 51.3 -61.7 -40.5 44.9 7.5 30.4 35 36 A L H X S+ 0 0 13 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.940 113.7 43.3 -61.1 -48.5 44.8 3.8 29.5 36 37 A M H X S+ 0 0 4 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.916 112.8 50.2 -66.2 -45.2 46.4 4.4 26.1 37 38 A T H X S+ 0 0 50 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.869 111.4 50.3 -63.4 -34.2 49.1 6.8 27.3 38 39 A T H X S+ 0 0 30 -4,-2.0 4,-2.6 -5,-0.3 5,-0.3 0.912 109.1 51.4 -68.9 -40.9 50.1 4.3 30.0 39 40 A L H X S+ 0 0 14 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.944 112.6 45.7 -59.5 -47.6 50.3 1.6 27.4 40 41 A F H < S+ 0 0 13 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.835 114.3 48.9 -65.7 -33.7 52.5 3.7 25.2 41 42 A A H < S+ 0 0 75 -4,-1.9 3,-0.4 -5,-0.2 -2,-0.2 0.897 119.8 34.3 -74.5 -41.0 54.7 4.7 28.1 42 43 A D H < S+ 0 0 73 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.600 129.0 35.0 -90.8 -12.8 55.3 1.3 29.6 43 44 A N >< + 0 0 30 -4,-1.7 3,-2.2 -5,-0.3 4,-0.3 -0.517 64.5 167.2-139.8 67.5 55.3 -0.7 26.4 44 45 A Q G > + 0 0 123 -3,-0.4 3,-1.3 1,-0.3 4,-0.4 0.729 69.4 73.6 -54.6 -26.4 57.0 1.6 23.8 45 46 A E G 3 S+ 0 0 85 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.531 90.5 59.0 -69.2 -5.0 57.4 -1.3 21.4 46 47 A T G X S+ 0 0 7 -3,-2.2 3,-1.5 -7,-0.2 4,-0.5 0.605 79.0 86.2 -97.7 -13.8 53.6 -1.1 20.7 47 48 A I G X S+ 0 0 64 -3,-1.3 3,-1.6 -4,-0.3 -2,-0.1 0.838 77.4 68.9 -55.1 -35.0 53.6 2.5 19.4 48 49 A G G > S+ 0 0 49 -4,-0.4 3,-0.9 1,-0.3 -1,-0.3 0.791 91.2 60.1 -55.8 -31.0 54.5 1.3 15.9 49 50 A Y G < S+ 0 0 96 -3,-1.5 3,-0.3 1,-0.2 -1,-0.3 0.740 99.5 58.0 -69.5 -23.9 51.0 -0.4 15.5 50 51 A F G X + 0 0 49 -3,-1.6 3,-1.7 -4,-0.5 4,-0.3 -0.027 60.8 131.7 -99.8 32.2 49.3 3.0 16.0 51 52 A K G X + 0 0 164 -3,-0.9 3,-1.5 1,-0.3 -1,-0.2 0.807 66.1 65.4 -51.6 -34.3 50.9 4.9 13.2 52 53 A R G 3 S+ 0 0 96 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.806 93.3 60.4 -61.3 -30.0 47.4 6.1 12.0 53 54 A L G < S- 0 0 4 -3,-1.7 12,-0.3 1,-0.2 -1,-0.3 0.565 96.3-148.6 -76.9 -7.4 46.9 8.1 15.2 54 55 A G < + 0 0 40 -3,-1.5 2,-1.3 -4,-0.3 -1,-0.2 -0.553 64.4 10.8 79.8-140.0 50.0 10.3 14.6 55 56 A D > - 0 0 80 -2,-0.2 3,-1.6 1,-0.2 4,-0.1 -0.619 63.1-178.4 -80.5 93.5 52.0 11.6 17.5 56 57 A V G > S+ 0 0 11 -2,-1.3 3,-1.7 1,-0.3 -1,-0.2 0.675 72.3 76.2 -66.8 -17.6 50.6 9.7 20.5 57 58 A S G 3 S+ 0 0 98 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.670 81.3 72.0 -68.2 -13.9 52.9 11.6 22.9 58 59 A Q G X S- 0 0 101 -3,-1.6 3,-1.7 1,-0.2 -1,-0.3 0.596 80.9-178.3 -76.2 -11.0 50.5 14.5 22.5 59 60 A G G X + 0 0 9 -3,-1.7 3,-2.0 1,-0.3 7,-0.2 -0.196 63.6 8.8 53.9-128.8 47.9 12.7 24.5 60 61 A M G 3 S+ 0 0 83 1,-0.3 -1,-0.3 5,-0.1 6,-0.1 0.756 124.8 64.6 -55.6 -28.8 44.5 14.5 25.0 61 62 A A G < S+ 0 0 77 -3,-1.7 2,-0.8 1,-0.1 -1,-0.3 0.657 82.8 88.8 -71.1 -16.4 45.6 17.2 22.5 62 63 A N <> - 0 0 9 -3,-2.0 4,-2.5 1,-0.2 5,-0.2 -0.756 65.3-160.7 -87.6 107.8 45.7 14.6 19.7 63 64 A D H > S+ 0 0 88 -2,-0.8 4,-2.4 1,-0.2 5,-0.2 0.854 89.7 50.2 -56.8 -40.5 42.2 14.4 18.2 64 65 A K H > S+ 0 0 96 -11,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.890 111.6 48.4 -67.8 -38.3 42.7 11.0 16.6 65 66 A L H > S+ 0 0 0 -12,-0.3 4,-2.9 2,-0.2 -2,-0.2 0.908 111.9 49.6 -67.8 -39.6 44.0 9.5 19.9 66 67 A R H X S+ 0 0 20 -4,-2.5 4,-2.5 -7,-0.2 5,-0.2 0.924 111.8 47.9 -65.2 -42.7 41.0 11.0 21.8 67 68 A G H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.905 114.3 46.8 -63.4 -41.5 38.5 9.6 19.3 68 69 A H H X S+ 0 0 35 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.918 112.8 49.8 -64.4 -45.9 40.2 6.2 19.4 69 70 A S H X S+ 0 0 0 -4,-2.9 4,-1.5 2,-0.2 -2,-0.2 0.884 110.2 48.1 -63.2 -43.4 40.3 6.3 23.2 70 71 A I H X S+ 0 0 1 -4,-2.5 4,-1.1 1,-0.2 3,-0.2 0.931 112.4 50.5 -64.1 -43.3 36.7 7.2 23.7 71 72 A T H X S+ 0 0 42 -4,-1.9 4,-0.9 -5,-0.2 3,-0.4 0.873 104.9 57.3 -62.5 -37.2 35.6 4.5 21.2 72 73 A L H >X S+ 0 0 48 -4,-2.1 4,-1.5 1,-0.2 3,-0.7 0.890 102.7 55.1 -61.1 -39.0 37.7 1.9 23.0 73 74 A M H 3X S+ 0 0 2 -4,-1.5 4,-2.0 1,-0.3 -1,-0.2 0.799 102.8 55.6 -66.7 -27.3 35.8 2.6 26.2 74 75 A Y H 3X S+ 0 0 11 -4,-1.1 4,-1.8 -3,-0.4 -1,-0.3 0.721 102.0 57.3 -77.3 -19.2 32.5 1.9 24.5 75 76 A A H < S+ 0 0 6 -4,-2.1 3,-0.8 1,-0.2 4,-0.3 0.924 110.9 50.7 -57.3 -47.1 31.3 -6.2 27.1 80 81 A I H >< S+ 0 0 6 -4,-2.6 3,-1.2 1,-0.2 -1,-0.2 0.898 108.6 52.4 -59.0 -41.0 30.0 -5.2 30.5 81 82 A D H 3< S+ 0 0 64 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.719 108.2 51.8 -69.1 -20.5 26.5 -5.0 29.2 82 83 A Q T X< S+ 0 0 21 -4,-1.2 3,-1.0 -3,-0.8 7,-0.5 0.358 75.0 103.6 -97.4 5.6 26.7 -8.5 27.7 83 84 A L T < S+ 0 0 3 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.1 0.769 74.8 61.3 -59.0 -25.3 27.9 -10.3 30.9 84 85 A D T 3 S+ 0 0 124 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.838 106.9 45.0 -70.1 -33.3 24.4 -11.7 31.4 85 86 A N X> - 0 0 56 -3,-1.0 4,-2.2 1,-0.1 3,-0.7 -0.895 63.4-166.3-120.1 104.7 24.4 -13.6 28.2 86 87 A P H 3> S+ 0 0 70 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.827 89.7 58.3 -54.3 -37.3 27.5 -15.7 27.3 87 88 A D H 3> S+ 0 0 93 1,-0.2 4,-1.5 2,-0.2 -5,-0.0 0.886 110.9 41.7 -63.3 -38.1 26.3 -16.2 23.7 88 89 A D H <> S+ 0 0 9 -3,-0.7 4,-1.7 2,-0.2 5,-0.2 0.847 111.9 54.1 -78.7 -33.8 26.1 -12.4 23.1 89 90 A L H X S+ 0 0 4 -4,-2.2 4,-2.2 -7,-0.5 5,-0.2 0.947 108.2 51.9 -63.4 -45.3 29.4 -11.7 24.9 90 91 A V H X S+ 0 0 1 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.908 108.4 49.2 -59.0 -44.1 31.2 -14.2 22.7 91 92 A C H X S+ 0 0 5 -4,-1.5 4,-1.3 1,-0.2 -1,-0.2 0.833 113.0 45.8 -70.1 -28.9 29.9 -12.6 19.5 92 93 A V H X S+ 0 0 2 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.829 113.5 50.9 -80.4 -28.6 30.9 -9.1 20.4 93 94 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.920 109.0 50.5 -70.3 -42.9 34.3 -10.3 21.6 94 95 A E H X S+ 0 0 66 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.865 107.9 54.0 -63.4 -32.9 34.9 -12.2 18.4 95 96 A K H X S+ 0 0 40 -4,-1.3 4,-1.3 2,-0.2 -1,-0.2 0.939 111.2 44.8 -65.2 -46.2 34.0 -9.0 16.4 96 97 A L H X S+ 0 0 36 -4,-1.8 4,-1.0 1,-0.2 -2,-0.2 0.887 108.7 58.0 -65.4 -37.4 36.6 -7.0 18.4 97 98 A A H >X S+ 0 0 2 -4,-2.6 4,-2.6 1,-0.2 3,-0.9 0.910 101.0 55.9 -59.3 -42.8 39.1 -9.8 17.9 98 99 A V H 3X S+ 0 0 42 -4,-1.9 4,-2.1 1,-0.3 -1,-0.2 0.892 101.8 56.8 -57.5 -40.3 38.8 -9.6 14.2 99 100 A N H 3< S+ 0 0 39 -4,-1.3 4,-0.3 1,-0.2 -1,-0.3 0.792 114.1 40.0 -62.1 -27.6 39.7 -5.9 14.3 100 101 A H H <<>S+ 0 0 56 -4,-1.0 5,-2.4 -3,-0.9 3,-0.4 0.796 108.5 58.0 -92.2 -30.9 42.9 -6.8 16.1 101 102 A I H ><5S+ 0 0 80 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.900 103.6 55.8 -64.2 -38.1 43.8 -9.9 14.1 102 103 A T T 3<5S+ 0 0 95 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.779 106.4 50.5 -64.4 -26.7 43.8 -7.7 11.0 103 104 A R T 3 5S- 0 0 121 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.2 0.263 119.9-112.1 -93.6 10.2 46.4 -5.5 12.6 104 105 A K T < 5 + 0 0 168 -3,-1.8 2,-0.6 1,-0.2 -3,-0.2 0.834 60.5 158.9 64.1 36.8 48.5 -8.5 13.5 105 106 A I < - 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0 0 25 -5,-2.4 -1,-0.2 4,-0.1 -2,-0.1 -0.788 27.3-148.8 -90.5 117.1 31.3 3.9 1.4 252 107 B S > - 0 0 44 -2,-0.7 4,-2.5 39,-0.1 5,-0.2 -0.270 26.3-107.2 -79.2 167.6 30.3 7.3 0.0 253 108 B A H > S+ 0 0 28 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.895 122.2 51.3 -61.0 -40.2 28.3 10.0 1.8 254 109 B A H 4 S+ 0 0 77 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.910 111.1 46.9 -64.0 -42.9 25.3 9.1 -0.4 255 110 B E H >4 S+ 0 0 50 1,-0.2 3,-1.6 2,-0.2 4,-0.2 0.882 108.0 55.2 -67.6 -38.4 25.6 5.4 0.4 256 111 B F H >< S+ 0 0 33 -4,-2.5 3,-1.8 1,-0.3 -1,-0.2 0.885 99.6 63.7 -61.2 -36.7 25.9 6.1 4.1 257 112 B G G >< S+ 0 0 14 -4,-1.6 3,-1.7 1,-0.3 4,-0.3 0.608 78.8 83.3 -63.1 -12.3 22.7 8.0 3.9 258 113 B K G X S+ 0 0 60 -3,-1.6 3,-0.9 1,-0.3 -1,-0.3 0.721 76.0 73.1 -65.0 -17.4 20.8 4.9 2.9 259 114 B I G <> S+ 0 0 33 -3,-1.8 4,-2.3 1,-0.2 -1,-0.3 0.702 76.9 78.8 -70.0 -18.2 20.6 4.1 6.6 260 115 B N H <> S+ 0 0 46 -3,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.852 89.3 53.5 -59.6 -36.9 18.0 6.9 7.0 261 116 B G H <> S+ 0 0 39 -3,-0.9 4,-2.2 -4,-0.3 -1,-0.2 0.975 110.6 44.5 -62.7 -56.0 15.2 4.7 5.6 262 117 B P H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.889 113.3 52.1 -55.6 -41.0 15.8 1.8 8.1 263 118 B I H X S+ 0 0 14 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.930 107.9 51.4 -63.0 -43.8 16.1 4.3 11.0 264 119 B K H X S+ 0 0 108 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.914 112.1 47.1 -59.0 -42.7 12.8 5.9 10.1 265 120 B K H X S+ 0 0 113 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.895 112.0 48.4 -67.4 -41.4 11.2 2.4 10.1 266 121 B V H X S+ 0 0 9 -4,-2.5 4,-0.5 2,-0.2 -2,-0.2 0.904 112.7 49.1 -66.0 -40.2 12.7 1.3 13.4 267 122 B L H ><>S+ 0 0 1 -4,-2.6 5,-2.6 1,-0.2 3,-1.5 0.925 108.9 53.3 -63.2 -43.7 11.6 4.6 15.0 268 123 B A H ><5S+ 0 0 57 -4,-2.3 3,-1.6 1,-0.3 -1,-0.2 0.793 98.2 64.1 -62.2 -30.1 8.1 4.2 13.6 269 124 B S H 3<5S+ 0 0 78 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.709 108.0 42.2 -67.7 -18.9 7.8 0.8 15.1 270 125 B K T <<5S- 0 0 93 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.127 125.4-105.6-110.0 14.9 8.1 2.5 18.5 271 126 B N T < 5S+ 0 0 154 -3,-1.6 2,-0.7 1,-0.2 -3,-0.2 0.676 72.4 142.5 68.9 22.7 5.8 5.2 17.4 272 127 B F < - 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