==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 04-FEB-09 3G50 . COMPND 2 MOLECULE: SUPEROXIDE DISMUTASE [NI]; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR; . AUTHOR S.C.GARMAN,A.I.GUCE,R.W.HERBST,P.A.BRYNGELSON,D.E.CABELLI, . 346 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18472.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 275 79.5 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 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 239 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.7 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 3 0 0 0 0 0 0 0 0 0 3 2 0 1 0 1 2 0 0 0 0 0 3 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 H 0 0 77 0, 0.0 8,-0.1 0, 0.0 57,-0.1 0.000 360.0 360.0 360.0 23.8 -9.8 21.7 26.6 2 2 A C - 0 0 76 59,-0.1 55,-0.0 55,-0.1 0, 0.0 0.398 360.0-125.7-134.8 -9.7 -11.5 18.5 28.1 3 3 A A S S+ 0 0 62 54,-0.1 59,-0.0 58,-0.1 54,-0.0 0.679 81.3 110.4 58.9 26.3 -15.0 18.7 26.5 4 4 A L S S- 0 0 138 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 0.905 102.8-111.3 -51.8 -49.6 -16.8 18.4 30.0 5 5 A P S S+ 0 0 107 0, 0.0 56,-0.0 0, 0.0 0, 0.0 0.524 70.9 159.0 -88.8 146.9 -17.2 21.2 28.9 6 6 A C - 0 0 54 2,-0.1 3,-0.1 -2,-0.1 0, 0.0 0.585 43.9-136.2 -98.5 -14.9 -15.1 23.2 31.3 7 7 A G + 0 0 49 1,-0.2 2,-0.7 54,-0.1 55,-0.0 0.689 59.6 130.9 62.3 22.5 -14.8 26.3 28.9 8 8 A V + 0 0 92 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.839 26.3 150.2-105.1 95.9 -11.0 26.8 29.6 9 9 A Y + 0 0 13 -2,-0.7 3,-0.0 -3,-0.1 49,-0.0 -0.920 13.4 164.7-122.7 148.9 -9.3 27.1 26.2 10 10 A D > - 0 0 57 -2,-0.3 3,-2.2 44,-0.1 4,-0.4 -0.755 34.9-143.9-165.2 120.5 -6.2 29.0 25.1 11 11 A P T 3> S+ 0 0 1 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.631 90.8 88.7 -60.9 -12.4 -4.1 28.7 21.9 12 12 A A H 3> S+ 0 0 18 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.804 81.9 58.5 -50.5 -34.6 -1.1 29.5 24.2 13 13 A Q H <> S+ 0 0 68 -3,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.950 109.6 41.0 -64.2 -48.9 -1.0 25.6 24.8 14 14 A A H > S+ 0 0 1 -4,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.940 116.2 51.6 -60.6 -48.3 -0.5 24.9 21.1 15 15 A R H X S+ 0 0 92 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.906 107.4 50.7 -56.7 -48.7 1.9 27.9 20.7 16 16 A I H X S+ 0 0 86 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.914 113.1 46.0 -56.8 -44.1 4.2 26.8 23.6 17 17 A E H X S+ 0 0 30 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.905 114.0 48.3 -68.3 -37.9 4.5 23.3 22.2 18 18 A A H X S+ 0 0 1 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.809 108.1 55.7 -72.2 -29.4 5.1 24.6 18.6 19 19 A E H X S+ 0 0 86 -4,-2.4 4,-2.7 -5,-0.2 -1,-0.2 0.897 105.9 52.0 -62.9 -41.9 7.7 27.1 20.1 20 20 A S H X S+ 0 0 42 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.898 105.3 54.6 -61.2 -42.6 9.4 24.0 21.6 21 21 A V H X S+ 0 0 2 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.941 112.3 43.6 -54.0 -49.4 9.5 22.4 18.1 22 22 A K H X S+ 0 0 46 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.914 111.6 52.8 -67.8 -39.9 11.2 25.4 16.7 23 23 A A H X S+ 0 0 40 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.900 110.0 49.1 -63.6 -39.2 13.7 25.8 19.5 24 24 A V H X S+ 0 0 22 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.935 109.1 52.8 -65.5 -44.3 14.6 22.1 19.1 25 25 A Q H X S+ 0 0 1 -4,-2.5 4,-0.8 1,-0.2 -2,-0.2 0.933 109.3 48.7 -54.2 -46.7 15.1 22.6 15.4 26 26 A E H >< S+ 0 0 102 -4,-2.6 3,-0.7 1,-0.2 4,-0.4 0.895 109.6 52.7 -63.0 -37.8 17.5 25.6 16.0 27 27 A K H >< S+ 0 0 137 -4,-1.9 3,-1.4 1,-0.2 4,-0.4 0.869 99.6 63.1 -67.6 -32.6 19.5 23.5 18.6 28 28 A M H 3< S+ 0 0 10 -4,-2.3 3,-0.5 1,-0.3 -1,-0.2 0.769 98.8 55.1 -62.8 -24.6 20.0 20.7 16.1 29 29 A A T << S+ 0 0 92 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.644 107.2 52.9 -79.5 -13.7 22.0 23.1 13.8 30 30 A G S < S+ 0 0 69 -3,-1.4 2,-0.2 -4,-0.4 -1,-0.2 0.396 110.1 38.9-102.8 4.0 24.3 23.8 16.8 31 31 A N - 0 0 66 -3,-0.5 -1,-0.2 -4,-0.4 6,-0.1 -0.746 52.2-171.1-158.9 100.2 25.5 20.4 17.9 32 32 A D + 0 0 148 -2,-0.2 -4,-0.1 -3,-0.1 -1,-0.0 0.430 41.2 135.1 -82.4 5.4 26.2 17.5 15.6 33 33 A D > - 0 0 61 1,-0.2 4,-3.2 2,-0.1 5,-0.2 -0.348 54.0-142.4 -51.6 118.9 26.5 14.9 18.4 34 34 A P H > S+ 0 0 93 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.856 99.9 51.1 -58.5 -38.2 24.5 11.9 17.1 35 35 A H H > S+ 0 0 10 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.947 112.8 45.2 -64.1 -48.3 23.1 11.1 20.5 36 36 A F H > S+ 0 0 46 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.923 111.5 54.3 -58.6 -43.7 22.0 14.7 21.0 37 37 A Q H X S+ 0 0 31 -4,-3.2 4,-1.9 1,-0.2 -2,-0.2 0.898 110.6 46.1 -58.0 -41.9 20.6 14.7 17.4 38 38 A T H X S+ 0 0 14 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.925 112.4 48.4 -67.6 -48.4 18.5 11.6 18.3 39 39 A R H X S+ 0 0 39 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.944 111.2 51.6 -56.1 -49.5 17.2 13.0 21.6 40 40 A A H X S+ 0 0 6 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.903 110.1 50.4 -51.0 -43.4 16.3 16.2 19.8 41 41 A T H X S+ 0 0 2 -4,-1.9 4,-2.1 -5,-0.3 -2,-0.2 0.931 109.9 49.5 -63.9 -44.0 14.4 14.1 17.2 42 42 A V H X S+ 0 0 4 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.956 114.4 45.1 -56.4 -51.4 12.6 12.2 20.0 43 43 A I H X S+ 0 0 43 -4,-2.9 4,-3.0 1,-0.2 5,-0.3 0.926 111.2 51.8 -61.7 -45.9 11.5 15.4 21.7 44 44 A K H X S+ 0 0 0 -4,-2.7 4,-2.4 -5,-0.3 5,-0.3 0.898 106.7 53.3 -63.6 -38.4 10.5 17.2 18.6 45 45 A E H X S+ 0 0 7 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.937 114.2 43.7 -60.1 -41.2 8.2 14.3 17.5 46 46 A Q H X S+ 0 0 76 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.937 114.4 46.4 -71.7 -50.1 6.5 14.4 20.9 47 47 A R H X S+ 0 0 84 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.871 111.6 52.5 -63.7 -38.1 6.1 18.2 21.2 48 48 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.3 -1,-0.2 0.914 109.1 50.2 -65.3 -40.0 4.8 18.5 17.6 49 49 A E H X S+ 0 0 78 -4,-1.7 4,-2.3 -5,-0.3 -2,-0.2 0.899 110.2 49.2 -66.6 -37.4 2.2 15.9 18.3 50 50 A L H X S+ 0 0 69 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.907 109.2 53.2 -66.3 -41.0 1.0 17.7 21.4 51 51 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.942 109.2 49.2 -55.3 -44.9 0.8 20.9 19.5 52 52 A K H X S+ 0 0 40 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.899 109.5 52.0 -65.1 -41.6 -1.4 19.2 16.9 53 53 A H H X S+ 0 0 108 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.940 108.4 50.1 -58.2 -47.7 -3.6 17.8 19.7 54 54 A H H X S+ 0 0 32 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.896 113.0 47.3 -58.7 -40.0 -4.0 21.4 21.2 55 55 A V H X S+ 0 0 2 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.952 111.1 50.0 -66.3 -49.4 -5.0 22.8 17.8 56 56 A S H X S+ 0 0 46 -4,-2.8 4,-3.0 1,-0.2 5,-0.3 0.908 109.1 53.0 -54.7 -43.8 -7.4 20.0 17.1 57 57 A V H X>S+ 0 0 14 -4,-2.6 4,-2.9 2,-0.2 5,-0.7 0.891 107.5 50.7 -60.2 -42.8 -9.1 20.5 20.5 58 58 A L H X>S+ 0 0 8 -4,-1.7 5,-3.0 3,-0.2 4,-1.2 0.914 114.1 46.1 -61.0 -42.1 -9.6 24.2 19.9 59 59 A W H <5S+ 0 0 94 -4,-2.3 -2,-0.2 3,-0.2 -1,-0.2 0.918 123.4 31.7 -69.0 -42.2 -11.2 23.3 16.5 60 60 A S H <5S+ 0 0 66 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.890 132.7 25.1 -86.4 -37.4 -13.4 20.5 17.8 61 61 A D H <5S+ 0 0 48 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.2 0.624 128.5 33.4-107.6 -19.9 -14.3 21.6 21.3 62 62 A Y T <> - 0 0 111 -2,-0.1 4,-1.8 -3,-0.0 3,-1.0 -0.707 36.7 -91.1-120.3 166.5 -18.7 26.5 17.2 65 65 A P H 3> S+ 0 0 98 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.820 123.5 56.1 -53.9 -35.6 -20.9 26.8 14.1 66 66 A P H 3> S+ 0 0 82 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.921 107.9 50.2 -59.7 -39.1 -21.4 30.6 14.5 67 67 A H H <> S+ 0 0 37 -3,-1.0 4,-2.2 2,-0.2 7,-0.2 0.892 111.0 48.8 -62.4 -41.4 -17.6 30.9 14.5 68 68 A F H < S+ 0 0 39 -4,-1.8 6,-0.3 2,-0.2 -1,-0.2 0.908 111.8 48.8 -67.1 -41.9 -17.4 28.8 11.3 69 69 A E H < S+ 0 0 165 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.988 116.0 43.1 -54.5 -59.4 -20.2 30.9 9.7 70 70 A K H < S+ 0 0 148 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.751 124.9 35.0 -59.5 -32.1 -18.3 34.1 10.6 71 71 A Y >< + 0 0 16 -4,-2.2 3,-1.9 -5,-0.2 4,-0.3 -0.747 66.6 173.0-126.7 81.0 -14.9 32.8 9.6 72 72 A P T 3 S+ 0 0 107 0, 0.0 4,-0.3 0, 0.0 3,-0.2 0.638 79.2 58.0 -65.2 -18.9 -15.4 30.5 6.6 73 73 A E T 3> S+ 0 0 99 1,-0.1 4,-2.4 2,-0.1 5,-0.2 0.415 82.4 92.8 -81.9 -2.2 -11.6 30.1 6.1 74 74 A L H <> S+ 0 0 0 -3,-1.9 4,-2.6 -6,-0.3 5,-0.2 0.930 79.1 51.9 -69.0 -42.8 -11.3 28.6 9.7 75 75 A H H > S+ 0 0 94 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.922 115.0 42.8 -52.5 -50.5 -11.6 24.9 8.8 76 76 A Q H > S+ 0 0 112 -4,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.853 111.2 55.3 -69.1 -37.2 -8.9 25.1 6.2 77 77 A L H X S+ 0 0 14 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.890 109.6 46.7 -57.0 -44.4 -6.8 27.3 8.4 78 78 A V H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.962 113.1 49.6 -67.9 -45.0 -6.9 24.6 11.2 79 79 A N H X S+ 0 0 64 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.900 111.2 49.1 -55.2 -43.2 -6.1 21.9 8.6 80 80 A D H X S+ 0 0 48 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.865 108.3 53.9 -67.6 -35.8 -3.2 23.9 7.3 81 81 A T H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.922 110.0 46.6 -63.6 -48.4 -1.9 24.4 10.8 82 82 A L H X S+ 0 0 34 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.907 113.2 48.4 -62.3 -41.1 -1.9 20.7 11.6 83 83 A K H X S+ 0 0 124 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.886 110.7 52.4 -67.0 -34.3 -0.2 19.9 8.2 84 84 A A H X S+ 0 0 12 -4,-2.2 4,-2.5 2,-0.2 16,-0.3 0.915 108.9 49.1 -67.3 -41.2 2.4 22.6 9.0 85 85 A L H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.892 110.0 52.0 -63.4 -37.9 3.0 21.0 12.4 86 86 A S H X S+ 0 0 42 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.916 109.3 50.0 -63.3 -41.1 3.4 17.6 10.6 87 87 A A H < S+ 0 0 56 -4,-2.5 4,-0.3 2,-0.2 -2,-0.2 0.907 111.1 48.6 -64.2 -39.3 6.0 19.2 8.2 88 88 A A H >< S+ 0 0 0 -4,-2.5 3,-1.7 8,-0.3 -2,-0.2 0.928 107.6 55.8 -62.4 -47.6 7.9 20.6 11.2 89 89 A K H 3< S+ 0 0 31 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.876 109.9 45.9 -47.6 -43.2 7.8 17.2 12.8 90 90 A G T 3< S+ 0 0 30 -4,-1.8 2,-0.3 -5,-0.1 -1,-0.3 0.458 109.6 69.1 -83.6 -0.4 9.4 15.7 9.8 91 91 A S < - 0 0 28 -3,-1.7 -66,-0.0 -4,-0.3 6,-0.0 -0.812 55.8-157.2-127.2 154.0 12.1 18.4 9.4 92 92 A K S S+ 0 0 91 -2,-0.3 -63,-0.1 -64,-0.0 -64,-0.1 0.443 70.2 107.0 -97.2 -3.8 15.3 19.9 11.1 93 93 A D >> - 0 0 84 1,-0.2 3,-2.3 -5,-0.1 4,-0.8 -0.678 62.4-152.5 -81.9 115.3 14.7 23.2 9.3 94 94 A P H 3> S+ 0 0 33 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.679 91.8 75.0 -62.9 -15.3 13.5 25.9 11.9 95 95 A A H 3> S+ 0 0 57 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.847 94.4 51.5 -60.6 -30.7 11.7 27.6 9.0 96 96 A T H <> S+ 0 0 33 -3,-2.3 4,-2.0 2,-0.2 -8,-0.3 0.917 108.3 49.4 -74.8 -39.6 9.2 24.8 9.2 97 97 A G H X S+ 0 0 1 -4,-0.8 4,-2.3 1,-0.2 -2,-0.2 0.890 112.2 50.9 -61.7 -40.7 8.7 25.4 13.0 98 98 A Q H X S+ 0 0 63 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.943 105.7 53.2 -61.7 -53.0 8.2 29.1 12.2 99 99 A K H X S+ 0 0 99 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.893 109.4 49.9 -47.7 -44.4 5.6 28.4 9.5 100 100 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 -16,-0.3 -1,-0.2 0.935 109.7 50.6 -62.3 -44.9 3.6 26.3 12.0 101 101 A L H X S+ 0 0 22 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.897 106.2 56.7 -58.3 -39.5 3.9 29.2 14.6 102 102 A D H X S+ 0 0 63 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.923 109.0 45.5 -58.3 -46.3 2.6 31.6 11.9 103 103 A Y H X S+ 0 0 58 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.921 111.1 52.1 -61.8 -44.5 -0.5 29.5 11.4 104 104 A I H X S+ 0 0 5 -4,-2.4 4,-3.1 1,-0.2 -2,-0.2 0.906 105.6 56.1 -58.9 -41.2 -1.1 29.2 15.2 105 105 A A H X S+ 0 0 58 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.891 106.1 51.1 -59.5 -39.3 -0.8 33.0 15.4 106 106 A Q H X S+ 0 0 98 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.878 110.9 46.8 -64.9 -39.3 -3.6 33.3 12.9 107 107 A I H X S+ 0 0 2 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.929 109.7 55.7 -63.8 -42.1 -5.8 30.9 14.9 108 108 A D H X S+ 0 0 51 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.879 105.1 52.4 -59.8 -37.8 -4.9 32.9 18.0 109 109 A K H X S+ 0 0 138 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.946 112.2 44.0 -67.4 -47.4 -6.1 36.1 16.4 110 110 A I H X S+ 0 0 11 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.927 110.9 56.2 -56.6 -49.5 -9.5 34.5 15.5 111 111 A F H X S+ 0 0 0 -4,-2.9 4,-1.0 1,-0.2 3,-0.2 0.946 106.7 47.6 -49.0 -57.5 -9.8 32.9 19.0 112 112 A W H >< S+ 0 0 106 -4,-2.2 3,-0.5 1,-0.2 4,-0.5 0.855 107.5 56.4 -62.7 -32.8 -9.4 36.2 20.9 113 113 A E H >X S+ 0 0 61 -4,-1.6 3,-1.8 1,-0.2 4,-1.5 0.942 105.2 52.2 -57.5 -45.0 -12.0 38.0 18.6 114 114 A T H 3< S+ 0 0 18 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.687 102.1 60.7 -66.1 -19.9 -14.6 35.3 19.6 115 115 A K T << S+ 0 0 97 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.589 107.6 45.6 -80.3 -13.5 -13.8 36.0 23.3 116 116 A K T <4 0 0 164 -3,-1.8 -2,-0.2 -4,-0.5 -1,-0.2 0.777 360.0 360.0 -93.6 -31.4 -15.0 39.6 22.7 117 117 A A < 0 0 124 -4,-1.5 -3,-0.2 0, 0.0 -2,-0.1 0.304 360.0 360.0-169.6 360.0 -18.2 38.9 20.8 118 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 119 4 B L 0 0 202 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -57.9 -15.5 -3.2 32.1 120 5 B P + 0 0 89 0, 0.0 57,-0.0 0, 0.0 56,-0.0 0.709 360.0 163.7 -86.0 158.5 -16.0 -5.4 30.2 121 6 B C - 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