==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 12-JUN-11 3SF6 . COMPND 2 MOLECULE: GLUTARYL-COA DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM SMEGMATIS; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 387 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16528.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 299 77.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 10.6 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 . 4 1.0 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 . 18 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 175 45.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 3.1 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 0 1 0 1 1 0 1 0 2 2 1 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 2 RESIDUES PER ALPHA HELIX . 1 0 0 1 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 . 2 1 0 0 2 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 1 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 13 A R 0 0 200 0, 0.0 2,-0.5 0, 0.0 268,-0.0 0.000 360.0 360.0 360.0 125.4 74.9 20.5 8.3 2 14 A R - 0 0 157 4,-0.0 0, 0.0 2,-0.0 0, 0.0 -0.954 360.0-129.3-103.4 129.7 73.1 17.8 6.2 3 15 A G > - 0 0 29 -2,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.244 27.8-104.9 -66.7 167.8 69.3 17.4 6.8 4 16 A A H > S+ 0 0 7 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.924 119.8 48.3 -65.3 -46.4 67.9 13.9 7.5 5 17 A D H >>S+ 0 0 38 1,-0.2 4,-2.5 2,-0.2 5,-1.6 0.887 113.8 48.5 -60.9 -38.6 66.3 13.4 4.0 6 18 A D H 45S+ 0 0 93 2,-0.2 -2,-0.2 3,-0.2 -1,-0.2 0.924 112.2 48.1 -66.7 -43.5 69.6 14.5 2.4 7 19 A L H <5S+ 0 0 99 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.912 116.4 43.0 -64.8 -41.7 71.7 12.2 4.7 8 20 A I H <5S- 0 0 49 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.899 106.3-133.0 -69.7 -36.0 69.3 9.2 3.9 9 21 A G T <5 + 0 0 34 -4,-2.5 4,-0.3 -5,-0.2 -3,-0.2 0.903 42.7 162.2 80.8 54.9 69.2 10.1 0.2 10 22 A I > < + 0 0 6 -5,-1.6 3,-1.8 1,-0.2 4,-0.3 0.919 62.1 58.5 -75.5 -44.5 65.4 9.9 -0.4 11 23 A N G > S+ 0 0 83 1,-0.3 3,-1.5 -6,-0.2 -1,-0.2 0.844 98.4 62.1 -58.3 -32.4 64.9 11.8 -3.6 12 24 A A G 3 S+ 0 0 95 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.2 0.692 102.6 49.9 -70.3 -17.7 67.3 9.5 -5.5 13 25 A V G < S+ 0 0 74 -3,-1.8 2,-0.3 -4,-0.3 -1,-0.3 0.330 103.0 73.9-102.4 11.0 65.0 6.5 -4.8 14 26 A L S < S- 0 0 13 -3,-1.5 2,-0.2 -4,-0.3 289,-0.0 -0.767 80.2-117.2-113.1 158.7 61.8 8.2 -6.0 15 27 A S > - 0 0 37 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.548 27.9-110.7 -86.8 165.2 60.6 9.0 -9.5 16 28 A A H > S+ 0 0 57 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.882 121.2 53.4 -62.0 -37.9 60.0 12.6 -10.8 17 29 A E H > S+ 0 0 136 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.878 110.8 46.0 -62.5 -43.7 56.3 11.8 -10.9 18 30 A E H > S+ 0 0 15 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.922 112.4 49.6 -64.9 -45.2 56.4 10.7 -7.2 19 31 A R H X S+ 0 0 75 -4,-2.8 4,-2.8 2,-0.2 5,-0.2 0.880 108.9 54.1 -63.0 -40.0 58.4 13.7 -6.2 20 32 A E H X S+ 0 0 132 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.944 109.9 45.7 -59.9 -44.7 55.9 16.0 -8.0 21 33 A I H X S+ 0 0 48 -4,-1.8 4,-2.5 2,-0.2 5,-0.3 0.950 113.7 50.0 -63.9 -45.9 52.9 14.5 -6.1 22 34 A R H X S+ 0 0 13 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.935 112.2 47.2 -55.2 -48.0 54.8 14.7 -2.8 23 35 A D H X S+ 0 0 75 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.869 110.0 53.3 -64.6 -39.8 55.7 18.4 -3.5 24 36 A T H X S+ 0 0 76 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.930 112.2 43.8 -62.3 -45.4 52.2 19.3 -4.5 25 37 A V H X S+ 0 0 3 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.923 110.1 55.9 -69.4 -39.3 50.8 17.8 -1.3 26 38 A R H X S+ 0 0 64 -4,-2.7 4,-2.8 -5,-0.3 -1,-0.2 0.918 107.6 49.9 -56.7 -43.0 53.5 19.5 0.8 27 39 A S H X S+ 0 0 44 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.926 109.1 51.2 -64.5 -40.5 52.5 22.9 -0.7 28 40 A V H X>S+ 0 0 2 -4,-2.0 4,-3.2 1,-0.2 5,-0.6 0.924 112.3 47.6 -59.7 -44.0 48.8 22.2 0.2 29 41 A V H X>S+ 0 0 4 -4,-2.7 5,-2.9 1,-0.2 4,-1.7 0.938 112.0 48.0 -64.4 -45.1 49.8 21.4 3.7 30 42 A Q H <5S+ 0 0 109 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.870 122.6 35.1 -63.8 -36.1 52.1 24.4 4.2 31 43 A R H <5S+ 0 0 154 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.881 130.3 23.9 -87.3 -38.8 49.4 26.8 2.8 32 44 A R H <5S+ 0 0 8 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.592 130.3 27.1-110.9 -15.3 46.1 25.4 3.9 33 45 A I T >X S+ 0 0 93 -3,-1.5 4,-2.4 2,-0.1 3,-0.4 0.551 94.6 90.7-109.0 -16.7 45.5 27.0 11.2 37 49 A I H X S+ 0 0 4 -4,-1.7 4,-2.7 1,-0.3 5,-0.3 0.832 82.2 55.2 -66.4 -36.2 46.4 23.7 12.9 38 50 A A H > S+ 0 0 40 -4,-0.5 4,-2.5 1,-0.2 -1,-0.3 0.936 114.2 43.5 -58.5 -44.5 47.6 24.9 16.3 39 51 A S H > S+ 0 0 66 -3,-0.4 4,-2.5 2,-0.2 6,-0.2 0.910 113.5 49.5 -67.0 -44.7 44.3 26.7 16.7 40 52 A W H X>S+ 0 0 31 -4,-2.4 4,-1.7 2,-0.2 5,-1.2 0.925 113.7 47.2 -59.8 -44.2 42.2 23.8 15.4 41 53 A Y H <5S+ 0 0 26 -4,-2.7 -2,-0.2 -5,-0.2 3,-0.2 0.954 113.4 46.8 -65.2 -48.1 44.0 21.4 17.7 42 54 A E H <5S+ 0 0 116 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.923 117.2 43.6 -58.4 -45.5 43.7 23.7 20.8 43 55 A D H <5S- 0 0 108 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.738 98.5-137.6 -71.5 -25.2 40.0 24.3 20.1 44 56 A G T <5S+ 0 0 28 -4,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.757 73.9 97.9 66.2 29.5 39.2 20.7 19.3 45 57 A E < + 0 0 132 -5,-1.2 -1,-0.2 -6,-0.2 -2,-0.2 -0.990 45.6 171.0-146.4 140.7 37.1 22.0 16.5 46 58 A L - 0 0 28 -2,-0.3 2,-2.3 -3,-0.1 3,-0.2 -0.972 47.6-102.5-149.5 156.3 37.8 22.4 12.8 47 59 A P > + 0 0 64 0, 0.0 4,-2.9 0, 0.0 5,-0.2 -0.482 52.2 167.3 -77.2 71.0 35.8 23.3 9.7 48 60 A A H > + 0 0 3 -2,-2.3 4,-2.6 1,-0.2 5,-0.2 0.883 68.5 48.9 -60.7 -43.0 35.8 19.7 8.7 49 61 A R H > S+ 0 0 147 -3,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.935 115.0 44.1 -63.9 -45.3 33.1 20.0 6.0 50 62 A E H > S+ 0 0 67 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.902 114.0 51.5 -66.0 -39.6 34.7 23.0 4.3 51 63 A L H X S+ 0 0 4 -4,-2.9 4,-2.9 1,-0.2 5,-0.2 0.893 105.0 55.2 -64.8 -40.7 38.1 21.3 4.6 52 64 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 -5,-0.2 5,-0.2 0.923 108.4 49.3 -57.5 -44.2 36.9 18.1 2.9 53 65 A V H X S+ 0 0 35 -4,-1.7 4,-2.8 73,-0.3 5,-0.2 0.932 111.2 49.6 -60.1 -46.7 35.7 20.1 -0.1 54 66 A E H X S+ 0 0 84 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.930 114.9 43.1 -55.8 -50.0 39.0 21.9 -0.3 55 67 A L H <>S+ 0 0 0 -4,-2.9 5,-2.5 2,-0.2 6,-0.3 0.911 114.8 49.8 -66.8 -40.9 41.0 18.6 -0.2 56 68 A G H ><5S+ 0 0 8 -4,-2.9 3,-1.7 -5,-0.2 5,-0.3 0.919 109.1 50.5 -63.4 -45.5 38.6 16.8 -2.6 57 69 A E H 3<5S+ 0 0 134 -4,-2.8 -1,-0.2 68,-0.4 -2,-0.2 0.777 107.6 56.2 -66.3 -22.4 38.7 19.6 -5.1 58 70 A L T 3<5S- 0 0 85 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.441 121.1-110.0 -83.5 -4.6 42.6 19.4 -4.8 59 71 A G T < 5S+ 0 0 31 -3,-1.7 12,-0.4 -4,-0.2 -3,-0.2 0.584 84.0 122.0 89.5 15.7 42.4 15.7 -5.7 60 72 A L < + 0 0 8 -5,-2.5 2,-0.5 -6,-0.1 3,-0.3 0.346 47.4 83.9 -98.6 3.8 43.4 14.4 -2.3 61 73 A L S S+ 0 0 2 63,-0.4 10,-0.2 -6,-0.3 36,-0.1 -0.941 104.8 5.9-111.0 123.5 40.3 12.2 -1.4 62 74 A G S > S+ 0 0 3 -2,-0.5 3,-2.0 34,-0.3 10,-0.6 0.765 80.1 162.4 78.3 29.0 40.4 8.7 -2.8 63 75 A M T 3 S+ 0 0 2 -3,-0.3 10,-2.5 1,-0.3 9,-0.1 0.776 71.2 42.6 -53.4 -37.8 44.0 9.2 -4.0 64 76 A H T 3 S+ 0 0 40 8,-0.2 -1,-0.3 7,-0.1 2,-0.2 0.454 98.5 93.4 -93.4 1.6 44.8 5.5 -4.4 65 77 A L S < S- 0 0 13 -3,-2.0 7,-1.5 2,-0.1 2,-0.4 -0.600 70.3-129.5 -94.6 155.1 41.4 4.5 -6.0 66 78 A K - 0 0 134 -2,-0.2 5,-0.1 6,-0.1 -2,-0.1 -0.834 62.9 -0.1-105.4 137.6 40.7 4.4 -9.7 67 79 A G S > S+ 0 0 42 3,-0.4 3,-2.3 -2,-0.4 5,-0.1 -0.171 84.2 82.9 86.0 178.4 37.8 6.1 -11.4 68 80 A Y T 3 S- 0 0 71 1,-0.3 56,-0.3 55,-0.0 55,-0.1 0.748 126.6 -53.9 59.2 27.6 34.9 8.3 -10.1 69 81 A G T 3 S+ 0 0 75 1,-0.3 -1,-0.3 55,-0.1 2,-0.1 0.456 103.2 138.7 85.4 2.5 37.0 11.4 -10.1 70 82 A C < - 0 0 20 -3,-2.3 -3,-0.4 1,-0.1 -1,-0.3 -0.440 62.2-119.0 -82.7 157.5 39.8 9.8 -8.0 71 83 A A - 0 0 55 -12,-0.4 -8,-0.2 -10,-0.2 -7,-0.1 0.766 26.0-151.1 -69.0 -28.7 43.5 10.4 -8.7 72 84 A G + 0 0 28 -7,-1.5 -8,-0.2 -10,-0.6 -6,-0.1 0.855 35.0 165.9 59.1 33.5 44.4 6.7 -9.4 73 85 A M - 0 0 24 -10,-2.5 -1,-0.1 -8,-0.2 -2,-0.0 -0.286 39.0 -90.2 -79.8 167.0 47.9 7.3 -8.2 74 86 A S > - 0 0 42 1,-0.1 4,-2.6 -2,-0.0 5,-0.2 -0.239 34.0-109.1 -69.9 165.6 50.5 4.6 -7.3 75 87 A A H > S+ 0 0 0 231,-0.2 4,-2.5 1,-0.2 5,-0.1 0.904 120.9 49.8 -60.5 -44.5 50.9 3.1 -3.8 76 88 A V H > S+ 0 0 0 230,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.927 111.9 46.8 -61.9 -45.3 54.2 4.8 -3.4 77 89 A A H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.927 113.0 50.0 -64.2 -41.2 52.8 8.3 -4.5 78 90 A Y H X S+ 0 0 10 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.927 109.6 51.9 -59.3 -44.7 49.8 7.8 -2.2 79 91 A G H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.931 108.6 49.6 -57.5 -47.5 52.2 6.9 0.6 80 92 A L H X S+ 0 0 4 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.880 109.3 53.1 -61.9 -38.7 54.2 10.1 0.0 81 93 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.922 109.1 48.5 -59.1 -47.3 51.0 12.1 0.1 82 94 A C H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.885 108.4 54.4 -60.7 -40.6 50.0 10.6 3.4 83 95 A L H X S+ 0 0 4 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.943 110.8 45.7 -58.0 -49.1 53.4 11.3 4.8 84 96 A E H X S+ 0 0 5 -4,-2.3 4,-1.1 2,-0.2 -2,-0.2 0.906 112.0 51.5 -61.7 -41.0 53.1 15.0 3.8 85 97 A L H X S+ 0 0 1 -4,-2.4 4,-2.4 1,-0.2 3,-0.4 0.929 112.3 45.7 -61.5 -44.0 49.5 15.3 5.2 86 98 A E H < S+ 0 0 0 -4,-2.6 4,-0.3 2,-0.3 -1,-0.2 0.801 101.3 63.9 -74.6 -30.6 50.5 13.8 8.6 87 99 A A H < S+ 0 0 0 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.851 109.3 45.1 -56.4 -33.5 53.6 16.0 8.8 88 100 A G H < S- 0 0 0 -4,-1.1 -2,-0.3 -3,-0.4 2,-0.3 0.983 141.2 -42.9 -64.1 -68.5 50.9 18.7 8.9 89 101 A D X - 0 0 0 -4,-2.4 4,-2.2 1,-0.1 3,-0.4 -0.879 37.3-133.3-166.9 137.3 48.7 16.8 11.4 90 102 A S H > S+ 0 0 0 -4,-0.3 4,-2.3 -2,-0.3 5,-0.1 0.799 107.6 59.3 -62.3 -32.4 47.7 13.1 12.0 91 103 A G H > S+ 0 0 1 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.902 106.6 46.4 -61.7 -42.2 44.1 14.3 12.6 92 104 A I H > S+ 0 0 1 -3,-0.4 4,-1.7 2,-0.2 3,-0.2 0.941 112.5 49.0 -65.7 -46.8 43.9 15.8 9.1 93 105 A R H X S+ 0 0 0 -4,-2.2 4,-3.1 -8,-0.2 -2,-0.2 0.874 107.8 57.7 -60.4 -36.2 45.5 12.6 7.6 94 106 A S H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 5,-0.3 0.889 101.8 53.0 -60.1 -42.2 42.9 10.6 9.5 95 107 A L H X S+ 0 0 6 -4,-1.7 4,-2.1 -3,-0.2 -1,-0.2 0.940 113.9 44.4 -57.1 -44.1 40.0 12.5 7.9 96 108 A V H X S+ 0 0 3 -4,-1.7 4,-2.9 2,-0.2 5,-0.5 0.924 110.8 52.5 -68.5 -47.0 41.6 11.6 4.5 97 109 A S H X>S+ 0 0 4 -4,-3.1 5,-0.9 1,-0.2 4,-0.8 0.904 112.7 45.4 -55.1 -45.7 42.3 7.9 5.4 98 110 A V H X>S+ 0 0 12 -4,-2.4 5,-3.1 3,-0.2 4,-0.6 0.925 114.5 49.0 -66.3 -45.3 38.7 7.3 6.5 99 111 A Q H <>S+ 0 0 1 -4,-2.1 5,-2.5 -5,-0.3 -2,-0.2 0.954 128.1 17.8 -58.2 -51.1 37.3 9.1 3.5 100 112 A G H <>S+ 0 0 6 -4,-2.9 5,-1.7 3,-0.2 -3,-0.2 0.955 129.8 35.8 -92.3 -59.0 39.4 7.2 0.9 101 113 A S H <5S+ 0 0 9 -4,-0.8 144,-0.4 -5,-0.5 143,-0.2 0.598 130.6 24.9 -80.6 -11.6 40.9 4.0 2.2 102 114 A L T X - 0 0 33 116,-0.2 4,-2.4 114,-0.2 5,-0.2 -0.412 37.0-105.8 -69.3 163.5 26.9 -2.4 -6.2 113 125 A D H > S+ 0 0 114 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.910 123.5 57.5 -60.2 -36.5 27.2 -0.2 -9.3 114 126 A E H > S+ 0 0 117 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.918 108.3 45.1 -59.6 -45.1 24.3 1.8 -7.9 115 127 A Q H >>S+ 0 0 8 2,-0.2 4,-2.5 1,-0.2 5,-0.5 0.917 114.5 48.3 -64.5 -43.4 26.2 2.5 -4.7 116 128 A K H X5S+ 0 0 37 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.927 114.8 44.3 -62.3 -46.4 29.4 3.4 -6.5 117 129 A D H <5S+ 0 0 106 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.856 116.3 47.3 -71.1 -33.1 27.7 5.7 -8.9 118 130 A Q H <5S+ 0 0 109 -4,-2.1 4,-0.2 -5,-0.3 -2,-0.2 0.912 127.8 18.1 -71.4 -43.3 25.6 7.4 -6.2 119 131 A W H X5S+ 0 0 24 -4,-2.5 4,-1.7 -5,-0.2 5,-0.2 0.814 105.9 69.8-104.0 -40.7 28.3 8.0 -3.7 120 132 A L H X S+ 0 0 54 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.936 115.1 45.8 -65.1 -37.5 32.1 11.0 -7.2 122 134 A D H 4>S+ 0 0 72 -4,-0.2 6,-1.9 1,-0.2 5,-1.0 0.784 113.2 51.0 -72.0 -25.5 30.7 13.2 -4.5 123 135 A M H ><5S+ 0 0 0 -4,-1.7 3,-0.8 4,-0.2 -1,-0.2 0.877 107.4 52.8 -72.5 -39.5 33.0 11.6 -1.9 124 136 A A H 3<5S+ 0 0 8 -4,-2.8 -63,-0.4 -56,-0.3 -65,-0.2 0.885 111.2 47.1 -65.3 -32.4 36.0 12.2 -4.2 125 137 A S T 3<5S- 0 0 31 -4,-1.7 -68,-0.4 -5,-0.2 -1,-0.2 0.551 112.3-121.0 -83.8 -9.8 35.1 15.9 -4.4 126 138 A G T < 5S+ 0 0 2 -3,-0.8 -73,-0.3 2,-0.3 -3,-0.2 0.436 82.1 117.5 84.0 0.7 34.6 16.1 -0.7 127 139 A H S -H 139 0B 11 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