==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 23-MAY-13 4KVR . COMPND 2 MOLECULE: ALDEHYDE DECARBONYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PROCHLOROCOCCUS MARINUS; . AUTHOR C.W.LEVY,B.KHARA,N.MENON,D.MANSELL,D.DAS,E.N.G.MARSH,D.LEYS, . 221 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10311.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 195 88.2 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 . 5 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 155 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 4.1 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 0 0 0 1 1 0 0 0 1 0 0 0 0 0 1 1 0 0 0 0 1 0 1 0 1 1 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 21 A A 0 0 124 0, 0.0 120,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 157.1 -9.8 -12.6 -29.7 2 22 A L - 0 0 95 1,-0.1 183,-0.1 120,-0.0 119,-0.1 -0.336 360.0-106.0 -61.6 145.2 -12.8 -10.3 -30.0 3 23 A P - 0 0 15 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 -0.186 31.7-105.6 -61.0 161.3 -16.3 -11.7 -29.6 4 24 A D > - 0 0 92 1,-0.1 3,-1.5 119,-0.0 6,-0.3 -0.856 32.5-164.8 -90.0 104.5 -18.6 -12.2 -32.5 5 25 A F T 3 S+ 0 0 30 -2,-0.9 -1,-0.1 1,-0.3 118,-0.0 0.608 83.8 55.7 -72.0 -9.9 -20.9 -9.3 -31.9 6 26 A T T 3 S+ 0 0 101 4,-0.1 -1,-0.3 -3,-0.0 -2,-0.0 0.557 82.6 107.8 -96.7 -10.9 -23.4 -10.7 -34.3 7 27 A S S <> S- 0 0 29 -3,-1.5 4,-2.4 1,-0.1 5,-0.2 -0.286 73.7-128.6 -69.9 153.1 -23.8 -14.2 -32.8 8 28 A D H > S+ 0 0 129 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.827 110.8 57.5 -67.3 -31.6 -27.0 -15.2 -30.9 9 29 A R H > S+ 0 0 150 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.922 110.1 42.8 -62.9 -46.6 -24.8 -16.3 -28.0 10 30 A Y H > S+ 0 0 1 -6,-0.3 4,-3.1 1,-0.2 5,-0.2 0.954 112.9 51.0 -66.0 -51.3 -23.2 -12.8 -27.7 11 31 A K H X S+ 0 0 68 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.855 108.0 54.7 -56.5 -35.0 -26.5 -10.9 -28.2 12 32 A D H X S+ 0 0 86 -4,-1.9 4,-0.6 2,-0.2 -1,-0.2 0.949 112.8 39.9 -67.1 -46.2 -28.1 -13.0 -25.4 13 33 A A H >X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 3,-1.2 0.922 113.1 57.2 -67.7 -39.6 -25.5 -12.2 -22.9 14 34 A Y H 3X>S+ 0 0 0 -4,-3.1 4,-2.7 1,-0.3 5,-0.5 0.835 94.1 66.1 -58.4 -35.7 -25.3 -8.6 -24.0 15 35 A S H 3<5S+ 0 0 7 -4,-1.8 57,-2.9 -5,-0.2 4,-0.4 0.818 112.2 34.7 -58.8 -30.2 -29.0 -8.1 -23.4 16 36 A R H X S+ 0 0 74 -4,-2.0 3,-0.6 -5,-0.2 4,-0.5 0.938 111.3 51.1 -61.4 -45.8 -30.3 13.8 -7.1 34 54 A A H >< S+ 0 0 17 -4,-2.5 3,-1.4 1,-0.2 4,-0.5 0.868 103.7 57.0 -58.7 -39.7 -31.4 12.1 -3.9 35 55 A I H >X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.3 3,-1.3 0.813 95.3 68.4 -64.3 -26.2 -28.1 13.0 -2.2 36 56 A G H << S+ 0 0 8 -4,-1.1 -1,-0.3 -3,-0.6 7,-0.2 0.767 91.2 58.7 -64.0 -26.5 -29.1 16.6 -3.0 37 57 A T T << S+ 0 0 100 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.716 112.5 41.2 -72.2 -20.6 -31.9 16.4 -0.5 38 58 A L T <4 S+ 0 0 38 -3,-1.3 -2,-0.2 -4,-0.5 -1,-0.2 0.725 123.8 36.5 -96.2 -29.1 -29.2 15.6 2.1 39 59 A L >< + 0 0 16 -4,-2.2 3,-2.7 1,-0.1 4,-0.3 -0.656 68.2 173.4-123.5 75.0 -26.7 18.1 1.0 40 60 A P G > S+ 0 0 97 0, 0.0 3,-0.8 0, 0.0 4,-0.2 0.746 79.7 55.1 -57.6 -27.7 -28.8 21.1 -0.1 41 61 A D G 3 S+ 0 0 134 1,-0.2 3,-0.2 2,-0.1 4,-0.1 0.510 104.1 55.7 -83.9 -5.1 -25.8 23.3 -0.7 42 62 A H G <> S+ 0 0 42 -3,-2.7 4,-2.5 -6,-0.2 3,-0.4 0.374 75.7 108.5-100.7 2.3 -24.3 20.7 -3.0 43 63 A V H <> S+ 0 0 48 -3,-0.8 4,-2.4 -4,-0.3 5,-0.2 0.847 73.8 49.7 -54.5 -44.1 -27.3 20.6 -5.3 44 64 A E H > S+ 0 0 123 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.890 114.5 45.1 -67.3 -37.3 -25.9 22.4 -8.4 45 65 A E H > S+ 0 0 86 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.910 113.4 50.5 -67.3 -42.7 -22.8 20.2 -8.5 46 66 A L H X S+ 0 0 2 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.838 105.6 56.7 -65.7 -34.0 -25.0 17.1 -7.9 47 67 A K H X S+ 0 0 72 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.886 107.1 49.1 -62.0 -39.8 -27.2 18.2 -10.8 48 68 A R H X S+ 0 0 157 -4,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.893 111.7 49.0 -64.0 -43.4 -24.2 18.2 -13.1 49 69 A L H X S+ 0 0 1 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.939 111.8 48.4 -61.3 -45.5 -23.2 14.7 -11.9 50 70 A A H X S+ 0 0 1 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.874 108.7 53.7 -66.7 -36.4 -26.7 13.4 -12.5 51 71 A K H X S+ 0 0 118 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.874 106.0 53.3 -64.8 -36.2 -26.8 14.9 -16.0 52 72 A M H X S+ 0 0 11 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.912 105.6 54.5 -63.2 -41.6 -23.6 13.2 -16.9 53 73 A E H X S+ 0 0 1 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.861 106.0 51.7 -61.5 -34.4 -25.1 9.9 -15.7 54 74 A M H X S+ 0 0 48 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.851 107.7 52.2 -73.1 -31.0 -28.0 10.5 -18.1 55 75 A R H X S+ 0 0 144 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.894 110.0 49.5 -65.0 -41.1 -25.6 11.1 -20.9 56 76 A H H X S+ 0 0 5 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.907 110.1 50.6 -61.4 -44.4 -23.9 7.8 -20.0 57 77 A K H X S+ 0 0 51 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.944 109.2 50.7 -61.1 -46.3 -27.3 6.0 -20.0 58 78 A K H X S+ 0 0 150 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.872 109.0 52.5 -60.2 -37.6 -28.1 7.4 -23.4 59 79 A G H X S+ 0 0 12 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.909 111.1 44.6 -66.0 -43.7 -24.8 6.2 -24.8 60 80 A F H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.869 109.8 56.3 -71.8 -34.0 -25.3 2.7 -23.6 61 81 A T H X S+ 0 0 51 -4,-2.9 4,-2.0 -5,-0.2 3,-0.2 0.948 108.5 48.8 -54.9 -46.6 -28.9 2.8 -24.9 62 82 A A H X S+ 0 0 33 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.851 105.2 57.4 -61.6 -38.4 -27.3 3.7 -28.3 63 83 A C H X S+ 0 0 0 -4,-1.8 4,-1.3 1,-0.2 -1,-0.2 0.875 107.7 48.9 -60.0 -40.0 -24.8 0.8 -28.0 64 84 A G H X>S+ 0 0 2 -4,-1.8 5,-2.8 -3,-0.2 4,-0.8 0.921 110.3 49.0 -65.0 -47.1 -27.8 -1.6 -27.6 65 85 A K H ><5S+ 0 0 166 -4,-2.0 3,-0.7 1,-0.2 -2,-0.2 0.901 108.2 56.7 -58.4 -41.1 -29.6 -0.2 -30.6 66 86 A N H 3<5S+ 0 0 82 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.833 112.0 39.1 -61.9 -37.7 -26.4 -0.4 -32.7 67 87 A L H 3<5S- 0 0 29 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.495 113.8-117.5 -88.3 -5.5 -26.0 -4.2 -32.0 68 88 A G T <<5 + 0 0 54 -4,-0.8 2,-0.5 -3,-0.7 -3,-0.2 0.845 64.4 147.4 71.7 35.8 -29.8 -4.7 -32.4 69 89 A V < - 0 0 10 -5,-2.8 2,-0.5 -6,-0.1 -1,-0.2 -0.913 45.2-141.1-115.2 124.1 -30.2 -5.9 -28.8 70 90 A E - 0 0 136 -2,-0.5 2,-0.2 1,-0.1 -51,-0.1 -0.659 29.3-122.8 -75.5 121.8 -33.2 -5.3 -26.6 71 91 A A - 0 0 35 -2,-0.5 2,-1.6 1,-0.1 3,-0.2 -0.486 9.7-134.5 -70.2 133.3 -32.0 -4.6 -23.0 72 92 A D > + 0 0 60 -57,-2.9 4,-1.6 -2,-0.2 3,-0.3 -0.632 34.0 171.3 -84.9 83.5 -33.4 -7.0 -20.4 73 93 A M H > + 0 0 43 -2,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.800 69.8 60.0 -71.5 -28.6 -34.3 -4.2 -18.0 74 94 A D H > S+ 0 0 112 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.913 105.4 49.1 -62.4 -44.3 -36.1 -6.5 -15.5 75 95 A F H > S+ 0 0 71 -3,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.927 112.0 49.4 -58.4 -45.9 -33.0 -8.6 -15.0 76 96 A A H X S+ 0 0 0 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.897 106.8 53.9 -64.4 -42.3 -31.0 -5.4 -14.4 77 97 A R H X S+ 0 0 100 -4,-2.4 4,-0.7 1,-0.2 -1,-0.2 0.882 111.3 45.6 -62.1 -37.4 -33.4 -3.9 -11.9 78 98 A E H >< S+ 0 0 135 -4,-1.6 3,-0.6 2,-0.2 -1,-0.2 0.903 108.2 57.7 -71.3 -39.3 -33.3 -7.1 -9.8 79 99 A F H 3< S+ 0 0 8 -4,-2.3 4,-0.3 1,-0.3 -2,-0.2 0.879 113.8 38.5 -55.3 -41.1 -29.5 -7.2 -10.0 80 100 A F H 3X S+ 0 0 6 -4,-2.0 4,-2.8 1,-0.2 5,-0.3 0.552 90.2 98.6 -87.8 -8.6 -29.3 -3.7 -8.5 81 101 A A H S+ 0 0 53 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.949 116.8 37.1 -61.0 -49.9 -29.9 -5.2 -3.0 83 103 A L H > S+ 0 0 2 -4,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.871 117.0 53.7 -66.7 -37.9 -27.8 -2.0 -3.2 84 104 A R H X S+ 0 0 63 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.929 108.9 48.3 -62.9 -44.7 -30.8 0.1 -4.2 85 105 A D H X S+ 0 0 94 -4,-3.0 4,-2.3 -5,-0.3 -1,-0.2 0.924 113.6 47.5 -58.9 -46.3 -32.8 -1.1 -1.2 86 106 A N H X S+ 0 0 56 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.852 110.2 52.2 -65.1 -36.5 -29.8 -0.3 1.1 87 107 A F H X S+ 0 0 1 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.927 110.1 48.5 -63.9 -44.9 -29.4 3.1 -0.5 88 108 A Q H X S+ 0 0 92 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.917 109.7 52.1 -63.3 -44.4 -33.0 4.0 0.1 89 109 A T H X S+ 0 0 75 -4,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.940 112.6 45.1 -55.2 -50.6 -32.9 2.8 3.7 90 110 A A H <>S+ 0 0 5 -4,-2.2 5,-2.9 2,-0.2 3,-0.4 0.904 111.5 53.6 -58.7 -44.6 -29.8 5.0 4.3 91 111 A L H ><5S+ 0 0 34 -4,-2.7 3,-2.0 1,-0.2 -2,-0.2 0.937 106.5 51.3 -58.1 -50.0 -31.5 8.0 2.5 92 112 A G H 3<5S+ 0 0 71 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.772 111.0 49.0 -58.6 -28.3 -34.6 7.8 4.6 93 113 A Q T 3<5S- 0 0 115 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.335 115.1-116.7 -94.4 4.7 -32.5 7.9 7.7 94 114 A G T < 5 + 0 0 41 -3,-2.0 2,-1.8 1,-0.2 -3,-0.2 0.747 57.5 159.2 69.2 25.2 -30.5 10.8 6.5 95 115 A K >>< + 0 0 78 -5,-2.9 4,-2.2 1,-0.2 3,-0.6 -0.503 9.1 170.7 -87.4 74.8 -27.3 8.8 6.4 96 116 A T H 3> S+ 0 0 17 -2,-1.8 4,-2.5 1,-0.2 5,-0.2 0.847 74.0 53.9 -51.4 -44.2 -25.2 10.9 3.9 97 117 A P H 3> S+ 0 0 14 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.896 110.3 47.3 -65.1 -33.7 -22.0 9.0 4.5 98 118 A T H <> S+ 0 0 16 -3,-0.6 4,-2.5 2,-0.2 5,-0.2 0.910 111.2 51.4 -69.6 -42.6 -23.6 5.6 3.7 99 119 A C H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.4 0.920 112.2 46.6 -59.2 -45.3 -25.3 7.0 0.6 100 120 A L H X>S+ 0 0 0 -4,-2.5 5,-1.3 2,-0.2 4,-1.0 0.894 111.1 51.2 -65.1 -41.2 -21.9 8.4 -0.6 101 121 A L H <>S+ 0 0 0 -4,-2.2 5,-3.0 -5,-0.2 4,-0.4 0.925 114.0 44.6 -62.6 -43.4 -20.1 5.2 0.1 102 122 A I H <>S+ 0 0 0 -4,-2.5 5,-2.4 3,-0.2 -2,-0.2 0.953 129.1 22.9 -65.2 -50.1 -22.7 3.1 -1.8 103 123 A Q H <>S+ 0 0 0 -4,-2.6 5,-1.4 -5,-0.2 -3,-0.2 0.974 128.5 36.8 -84.5 -59.2 -23.0 5.4 -4.8 104 124 A A T <5S+ 0 0 0 -4,-1.0 40,-0.2 -5,-0.4 -3,-0.2 0.759 133.1 22.5 -71.6 -24.9 -19.8 7.5 -5.2 105 125 A L T >< S+ 0 0 0 -4,-2.0 3,-1.5 -5,-0.2 4,-0.4 0.820 93.2 76.2 -77.7 -32.7 -15.1 -4.1 -21.4 119 139 A I G >< S+ 0 0 22 -4,-2.0 3,-1.6 1,-0.3 -1,-0.2 0.895 92.4 47.7 -49.6 -54.0 -13.2 -1.6 -23.6 120 140 A P G 3 S+ 0 0 78 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.620 120.8 39.2 -70.1 -8.4 -10.6 -3.9 -25.1 121 141 A V G < S+ 0 0 22 -3,-1.5 -2,-0.2 -4,-0.2 2,-0.2 0.197 94.7 109.9-118.9 13.0 -13.3 -6.5 -26.0 122 142 A S S < S- 0 0 1 -3,-1.6 -120,-0.0 -4,-0.4 -3,-0.0 -0.510 75.1-100.7 -91.2 157.0 -16.1 -4.1 -27.1 123 143 A D > - 0 0 5 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.297 43.5-101.6 -68.4 159.4 -17.4 -3.5 -30.6 124 144 A P H > S+ 0 0 103 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.841 120.5 47.7 -60.2 -33.6 -16.0 -0.4 -32.3 125 145 A F H > S+ 0 0 83 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.948 116.3 43.0 -67.7 -51.8 -19.2 1.8 -31.7 126 146 A A H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.811 107.5 62.9 -63.7 -32.2 -19.4 0.8 -28.0 127 147 A R H X S+ 0 0 68 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.962 104.5 44.3 -61.1 -50.5 -15.6 1.2 -27.5 128 148 A K H X S+ 0 0 166 -4,-1.5 4,-1.6 1,-0.2 -1,-0.2 0.911 115.9 48.7 -60.6 -41.6 -15.6 4.9 -28.3 129 149 A I H X S+ 0 0 51 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.926 114.1 45.4 -60.9 -46.4 -18.7 5.5 -26.2 130 150 A T H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.872 106.4 58.4 -72.5 -36.8 -17.2 3.5 -23.2 131 151 A E H X S+ 0 0 87 -4,-3.0 4,-1.0 -5,-0.2 -1,-0.2 0.906 108.0 48.5 -56.0 -40.6 -13.8 5.2 -23.5 132 152 A G H X S+ 0 0 24 -4,-1.6 4,-0.9 -5,-0.2 3,-0.4 0.943 110.1 52.3 -62.3 -46.5 -15.6 8.5 -23.0 133 153 A V H >X S+ 0 0 6 -4,-1.9 4,-1.4 1,-0.2 3,-0.8 0.886 100.9 58.4 -59.4 -45.2 -17.5 7.2 -20.0 134 154 A V H 3X S+ 0 0 9 -4,-2.3 4,-0.9 1,-0.3 -1,-0.2 0.848 100.6 56.5 -60.4 -37.4 -14.5 5.9 -18.0 135 155 A K H 3< S+ 0 0 148 -4,-1.0 4,-0.5 -3,-0.4 3,-0.3 0.861 108.0 51.7 -59.5 -34.8 -12.8 9.2 -17.8 136 156 A D H XX S+ 0 0 46 -4,-0.9 4,-1.2 -3,-0.8 3,-1.0 0.831 96.7 62.2 -72.0 -37.2 -16.0 10.6 -16.3 137 157 A E H 3X S+ 0 0 1 -4,-1.4 4,-2.4 1,-0.3 -1,-0.2 0.788 95.1 62.7 -73.5 -17.9 -16.5 8.1 -13.5 138 158 A Y H 3X S+ 0 0 99 -4,-0.9 4,-2.6 -3,-0.3 -1,-0.3 0.838 99.4 56.5 -64.9 -32.4 -13.2 9.2 -11.9 139 159 A T H <> S+ 0 0 62 -3,-1.0 4,-1.6 -4,-0.5 -2,-0.2 0.888 107.6 48.3 -62.6 -37.6 -14.8 12.6 -11.5 140 160 A H H X S+ 0 0 0 -4,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.915 109.7 49.9 -73.0 -43.7 -17.5 10.9 -9.6 141 161 A L H X S+ 0 0 4 -4,-2.4 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111.5 49.3 -61.3 -43.9 -10.6 5.8 -2.7 203 223 A L H X>S+ 0 0 2 -4,-2.6 5,-2.5 2,-0.2 4,-1.3 0.901 111.2 49.9 -64.4 -38.5 -10.3 4.6 0.8 204 224 A T H ><5S+ 0 0 88 -4,-2.5 3,-0.6 1,-0.2 -2,-0.2 0.945 110.6 49.2 -62.6 -49.1 -6.7 5.7 1.0 205 225 A E H 3<5S+ 0 0 86 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.866 107.3 55.6 -58.0 -38.0 -7.5 9.1 -0.4 206 226 A I H 3<5S- 0 0 3 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.794 126.7 -99.3 -67.8 -28.0 -10.3 9.5 2.2 207 227 A G T <<5S+ 0 0 43 -4,-1.3 2,-0.2 -3,-0.6 -3,-0.2 0.523 72.0 141.6 121.2 10.2 -7.8 8.8 5.0 208 228 A F < - 0 0 8 -5,-2.5 -1,-0.3 1,-0.1 2,-0.1 -0.577 44.3-131.0 -76.7 144.1 -8.1 5.1 6.0 209 229 A N > - 0 0 89 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.429 28.5 -94.6 -90.1 173.5 -4.8 3.4 6.7 210 230 A T H > S+ 0 0 111 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.862 123.0 48.9 -56.3 -43.7 -3.6 0.0 5.4 211 231 A R H > S+ 0 0 217 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.947 112.4 48.0 -62.0 -48.9 -4.8 -2.0 8.4 212 232 A E H > S+ 0 0 50 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.896 114.3 47.2 -56.9 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