==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 11-AUG-11 3TDG . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HELICOBACTER PYLORI; . AUTHOR J.Y.YOON,J.KIM,S.J.LEE,H.S.KIM,H.N.IM,H.YOON,K.H.KIM,S.KIM,B . 232 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13162.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 12.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 21 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 39.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 0 0 0 1 1 0 0 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 0 2 1 0 2 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 2 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 32 A Q > 0 0 108 0, 0.0 4,-1.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 109.9 -46.7 50.4 22.0 2 33 A D H > + 0 0 143 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.832 360.0 62.1 -67.7 -30.6 -46.8 49.7 18.4 3 34 A N H > S+ 0 0 51 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.921 103.6 45.2 -65.8 -42.8 -43.9 52.0 17.7 4 35 A L H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.940 113.6 50.8 -64.8 -44.5 -41.4 50.1 19.7 5 36 A V H X S+ 0 0 23 -4,-1.5 4,-2.3 1,-0.2 11,-0.3 0.887 113.4 46.1 -57.0 -40.6 -42.5 46.8 18.3 6 37 A S H X S+ 0 0 42 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.881 108.6 54.0 -76.7 -34.9 -42.2 48.2 14.9 7 38 A V H X S+ 0 0 25 -4,-2.6 4,-1.0 45,-0.2 -2,-0.2 0.920 113.5 43.7 -63.5 -40.8 -38.8 49.8 15.4 8 39 A I H X S+ 0 0 26 -4,-2.3 4,-1.0 1,-0.2 6,-0.4 0.933 110.2 55.6 -70.6 -44.3 -37.5 46.5 16.6 9 40 A E H >X S+ 0 0 78 -4,-2.3 4,-2.5 1,-0.2 3,-0.7 0.902 103.7 53.6 -54.3 -45.6 -39.1 44.5 13.8 10 41 A K H 3< S+ 0 0 174 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.839 117.4 35.4 -60.9 -38.6 -37.6 46.6 11.0 11 42 A Q H 3< S+ 0 0 152 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.387 133.8 23.0-103.6 6.0 -34.0 46.1 12.2 12 43 A T H << S- 0 0 75 -4,-1.0 -3,-0.2 -3,-0.7 -2,-0.2 0.486 88.9-129.6-132.6 -14.8 -34.2 42.6 13.6 13 44 A N S < S+ 0 0 138 -4,-2.5 2,-0.5 -5,-0.4 -4,-0.2 0.783 70.3 124.9 53.3 31.8 -37.1 41.0 11.7 14 45 A K - 0 0 59 -6,-0.4 2,-0.9 -5,-0.1 -1,-0.2 -0.986 54.2-151.0-115.7 124.5 -38.4 39.9 15.2 15 46 A K - 0 0 140 -2,-0.5 2,-0.1 -3,-0.1 -9,-0.1 -0.851 24.0-155.7 -91.8 104.8 -41.9 40.9 16.2 16 47 A V - 0 0 13 -2,-0.9 2,-0.5 -11,-0.3 21,-0.2 -0.429 8.9-132.8 -82.5 153.7 -41.6 41.1 20.0 17 48 A R E -A 36 0A 134 19,-1.7 19,-2.4 -2,-0.1 2,-0.4 -0.931 19.9-130.2-105.8 130.2 -44.5 40.7 22.5 18 49 A I E +A 35 0A 48 -2,-0.5 17,-0.2 17,-0.2 3,-0.1 -0.672 32.1 168.2 -82.1 126.8 -44.8 43.4 25.2 19 50 A L E + 0 0 68 15,-2.8 2,-0.3 -2,-0.4 16,-0.2 0.742 59.2 12.5-106.3 -32.5 -45.2 41.8 28.7 20 51 A E E -A 34 0A 32 14,-1.5 14,-2.1 2,-0.0 2,-0.4 -0.994 49.6-168.3-155.4 134.7 -44.7 44.6 31.3 21 52 A I E +A 33 0A 89 -2,-0.3 12,-0.2 12,-0.2 -3,-0.0 -0.996 16.5 169.8-128.3 128.1 -44.4 48.4 31.4 22 53 A K E -A 32 0A 84 10,-2.9 10,-3.5 -2,-0.4 2,-0.1 -0.995 27.9-121.3-135.9 144.6 -43.2 50.3 34.5 23 54 A P E -A 31 0A 83 0, 0.0 2,-0.4 0, 0.0 8,-0.2 -0.396 18.7-132.2 -81.7 159.1 -42.3 53.9 35.1 24 55 A L > - 0 0 16 6,-0.8 3,-1.0 3,-0.5 6,-0.1 -0.953 2.7-152.2-112.0 131.1 -39.0 55.2 36.4 25 56 A K T 3 S+ 0 0 137 -2,-0.4 -1,-0.1 1,-0.2 3,-0.0 0.804 97.2 62.1 -60.5 -26.5 -38.8 57.7 39.2 26 57 A S T 3 S+ 0 0 56 40,-0.1 2,-0.3 1,-0.1 -1,-0.2 0.612 109.4 26.6 -87.8 -14.3 -35.6 58.8 37.6 27 58 A S < - 0 0 37 -3,-1.0 -3,-0.5 3,-0.2 -1,-0.1 -1.000 51.5-154.3-147.2 150.2 -36.9 60.0 34.3 28 59 A Q S S+ 0 0 175 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.0 0.767 99.1 41.0 -92.8 -28.3 -40.0 61.3 32.8 29 60 A D S S+ 0 0 75 20,-0.1 21,-0.4 21,-0.0 2,-0.3 0.805 102.3 78.9 -87.6 -29.0 -39.5 60.2 29.3 30 61 A L - 0 0 47 19,-0.2 -6,-0.8 -6,-0.1 2,-0.3 -0.649 55.3-175.2 -90.9 133.1 -38.1 56.8 29.9 31 62 A K E -AB 23 48A 68 17,-2.8 17,-2.7 -2,-0.3 2,-0.5 -0.875 27.7-117.9-118.4 155.8 -40.1 53.7 30.9 32 63 A M E -AB 22 47A 0 -10,-3.5 -10,-2.9 -2,-0.3 2,-0.4 -0.834 37.3-179.6 -92.0 122.8 -39.1 50.1 31.8 33 64 A V E -AB 21 46A 5 13,-2.8 13,-3.4 -2,-0.5 2,-0.4 -0.989 17.1-160.8-127.3 131.6 -40.4 47.6 29.3 34 65 A V E -AB 20 45A 1 -14,-2.1 -15,-2.8 -2,-0.4 -14,-1.5 -0.948 18.1-176.5-107.0 134.8 -40.0 43.8 29.3 35 66 A I E -AB 18 44A 7 9,-2.5 9,-2.9 -2,-0.4 2,-0.5 -0.826 23.9-125.0-124.6 161.5 -40.6 42.0 26.0 36 67 A E E -AB 17 43A 34 -19,-2.4 -19,-1.7 -2,-0.3 7,-0.2 -0.958 21.6-131.8-108.6 125.7 -40.6 38.4 24.8 37 68 A D > - 0 0 22 5,-2.7 4,-1.9 -2,-0.5 -21,-0.1 -0.624 15.6-142.9 -70.3 125.4 -38.3 37.4 22.0 38 69 A P T 4 S+ 0 0 38 0, 0.0 -1,-0.1 0, 0.0 -22,-0.1 0.708 94.5 42.9 -71.1 -13.8 -40.6 35.4 19.6 39 70 A D T 4 S+ 0 0 112 3,-0.1 -2,-0.0 1,-0.0 -25,-0.0 0.913 128.2 22.3 -91.3 -53.7 -37.8 32.9 18.7 40 71 A T T 4 S- 0 0 49 2,-0.1 3,-0.1 1,-0.0 51,-0.1 0.636 89.8-135.3 -88.3 -17.2 -36.1 32.1 22.0 41 72 A K < + 0 0 88 -4,-1.9 46,-0.1 1,-0.2 2,-0.0 0.477 52.6 153.0 64.2 6.8 -39.1 33.1 24.2 42 73 A Y - 0 0 65 -6,-0.1 -5,-2.7 1,-0.1 2,-0.5 -0.356 47.0-126.2 -61.0 139.5 -36.5 34.8 26.4 43 74 A N E -B 36 0A 28 37,-0.3 -7,-0.2 -7,-0.2 41,-0.1 -0.837 28.0-164.7 -90.0 128.4 -37.8 37.8 28.4 44 75 A I E -B 35 0A 60 -9,-2.9 -9,-2.5 -2,-0.5 2,-0.3 -0.970 9.6-143.2-124.1 120.9 -35.7 40.9 27.7 45 76 A P E +B 34 0A 11 0, 0.0 13,-2.8 0, 0.0 2,-0.3 -0.685 26.5 175.6 -85.3 137.8 -35.8 44.0 29.9 46 77 A L E -BC 33 57A 12 -13,-3.4 -13,-2.8 -2,-0.3 2,-0.5 -0.925 34.0-133.6-135.2 155.3 -35.5 47.4 28.2 47 78 A V E -BC 32 56A 12 9,-3.2 9,-2.8 -2,-0.3 2,-0.4 -0.977 36.7-174.7-106.7 129.3 -35.6 51.2 28.8 48 79 A V E -BC 31 55A 3 -17,-2.7 -17,-2.8 -2,-0.5 7,-0.2 -0.976 22.1-120.4-130.3 136.2 -37.8 52.8 26.2 49 80 A S > - 0 0 8 5,-2.1 3,-1.2 -2,-0.4 -19,-0.2 -0.237 35.8-103.0 -66.3 163.3 -38.7 56.4 25.3 50 81 A K T 3 S+ 0 0 124 -21,-0.4 -1,-0.1 1,-0.3 -20,-0.1 0.864 123.3 46.4 -54.3 -44.8 -42.3 57.7 25.5 51 82 A D T 3 S- 0 0 88 -48,-0.1 -1,-0.3 1,-0.0 -48,-0.0 0.518 111.1-121.7 -80.5 -2.4 -42.7 57.7 21.7 52 83 A G S < S+ 0 0 0 -3,-1.2 -45,-0.2 2,-0.2 -2,-0.1 0.619 81.6 116.2 73.7 14.6 -41.2 54.1 21.5 53 84 A N + 0 0 91 1,-0.1 2,-0.4 -46,-0.1 -3,-0.1 0.517 65.3 53.3 -93.9 -10.9 -38.4 55.4 19.2 54 85 A L + 0 0 95 -5,-0.1 -5,-2.1 2,-0.0 2,-0.4 -0.998 63.8 179.5-129.1 129.4 -35.4 54.7 21.5 55 86 A I E -C 48 0A 47 -2,-0.4 2,-0.4 -7,-0.2 -7,-0.2 -0.990 3.0-179.0-138.1 121.4 -34.8 51.3 23.0 56 87 A I E -C 47 0A 88 -9,-2.8 -9,-3.2 -2,-0.4 2,-0.2 -0.988 28.1-122.8-126.1 127.4 -31.9 50.4 25.3 57 88 A G E -C 46 0A 50 -2,-0.4 -11,-0.3 -11,-0.2 2,-0.2 -0.481 27.2-129.9 -67.6 136.1 -31.4 46.9 26.7 58 89 A L + 0 0 24 -13,-2.8 2,-0.2 -2,-0.2 4,-0.1 -0.588 37.2 155.4 -84.1 150.9 -31.2 46.8 30.5 59 90 A S - 0 0 55 2,-0.2 18,-0.1 -2,-0.2 14,-0.0 -0.819 61.9 -73.4-151.3-172.0 -28.3 45.0 32.3 60 91 A N S S+ 0 0 129 -2,-0.2 2,-1.8 1,-0.1 14,-0.0 0.687 110.3 88.1 -65.0 -23.2 -26.5 45.1 35.6 61 92 A I + 0 0 139 2,-0.0 2,-0.3 0, 0.0 -2,-0.2 -0.647 62.2 123.0 -80.5 85.9 -24.9 48.3 34.5 62 93 A F + 0 0 40 -2,-1.8 2,-0.4 -4,-0.1 12,-0.0 -0.946 32.2 172.5-147.3 123.2 -27.6 50.5 35.8 63 94 A F + 0 0 175 -2,-0.3 2,-0.3 6,-0.0 4,-0.0 -0.992 1.6 165.9-136.7 144.5 -27.3 53.4 38.3 64 95 A S - 0 0 31 -2,-0.4 6,-0.1 1,-0.1 -2,-0.0 -0.989 43.9-131.2-148.8 149.5 -29.6 56.0 39.7 65 96 A N S S+ 0 0 146 -2,-0.3 2,-0.8 1,-0.1 -1,-0.1 0.658 97.6 82.8 -68.3 -15.8 -29.8 58.5 42.5 66 97 A K >> - 0 0 91 1,-0.2 4,-1.6 2,-0.0 3,-0.7 -0.819 67.8-162.6 -94.1 109.7 -33.3 57.0 43.0 67 98 A S H 3> S+ 0 0 93 -2,-0.8 4,-2.0 1,-0.2 -1,-0.2 0.764 87.3 62.7 -59.2 -30.4 -32.9 53.8 45.0 68 99 A D H 3> S+ 0 0 86 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.866 104.0 47.7 -63.6 -38.3 -36.4 52.6 43.9 69 100 A D H <> S+ 0 0 4 -3,-0.7 4,-2.8 2,-0.2 5,-0.2 0.925 110.1 51.1 -69.3 -45.5 -35.3 52.5 40.2 70 101 A V H X S+ 0 0 59 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.883 114.8 45.8 -53.3 -42.8 -32.1 50.5 41.1 71 102 A Q H X S+ 0 0 99 -4,-2.0 4,-2.9 2,-0.2 5,-0.3 0.920 110.3 51.3 -68.7 -49.6 -34.4 48.2 43.0 72 103 A L H X S+ 0 0 28 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.933 113.4 46.0 -51.7 -50.3 -37.0 47.9 40.2 73 104 A V H X S+ 0 0 4 -4,-2.8 4,-3.4 2,-0.2 5,-0.2 0.895 112.1 51.3 -61.3 -43.5 -34.2 47.1 37.7 74 105 A A H X S+ 0 0 38 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.922 112.7 44.9 -60.2 -48.8 -32.6 44.5 40.1 75 106 A E H X S+ 0 0 106 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.872 115.8 48.3 -59.6 -42.8 -35.9 42.7 40.7 76 107 A T H X S+ 0 0 2 -4,-2.4 4,-2.6 -5,-0.3 5,-0.3 0.975 111.6 47.6 -66.0 -56.1 -36.6 42.8 37.0 77 108 A N H X S+ 0 0 10 -4,-3.4 4,-2.4 1,-0.2 -2,-0.2 0.914 115.1 46.6 -48.5 -50.0 -33.2 41.5 35.9 78 109 A Q H X S+ 0 0 130 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.879 111.7 50.7 -64.8 -40.1 -33.4 38.7 38.5 79 110 A K H X S+ 0 0 94 -4,-2.3 4,-2.2 2,-0.2 3,-0.2 0.956 113.9 43.6 -62.0 -51.6 -37.0 37.7 37.5 80 111 A V H X S+ 0 0 5 -4,-2.6 4,-3.0 1,-0.2 -37,-0.3 0.869 110.6 55.7 -63.7 -37.4 -36.1 37.5 33.8 81 112 A Q H X S+ 0 0 117 -4,-2.4 4,-1.7 -5,-0.3 -1,-0.2 0.858 109.7 46.8 -63.5 -33.8 -32.9 35.6 34.5 82 113 A A H X S+ 0 0 61 -4,-1.5 4,-1.7 -3,-0.2 -2,-0.2 0.909 114.8 45.7 -72.7 -44.3 -34.8 33.0 36.4 83 114 A L H X S+ 0 0 86 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.895 114.9 47.6 -61.6 -42.9 -37.5 32.7 33.7 84 115 A N H X S+ 0 0 31 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.843 107.4 55.6 -71.8 -36.6 -34.8 32.5 30.9 85 116 A A H X S+ 0 0 54 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.912 111.7 44.7 -58.5 -44.1 -32.7 29.9 32.7 86 117 A T H X S+ 0 0 91 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.891 112.6 51.0 -64.9 -43.9 -35.9 27.7 32.9 87 118 A Q H X S+ 0 0 68 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.925 111.1 48.3 -60.4 -45.5 -36.7 28.4 29.2 88 119 A Q H X S+ 0 0 86 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.869 110.4 52.2 -63.2 -38.9 -33.2 27.5 28.2 89 120 A N H X S+ 0 0 70 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.924 109.4 48.6 -65.4 -43.7 -33.4 24.3 30.2 90 121 A S H X S+ 0 0 39 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.929 111.8 49.4 -59.5 -45.6 -36.7 23.2 28.6 91 122 A A H X S+ 0 0 49 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.857 109.5 51.7 -64.8 -36.5 -35.2 23.9 25.1 92 123 A K H X S+ 0 0 97 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.900 111.1 48.6 -64.0 -39.7 -32.1 21.8 26.0 93 124 A L H X S+ 0 0 8 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.947 109.4 50.8 -64.1 -53.5 -34.4 19.0 27.1 94 125 A N H X S+ 0 0 47 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.873 111.2 50.0 -47.5 -44.2 -36.5 19.1 23.9 95 126 A A H X S+ 0 0 54 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.883 108.1 52.6 -66.6 -40.3 -33.3 19.0 21.9 96 127 A I H >< S+ 0 0 12 -4,-2.1 3,-0.6 1,-0.2 4,-0.5 0.964 113.8 43.0 -56.1 -51.8 -32.0 16.0 23.9 97 128 A F H 3< S+ 0 0 6 -4,-2.6 3,-0.4 1,-0.2 -2,-0.2 0.766 112.1 53.1 -68.8 -27.7 -35.3 14.1 23.2 98 129 A N H 3< S+ 0 0 104 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.680 104.8 57.1 -76.7 -21.6 -35.4 15.1 19.5 99 130 A E S << S+ 0 0 105 -4,-1.3 -1,-0.2 -3,-0.6 -2,-0.2 0.558 81.3 103.8 -87.2 -10.7 -31.8 13.9 19.0 100 131 A I S S- 0 0 19 -4,-0.5 5,-0.1 -3,-0.4 4,-0.0 -0.553 90.8 -92.2 -71.3 132.9 -32.7 10.3 20.2 101 132 A P >> - 0 0 47 0, 0.0 3,-1.7 0, 0.0 4,-0.7 -0.122 36.8-118.7 -48.4 143.4 -32.9 7.8 17.2 102 133 A A T 34 S+ 0 0 109 1,-0.3 -2,-0.1 2,-0.2 3,-0.0 0.724 111.5 43.9 -62.3 -27.9 -36.6 7.6 16.1 103 134 A D T 34 S+ 0 0 75 1,-0.1 -1,-0.3 3,-0.1 -3,-0.0 0.475 96.2 82.4 -91.1 -4.0 -37.0 3.9 16.8 104 135 A Y T <4 S+ 0 0 1 -3,-1.7 47,-0.3 2,-0.1 -2,-0.2 0.944 74.9 71.6 -72.5 -49.4 -35.2 4.1 20.2 105 136 A A S < S- 0 0 18 -4,-0.7 2,-0.8 45,-0.1 45,-0.2 -0.367 78.6-131.5 -69.2 147.2 -38.0 5.3 22.5 106 137 A I E -D 149 0B 2 43,-2.6 43,-2.4 -2,-0.0 2,-0.6 -0.892 24.2-158.0-100.6 106.0 -40.8 2.9 23.3 107 138 A E E -D 148 0B 93 -2,-0.8 41,-0.2 41,-0.2 39,-0.0 -0.763 11.2-175.2 -92.6 119.5 -44.0 4.8 22.7 108 139 A L E -D 147 0B 0 39,-3.1 39,-1.9 -2,-0.6 3,-0.1 -0.945 21.4-135.7-114.9 109.9 -47.1 3.5 24.5 109 140 A P - 0 0 65 0, 0.0 37,-0.2 0, 0.0 7,-0.1 -0.339 34.7 -92.7 -64.4 142.9 -50.4 5.3 23.7 110 141 A S - 0 0 12 2,-0.2 33,-0.2 1,-0.1 36,-0.1 -0.165 22.8-126.8 -53.2 146.0 -52.6 6.2 26.6 111 142 A T S S+ 0 0 96 34,-0.2 2,-0.6 28,-0.2 32,-0.2 0.722 103.8 65.8 -64.2 -21.4 -55.4 3.8 27.5 112 143 A N S > S- 0 0 91 30,-0.7 3,-1.9 33,-0.1 4,-0.3 -0.922 77.5-152.6-106.9 114.0 -57.6 6.8 27.2 113 144 A A G > S+ 0 0 78 -2,-0.6 3,-0.9 1,-0.3 4,-0.2 0.714 92.2 66.8 -58.6 -26.2 -57.8 8.1 23.6 114 145 A A G 3 S+ 0 0 83 1,-0.2 3,-0.3 2,-0.1 -1,-0.3 0.806 103.9 45.1 -60.7 -31.3 -58.6 11.6 24.8 115 146 A N G X S+ 0 0 15 -3,-1.9 3,-2.2 1,-0.2 31,-0.4 0.343 75.9 110.0-100.4 2.8 -55.1 11.8 26.3 116 147 A K T < S+ 0 0 118 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.1 0.718 76.6 55.9 -54.5 -25.3 -53.0 10.4 23.4 117 148 A D T 3 S+ 0 0 126 -3,-0.3 2,-0.9 -4,-0.2 -1,-0.3 0.544 81.7 96.7 -87.2 -7.7 -51.5 13.8 22.7 118 149 A K < - 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0 0 13 -3,-1.3 4,-2.2 1,-0.2 3,-0.3 -0.922 60.9-154.2-114.5 118.3 -32.1 0.7 38.8 129 160 A P H > S+ 0 0 88 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.871 99.1 53.9 -57.2 -37.0 -34.5 -0.2 41.7 130 161 A H H > S+ 0 0 116 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.874 109.5 48.1 -65.1 -33.8 -36.0 3.3 41.5 131 162 A C H > S+ 0 0 0 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.854 108.4 54.8 -71.3 -34.3 -36.7 2.8 37.8 132 163 A Q H X S+ 0 0 50 -4,-2.2 4,-1.0 2,-0.2 -2,-0.2 0.906 110.3 46.2 -61.9 -42.3 -38.2 -0.6 38.7 133 164 A K H >X S+ 0 0 108 -4,-2.3 3,-0.7 2,-0.2 4,-0.6 0.929 111.8 50.6 -63.7 -48.6 -40.5 1.1 41.1 134 165 A E H >< S+ 0 0 21 -4,-2.5 3,-1.6 1,-0.2 4,-0.2 0.901 103.3 61.3 -54.8 -41.1 -41.3 3.8 38.5 135 166 A L H >< S+ 0 0 13 -4,-2.6 3,-1.6 1,-0.3 4,-0.3 0.844 94.7 61.5 -57.0 -33.4 -42.1 0.9 36.0 136 167 A T H << S+ 0 0 103 -4,-1.0 3,-0.3 -3,-0.7 -1,-0.3 0.745 101.3 54.7 -64.8 -21.2 -44.9 -0.3 38.3 137 168 A K T S+ 0 0 4 -3,-1.6 4,-1.5 1,-0.2 -1,-0.2 0.902 79.5 50.5 -60.2 -48.8 -46.6 2.8 34.0 139 170 A R H > S+ 0 0 87 -4,-0.3 4,-1.0 -3,-0.3 -1,-0.2 0.808 112.8 49.0 -58.8 -32.0 -50.2 1.5 33.5 140 171 A D H > S+ 0 0 101 -3,-0.4 4,-0.7 -4,-0.2 3,-0.2 0.889 107.4 53.6 -73.2 -41.5 -51.4 4.4 35.7 141 172 A H H >X S+ 0 0 40 -4,-2.4 4,-2.3 1,-0.2 3,-0.6 0.794 102.3 61.4 -57.2 -31.7 -49.4 7.0 33.7 142 173 A L H 3< S+ 0 0 1 -4,-1.5 -30,-0.7 1,-0.2 -1,-0.2 0.897 91.9 63.2 -69.2 -40.4 -51.1 5.6 30.6 143 174 A K H 3< S+ 0 0 112 -4,-1.0 -1,-0.2 -3,-0.2 -2,-0.2 0.835 120.1 26.3 -45.9 -34.9 -54.5 6.6 31.8 144 175 A E H << S+ 0 0 117 -4,-0.7 2,-0.3 -3,-0.6 -2,-0.2 0.652 127.0 17.2-108.4 -21.8 -53.2 10.2 31.7 145 176 A N < - 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