==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 19-JAN-09 2W8P . COMPND 2 MOLECULE: SUCCINIC SEMIALDEHYDE DEHYDROGENASE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.-G.KIM,K.-J.KIM . 485 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20294.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 350 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 1 0.2 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 . 34 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 159 32.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 0 1 0 2 4 0 1 0 1 2 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 3 4 1 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 . 3 1 3 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 2 0 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 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 51 A L 0 0 173 0, 0.0 2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -48.7 23.1 -27.8 -49.6 2 52 A A + 0 0 66 1,-0.1 3,-0.1 2,-0.0 88,-0.0 -0.238 360.0 95.1-123.0-148.5 22.5 -28.5 -45.9 3 53 A G + 0 0 83 1,-0.2 2,-0.1 -2,-0.1 -1,-0.1 0.656 67.5 144.3 66.2 13.1 19.6 -28.1 -43.4 4 54 A L - 0 0 31 1,-0.1 2,-0.5 -3,-0.1 -1,-0.2 -0.411 67.4 -82.6 -81.5 157.3 19.0 -31.8 -44.3 5 55 A S >> - 0 0 49 1,-0.2 3,-2.5 -2,-0.1 4,-1.3 -0.492 38.3-141.2 -63.5 112.1 17.8 -34.4 -41.8 6 56 A A T 34 S+ 0 0 90 -2,-0.5 -1,-0.2 1,-0.3 -2,-0.1 0.777 101.0 59.3 -45.3 -32.5 21.0 -35.4 -40.1 7 57 A A T 34 S+ 0 0 33 1,-0.2 -1,-0.3 3,-0.1 185,-0.1 0.785 102.7 52.1 -70.0 -28.9 19.8 -38.9 -40.1 8 58 A L T <4 S+ 0 0 2 -3,-2.5 2,-0.8 1,-0.1 -2,-0.2 0.842 96.6 68.7 -77.7 -37.1 19.5 -39.0 -43.9 9 59 A L S < S+ 0 0 75 -4,-1.3 2,-0.3 180,-0.1 -1,-0.1 -0.769 74.3 176.2 -87.8 110.8 23.1 -37.8 -44.7 10 60 A R - 0 0 62 -2,-0.8 178,-0.1 175,-0.2 179,-0.1 -0.861 31.8-178.4-121.1 153.7 25.3 -40.7 -43.6 11 61 A T + 0 0 58 -2,-0.3 30,-2.9 2,-0.1 2,-0.2 0.547 61.7 79.0-122.3 -15.5 29.0 -41.5 -43.7 12 62 A D S S- 0 0 50 28,-0.2 2,-0.0 1,-0.1 -2,-0.0 -0.568 82.7-104.7 -94.8 160.6 29.4 -45.0 -42.2 13 63 A S E -A 20 0A 2 7,-2.0 7,-2.1 -2,-0.2 2,-0.5 -0.356 31.0-130.6 -74.6 165.1 28.7 -48.3 -43.9 14 64 A F E +AB 19 206A 11 192,-2.4 192,-2.6 5,-0.2 2,-0.4 -0.950 38.8 155.8-123.5 109.4 25.4 -50.1 -42.9 15 65 A V E > -A 18 0A 13 3,-2.7 3,-2.1 -2,-0.5 190,-0.1 -0.999 64.0 -3.7-138.2 137.4 25.8 -53.7 -41.9 16 66 A G T 3 S- 0 0 26 -2,-0.4 185,-0.2 1,-0.3 -1,-0.1 0.822 128.1 -56.5 54.0 36.1 23.7 -56.0 -39.7 17 67 A G T 3 S+ 0 0 29 187,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.562 118.9 104.3 75.1 7.6 21.4 -53.1 -38.8 18 68 A R E < S-A 15 0A 180 -3,-2.1 -3,-2.7 2,-0.0 2,-0.7 -0.926 72.9-122.1-126.5 149.6 24.4 -51.0 -37.5 19 69 A W E -A 14 0A 56 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.0 -0.779 36.6-177.2 -87.3 116.5 26.4 -48.1 -38.7 20 70 A L E -A 13 0A 80 -7,-2.1 -7,-2.0 -2,-0.7 2,-0.1 -0.961 16.3-146.6-122.5 123.3 30.0 -49.2 -38.9 21 71 A P - 0 0 89 0, 0.0 2,-0.2 0, 0.0 -9,-0.1 -0.391 19.8-133.1 -78.9 163.7 33.0 -46.9 -39.9 22 72 A A - 0 0 18 2,-0.4 21,-0.1 1,-0.1 0, 0.0 -0.705 24.0-106.2-113.4 168.6 35.9 -48.4 -41.7 23 73 A A S S+ 0 0 109 -2,-0.2 2,-0.2 19,-0.2 20,-0.1 0.905 106.9 34.5 -58.8 -38.7 39.7 -48.1 -41.2 24 74 A A E -H 42 0B 46 18,-0.6 18,-2.4 -3,-0.0 -2,-0.4 -0.609 68.2-165.6-112.3 171.3 39.8 -45.9 -44.3 25 75 A T E -H 41 0B 73 16,-0.3 16,-0.2 -2,-0.2 14,-0.1 -0.907 7.9-146.5-146.1 170.0 37.5 -43.3 -45.8 26 76 A F E -H 40 0B 11 14,-1.7 14,-2.8 -2,-0.3 2,-0.2 -0.991 23.0-111.2-143.3 147.0 37.2 -41.5 -49.1 27 77 A P E -H 39 0B 72 0, 0.0 2,-0.4 0, 0.0 12,-0.2 -0.505 20.3-159.8 -80.7 147.2 36.0 -37.9 -50.0 28 78 A V E -H 38 0B 6 10,-1.5 9,-3.6 -2,-0.2 10,-1.1 -0.995 14.3-171.0-128.0 123.2 32.8 -37.1 -51.9 29 79 A Q E -H 36 0B 107 -2,-0.4 7,-0.2 7,-0.2 6,-0.1 -0.893 33.7-101.9-120.8 148.2 32.5 -33.8 -53.6 30 80 A D > - 0 0 12 5,-2.4 4,-2.8 -2,-0.3 65,-0.2 -0.493 31.4-143.5 -62.7 114.3 29.7 -31.9 -55.4 31 81 A P T 4 S+ 0 0 10 0, 0.0 337,-0.4 0, 0.0 -1,-0.2 0.710 96.0 43.7 -56.1 -20.9 30.5 -32.4 -59.1 32 82 A A T 4 S+ 0 0 7 62,-0.2 336,-0.2 300,-0.1 337,-0.1 0.921 128.7 20.2 -89.5 -54.1 29.4 -28.8 -59.9 33 83 A S T 4 S- 0 0 51 2,-0.1 3,-0.1 334,-0.1 334,-0.0 0.736 91.0-129.7 -89.5 -28.0 30.9 -26.7 -57.1 34 84 A G < + 0 0 38 -4,-2.8 3,-0.1 1,-0.3 333,-0.0 0.383 52.3 156.2 91.3 -3.9 33.7 -29.0 -55.9 35 85 A A - 0 0 46 -5,-0.2 -5,-2.4 -6,-0.1 2,-0.3 -0.260 51.2-108.0 -59.1 137.2 32.5 -28.6 -52.3 36 86 A A E -H 29 0B 88 -7,-0.2 -7,-0.2 1,-0.2 -1,-0.1 -0.514 33.8-176.7 -68.1 125.1 33.5 -31.4 -49.9 37 87 A L E - 0 0 52 -9,-3.6 2,-0.3 1,-0.3 -8,-0.2 0.780 53.0 -66.3 -93.9 -31.7 30.3 -33.3 -49.1 38 88 A G E -H 28 0B 21 -10,-1.1 -10,-1.5 2,-0.0 2,-0.6 -0.902 42.9 -83.2 161.3 169.5 31.8 -35.7 -46.6 39 89 A M E -H 27 0B 95 -2,-0.3 2,-0.4 -12,-0.2 3,-0.0 -0.905 44.0-161.4-102.3 122.3 34.2 -38.6 -45.7 40 90 A V E -H 26 0B 0 -14,-2.8 -14,-1.7 -2,-0.6 -28,-0.2 -0.854 28.0 -96.5-109.6 141.5 32.6 -42.0 -46.4 41 91 A A E -H 25 0B 2 -30,-2.9 2,-0.9 -2,-0.4 -16,-0.3 -0.222 30.0-147.0 -52.7 133.1 33.7 -45.3 -45.0 42 92 A D E -H 24 0B 11 -18,-2.4 -18,-0.6 167,-0.1 167,-0.3 -0.829 19.0-153.9-106.8 90.7 35.9 -47.2 -47.5 43 93 A C - 0 0 0 165,-3.2 174,-0.2 -2,-0.9 2,-0.2 -0.386 8.8-160.9 -68.9 140.5 35.0 -50.8 -46.9 44 94 A G > - 0 0 14 -2,-0.1 4,-1.7 172,-0.1 3,-0.3 -0.503 43.0 -78.4-110.2-177.7 37.6 -53.4 -47.6 45 95 A V H > S+ 0 0 41 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.831 128.8 56.9 -51.0 -37.0 37.4 -57.2 -48.3 46 96 A R H > S+ 0 0 180 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.953 107.4 45.5 -61.1 -51.3 37.1 -57.8 -44.5 47 97 A E H > S+ 0 0 57 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.776 111.8 55.1 -63.3 -27.0 34.0 -55.5 -44.1 48 98 A A H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.930 106.3 47.7 -73.4 -46.5 32.5 -57.1 -47.2 49 99 A R H X S+ 0 0 106 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.920 112.4 51.5 -60.6 -41.9 32.7 -60.7 -45.9 50 100 A A H X S+ 0 0 35 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.902 109.3 49.9 -61.3 -40.7 31.2 -59.5 -42.7 51 101 A A H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.913 109.5 51.9 -64.6 -41.9 28.4 -57.9 -44.5 52 102 A V H X S+ 0 0 0 -4,-2.6 4,-3.2 2,-0.2 -2,-0.2 0.948 109.3 48.7 -59.5 -49.8 27.8 -61.0 -46.5 53 103 A R H X S+ 0 0 124 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.918 109.8 53.1 -56.6 -42.6 27.6 -63.1 -43.3 54 104 A A H X S+ 0 0 24 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.928 112.6 44.7 -57.6 -44.5 25.2 -60.5 -41.9 55 105 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.901 112.4 51.1 -66.6 -43.9 23.0 -60.9 -45.0 56 106 A Y H X S+ 0 0 100 -4,-3.2 4,-1.5 1,-0.2 -2,-0.2 0.945 112.5 44.9 -60.1 -50.1 23.2 -64.7 -45.0 57 107 A E H X S+ 0 0 117 -4,-2.9 4,-0.6 1,-0.2 -1,-0.2 0.861 113.2 51.3 -63.7 -34.3 22.2 -65.0 -41.4 58 108 A A H >X S+ 0 0 8 -4,-1.8 4,-3.3 -5,-0.3 3,-0.6 0.829 104.5 60.3 -70.3 -31.1 19.4 -62.5 -41.9 59 109 A F H 3X S+ 0 0 12 -4,-2.0 4,-2.7 1,-0.2 5,-0.3 0.905 95.2 58.6 -63.1 -45.0 18.2 -64.6 -44.9 60 110 A C H 3< S+ 0 0 51 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.757 118.5 33.8 -58.8 -23.1 17.5 -67.7 -42.9 61 111 A R H XX S+ 0 0 180 -3,-0.6 3,-1.0 -4,-0.6 4,-0.5 0.843 116.2 53.1 -97.1 -44.9 15.1 -65.6 -40.9 62 112 A W H >< S+ 0 0 4 -4,-3.3 3,-1.5 1,-0.3 -3,-0.2 0.879 102.8 57.5 -59.0 -42.8 13.8 -63.2 -43.6 63 113 A R T 3< S+ 0 0 117 -4,-2.7 -1,-0.3 1,-0.3 -3,-0.1 0.749 103.4 57.9 -60.5 -23.6 12.8 -66.0 -46.0 64 114 A E T <4 S+ 0 0 142 -3,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.661 84.0 100.4 -81.6 -19.8 10.6 -67.3 -43.1 65 115 A V S << S- 0 0 42 -3,-1.5 5,-0.1 -4,-0.5 -3,-0.0 -0.465 85.2-100.5 -71.5 139.3 8.6 -64.1 -42.9 66 116 A S >> - 0 0 74 -2,-0.2 4,-2.5 1,-0.1 3,-0.5 -0.199 23.3-123.4 -58.0 148.2 5.2 -64.1 -44.5 67 117 A A H 3> S+ 0 0 29 1,-0.3 4,-2.4 2,-0.2 5,-0.1 0.827 113.6 57.9 -63.5 -30.7 4.9 -62.4 -47.9 68 118 A K H 3> S+ 0 0 125 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.842 109.5 45.2 -68.8 -29.9 2.2 -60.2 -46.5 69 119 A E H <> S+ 0 0 79 -3,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.904 112.3 48.0 -78.5 -44.9 4.7 -59.0 -43.9 70 120 A R H X S+ 0 0 22 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.919 112.7 52.5 -61.0 -39.6 7.6 -58.5 -46.2 71 121 A S H X S+ 0 0 14 -4,-2.4 4,-1.6 -5,-0.2 -1,-0.2 0.907 107.2 51.5 -60.3 -43.8 5.1 -56.6 -48.4 72 122 A S H X S+ 0 0 43 -4,-1.5 4,-1.9 1,-0.2 -1,-0.2 0.884 110.5 47.6 -61.8 -41.9 4.1 -54.4 -45.5 73 123 A L H X S+ 0 0 9 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.874 107.5 55.7 -68.9 -38.2 7.7 -53.5 -44.7 74 124 A L H X S+ 0 0 0 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.874 110.4 47.1 -63.4 -33.4 8.5 -52.7 -48.3 75 125 A R H X S+ 0 0 78 -4,-1.6 4,-3.0 2,-0.2 -2,-0.2 0.869 107.3 53.2 -76.7 -37.0 5.6 -50.2 -48.3 76 126 A K H X S+ 0 0 101 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.909 110.0 51.4 -62.0 -37.6 6.5 -48.5 -45.0 77 127 A W H X S+ 0 0 2 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.884 109.1 50.1 -64.0 -39.7 9.9 -48.1 -46.6 78 128 A Y H X S+ 0 0 32 -4,-1.4 4,-2.2 2,-0.2 3,-0.3 0.937 109.4 50.2 -64.3 -47.4 8.2 -46.6 -49.7 79 129 A N H X S+ 0 0 66 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.885 107.8 54.1 -59.1 -40.1 6.1 -44.2 -47.5 80 130 A L H X S+ 0 0 18 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.837 106.5 52.2 -64.2 -33.0 9.3 -43.1 -45.8 81 131 A M H < S+ 0 0 0 -4,-1.4 3,-0.3 -3,-0.3 -2,-0.2 0.941 112.1 44.8 -68.5 -45.4 10.9 -42.3 -49.1 82 132 A I H >< S+ 0 0 48 -4,-2.2 3,-1.4 1,-0.2 4,-0.3 0.910 110.1 55.1 -63.9 -41.6 7.9 -40.1 -50.1 83 133 A Q H 3< S+ 0 0 143 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.800 119.0 34.4 -60.3 -31.1 7.8 -38.4 -46.7 84 134 A N T 3X S+ 0 0 26 -4,-1.3 4,-2.2 -3,-0.3 3,-0.4 0.146 81.9 122.5-109.9 17.9 11.5 -37.5 -47.1 85 135 A K H <> + 0 0 74 -3,-1.4 4,-2.4 1,-0.2 5,-0.2 0.833 69.4 54.6 -51.7 -42.7 11.5 -36.9 -50.9 86 136 A D H > S+ 0 0 86 -4,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.930 114.7 39.3 -60.0 -46.1 12.7 -33.3 -50.9 87 137 A D H > S+ 0 0 41 -3,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.813 114.4 54.1 -73.0 -30.9 15.8 -34.1 -48.8 88 138 A L H X S+ 0 0 7 -4,-2.2 4,-1.3 -7,-0.2 -2,-0.2 0.873 108.4 50.7 -69.6 -35.0 16.4 -37.3 -50.7 89 139 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.887 106.8 53.7 -68.6 -40.8 16.3 -35.3 -54.0 90 140 A R H X S+ 0 0 84 -4,-1.7 4,-3.0 1,-0.2 -1,-0.2 0.889 104.3 55.4 -61.8 -39.3 18.8 -32.8 -52.7 91 141 A I H X S+ 0 0 8 -4,-1.7 4,-1.6 2,-0.2 5,-0.2 0.891 108.8 48.7 -61.2 -38.7 21.3 -35.6 -51.8 92 142 A I H X>S+ 0 0 0 -4,-1.3 4,-3.3 2,-0.2 5,-0.8 0.944 113.5 44.9 -66.6 -47.6 21.0 -36.8 -55.4 93 143 A T H X5S+ 0 0 2 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.905 111.6 55.1 -62.5 -40.3 21.6 -33.4 -56.9 94 144 A A H <5S+ 0 0 13 -4,-3.0 -1,-0.2 -5,-0.2 -62,-0.2 0.830 122.1 25.4 -64.0 -33.5 24.5 -32.8 -54.4 95 145 A E H <5S+ 0 0 1 -4,-1.6 -2,-0.2 -3,-0.2 -1,-0.2 0.774 131.0 35.3-104.0 -30.3 26.4 -35.9 -55.5 96 146 A S H <5S- 0 0 1 -4,-3.3 -3,-0.2 -5,-0.2 -2,-0.1 0.724 93.1-137.0 -93.3 -25.7 25.3 -36.7 -59.0 97 147 A G << + 0 0 2 -4,-1.2 226,-0.4 -5,-0.8 -4,-0.2 0.402 52.1 144.0 85.4 -3.7 25.0 -33.0 -60.0 98 148 A K - 0 0 3 -6,-0.4 -1,-0.3 233,-0.1 -2,-0.1 -0.377 62.2 -84.9 -69.7 148.1 21.8 -33.6 -61.9 99 149 A P >> - 0 0 4 0, 0.0 4,-2.5 0, 0.0 3,-0.6 -0.190 35.9-116.7 -53.6 139.5 19.2 -30.7 -61.7 100 150 A L H 3> S+ 0 0 35 223,-2.1 4,-3.0 1,-0.3 5,-0.3 0.861 115.2 57.3 -44.5 -46.3 16.9 -30.8 -58.7 101 151 A K H 3> S+ 0 0 185 222,-0.3 4,-1.6 1,-0.2 -1,-0.3 0.942 110.3 43.9 -53.9 -48.6 13.8 -31.3 -60.9 102 152 A E H <> S+ 0 0 45 -3,-0.6 4,-1.9 1,-0.2 -1,-0.2 0.900 111.7 53.2 -63.4 -41.2 15.4 -34.4 -62.4 103 153 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.887 106.9 52.4 -61.4 -39.0 16.5 -35.6 -58.9 104 154 A H H X S+ 0 0 63 -4,-3.0 4,-1.5 -5,-0.2 -1,-0.2 0.861 108.4 52.2 -63.5 -35.2 12.9 -35.2 -57.7 105 155 A G H X S+ 0 0 43 -4,-1.6 4,-1.9 -5,-0.3 -1,-0.2 0.846 108.7 50.2 -70.1 -33.8 11.9 -37.3 -60.6 106 156 A E H X S+ 0 0 7 -4,-1.9 4,-4.2 2,-0.2 5,-0.3 0.948 106.1 53.9 -70.5 -46.7 14.4 -40.0 -59.6 107 157 A I H X S+ 0 0 2 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.883 110.9 46.4 -55.6 -40.0 13.3 -40.2 -56.0 108 158 A L H X S+ 0 0 69 -4,-1.5 4,-3.1 2,-0.2 -1,-0.2 0.957 115.2 46.6 -65.0 -48.9 9.6 -40.8 -57.0 109 159 A Y H X S+ 0 0 32 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.946 113.8 48.4 -55.6 -51.5 10.8 -43.4 -59.5 110 160 A S H >X S+ 0 0 0 -4,-4.2 4,-1.1 1,-0.2 3,-0.8 0.930 112.9 47.7 -55.6 -48.5 13.0 -44.9 -56.9 111 161 A A H 3X S+ 0 0 0 -4,-2.9 4,-2.2 -5,-0.3 3,-0.4 0.902 105.4 60.2 -61.4 -40.0 10.2 -44.9 -54.4 112 162 A F H 3X S+ 0 0 74 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.747 98.3 57.9 -62.1 -24.0 7.8 -46.4 -57.0 113 163 A F H < S+ 0 0 27 -4,-1.2 3,-2.2 1,-0.2 -2,-0.2 0.805 89.6 75.6 -70.6 -30.9 4.7 -58.3 -56.1 121 171 A A G >< S+ 0 0 2 -4,-2.2 3,-0.6 1,-0.3 -1,-0.2 0.829 96.2 45.8 -52.4 -39.6 5.7 -60.1 -52.9 122 172 A R G 3 S+ 0 0 125 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.1 0.425 105.5 66.2 -86.2 3.6 2.3 -61.6 -52.2 123 173 A R G < + 0 0 132 -3,-2.2 2,-1.0 -4,-0.1 -1,-0.2 0.017 56.6 126.2-116.5 30.8 2.0 -62.7 -55.8 124 174 A V < - 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