==== 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 2W8Q . COMPND 2 MOLECULE: SUCCINATE-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) . 20240.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 354 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 51 10.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 7.8 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 . 36 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 158 32.6 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 1 2 3 0 1 0 1 2 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 3 2 3 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 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 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 0 175 0, 0.0 3,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -64.4 23.4 -27.7 -49.3 2 52 A A + 0 0 74 1,-0.1 3,-0.1 2,-0.0 88,-0.0 -0.295 360.0 97.7-114.8-160.0 22.5 -28.5 -45.6 3 53 A G + 0 0 78 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 0.349 61.7 141.1 91.8 -5.3 19.3 -28.3 -43.5 4 54 A L S S- 0 0 24 1,-0.1 2,-0.9 -3,-0.1 -1,-0.3 -0.258 71.8 -87.4 -68.1 155.4 18.8 -32.0 -44.1 5 55 A S >> - 0 0 44 1,-0.2 3,-4.0 -3,-0.1 4,-0.8 -0.547 42.2-134.8 -65.4 105.4 17.5 -34.3 -41.5 6 56 A A T 34 S+ 0 0 88 -2,-0.9 -1,-0.2 1,-0.3 -2,-0.1 0.712 102.9 62.9 -34.6 -31.7 20.9 -35.2 -40.0 7 57 A A T 34 S+ 0 0 30 1,-0.2 -1,-0.3 3,-0.1 185,-0.1 0.754 97.6 55.6 -70.8 -26.0 19.8 -38.8 -40.0 8 58 A L T <4 S+ 0 0 3 -3,-4.0 2,-0.8 1,-0.1 -1,-0.2 0.838 95.8 68.6 -76.0 -35.9 19.5 -38.9 -43.8 9 59 A L S < S+ 0 0 70 -4,-0.8 2,-0.3 180,-0.1 -1,-0.1 -0.778 74.1 176.9 -88.4 112.5 23.0 -37.8 -44.6 10 60 A R - 0 0 61 -2,-0.8 178,-0.2 175,-0.2 179,-0.1 -0.901 31.4-179.5-124.0 150.9 25.3 -40.6 -43.5 11 61 A T + 0 0 56 -2,-0.3 30,-2.8 29,-0.1 2,-0.2 0.565 62.3 79.1-118.6 -16.5 29.0 -41.4 -43.6 12 62 A D S S- 0 0 50 28,-0.2 2,-0.1 1,-0.1 -2,-0.0 -0.554 83.3-103.9 -93.5 160.7 29.3 -44.8 -42.1 13 63 A S E -A 20 0A 2 7,-1.9 7,-1.9 -2,-0.2 2,-0.6 -0.396 30.3-131.3 -75.6 160.7 28.6 -48.2 -43.8 14 64 A F E +AB 19 206A 10 192,-2.2 192,-2.4 5,-0.2 2,-0.4 -0.906 40.0 154.9-120.6 102.2 25.4 -49.9 -42.8 15 65 A V E > -A 18 0A 12 3,-2.2 3,-2.1 -2,-0.6 190,-0.1 -0.987 63.6 -3.5-131.7 138.3 25.9 -53.6 -41.8 16 66 A G T 3 S- 0 0 28 -2,-0.4 185,-0.2 1,-0.3 -1,-0.1 0.757 127.0 -57.4 55.7 29.4 23.8 -55.8 -39.6 17 67 A G T 3 S+ 0 0 26 187,-0.3 2,-0.3 1,-0.3 -1,-0.3 0.434 118.9 99.8 83.7 -1.3 21.4 -53.0 -38.7 18 68 A R E < S-A 15 0A 179 -3,-2.1 -3,-2.2 2,-0.0 2,-0.8 -0.870 76.0-118.4-121.6 153.7 24.3 -50.9 -37.3 19 69 A W E -A 14 0A 56 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.0 -0.791 37.7-177.7 -89.4 109.1 26.3 -48.0 -38.6 20 70 A L E -A 13 0A 81 -7,-1.9 -7,-1.9 -2,-0.8 2,-0.1 -0.931 16.1-145.6-113.5 123.9 29.9 -49.1 -38.7 21 71 A P - 0 0 88 0, 0.0 2,-0.2 0, 0.0 -9,-0.1 -0.379 20.2-129.3 -78.3 165.2 32.8 -46.8 -39.8 22 72 A A - 0 0 17 2,-0.4 21,-0.1 -2,-0.1 0, 0.0 -0.702 22.9-106.2-112.2 167.3 35.8 -48.3 -41.7 23 73 A A S S+ 0 0 110 -2,-0.2 2,-0.2 19,-0.1 20,-0.1 0.836 106.6 31.7 -59.8 -31.4 39.5 -48.1 -41.1 24 74 A A - 0 0 46 18,-0.5 18,-2.7 2,-0.0 -2,-0.4 -0.742 69.1-159.1-122.1 169.7 39.7 -45.7 -44.1 25 75 A T E -H 41 0B 74 16,-0.3 16,-0.2 -2,-0.2 14,-0.1 -0.920 6.2-147.4-142.0 165.0 37.4 -43.1 -45.7 26 76 A F E -H 40 0B 10 14,-2.2 14,-2.5 -2,-0.3 2,-0.2 -0.990 24.3-113.5-136.6 144.6 37.1 -41.4 -49.1 27 77 A P E -H 39 0B 73 0, 0.0 2,-0.4 0, 0.0 12,-0.2 -0.487 20.9-157.6 -79.1 148.0 36.0 -37.8 -49.9 28 78 A V E -H 38 0B 6 10,-1.6 9,-3.6 -2,-0.2 10,-1.1 -0.996 13.2-170.4-126.8 127.8 32.8 -37.0 -51.7 29 79 A Q E -H 36 0B 106 -2,-0.4 7,-0.2 7,-0.2 6,-0.1 -0.921 33.3-104.0-125.0 148.1 32.4 -33.6 -53.5 30 80 A D > - 0 0 12 5,-2.3 4,-2.8 -2,-0.3 5,-0.2 -0.507 31.5-143.4 -63.7 113.2 29.6 -31.7 -55.2 31 81 A P T 4 S+ 0 0 12 0, 0.0 337,-0.3 0, 0.0 302,-0.2 0.666 95.3 44.3 -57.3 -15.2 30.4 -32.3 -58.9 32 82 A A T 4 S+ 0 0 7 62,-0.3 336,-0.2 300,-0.1 337,-0.1 0.906 127.8 20.8 -93.8 -54.2 29.3 -28.7 -59.7 33 83 A S T 4 S- 0 0 55 2,-0.1 3,-0.1 334,-0.1 334,-0.0 0.521 92.3-129.0 -94.2 -8.9 30.8 -26.5 -57.0 34 84 A G < + 0 0 44 -4,-2.8 3,-0.1 1,-0.2 333,-0.0 0.500 53.4 156.2 73.5 2.2 33.6 -28.8 -55.9 35 85 A A - 0 0 43 -5,-0.2 -5,-2.3 1,-0.1 2,-0.4 -0.258 51.2-105.9 -63.1 145.5 32.5 -28.5 -52.3 36 86 A A E -H 29 0B 91 -7,-0.2 -7,-0.2 1,-0.2 -1,-0.1 -0.598 35.7-179.6 -73.9 126.1 33.3 -31.2 -49.7 37 87 A L E - 0 0 50 -9,-3.6 2,-0.3 -2,-0.4 -8,-0.2 0.775 53.4 -59.3 -96.4 -33.9 30.2 -33.2 -49.0 38 88 A G E -H 28 0B 21 -10,-1.1 -10,-1.6 2,-0.0 2,-0.7 -0.916 43.0 -90.0 165.5 167.8 31.6 -35.6 -46.4 39 89 A M E -H 27 0B 96 -2,-0.3 2,-0.3 -12,-0.2 -3,-0.0 -0.917 43.8-163.6-105.5 112.3 34.0 -38.3 -45.5 40 90 A V E -H 26 0B 0 -14,-2.5 -14,-2.2 -2,-0.7 -28,-0.2 -0.738 27.4 -97.7-100.6 145.4 32.5 -41.8 -46.2 41 91 A A E -H 25 0B 1 -30,-2.8 2,-0.8 -2,-0.3 -16,-0.3 -0.284 28.5-145.8 -58.7 139.0 33.7 -45.1 -44.9 42 92 A D - 0 0 13 -18,-2.7 -18,-0.5 167,-0.1 167,-0.3 -0.791 20.2-154.0-110.4 86.8 35.9 -47.0 -47.4 43 93 A C - 0 0 0 165,-3.1 2,-0.2 -2,-0.8 174,-0.2 -0.216 8.8-161.6 -62.7 147.2 35.0 -50.6 -46.8 44 94 A G > - 0 0 14 172,-0.1 4,-2.0 165,-0.1 3,-0.3 -0.606 43.2 -77.6-118.4-178.6 37.6 -53.4 -47.6 45 95 A V H > S+ 0 0 40 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.823 128.8 55.5 -50.2 -36.4 37.3 -57.1 -48.1 46 96 A R H > S+ 0 0 176 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.949 108.9 45.0 -63.8 -49.4 37.0 -57.7 -44.4 47 97 A E H > S+ 0 0 56 -3,-0.3 4,-1.4 1,-0.2 -1,-0.2 0.799 114.3 52.0 -64.3 -28.5 34.0 -55.4 -44.0 48 98 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.917 107.4 48.6 -75.4 -44.7 32.5 -56.9 -47.1 49 99 A R H X S+ 0 0 103 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.874 113.6 49.9 -62.8 -34.6 32.8 -60.5 -45.9 50 100 A A H X S+ 0 0 34 -4,-1.9 4,-2.0 -5,-0.2 -1,-0.2 0.845 108.4 51.2 -72.1 -34.1 31.2 -59.4 -42.7 51 101 A A H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.871 110.1 51.1 -70.2 -35.8 28.4 -57.7 -44.5 52 102 A V H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.959 109.1 48.7 -64.7 -51.4 27.8 -60.9 -46.4 53 103 A R H X S+ 0 0 120 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.901 110.6 53.2 -54.9 -41.0 27.6 -63.0 -43.3 54 104 A A H X S+ 0 0 23 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.914 111.7 44.7 -60.5 -43.3 25.2 -60.5 -41.8 55 105 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.872 111.0 53.6 -68.8 -39.3 23.0 -60.8 -44.9 56 106 A Y H X S+ 0 0 95 -4,-2.9 4,-1.4 1,-0.2 -2,-0.2 0.897 110.9 45.7 -63.9 -41.4 23.2 -64.6 -44.9 57 107 A E H < S+ 0 0 123 -4,-2.4 4,-0.4 -5,-0.2 -1,-0.2 0.879 112.2 50.7 -70.8 -35.8 22.1 -64.8 -41.3 58 108 A A H >X S+ 0 0 6 -4,-1.8 4,-3.3 -5,-0.2 3,-1.0 0.856 105.5 60.1 -67.7 -33.4 19.3 -62.3 -41.8 59 109 A F H 3X S+ 0 0 11 -4,-2.1 4,-2.5 1,-0.2 5,-0.3 0.887 94.9 59.6 -61.1 -42.8 18.2 -64.4 -44.9 60 110 A C H 3< S+ 0 0 50 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.692 118.7 31.8 -62.8 -16.1 17.6 -67.6 -42.9 61 111 A R H X> S+ 0 0 179 -3,-1.0 3,-0.8 -4,-0.4 4,-0.6 0.761 116.2 54.8-105.7 -40.6 15.0 -65.6 -40.9 62 112 A W H >< S+ 0 0 3 -4,-3.3 3,-0.9 1,-0.2 -3,-0.2 0.847 101.1 59.7 -63.1 -36.3 13.7 -63.2 -43.5 63 113 A R T 3< S+ 0 0 117 -4,-2.5 -1,-0.2 1,-0.3 -3,-0.1 0.762 104.4 53.8 -63.5 -25.0 12.8 -66.0 -45.9 64 114 A E T <4 S+ 0 0 144 -3,-0.8 -1,-0.3 -5,-0.3 -2,-0.2 0.659 84.2 102.8 -84.2 -20.7 10.5 -67.3 -43.1 65 115 A V S << S- 0 0 40 -3,-0.9 5,-0.0 -4,-0.6 -3,-0.0 -0.416 85.2-100.8 -66.3 140.0 8.6 -64.0 -42.7 66 116 A S > - 0 0 72 1,-0.1 4,-2.4 -2,-0.1 3,-0.4 -0.224 23.3-122.8 -60.0 150.5 5.2 -64.0 -44.4 67 117 A A H > S+ 0 0 31 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.839 113.9 57.0 -64.7 -32.4 4.9 -62.4 -47.8 68 118 A K H > S+ 0 0 127 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.848 109.5 46.5 -67.6 -30.1 2.2 -60.1 -46.4 69 119 A E H > S+ 0 0 80 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.929 112.0 47.1 -76.2 -47.3 4.7 -59.0 -43.7 70 120 A R H X S+ 0 0 23 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.894 112.0 54.1 -60.0 -37.6 7.6 -58.4 -46.0 71 121 A S H X S+ 0 0 14 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.865 105.8 52.2 -62.8 -38.7 5.2 -56.5 -48.3 72 122 A S H X S+ 0 0 43 -4,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.905 110.4 46.7 -65.5 -43.7 4.2 -54.3 -45.4 73 123 A L H X S+ 0 0 9 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.887 108.5 55.4 -66.6 -40.4 7.7 -53.3 -44.6 74 124 A L H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.882 111.0 47.2 -61.3 -33.1 8.5 -52.7 -48.2 75 125 A R H X S+ 0 0 79 -4,-1.5 4,-2.9 2,-0.2 -2,-0.2 0.897 107.6 52.4 -75.9 -40.3 5.6 -50.3 -48.2 76 126 A K H X S+ 0 0 103 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.903 109.3 52.4 -59.9 -39.2 6.5 -48.5 -45.0 77 127 A W H X S+ 0 0 2 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.900 109.0 50.1 -61.6 -42.0 9.9 -47.9 -46.5 78 128 A Y H X S+ 0 0 28 -4,-1.4 4,-2.3 1,-0.2 -2,-0.2 0.936 109.6 49.8 -62.3 -48.0 8.2 -46.5 -49.6 79 129 A N H X S+ 0 0 70 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.871 108.6 53.5 -60.3 -36.9 6.1 -44.1 -47.4 80 130 A L H X S+ 0 0 19 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.878 106.8 52.5 -66.0 -36.1 9.3 -43.0 -45.6 81 131 A M H < S+ 0 0 0 -4,-1.8 -2,-0.2 2,-0.2 7,-0.2 0.937 111.8 44.9 -64.7 -45.9 10.8 -42.2 -49.0 82 132 A I H >< S+ 0 0 49 -4,-2.3 3,-1.7 1,-0.2 4,-0.3 0.934 109.4 56.0 -63.2 -45.0 7.9 -40.0 -50.0 83 133 A Q H 3< S+ 0 0 144 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.835 119.0 33.4 -55.4 -34.8 7.8 -38.4 -46.6 84 134 A N T 3X S+ 0 0 29 -4,-1.6 4,-2.7 -3,-0.2 3,-0.3 0.145 81.1 123.0-107.9 18.4 11.5 -37.3 -47.1 85 135 A K H <> S+ 0 0 74 -3,-1.7 4,-2.3 1,-0.2 5,-0.2 0.835 71.0 54.6 -51.0 -41.3 11.4 -36.8 -50.9 86 136 A D H > S+ 0 0 87 -4,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.953 114.6 38.8 -60.8 -49.0 12.6 -33.2 -50.7 87 137 A D H > S+ 0 0 43 -3,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.881 114.8 54.0 -68.2 -38.2 15.7 -34.0 -48.7 88 138 A L H X S+ 0 0 7 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.867 109.1 50.0 -64.0 -33.7 16.3 -37.2 -50.6 89 139 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.3 -2,-0.2 0.893 106.3 54.1 -71.5 -40.7 16.2 -35.2 -53.8 90 140 A R H X S+ 0 0 86 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.888 105.1 55.0 -60.9 -38.0 18.7 -32.6 -52.6 91 141 A I H X S+ 0 0 4 -4,-1.9 4,-2.2 2,-0.2 5,-0.3 0.899 107.7 49.5 -62.6 -40.2 21.2 -35.4 -51.7 92 142 A I H X>S+ 0 0 0 -4,-1.3 4,-3.2 2,-0.2 5,-0.8 0.936 113.3 45.3 -63.7 -46.8 21.0 -36.7 -55.3 93 143 A T H X5S+ 0 0 1 -4,-2.2 4,-1.0 3,-0.2 -2,-0.2 0.887 110.8 56.3 -63.6 -38.5 21.6 -33.2 -56.8 94 144 A A H <5S+ 0 0 13 -4,-2.7 -62,-0.3 -5,-0.2 -2,-0.2 0.923 122.3 22.9 -60.3 -47.6 24.4 -32.7 -54.3 95 145 A E H <5S+ 0 0 1 -4,-2.2 -2,-0.2 -65,-0.2 -1,-0.2 0.787 131.1 37.2 -93.8 -30.9 26.4 -35.8 -55.4 96 146 A S H <5S- 0 0 0 -4,-3.2 -3,-0.2 -5,-0.3 -2,-0.1 0.762 92.1-138.0 -91.3 -28.5 25.2 -36.6 -58.9 97 147 A G << + 0 0 2 -4,-1.0 226,-0.4 -5,-0.8 -4,-0.2 0.287 52.3 141.4 90.2 -11.3 24.9 -32.9 -60.0 98 148 A K - 0 0 2 -6,-0.4 -1,-0.3 233,-0.1 -2,-0.1 -0.314 63.2 -86.5 -64.3 147.5 21.7 -33.4 -61.9 99 149 A P >> - 0 0 4 0, 0.0 4,-2.3 0, 0.0 3,-0.7 -0.171 36.1-113.5 -55.4 145.1 19.1 -30.6 -61.5 100 150 A L H 3> S+ 0 0 36 223,-2.3 4,-3.0 1,-0.3 5,-0.3 0.868 116.0 56.2 -46.4 -48.1 16.7 -30.7 -58.6 101 151 A K H 3> S+ 0 0 189 222,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.897 110.7 45.4 -55.9 -40.4 13.7 -31.2 -60.8 102 152 A E H <> S+ 0 0 44 -3,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.879 111.5 52.5 -70.6 -36.2 15.4 -34.3 -62.2 103 153 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.883 108.0 50.9 -65.8 -38.3 16.4 -35.4 -58.7 104 154 A H H X S+ 0 0 56 -4,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.871 108.6 53.4 -65.1 -36.3 12.8 -35.1 -57.6 105 155 A G H X S+ 0 0 41 -4,-1.6 4,-2.0 -5,-0.3 -2,-0.2 0.882 109.8 47.5 -66.1 -38.0 11.8 -37.2 -60.6 106 156 A E H X S+ 0 0 7 -4,-1.9 4,-3.8 1,-0.2 5,-0.3 0.943 106.8 55.3 -69.1 -46.8 14.3 -39.9 -59.5 107 157 A I H X S+ 0 0 3 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.836 110.9 46.4 -55.6 -34.0 13.2 -40.0 -55.9 108 158 A L H X S+ 0 0 65 -4,-1.5 4,-3.2 2,-0.2 -1,-0.2 0.960 113.9 47.0 -70.7 -51.8 9.7 -40.7 -57.0 109 159 A Y H X S+ 0 0 30 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.902 114.2 48.9 -54.5 -44.6 10.7 -43.3 -59.5 110 160 A S H >X S+ 0 0 0 -4,-3.8 4,-1.3 1,-0.2 3,-0.7 0.929 112.2 47.5 -63.0 -45.6 13.0 -44.8 -56.8 111 161 A A H 3X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.3 -2,-0.2 0.889 106.3 59.8 -63.9 -37.0 10.1 -44.8 -54.3 112 162 A F H 3X S+ 0 0 73 -4,-3.2 4,-2.8 1,-0.2 -1,-0.2 0.757 98.6 57.2 -64.3 -25.7 7.8 -46.3 -56.9 113 163 A F H < S+ 0 0 24 -4,-1.0 3,-2.0 1,-0.2 -1,-0.2 0.775 88.7 77.1 -78.5 -27.9 4.7 -58.2 -55.9 121 171 A A G >< S+ 0 0 2 -4,-2.1 3,-0.6 -3,-0.3 -1,-0.2 0.829 96.1 45.4 -51.8 -40.2 5.7 -59.9 -52.7 122 172 A R G 3 S+ 0 0 129 -4,-0.5 -1,-0.3 -3,-0.3 -2,-0.1 0.463 105.6 66.2 -86.0 0.8 2.3 -61.5 -52.1 123 173 A R G < + 0 0 131 -3,-2.0 2,-1.1 -56,-0.1 -1,-0.2 -0.006 56.9 125.8-114.0 30.7 2.0 -62.6 -55.7 124 174 A V < - 0 0 47 -3,-0.6 2,-0.4 18,-0.1 18,-0.2 -0.761 45.2-166.5 -88.7 101.9 4.7 -65.2 -56.1 125 175 A Y - 0 0 151 -2,-1.1 2,-0.1 16,-0.1 -2,-0.1 -0.755 14.8-160.2-100.3 134.6 2.6 -68.2 -57.5 126 176 A G - 0 0 40 -2,-0.4 2,-0.3 16,-0.1 15,-0.2 -0.420 24.5-122.6 -92.8 176.1 3.7 -71.8 -57.8 127 177 A D E -I 140 0C 79 13,-1.7 13,-3.0 -2,-0.1 2,-0.5 -0.837 8.5-143.5-125.6 165.4 1.9 -74.2 -60.1 128 178 A I E -I 139 0C 143 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.990 29.5-165.9-123.8 113.2 -0.0 -77.4 -60.1 129 179 A I E -I 138 0C 84 9,-2.5 9,-1.3 -2,-0.5 2,-0.4 -0.796 15.7-128.5-107.3 146.4 0.7 -79.4 -63.3 130 180 A H - 0 0 171 -2,-0.3 7,-0.1 7,-0.1 3,-0.1 -0.768 27.3-178.8 -94.0 135.6 -1.1 -82.4 -64.7 131 181 A T - 0 0 33 -2,-0.4 5,-0.1 5,-0.3 7,-0.0 -0.927 37.0-113.0-129.5 155.8 0.9 -85.5 -65.7 132 182 A P S S+ 0 0 124 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.953 89.6 89.5 -49.4 -61.9 -0.1 -88.8 -67.3 133 183 A A > - 0 0 38 1,-0.2 3,-0.7 2,-0.1 -2,-0.3 -0.063 63.6-155.6 -42.8 127.5 0.6 -91.0 -64.2 134 184 A K T 3 S+ 0 0 191 1,-0.2 -1,-0.2 351,-0.1 3,-0.0 0.551 85.7 69.8 -85.2 -7.1 -2.4 -91.3 -61.9 135 185 A D T 3 S+ 0 0 59 350,-0.1 350,-2.2 349,-0.0 349,-0.4 0.282 100.5 45.6 -94.0 11.7 -0.2 -92.1 -58.8 136 186 A R < - 0 0 100 -3,-0.7 2,-0.4 347,-0.2 -5,-0.3 -0.994 57.5-150.5-154.5 158.9 1.2 -88.6 -58.6 137 187 A R E - J 0 482C 131 345,-3.1 345,-2.3 -2,-0.3 2,-0.6 -0.976 21.3-136.6-128.5 141.1 0.7 -84.9 -58.6 138 188 A A E -IJ 129 481C 3 -9,-1.3 -9,-2.5 -2,-0.4 2,-0.4 -0.882 22.2-180.0-105.4 124.4 3.2 -82.3 -59.8 139 189 A L E -IJ 128 480C 51 341,-2.6 341,-3.5 -2,-0.6 2,-0.5 -0.932 12.7-157.7-119.4 143.6 3.6 -79.1 -57.8 140 190 A V E -IJ 127 479C 15 -13,-3.0 -13,-1.7 -2,-0.4 2,-0.2 -0.964 12.1-169.7-125.1 115.6 6.0 -76.3 -58.6 141 191 A L E - J 0 478C 75 337,-2.6 337,-2.6 -2,-0.5 2,-0.4 -0.657 12.2-145.3 -98.3 156.9 7.1 -74.0 -55.8 142 192 A K E + J 0 477C 70 -2,-0.2 335,-0.2 335,-0.2 -16,-0.1 -0.995 23.5 175.5-124.1 127.8 9.0 -70.7 -56.1 143 193 A Q E - J 0 476C 80 333,-2.2 333,-2.7 -2,-0.4 29,-0.1 -0.934 35.4 -93.4-131.7 154.7 11.6 -69.8 -53.4 144 194 A P E - J 0 475C 32 0, 0.0 331,-0.2 0, 0.0 3,-0.1 -0.379 27.7-134.1 -68.7 145.6 14.1 -67.0 -52.8 145 195 A I - 0 0 24 329,-2.1 2,-0.4 1,-0.2 330,-0.1 0.884 42.6-120.2 -65.6 -43.8 17.7 -67.6 -54.0 146 196 A G + 0 0 3 328,-0.3 28,-1.4 28,-0.1 2,-0.4 -0.982 67.8 12.8 142.5-127.5 19.4 -66.3 -50.9 147 197 A V E -cd 174 227A 1 79,-0.6 81,-2.6 -2,-0.4 82,-1.5 -0.738 63.2-159.3 -91.2 134.6 21.9 -63.5 -50.5 148 198 A A E -cd 175 229A 0 26,-2.4 28,-2.2 -2,-0.4 2,-0.6 -0.946 12.0-143.7-118.8 131.1 22.3 -61.1 -53.5 149 199 A A E -cd 176 230A 0 80,-3.4 82,-3.1 -2,-0.4 2,-0.5 -0.810 21.4-164.7 -90.2 121.5 25.3 -58.8 -54.2 150 200 A V E -cd 177 231A 0 26,-2.4 28,-2.7 -2,-0.6 2,-0.5 -0.945 8.2-176.1-113.3 119.8 24.0 -55.6 -55.7 151 201 A I E -cd 178 232A 10 80,-3.2 82,-1.7 -2,-0.5 26,-0.1 -0.964 9.6-172.4-118.7 119.8 26.4 -53.2 -57.4 152 202 A T - 0 0 7 26,-1.2 28,-0.2 -2,-0.5 82,-0.1 -0.819 16.3-130.2-117.5 153.1 25.1 -49.8 -58.7 153 203 A P - 0 0 18 0, 0.0 27,-0.5 0, 0.0 7,-0.1 -0.136 27.8-111.2 -83.7-175.5 26.4 -46.9 -60.8 154 204 A W S S+ 0 0 35 1,-0.1 4,-0.1 25,-0.1 80,-0.0 0.660 94.6 86.0 -94.8 -19.4 26.3 -43.2 -60.0 155 205 A N S S+ 0 0 23 1,-0.3 -1,-0.1 2,-0.1 -57,-0.1 0.864 110.3 15.2 -49.9 -48.6 23.8 -42.0 -62.7 156 206 A F S > S- 0 0 30 -3,-0.1 4,-2.1 1,-0.1 5,-0.4 -0.660 76.4-176.5-129.8 74.0 20.7 -42.7 -60.6 157 207 A P T 4 S+ 0 0 1 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 0.557 82.5 26.4 -47.7 -15.1 22.2 -43.2 -57.1 158 208 A S T >> S+ 0 0 3 3,-0.1 4,-2.5 -4,-0.1 3,-0.8 0.757 118.5 48.5-116.0 -56.4 18.8 -44.1 -55.7 159 209 A A H 3> S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.836 107.4 58.2 -57.5 -37.4 16.5 -45.6 -58.3 160 210 A M H 3< S+ 0 0 7 -4,-2.1 4,-0.3 2,-0.2 -1,-0.2 0.794 112.7 40.3 -65.1 -29.2 19.2 -48.0 -59.5 161 211 A I H X> S+ 0 0 0 -3,-0.8 4,-2.8 -5,-0.4 3,-1.5 0.937 114.0 51.8 -80.7 -53.9 19.5 -49.5 -56.0 162 212 A T H 3X S+ 0 0 1 -4,-2.5 4,-2.1 1,-0.3 5,-0.3 0.795 103.5 57.0 -53.8 -37.4 15.8 -49.5 -55.2 163 213 A R H 3< S+ 0 0 15 -4,-2.1 303,-0.5 -5,-0.2 4,-0.5 0.711 116.3 36.8 -72.0 -19.1 14.7 -51.3 -58.4 164 214 A K H <> S+ 0 0 0 -3,-1.5 4,-2.5 -4,-0.3 -2,-0.2 0.843 119.4 45.3 -96.0 -46.6 17.0 -54.2 -57.5 165 215 A V H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.829 108.7 58.6 -66.4 -35.5 16.6 -54.3 -53.7 166 216 A G H X S+ 0 0 0 -4,-2.1 4,-2.6 -5,-0.3 5,-0.2 0.983 111.2 41.0 -58.3 -55.6 12.8 -53.9 -54.0 167 217 A A H > S+ 0 0 2 -4,-0.5 4,-2.1 -5,-0.3 6,-0.2 0.934 114.0 53.2 -56.5 -51.1 12.6 -57.1 -56.1 168 218 A A H X>S+ 0 0 0 -4,-2.5 5,-2.7 1,-0.2 4,-0.8 0.922 113.8 40.5 -53.4 -51.5 15.2 -59.0 -54.0 169 219 A L H ><5S+ 0 0 0 -4,-2.7 3,-1.2 1,-0.2 -1,-0.2 0.926 111.5 56.4 -66.3 -43.0 13.4 -58.3 -50.7 170 220 A A H 3<5S+ 0 0 0 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.861 108.2 49.8 -55.6 -35.1 9.9 -58.9 -52.2 171 221 A A H 3<5S- 0 0 4 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.687 125.6-104.0 -77.0 -18.5 11.2 -62.3 -53.3 172 222 A G T <<5S+ 0 0 0 -3,-1.2 -3,-0.2 -4,-0.8 2,-0.1 0.518 79.5 126.1 106.7 8.1 12.5 -63.1 -49.8 173 223 A C < - 0 0 0 -5,-2.7 -1,-0.3 -6,-0.2 2,-0.3 -0.455 50.8-135.3 -91.5 168.3 16.2 -62.5 -50.4 174 224 A T E -c 147 0A 0 -28,-1.4 -26,-2.4 -2,-0.1 2,-0.3 -0.808 22.0-144.6-117.4 162.0 18.6 -60.2 -48.5 175 225 A V E -ce 148 204A 0 28,-2.5 30,-1.6 -2,-0.3 2,-0.5 -0.946 19.9-155.8-136.9 154.6 21.1 -57.9 -50.1 176 226 A V E -ce 149 205A 0 -28,-2.2 -26,-2.4 -2,-0.3 2,-0.4 -0.967 27.3-157.2-124.2 107.2 24.6 -56.4 -49.7 177 227 A V E -ce 150 206A 0 28,-4.2 30,-3.2 -2,-0.5 -26,-0.2 -0.758 13.9-169.5 -93.2 132.3 24.8 -53.1 -51.7 178 228 A K E -c 151 0A 24 -28,-2.7 -26,-1.2 -2,-0.4 3,-0.1 -0.904 21.9-158.1-119.1 96.0 28.1 -51.7 -52.9 179 229 A P - 0 0 1 0, 0.0 30,-0.5 0, 0.0 -25,-0.1 -0.309 27.4 -86.8 -76.0 159.5 27.2 -48.2 -54.2 180 230 A A > - 0 0 14 -27,-0.5 3,-0.6 3,-0.3 30,-0.1 -0.351 32.7-130.6 -63.0 142.8 29.2 -46.0 -56.6 181 231 A E T 3 S+ 0 0 63 1,-0.2 -1,-0.1 2,-0.1 -141,-0.1 0.686 105.5 59.6 -71.3 -19.0 31.9 -44.0 -54.9 182 232 A D T 3 S+ 0 0 58 1,-0.2 -1,-0.2 -154,-0.1 3,-0.1 0.762 121.9 23.0 -78.1 -25.5 30.8 -40.8 -56.7 183 233 A T S < S+ 0 0 2 -3,-0.6 -3,-0.3 1,-0.1 4,-0.3 -0.529 70.4 137.9-142.2 71.0 27.4 -41.1 -55.1 184 234 A P >> + 0 0 0 0, 0.0 4,-1.1 0, 0.0 3,-1.0 0.806 61.3 74.8 -85.0 -29.7 27.3 -43.2 -51.9 185 235 A F H >> S+ 0 0 2 1,-0.3 4,-2.5 2,-0.2 3,-1.0 0.874 87.7 56.7 -50.5 -50.8 25.0 -41.0 -49.9 186 236 A S H 3> S+ 0 0 5 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.831 106.8 53.4 -53.6 -32.2 21.7 -41.8 -51.6 187 237 A A H <> S+ 0 0 0 -3,-1.0 4,-1.3 -4,-0.3 -1,-0.3 0.798 111.8 43.4 -72.9 -30.8 22.4 -45.5 -50.7 188 238 A L H X S+ 0 0 18 -4,-2.2 4,-1.7 1,-0.2 3,-0.7 0.954 112.5 46.3 -58.9 -49.5 18.4 -44.9 -42.6 193 243 A L H 3X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.802 106.5 59.3 -64.6 -28.3 14.9 -45.1 -43.9 194 244 A A H 3X>S+ 0 0 1 -4,-2.2 5,-2.6 1,-0.2 4,-0.7 0.796 107.6 45.6 -71.6 -27.0 15.1 -48.9 -44.0 195 245 A S H <<5S+ 0 0 50 -4,-1.4 -2,-0.2 -3,-0.7 -1,-0.2 0.786 111.5 51.9 -84.5 -27.8 15.8 -49.0 -40.2 196 246 A Q H <5S+ 0 0 97 -4,-1.7 -2,-0.2 1,-0.2 -3,-0.2 0.882 108.6 51.9 -70.7 -37.6 13.0 -46.5 -39.6 197 247 A A H <5S- 0 0 8 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.754 119.9-112.3 -68.4 -26.8 10.6 -48.7 -41.6 198 248 A G T <5 + 0 0 40 -4,-0.7 -3,-0.2 1,-0.3 -2,-0.1 0.639 51.3 169.9 102.0 17.5 11.6 -51.6 -39.5 199 249 A I < - 0 0 14 -5,-2.6 -1,-0.3 -6,-0.2 3,-0.1 -0.476 45.7-104.8 -62.0 127.4 13.5 -53.7 -42.1 200 250 A P > - 0 0 55 0, 0.0 3,-2.0 0, 0.0 4,-0.5 -0.193 43.5 -87.0 -56.5 145.6 15.2 -56.5 -40.0 201 251 A S T 3 S+ 0 0 80 1,-0.2 4,-0.1 -185,-0.2 -184,-0.0 -0.227 113.0 20.4 -55.2 135.7 18.9 -56.1 -39.4 202 252 A G T 3 S+ 0 0 3 2,-0.4 -1,-0.2 -3,-0.1 -144,-0.2 0.318 95.6 98.7 88.2 -9.6 21.0 -57.7 -42.1 203 253 A V S < S+ 0 0 0 -3,-2.0 -28,-2.5 1,-0.3 2,-0.5 0.877 92.0 29.4 -76.4 -38.1 18.3 -57.6 -44.7 204 254 A Y E S+ e 0 175A 3 -4,-0.5 2,-0.4 -30,-0.2 -2,-0.4 -0.972 77.0 174.0-126.2 114.8 19.6 -54.4 -46.3 205 255 A N E - e 0 176A 0 -30,-1.6 -28,-4.2 -2,-0.5 2,-0.4 -0.962 13.7-164.3-125.6 141.0 23.3 -53.7 -46.1 206 256 A V E -Be 14 177A 0 -192,-2.4 -192,-2.2 -2,-0.4 -28,-0.2 -0.986 5.6-177.7-126.4 126.2 25.4 -51.0 -47.7 207 257 A I - 0 0 0 -30,-3.2 -194,-0.1 -2,-0.4 -159,-0.0 -0.748 13.3-161.5-124.3 85.2 29.2 -51.1 -48.0 208 258 A P + 0 0 1 0, 0.0 -165,-3.1 0, 0.0 2,-0.3 -0.303 18.9 163.7 -63.7 147.3 30.7 -47.9 -49.6 209 259 A C - 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0 0 135 -3,-1.0 -3,-0.2 -4,-0.5 2,-0.2 0.867 49.9-177.9 48.7 48.0 27.8 -70.8 -60.7 251 301 A K < - 0 0 22 -5,-1.4 -22,-0.2 -29,-0.1 2,-0.2 -0.497 31.9-109.4 -78.2 143.2 26.1 -67.7 -59.3 252 302 A R E -f 229 0A 74 -24,-2.0 -22,-2.1 -2,-0.2 2,-0.4 -0.502 44.9-166.0 -68.4 137.8 22.8 -66.4 -60.7 253 303 A V E +f 230 0A 27 -24,-0.2 2,-0.3 -2,-0.2 -22,-0.2 -0.973 24.1 172.3-135.5 146.7 23.5 -63.1 -62.5 254 304 A S E +f 231 0A 2 -24,-2.0 -22,-1.9 -2,-0.4 2,-0.3 -0.977 19.5 158.9-146.8 133.5 21.5 -60.2 -63.9 255 305 A M E -fG 232 462A 7 207,-1.5 207,-2.3 -2,-0.3 2,-0.4 -0.998 33.4-142.0-158.0 158.8 23.1 -57.0 -65.2 256 306 A E E -fG 233 461A 13 -24,-1.9 -22,-2.2 -2,-0.3 2,-0.5 -0.993 22.7-161.1-124.2 123.5 22.7 -53.9 -67.4 257 307 A L E -f 234 0A 10 203,-3.4 -22,-0.2 -2,-0.4 -24,-0.0 -0.922 30.2 -98.5-116.0 127.1 25.7 -52.7 -69.4 258 308 A G + 0 0 10 -24,-2.3 -22,-0.3 -2,-0.5 2,-0.2 -0.071 54.7 167.6 -42.0 113.7 26.2 -49.2 -70.9 259 309 A G - 0 0 0 31,-0.3 2,-0.4 201,-0.1 33,-0.2 -0.669 39.4 -90.3-124.9 178.4 25.3 -49.3 -74.6 260 310 A L - 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0 0 95 -24,-0.4 -24,-0.3 1,-0.1 -1,-0.2 -0.987 54.6-167.1-149.6 137.1 8.5 -41.0 -77.1 445 495 A G S S+ 0 0 2 -2,-0.3 2,-0.5 1,-0.2 -152,-0.2 0.532 81.1 58.3-101.0 -9.3 11.9 -40.1 -75.8 446 496 A L + 0 0 76 1,-0.1 -1,-0.2 2,-0.1 -165,-0.1 -0.964 51.7 161.3-124.3 113.0 11.2 -41.0 -72.1 447 497 A I + 0 0 40 -2,-0.5 -1,-0.1 -3,-0.1 -7,-0.1 0.329 22.4 140.1-114.2 7.1 10.2 -44.6 -71.5 448 498 A S + 0 0 50 2,-0.0 2,-0.2 6,-0.0 -2,-0.1 -0.186 17.1 148.8 -53.7 141.6 10.9 -45.0 -67.7 449 499 A S > - 0 0 28 3,-0.2 3,-0.9 1,-0.0 18,-0.1 -0.794 44.0-145.1-175.3 129.5 8.2 -47.0 -65.9 450 500 A V T 3 S+ 0 0 8 -2,-0.2 17,-2.7 1,-0.2 4,-0.1 0.653 101.0 57.9 -77.0 -14.1 8.4 -49.3 -62.8 451 501 A E T 3 S+ 0 0 107 15,-0.2 17,-0.4 16,-0.1 -1,-0.2 0.421 96.6 74.4 -95.8 3.0 5.7 -51.6 -64.2 452 502 A C S < S- 0 0 59 -3,-0.9 2,-0.5 15,-0.2 15,-0.3 -0.880 90.2-100.9-116.4 149.7 7.6 -52.4 -67.4 453 503 A P - 0 0 55 0, 0.0 2,-0.4 0, 0.0 13,-0.2 -0.562 35.2-163.5 -73.8 112.2 10.7 -54.7 -67.9 454 504 A F B +S 465 0H 13 11,-2.8 11,-2.2 -2,-0.5 2,-0.3 -0.778 37.5 85.8 -98.0 136.0 14.0 -52.9 -68.2 455 505 A G - 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