==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 15-FEB-10 3LT4 . COMPND 2 MOLECULE: ENOYL-ACP REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR K.MAITY,S.P.BHARGAV,N.SUROLIA,A.SUROLIA,K.SUGUNA . 575 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25350.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 414 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 74 12.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 31 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 191 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.9 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 4 2 0 0 0 0 2 4 8 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 4 6 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 PARALLEL BRIDGES PER LADDER . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 97 A E 0 0 99 0, 0.0 2,-0.4 0, 0.0 27,-0.1 0.000 360.0 360.0 360.0 60.5 30.0 73.9 51.0 2 98 A D - 0 0 67 25,-0.3 27,-3.0 111,-0.1 2,-0.4 -0.799 360.0-167.1 -84.9 133.4 31.4 76.2 48.1 3 99 A I E -a 29 0A 18 -2,-0.4 111,-1.7 25,-0.2 112,-1.4 -0.986 4.9-168.8-125.5 133.5 34.9 75.4 47.1 4 100 A C E -ab 30 115A 0 25,-3.1 27,-2.6 -2,-0.4 2,-0.5 -0.981 11.6-152.9-121.8 128.1 37.2 77.5 44.9 5 101 A F E -ab 31 116A 0 110,-2.0 112,-2.5 -2,-0.4 2,-0.6 -0.893 12.6-163.7 -92.1 126.1 40.5 76.6 43.2 6 102 A I E -ab 32 117A 0 25,-3.3 27,-3.1 -2,-0.5 2,-0.7 -0.917 1.5-162.8-113.5 104.4 42.7 79.7 42.7 7 103 A A E +ab 33 118A 0 110,-2.8 112,-2.7 -2,-0.6 27,-0.1 -0.787 67.9 40.0 -89.8 113.8 45.5 79.0 40.2 8 104 A G + 0 0 28 25,-2.6 2,-0.5 -2,-0.7 8,-0.4 0.776 61.7 142.9 120.3 45.8 48.2 81.7 40.5 9 105 A I + 0 0 6 24,-1.6 26,-0.3 -3,-0.3 -1,-0.2 -0.966 3.6 154.8-109.8 126.6 49.0 82.7 44.1 10 106 A G S S- 0 0 35 -2,-0.5 2,-0.3 1,-0.4 -1,-0.1 0.486 71.2 -22.5-121.9 -15.8 52.8 83.5 44.8 11 107 A D S S- 0 0 39 34,-0.0 -1,-0.4 40,-0.0 3,-0.4 -0.892 78.9 -80.6-175.1-166.4 52.5 85.9 47.7 12 108 A T S S+ 0 0 14 -2,-0.3 -3,-0.0 1,-0.2 209,-0.0 0.325 106.8 78.5-102.1 8.6 49.9 88.3 49.2 13 109 A N S S+ 0 0 96 4,-0.1 -1,-0.2 238,-0.0 2,-0.2 0.368 80.0 69.4-102.1 2.1 50.6 91.2 46.8 14 110 A G S > S- 0 0 14 -3,-0.4 4,-1.3 207,-0.1 3,-0.2 -0.467 93.6 -92.3-110.7-171.7 48.7 90.1 43.6 15 111 A Y H > S+ 0 0 30 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.788 115.4 67.2 -74.2 -29.0 45.1 89.7 42.5 16 112 A G H > S+ 0 0 2 -8,-0.4 4,-2.6 103,-0.2 -1,-0.2 0.929 102.8 47.0 -55.4 -45.0 44.9 86.0 43.5 17 113 A W H > S+ 0 0 5 -6,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.927 110.9 50.4 -63.5 -47.8 45.3 86.9 47.2 18 114 A G H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.873 112.0 48.5 -56.8 -39.9 42.6 89.7 47.0 19 115 A I H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.908 111.1 50.9 -67.2 -42.7 40.2 87.3 45.3 20 116 A A H X S+ 0 0 0 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.938 109.8 50.4 -57.7 -46.9 41.0 84.7 48.0 21 117 A K H X S+ 0 0 45 -4,-2.9 4,-1.4 1,-0.2 -2,-0.2 0.929 112.6 45.4 -58.3 -51.9 40.3 87.3 50.8 22 118 A E H X S+ 0 0 8 -4,-2.1 4,-0.9 1,-0.2 -1,-0.2 0.875 111.6 50.3 -62.1 -42.1 36.9 88.3 49.3 23 119 A L H ><>S+ 0 0 1 -4,-2.5 5,-2.1 1,-0.2 3,-0.7 0.869 106.2 58.7 -62.4 -33.5 35.7 84.8 48.7 24 120 A S H ><5S+ 0 0 7 -4,-2.0 3,-1.8 1,-0.3 -2,-0.2 0.858 95.9 61.8 -64.9 -35.9 36.7 84.0 52.3 25 121 A K H 3<5S+ 0 0 109 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.830 104.5 48.5 -51.1 -38.6 34.3 86.7 53.5 26 122 A R T <<5S- 0 0 85 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.212 121.5-110.6 -91.9 12.1 31.5 84.6 51.9 27 123 A N T < 5 + 0 0 137 -3,-1.8 -25,-0.3 1,-0.2 2,-0.3 0.790 62.2 158.2 67.0 31.7 32.8 81.5 53.6 28 124 A V < - 0 0 5 -5,-2.1 2,-0.4 -8,-0.1 36,-0.2 -0.684 45.4-119.8 -83.8 137.3 34.0 79.9 50.4 29 125 A K E -a 3 0A 92 -27,-3.0 -25,-3.1 -2,-0.3 2,-0.4 -0.711 32.8-149.4 -80.2 132.1 36.7 77.2 51.0 30 126 A I E -ac 4 65A 0 34,-0.9 36,-2.0 -2,-0.4 37,-1.1 -0.877 17.2-171.5-113.0 131.9 39.8 78.2 49.1 31 127 A I E -ac 5 67A 0 -27,-2.6 -25,-3.3 -2,-0.4 2,-0.4 -0.989 18.4-142.9-121.3 126.1 42.5 76.0 47.5 32 128 A F E -ac 6 68A 0 35,-2.5 37,-2.8 -2,-0.5 2,-0.6 -0.698 4.1-154.8 -92.1 134.9 45.7 77.7 46.2 33 129 A G E -ac 7 69A 0 -27,-3.1 -25,-2.6 -2,-0.4 -24,-1.6 -0.958 21.7-167.2-103.8 114.2 47.5 76.6 43.1 34 130 A I E - c 0 70A 0 35,-3.1 37,-2.5 -2,-0.6 5,-0.1 -0.917 25.4-116.0-116.2 125.5 51.1 77.7 43.5 35 131 A W >> - 0 0 96 -2,-0.5 3,-2.1 -26,-0.3 4,-0.6 -0.324 31.3-126.6 -54.9 125.8 53.8 77.7 40.8 36 132 A P H >> S+ 0 0 2 0, 0.0 3,-1.7 0, 0.0 4,-0.6 0.864 103.4 63.2 -53.7 -42.4 56.4 75.2 41.8 37 133 A P H 34 S+ 0 0 33 0, 0.0 4,-0.1 0, 0.0 -2,-0.1 0.744 118.6 29.9 -56.0 -19.8 59.5 77.4 41.6 38 134 A V H <> S+ 0 0 40 -3,-2.1 4,-2.4 2,-0.1 5,-0.2 0.335 93.9 98.8-114.9 4.7 57.9 79.5 44.4 39 135 A Y H S+ 0 0 88 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.930 112.2 47.9 -59.7 -44.8 59.2 79.8 49.6 42 138 A F H X S+ 0 0 2 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.949 112.0 47.7 -64.1 -48.9 55.5 80.4 49.9 43 139 A M H X S+ 0 0 47 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.907 112.9 49.9 -60.4 -41.6 55.0 77.5 52.3 44 140 A K H X S+ 0 0 140 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.938 111.8 46.1 -62.1 -49.7 57.9 78.7 54.4 45 141 A N H <>S+ 0 0 42 -4,-2.7 5,-2.4 1,-0.2 6,-0.4 0.902 114.4 50.3 -58.3 -40.9 56.7 82.3 54.6 46 142 A Y H ><5S+ 0 0 76 -4,-2.7 3,-1.7 -5,-0.3 5,-0.2 0.950 111.6 46.1 -62.2 -50.3 53.2 81.0 55.4 47 143 A K H 3<5S+ 0 0 78 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.889 109.7 56.1 -59.2 -41.0 54.5 78.7 58.2 48 144 A N T 3<5S- 0 0 125 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.411 117.7-113.3 -74.2 2.1 56.6 81.6 59.6 49 145 A G T X 5S+ 0 0 24 -3,-1.7 3,-1.3 -4,-0.2 4,-0.4 0.582 73.6 135.9 79.2 12.4 53.5 83.8 59.9 50 146 A K T 3 S+ 0 0 4 -6,-0.4 4,-0.9 -5,-0.2 -1,-0.2 0.412 83.0 101.9-100.0 -0.0 50.9 86.3 55.8 52 148 A D H X> S+ 0 0 80 -3,-1.3 3,-0.8 1,-0.2 4,-0.5 0.876 84.0 42.6 -58.3 -48.9 49.0 86.5 59.1 53 149 A N H >4 S+ 0 0 131 -4,-0.4 3,-1.1 1,-0.2 -1,-0.2 0.902 113.0 55.4 -63.3 -38.6 48.1 90.2 59.0 54 150 A D H 34 S+ 0 0 61 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.649 102.9 58.3 -68.0 -13.5 47.2 89.7 55.3 55 151 A M H << S+ 0 0 5 -4,-0.9 8,-3.3 -3,-0.8 2,-0.3 0.579 78.1 107.4 -92.8 -12.9 44.8 86.9 56.3 56 152 A I B << +G 62 0B 85 -3,-1.1 6,-0.2 -4,-0.5 3,-0.1 -0.513 39.3 177.8 -67.8 126.1 42.6 89.0 58.6 57 153 A I - 0 0 30 4,-2.2 2,-0.3 1,-0.4 5,-0.2 0.873 60.2 -55.7 -90.4 -55.0 39.2 89.8 57.1 58 154 A D S S- 0 0 94 3,-1.9 -1,-0.4 1,-0.0 0, 0.0 -0.955 73.8 -53.2-166.4-176.5 37.8 91.7 60.1 59 155 A K S S+ 0 0 112 -2,-0.3 3,-0.0 1,-0.2 -1,-0.0 0.804 132.2 41.6 -30.7 -50.4 37.0 91.5 63.9 60 156 A D S S+ 0 0 70 1,-0.1 2,-0.2 -4,-0.0 -1,-0.2 1.000 114.5 25.2 -66.3 -73.0 35.1 88.3 63.2 61 157 A K - 0 0 48 -36,-0.0 -4,-2.2 -5,-0.0 -3,-1.9 -0.548 46.1-156.6-115.9 165.4 37.1 86.1 60.8 62 158 A K B -G 56 0B 121 -6,-0.2 -6,-0.2 -2,-0.2 -7,-0.1 -0.933 51.4 -77.3-127.5 144.9 40.4 85.2 59.2 63 159 A M - 0 0 1 -8,-3.3 2,-0.6 -2,-0.3 -42,-0.1 -0.158 40.8-145.3 -45.6 135.1 41.0 83.6 55.8 64 160 A N - 0 0 99 -36,-0.2 -34,-0.9 -43,-0.1 2,-0.7 -0.943 14.4-165.9-106.2 109.9 40.2 79.9 55.9 65 161 A I E -c 30 0A 32 -2,-0.6 -34,-0.2 1,-0.2 3,-0.1 -0.906 9.2-170.7-105.7 115.8 42.6 78.1 53.5 66 162 A L E - 0 0 57 -36,-2.0 2,-0.3 -2,-0.7 -35,-0.2 0.939 65.0 -21.0 -67.6 -49.3 41.6 74.5 52.7 67 163 A D E -c 31 0A 37 -37,-1.1 -35,-2.5 2,-0.0 2,-0.4 -0.978 46.6-144.4-158.2 163.8 44.8 73.5 50.9 68 164 A M E +c 32 0A 13 -2,-0.3 -35,-0.2 -37,-0.2 -37,-0.0 -0.973 27.0 176.9-139.7 120.8 47.9 74.7 49.0 69 165 A L E -c 33 0A 13 -37,-2.8 -35,-3.1 -2,-0.4 2,-0.2 -0.958 34.8-108.7-130.7 143.0 49.2 72.7 46.1 70 166 A P E +c 34 0A 12 0, 0.0 2,-0.3 0, 0.0 -35,-0.2 -0.503 42.7 179.1 -70.7 141.3 52.0 73.1 43.5 71 167 A F - 0 0 5 -37,-2.5 2,-0.5 -2,-0.2 27,-0.2 -0.969 17.1-170.6-150.6 121.6 50.5 73.8 40.1 72 168 A D > - 0 0 3 25,-3.0 3,-1.3 -2,-0.3 27,-0.4 -0.961 8.4-165.6-122.7 114.7 52.2 74.5 36.8 73 169 A A T 3 S+ 0 0 10 -2,-0.5 78,-0.1 1,-0.3 79,-0.1 0.368 81.7 78.4 -79.2 0.2 50.1 75.7 33.9 74 170 A S T 3 S+ 0 0 34 1,-0.1 2,-0.4 2,-0.0 -1,-0.3 0.682 92.9 55.4 -74.8 -22.3 52.9 74.9 31.5 75 171 A F < - 0 0 18 -3,-1.3 24,-2.6 22,-0.2 -3,-0.2 -0.969 54.7-171.2-128.7 124.3 52.0 71.2 31.6 76 172 A D S S+ 0 0 35 -2,-0.4 24,-2.6 22,-0.2 2,-0.3 0.887 77.2 3.4 -76.4 -42.9 48.6 69.5 30.9 77 173 A T S > S- 0 0 24 22,-0.2 3,-2.0 23,-0.1 4,-0.4 -0.872 82.1 -94.3-141.3 166.7 49.6 66.0 32.0 78 174 A A G > S+ 0 0 50 1,-0.3 3,-1.5 -2,-0.3 -1,-0.0 0.876 120.4 62.3 -52.2 -40.2 52.5 64.1 33.6 79 175 A N G 3 S+ 0 0 155 1,-0.2 -1,-0.3 -4,-0.0 -4,-0.0 0.704 93.0 65.0 -57.8 -23.9 53.7 63.1 30.2 80 176 A D G < S+ 0 0 83 -3,-2.0 2,-0.3 2,-0.0 -1,-0.2 0.623 73.4 107.4 -82.1 -12.7 54.3 66.8 29.2 81 177 A I < - 0 0 21 -3,-1.5 2,-0.1 -4,-0.4 -6,-0.0 -0.507 64.4-137.3 -72.6 125.7 57.1 67.6 31.6 82 178 A D > - 0 0 73 -2,-0.3 4,-2.2 1,-0.1 3,-0.3 -0.385 21.4-112.9 -74.1 160.9 60.5 67.9 30.0 83 179 A E H > S+ 0 0 131 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.875 114.1 60.4 -65.9 -40.8 63.6 66.4 31.7 84 180 A E H 4 S+ 0 0 74 2,-0.2 -1,-0.2 1,-0.2 -3,-0.0 0.880 110.4 43.0 -53.1 -41.5 65.2 69.7 32.5 85 181 A T H >4 S+ 0 0 21 -3,-0.3 3,-1.8 2,-0.2 6,-0.3 0.928 112.6 51.7 -69.6 -48.9 62.1 70.6 34.6 86 182 A K H 3< S+ 0 0 95 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.899 113.2 46.9 -48.3 -44.4 62.0 67.1 36.1 87 183 A N T 3< S+ 0 0 85 -4,-3.4 -1,-0.3 -5,-0.1 2,-0.2 0.286 87.7 117.7 -86.4 7.4 65.7 67.6 37.0 88 184 A N <> - 0 0 62 -3,-1.8 4,-2.5 -5,-0.2 3,-0.2 -0.566 69.5-131.6 -75.4 141.8 65.1 71.0 38.5 89 185 A K H > S+ 0 0 146 -2,-0.2 4,-0.6 1,-0.2 -1,-0.1 0.807 106.7 48.6 -62.8 -32.1 65.9 71.4 42.2 90 186 A R H 4 S+ 0 0 110 1,-0.1 -1,-0.2 2,-0.1 -50,-0.1 0.791 118.5 37.8 -82.0 -27.5 62.6 73.1 42.8 91 187 A Y H >4 S+ 0 0 19 -6,-0.3 3,-2.4 -3,-0.2 -2,-0.2 0.782 98.2 76.1 -90.1 -31.5 60.5 70.5 41.0 92 188 A N H 3< S+ 0 0 65 -4,-2.5 -2,-0.1 1,-0.3 -3,-0.1 0.818 97.9 46.2 -57.5 -36.7 62.3 67.3 41.9 93 189 A M T 3< S+ 0 0 155 -4,-0.6 -1,-0.3 2,-0.0 2,-0.3 0.248 107.1 73.6 -86.1 10.0 60.8 67.3 45.5 94 190 A L < - 0 0 23 -3,-2.4 2,-0.3 3,-0.0 3,-0.1 -0.836 58.6-175.9-120.9 160.9 57.3 68.0 44.3 95 191 A Q + 0 0 134 -2,-0.3 -2,-0.0 1,-0.1 -3,-0.0 -0.972 54.2 30.7-149.7 166.3 54.7 65.9 42.5 96 192 A N S S+ 0 0 77 -2,-0.3 9,-0.1 1,-0.1 -1,-0.1 0.869 70.6 131.9 53.7 46.9 51.2 65.9 40.8 97 193 A Y + 0 0 15 -3,-0.1 -25,-3.0 4,-0.1 -22,-0.2 0.324 31.3 107.2-111.7 3.4 51.5 69.5 39.8 98 194 A T S > S- 0 0 0 -27,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.385 86.1-102.9 -74.8 165.1 50.4 69.3 36.1 99 195 A I H > S+ 0 0 0 -24,-2.6 4,-1.9 -27,-0.4 -22,-0.2 0.926 122.2 42.6 -58.2 -47.8 46.9 70.7 35.3 100 196 A E H > S+ 0 0 69 -24,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.915 112.7 53.7 -63.6 -44.1 45.3 67.2 35.1 101 197 A D H > S+ 0 0 28 -25,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.872 108.5 49.2 -60.3 -40.2 47.1 65.9 38.2 102 198 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.893 109.6 51.2 -70.2 -40.3 45.9 68.9 40.3 103 199 A A H X S+ 0 0 1 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.948 113.6 45.8 -55.8 -48.5 42.2 68.4 39.1 104 200 A N H X S+ 0 0 88 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.908 114.0 48.4 -62.5 -43.0 42.5 64.7 40.1 105 201 A L H X S+ 0 0 28 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.901 113.0 46.2 -63.4 -47.2 44.1 65.5 43.4 106 202 A I H X>S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.5 0.938 114.7 48.0 -63.1 -43.2 41.6 68.1 44.4 107 203 A H H X5S+ 0 0 70 -4,-2.4 4,-2.0 -5,-0.3 -2,-0.2 0.921 112.7 48.4 -67.7 -38.8 38.7 65.9 43.4 108 204 A Q H <5S+ 0 0 163 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.909 118.3 39.8 -67.1 -41.7 40.1 62.9 45.3 109 205 A K H <5S+ 0 0 105 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.885 137.4 7.8 -72.8 -39.8 40.7 64.9 48.5 110 206 A Y H <5S- 0 0 72 -4,-2.8 -3,-0.2 1,-0.3 -2,-0.2 0.400 92.4-129.5-130.3 -3.4 37.6 67.1 48.6 111 207 A G << - 0 0 26 -4,-2.0 -1,-0.3 -5,-0.5 -2,-0.1 -0.366 63.2 -2.0 79.9-161.5 35.2 66.0 45.9 112 208 A K - 0 0 94 -2,-0.1 2,-0.2 48,-0.1 48,-0.2 -0.283 63.7-157.2 -67.6 147.1 33.5 68.3 43.3 113 209 A I E - d 0 160A 1 46,-2.8 48,-1.6 43,-0.2 -109,-0.1 -0.743 12.5-157.9-117.2 169.3 34.1 72.0 43.4 114 210 A N E + 0 0 30 -111,-1.7 51,-1.5 -2,-0.2 2,-0.3 0.374 68.2 59.4-132.4 7.4 32.1 74.9 42.0 115 211 A M E -bd 4 165A 8 -112,-1.4 -110,-2.0 49,-0.2 2,-0.4 -0.999 53.0-175.0-142.6 137.0 34.4 77.9 41.5 116 212 A L E -bd 5 166A 0 49,-1.8 51,-2.4 -2,-0.3 2,-0.5 -0.998 2.1-170.7-138.6 127.7 37.5 78.3 39.4 117 213 A V E -bd 6 167A 0 -112,-2.5 -110,-2.8 -2,-0.4 2,-0.7 -0.984 8.9-163.7-125.6 123.3 39.9 81.2 39.2 118 214 A H E +bd 7 168A 1 49,-2.9 51,-0.6 -2,-0.5 -110,-0.1 -0.932 23.7 158.3-102.7 112.9 42.7 81.6 36.6 119 215 A S + 0 0 18 -112,-2.7 2,-0.3 -2,-0.7 -103,-0.2 -0.401 38.4 96.5-134.2 51.0 45.0 84.3 38.0 120 216 A L + 0 0 37 25,-0.1 2,-0.3 49,-0.1 49,-0.2 -0.974 35.6 167.2-146.2 154.9 48.2 83.7 36.3 121 217 A A + 0 0 40 -2,-0.3 2,-0.3 27,-0.0 24,-0.1 -0.960 4.1 179.6-161.3 154.5 50.3 84.7 33.3 122 218 A N + 0 0 52 19,-0.3 23,-0.3 -2,-0.3 22,-0.3 -0.966 8.4 172.6-157.5 153.2 53.8 84.3 32.0 123 219 A A > - 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0 0 48 0, 0.0 -4,-2.4 0, 0.0 -3,-1.3 -0.891 63.8-160.2-128.1 151.8 10.5 87.5 53.8 351 158 B K B -N 345 0D 60 -2,-0.3 -6,-0.2 -6,-0.3 -7,-0.1 -0.947 37.6 -90.9-127.0 151.4 8.3 90.0 51.9 352 159 B M - 0 0 9 -8,-2.9 2,-0.5 -2,-0.3 -42,-0.1 -0.223 31.7-151.1 -60.0 144.2 9.3 93.3 50.1 353 160 B N - 0 0 129 -36,-0.2 -34,-0.7 -43,-0.1 2,-0.6 -0.992 6.5-160.9-118.7 123.1 9.1 96.5 52.1 354 161 B I E -j 319 0C 27 -2,-0.5 -34,-0.1 1,-0.2 3,-0.1 -0.919 5.9-165.7-105.6 116.9 8.4 99.6 50.1 355 162 B L E - 0 0 59 -36,-1.8 2,-0.3 -2,-0.6 -35,-0.2 0.887 67.7 -13.3 -67.0 -41.8 9.3 102.9 51.9 356 163 B D E -j 320 0C 29 -37,-1.5 -35,-2.7 2,-0.0 2,-0.4 -0.990 47.5-146.8-164.2 160.9 7.4 105.2 49.5 357 164 B M E -j 321 0C 14 -2,-0.3 -35,-0.2 -37,-0.2 -37,-0.0 -0.973 26.0-178.0-142.2 114.4 5.6 105.6 46.2 358 165 B L E -j 322 0C 9 -37,-3.4 -35,-3.4 -2,-0.4 2,-0.2 -0.931 31.9-113.9-127.4 136.6 5.8 108.9 44.4 359 166 B P E +j 323 0C 16 0, 0.0 2,-0.3 0, 0.0 -35,-0.2 -0.499 45.7 177.1 -64.8 138.0 4.3 110.3 41.2 360 167 B F - 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