==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 24-JUN-03 1UH5 . COMPND 2 MOLECULE: ENOYL-ACP REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR P.L.SWARNAMUKHI,M.KAPOOR,N.SUROLIA,A.SUROLIA,K.SUGUNA . 574 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24427.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 420 73.2 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 . 5 0.9 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 . 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 . 37 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 189 32.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.1 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 3 1 0 0 0 1 2 4 7 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 . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 96 A N 0 0 133 0, 0.0 28,-0.1 0, 0.0 27,-0.1 0.000 360.0 360.0 360.0 62.5 28.3 77.7 53.4 2 97 A E + 0 0 51 26,-0.4 2,-0.4 1,-0.3 27,-0.1 0.480 360.0 138.4 118.2 5.2 30.1 75.4 51.0 3 98 A D - 0 0 53 25,-0.3 27,-3.0 111,-0.1 2,-0.4 -0.701 26.7-174.9 -87.6 132.3 31.9 77.7 48.5 4 99 A I E -a 30 0A 23 -2,-0.4 111,-1.6 25,-0.2 112,-1.3 -0.991 3.0-168.4-128.9 130.1 35.4 76.9 47.5 5 100 A C E -ab 31 116A 0 25,-3.0 27,-2.5 -2,-0.4 2,-0.6 -0.961 11.1-152.7-122.3 132.5 37.6 79.0 45.2 6 101 A F E -ab 32 117A 0 110,-2.1 112,-2.6 -2,-0.4 2,-0.7 -0.905 11.4-161.4-102.5 119.1 40.9 78.1 43.6 7 102 A I E -ab 33 118A 0 25,-3.1 27,-3.0 -2,-0.6 2,-0.7 -0.881 3.6-161.0-104.6 107.9 43.1 81.2 43.0 8 103 A A E +ab 34 119A 0 110,-2.7 112,-2.5 -2,-0.7 27,-0.1 -0.782 65.8 39.0 -91.4 112.1 45.8 80.5 40.4 9 104 A G + 0 0 24 25,-2.1 2,-0.4 -2,-0.7 8,-0.3 0.755 63.7 141.2 116.7 66.9 48.6 83.0 40.6 10 105 A I + 0 0 9 24,-1.2 26,-0.3 -3,-0.1 -1,-0.2 -0.990 7.9 154.5-137.8 126.9 49.8 84.2 44.0 11 106 A G S S- 0 0 36 -2,-0.4 2,-0.3 1,-0.2 -1,-0.1 0.432 74.1 -13.2-126.6 -7.6 53.4 84.8 45.1 12 107 A D S S- 0 0 50 40,-0.0 -1,-0.2 31,-0.0 3,-0.2 -0.891 75.7 -88.2-169.1-165.1 52.8 87.4 47.8 13 108 A T S S+ 0 0 15 -2,-0.3 -3,-0.0 1,-0.1 209,-0.0 0.192 103.2 78.5-111.3 16.1 50.2 89.7 49.3 14 109 A N S S+ 0 0 98 4,-0.1 -1,-0.1 238,-0.0 2,-0.1 0.461 81.1 76.1-102.6 -3.2 50.8 92.7 47.1 15 110 A G S > S- 0 0 16 -3,-0.2 4,-1.2 207,-0.1 3,-0.1 -0.302 93.5 -96.8 -99.6-173.8 49.0 91.6 44.0 16 111 A Y H > S+ 0 0 33 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.759 115.2 67.6 -74.0 -27.1 45.4 91.3 42.9 17 112 A G H > S+ 0 0 3 -8,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.925 103.1 45.3 -59.1 -44.2 45.2 87.6 43.8 18 113 A W H > S+ 0 0 7 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.919 111.0 52.5 -65.9 -44.0 45.5 88.5 47.5 19 114 A G H X S+ 0 0 0 -4,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.874 110.2 49.1 -59.5 -37.3 43.0 91.3 47.3 20 115 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.914 110.1 51.0 -68.6 -42.2 40.5 88.9 45.7 21 116 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.912 108.5 52.5 -61.2 -43.5 41.2 86.3 48.4 22 117 A K H X S+ 0 0 49 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.937 112.0 44.0 -58.9 -50.1 40.6 88.8 51.2 23 118 A E H X S+ 0 0 14 -4,-1.9 4,-0.6 1,-0.2 3,-0.4 0.889 111.9 51.9 -65.1 -39.9 37.2 89.9 49.8 24 119 A L H ><>S+ 0 0 0 -4,-2.3 5,-1.7 1,-0.2 3,-0.9 0.858 104.4 60.0 -64.0 -32.5 36.0 86.4 49.1 25 120 A S H ><5S+ 0 0 13 -4,-1.9 3,-2.3 1,-0.3 -1,-0.2 0.854 94.1 61.7 -62.9 -36.1 36.9 85.6 52.7 26 121 A K H 3<5S+ 0 0 117 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.780 104.0 51.1 -60.7 -25.3 34.5 88.2 54.0 27 122 A R T <<5S- 0 0 82 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.261 121.6-111.1 -94.3 10.4 31.8 86.0 52.3 28 123 A N T < 5 + 0 0 137 -3,-2.3 2,-0.4 1,-0.2 -26,-0.4 0.830 61.1 159.9 63.6 35.3 33.1 82.9 54.0 29 124 A V < - 0 0 2 -5,-1.7 2,-0.3 -8,-0.1 36,-0.2 -0.746 42.5-122.8 -89.4 131.9 34.5 81.4 50.8 30 125 A K E -a 4 0A 28 -27,-3.0 -25,-3.0 -2,-0.4 2,-0.4 -0.603 31.1-146.5 -75.3 132.3 37.1 78.7 51.4 31 126 A I E -ac 5 66A 0 34,-1.8 36,-2.3 -2,-0.3 37,-1.2 -0.857 19.8-174.8-110.6 135.9 40.3 79.6 49.6 32 127 A I E -ac 6 68A 0 -27,-2.5 -25,-3.1 -2,-0.4 2,-0.4 -0.995 18.5-146.5-123.7 125.0 42.9 77.4 47.9 33 128 A F E -ac 7 69A 0 35,-2.3 37,-3.0 -2,-0.4 2,-0.7 -0.763 3.4-152.3 -96.0 136.6 46.1 79.1 46.5 34 129 A G E -ac 8 70A 1 -27,-3.0 -25,-2.1 -2,-0.4 -24,-1.2 -0.933 22.6-165.2-105.2 114.1 47.9 78.0 43.4 35 130 A I E - c 0 71A 0 35,-3.5 37,-3.0 -2,-0.7 5,-0.1 -0.894 24.7-115.8-112.4 129.9 51.6 79.0 43.8 36 131 A W > - 0 0 114 -2,-0.5 3,-2.2 -26,-0.3 4,-0.3 -0.377 29.8-129.7 -58.1 119.2 54.2 79.1 41.1 37 132 A P G >> S+ 0 0 2 0, 0.0 3,-2.0 0, 0.0 4,-0.6 0.823 100.9 66.9 -40.9 -47.3 56.8 76.5 42.1 38 133 A P G 34 S+ 0 0 62 0, 0.0 4,-0.2 0, 0.0 -2,-0.1 0.768 117.4 26.4 -50.7 -27.0 59.9 78.8 41.8 39 134 A V G <> S+ 0 0 42 -3,-2.2 4,-2.0 2,-0.1 5,-0.2 0.189 94.2 102.3-121.2 15.9 58.6 80.8 44.7 40 135 A Y H <> S+ 0 0 41 -3,-2.0 4,-2.7 -4,-0.3 5,-0.2 0.949 83.2 44.2 -65.4 -51.2 56.6 78.1 46.5 41 136 A N H X S+ 0 0 95 -4,-0.6 4,-2.6 2,-0.2 -1,-0.2 0.902 113.8 50.1 -62.4 -42.4 59.0 77.4 49.3 42 137 A I H > S+ 0 0 106 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.931 111.6 49.1 -62.4 -43.7 59.8 81.0 50.0 43 138 A F H X S+ 0 0 4 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.957 111.8 48.8 -58.1 -50.7 56.1 81.8 50.2 44 139 A M H X S+ 0 0 47 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.881 109.5 53.9 -56.2 -41.0 55.6 78.8 52.6 45 140 A K H X S+ 0 0 42 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.955 110.4 44.4 -60.0 -53.3 58.5 80.1 54.6 46 141 A N H <>S+ 0 0 60 -4,-2.5 5,-2.4 1,-0.2 6,-0.4 0.917 112.3 53.6 -58.4 -44.7 57.1 83.6 55.1 47 142 A Y H ><5S+ 0 0 71 -4,-2.7 3,-1.4 1,-0.2 5,-0.2 0.939 111.6 44.4 -55.7 -50.1 53.6 82.1 55.8 48 143 A K H 3<5S+ 0 0 79 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.905 110.1 55.6 -61.6 -42.3 55.1 79.9 58.6 49 144 A N T 3<5S- 0 0 136 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.436 116.0-116.2 -72.3 2.0 57.1 82.8 60.0 50 145 A G T X 5S+ 0 0 21 -3,-1.4 3,-1.2 -4,-0.3 4,-0.4 0.657 70.6 140.2 72.9 17.1 54.0 84.9 60.3 51 146 A K T 3 S+ 0 0 15 -6,-0.4 4,-1.0 -5,-0.2 -1,-0.2 0.390 79.8 105.2-111.5 1.5 51.5 87.6 56.4 53 148 A D T X4 S+ 0 0 78 -3,-1.2 3,-0.7 1,-0.2 4,-0.3 0.875 83.9 46.7 -49.4 -46.3 49.5 87.5 59.6 54 149 A N G >4 S+ 0 0 146 -4,-0.4 3,-1.3 1,-0.2 -1,-0.2 0.896 109.5 54.4 -65.0 -39.8 48.6 91.2 59.4 55 150 A D G 34 S+ 0 0 58 1,-0.2 -1,-0.2 -4,-0.2 -2,-0.2 0.638 103.7 57.8 -69.2 -13.9 47.6 90.9 55.7 56 151 A M G << S+ 0 0 1 -4,-1.0 8,-2.2 -3,-0.7 -1,-0.2 0.490 79.0 112.3 -95.4 -3.7 45.2 88.1 56.7 57 152 A I E < -G 63 0B 95 -3,-1.3 2,-0.4 -4,-0.3 6,-0.2 -0.490 43.6-177.7 -72.5 136.8 43.2 90.1 59.2 58 153 A I E > -G 62 0B 12 4,-2.8 4,-0.9 2,-0.3 -2,-0.0 -1.000 47.6 -39.7-138.5 134.8 39.6 90.9 58.1 59 154 A D T 4 S- 0 0 89 -2,-0.4 3,-0.3 2,-0.1 -1,-0.1 -0.035 103.8 -39.5 46.5-151.6 37.0 92.9 59.9 60 155 A K T 4 S- 0 0 91 1,-0.2 2,-2.4 -3,-0.1 -2,-0.3 0.766 130.3 -0.2 -70.1-114.6 36.9 92.5 63.6 61 156 A D T 4 S+ 0 0 91 -4,-0.1 2,-0.4 2,-0.0 -1,-0.2 -0.347 105.0 114.5 -77.4 62.4 37.4 89.0 64.9 62 157 A K E < -G 58 0B 45 -2,-2.4 -4,-2.8 -4,-0.9 2,-0.3 -0.993 42.4-169.8-137.8 130.2 37.8 87.4 61.4 63 158 A K E -G 57 0B 134 -2,-0.4 -6,-0.2 -6,-0.2 2,-0.1 -0.887 38.5 -94.0-117.3 147.9 40.9 85.8 59.8 64 159 A M - 0 0 5 -8,-2.2 2,-1.1 -2,-0.3 -42,-0.1 -0.387 37.4-135.8 -60.7 128.6 41.3 84.8 56.2 65 160 A N - 0 0 59 -36,-0.2 -34,-1.8 -2,-0.1 2,-0.8 -0.719 24.1-176.1 -93.3 92.4 40.4 81.1 55.8 66 161 A I E -c 31 0A 31 -2,-1.1 -34,-0.2 1,-0.2 3,-0.1 -0.791 7.0-174.3 -91.9 110.3 43.0 79.5 53.6 67 162 A L E - 0 0 62 -36,-2.3 2,-0.3 -2,-0.8 -35,-0.2 0.936 63.5 -21.7 -68.7 -49.7 42.1 75.9 53.0 68 163 A D E -c 32 0A 35 -37,-1.2 -35,-2.3 2,-0.0 2,-0.4 -0.981 47.7-142.9-158.0 165.9 45.3 74.8 51.2 69 164 A M E -c 33 0A 16 -2,-0.3 -35,-0.2 -37,-0.2 -37,-0.0 -0.976 26.1-179.0-138.4 119.4 48.3 76.1 49.2 70 165 A L E -c 34 0A 11 -37,-3.0 -35,-3.5 -2,-0.4 2,-0.2 -0.924 33.1-109.0-127.1 147.3 49.6 74.1 46.3 71 166 A P E +c 35 0A 15 0, 0.0 2,-0.3 0, 0.0 -35,-0.2 -0.493 44.7 177.5 -69.0 139.1 52.5 74.4 43.8 72 167 A F - 0 0 5 -37,-3.0 2,-0.5 -2,-0.2 27,-0.2 -0.951 19.5-171.7-151.4 124.2 51.0 75.2 40.4 73 168 A D > - 0 0 4 25,-2.7 3,-1.4 -2,-0.3 27,-0.4 -0.951 9.9-162.8-122.3 112.9 52.7 75.9 37.1 74 169 A A T 3 S+ 0 0 11 -2,-0.5 78,-0.1 1,-0.3 -1,-0.1 0.469 83.2 77.2 -70.4 -2.5 50.4 77.0 34.2 75 170 A S T 3 S+ 0 0 38 1,-0.1 2,-0.5 2,-0.0 -1,-0.3 0.723 90.4 60.0 -78.4 -23.3 53.1 76.1 31.7 76 171 A F < - 0 0 19 -3,-1.4 24,-2.7 22,-0.2 -3,-0.2 -0.930 54.6-174.9-115.7 125.6 52.3 72.4 32.0 77 172 A D S S+ 0 0 37 -2,-0.5 24,-2.5 22,-0.2 2,-0.3 0.898 74.6 0.2 -80.8 -43.5 48.9 70.9 31.2 78 173 A T S > S- 0 0 18 22,-0.2 3,-2.1 23,-0.1 4,-0.3 -0.890 80.8 -93.9-140.6 170.4 49.7 67.3 32.2 79 174 A A G > S+ 0 0 54 1,-0.3 3,-1.4 -2,-0.3 -1,-0.0 0.813 119.0 66.3 -55.0 -32.1 52.5 65.2 33.7 80 175 A N G 3 S+ 0 0 155 1,-0.2 -1,-0.3 -4,-0.0 -4,-0.0 0.688 92.9 60.7 -64.5 -19.9 53.5 64.3 30.2 81 176 A D G < S+ 0 0 77 -3,-2.1 2,-0.5 2,-0.1 -1,-0.2 0.539 76.1 109.3 -87.2 -6.9 54.5 67.9 29.4 82 177 A I < - 0 0 46 -3,-1.4 2,-0.1 -4,-0.3 -6,-0.0 -0.598 57.8-153.0 -75.7 119.4 57.2 68.1 32.1 83 178 A D >> - 0 0 70 -2,-0.5 4,-3.0 1,-0.1 3,-1.0 -0.431 25.3-110.3 -88.0 164.5 60.6 68.2 30.5 84 179 A E H 3> S+ 0 0 50 1,-0.3 4,-3.4 2,-0.2 5,-0.2 0.861 115.6 62.9 -61.7 -38.3 63.9 67.1 32.0 85 180 A E H 34 S+ 0 0 76 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.779 115.2 35.1 -58.2 -25.8 65.2 70.6 32.4 86 181 A T H X4 S+ 0 0 20 -3,-1.0 3,-1.4 2,-0.2 6,-0.3 0.875 117.0 49.7 -92.7 -50.5 62.3 71.2 34.7 87 182 A K H 3< S+ 0 0 52 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.876 116.0 45.2 -56.5 -38.7 62.1 67.8 36.4 88 183 A N T 3< S+ 0 0 86 -4,-3.4 -1,-0.3 -5,-0.2 -2,-0.2 0.509 90.6 116.3 -83.2 -5.5 65.8 68.0 37.0 89 184 A N S <> S- 0 0 71 -3,-1.4 4,-2.8 -5,-0.2 5,-0.2 -0.383 71.0-130.5 -66.2 141.2 65.4 71.6 38.2 90 185 A K H > S+ 0 0 87 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.905 106.3 47.6 -58.4 -46.0 66.3 72.1 41.9 91 186 A R H 4 S+ 0 0 25 1,-0.2 -1,-0.2 2,-0.1 4,-0.1 0.792 119.2 38.7 -68.6 -29.4 63.1 74.0 42.6 92 187 A Y H >4 S+ 0 0 21 -6,-0.3 3,-1.6 -3,-0.2 -2,-0.2 0.780 98.8 74.4 -91.4 -30.8 60.8 71.4 40.9 93 188 A N H 3< S+ 0 0 55 -4,-2.8 -2,-0.1 1,-0.3 -3,-0.1 0.882 98.6 47.9 -48.8 -45.4 62.6 68.2 42.0 94 189 A M T 3< S+ 0 0 150 -4,-0.9 -1,-0.3 -5,-0.2 2,-0.3 0.614 107.7 68.4 -74.4 -13.1 61.2 68.6 45.6 95 190 A L < - 0 0 27 -3,-1.6 2,-0.3 -4,-0.1 3,-0.1 -0.712 60.8-173.0-108.7 160.3 57.7 69.2 44.4 96 191 A Q + 0 0 146 -2,-0.3 -3,-0.0 1,-0.1 -2,-0.0 -0.960 56.9 28.3-146.9 162.5 55.1 67.0 42.6 97 192 A N + 0 0 68 -2,-0.3 -1,-0.1 1,-0.1 9,-0.1 0.900 69.6 136.3 52.3 49.9 51.7 67.1 41.0 98 193 A Y + 0 0 10 -3,-0.1 -25,-2.7 4,-0.1 -22,-0.2 0.290 32.3 105.4-108.5 8.5 52.0 70.7 39.9 99 194 A T S > S- 0 0 0 -27,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.457 85.3-104.8 -82.6 164.0 50.6 70.5 36.3 100 195 A I H > S+ 0 0 0 -24,-2.7 4,-1.8 -27,-0.4 -22,-0.2 0.906 120.2 44.9 -56.7 -47.0 47.1 71.9 35.6 101 196 A E H > S+ 0 0 70 -24,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.915 112.8 51.7 -65.5 -41.4 45.5 68.4 35.4 102 197 A D H > S+ 0 0 26 1,-0.2 4,-2.8 -25,-0.2 -2,-0.2 0.897 108.9 49.9 -62.1 -41.6 47.3 67.1 38.5 103 198 A V H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.914 110.0 51.2 -65.0 -41.0 46.2 70.1 40.6 104 199 A A H X S+ 0 0 3 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.932 114.0 43.6 -61.0 -45.6 42.6 69.7 39.5 105 200 A N H X S+ 0 0 86 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.902 114.0 51.4 -66.2 -40.1 42.7 65.9 40.4 106 201 A L H X S+ 0 0 31 -4,-2.8 4,-2.1 2,-0.2 5,-0.2 0.917 111.4 46.1 -62.8 -46.2 44.4 66.7 43.7 107 202 A I H X>S+ 0 0 0 -4,-2.8 4,-3.3 1,-0.2 5,-0.7 0.933 114.6 47.9 -62.8 -46.0 41.9 69.3 44.8 108 203 A H H X5S+ 0 0 72 -4,-2.2 4,-1.3 -5,-0.2 -2,-0.2 0.893 111.3 51.0 -62.1 -40.8 39.0 67.1 43.8 109 204 A Q H <5S+ 0 0 163 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.863 120.0 35.2 -65.6 -36.3 40.6 64.2 45.7 110 205 A K H <5S+ 0 0 109 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.864 137.4 9.3 -87.6 -39.8 41.0 66.2 48.9 111 206 A Y H <5S- 0 0 72 -4,-3.3 -3,-0.2 1,-0.3 2,-0.2 0.461 92.0-129.1-124.8 -1.6 38.0 68.6 49.0 112 207 A G << - 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