==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-JAN-03 1NNU . COMPND 2 MOLECULE: ENOYL-ACYL CARRIER REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR R.PEROZZO,M.KUO,A.S.SIDHU,J.T.VALIYAVEETTIL,R.BITTMAN, . 578 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26626.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 434 75.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 74 12.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.0 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 . 50 8.7 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 . 190 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 2 3 0 0 0 2 3 3 6 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 0 173 0, 0.0 2,-0.3 0, 0.0 27,-0.1 0.000 360.0 360.0 360.0 86.4 30.1 76.1 51.0 2 98 A D - 0 0 64 25,-0.3 27,-2.8 111,-0.1 2,-0.4 -0.581 360.0-166.8 -77.4 134.5 31.7 78.1 48.3 3 99 A I E -a 29 0A 16 -2,-0.3 111,-1.4 25,-0.2 112,-1.4 -0.988 2.4-168.2-123.5 130.4 35.3 77.1 47.3 4 100 A C E -ab 30 115A 0 25,-3.2 27,-2.8 -2,-0.4 2,-0.6 -0.968 10.8-155.8-126.6 125.8 37.4 79.4 45.2 5 101 A F E -ab 31 116A 0 110,-2.0 112,-2.9 -2,-0.5 2,-0.6 -0.861 10.8-163.8 -97.8 123.7 40.7 78.5 43.6 6 102 A I E -ab 32 117A 0 25,-3.1 27,-2.7 -2,-0.6 2,-0.6 -0.937 2.8-164.0-111.0 111.5 42.9 81.5 42.9 7 103 A A E +ab 33 118A 0 110,-2.9 112,-2.7 -2,-0.6 27,-0.1 -0.847 64.9 45.2 -98.2 120.3 45.7 80.8 40.5 8 104 A G + 0 0 25 25,-2.0 2,-0.4 -2,-0.6 8,-0.3 0.759 66.0 138.2 114.2 61.5 48.4 83.5 40.4 9 105 A I + 0 0 8 24,-1.1 26,-0.5 -3,-0.1 -1,-0.2 -0.998 8.2 149.9-136.5 130.7 49.5 84.4 43.9 10 106 A G S S- 0 0 33 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.329 74.0 -11.9-136.2 -3.1 53.1 85.0 45.0 11 107 A D S S- 0 0 36 34,-0.0 -1,-0.3 40,-0.0 3,-0.2 -0.925 74.4 -87.3-173.0-166.6 52.6 87.6 47.7 12 108 A T S S+ 0 0 19 -2,-0.3 -3,-0.0 1,-0.1 209,-0.0 0.287 104.2 77.0-107.8 7.7 50.1 90.0 49.3 13 109 A N S S+ 0 0 93 4,-0.1 -1,-0.1 206,-0.0 2,-0.1 0.373 82.2 77.0 -99.5 3.3 50.8 93.0 47.0 14 110 A G S > S- 0 0 15 -3,-0.2 4,-1.0 207,-0.1 469,-0.1 -0.358 90.9-101.2-104.3-173.0 48.9 91.8 44.0 15 111 A Y H > S+ 0 0 34 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.788 113.5 67.2 -76.9 -32.1 45.3 91.6 42.9 16 112 A G H > S+ 0 0 2 -8,-0.3 4,-2.3 103,-0.2 -1,-0.2 0.901 104.1 45.8 -55.9 -40.8 44.9 87.9 43.7 17 113 A W H > S+ 0 0 7 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.892 110.1 52.5 -69.6 -40.6 45.4 88.8 47.4 18 114 A G H X S+ 0 0 0 -4,-1.0 4,-1.6 1,-0.2 -2,-0.2 0.857 111.7 48.5 -63.0 -32.9 42.9 91.7 47.1 19 115 A I H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.913 111.5 47.8 -72.9 -43.6 40.5 89.2 45.6 20 116 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.920 109.5 53.9 -62.6 -43.8 41.0 86.6 48.3 21 117 A K H X S+ 0 0 42 -4,-2.8 4,-0.6 1,-0.2 -1,-0.2 0.919 111.6 44.6 -57.6 -45.3 40.6 89.1 51.0 22 118 A E H < S+ 0 0 12 -4,-1.6 4,-0.4 -5,-0.2 -1,-0.2 0.814 113.2 51.2 -70.9 -31.5 37.2 90.3 49.7 23 119 A L H ><>S+ 0 0 0 -4,-2.0 3,-2.8 1,-0.2 5,-0.8 0.965 107.2 50.2 -70.2 -52.5 36.0 86.7 49.1 24 120 A S H ><5S+ 0 0 8 -4,-2.7 3,-1.3 1,-0.3 -1,-0.2 0.691 98.3 70.8 -60.3 -14.4 36.8 85.4 52.6 25 121 A K T 3<5S+ 0 0 45 -4,-0.6 -1,-0.3 -5,-0.3 -2,-0.2 0.806 102.8 43.1 -68.7 -28.4 34.9 88.5 53.7 26 122 A R T < 5S- 0 0 76 -3,-2.8 -1,-0.3 -4,-0.4 -2,-0.2 0.019 125.7-104.1-105.2 23.8 31.9 86.6 52.4 27 123 A N T < 5 + 0 0 111 -3,-1.3 2,-0.5 1,-0.2 -25,-0.3 0.835 66.9 151.3 58.6 41.4 33.0 83.3 54.0 28 124 A V < - 0 0 7 -5,-0.8 2,-0.2 -8,-0.2 -25,-0.2 -0.881 48.8-117.4-103.9 133.4 34.2 81.5 50.8 29 125 A K E -a 3 0A 76 -27,-2.8 -25,-3.2 -2,-0.5 2,-0.4 -0.493 31.9-147.0 -68.6 132.3 37.0 78.9 51.2 30 126 A I E -ac 4 65A 0 34,-1.3 36,-1.9 -2,-0.2 37,-1.1 -0.860 18.1-174.7-110.3 135.5 40.1 79.9 49.4 31 127 A I E -ac 5 67A 0 -27,-2.8 -25,-3.1 -2,-0.4 2,-0.3 -0.993 17.5-148.5-123.2 123.2 42.7 77.7 47.7 32 128 A F E -ac 6 68A 0 35,-2.4 37,-2.6 -2,-0.5 2,-0.6 -0.723 3.7-150.8 -93.9 144.2 45.8 79.5 46.4 33 129 A G E -ac 7 69A 0 -27,-2.7 -25,-2.0 -2,-0.3 -24,-1.1 -0.957 21.9-162.7-111.7 109.9 47.7 78.2 43.3 34 130 A I E - c 0 70A 0 35,-3.2 37,-3.5 -2,-0.6 5,-0.1 -0.846 22.4-117.7-104.1 130.2 51.3 79.2 43.8 35 131 A W > - 0 0 113 -26,-0.5 3,-2.2 -2,-0.5 4,-0.4 -0.414 30.2-125.8 -60.4 122.6 53.9 79.4 41.0 36 132 A P G >> S+ 0 0 1 0, 0.0 3,-1.7 0, 0.0 4,-0.6 0.810 103.1 64.3 -38.7 -51.0 56.6 76.8 42.0 37 133 A P G 34 S+ 0 0 31 0, 0.0 4,-0.2 0, 0.0 -2,-0.1 0.729 117.8 27.8 -51.6 -24.8 59.6 79.2 41.8 38 134 A V G <> S+ 0 0 42 -3,-2.2 4,-1.6 2,-0.1 5,-0.1 0.221 94.2 99.4-122.4 12.8 58.2 81.2 44.7 39 135 A Y H <> S+ 0 0 39 -3,-1.7 4,-2.8 -4,-0.4 5,-0.2 0.965 86.7 41.0 -65.2 -55.0 56.2 78.5 46.5 40 136 A N H X S+ 0 0 59 -4,-0.6 4,-2.5 1,-0.2 5,-0.2 0.914 114.9 52.0 -62.5 -41.1 58.7 77.7 49.3 41 137 A I H > S+ 0 0 75 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.855 112.0 48.4 -62.8 -32.2 59.6 81.4 49.7 42 138 A F H X S+ 0 0 1 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.938 111.0 47.9 -72.1 -47.3 55.8 82.0 50.1 43 139 A M H X S+ 0 0 54 -4,-2.8 4,-3.1 2,-0.2 -2,-0.2 0.866 111.5 52.5 -60.4 -37.0 55.3 79.2 52.6 44 140 A K H X S+ 0 0 133 -4,-2.5 4,-2.1 2,-0.2 6,-0.2 0.954 111.2 44.6 -64.0 -51.0 58.3 80.4 54.6 45 141 A N H <>S+ 0 0 46 -4,-2.0 5,-2.2 1,-0.2 6,-0.5 0.823 115.5 50.7 -63.3 -30.2 56.9 84.0 54.7 46 142 A Y H ><5S+ 0 0 84 -4,-2.2 3,-1.5 3,-0.2 5,-0.3 0.932 109.0 49.2 -72.0 -46.9 53.5 82.5 55.6 47 143 A K H 3<5S+ 0 0 181 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.826 107.2 54.4 -63.3 -34.8 54.8 80.3 58.4 48 144 A N T 3<5S- 0 0 95 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.275 117.6-111.6 -84.4 12.6 56.8 83.1 60.1 49 145 A G T X 5S+ 0 0 16 -3,-1.5 3,-1.0 -5,-0.1 4,-0.4 0.684 71.7 141.6 68.4 20.8 53.6 85.2 60.2 50 146 A K T 3 S+ 0 0 13 -6,-0.5 4,-1.1 -5,-0.3 -1,-0.3 0.443 82.5 108.4-105.3 -2.2 51.2 87.9 56.2 52 148 A D T X4 S+ 0 0 76 -3,-1.0 3,-1.1 1,-0.2 4,-0.3 0.865 83.8 40.2 -41.1 -56.0 49.4 87.8 59.6 53 149 A N G >4 S+ 0 0 136 -4,-0.4 3,-2.0 1,-0.3 -1,-0.2 0.918 110.8 58.6 -63.5 -42.2 48.3 91.5 59.5 54 150 A D G 34 S+ 0 0 61 1,-0.3 -1,-0.3 -4,-0.2 -2,-0.2 0.632 102.4 57.3 -61.8 -13.2 47.4 91.2 55.8 55 151 A M G << S+ 0 0 6 -3,-1.1 8,-2.5 -4,-1.1 2,-0.8 0.460 75.5 109.5 -97.9 -3.5 45.0 88.4 56.7 56 152 A I E < -G 62 0B 82 -3,-2.0 2,-0.6 -4,-0.3 6,-0.2 -0.652 64.9-142.4 -78.5 111.7 42.9 90.3 59.1 57 153 A I E > -G 61 0B 0 4,-2.2 4,-1.4 -2,-0.8 3,-0.5 -0.662 24.1-113.9 -78.2 118.5 39.6 90.8 57.4 58 154 A D T 4 S+ 0 0 123 -2,-0.6 2,-1.7 1,-0.3 -1,-0.1 0.646 113.7 65.1 -13.5 -59.2 38.2 94.3 58.3 59 155 A K T 4 S- 0 0 147 1,-0.2 -1,-0.3 -34,-0.0 3,-0.1 0.028 127.5 -96.0 -66.7 32.8 35.3 92.9 60.3 60 156 A D T 4 S+ 0 0 145 -2,-1.7 -2,-0.2 -3,-0.5 -1,-0.2 0.502 87.5 134.3 66.5 2.5 37.8 91.4 62.8 61 157 A K E < -G 57 0B 59 -4,-1.4 -4,-2.2 -5,-0.1 2,-0.4 -0.286 55.3-124.7 -78.0 168.9 37.7 88.1 60.9 62 158 A K E -G 56 0B 103 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.949 27.2-112.4-115.4 134.4 40.7 86.0 59.9 63 159 A M - 0 0 5 -8,-2.5 2,-0.8 -2,-0.4 -42,-0.1 -0.523 30.4-144.8 -67.7 123.9 41.2 85.1 56.3 64 160 A N - 0 0 117 -2,-0.3 -34,-1.3 -36,-0.2 2,-0.8 -0.797 12.2-167.1-100.5 103.9 40.8 81.3 56.0 65 161 A I E -c 30 0A 29 -2,-0.8 -34,-0.2 1,-0.2 3,-0.1 -0.775 4.5-165.3 -89.9 108.7 43.1 79.7 53.5 66 162 A L E - 0 0 57 -36,-1.9 2,-0.3 -2,-0.8 -35,-0.2 0.931 66.9 -24.8 -58.5 -48.7 41.9 76.2 52.8 67 163 A D E -c 31 0A 36 -37,-1.1 -35,-2.4 -3,-0.1 2,-0.4 -0.987 48.3-140.2-162.1 164.3 45.1 75.1 51.1 68 164 A M E -c 32 0A 12 -2,-0.3 -35,-0.2 -37,-0.2 -37,-0.0 -0.971 26.1-176.6-136.2 117.2 48.1 76.4 49.1 69 165 A L E -c 33 0A 16 -37,-2.6 -35,-3.2 -2,-0.4 2,-0.1 -0.901 32.3-111.6-121.6 143.1 49.4 74.3 46.2 70 166 A P E +c 34 0A 14 0, 0.0 2,-0.3 0, 0.0 -35,-0.2 -0.507 47.0 175.5 -67.2 141.0 52.3 74.6 43.9 71 167 A F - 0 0 6 -37,-3.5 2,-0.5 -2,-0.1 27,-0.2 -0.940 23.4-170.2-155.3 127.4 50.8 75.4 40.4 72 168 A D > - 0 0 7 25,-2.6 3,-1.7 -2,-0.3 27,-0.5 -0.937 9.7-160.3-123.7 109.5 52.3 76.2 37.0 73 169 A A T 3 S+ 0 0 9 -2,-0.5 78,-0.1 1,-0.3 -1,-0.1 0.553 85.4 70.7 -64.5 -8.5 49.9 77.4 34.3 74 170 A S T 3 S+ 0 0 32 1,-0.1 2,-0.5 2,-0.0 -1,-0.3 0.509 89.2 68.6 -88.5 -2.6 52.4 76.6 31.5 75 171 A F < - 0 0 16 -3,-1.7 24,-2.5 22,-0.2 25,-0.2 -0.951 54.5-176.4-120.9 114.4 52.0 72.8 32.0 76 172 A D S S- 0 0 36 -2,-0.5 24,-2.0 22,-0.2 2,-0.3 0.908 70.0 -0.7 -73.6 -43.2 48.7 71.2 31.1 77 173 A T S > S- 0 0 14 22,-0.2 3,-1.8 23,-0.1 4,-0.3 -0.895 79.4 -91.1-142.9 172.7 49.5 67.7 32.2 78 174 A A G > S+ 0 0 53 1,-0.3 3,-1.8 -2,-0.3 -1,-0.1 0.892 119.4 55.9 -51.3 -50.6 52.2 65.5 33.7 79 175 A N G 3 S+ 0 0 144 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.0 0.271 95.1 70.6 -73.3 17.9 53.8 64.5 30.4 80 176 A D G < S+ 0 0 71 -3,-1.8 2,-0.7 2,-0.1 -1,-0.3 0.506 70.1 106.3-105.3 -10.7 54.2 68.1 29.5 81 177 A I < - 0 0 37 -3,-1.8 2,-0.1 -4,-0.3 -6,-0.0 -0.608 64.2-145.4 -75.8 113.5 57.0 68.7 32.0 82 178 A D >> - 0 0 70 -2,-0.7 4,-3.0 1,-0.1 3,-0.7 -0.428 22.5-110.1 -78.5 153.9 60.3 68.9 30.1 83 179 A E H 3> S+ 0 0 152 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.764 114.4 61.7 -53.0 -31.8 63.6 67.6 31.6 84 180 A E H 3> S+ 0 0 161 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.931 115.9 30.5 -64.0 -44.6 65.0 71.1 32.1 85 181 A T H <4 S+ 0 0 25 -3,-0.7 3,-0.3 2,-0.2 6,-0.3 0.826 112.3 66.6 -80.5 -33.7 62.2 72.1 34.5 86 182 A K H < S+ 0 0 124 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.750 111.4 35.1 -58.1 -25.4 61.9 68.5 35.7 87 183 A N H < S+ 0 0 101 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.561 88.0 123.2-106.0 -13.2 65.4 68.8 37.2 88 184 A N >X - 0 0 61 -4,-0.6 4,-1.5 -3,-0.3 3,-0.6 -0.197 68.9-124.7 -52.7 138.4 65.2 72.5 38.3 89 185 A K H 3> S+ 0 0 158 1,-0.2 4,-0.6 2,-0.2 -1,-0.1 0.844 109.7 52.4 -52.8 -39.8 65.9 73.0 42.0 90 186 A R H 34 S+ 0 0 102 1,-0.2 -1,-0.2 2,-0.1 -50,-0.1 0.816 116.3 37.7 -70.4 -31.9 62.6 74.8 42.5 91 187 A Y H X4 S+ 0 0 21 -3,-0.6 3,-1.0 -6,-0.3 -1,-0.2 0.514 97.3 84.3 -97.6 -6.8 60.5 72.1 40.9 92 188 A N H 3< S+ 0 0 98 -4,-1.5 -2,-0.1 1,-0.2 -3,-0.1 0.982 91.8 40.7 -59.8 -64.5 62.4 69.1 42.2 93 189 A M T 3< S+ 0 0 136 -4,-0.6 2,-0.3 2,-0.0 -1,-0.2 0.229 109.4 81.0 -73.5 19.1 60.9 68.6 45.6 94 190 A L < + 0 0 24 -3,-1.0 2,-0.3 3,-0.0 3,-0.1 -0.939 52.4 172.1-127.2 149.3 57.4 69.3 44.2 95 191 A Q + 0 0 150 -2,-0.3 -3,-0.0 1,-0.1 -2,-0.0 -0.942 55.4 38.7-147.2 165.5 54.9 67.2 42.2 96 192 A N + 0 0 73 -2,-0.3 -1,-0.1 1,-0.1 9,-0.1 0.903 68.5 132.4 59.1 45.1 51.4 67.4 40.9 97 193 A Y + 0 0 9 -3,-0.1 -25,-2.6 4,-0.1 2,-0.2 0.100 33.9 106.9-113.3 22.3 51.7 71.1 39.9 98 194 A T S > S- 0 0 0 -27,-0.2 4,-2.8 1,-0.1 5,-0.4 -0.661 84.9-105.6 -96.3 158.1 50.2 70.9 36.4 99 195 A I H > S+ 0 0 0 -24,-2.5 4,-1.4 -27,-0.5 -23,-0.2 0.885 121.5 44.5 -48.9 -45.3 46.8 72.2 35.6 100 196 A E H > S+ 0 0 68 -24,-2.0 4,-2.2 -25,-0.2 -1,-0.2 0.917 113.0 50.4 -68.4 -42.7 45.3 68.7 35.4 101 197 A D H > S+ 0 0 26 1,-0.2 4,-3.5 2,-0.2 -2,-0.2 0.928 111.0 46.5 -63.5 -45.2 47.0 67.5 38.5 102 198 A V H X S+ 0 0 1 -4,-2.8 4,-3.0 2,-0.2 5,-0.2 0.847 110.1 56.0 -67.3 -29.5 46.0 70.3 40.8 103 199 A A H X S+ 0 0 2 -4,-1.4 4,-2.3 -5,-0.4 -1,-0.2 0.945 114.4 38.8 -63.7 -46.7 42.4 70.0 39.4 104 200 A N H X S+ 0 0 90 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.903 114.2 55.1 -67.1 -43.4 42.5 66.3 40.5 105 201 A L H X S+ 0 0 28 -4,-3.5 4,-1.9 1,-0.2 -2,-0.2 0.938 112.3 43.1 -55.7 -49.1 44.3 67.2 43.7 106 202 A I H X>S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 5,-0.7 0.916 113.4 50.8 -65.1 -44.8 41.6 69.7 44.6 107 203 A H H X5S+ 0 0 84 -4,-2.3 4,-1.4 -5,-0.2 -2,-0.2 0.921 111.3 49.3 -59.4 -44.1 38.8 67.4 43.6 108 204 A Q H <5S+ 0 0 161 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.873 119.8 34.7 -64.4 -40.7 40.2 64.6 45.7 109 205 A K H <5S+ 0 0 115 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.840 138.2 9.7 -86.3 -35.4 40.7 66.6 48.9 110 206 A Y H <5S- 0 0 75 -4,-2.8 -3,-0.2 1,-0.3 2,-0.2 0.422 91.3-135.8-127.4 -1.3 37.8 69.1 48.9 111 207 A G << + 0 0 24 -4,-1.4 -1,-0.3 -5,-0.7 2,-0.2 -0.512 60.0 0.5 83.1-149.0 35.4 68.0 46.1 112 208 A K - 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0 0 80 -48,-2.0 3,-1.1 -2,-0.4 -2,-0.1 -0.327 42.5 -80.8 -77.0 161.1 25.9 112.9 49.6 392 258 B P E 3 S+ 0 0 93 0, 0.0 46,-0.2 0, 0.0 47,-0.2 -0.285 117.0 26.7 -60.6 150.8 29.5 112.4 48.4 393 259 B Q E 3 S+ 0 0 82 45,-1.4 46,-0.2 44,-0.6 45,-0.1 0.688 87.8 151.3 69.4 18.0 30.2 109.0 46.9 394 260 B S E < - 0 0 2 -3,-1.1 46,-2.2 43,-0.3 2,-0.4 -0.284 37.1-132.3 -72.2 168.6 26.5 108.6 45.9 395 261 B S E -kl 345 440C 1 -51,-1.8 -49,-2.1 160,-0.2 2,-0.4 -0.978 17.6-168.8-131.7 141.7 25.7 106.4 42.9 396 262 B I E +kl 346 441C 1 44,-1.8 46,-2.2 -2,-0.4 2,-0.3 -0.966 8.6 176.1-127.9 140.8 23.5 107.0 39.9 397 263 B I E -kl 347 442C 0 -51,-2.2 -49,-3.1 -2,-0.4 2,-0.3 -0.989 7.4-174.7-143.6 155.5 22.3 104.5 37.2 398 264 B S E -kl 348 443C 0 44,-1.1 46,-3.0 -2,-0.3 2,-0.4 -0.858 27.7-110.5-137.8 171.2 20.0 104.4 34.2 399 265 B L E + l 0 444C 17 -51,-0.8 2,-0.2 -2,-0.3 46,-0.2 -0.914 35.2 170.5-111.7 134.0 18.9 101.7 31.8 400 266 B T E - l 0 445C 6 44,-3.2 46,-1.8 -2,-0.4 2,-0.3 -0.720 22.0-131.9-128.3-179.2 19.9 101.5 28.2 401 267 B Y > - 0 0 47 -2,-0.2 3,-1.8 44,-0.2 4,-0.2 -0.999 23.5-117.9-142.7 140.0 19.5 98.9 25.4 402 268 B H G >> S+ 0 0 44 44,-0.4 4,-2.4 -2,-0.3 3,-1.5 0.540 98.7 88.3 -50.8 -12.8 22.0 97.5 22.9 403 269 B A G 34 S+ 0 0 6 1,-0.3 -1,-0.3 2,-0.2 5,-0.3 0.599 78.1 67.1 -66.1 -9.2 20.0 99.0 20.0 404 270 B S G <4 S+ 0 0 22 -3,-1.8 -1,-0.3 1,-0.1 -2,-0.2 0.796 111.8 29.9 -78.3 -31.1 22.2 102.0 20.5 405 271 B Q T <4 S+ 0 0 100 -3,-1.5 2,-0.3 1,-0.2 -2,-0.2 0.768 131.1 27.9 -97.4 -35.0 25.3 100.1 19.4 406 272 B K S < S- 0 0 137 -4,-2.4 2,-0.3 2,-0.0 -1,-0.2 -0.934 90.7-102.4-127.4 151.7 23.7 97.6 16.9 407 273 B V + 0 0 128 -2,-0.3 -3,-0.1 -3,-0.1 -4,-0.1 -0.564 31.1 179.3 -82.8 132.5 20.6 98.0 14.9 408 274 B V > - 0 0 32 -2,-0.3 3,-1.5 -5,-0.3 2,-0.2 -0.984 28.1-133.7-126.8 114.0 17.4 96.3 15.9 409 275 B P T 3 S+ 0 0 96 0, 0.0 50,-0.1 0, 0.0 3,-0.1 -0.515 91.1 41.1 -67.4 137.3 14.6 97.2 13.4 410 276 B G T 3 S+ 0 0 13 -2,-0.2 2,-1.5 49,-0.1 114,-0.1 0.108 82.1 103.2 111.7 -22.2 11.4 98.1 15.3 411 277 B Y < > + 0 0 24 -3,-1.5 5,-0.7 113,-0.0 3,-0.2 -0.593 59.9 141.3 -91.4 71.8 13.2 100.2 17.9 412 278 B G T > 5 + 0 0 3 -2,-1.5 3,-1.3 -56,-1.1 -53,-0.2 -0.004 21.5 79.2 -99.9-156.5 12.2 103.5 16.3 413 279 B G T 3 5S- 0 0 0 -55,-1.7 -42,-0.3 -58,-0.4 -58,-0.3 0.493 122.4 -65.0 71.7 4.2 11.0 107.0 17.1 414 280 B G T 3>5S+ 0 0 0 -56,-0.2 4,-2.5 -3,-0.2 -1,-0.3 0.669 102.0 130.4 90.5 18.1 14.6 107.9 17.9 415 281 B M H <>5S+ 0 0 15 -3,-1.3 4,-2.3 2,-0.2 5,-0.2 0.885 74.9 50.5 -69.6 -38.3 14.8 105.5 20.8 416 282 B S H > S+ 0 0 22 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.935 110.1 50.9 -64.4 -47.4 19.3 107.7 19.1 418 284 B A H X S+ 0 0 1 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.859 110.6 48.0 -59.7 -39.7 18.2 108.5 22.7 419 285 B K H X S+ 0 0 12 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.872 109.8 52.9 -70.8 -35.8 20.0 105.4 24.1 420 286 B A H X S+ 0 0 39 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.957 113.3 43.9 -62.3 -47.6 23.2 106.3 22.1 421 287 B A H X S+ 0 0 29 -4,-2.6 4,-3.7 1,-0.2 5,-0.3 0.915 112.0 53.4 -61.9 -44.3 23.1 109.8 23.6 422 288 B L H X S+ 0 0 1 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.907 110.2 46.5 -58.1 -45.5 22.3 108.4 27.1 423 289 B E H X S+ 0 0 5 -4,-2.5 4,-1.0 2,-0.2 -1,-0.2 0.936 115.8 46.1 -63.9 -44.4 25.3 106.0 27.0 424 290 B S H >X S+ 0 0 50 -4,-2.3 4,-1.7 1,-0.2 3,-0.6 0.918 112.5 49.8 -64.3 -43.9 27.5 108.8 25.8 425 291 B D H 3X S+ 0 0 42 -4,-3.7 4,-2.6 1,-0.2 5,-0.2 0.781 100.8 64.9 -66.4 -26.6 26.2 111.3 28.4 426 292 B T H 3X S+ 0 0 0 -4,-1.7 4,-1.5 -5,-0.3 -1,-0.2 0.893 105.5 45.1 -63.6 -35.8 26.8 108.7 31.1 427 293 B R H S+ 0 0 8 -4,-3.2 6,-2.1 3,-0.2 4,-1.5 0.857 115.8 48.3 -74.2 -36.0 30.1 114.3 38.7 434 300 B G H X5S+ 0 0 1 -4,-1.1 4,-1.0 -5,-0.4 44,-0.3 0.951 117.2 39.4 -69.1 -50.3 33.3 112.4 39.6 435 301 B R H <5S+ 0 0 38 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.929 127.8 31.1 -65.5 -48.9 35.6 115.3 39.6 436 302 B N H <5S+ 0 0 109 -4,-1.8 -3,-0.2 -5,-0.3 -2,-0.2 0.871 136.8 15.6 -81.5 -40.2 33.2 117.9 41.2 437 303 B Y H <5S- 0 0 105 -4,-1.5 -44,-0.6 -5,-0.4 -43,-0.3 0.469 88.8-120.4-118.2 -1.4 31.1 115.8 43.5 438 304 B N << + 0 0 75 -4,-1.0 -45,-1.4 -5,-0.6 2,-0.3 0.876 67.1 142.7 63.5 34.4 32.7 112.4 44.0 439 305 B I - 0 0 1 -6,-2.1 2,-0.3 -46,-0.2 -1,-0.2 -0.842 41.2-143.3-110.8 145.7 29.6 110.8 42.5 440 306 B R E -l 395 0C 10 -46,-2.2 -44,-1.8 -2,-0.3 2,-0.3 -0.752 13.7-174.5-107.5 155.9 29.4 107.8 40.2 441 307 B I E +l 396 0C 0 -2,-0.3 123,-3.4 -46,-0.2 2,-0.3 -0.946 10.3 161.0-152.1 126.4 27.1 107.2 37.3 442 308 B N E -l 397 0C 0 -46,-2.2 -44,-1.1 -2,-0.3 2,-0.4 -0.857 25.3-135.6-135.5 169.9 26.8 104.0 35.2 443 309 B T E -lm 398 566C 0 122,-3.0 124,-2.2 -2,-0.3 2,-0.6 -0.998 10.0-139.0-135.4 138.8 24.2 102.6 32.8 444 310 B I E -lm 399 567C 0 -46,-3.0 -44,-3.2 -2,-0.4 2,-1.0 -0.849 5.8-151.9 -99.2 123.3 22.9 99.1 32.5 445 311 B S E -lm 400 568C 1 122,-2.5 124,-2.4 -2,-0.6 -44,-0.2 -0.820 29.1-162.5 -92.7 102.5 22.2 97.7 29.1 446 312 B A E - m 0 569C 9 -46,-1.8 -44,-0.4 -2,-1.0 124,-0.2 -0.475 13.4-123.1 -90.2 158.1 19.4 95.2 29.8 447 313 B G - 0 0 8 122,-1.5 2,-0.2 1,-0.2 -1,-0.1 -0.191 55.7 -54.8 -83.4-175.8 18.1 92.3 27.9 448 314 B P + 0 0 18 0, 0.0 2,-0.4 0, 0.0 94,-0.2 -0.391 54.6 177.0 -68.7 133.3 14.4 91.9 26.8 449 315 B L - 0 0 26 -2,-0.2 2,-2.4 -3,-0.1 5,-0.2 -1.000 35.3-124.8-135.7 132.3 11.7 92.1 29.5 450 316 B K + 0 0 106 -2,-0.4 2,-0.1 4,-0.1 76,-0.0 -0.422 52.8 157.6 -78.2 69.0 8.0 91.9 28.8 451 317 B S > - 0 0 25 -2,-2.4 4,-0.9 1,-0.1 -207,-0.1 -0.425 58.7-101.4 -87.2 167.4 7.2 95.2 30.5 452 318 B R H >> S+ 0 0 168 1,-0.2 3,-0.9 2,-0.2 4,-0.6 0.920 124.5 47.5 -54.9 -46.2 4.1 97.2 29.8 453 319 B A H >> S+ 0 0 63 1,-0.2 3,-1.6 2,-0.2 4,-0.5 0.872 98.4 68.6 -64.3 -38.3 6.1 99.6 27.7 454 320 B A H >4 S+ 0 0 10 1,-0.3 3,-0.8 2,-0.2 71,-0.4 0.786 94.9 58.5 -51.7 -29.4 7.8 96.8 25.8 455 321 B T H << S+ 0 0 73 -4,-0.9 -1,-0.3 -3,-0.9 -2,-0.2 0.808 89.2 70.9 -72.1 -29.9 4.4 96.1 24.2 456 322 B A H << S+ 0 0 53 -3,-1.6 2,-2.8 -4,-0.6 -1,-0.2 0.735 74.0 92.0 -59.0 -21.5 4.1 99.6 22.8 457 323 B I << - 0 0 22 -3,-0.8 2,-1.8 -4,-0.5 67,-1.0 -0.373 62.4-176.6 -75.5 66.0 6.9 98.6 20.4 458 324 B N 0 0 103 -2,-2.8 -1,-0.1 65,-0.1 -2,-0.1 -0.471 360.0 360.0 -68.5 84.9 4.4 97.5 17.7 459 325 B K 0 0 133 -2,-1.8 65,-0.4 -50,-0.1 66,-0.1 -0.933 360.0 360.0-167.8 360.0 6.8 96.1 15.2 460 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 461 366 C Y 0 0 159 0, 0.0 4,-0.3 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 47.8 60.9 106.4 37.6 462 367 C T > - 0 0 42 -233,-0.5 4,-1.3 3,-0.1 3,-0.5 0.579 360.0 -97.2 71.2 139.7 59.4 103.2 36.3 463 368 C F H > S+ 0 0 18 -236,-0.8 4,-2.1 1,-0.2 3,-0.2 0.832 118.4 53.7 -50.2 -46.3 56.3 102.5 34.1 464 369 C I H > S+ 0 0 9 -237,-0.5 4,-2.6 -240,-0.4 -1,-0.2 0.861 105.2 53.5 -65.0 -36.1 54.0 101.6 37.0 465 370 C D H > S+ 0 0 48 -3,-0.5 4,-1.7 -4,-0.3 -1,-0.2 0.821 109.1 50.1 -68.4 -29.7 54.7 104.8 38.8 466 371 C Y H X S+ 0 0 130 -4,-1.3 4,-2.8 -3,-0.2 -2,-0.2 0.941 112.1 46.7 -71.2 -48.0 53.8 106.8 35.7 467 372 C A H X S+ 0 0 10 -4,-2.1 4,-3.0 2,-0.2 -2,-0.2 0.921 114.0 46.8 -59.9 -47.8 50.5 105.0 35.2 468 373 C I H X S+ 0 0 35 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.910 114.1 48.4 -61.9 -42.1 49.5 105.3 38.8 469 374 C E H X S+ 0 0 82 -4,-1.7 4,-1.1 -5,-0.2 -2,-0.2 0.929 114.0 46.0 -63.2 -46.3 50.4 109.0 38.9 470 375 C Y H X S+ 0 0 64 -4,-2.8 4,-2.5 1,-0.2 3,-0.4 0.908 111.3 52.6 -64.1 -42.6 48.5 109.6 35.6 471 376 C S H X S+ 0 0 3 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.887 108.3 50.0 -62.7 -39.8 45.5 107.6 36.8 472 377 C E H < S+ 0 0 79 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.732 116.7 41.0 -73.4 -21.6 45.2 109.6 40.1 473 378 C K H < S+ 0 0 129 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.815 126.5 26.7 -94.7 -33.5 45.3 112.9 38.3 474 379 C Y H < S+ 0 0 39 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.606 88.5 104.2-108.8 -12.2 43.2 112.4 35.2 475 380 C A S < S- 0 0 0 -4,-1.7 36,-0.2 -5,-0.4 35,-0.1 -0.350 80.5-114.7 -68.3 152.7 40.6 109.6 36.0 476 381 C P S S+ 0 0 0 0, 0.0 2,-0.7 0, 0.0 -38,-0.2 0.874 111.0 50.8 -53.6 -40.0 37.0 110.8 36.7 477 382 C L S S- 0 0 3 33,-1.5 2,-1.6 32,-0.1 -2,-0.2 -0.903 78.4-156.5-103.3 110.3 37.4 109.6 40.3 478 383 C R + 0 0 144 -2,-0.7 2,-0.3 -44,-0.3 -6,-0.1 -0.621 51.4 113.5 -88.8 80.3 40.6 111.0 41.9 479 384 C Q S S- 0 0 30 -2,-1.6 2,-0.3 -8,-0.2 -4,-0.1 -0.912 74.9 -87.1-141.7 165.7 41.1 108.4 44.5 480 385 C K - 0 0 148 -2,-0.3 2,-0.6 1,-0.0 30,-0.1 -0.631 39.5-131.7 -79.0 131.5 43.7 105.6 45.2 481 386 C L - 0 0 15 -2,-0.3 2,-0.3 -263,-0.2 -1,-0.0 -0.768 26.5-161.7 -87.1 119.3 42.9 102.4 43.5 482 387 C L >> - 0 0 74 -2,-0.6 3,-1.9 1,-0.1 4,-1.1 -0.727 29.6-123.1-102.7 151.4 43.2 99.5 45.9 483 388 C S H 3> S+ 0 0 23 -2,-0.3 4,-1.7 1,-0.3 -1,-0.1 0.785 114.8 60.4 -61.3 -23.9 43.5 95.8 45.2 484 389 C T H 3> S+ 0 0 35 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.657 92.5 64.9 -78.8 -13.5 40.4 95.4 47.2 485 390 C D H <> S+ 0 0 7 -3,-1.9 4,-1.2 2,-0.2 -1,-0.2 0.937 109.2 38.9 -70.3 -45.2 38.4 97.6 44.9 486 391 C I H X S+ 0 0 0 -4,-1.1 4,-2.9 1,-0.2 -2,-0.2 0.871 113.1 61.0 -68.2 -34.8 39.0 95.0 42.2 487 392 C G H X S+ 0 0 0 -4,-1.7 4,-2.8 1,-0.2 -2,-0.2 0.898 102.6 47.2 -58.8 -45.3 38.4 92.4 44.9 488 393 C S H X S+ 0 0 8 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.831 113.8 48.9 -68.7 -31.0 34.9 93.5 45.7 489 394 C V H X S+ 0 0 1 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.918 111.3 49.2 -73.7 -41.8 34.0 93.6 42.0 490 395 C A H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 5,-0.2 0.970 109.1 53.9 -56.9 -53.2 35.5 90.1 41.5 491 396 C S H X S+ 0 0 1 -4,-2.8 4,-0.6 1,-0.2 -1,-0.2 0.856 109.6 47.6 -49.0 -42.8 33.5 88.9 44.5 492 397 C F H >< S+ 0 0 6 -4,-1.5 3,-0.7 1,-0.2 6,-0.5 0.894 111.4 48.9 -69.3 -41.0 30.3 90.2 43.0 493 398 C L H 3< S+ 0 0 2 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.737 109.8 54.0 -70.6 -22.1 31.0 88.6 39.5 494 399 C L H 3< S+ 0 0 6 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.620 99.7 78.1 -87.0 -12.3 31.8 85.3 41.2 495 400 C S S X< S- 0 0 21 -3,-0.7 3,-1.4 -4,-0.6 -3,-0.0 -0.442 93.8-107.7 -94.5 168.5 28.5 85.2 43.1 496 401 C R G > S+ 0 0 140 1,-0.3 3,-1.8 -2,-0.1 4,-0.1 0.644 106.4 85.1 -67.5 -14.9 25.0 84.3 41.9 497 402 C E G 3 S+ 0 0 82 1,-0.3 -1,-0.3 -5,-0.1 3,-0.2 0.798 92.2 46.8 -57.1 -29.3 24.1 88.0 42.1 498 403 C S G X + 0 0 0 -3,-1.4 3,-2.2 -6,-0.5 -1,-0.3 -0.105 69.4 135.4-106.3 35.8 25.5 88.4 38.6 499 404 C R T < S+ 0 0 57 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.682 71.9 53.7 -57.3 -19.4 23.8 85.4 37.0 500 405 C A T 3 S+ 0 0 2 -3,-0.2 71,-2.0 46,-0.2 70,-0.8 0.308 92.7 85.5-100.2 8.4 22.9 87.5 33.9 501 406 C I < + 0 0 2 -3,-2.2 2,-0.3 68,-0.2 68,-0.1 -0.938 48.8 140.3-114.4 129.0 26.4 88.7 33.2 502 407 C T + 0 0 0 -2,-0.5 -290,-0.2 66,-0.2 73,-0.2 -0.956 56.5 24.6-164.0 146.9 28.9 86.6 31.1 503 408 C G S S+ 0 0 3 -292,-3.4 2,-0.2 -2,-0.3 -291,-0.2 0.696 89.2 136.0 72.0 20.6 31.5 87.1 28.4 504 409 C Q - 0 0 19 -293,-0.3 -291,-2.6 -308,-0.1 2,-0.6 -0.632 54.7-143.2-104.0 159.2 32.0 90.7 29.6 505 410 C T E -f 213 0A 33 -2,-0.2 2,-0.5 -293,-0.2 -291,-0.2 -0.975 24.7-163.5-116.4 107.3 35.0 92.9 30.2 506 411 C I E -f 214 0A 9 -293,-2.2 -291,-3.0 -2,-0.6 2,-0.5 -0.849 12.1-136.1 -98.1 129.6 34.1 95.0 33.2 507 412 C Y E +f 215 0A 28 -2,-0.5 2,-0.4 -293,-0.2 56,-0.2 -0.738 25.7 173.3 -89.6 125.1 36.3 98.1 33.8 508 413 C V E +f 216 0A 0 -293,-2.3 -291,-1.4 -2,-0.5 54,-0.2 -0.785 42.6 112.6-128.6 82.2 37.4 98.8 37.4 509 414 C D S > S- 0 0 10 52,-0.8 3,-2.4 -2,-0.4 53,-0.1 -0.095 95.4 -95.4-146.4 33.9 39.8 101.7 36.8 510 415 C N T 3 S- 0 0 0 51,-1.8 -33,-1.5 1,-0.3 52,-0.2 0.677 80.3 -69.3 55.0 15.6 38.1 104.7 38.5 511 416 C G T > S+ 0 0 0 50,-0.5 3,-2.4 -35,-0.2 4,-0.4 0.472 94.6 138.5 85.1 2.9 36.8 105.4 35.0 512 417 C L G X + 0 0 41 -3,-2.4 3,-2.2 1,-0.3 -2,-0.1 0.868 63.5 69.0 -47.2 -40.9 40.1 106.4 33.4 513 418 C N G 3 S+ 0 0 36 1,-0.3 -1,-0.3 -4,-0.1 -3,-0.1 0.695 89.9 61.3 -55.2 -21.1 39.2 104.4 30.3 514 419 C I G < S+ 0 0 32 -3,-2.4 -1,-0.3 49,-0.2 -2,-0.2 0.636 86.0 95.7 -83.5 -10.6 36.5 106.9 29.3 515 420 C M < + 0 0 45 -3,-2.2 -40,-0.0 -4,-0.4 -87,-0.0 -0.460 40.4 171.8 -80.9 151.1 38.9 109.8 29.0 516 421 C F S S+ 0 0 178 1,-0.4 -1,-0.2 -2,-0.1 -2,-0.0 0.647 70.9 26.9-116.7 -70.5 40.4 110.9 25.7 517 422 C L S S- 0 0 125 1,-0.0 -1,-0.4 2,-0.0 2,-0.1 -0.854 83.5-125.2-101.7 129.8 42.2 114.2 26.2 518 423 C P - 0 0 51 0, 0.0 -44,-0.1 0, 0.0 -43,-0.0 -0.396 14.2-126.5 -71.7 150.6 43.6 115.0 29.7 519 424 C D 0 0 76 -45,-0.1 -45,-0.1 -2,-0.1 -2,-0.0 0.974 360.0 360.0 -58.8 -60.6 42.6 118.3 31.4 520 425 C D 0 0 164 -47,-0.1 -47,-0.0 -3,-0.0 0, 0.0 -0.367 360.0 360.0-104.5 360.0 46.1 119.4 32.1 521 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 522 366 D Y 0 0 169 0, 0.0 4,-0.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 40.2 3.2 88.5 17.8 523 367 D T > - 0 0 54 3,-0.1 4,-1.0 2,-0.1 3,-0.1 0.447 360.0 -91.8 67.4 154.1 5.0 91.8 18.7 524 368 D F H > S+ 0 0 21 -67,-1.0 4,-2.7 -65,-0.4 3,-0.5 0.893 118.6 57.0 -63.5 -46.6 8.6 92.8 18.9 525 369 D I H > S+ 0 0 9 -71,-0.4 4,-2.6 1,-0.2 5,-0.2 0.841 104.1 52.6 -59.5 -35.4 9.1 92.0 22.5 526 370 D D H > S+ 0 0 45 -4,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.833 111.8 46.9 -69.8 -30.8 8.0 88.4 22.1 527 371 D Y H X S+ 0 0 124 -4,-1.0 4,-2.6 -3,-0.5 5,-0.2 0.910 112.0 50.7 -74.2 -43.1 10.6 88.0 19.3 528 372 D A H X S+ 0 0 11 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.930 114.2 43.5 -58.7 -48.8 13.3 89.7 21.4 529 373 D I H X S+ 0 0 33 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.932 115.0 47.7 -64.2 -48.4 12.6 87.4 24.4 530 374 D E H X S+ 0 0 86 -4,-1.9 4,-0.8 1,-0.2 -1,-0.2 0.906 113.4 48.6 -60.9 -41.8 12.4 84.2 22.4 531 375 D Y H X S+ 0 0 64 -4,-2.6 4,-1.7 1,-0.2 5,-0.3 0.837 111.3 50.8 -67.4 -34.0 15.5 85.0 20.4 532 376 D S H X S+ 0 0 4 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.898 109.0 50.1 -71.1 -40.2 17.4 85.8 23.6 533 377 D E H < S+ 0 0 66 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.626 115.7 43.7 -75.1 -11.5 16.4 82.5 25.3 534 378 D K H < S+ 0 0 119 -4,-0.8 -2,-0.2 -3,-0.2 -1,-0.2 0.747 125.9 24.4-102.4 -29.3 17.5 80.5 22.3 535 379 D Y H < S+ 0 0 46 -4,-1.7 -3,-0.2 -5,-0.1 -2,-0.2 0.602 87.3 110.9-114.3 -13.6 20.8 82.1 21.4 536 380 D A S < S- 0 0 0 -4,-1.8 36,-0.2 -5,-0.3 35,-0.1 -0.266 76.5-119.6 -61.7 148.9 22.2 83.7 24.5 537 381 D P S S+ 0 0 0 0, 0.0 2,-0.6 0, 0.0 -329,-0.2 0.862 110.9 50.3 -56.7 -31.9 25.3 82.0 26.0 538 382 D L S S- 0 0 2 33,-1.5 2,-0.9 32,-0.1 -2,-0.2 -0.923 81.6-154.7-110.6 108.1 23.1 81.5 29.0 539 383 D R + 0 0 125 -2,-0.6 2,-0.3 -335,-0.3 -6,-0.1 -0.750 51.0 101.8 -85.7 107.6 19.7 80.0 28.2 540 384 D Q S S- 0 0 35 -2,-0.9 2,-0.2 -8,-0.1 -2,-0.1 -0.914 78.3 -79.9-177.1 154.0 17.3 81.1 31.0 541 385 D K - 0 0 146 -2,-0.3 2,-0.6 1,-0.1 30,-0.1 -0.481 41.4-130.8 -69.5 132.7 14.6 83.7 31.5 542 386 D L - 0 0 17 -94,-0.2 2,-0.3 -2,-0.2 -1,-0.1 -0.754 27.5-156.4 -83.0 123.4 16.0 87.1 32.2 543 387 D L >> - 0 0 83 -2,-0.6 3,-1.3 1,-0.1 4,-1.0 -0.714 26.4-122.8-101.6 154.0 14.1 88.4 35.3 544 388 D S H 3> S+ 0 0 25 1,-0.3 4,-1.7 -2,-0.3 3,-0.1 0.799 116.3 59.5 -63.5 -25.5 13.6 92.0 36.2 545 389 D T H 3> S+ 0 0 31 2,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.713 92.7 65.6 -74.8 -20.6 15.4 91.1 39.5 546 390 D D H <> S+ 0 0 6 -3,-1.3 4,-1.2 2,-0.2 -46,-0.2 0.907 108.5 38.9 -66.1 -40.7 18.4 90.0 37.5 547 391 D I H X S+ 0 0 0 -4,-1.0 4,-3.0 1,-0.2 5,-0.2 0.867 113.2 59.7 -73.6 -34.7 18.9 93.6 36.5 548 392 D G H X S+ 0 0 0 -4,-1.7 4,-1.7 1,-0.2 -2,-0.2 0.901 103.0 49.0 -59.6 -43.6 17.9 94.6 40.0 549 393 D S H X S+ 0 0 8 -4,-2.7 4,-1.4 2,-0.2 -1,-0.2 0.866 114.5 45.4 -66.9 -35.1 20.7 92.6 41.7 550 394 D V H X S+ 0 0 1 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.889 111.6 52.1 -73.5 -39.3 23.3 94.2 39.3 551 395 D A H X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.826 107.3 55.1 -64.0 -30.7 21.8 97.7 39.8 552 396 D S H X S+ 0 0 2 -4,-1.7 4,-1.0 -5,-0.2 -1,-0.2 0.904 107.2 48.3 -68.9 -42.0 22.1 97.0 43.5 553 397 D F H >< S+ 0 0 7 -4,-1.4 3,-0.6 1,-0.2 6,-0.4 0.924 112.3 48.1 -64.1 -46.3 25.8 96.3 43.3 554 398 D L H 3< S+ 0 0 2 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.837 110.3 52.7 -65.2 -32.6 26.5 99.4 41.2 555 399 D L H 3< S+ 0 0 5 -4,-1.7 -1,-0.2 -5,-0.2 -160,-0.2 0.686 101.3 75.1 -77.0 -18.0 24.5 101.6 43.6 556 400 D S S X< S- 0 0 21 -4,-1.0 3,-1.3 -3,-0.6 -3,-0.0 -0.404 95.1-108.1 -90.3 169.6 26.5 100.4 46.6 557 401 D R G > S+ 0 0 142 1,-0.3 3,-1.7 2,-0.1 4,-0.1 0.549 105.2 87.7 -73.2 -7.1 30.0 101.3 47.7 558 402 D E G 3 S+ 0 0 68 1,-0.3 -1,-0.3 -5,-0.2 3,-0.2 0.704 92.1 45.9 -63.7 -19.3 31.1 97.8 46.6 559 403 D S G X S+ 0 0 0 -3,-1.3 3,-2.3 -6,-0.4 -1,-0.3 -0.077 70.7 137.2-114.6 32.6 31.5 99.3 43.1 560 404 D R T < S+ 0 0 54 -3,-1.7 -1,-0.1 1,-0.3 -2,-0.1 0.662 72.1 51.2 -53.4 -21.4 33.4 102.4 44.2 561 405 D A T 3 S+ 0 0 1 -76,-0.2 -51,-1.8 -3,-0.2 -52,-0.8 0.376 91.8 86.7-100.9 4.5 35.9 102.1 41.3 562 406 D I < + 0 0 1 -3,-2.3 2,-0.3 -54,-0.2 -54,-0.1 -0.910 50.4 144.2-107.8 124.9 33.4 101.7 38.5 563 407 D T + 0 0 0 -2,-0.5 -121,-0.2 -56,-0.2 -49,-0.2 -0.982 54.9 21.9-158.5 146.6 32.0 104.8 36.7 564 408 D G S S+ 0 0 2 -123,-3.4 2,-0.2 -2,-0.3 -122,-0.2 0.610 90.0 135.8 74.3 12.4 30.9 106.0 33.3 565 409 D Q - 0 0 18 -124,-0.2 -122,-3.0 -139,-0.1 2,-0.7 -0.571 55.9-140.4 -98.2 157.4 30.4 102.4 32.2 566 410 D T E -m 443 0C 33 -2,-0.2 2,-0.5 -124,-0.2 -122,-0.2 -0.948 25.6-163.3-112.6 103.2 27.7 100.5 30.3 567 411 D I E -m 444 0C 9 -124,-2.2 -122,-2.5 -2,-0.7 2,-0.5 -0.820 11.2-137.5 -94.6 126.4 27.3 97.2 32.0 568 412 D Y E +m 445 0C 28 -2,-0.5 2,-0.3 -124,-0.2 -122,-0.2 -0.716 25.7 172.5 -87.4 127.0 25.6 94.5 30.0 569 413 D V E +m 446 0C 0 -124,-2.4 -122,-1.5 -2,-0.5 -68,-0.2 -0.786 42.7 111.0-131.4 82.3 23.0 92.3 31.9 570 414 D D S > S- 0 0 10 -70,-0.8 3,-1.9 -2,-0.3 -69,-0.1 -0.019 96.0 -93.6-147.7 30.3 21.5 90.3 29.0 571 415 D N T 3 S- 0 0 0 -71,-2.0 -33,-1.5 1,-0.3 -70,-0.2 0.710 80.6 -66.6 59.4 21.1 22.7 86.8 29.6 572 416 D G T > S+ 0 0 0 -72,-0.6 3,-2.1 -36,-0.2 4,-0.3 0.448 95.1 137.7 82.9 2.1 25.6 87.5 27.3 573 417 D L G X + 0 0 41 -3,-1.9 3,-2.3 1,-0.3 -2,-0.1 0.861 64.1 64.7 -47.0 -45.4 23.5 88.0 24.1 574 418 D N G 3 S+ 0 0 32 1,-0.3 -1,-0.3 -4,-0.1 -3,-0.0 0.688 92.3 63.0 -54.4 -23.4 25.4 91.0 23.0 575 419 D I G < S+ 0 0 29 -3,-2.1 -1,-0.3 -73,-0.2 -2,-0.2 0.590 87.0 93.1 -81.2 -9.5 28.6 89.0 22.6 576 420 D M < + 0 0 46 -3,-2.3 -40,-0.0 -4,-0.3 -41,-0.0 -0.482 41.7 171.7 -83.6 155.0 27.1 86.8 19.8 577 421 D F S S+ 0 0 184 1,-0.4 -1,-0.1 -2,-0.1 -2,-0.0 0.595 70.3 31.4-121.9 -64.6 27.4 87.6 16.1 578 422 D L S S- 0 0 124 1,-0.0 -1,-0.4 2,-0.0 3,-0.0 -0.859 82.6-125.1-103.3 130.5 25.9 84.6 14.2 579 423 D P - 0 0 52 0, 0.0 -44,-0.1 0, 0.0 -43,-0.0 -0.363 25.2-116.3 -69.0 154.8 23.1 82.6 15.7 580 424 D D 0 0 68 -46,-0.1 -45,-0.1 -45,-0.0 -46,-0.0 0.968 360.0 360.0 -53.7 -90.4 23.7 78.8 16.0 581 425 D D 0 0 177 -3,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.464 360.0 360.0 -79.6 360.0 21.2 77.1 13.8