==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 09-FEB-12 4DOJ . COMPND 2 MOLECULE: GLYCINE BETAINE TRANSPORTER BETP; . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM GLUTAMICUM; . AUTHOR C.PEREZ,C.ZIEGLER . 1534 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 60346.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1208 78.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 1 0.1 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 . 1 0.1 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 . 52 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 245 16.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 834 54.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 39 2.5 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 8 0 2 5 6 5 4 2 4 2 0 2 3 2 2 3 6 1 2 2 2 0 0 2 0 1 3 RESIDUES PER ALPHA HELIX . 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 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 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 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 57 A S 0 0 109 0, 0.0 2,-0.4 0, 0.0 422,-0.0 0.000 360.0 360.0 360.0 158.7 -25.4 10.0 -0.2 2 58 A L - 0 0 66 422,-0.1 2,-1.3 423,-0.1 422,-0.2 -0.965 360.0-128.7-127.0 145.8 -23.5 7.0 -1.4 3 59 A N >> + 0 0 23 420,-1.5 4,-1.9 -2,-0.4 3,-1.2 -0.666 28.2 173.2 -93.2 82.2 -19.8 6.0 -1.0 4 60 A W T 34 S+ 0 0 179 -2,-1.3 -1,-0.1 1,-0.2 419,-0.0 -0.059 76.4 59.4 -79.4 35.6 -18.8 5.1 -4.6 5 61 A S T 34 S+ 0 0 73 -2,-0.6 -1,-0.2 3,-0.1 -2,-0.1 0.461 110.9 34.2-131.7 -22.4 -15.2 4.8 -3.4 6 62 A V T <4 S+ 0 0 8 -3,-1.2 -2,-0.2 2,-0.1 181,-0.1 0.642 121.3 47.7-104.2 -25.5 -15.6 2.1 -0.8 7 63 A I S X S+ 0 0 28 -4,-1.9 4,-1.6 2,-0.2 5,-0.3 0.704 103.4 63.0 -88.9 -22.9 -18.4 0.2 -2.6 8 64 A V H > S+ 0 0 83 -5,-0.3 4,-0.8 1,-0.2 -1,-0.1 0.954 107.9 40.4 -66.2 -52.0 -16.5 0.2 -5.9 9 65 A P H 4 S+ 0 0 46 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.486 113.7 68.2 -72.5 1.3 -13.6 -1.8 -4.6 10 66 A A H >> S+ 0 0 0 -3,-0.2 4,-2.1 2,-0.1 3,-2.0 0.963 103.3 28.3 -82.2 -79.6 -16.3 -3.8 -2.8 11 67 A L H 3X S+ 0 0 76 -4,-1.6 4,-1.6 1,-0.3 5,-0.2 0.659 108.9 76.1 -60.6 -16.1 -18.5 -5.8 -5.3 12 68 A V H 3< S+ 0 0 87 -4,-0.8 -1,-0.3 -5,-0.3 -2,-0.1 0.809 113.6 20.8 -65.7 -30.2 -15.5 -5.9 -7.6 13 69 A I H <4 S+ 0 0 89 -3,-2.0 4,-0.3 -4,-0.3 -2,-0.2 0.573 112.7 72.0-112.0 -19.3 -14.0 -8.6 -5.4 14 70 A V H X S+ 0 0 10 -4,-2.1 4,-0.6 1,-0.2 3,-0.2 0.883 115.4 28.6 -57.7 -38.7 -17.2 -9.7 -3.7 15 71 A L H X>S+ 0 0 76 -4,-1.6 4,-2.6 2,-0.2 5,-0.8 0.663 104.0 77.2 -95.9 -22.5 -18.0 -11.2 -7.1 16 72 A A H 45S+ 0 0 52 -5,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.503 111.5 31.7 -64.6 -2.2 -14.3 -11.8 -8.1 17 73 A T H >5S+ 0 0 42 -4,-0.3 4,-1.4 -3,-0.2 -1,-0.2 0.538 117.8 54.9-121.6 -29.3 -14.8 -14.7 -5.6 18 74 A V H X5S+ 0 0 7 -4,-0.6 4,-2.3 2,-0.2 3,-0.4 0.980 118.8 32.6 -67.4 -59.3 -18.5 -15.4 -6.3 19 75 A V H X5S+ 0 0 87 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.718 117.4 60.7 -68.7 -21.0 -18.1 -15.9 -10.0 20 76 A W H 4> S- 0 0 119 1,-0.2 3,-1.4 -5,-0.1 4,-0.6 -0.737 74.5-169.4 -85.8 98.3 -11.8 -22.7 -12.3 26 82 A D G >4 S+ 0 0 78 -2,-1.2 3,-0.5 1,-0.3 -1,-0.2 0.882 85.7 37.7 -56.0 -44.1 -14.5 -24.4 -10.3 27 83 A S G 34 S+ 0 0 84 1,-0.2 -1,-0.3 2,-0.1 3,-0.3 0.253 95.7 83.2 -97.1 11.9 -12.1 -26.6 -8.3 28 84 A F G X4 S+ 0 0 105 -3,-1.4 3,-1.4 -8,-0.2 4,-0.4 0.730 80.5 66.4 -81.1 -24.4 -9.5 -23.8 -7.9 29 85 A T G XX S+ 0 0 5 -4,-0.6 4,-0.8 -3,-0.5 3,-0.6 0.655 87.1 71.2 -68.5 -15.0 -11.5 -22.5 -5.0 30 86 A N G 34 S+ 0 0 61 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.159 86.8 65.1 -85.8 17.0 -10.5 -25.8 -3.4 31 87 A F G <4 S+ 0 0 146 -3,-1.4 -1,-0.2 2,-0.1 -2,-0.2 0.577 97.5 52.2-105.6 -23.0 -6.9 -24.4 -3.2 32 88 A A T X> S+ 0 0 33 -3,-0.6 3,-1.1 -4,-0.4 4,-0.8 0.761 101.6 61.2 -79.4 -27.9 -8.1 -21.7 -0.7 33 89 A S T 3< S+ 0 0 42 -4,-0.8 4,-0.2 1,-0.3 -1,-0.2 0.769 109.9 41.2 -67.4 -26.8 -9.6 -24.4 1.4 34 90 A S T 34 S+ 0 0 93 1,-0.1 -1,-0.3 2,-0.1 -2,-0.2 0.217 106.7 68.2 -99.1 10.7 -6.1 -25.7 1.7 35 91 A A T X4 S+ 0 0 39 -3,-1.1 3,-0.7 1,-0.1 4,-0.3 0.572 85.8 64.2-102.8 -16.1 -4.9 -22.2 2.1 36 92 A L G >X S+ 0 0 38 -4,-0.8 4,-3.1 1,-0.3 3,-1.4 0.760 84.9 75.7 -74.4 -25.0 -6.5 -21.6 5.5 37 93 A S G 34 S+ 0 0 69 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.202 92.4 57.6 -69.6 19.5 -4.1 -24.3 6.7 38 94 A A G <4 S+ 0 0 52 -3,-0.7 4,-0.3 3,-0.1 -1,-0.3 0.532 114.8 31.7-117.6 -26.6 -1.7 -21.4 6.5 39 95 A V T <>>S+ 0 0 27 -3,-1.4 4,-3.8 -4,-0.3 5,-0.8 0.858 116.2 54.8 -92.1 -51.0 -3.5 -19.1 8.8 40 96 A V T <5S+ 0 0 25 -4,-3.1 4,-0.3 1,-0.2 -3,-0.2 0.843 120.2 32.9 -53.8 -37.3 -5.1 -21.6 11.2 41 97 A D T 45S+ 0 0 64 -5,-0.4 -1,-0.2 2,-0.1 4,-0.2 0.761 126.4 40.3 -92.4 -25.1 -1.7 -23.2 11.9 42 98 A N T 45S+ 0 0 80 -4,-0.3 -2,-0.2 2,-0.1 -3,-0.2 0.668 131.9 24.3 -95.9 -20.0 0.4 -20.0 11.7 43 99 A L T X5S+ 0 0 41 -4,-3.8 4,-2.0 2,-0.1 5,-0.2 0.391 91.6 101.6-120.9 -4.2 -2.0 -17.6 13.4 44 100 A G H >> S+ 0 0 41 1,-0.2 4,-2.8 -4,-0.2 3,-0.5 0.946 109.3 48.6 -56.4 -50.8 -1.8 -19.0 18.4 46 102 A A H 3> S+ 0 0 1 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.729 108.6 55.5 -65.3 -22.2 -2.6 -15.4 17.8 47 103 A F H 3< S+ 0 0 5 -4,-2.0 4,-0.4 -3,-0.3 -1,-0.2 0.828 115.8 37.1 -76.0 -33.3 -6.3 -16.3 17.5 48 104 A I H X S+ 0 0 16 -4,-2.2 3,-2.1 -3,-0.3 4,-1.2 0.920 108.7 58.3 -74.9 -47.3 -8.9 -14.9 25.8 53 109 A V H 3X S+ 0 0 55 -4,-1.9 4,-3.2 -5,-0.3 -1,-0.2 0.834 98.1 66.0 -49.1 -31.6 -7.4 -11.5 26.5 54 110 A F H 3X S+ 0 0 1 -4,-1.5 4,-1.4 1,-0.2 5,-0.3 0.840 98.1 51.2 -59.5 -34.2 -10.7 -10.3 25.0 55 111 A V H <> S+ 0 0 4 -3,-2.1 4,-0.9 -4,-0.4 -1,-0.2 0.830 115.4 39.6 -78.3 -33.1 -12.6 -11.8 27.9 56 112 A F H X S+ 0 0 91 -4,-1.2 4,-2.1 2,-0.1 5,-0.3 0.901 109.6 64.2 -74.7 -44.1 -10.5 -10.2 30.6 57 113 A F H >X S+ 0 0 29 -4,-3.2 4,-1.9 -5,-0.2 3,-0.7 0.926 109.8 32.4 -46.6 -69.2 -10.3 -6.9 28.7 58 114 A I H 3X S+ 0 0 0 -4,-1.4 4,-3.7 1,-0.2 5,-0.3 0.932 111.3 65.4 -57.1 -45.9 -13.9 -5.9 28.6 59 115 A V H 3X S+ 0 0 73 -4,-0.9 4,-1.7 -5,-0.3 -1,-0.2 0.839 106.9 42.1 -48.8 -38.9 -14.6 -7.5 32.0 60 116 A V H < S- 0 0 36 -4,-2.6 3,-1.9 1,-0.1 274,-0.1 -0.081 97.4-101.6 -64.9 167.7 -13.9 0.1 35.6 65 121 A K G >> S+ 0 0 95 1,-0.3 3,-2.0 2,-0.2 4,-0.6 0.799 122.3 73.5 -59.2 -26.4 -15.1 3.6 36.3 66 122 A F G >4 S+ 0 0 15 1,-0.3 3,-1.0 2,-0.2 271,-0.4 0.828 79.1 75.4 -53.1 -31.4 -15.7 3.6 32.5 67 123 A G G <4 S+ 0 0 2 -3,-1.9 271,-0.9 -6,-0.5 272,-0.4 0.421 91.3 53.9 -66.2 2.9 -18.6 1.3 33.4 68 124 A T G <4 S+ 0 0 69 -3,-2.0 -1,-0.3 269,-0.1 -2,-0.2 0.673 78.2 108.5-106.1 -27.7 -20.5 4.3 34.6 69 125 A I << - 0 0 0 -3,-1.0 268,-2.0 -4,-0.6 2,-0.2 -0.302 68.2-135.7 -48.9 120.4 -20.2 6.4 31.4 70 126 A R B -A 336 0A 104 266,-0.2 2,-1.5 267,-0.1 4,-0.3 -0.583 18.2-114.5 -81.7 148.6 -23.6 6.4 29.8 71 127 A L S S+ 0 0 0 264,-0.6 263,-1.7 261,-0.2 264,-0.3 -0.561 82.3 14.8 -92.4 77.3 -23.7 5.8 26.1 72 128 A G S S- 0 0 0 -2,-1.5 82,-0.3 261,-0.2 81,-0.1 0.019 117.8 -20.8 130.6 126.7 -25.0 9.1 24.5 73 129 A R S > S- 0 0 144 80,-0.9 3,-0.6 81,-0.5 -2,-0.1 0.672 97.8 -89.5 18.4 68.8 -25.5 12.7 25.4 74 130 A I T 3 S+ 0 0 115 -4,-0.3 260,-0.1 1,-0.2 0, 0.0 -0.112 115.3 32.1 40.9-115.3 -25.6 12.1 29.2 75 131 A D T 3 + 0 0 121 -5,-0.0 -1,-0.2 1,-0.0 -4,-0.1 0.825 68.5 155.0 -30.9 -82.5 -29.2 11.4 30.2 76 132 A E < - 0 0 40 -3,-0.6 3,-0.2 1,-0.1 -5,-0.1 0.944 48.8-125.7 44.2 74.1 -30.6 9.6 27.1 77 133 A A - 0 0 82 1,-0.1 258,-0.1 2,-0.0 -1,-0.1 -0.218 45.1 -78.0 -47.6 131.3 -33.4 7.6 28.6 78 134 A P - 0 0 56 0, 0.0 256,-0.2 0, 0.0 -1,-0.1 -0.015 46.3-145.7 -38.7 125.7 -32.9 3.9 27.7 79 135 A E S S+ 0 0 78 254,-1.9 255,-0.1 -3,-0.2 253,-0.1 0.993 84.2 2.1 -63.9 -79.2 -34.1 3.5 24.1 80 136 A F S S- 0 0 62 251,-0.2 2,-0.8 1,-0.2 4,-0.2 0.805 89.2-155.3 -80.4 -32.5 -35.6 0.1 23.8 81 137 A R - 0 0 137 250,-0.3 -1,-0.2 2,-0.1 2,-0.2 -0.826 45.2 -23.6 95.5-105.6 -35.1 -0.9 27.4 82 138 A T S S+ 0 0 61 -2,-0.8 2,-3.8 -4,-0.1 3,-0.1 -0.450 110.2 33.6-127.6-163.4 -34.9 -4.7 27.9 83 139 A V S > S+ 0 0 83 1,-0.3 4,-2.1 -2,-0.2 5,-0.2 -0.093 104.7 71.3 47.1 -59.7 -35.9 -8.1 26.4 84 140 A S H > S+ 0 0 6 -2,-3.8 4,-2.0 2,-0.2 -1,-0.3 0.808 96.3 58.5 -50.2 -29.5 -35.6 -6.7 22.8 85 141 A W H >> S+ 0 0 23 2,-0.2 4,-2.1 1,-0.2 3,-1.1 0.999 107.3 39.1 -60.7 -74.3 -31.9 -6.8 23.7 86 142 A I H 3> S+ 0 0 43 1,-0.3 4,-0.9 2,-0.2 5,-0.2 0.717 117.9 54.0 -51.4 -22.9 -31.5 -10.5 24.5 87 143 A S H 3X S+ 0 0 11 -4,-2.1 4,-1.3 2,-0.2 -1,-0.3 0.859 114.9 37.2 -80.2 -36.9 -33.9 -11.2 21.6 88 144 A M H S+ 0 0 2 -4,-2.0 4,-0.8 -3,-1.1 5,-0.6 0.525 103.0 74.6 -92.2 -8.1 -31.7 -9.2 19.1 89 145 A M H X5S+ 0 0 6 -4,-2.1 4,-1.8 3,-0.2 5,-0.5 0.980 115.3 18.6 -61.8 -56.1 -28.5 -10.4 20.6 90 146 A F H <5S+ 0 0 24 -4,-0.9 6,-0.2 3,-0.2 -2,-0.2 0.959 117.6 62.7 -81.6 -57.5 -29.0 -13.8 19.1 91 147 A A H <5S+ 0 0 2 -4,-1.3 5,-0.2 -5,-0.2 -3,-0.2 0.842 124.1 24.9 -35.9 -43.4 -31.5 -13.2 16.3 92 148 A A H <5S+ 0 0 0 -4,-0.8 -2,-0.2 -5,-0.1 -1,-0.2 0.941 134.7 32.0 -85.3 -68.8 -28.8 -10.9 14.9 93 149 A G S < S+ 0 0 2 1,-0.2 3,-0.5 2,-0.0 -4,-0.2 -0.704 81.1 31.5 91.6 -95.6 -29.8 -17.2 15.9 96 152 A I G >> S+ 0 0 6 -2,-1.1 3,-1.7 311,-0.2 4,-1.7 0.832 113.2 64.1 -67.8 -33.2 -29.8 -20.0 13.4 97 153 A D G 34 S+ 0 0 8 -3,-0.3 5,-0.4 1,-0.3 -1,-0.2 0.822 85.1 73.6 -60.1 -33.3 -26.4 -21.2 14.6 98 154 A L G <4 S+ 0 0 27 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.2 0.582 110.8 30.2 -59.1 -7.9 -27.9 -22.0 18.0 99 155 A M T <> S+ 0 0 8 -3,-1.7 2,-0.9 3,-0.1 4,-0.9 0.750 109.0 60.7-116.5 -52.5 -29.5 -25.0 16.2 100 156 A F T < S+ 0 0 29 -4,-1.7 -2,-0.1 1,-0.2 -3,-0.1 0.034 132.7 9.5 -73.1 31.5 -27.3 -26.2 13.4 101 157 A Y T > S+ 0 0 54 -2,-0.9 4,-1.1 -5,-0.1 -1,-0.2 0.239 111.8 83.2-179.0 -12.1 -24.6 -26.9 15.9 102 158 A G T 4 S+ 0 0 0 -5,-0.4 258,-0.3 1,-0.2 -3,-0.1 0.644 97.6 37.3 -86.9 -17.4 -26.3 -26.5 19.3 103 159 A T T < S+ 0 0 1 -4,-0.9 -1,-0.2 276,-0.1 -3,-0.1 0.318 122.6 43.0-114.4 5.3 -27.8 -29.9 19.7 104 160 A T T > S+ 0 0 7 -3,-0.2 4,-3.3 -5,-0.1 5,-0.2 0.547 98.2 68.6-123.3 -19.6 -25.0 -31.8 18.1 105 161 A E H X S+ 0 0 0 -4,-1.1 4,-2.0 2,-0.2 5,-0.2 0.935 102.3 45.1 -72.6 -47.6 -21.9 -30.2 19.6 106 162 A P H > S+ 0 0 0 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.785 118.9 49.2 -60.7 -23.2 -22.4 -31.6 23.1 107 163 A L H > S+ 0 0 2 2,-0.2 4,-1.4 3,-0.1 -2,-0.2 0.901 108.0 47.7 -83.8 -46.4 -23.2 -34.8 21.3 108 164 A T H X>S+ 0 0 12 -4,-3.3 4,-2.3 1,-0.2 5,-0.6 0.854 115.7 48.4 -62.6 -33.3 -20.1 -35.0 19.0 109 165 A F H X5S+ 0 0 7 -4,-2.0 4,-1.0 1,-0.2 12,-0.4 0.876 107.2 53.1 -75.0 -39.4 -18.0 -34.2 22.0 110 166 A Y H <5S+ 0 0 5 -4,-1.3 10,-2.1 -5,-0.2 -1,-0.2 0.782 119.5 39.4 -62.4 -26.0 -19.7 -36.8 24.2 111 167 A R H <5S+ 0 0 82 -4,-1.4 9,-0.2 8,-0.2 -2,-0.2 0.951 127.0 23.3 -87.3 -72.7 -18.9 -39.3 21.4 112 168 A N H <5S- 0 0 107 -4,-2.3 -3,-0.2 -5,-0.1 -2,-0.1 0.768 100.0-136.7 -70.2 -27.6 -15.4 -38.6 19.9 113 169 A G << - 0 0 13 -4,-1.0 6,-0.2 -5,-0.6 -3,-0.1 0.574 18.9 -90.5 73.5 131.7 -14.1 -36.9 23.0 114 170 A V > - 0 0 3 4,-0.3 3,-1.4 -5,-0.2 2,-0.2 -0.371 54.1 -85.2 -70.1 148.9 -12.0 -33.7 22.9 115 171 A P T 3 S+ 0 0 32 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.388 118.9 35.5 -58.2 125.0 -8.2 -33.9 22.7 116 172 A G T 3 S+ 0 0 59 1,-0.3 2,-0.3 -2,-0.2 -2,-0.1 0.388 114.1 68.1 107.3 3.8 -6.8 -34.3 26.2 117 173 A H S < S- 0 0 57 -3,-1.4 -1,-0.3 -4,-0.1 4,-0.1 -0.995 77.1-115.6-152.9 151.8 -9.7 -36.5 27.4 118 174 A D - 0 0 125 -2,-0.3 3,-0.3 1,-0.2 -4,-0.3 -0.165 46.7 -88.3 -75.4 178.6 -11.4 -39.8 26.8 119 175 A E S S+ 0 0 100 1,-0.2 -8,-0.2 -6,-0.2 -1,-0.2 -0.110 101.3 46.0 -77.7-178.9 -14.9 -40.2 25.4 120 176 A H + 0 0 84 -10,-2.1 2,-1.0 -9,-0.2 -1,-0.2 0.803 68.8 150.7 55.0 34.7 -18.2 -40.2 27.3 121 177 A N > - 0 0 54 -12,-0.4 4,-3.0 -3,-0.3 5,-0.3 -0.722 26.2-175.9-102.7 85.9 -17.2 -37.2 29.3 122 178 A V H > S+ 0 0 3 -2,-1.0 4,-1.2 1,-0.2 -1,-0.2 0.815 84.7 55.6 -42.3 -35.4 -20.5 -35.4 30.2 123 179 A G H > S+ 0 0 4 2,-0.2 4,-2.7 1,-0.2 3,-0.4 0.969 112.3 33.7 -68.6 -59.4 -18.2 -32.8 31.8 124 180 A V H > S+ 0 0 6 1,-0.2 4,-3.2 2,-0.2 5,-0.4 0.851 112.5 65.0 -67.1 -32.8 -15.9 -31.8 28.9 125 181 A A H X S+ 0 0 2 -4,-3.0 4,-0.6 1,-0.2 -1,-0.2 0.880 113.2 33.0 -55.1 -39.8 -18.7 -32.3 26.5 126 182 A M H X S+ 0 0 2 -4,-1.2 4,-1.6 -3,-0.4 -2,-0.2 0.863 119.5 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63.0 -79.7 -21.4 -9.6 -1.8 18.8 480 537 A M H <> S+ 0 0 20 -3,-2.4 4,-2.4 -4,-0.3 5,-0.2 0.931 107.2 42.2 -65.6 -45.7 -8.9 -2.3 22.5 481 538 A F H X S+ 0 0 101 -4,-0.6 4,-4.2 1,-0.2 5,-0.3 0.953 112.9 51.1 -65.7 -51.3 -6.5 0.7 22.6 482 539 A A H < S+ 0 0 1 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.694 113.8 49.1 -59.8 -18.3 -8.8 2.8 20.4 483 540 A L H X S+ 0 0 1 -4,-0.8 4,-2.4 -3,-0.2 3,-0.3 0.882 120.5 32.0 -84.6 -45.3 -11.5 1.9 22.9 484 541 A V H X S+ 0 0 42 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.836 115.2 55.5 -85.7 -35.1 -9.6 2.7 26.1 485 542 A K H < S+ 0 0 121 -4,-4.2 -1,-0.2 -5,-0.2 -3,-0.2 0.385 119.1 39.1 -78.2 5.8 -7.4 5.5 24.8 486 543 A D H >4 S+ 0 0 14 -3,-0.3 3,-1.5 -5,-0.3 4,-0.4 0.667 108.9 55.4-117.2 -46.5 -10.8 7.1 23.9 487 544 A L H >< S+ 0 0 0 -4,-2.4 3,-1.1 1,-0.3 6,-0.2 0.814 103.4 61.9 -54.2 -31.8 -13.0 6.1 26.8 488 545 A S T 3< S+ 0 0 20 -4,-1.5 -1,-0.3 1,-0.3 -3,-0.1 0.668 95.7 57.3 -74.8 -18.8 -10.4 7.8 28.9 489 546 A N T < S+ 0 0 104 -3,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.477 77.7 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107.5 72.5 -87.5 65.6 -35.9 8.7 48.0 1027 556 B Q T < 5S- 0 0 118 -2,-1.6 -3,-0.1 -3,-0.6 -2,-0.1 0.009 114.0 -18.5-136.6-112.7 -33.9 11.5 46.6 1028 557 B Q T 5 0 0 151 -4,-0.3 -3,-0.1 -2,-0.1 -2,-0.1 0.814 360.0 360.0 -74.3 -30.8 -33.5 12.5 42.9 1029 558 B R < 0 0 164 -5,-0.6 -4,-0.1 -4,-0.1 -3,-0.1 0.738 360.0 360.0 -93.5 360.0 -34.7 9.1 41.9 1030 !* 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 1031 57 C S 0 0 108 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 83.2 32.0 3.7 58.9 1032 58 C L - 0 0 59 1,-0.1 2,-1.1 420,-0.1 420,-0.2 -0.260 360.0-121.4 -62.0 146.4 31.8 -0.1 58.2 1033 59 C N >> + 0 0 9 418,-1.5 4,-2.1 1,-0.2 3,-1.0 -0.759 34.9 172.2 -91.9 94.3 29.7 -2.3 60.4 1034 60 C W H 3> S+ 0 0 157 -2,-1.1 4,-1.0 1,-0.3 -1,-0.2 0.789 73.6 70.1 -74.9 -27.5 32.2 -4.8 61.7 1035 61 C S H 34 S+ 0 0 83 1,-0.2 -1,-0.3 -3,-0.2 179,-0.1 0.490 117.2 26.7 -64.0 -0.4 29.7 -6.2 64.2 1036 62 C V H <> S+ 0 0 1 -3,-1.0 4,-0.7 415,-0.2 -2,-0.2 0.561 115.1 60.2-131.9 -32.6 28.1 -7.5 60.9 1037 63 C I H >X S+ 0 0 9 -4,-2.1 4,-2.0 414,-0.2 3,-0.7 0.988 110.6 36.5 -67.0 -60.4 31.0 -7.9 58.4 1038 64 C V H 3X S+ 0 0 70 -4,-1.0 4,-2.3 1,-0.2 5,-0.2 0.883 108.9 60.7 -65.8 -41.2 33.2 -10.4 60.2 1039 65 C P H 3> S+ 0 0 44 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.810 111.1 45.6 -58.0 -23.6 30.4 -12.5 61.8 1040 66 C A H XX S+ 0 0 2 -3,-0.7 4,-2.2 -4,-0.7 3,-1.1 0.904 109.4 51.7 -79.4 -47.7 29.5 -13.1 58.1 1041 67 C L H 3X S+ 0 0 55 -4,-2.0 4,-2.0 1,-0.3 5,-0.3 0.738 100.5 66.3 -61.3 -22.6 33.0 -13.8 57.0 1042 68 C V H 3X S+ 0 0 85 -4,-2.3 4,-1.4 1,-0.2 -1,-0.3 0.869 109.7 35.2 -65.8 -36.9 33.2 -16.3 59.8 1043 69 C I H S+ 0 0 25 -4,-1.3 5,-1.2 3,-0.2 4,-1.1 0.870 121.7 42.2 -57.3 -38.7 35.7 -22.6 52.0 1049 75 C V H >X>S+ 0 0 82 -4,-3.6 5,-1.7 2,-0.2 3,-0.7 0.996 124.2 31.6 -67.1 -69.3 38.0 -23.9 54.8 1050 76 C W H 3<5S+ 0 0 90 -4,-2.2 6,-0.8 -5,-0.3 9,-0.2 0.576 122.2 53.4 -70.1 -9.4 36.1 -26.9 56.1 1051 77 C G H 3<5S+ 0 0 0 -4,-2.1 -1,-0.2 -5,-0.2 -3,-0.2 0.686 127.4 3.8-103.9 -22.8 34.7 -27.6 52.6 1052 78 C I H <<5S+ 0 0 70 -4,-1.1 -3,-0.2 -3,-0.7 -2,-0.1 0.620 127.0 48.3-125.7 -49.8 37.7 -27.8 50.3 1053 79 C G T <> S+ 0 0 59 -2,-2.3 3,-1.1 -6,-0.8 4,-0.9 -0.269 77.0 71.0 74.1 -55.4 36.0 -32.2 52.0 1057 83 C S T 34 S+ 0 0 81 -2,-2.7 -1,-0.2 1,-0.2 -2,-0.1 0.659 91.7 63.4 -63.9 -13.0 34.1 -35.4 52.4 1058 84 C F T >> S+ 0 0 101 -8,-0.2 3,-1.6 1,-0.2 4,-0.7 0.749 88.6 63.0 -85.4 -26.9 32.8 -33.8 55.6 1059 85 C T H X> S+ 0 0 21 -3,-1.1 4,-0.9 1,-0.3 3,-0.9 0.878 95.3 63.2 -63.8 -34.8 31.0 -30.9 53.9 1060 86 C N H 3< S+ 0 0 63 -4,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.421 92.2 66.5 -70.5 2.9 28.8 -33.6 52.3 1061 87 C F H X4 S+ 0 0 149 -3,-1.6 3,-1.4 2,-0.1 4,-0.4 0.817 98.7 48.2 -86.5 -39.7 27.7 -34.4 55.8 1062 88 C A H X< S+ 0 0 39 -3,-0.9 3,-0.8 -4,-0.7 4,-0.3 0.721 99.5 70.3 -69.3 -20.8 26.0 -31.0 56.2 1063 89 C S T 3< S+ 0 0 19 -4,-0.9 4,-0.4 1,-0.3 -1,-0.3 0.285 91.6 58.2 -80.3 10.2 24.4 -31.8 52.8 1064 90 C S T <> S+ 0 0 58 -3,-1.4 4,-1.1 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116 252,-0.9 2,-0.3 250,-0.3 253,-0.1 0.685 86.8 34.1 -93.1 -22.5 12.5 9.4 38.8 1110 136 C F S S- 0 0 85 249,-0.2 -1,-0.0 1,-0.1 0, 0.0 -0.859 93.8 -90.8-126.9 163.8 12.3 7.7 35.4 1111 137 C R > - 0 0 177 -2,-0.3 4,-3.0 1,-0.1 5,-0.3 -0.264 39.5-108.7 -67.5 159.6 9.5 7.1 32.9 1112 138 C T H > S+ 0 0 72 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.944 123.1 52.0 -52.4 -46.6 7.3 4.1 33.1 1113 139 C V H > S+ 0 0 89 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.911 112.4 42.8 -58.2 -46.6 9.1 2.8 30.0 1114 140 C S H 4 S+ 0 0 39 2,-0.2 4,-0.3 1,-0.2 -1,-0.2 0.850 112.9 53.4 -68.9 -35.1 12.5 3.3 31.5 1115 141 C W H X S+ 0 0 8 -4,-3.0 4,-0.7 2,-0.2 3,-0.3 0.866 115.7 39.7 -67.0 -37.2 11.4 1.9 34.8 1116 142 C I H >X S+ 0 0 46 -4,-2.6 4,-1.7 -5,-0.3 3,-0.8 0.874 106.7 63.9 -75.5 -40.5 10.1 -1.2 33.0 1117 143 C S H 3< S+ 0 0 78 -4,-3.0 4,-0.4 -5,-0.3 -1,-0.2 0.584 106.0 47.9 -59.5 -8.4 13.2 -1.2 30.7 1118 144 C M H 34 S+ 0 0 53 -3,-0.3 4,-0.3 -4,-0.3 -1,-0.3 0.671 102.5 58.8-104.7 -25.0 15.1 -1.8 33.9 1119 145 C M H < S+ 0 0 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4,-1.7 -4,-0.4 -2,-0.2 0.875 110.0 50.3 -80.8 -46.3 30.8 -22.3 30.4 1236 262 C G H < S+ 0 0 17 -4,-1.5 4,-0.5 1,-0.3 3,-0.5 0.925 112.7 45.8 -56.7 -47.8 33.1 -25.3 30.9 1237 263 C A T < S+ 0 0 25 -4,-1.6 3,-0.4 1,-0.2 -1,-0.3 0.772 111.2 56.4 -65.1 -25.0 30.6 -27.5 29.2 1238 264 C G T >4 S+ 0 0 0 -4,-0.3 3,-0.9 1,-0.2 4,-0.3 0.752 92.0 66.6 -79.1 -26.5 30.3 -24.8 26.6 1239 265 C L G >X S+ 0 0 52 -4,-1.7 3,-1.0 -3,-0.5 4,-0.9 0.684 84.1 76.7 -67.7 -17.4 34.0 -24.9 25.8 1240 266 C S G 34 S+ 0 0 50 -4,-0.5 -1,-0.3 -3,-0.4 -2,-0.1 0.072 87.7 61.1 -79.2 25.3 33.2 -28.4 24.5 1241 267 C A G <4 S+ 0 0 11 -3,-0.9 -1,-0.2 2,-0.1 -2,-0.2 0.496 119.1 21.0-117.9 -22.6 31.7 -26.5 21.5 1242 268 C A T <4 S+ 0 0 61 -3,-1.0 2,-0.4 1,-0.3 -2,-0.1 0.739 128.6 25.7-105.4 -78.0 35.0 -24.8 20.5 1243 269 C N < 0 0 109 -4,-0.9 -1,-0.3 1,-0.0 -2,-0.1 -0.780 360.0 360.0 -97.6 133.5 38.0 -26.7 21.9 1244 270 C I 0 0 146 -2,-0.4 -4,-0.1 -3,-0.1 -1,-0.0 -0.635 360.0 360.0-128.1 360.0 37.9 -30.4 22.8 1245 ! 0 0 0 0, 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