==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-NOV-06 2NYV . COMPND 2 MOLECULE: PHOSPHOGLYCOLATE PHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR C.CIATTO,T.MIN,J.GORMAN,S.K.BURLEY,L.SHAPIRO,NEW YORK SGX . 217 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10592.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 145 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 12.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.4 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 4 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 3.7 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 1 0 1 4 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 2 3 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 . 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 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 1 A X 0 0 84 0, 0.0 213,-2.5 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 119.4 -11.6 8.7 -16.8 2 2 A S E +a 214 0A 58 211,-0.2 2,-0.3 213,-0.1 213,-0.2 -0.727 360.0 167.6 -94.8 124.7 -14.2 8.7 -13.9 3 3 A L E -a 215 0A 2 211,-2.8 213,-2.4 -2,-0.5 156,-0.2 -0.934 26.6-176.5-135.8 158.5 -13.2 10.0 -10.5 4 4 A R + 0 0 57 154,-3.2 97,-2.4 1,-0.3 2,-0.3 0.630 69.8 35.8-124.0 -21.2 -14.8 11.0 -7.2 5 5 A V E -bc 101 159B 0 153,-1.6 155,-2.3 95,-0.2 2,-0.4 -0.987 53.9-158.7-146.2 138.2 -12.0 12.3 -4.9 6 6 A I E -bc 102 160B 4 95,-2.3 97,-2.0 -2,-0.3 2,-0.5 -0.993 9.1-163.2-122.6 121.7 -8.9 14.3 -5.3 7 7 A L E -bc 103 161B 4 153,-3.3 155,-2.9 -2,-0.4 2,-0.4 -0.942 9.1-161.9-108.9 127.4 -6.1 14.2 -2.6 8 8 A F E -bc 104 162B 5 95,-2.7 97,-2.4 -2,-0.5 155,-0.2 -0.835 16.9-134.0-109.5 135.6 -3.5 17.0 -2.5 9 9 A D > - 0 0 10 153,-2.6 5,-0.5 -2,-0.4 97,-0.2 -0.359 25.7-142.2 -64.3 168.7 -0.0 17.1 -0.9 10 10 A L T >>>S+ 0 0 0 3,-0.2 5,-2.2 1,-0.2 3,-2.1 0.867 71.7 57.5-103.3 -76.1 0.4 20.4 0.9 11 11 A D B 345S+g 15 0C 20 1,-0.3 153,-0.3 2,-0.2 5,-0.2 -0.410 123.7 8.4 -62.9 126.9 3.9 22.1 0.8 12 12 A G T 345S+ 0 0 0 3,-2.6 -1,-0.3 -2,-0.1 175,-0.2 0.526 133.1 55.3 80.7 3.2 4.9 22.6 -2.7 13 13 A T T <45S+ 0 0 0 -3,-2.1 72,-0.2 2,-0.4 -3,-0.2 0.532 123.4 7.6-127.1 -68.9 1.5 21.7 -4.0 14 14 A L T <> + 0 0 0 -2,-1.2 4,-2.2 65,-0.2 3,-0.8 0.371 28.4 108.5-100.2 0.8 5.7 27.6 2.3 18 18 A A H 3> S+ 0 0 10 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.828 80.0 52.5 -55.0 -35.7 9.5 27.4 1.8 19 19 A K H 3> S+ 0 0 138 -3,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.857 111.4 45.7 -71.2 -35.5 10.1 30.9 3.2 20 20 A D H <> S+ 0 0 1 -3,-0.8 4,-1.8 2,-0.2 -1,-0.2 0.791 112.1 51.5 -75.9 -31.9 8.1 30.1 6.4 21 21 A I H X S+ 0 0 9 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.892 110.7 49.7 -63.2 -42.7 9.9 26.7 6.7 22 22 A A H X S+ 0 0 17 -4,-2.4 4,-2.5 -5,-0.3 -2,-0.2 0.900 108.1 53.3 -61.8 -41.4 13.2 28.6 6.3 23 23 A L H X S+ 0 0 40 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.916 111.7 44.9 -61.9 -42.0 12.1 31.0 9.1 24 24 A A H X S+ 0 0 2 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.904 112.0 51.9 -67.9 -41.6 11.4 28.1 11.4 25 25 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.904 108.9 51.7 -59.2 -45.8 14.7 26.4 10.5 26 26 A E H X S+ 0 0 84 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.954 111.2 45.0 -53.9 -53.0 16.5 29.6 11.2 27 27 A K H X S+ 0 0 41 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.861 112.9 55.0 -62.8 -31.8 14.9 30.0 14.7 28 28 A T H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.932 107.7 45.4 -65.4 -46.1 15.7 26.3 15.3 29 29 A L H <>S+ 0 0 3 -4,-2.5 5,-2.9 2,-0.2 4,-0.4 0.853 112.6 52.5 -72.2 -33.3 19.5 26.5 14.5 30 30 A K H ><5S+ 0 0 140 -4,-2.0 3,-1.6 -5,-0.2 -2,-0.2 0.980 109.0 49.1 -64.5 -54.9 19.7 29.6 16.7 31 31 A E H 3<5S+ 0 0 96 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.912 119.6 39.0 -44.8 -47.1 18.0 27.8 19.6 32 32 A L T 3<5S- 0 0 43 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.364 108.9-120.2 -89.1 -0.9 20.4 24.9 19.2 33 33 A G T < 5S+ 0 0 41 -3,-1.6 -3,-0.2 -4,-0.4 3,-0.2 0.870 77.5 122.3 60.4 40.4 23.6 26.8 18.4 34 34 A L > < + 0 0 15 -5,-2.9 3,-2.0 1,-0.1 4,-0.2 -0.141 19.9 137.7-123.6 38.0 23.9 25.1 15.0 35 35 A E G > + 0 0 100 -6,-0.4 3,-1.7 1,-0.3 -1,-0.1 0.787 62.2 65.5 -57.1 -33.9 23.9 28.3 12.8 36 36 A E G 3 S+ 0 0 133 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.614 93.1 64.8 -69.1 -13.5 26.6 27.2 10.5 37 37 A Y G < + 0 0 62 -3,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.511 65.7 121.0 -84.9 -7.3 24.4 24.3 9.3 38 38 A Y < - 0 0 89 -3,-1.7 -16,-0.0 -4,-0.2 -12,-0.0 -0.425 66.0-126.2 -60.6 125.7 21.8 26.6 7.7 39 39 A P - 0 0 17 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 -0.203 5.4-124.1 -84.8 169.6 21.9 25.4 4.1 40 40 A D S S+ 0 0 178 1,-0.3 2,-0.4 2,-0.1 -2,-0.1 0.874 105.1 28.0 -76.5 -32.6 22.4 27.3 0.9 41 41 A N > + 0 0 52 1,-0.1 3,-0.8 2,-0.0 -1,-0.3 -0.841 62.9 178.3-129.9 98.0 19.1 26.1 -0.6 42 42 A V G > S+ 0 0 15 -2,-0.4 3,-2.0 -3,-0.3 4,-0.2 0.821 76.6 67.8 -68.9 -28.8 16.4 25.2 1.9 43 43 A T G > S+ 0 0 47 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.772 87.2 68.5 -67.5 -25.4 13.8 24.3 -0.8 44 44 A K G < S+ 0 0 150 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.633 101.1 49.0 -55.3 -22.3 15.9 21.2 -1.8 45 45 A Y G < S+ 0 0 63 -3,-2.0 3,-0.4 -4,-0.2 2,-0.3 0.354 87.3 105.3-104.1 1.3 15.0 19.7 1.6 46 46 A I < + 0 0 16 -3,-1.3 140,-0.1 -4,-0.2 4,-0.0 -0.677 59.8 49.7 -87.9 136.0 11.3 20.3 1.5 47 47 A G S S+ 0 0 18 -2,-0.3 60,-0.3 118,-0.0 -1,-0.2 -0.104 89.7 67.8 136.8 -44.2 8.9 17.3 0.9 48 48 A G S S- 0 0 47 -3,-0.4 4,-0.4 1,-0.3 3,-0.1 0.351 104.9 -94.3 -90.6 3.0 9.7 14.4 3.2 49 49 A G > - 0 0 21 1,-0.2 4,-2.3 2,-0.1 -1,-0.3 -0.240 45.4 -67.2 104.3 162.9 8.7 16.0 6.5 50 50 A V H > S+ 0 0 22 57,-0.3 4,-2.6 1,-0.2 5,-0.2 0.887 129.7 54.6 -56.6 -40.4 10.5 17.9 9.3 51 51 A R H > S+ 0 0 110 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.944 109.5 44.2 -61.9 -50.2 12.4 14.8 10.3 52 52 A A H > S+ 0 0 28 -4,-0.4 4,-1.9 1,-0.2 5,-0.2 0.900 113.3 54.6 -61.9 -39.6 13.9 14.2 6.8 53 53 A L H X S+ 0 0 6 -4,-2.3 4,-1.9 1,-0.2 3,-0.3 0.960 110.8 42.8 -58.0 -52.2 14.6 17.9 6.5 54 54 A L H X S+ 0 0 1 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.818 111.3 56.7 -66.8 -34.7 16.6 18.1 9.8 55 55 A E H X S+ 0 0 68 -4,-2.3 4,-1.2 -5,-0.2 -1,-0.2 0.859 111.3 41.6 -64.2 -37.5 18.4 14.8 9.0 56 56 A K H < S+ 0 0 120 -4,-1.9 -2,-0.2 -3,-0.3 -1,-0.2 0.841 118.9 45.9 -82.3 -28.1 19.7 16.1 5.7 57 57 A V H < S+ 0 0 3 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.944 124.6 29.1 -75.3 -43.9 20.5 19.5 7.1 58 58 A L H >< S+ 0 0 0 -4,-3.0 3,-3.0 1,-0.2 -3,-0.2 0.644 79.3 175.2 -93.9 -19.0 22.3 18.4 10.3 59 59 A K G >< S+ 0 0 124 -4,-1.2 3,-1.6 -5,-0.3 -1,-0.2 -0.234 77.5 9.6 46.7-113.9 23.7 15.0 9.2 60 60 A D G 3 S+ 0 0 135 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.675 128.7 60.6 -67.7 -13.2 25.8 13.8 12.1 61 61 A K G < S+ 0 0 93 -3,-3.0 -1,-0.3 -6,-0.1 -2,-0.2 0.435 78.7 120.8 -92.0 2.6 24.5 16.5 14.4 62 62 A F < - 0 0 32 -3,-1.6 2,-0.3 -7,-0.2 -7,-0.1 -0.452 37.2-178.8 -70.4 141.6 20.9 15.4 14.1 63 63 A R > - 0 0 130 -2,-0.1 3,-2.7 1,-0.1 4,-0.5 -0.997 34.1-124.9-138.3 139.3 18.9 14.4 17.3 64 64 A E T >> S+ 0 0 105 -2,-0.3 3,-1.1 1,-0.3 4,-0.6 0.796 107.4 63.5 -57.8 -32.6 15.3 13.2 17.4 65 65 A E H 3> S+ 0 0 94 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.591 86.5 73.8 -66.2 -9.3 14.3 15.8 19.9 66 66 A Y H <> S+ 0 0 37 -3,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.784 83.6 67.4 -77.4 -25.7 15.1 18.6 17.4 67 67 A V H <> S+ 0 0 14 -3,-1.1 4,-2.5 -4,-0.5 5,-0.2 0.978 100.6 48.0 -53.3 -54.5 12.0 17.7 15.5 68 68 A E H X S+ 0 0 154 -4,-0.6 4,-2.5 1,-0.2 -1,-0.2 0.875 110.6 52.9 -55.3 -39.6 9.9 19.0 18.4 69 69 A V H X S+ 0 0 18 -4,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.920 110.0 46.5 -59.7 -47.1 12.0 22.2 18.5 70 70 A F H X S+ 0 0 2 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.961 113.1 49.7 -61.3 -50.3 11.5 22.9 14.8 71 71 A R H X S+ 0 0 31 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.908 106.8 55.2 -60.3 -42.1 7.8 22.3 15.1 72 72 A K H X S+ 0 0 95 -4,-2.5 4,-1.3 -5,-0.2 -1,-0.2 0.922 111.9 43.1 -53.0 -47.2 7.5 24.5 18.1 73 73 A H H X S+ 0 0 18 -4,-1.9 4,-0.5 2,-0.2 -2,-0.2 0.891 111.9 52.3 -72.1 -37.5 9.0 27.4 16.2 74 74 A Y H >< S+ 0 0 4 -4,-2.7 3,-1.2 1,-0.2 -1,-0.2 0.905 108.3 53.9 -62.1 -38.8 7.0 26.8 13.0 75 75 A L H 3< S+ 0 0 52 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.801 99.6 60.3 -68.4 -26.8 3.9 26.9 15.2 76 76 A E H 3< S+ 0 0 99 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.733 125.3 17.6 -74.9 -9.1 4.8 30.2 16.6 77 77 A N << + 0 0 62 -3,-1.2 -1,-0.2 -4,-0.5 3,-0.2 -0.349 69.8 160.1-154.7 64.8 4.6 31.6 13.0 78 78 A P S S+ 0 0 15 0, 0.0 2,-0.4 0, 0.0 4,-0.1 0.807 76.4 28.7 -64.6 -30.2 2.7 29.2 10.7 79 79 A V + 0 0 37 -4,-0.1 -62,-0.0 1,-0.1 4,-0.0 -0.902 66.6 120.1-137.6 108.6 2.0 31.9 8.1 80 80 A V S S+ 0 0 70 -2,-0.4 -1,-0.1 -3,-0.2 -60,-0.0 0.557 100.0 3.2-120.3 -61.7 4.3 34.9 7.4 81 81 A Y S S+ 0 0 131 -64,-0.1 -65,-0.1 2,-0.0 -63,-0.1 0.545 101.0 119.4 -94.9 -16.3 5.3 34.5 3.8 82 82 A T + 0 0 4 -65,-0.2 -65,-0.2 -4,-0.1 -67,-0.0 -0.312 33.4 162.4 -65.2 134.4 3.2 31.4 3.0 83 83 A K E -H 16 0C 142 -67,-0.7 -67,-3.2 -2,-0.0 -2,-0.0 -0.982 44.4 -95.5-142.7 155.5 0.5 31.7 0.2 84 84 A P E -H 15 0C 32 0, 0.0 -69,-0.2 0, 0.0 3,-0.1 -0.311 55.7 -97.7 -59.1 149.6 -1.5 29.4 -1.9 85 85 A Y > - 0 0 19 -71,-1.9 3,-2.7 -72,-0.2 100,-0.0 -0.498 54.9 -81.7 -64.8 145.6 0.2 28.9 -5.3 86 86 A P T 3 S+ 0 0 104 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.193 120.9 18.7 -42.9 133.4 -1.4 31.2 -8.0 87 87 A E T 3> S+ 0 0 67 114,-0.1 4,-2.4 -3,-0.1 5,-0.2 0.364 92.2 111.6 77.9 -5.4 -4.5 29.5 -9.3 88 88 A I H <> S+ 0 0 3 -3,-2.7 4,-2.6 2,-0.2 5,-0.2 0.972 79.7 43.8 -61.0 -54.0 -4.9 27.2 -6.3 89 89 A P H > S+ 0 0 52 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.961 115.9 49.8 -56.0 -47.9 -8.1 29.0 -4.9 90 90 A Y H > S+ 0 0 129 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.933 112.2 47.8 -53.4 -45.9 -9.5 29.1 -8.5 91 91 A T H X S+ 0 0 2 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.915 110.6 48.8 -70.4 -42.0 -8.8 25.4 -9.0 92 92 A L H X S+ 0 0 1 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.918 111.5 51.6 -57.9 -47.9 -10.2 24.2 -5.7 93 93 A E H X S+ 0 0 104 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.930 111.3 47.5 -56.2 -47.6 -13.4 26.2 -6.4 94 94 A A H X S+ 0 0 17 -4,-2.5 4,-0.6 -5,-0.2 -1,-0.2 0.890 114.2 45.9 -59.7 -43.7 -13.7 24.6 -9.9 95 95 A L H ><>S+ 0 0 0 -4,-2.1 5,-1.6 -5,-0.2 3,-0.9 0.931 112.4 49.0 -70.8 -43.4 -13.2 21.1 -8.6 96 96 A K H ><5S+ 0 0 73 -4,-2.5 3,-1.6 1,-0.3 -1,-0.2 0.907 108.5 53.9 -66.0 -38.1 -15.5 21.3 -5.7 97 97 A S H 3<5S+ 0 0 90 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.677 102.0 57.6 -72.8 -11.1 -18.3 22.8 -7.9 98 98 A K T <<5S- 0 0 69 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.598 126.5-105.6 -92.1 -8.2 -18.0 19.9 -10.3 99 99 A G T < 5 + 0 0 36 -3,-1.6 -3,-0.2 -4,-0.5 -2,-0.1 0.350 67.4 149.2 104.5 -4.3 -18.8 17.8 -7.2 100 100 A F < - 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0 0 45 -175,-0.2 -2,-0.1 1,-0.1 3,-0.1 -0.517 43.9-176.0 -78.0 125.7 11.0 19.5 -7.2 188 188 A K S S+ 0 0 191 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.713 70.9 33.2 -92.2 -30.1 13.3 20.1 -10.1 189 189 A L - 0 0 154 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 -0.998 63.5-174.1-132.5 146.4 13.7 16.5 -11.3 190 190 A N - 0 0 50 -2,-0.4 -25,-0.1 -3,-0.1 -9,-0.0 -0.993 15.8-177.0-132.2 131.2 11.2 13.6 -11.2 191 191 A S + 0 0 106 -2,-0.4 2,-0.3 2,-0.0 -1,-0.1 0.509 60.8 93.7-109.7 1.4 11.7 10.0 -12.1 192 192 A Q - 0 0 53 1,-0.0 -11,-0.0 0, 0.0 -2,-0.0 -0.686 66.6-141.9 -86.3 144.0 8.2 8.8 -11.5 193 193 A I - 0 0 136 -2,-0.3 4,-0.1 -27,-0.0 -14,-0.1 -0.887 23.6-171.1-102.6 106.3 5.7 8.7 -14.4 194 194 A P - 0 0 16 0, 0.0 -14,-0.2 0, 0.0 3,-0.1 -0.280 37.6-108.0 -83.8 171.4 2.2 9.8 -13.3 195 195 A D S S+ 0 0 80 -16,-1.0 2,-0.4 1,-0.2 -15,-0.2 0.847 105.0 23.5 -60.5 -33.6 -1.1 9.5 -15.2 196 196 A F E -f 180 0B 28 -17,-1.5 -15,-2.5 2,-0.0 2,-0.5 -0.979 63.4-155.5-140.3 144.8 -1.0 13.3 -15.6 197 197 A T E -f 181 0B 78 -2,-0.4 2,-0.5 -17,-0.2 -15,-0.2 -0.984 16.1-163.2-120.6 125.4 1.6 16.0 -15.5 198 198 A L E -f 182 0B 3 -17,-3.4 -15,-3.0 -2,-0.5 -14,-0.3 -0.921 17.2-175.8-114.4 126.4 0.4 19.5 -14.5 199 199 A S S S+ 0 0 72 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.739 80.9 13.7 -91.8 -24.7 2.4 22.6 -15.2 200 200 A R S > S- 0 0 141 1,-0.1 3,-1.3 -17,-0.1 4,-0.4 -0.980 80.6-112.7-142.2 160.2 -0.1 24.9 -13.5 201 201 A P T > S+ 0 0 6 0, 0.0 3,-2.5 0, 0.0 4,-0.5 0.919 112.6 61.6 -61.7 -44.0 -3.0 24.2 -11.2 202 202 A S T >> S+ 0 0 27 1,-0.3 4,-1.9 2,-0.2 3,-0.8 0.752 85.2 80.7 -58.6 -18.2 -5.7 25.4 -13.6 203 203 A D H <> S+ 0 0 39 -3,-1.3 4,-1.6 1,-0.3 -1,-0.3 0.849 83.9 61.2 -54.3 -33.2 -4.5 22.5 -15.9 204 204 A L H <> S+ 0 0 4 -3,-2.5 4,-1.3 -4,-0.4 -1,-0.3 0.904 102.6 50.9 -55.3 -42.1 -6.6 20.2 -13.7 205 205 A V H <> S+ 0 0 10 -3,-0.8 4,-2.8 -4,-0.5 -2,-0.2 0.909 104.7 55.2 -69.3 -41.0 -9.6 22.2 -14.8 206 206 A K H X S+ 0 0 147 -4,-1.9 4,-1.8 2,-0.2 6,-0.3 0.875 104.8 54.5 -52.2 -39.5 -8.7 21.9 -18.5 207 207 A L H <>S+ 0 0 30 -4,-1.6 5,-2.6 1,-0.2 6,-1.6 0.902 109.7 48.0 -68.0 -36.2 -8.6 18.1 -18.2 208 208 A X H ><5S+ 0 0 11 -4,-1.3 3,-1.7 4,-0.2 -2,-0.2 0.934 108.1 53.6 -66.1 -45.0 -12.1 18.3 -16.8 209 209 A D H 3<5S+ 0 0 114 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.818 110.2 48.1 -58.1 -32.8 -13.3 20.7 -19.6 210 210 A N T 3<5S- 0 0 112 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.403 114.8-117.6 -90.5 5.2 -12.1 18.1 -22.2 211 211 A H T < 5S+ 0 0 122 -3,-1.7 -3,-0.2 2,-0.3 3,-0.2 0.761 79.8 128.9 62.4 25.8 -13.8 15.3 -20.3 212 212 A I S