==== 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 HYDROLASE 13-MAY-04 1T8Q . COMPND 2 MOLECULE: GLYCEROPHOSPHORYL DIESTER PHOSPHODIESTERASE, PERI . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.ZHANG,Y.KIM,I.DEMENTIEVA,N.DUKE,L.STOLS,M.DONNELLY,A.JOACH . 1312 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 51505.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 883 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 146 11.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 96 7.3 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 . 12 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.6 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 . 84 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 171 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 290 22.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 37 2.8 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 9 7 5 3 4 10 2 4 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 17 8 0 12 0 4 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 . 22 0 8 4 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 . 8 2 0 0 0 0 0 0 0 0 4 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 29 A N 0 0 193 0, 0.0 326,-0.0 0, 0.0 327,-0.0 0.000 360.0 360.0 360.0 7.6 -10.6 -12.1 5.7 2 30 A E + 0 0 129 2,-0.1 2,-0.2 312,-0.0 311,-0.0 0.217 360.0 116.8-115.4 13.2 -10.8 -8.4 6.4 3 31 A K - 0 0 49 324,-0.1 2,-0.3 311,-0.0 311,-0.2 -0.567 52.1-150.2 -78.8 145.2 -8.0 -8.2 9.0 4 32 A I E -a 314 0A 27 309,-2.3 311,-0.9 -2,-0.2 2,-0.5 -0.862 10.7-139.9-122.3 156.8 -5.0 -6.1 8.0 5 33 A V E -a 315 0A 1 -2,-0.3 27,-1.9 25,-0.2 28,-1.6 -0.960 15.7-164.1-113.5 123.0 -1.3 -6.0 8.7 6 34 A I E -ab 316 33A 0 309,-2.2 311,-2.1 -2,-0.5 2,-0.9 -0.953 18.2-134.1-112.9 119.0 0.3 -2.6 9.2 7 35 A A E > -ab 317 34A 0 26,-2.7 28,-2.4 -2,-0.6 3,-1.8 -0.620 18.2-139.9 -76.5 104.8 4.1 -2.5 9.0 8 36 A H T 3> S- 0 0 9 309,-2.1 4,-0.7 -2,-0.9 10,-0.1 -0.554 86.3 -20.3 -70.3 103.7 5.3 -0.5 12.0 9 37 A R T 34 S- 0 0 45 -2,-0.8 9,-2.6 8,-0.1 -1,-0.3 0.820 123.1 -76.3 61.4 32.5 8.1 1.6 10.6 10 38 A G T <4 S- 0 0 0 -3,-1.8 2,-1.9 1,-0.2 13,-0.2 -0.461 98.7 -19.7 79.3-155.2 8.2 -1.0 7.8 11 39 A A T >> S+ 0 0 0 11,-2.0 3,-2.3 1,-0.2 4,-1.8 -0.370 81.9 160.1 -83.7 57.5 9.8 -4.4 8.5 12 40 A S T 3< + 0 0 2 -2,-1.9 5,-0.3 -4,-0.7 96,-0.3 0.647 61.1 68.6 -55.3 -21.7 11.6 -2.8 11.4 13 41 A G T 34 S+ 0 0 1 305,-2.4 -1,-0.3 -3,-0.2 306,-0.1 0.637 115.1 26.0 -75.1 -11.5 12.3 -6.2 13.1 14 42 A Y T <4 S+ 0 0 12 -3,-2.3 -2,-0.2 304,-0.3 1106,-0.2 0.623 126.9 29.3-121.0 -28.1 14.7 -7.0 10.2 15 43 A L S < S- 0 0 0 -4,-1.8 -1,-0.3 93,-0.1 3,-0.1 -0.934 100.2 -70.5-135.2 158.7 16.0 -3.7 8.9 16 44 A P S > S- 0 0 0 0, 0.0 3,-1.2 0, 0.0 6,-0.4 -0.235 71.5 -93.0 -48.8 125.7 16.6 -0.2 10.2 17 45 A E T 3 S+ 0 0 18 -5,-0.3 2,-0.8 1,-0.2 -7,-0.2 0.020 98.6 1.3 -45.2 145.0 13.2 1.3 10.9 18 46 A H T 3 S+ 0 0 5 -9,-2.6 -1,-0.2 1,-0.2 5,-0.1 0.062 90.3 136.5 64.4 -22.3 11.5 3.4 8.2 19 47 A T <> - 0 0 3 -3,-1.2 4,-2.8 -2,-0.8 3,-0.4 -0.135 68.7-114.7 -54.5 146.9 14.3 3.0 5.7 20 48 A L H > S+ 0 0 11 1,-0.3 4,-3.2 96,-0.3 5,-0.2 0.878 119.1 55.4 -53.4 -36.8 13.1 2.3 2.1 21 49 A P H > S+ 0 0 11 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.946 109.7 44.9 -63.7 -39.9 14.8 -1.1 2.4 22 50 A A H > S+ 0 0 0 -3,-0.4 -11,-2.0 -6,-0.4 4,-1.9 0.897 115.9 48.0 -66.2 -38.1 12.7 -1.9 5.5 23 51 A K H X S+ 0 0 0 -4,-2.8 4,-2.3 -13,-0.2 -1,-0.2 0.865 110.1 52.1 -68.3 -37.2 9.6 -0.4 3.7 24 52 A A H X S+ 0 0 0 -4,-3.2 4,-2.4 -5,-0.3 -2,-0.2 0.894 109.9 48.7 -66.9 -41.0 10.4 -2.5 0.6 25 53 A X H X S+ 0 0 2 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.895 111.0 50.1 -66.1 -40.4 10.6 -5.7 2.7 26 54 A A H <>S+ 0 0 0 -4,-1.9 5,-2.1 2,-0.2 4,-0.4 0.942 110.5 50.2 -62.6 -45.7 7.3 -5.0 4.4 27 55 A Y H ><5S+ 0 0 1 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.956 113.2 45.7 -57.1 -51.8 5.7 -4.4 1.1 28 56 A A H 3<5S+ 0 0 25 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.822 105.8 60.7 -62.3 -32.4 7.0 -7.7 -0.3 29 57 A Q T 3<5S- 0 0 26 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.502 124.8 -97.7 -75.9 -2.4 6.0 -9.6 2.9 30 58 A G T < 5 + 0 0 28 -3,-1.6 -25,-0.2 -4,-0.4 -3,-0.2 0.658 59.4 168.2 99.3 17.3 2.4 -8.7 2.3 31 59 A A < - 0 0 0 -5,-2.1 -1,-0.2 1,-0.2 -25,-0.2 -0.433 27.1-153.3 -63.9 134.0 1.8 -5.6 4.6 32 60 A D S S+ 0 0 63 -27,-1.9 107,-2.3 1,-0.2 2,-0.3 0.814 81.9 20.6 -77.5 -28.9 -1.6 -4.0 3.8 33 61 A Y E -bc 6 139A 20 -28,-1.6 -26,-2.7 105,-0.2 2,-0.5 -0.992 67.8-145.7-141.2 145.4 -0.3 -0.6 5.0 34 62 A L E -bc 7 140A 0 105,-2.4 107,-1.7 -2,-0.3 2,-0.3 -0.957 25.8-135.8-111.4 126.9 3.2 0.9 5.6 35 63 A E E - c 0 141A 1 -28,-2.4 2,-0.3 -2,-0.5 -26,-0.1 -0.644 17.0-166.8 -90.5 139.1 3.5 3.2 8.5 36 64 A Q E - c 0 142A 0 105,-1.3 107,-2.0 -2,-0.3 2,-0.4 -0.913 9.7-156.7-119.7 147.5 5.3 6.6 8.6 37 65 A D E - c 0 143A 1 -2,-0.3 12,-1.0 105,-0.2 2,-0.4 -0.983 24.7-155.8-117.6 135.0 6.2 8.8 11.6 38 66 A L E +Dc 48 144A 0 105,-2.4 107,-2.3 -2,-0.4 2,-0.3 -0.938 25.2 155.9-127.2 140.0 6.7 12.4 10.6 39 67 A V E -D 47 0A 1 8,-1.8 8,-2.5 -2,-0.4 2,-0.3 -0.898 36.6-108.2-142.5 168.2 8.5 15.5 11.9 40 68 A X E -D 46 0A 9 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.790 19.2-135.5-109.9 150.7 9.7 18.7 10.2 41 69 A T > - 0 0 0 4,-2.4 3,-1.2 -2,-0.3 36,-0.2 -0.268 36.2 -99.3 -87.4 177.9 13.2 19.9 9.3 42 70 A K T 3 S+ 0 0 95 37,-2.9 38,-0.2 34,-0.6 35,-0.1 0.864 126.5 50.9 -68.1 -35.3 14.5 23.4 9.8 43 71 A D T 3 S- 0 0 68 36,-0.4 -1,-0.3 1,-0.0 37,-0.1 -0.036 124.7-104.5 -94.3 34.3 13.7 24.2 6.2 44 72 A D S < S+ 0 0 77 -3,-1.2 2,-0.2 1,-0.2 -2,-0.1 0.685 71.8 141.9 55.1 29.5 10.2 22.9 6.6 45 73 A N - 0 0 42 75,-0.0 -4,-2.4 74,-0.0 2,-0.6 -0.598 51.8-122.2 -90.7 163.5 10.5 19.6 4.8 46 74 A L E -D 40 0A 0 -6,-0.2 74,-2.6 -2,-0.2 75,-0.3 -0.931 32.6-172.3-108.8 116.5 8.6 16.6 6.2 47 75 A V E -DE 39 119A 0 -8,-2.5 -8,-1.8 -2,-0.6 2,-1.1 -0.812 29.1-116.6-111.4 153.0 11.0 13.7 7.0 48 76 A V E +D 38 0A 3 70,-2.7 70,-0.4 -2,-0.3 2,-0.3 -0.745 55.9 142.6 -89.9 98.3 10.1 10.1 8.1 49 77 A L - 0 0 1 -2,-1.1 96,-0.1 -12,-1.0 -31,-0.1 -1.000 57.0-125.5-138.2 134.8 11.6 9.8 11.6 50 78 A H S S- 0 0 34 -2,-0.3 2,-0.3 -33,-0.1 -12,-0.1 0.782 91.0 -8.6 -54.7 -29.0 10.2 7.9 14.6 51 79 A D S S- 0 0 38 2,-0.3 -12,-0.1 -14,-0.1 25,-0.1 -0.918 84.4 -84.4-154.9 179.5 10.4 11.0 16.8 52 80 A H S S+ 0 0 22 -2,-0.3 24,-1.4 -14,-0.1 25,-0.5 0.319 96.5 86.2 -77.1 8.2 11.8 14.6 16.8 53 81 A Y B -L 75 0B 50 22,-0.2 -2,-0.3 23,-0.1 22,-0.2 -0.717 51.0-169.3-104.6 160.1 15.3 13.6 18.0 54 82 A L >> + 0 0 0 20,-2.0 3,-1.3 -2,-0.3 4,-0.8 0.593 69.1 84.4-117.5 -23.3 18.2 12.6 15.7 55 83 A D T 34 S+ 0 0 9 19,-0.8 20,-0.1 1,-0.2 -1,-0.1 0.169 87.8 49.3 -73.4 17.6 20.7 11.4 18.4 56 84 A R T 34 S+ 0 0 61 -2,-0.1 37,-2.0 -3,-0.1 -1,-0.2 0.338 119.9 31.3-132.7 2.6 19.4 7.8 18.9 57 85 A V T <4 S+ 0 0 3 -3,-1.3 33,-2.7 35,-0.2 2,-0.3 0.265 117.7 41.3-140.7 6.3 19.1 6.6 15.2 58 86 A T B < S-M 89 0C 4 -4,-0.8 3,-0.3 31,-0.2 31,-0.2 -0.897 79.0-109.5-146.1 177.5 21.9 8.6 13.5 59 87 A D S >> S+ 0 0 33 29,-0.8 4,-2.0 -2,-0.3 3,-1.5 0.111 70.5 128.0 -97.7 20.5 25.5 9.7 13.8 60 88 A V H 3> + 0 0 0 -6,-0.3 4,-3.0 1,-0.3 -1,-0.2 0.795 63.4 62.8 -45.8 -39.4 24.4 13.4 14.2 61 89 A A H 34 S+ 0 0 32 -3,-0.3 -1,-0.3 1,-0.2 6,-0.1 0.863 111.8 35.5 -58.6 -39.1 26.5 13.8 17.4 62 90 A D H <4 S+ 0 0 123 -3,-1.5 -1,-0.2 2,-0.1 -2,-0.2 0.827 118.6 52.2 -83.5 -34.1 29.8 13.2 15.6 63 91 A R H < S+ 0 0 102 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.866 130.2 12.4 -69.5 -43.3 28.7 14.9 12.3 64 92 A F S >< S+ 0 0 44 -4,-3.0 3,-2.1 -5,-0.2 -1,-0.2 -0.492 73.7 168.0-135.9 63.4 27.5 18.2 13.9 65 93 A P T 3 S+ 0 0 72 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.645 75.9 49.6 -52.8 -21.4 28.9 18.1 17.5 66 94 A D T 3 S+ 0 0 151 1,-0.2 -5,-0.1 0, 0.0 -2,-0.0 0.374 91.1 82.3-102.5 6.9 28.2 21.8 18.2 67 95 A R < + 0 0 74 -3,-2.1 8,-0.4 -7,-0.2 2,-0.2 0.180 61.2 115.3 -96.8 15.7 24.5 21.7 17.0 68 96 A A - 0 0 35 -3,-0.3 6,-0.2 6,-0.1 5,-0.0 -0.535 64.6-115.2 -86.0 154.0 22.8 20.3 20.1 69 97 A R > - 0 0 72 4,-2.5 3,-2.4 -2,-0.2 -1,-0.1 -0.133 41.8 -84.5 -78.0 178.5 20.3 22.3 22.1 70 98 A K T 3 S+ 0 0 108 1,-0.3 486,-2.9 2,-0.1 -1,-0.1 0.685 129.0 58.6 -59.5 -18.6 20.7 23.5 25.7 71 99 A D T 3 S- 0 0 57 2,-0.2 -1,-0.3 484,-0.2 3,-0.1 0.430 117.5-112.7 -90.7 1.8 19.5 20.1 26.9 72 100 A G S < S+ 0 0 35 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.448 77.9 122.3 84.4 0.2 22.2 18.4 25.0 73 101 A R - 0 0 49 -5,-0.0 -4,-2.5 -6,-0.0 2,-0.5 -0.688 59.7-128.8 -99.2 151.3 19.9 16.7 22.5 74 102 A Y - 0 0 26 -2,-0.3 -20,-2.0 -6,-0.2 -19,-0.8 -0.861 23.5-158.8 -99.3 126.6 19.9 17.0 18.7 75 103 A Y B > -L 53 0B 17 -2,-0.5 3,-2.6 -8,-0.4 -22,-0.2 -0.909 20.4-140.1-111.4 130.7 16.6 17.9 17.2 76 104 A A G > S+ 0 0 0 -24,-1.4 3,-2.0 -2,-0.4 -34,-0.6 0.842 101.7 67.4 -52.9 -35.1 15.7 17.3 13.5 77 105 A I G 3 S+ 0 0 8 -25,-0.5 -1,-0.3 1,-0.3 -33,-0.1 0.603 94.0 59.1 -65.9 -7.4 13.9 20.6 13.4 78 106 A D G < S+ 0 0 36 -3,-2.6 2,-0.3 2,-0.1 -1,-0.3 0.433 99.2 69.3 -99.4 1.1 17.3 22.3 13.8 79 107 A F S < S- 0 0 0 -3,-2.0 -37,-2.9 -4,-0.2 -36,-0.4 -0.902 79.1-119.7-123.5 148.5 18.8 20.8 10.6 80 108 A T > - 0 0 33 -2,-0.3 4,-2.6 -39,-0.2 5,-0.3 -0.396 34.0-106.9 -79.3 161.4 18.1 21.3 6.9 81 109 A L H > S+ 0 0 28 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.903 121.4 53.5 -53.9 -42.8 16.9 18.4 4.8 82 110 A D H > S+ 0 0 127 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.924 109.1 46.6 -59.7 -48.1 20.4 18.4 3.2 83 111 A E H >4 S+ 0 0 41 1,-0.2 3,-0.5 2,-0.2 4,-0.5 0.932 113.1 49.1 -60.9 -45.9 22.2 18.0 6.5 84 112 A I H >< S+ 0 0 0 -4,-2.6 3,-1.0 1,-0.3 33,-0.4 0.863 108.6 54.4 -62.4 -35.1 19.8 15.3 7.7 85 113 A K H 3< S+ 0 0 41 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.800 100.9 59.9 -70.5 -24.3 20.4 13.5 4.4 86 114 A S T << S+ 0 0 52 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.605 88.8 96.2 -77.5 -10.9 24.1 13.6 5.0 87 115 A L S < S- 0 0 0 -3,-1.0 2,-0.6 -4,-0.5 30,-0.3 -0.400 77.5-122.6 -78.6 155.8 23.7 11.6 8.2 88 116 A K - 0 0 110 28,-0.1 -29,-0.8 -2,-0.1 2,-0.3 -0.903 26.3-142.5-100.7 122.2 24.1 7.8 8.4 89 117 A F B -M 58 0C 11 26,-2.8 26,-0.5 -2,-0.6 2,-0.3 -0.610 23.3-177.8 -83.4 143.4 21.0 6.1 9.7 90 118 A T - 0 0 12 -33,-2.7 20,-0.1 -2,-0.3 3,-0.1 -0.944 39.4 -82.4-141.6 160.1 21.3 3.1 12.1 91 119 A E S S- 0 0 9 -2,-0.3 20,-0.2 18,-0.2 -79,-0.0 -0.388 74.5 -88.7 -54.5 135.5 19.3 0.5 14.0 92 120 A G - 0 0 13 10,-0.1 11,-1.9 18,-0.1 12,-0.5 -0.041 50.8-174.2 -56.0 152.6 18.3 2.4 17.1 93 121 A F E -N 102 0D 9 -37,-2.0 2,-0.3 9,-0.3 9,-0.2 -0.907 18.4-140.6-142.5 168.1 20.4 2.6 20.3 94 122 A D E -N 101 0D 86 7,-2.3 7,-2.5 -2,-0.3 2,-0.6 -0.773 31.0-110.6-120.3 167.0 20.5 3.8 23.9 95 123 A I E -N 100 0D 37 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.915 35.7-179.4-103.8 123.6 23.5 5.4 25.7 96 124 A E E > S-N 99 0D 101 3,-3.3 3,-1.6 -2,-0.6 -2,-0.0 -0.954 71.7 -23.2-129.9 109.9 24.8 3.0 28.5 97 125 A N T 3 S- 0 0 39 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.915 128.6 -49.4 53.4 48.6 27.8 4.3 30.5 98 126 A G T 3 S+ 0 0 47 1,-0.2 2,-0.3 441,-0.0 -1,-0.3 0.437 119.8 110.6 74.0 1.6 28.7 6.6 27.7 99 127 A K E < S-N 96 0D 80 -3,-1.6 -3,-3.3 489,-0.0 2,-0.5 -0.845 71.2-118.8-112.7 146.0 28.5 3.9 25.1 100 128 A K E -N 95 0D 84 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.691 34.0-174.5 -80.8 125.8 26.1 3.3 22.3 101 129 A V E -N 94 0D 38 -7,-2.5 -7,-2.3 -2,-0.5 2,-0.1 -0.988 29.3-115.2-125.9 125.4 24.3 -0.0 22.8 102 130 A Q E -N 93 0D 33 -2,-0.4 -9,-0.3 -9,-0.2 -10,-0.1 -0.363 19.8-146.9 -58.2 130.4 21.9 -1.5 20.2 103 131 A T S S+ 0 0 58 -11,-1.9 -1,-0.1 1,-0.3 -10,-0.1 0.929 90.7 35.8 -68.3 -45.1 18.4 -1.6 21.8 104 132 A Y > - 0 0 43 -12,-0.5 3,-1.8 1,-0.1 -1,-0.3 -0.810 69.7-172.9-112.7 90.6 17.3 -4.8 20.0 105 133 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.771 82.2 56.2 -52.7 -33.6 20.3 -7.1 19.7 106 134 A G T 3 S+ 0 0 43 184,-0.1 -2,-0.0 3,-0.0 2,-0.0 0.637 97.7 80.7 -77.0 -11.2 18.5 -9.7 17.4 107 135 A R S < S- 0 0 7 -3,-1.8 -93,-0.2 1,-0.2 3,-0.1 -0.115 101.7 -41.4 -86.4-174.8 17.7 -7.0 14.8 108 136 A F S S- 0 0 1 -96,-0.3 -1,-0.2 1,-0.1 2,-0.2 -0.165 76.2 -96.6 -50.4 132.9 19.8 -5.5 12.0 109 137 A P > - 0 0 30 0, 0.0 3,-1.8 0, 0.0 -18,-0.2 -0.304 43.2-107.3 -59.1 123.3 23.3 -4.8 13.2 110 138 A X T 3 S+ 0 0 68 1,-0.3 -20,-0.1 -2,-0.2 -18,-0.1 -0.108 95.9 3.4 -48.5 136.2 23.9 -1.2 14.3 111 139 A G T 3 S+ 0 0 56 1,-0.2 -1,-0.3 -20,-0.2 2,-0.1 0.454 96.2 135.0 65.6 1.6 26.0 1.0 12.0 112 140 A K < - 0 0 99 -3,-1.8 -1,-0.2 1000,-0.1 -21,-0.1 -0.351 62.1 -9.7 -80.5 164.3 26.4 -1.7 9.3 113 141 A S S S- 0 0 12 995,-0.2 2,-0.4 1,-0.1 997,-0.1 -0.094 101.6 -64.8 48.2-142.5 25.9 -1.1 5.6 114 142 A D + 0 0 17 995,-0.2 2,-0.3 -26,-0.0 -1,-0.1 -0.954 53.7 168.7-147.7 124.2 24.5 2.3 4.7 115 143 A F - 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0 0 91 -6,-0.4 -1,-0.3 1,-0.0 2,-0.2 -0.207 58.1-140.9 -78.2 171.9 32.2 3.0 67.2 466 165 B N + 0 0 102 -3,-0.1 2,-0.3 -5,-0.0 -9,-0.1 -0.556 27.2 175.4-135.9 71.6 32.8 6.2 65.2 467 166 B I - 0 0 17 -11,-0.2 -105,-0.2 -2,-0.2 -7,-0.1 -0.572 19.8-137.8 -81.2 138.6 31.1 5.8 61.8 468 167 B G E -u 362 0I 0 -107,-2.5 -105,-2.3 -2,-0.3 2,-0.3 -0.342 4.4-125.2 -93.7 173.4 31.0 8.7 59.5 469 168 B I E -ux 363 506I 0 36,-2.1 38,-1.3 -107,-0.2 -105,-0.2 -0.837 9.3-162.6-115.9 155.1 28.5 10.4 57.2 470 169 B Y E -u 364 0I 0 -107,-1.9 -105,-1.2 -2,-0.3 2,-0.2 -0.636 16.9-166.5-138.3 74.9 28.8 11.1 53.5 471 170 B P E -u 365 0I 0 0, 0.0 38,-2.5 0, 0.0 2,-0.5 -0.457 5.5-160.7 -72.7 130.8 26.2 13.7 52.4 472 171 B E E -uy 366 509I 9 -107,-2.4 -105,-2.7 -2,-0.2 2,-0.7 -0.947 12.2-143.1-110.5 122.9 25.4 14.3 48.8 473 172 B I E -u 367 0I 1 36,-1.8 38,-0.5 -2,-0.5 39,-0.3 -0.769 23.6-143.7 -83.5 113.8 23.6 17.5 47.9 474 173 B K - 0 0 13 -107,-2.2 5,-0.2 -2,-0.7 12,-0.1 -0.628 62.3 -21.7 -85.4 138.8 21.2 16.7 45.1 475 174 B A > + 0 0 4 -2,-0.3 4,-1.9 69,-0.2 3,-0.4 0.833 62.7 176.6 31.9 64.0 20.5 19.1 42.2 476 175 B P H > S+ 0 0 2 0, 0.0 4,-2.1 0, 0.0 10,-0.2 0.858 80.3 61.1 -62.5 -28.4 21.6 22.3 43.9 477 176 B W H > S+ 0 0 19 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.899 103.2 48.8 -62.7 -39.6 20.8 23.9 40.5 478 177 B F H > S+ 0 0 10 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.920 110.4 50.9 -66.1 -42.7 17.1 22.9 40.8 479 178 B H H <>S+ 0 0 1 -4,-1.9 5,-3.9 2,-0.2 -1,-0.2 0.866 109.0 51.7 -62.5 -36.0 16.9 24.2 44.3 480 179 B H H ><5S+ 0 0 64 -4,-2.1 3,-2.2 3,-0.2 -2,-0.2 0.934 108.2 50.5 -66.0 -45.3 18.4 27.5 43.1 481 180 B Q H 3<5S+ 0 0 75 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.874 111.1 50.5 -58.4 -35.8 15.8 27.7 40.4 482 181 B E T 3<5S- 0 0 67 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.271 125.1-106.6 -85.3 9.1 13.2 27.1 43.1 483 182 B G T < 5S+ 0 0 70 -3,-2.2 2,-0.3 1,-0.2 -3,-0.2 0.700 79.0 119.9 76.1 20.9 14.7 29.8 45.2 484 183 B K < - 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0 0 50 -3,-0.4 2,-0.2 5,-0.1 -3,-0.1 -0.573 37.9-117.2 -88.8 146.3 27.6 -6.6 37.5 622 321 B P > - 0 0 18 0, 0.0 3,-2.3 0, 0.0 -1,-0.1 -0.528 32.7-109.7 -78.4 150.7 29.5 -5.7 34.3 623 322 B E T 3 S+ 0 0 188 1,-0.3 -2,-0.0 -2,-0.2 -32,-0.0 0.764 115.1 64.1 -54.3 -24.9 30.2 -8.6 31.9 624 323 B Y T 3 S+ 0 0 18 1,-0.2 -31,-0.6 -33,-0.1 -30,-0.3 0.548 101.9 49.8 -80.0 -5.2 33.9 -8.3 32.8 625 324 B T < - 0 0 1 -3,-2.3 -1,-0.2 -33,-0.1 6,-0.1 -0.792 64.3-175.8-133.2 88.6 33.4 -9.2 36.5 626 325 B P S S+ 0 0 86 0, 0.0 2,-0.4 0, 0.0 -5,-0.1 0.721 76.6 32.5 -54.0 -31.7 31.2 -12.4 36.8 627 326 B D S >> S- 0 0 66 1,-0.1 3,-1.5 0, 0.0 4,-0.8 -0.984 87.2-117.3-131.6 149.0 31.2 -12.2 40.5 628 327 B V H >> S+ 0 0 16 -2,-0.4 4,-2.3 1,-0.3 3,-0.6 0.778 109.2 64.8 -54.3 -32.2 31.3 -9.1 42.7 629 328 B N H 3> S+ 0 0 55 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.861 97.2 56.2 -61.8 -33.7 34.6 -10.0 44.4 630 329 B Q H <> S+ 0 0 78 -3,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.832 109.9 47.3 -65.4 -30.7 36.3 -9.6 41.0 631 330 B L H S+ 0 0 73 -4,-2.3 4,-2.0 -5,-0.2 5,-1.9 0.956 108.0 51.8 -68.0 -50.2 39.4 -6.5 43.4 634 333 B A H <>S+ 0 0 3 -4,-2.3 5,-2.7 3,-0.2 6,-0.2 0.879 122.0 34.1 -53.9 -39.0 39.6 -4.6 40.1 635 334 B L H <5S+ 0 0 0 -4,-2.0 6,-2.6 3,-0.2 5,-0.3 0.911 123.8 38.2 -85.7 -47.5 38.8 -1.4 42.0 636 335 B Y H <5S+ 0 0 0 -4,-3.3 -3,-0.2 -5,-0.3 -2,-0.2 0.921 134.1 17.9 -71.6 -42.4 40.4 -1.8 45.4 637 336 B N T <5S+ 0 0 89 -4,-2.0 -3,-0.2 -5,-0.5 -4,-0.1 0.920 129.6 37.5 -96.9 -55.8 43.6 -3.5 44.3 638 337 B K T > + 0 0 10 -32,-0.5 4,-1.5 1,-0.2 3,-1.0 -0.655 65.2 176.1-127.1 75.1 26.1 -4.4 49.8 649 348 B P H 3> S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 3,-0.3 0.883 78.6 54.4 -45.9 -51.5 28.3 -3.2 52.7 650 349 B D H 3> S+ 0 0 17 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.831 104.2 54.2 -56.1 -36.3 28.9 -6.7 54.0 651 350 B K H <> S+ 0 0 69 -3,-1.0 4,-1.7 2,-0.2 -1,-0.2 0.925 112.6 43.5 -65.7 -42.1 30.2 -8.0 50.7 652 351 B A H X S+ 0 0 0 -4,-1.5 4,-2.4 -3,-0.3 5,-0.2 0.931 114.9 49.8 -67.1 -46.1 32.8 -5.2 50.5 653 352 B V H X S+ 0 0 25 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.950 111.7 47.4 -57.7 -51.2 33.8 -5.6 54.2 654 353 B K H < S+ 0 0 131 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.849 111.0 53.3 -60.5 -34.4 34.2 -9.4 53.9 655 354 B F H >< S+ 0 0 14 -4,-1.7 3,-1.4 -5,-0.2 -1,-0.2 0.926 108.8 47.5 -67.6 -44.1 36.3 -8.8 50.7 656 355 B L H 3< S+ 0 0 49 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.770 111.2 52.0 -68.4 -25.1 38.7 -6.4 52.4 657 356 B N T 3< 0 0 126 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.269 360.0 360.0 -94.5 13.1 39.1 -8.7 55.4 658 357 B K < 0 0 169 -3,-1.4 -1,-0.2 -5,-0.1 -2,-0.1 0.979 360.0 360.0 -54.4 360.0 40.0 -11.6 53.1 659 !* 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 0.0 660 29 C N 0 0 172 0, 0.0 312,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-125.9 22.7 -28.8 68.0 661 30 C E - 0 0 175 2,-0.0 311,-0.0 311,-0.0 0, 0.0 0.715 360.0-116.5 105.9 76.6 24.3 -25.6 66.7 662 31 C K - 0 0 53 1,-0.1 2,-0.3 309,-0.1 311,-0.2 0.134 30.9-138.7 -36.9 144.0 23.6 -23.1 69.4 663 32 C I E -m 973 0R 24 309,-1.9 311,-0.9 27,-0.0 2,-0.5 -0.789 7.6-140.7-116.3 158.7 21.5 -20.0 68.5 664 33 C V E -m 974 0R 1 -2,-0.3 27,-1.9 25,-0.2 28,-1.5 -0.951 15.9-163.5-112.9 128.0 21.4 -16.3 69.2 665 34 C I E -mn 975 692R 0 309,-2.0 311,-2.0 -2,-0.5 2,-0.9 -0.959 18.5-134.1-117.0 116.4 18.0 -14.7 69.9 666 35 C A E > -mn 976 693R 0 26,-2.9 28,-2.4 -2,-0.6 3,-1.9 -0.589 18.7-139.8 -74.4 104.9 17.9 -11.0 69.6 667 36 C H T 3> S- 0 0 10 309,-2.1 4,-0.6 -2,-0.9 10,-0.1 -0.542 86.4 -20.4 -68.4 101.8 16.0 -9.8 72.7 668 37 C R T 34 S- 0 0 47 -2,-0.9 9,-2.4 8,-0.1 -1,-0.3 0.880 123.6 -75.7 62.3 37.3 13.7 -7.0 71.3 669 38 C G T <4 S- 0 0 0 -3,-1.9 2,-1.9 1,-0.2 13,-0.2 -0.329 97.1 -22.6 72.2-157.9 16.3 -6.9 68.5 670 39 C A T >> S+ 0 0 0 11,-2.0 3,-2.6 1,-0.2 4,-1.7 -0.278 81.3 157.4 -82.9 54.1 19.7 -5.3 69.0 671 40 C S T 3< + 0 0 2 -2,-1.9 96,-0.3 -4,-0.6 5,-0.2 0.562 60.3 71.1 -57.2 -13.1 18.2 -3.3 71.9 672 41 C G T 34 S+ 0 0 1 305,-2.3 -1,-0.3 -3,-0.2 306,-0.1 0.674 114.5 25.9 -78.2 -13.9 21.6 -2.8 73.5 673 42 C Y T <4 S+ 0 0 8 -3,-2.6 -2,-0.2 304,-0.3 -211,-0.2 0.698 128.7 24.1-116.3 -34.4 22.3 -0.5 70.6 674 43 C L S < S- 0 0 0 -4,-1.7 -1,-0.3 93,-0.1 3,-0.1 -0.905 100.2 -66.3-132.7 161.6 19.0 1.0 69.3 675 44 C P S > S- 0 0 1 0, 0.0 3,-1.1 0, 0.0 6,-0.3 -0.186 71.9 -88.9 -49.7 134.4 15.5 1.5 70.8 676 45 C E T 3 S- 0 0 16 1,-0.2 -7,-0.2 -5,-0.2 -8,-0.1 -0.094 99.1 -4.4 -53.2 137.6 13.9 -1.9 71.5 677 46 C H T 3 S+ 0 0 4 -9,-2.4 -1,-0.2 1,-0.2 -8,-0.1 0.192 91.2 138.6 68.4 -16.1 11.9 -3.7 68.9 678 47 C T <> - 0 0 3 -3,-1.1 4,-2.3 -10,-0.2 3,-0.5 -0.204 68.2-113.0 -57.9 149.9 12.2 -0.8 66.4 679 48 C L H > S+ 0 0 12 1,-0.3 4,-2.7 96,-0.2 5,-0.2 0.854 119.5 55.5 -57.3 -33.2 12.8 -1.9 62.8 680 49 C P H > S+ 0 0 11 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.921 108.9 47.7 -64.7 -37.6 16.3 -0.3 62.9 681 50 C A H > S+ 0 0 0 -3,-0.5 -11,-2.0 -6,-0.3 4,-2.0 0.872 113.0 48.0 -68.2 -36.1 17.0 -2.4 66.0 682 51 C K H X S+ 0 0 0 -4,-2.3 4,-2.8 -13,-0.2 5,-0.2 0.902 109.3 53.1 -70.9 -39.1 15.7 -5.5 64.2 683 52 C A H X S+ 0 0 0 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.890 109.6 49.0 -62.3 -41.1 17.7 -4.8 61.1 684 53 C X H X S+ 0 0 1 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.941 112.2 46.9 -64.9 -48.0 20.9 -4.5 63.2 685 54 C A H <>S+ 0 0 0 -4,-2.0 5,-2.2 2,-0.2 4,-0.4 0.925 112.8 49.9 -59.5 -45.4 20.3 -7.8 65.0 686 55 C Y H ><5S+ 0 0 6 -4,-2.8 3,-1.4 1,-0.2 -1,-0.2 0.950 113.2 47.2 -57.8 -47.1 19.5 -9.5 61.7 687 56 C A H 3<5S+ 0 0 25 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.781 105.5 59.2 -65.6 -30.0 22.7 -8.1 60.3 688 57 C Q T 3<5S- 0 0 23 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.439 124.7 -97.3 -81.4 -0.6 24.8 -9.1 63.3 689 58 C G T < 5 + 0 0 34 -3,-1.4 -25,-0.2 -4,-0.4 -3,-0.2 0.616 61.0 165.7 99.9 12.3 23.9 -12.7 62.8 690 59 C A < - 0 0 0 -5,-2.2 -1,-0.2 1,-0.1 -25,-0.2 -0.355 29.3-151.3 -63.8 140.8 21.0 -13.4 65.1 691 60 C D S S+ 0 0 54 -27,-1.9 107,-2.3 1,-0.2 2,-0.3 0.733 80.4 21.2 -83.3 -26.6 19.2 -16.6 64.3 692 61 C Y E -no 665 798R 17 -28,-1.5 -26,-2.9 105,-0.2 2,-0.5 -0.995 66.5-145.9-143.0 145.9 15.9 -15.3 65.7 693 62 C L E -no 666 799R 0 105,-2.2 107,-2.4 -2,-0.3 2,-0.3 -0.954 24.4-135.9-112.6 130.5 14.4 -11.9 66.3 694 63 C E E - o 0 800R 1 -28,-2.4 2,-0.3 -2,-0.5 -25,-0.1 -0.670 17.1-167.4 -92.2 141.8 12.1 -11.6 69.3 695 64 C Q E - o 0 801R 0 105,-1.2 107,-2.0 -2,-0.3 2,-0.4 -0.922 11.4-151.6-123.3 149.1 8.7 -9.7 69.4 696 65 C D E - o 0 802R 2 -2,-0.3 12,-1.0 105,-0.2 2,-0.4 -0.971 23.5-154.5-115.9 132.7 6.6 -8.7 72.4 697 66 C L E +Po 707 803R 0 105,-2.2 107,-2.0 -2,-0.4 2,-0.3 -0.936 24.6 155.5-123.0 137.5 2.8 -8.5 71.5 698 67 C V E -P 706 0R 1 8,-1.6 8,-2.2 -2,-0.4 2,-0.2 -0.935 37.0-110.0-142.8 162.0 -0.1 -6.6 72.9 699 68 C X E -P 705 0R 8 -2,-0.3 6,-0.2 6,-0.2 2,-0.2 -0.640 19.7-138.3-101.1 156.8 -3.4 -5.5 71.4 700 69 C T > - 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