==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/METAL TRANSPORT 19-JAN-05 1WX5 . COMPND 2 MOLECULE: TYROSINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES CASTANEOGLOBISPORUS; . AUTHOR Y.MATOBA,T.KUMAGAI,A.YAMAMOTO,H.YOSHITSU,M.SUGIYAMA . 694 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25523.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 424 61.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 58 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 30 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 188 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 0.7 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 2 0 4 0 0 0 2 0 0 2 0 4 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 PARALLEL BRIDGES PER LADDER . 6 4 2 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 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 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 2 A T 0 0 85 0, 0.0 268,-1.6 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 111.2 34.7 14.0 -1.9 2 3 A V E -a 269 0A 56 266,-0.2 2,-0.6 79,-0.0 268,-0.2 -0.811 360.0-145.1-103.8 133.9 34.3 13.2 1.8 3 4 A R E -a 270 0A 0 266,-2.8 268,-1.6 -2,-0.4 2,-0.2 -0.866 26.9-158.5 -94.5 120.3 31.2 11.7 3.4 4 5 A K - 0 0 72 -2,-0.6 80,-1.4 266,-0.2 2,-0.2 -0.617 27.0 -93.4-100.4 160.1 31.0 13.2 6.9 5 6 A N B >> -b 84 0B 8 -2,-0.2 3,-2.2 78,-0.2 4,-0.6 -0.540 36.2-126.5 -67.5 131.8 29.2 12.0 10.0 6 7 A Q T 34 S+ 0 0 1 78,-2.8 3,-0.3 1,-0.3 -1,-0.2 0.699 110.1 63.9 -55.4 -19.1 25.7 13.7 10.0 7 8 A A T 34 S+ 0 0 12 77,-0.2 -1,-0.3 1,-0.2 591,-0.1 0.759 100.2 50.6 -76.9 -25.4 26.6 14.9 13.5 8 9 A T T <4 S+ 0 0 41 -3,-2.2 -1,-0.2 2,-0.0 -2,-0.2 0.540 81.7 119.6 -89.9 -9.0 29.5 17.0 12.1 9 10 A L < - 0 0 20 -4,-0.6 2,-0.1 -3,-0.3 -3,-0.0 -0.233 57.9-133.6 -57.6 144.3 27.5 18.8 9.4 10 11 A T > - 0 0 66 1,-0.1 4,-2.3 0, 0.0 5,-0.2 -0.462 26.1-105.2 -94.1 169.3 27.4 22.6 9.6 11 12 A A H > S+ 0 0 72 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.911 124.6 51.9 -61.9 -37.1 24.2 24.6 9.2 12 13 A D H > S+ 0 0 70 1,-0.2 4,-2.0 2,-0.2 3,-0.5 0.976 108.7 48.0 -59.4 -58.5 25.6 25.6 5.8 13 14 A E H > S+ 0 0 29 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.837 112.2 49.9 -52.2 -38.7 26.2 22.0 4.7 14 15 A K H X S+ 0 0 26 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.845 107.0 55.3 -71.8 -32.7 22.7 20.9 5.8 15 16 A R H X S+ 0 0 146 -4,-1.9 4,-1.7 -3,-0.5 -2,-0.2 0.893 112.2 42.6 -65.1 -40.2 21.2 23.8 3.9 16 17 A R H X S+ 0 0 47 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.748 114.9 50.7 -77.7 -26.5 22.9 22.7 0.7 17 18 A F H X S+ 0 0 3 -4,-1.5 4,-2.2 -5,-0.3 -2,-0.2 0.961 112.8 43.6 -74.5 -53.8 22.1 19.0 1.4 18 19 A V H X S+ 0 0 14 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.901 115.8 49.1 -57.6 -43.0 18.4 19.5 2.0 19 20 A A H X S+ 0 0 55 -4,-1.7 4,-1.5 -5,-0.3 -1,-0.2 0.860 108.5 53.7 -64.8 -38.0 18.1 21.9 -0.9 20 21 A A H X S+ 0 0 2 -4,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.919 111.0 46.2 -63.2 -42.8 19.9 19.4 -3.2 21 22 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.824 108.7 53.9 -69.1 -37.2 17.4 16.7 -2.3 22 23 A L H X S+ 0 0 33 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.825 107.6 52.0 -68.8 -30.1 14.3 18.8 -2.7 23 24 A E H X S+ 0 0 59 -4,-1.5 4,-3.3 2,-0.2 5,-0.3 0.941 107.3 51.9 -69.1 -46.0 15.5 19.7 -6.2 24 25 A L H X>S+ 0 0 0 -4,-1.7 6,-2.5 1,-0.2 4,-1.1 0.883 113.1 45.9 -56.0 -38.5 15.9 16.0 -7.0 25 26 A K H <5S+ 0 0 13 -4,-1.8 -1,-0.2 4,-0.2 -2,-0.2 0.929 113.2 49.3 -69.6 -45.5 12.3 15.5 -5.7 26 27 A R H <5S+ 0 0 169 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.869 111.4 48.3 -61.7 -40.5 11.1 18.5 -7.7 27 28 A S H <5S- 0 0 57 -4,-3.3 -1,-0.2 -5,-0.1 -2,-0.2 0.757 112.4-116.0 -75.0 -23.5 12.7 17.4 -11.0 28 29 A G T X5S+ 0 0 33 -4,-1.1 4,-0.9 -5,-0.3 -3,-0.2 0.323 88.2 111.5 103.7 -4.7 11.4 13.8 -10.7 29 30 A R H >> S+ 0 0 0 -6,-2.5 4,-1.3 1,-0.2 3,-0.6 0.897 100.6 53.1 -63.7 -43.4 14.2 11.3 -6.7 31 32 A D H 3> S+ 0 0 15 -7,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.806 97.4 66.6 -64.4 -28.8 11.2 9.1 -7.4 32 33 A E H 3X S+ 0 0 111 -4,-0.9 4,-1.6 1,-0.2 -1,-0.2 0.926 102.0 49.3 -57.5 -42.3 13.2 7.2 -10.0 33 34 A F H S- 0 0 0 115,-0.2 3,-2.4 -3,-0.1 4,-0.2 -0.972 95.4 -99.8-164.7 154.7 22.5 -11.8 -0.7 56 57 A P T > S+ 0 0 0 0, 0.0 3,-0.9 0, 0.0 -2,-0.1 0.774 118.2 61.7 -51.1 -30.2 26.3 -11.1 -0.7 57 58 A S T 3> S+ 0 0 0 1,-0.2 4,-2.4 -7,-0.2 5,-0.3 0.341 73.4 98.7 -82.3 10.1 25.9 -8.3 -3.2 58 59 A F H <> S+ 0 0 2 -3,-2.4 4,-1.3 2,-0.2 -1,-0.2 0.861 87.8 43.1 -62.6 -35.2 23.6 -6.4 -0.8 59 60 A L H <> S+ 0 0 3 -3,-0.9 4,-1.4 -4,-0.2 -1,-0.2 0.957 116.9 40.6 -78.9 -54.5 26.7 -4.4 0.1 60 61 A P H > S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.908 115.4 54.9 -62.2 -37.5 28.3 -3.6 -3.3 61 62 A W H X S+ 0 0 0 -4,-2.4 4,-2.3 -10,-0.3 -2,-0.2 0.900 109.9 43.6 -61.0 -45.7 24.8 -3.1 -4.8 62 63 A H H X S+ 0 0 9 -4,-1.3 4,-1.8 -5,-0.3 -1,-0.2 0.739 109.6 59.9 -73.7 -20.6 23.8 -0.4 -2.2 63 64 A R H X S+ 0 0 0 -4,-1.4 4,-1.1 2,-0.2 -2,-0.2 0.911 111.2 38.4 -70.3 -43.2 27.3 1.1 -2.6 64 65 A R H X S+ 0 0 40 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.873 114.6 55.1 -72.9 -41.0 26.7 1.7 -6.4 65 66 A F H X S+ 0 0 4 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.885 110.2 45.4 -59.3 -40.6 23.1 2.7 -5.8 66 67 A L H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.796 108.0 58.6 -72.6 -30.6 24.2 5.3 -3.3 67 68 A L H X S+ 0 0 0 -4,-1.1 4,-1.9 2,-0.2 -2,-0.2 0.872 105.4 50.2 -64.7 -39.5 26.9 6.4 -5.7 68 69 A D H X S+ 0 0 42 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.961 112.2 46.6 -62.4 -52.9 24.1 7.1 -8.2 69 70 A F H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.896 111.6 49.5 -57.0 -47.9 22.1 9.2 -5.7 70 71 A E H X S+ 0 0 4 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.894 110.9 51.2 -61.1 -39.1 25.1 11.2 -4.5 71 72 A Q H X S+ 0 0 86 -4,-1.9 4,-0.8 2,-0.2 -1,-0.2 0.858 107.2 52.6 -68.0 -34.2 26.0 12.0 -8.1 72 73 A A H < S+ 0 0 4 -4,-1.9 3,-0.2 2,-0.2 -1,-0.2 0.878 111.6 47.6 -67.4 -36.0 22.5 13.1 -8.8 73 74 A L H >X S+ 0 0 0 -4,-2.1 3,-2.9 1,-0.2 4,-2.1 0.964 108.0 53.5 -66.9 -50.4 22.8 15.4 -5.8 74 75 A Q H 3< S+ 0 0 56 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.660 100.3 63.8 -57.2 -19.1 26.2 16.7 -7.0 75 76 A S T 3< S+ 0 0 76 -4,-0.8 -1,-0.3 -3,-0.2 -2,-0.2 0.465 110.1 37.5 -84.6 -3.7 24.5 17.5 -10.3 76 77 A V T <4 S+ 0 0 59 -3,-2.9 2,-0.3 1,-0.3 -2,-0.2 0.635 143.6 2.3-111.0 -34.5 22.3 20.0 -8.4 77 78 A D >< - 0 0 49 -4,-2.1 3,-1.7 3,-0.1 -1,-0.3 -0.817 65.1-155.5-157.6 106.4 25.1 21.2 -6.1 78 79 A S T 3 S+ 0 0 102 -2,-0.3 -4,-0.1 1,-0.3 -3,-0.1 0.184 90.9 63.7 -73.8 18.4 28.6 19.7 -6.6 79 80 A S T 3 S+ 0 0 56 -6,-0.2 2,-0.3 -63,-0.1 -1,-0.3 0.459 79.8 100.6-116.3 -9.8 29.5 20.5 -3.0 80 81 A V < + 0 0 5 -3,-1.7 2,-0.3 -7,-0.1 -6,-0.1 -0.612 48.9 179.8 -82.1 132.7 26.9 18.2 -1.5 81 82 A T - 0 0 31 -2,-0.3 -77,-0.1 -8,-0.1 -78,-0.1 -0.932 37.0 -98.9-129.0 154.1 28.2 14.7 -0.4 82 83 A L - 0 0 0 -2,-0.3 2,-0.2 -16,-0.1 -12,-0.0 -0.660 39.8-154.6 -78.7 117.7 26.1 11.9 1.2 83 84 A P - 0 0 0 0, 0.0 133,-0.2 0, 0.0 -78,-0.2 -0.630 9.2-130.3 -91.9 149.9 26.6 11.9 5.0 84 85 A Y B -b 5 0B 6 -80,-1.4 -78,-2.8 -2,-0.2 2,-0.6 -0.579 3.8-135.8 -99.9 163.1 26.1 8.8 7.2 85 86 A W - 0 0 0 128,-1.7 2,-1.9 129,-0.2 132,-0.2 -0.928 6.4-156.9-119.8 104.5 24.1 8.2 10.4 86 87 A D >> - 0 0 23 -2,-0.6 4,-2.9 1,-0.2 3,-0.6 -0.611 16.0-179.6 -78.5 84.8 26.0 6.3 13.1 87 88 A W T 34 S+ 0 0 0 -2,-1.9 -1,-0.2 1,-0.2 62,-0.2 0.577 73.9 66.8 -65.7 -6.8 22.7 5.1 14.7 88 89 A S T 34 S+ 0 0 2 63,-0.1 64,-0.4 1,-0.1 3,-0.3 0.925 113.9 26.0 -78.1 -45.3 24.9 3.3 17.3 89 90 A A T <4 S+ 0 0 14 -3,-0.6 2,-0.9 1,-0.2 -2,-0.2 0.842 123.8 51.8 -84.5 -38.5 26.2 6.5 18.8 90 91 A D < + 0 0 7 -4,-2.9 -1,-0.2 1,-0.2 5,-0.1 -0.575 69.9 146.0-102.5 71.0 23.3 8.8 17.8 91 92 A R + 0 0 19 -2,-0.9 58,-0.2 -3,-0.3 -1,-0.2 0.631 41.7 72.8 -82.9 -22.0 20.5 6.7 19.2 92 93 A T S > S- 0 0 20 -3,-0.2 3,-0.6 517,-0.1 51,-0.1 -0.348 83.3-112.5 -93.7 177.5 17.8 9.1 20.5 93 94 A V T 3 S+ 0 0 62 1,-0.2 13,-0.1 -2,-0.1 -1,-0.1 0.460 108.1 76.0 -84.8 -2.8 15.3 11.4 18.8 94 95 A R T 3 S+ 0 0 134 515,-0.1 2,-0.3 11,-0.0 -1,-0.2 -0.029 70.4 124.9 -96.5 28.3 17.2 14.4 20.1 95 96 A A S X S- 0 0 4 -3,-0.6 3,-1.6 1,-0.1 4,-0.1 -0.680 74.1-118.0 -90.3 144.2 19.9 13.8 17.4 96 97 A S G > S+ 0 0 13 -2,-0.3 3,-3.0 1,-0.3 7,-0.3 0.899 111.3 66.2 -43.8 -50.6 20.9 16.7 15.1 97 98 A L G 3 S+ 0 0 0 1,-0.3 6,-2.2 5,-0.1 7,-0.5 0.814 101.0 48.5 -42.9 -41.1 19.7 14.6 12.1 98 99 A W G < S+ 0 0 9 -3,-1.6 -1,-0.3 5,-0.2 -2,-0.2 0.167 85.5 118.9 -90.2 18.7 16.1 14.7 13.4 99 100 A A S X >S- 0 0 27 -3,-3.0 3,-2.2 1,-0.1 5,-1.7 -0.500 80.0-111.5 -80.4 153.6 16.1 18.5 13.9 100 101 A P T 3 5S+ 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.742 117.8 59.3 -58.9 -19.4 13.6 20.6 11.9 101 102 A D T 3 5S+ 0 0 81 16,-0.2 -83,-0.2 -5,-0.1 -3,-0.1 0.213 118.2 25.1 -92.5 13.5 16.6 22.1 9.9 102 103 A F T < 5S- 0 0 0 -3,-2.2 -4,-0.2 -6,-0.1 -5,-0.1 0.231 136.2 -24.9-135.9 -95.2 17.7 18.6 8.7 103 104 A L T 5S- 0 0 0 -6,-2.2 16,-0.3 -7,-0.3 -5,-0.2 0.679 84.5-125.2-103.6 -20.9 15.3 15.7 8.3 104 105 A G < - 0 0 0 -5,-1.7 -1,-0.2 -7,-0.5 13,-0.1 -0.305 31.3 -77.6 96.8 172.5 12.6 16.6 10.8 105 106 A G - 0 0 11 1,-0.2 11,-0.2 -2,-0.1 -6,-0.1 -0.128 58.5 -56.6 -98.7-163.7 11.4 14.4 13.7 106 107 A T - 0 0 55 1,-0.1 9,-0.6 8,-0.1 -1,-0.2 -0.061 63.2 -95.8 -65.7 172.2 9.1 11.4 14.2 107 108 A G B -C 114 0C 13 7,-0.2 7,-0.3 5,-0.1 6,-0.2 -0.533 41.4 -91.2 -92.4 162.4 5.5 11.5 13.0 108 109 A R > - 0 0 103 5,-2.4 4,-3.0 -2,-0.2 3,-0.5 -0.367 34.3-120.7 -69.1 149.5 2.4 12.4 15.1 109 110 A S T 4 S+ 0 0 116 1,-0.2 -1,-0.1 2,-0.2 -2,-0.1 0.955 102.8 68.1 -55.4 -58.3 0.6 9.5 16.8 110 111 A T T 4 S- 0 0 111 1,-0.2 -1,-0.2 2,-0.1 -3,-0.0 0.772 133.7 -11.7 -31.5 -50.0 -2.8 9.9 15.1 111 112 A D T 4 S- 0 0 30 -3,-0.5 -1,-0.2 2,-0.1 -2,-0.2 0.351 90.1-110.6-139.6 4.5 -1.4 8.9 11.7 112 113 A G < + 0 0 10 -4,-3.0 28,-2.4 1,-0.2 2,-0.3 0.562 61.0 159.4 75.1 9.3 2.4 8.9 12.0 113 114 A R B -D 139 0D 53 -5,-0.3 -5,-2.4 26,-0.2 26,-0.3 -0.480 44.1-120.5 -72.2 126.9 2.7 11.9 9.7 114 115 A V B -C 107 0C 0 24,-2.9 7,-0.7 -2,-0.3 8,-0.4 -0.452 29.5-176.4 -64.8 131.2 5.9 13.9 9.9 115 116 A M + 0 0 81 -9,-0.6 2,-0.2 -2,-0.2 -1,-0.1 0.589 55.6 38.2-111.0 -10.4 5.1 17.5 11.0 116 117 A D S S+ 0 0 55 -10,-0.2 3,-0.3 -11,-0.2 7,-0.1 -0.713 80.0 53.8-129.3-178.1 8.4 19.4 10.9 117 118 A G S > S- 0 0 15 -2,-0.2 3,-1.1 1,-0.2 -16,-0.2 0.008 97.3 -65.4 78.4 168.7 11.6 19.6 8.9 118 119 A P T 3 S+ 0 0 25 0, 0.0 7,-0.2 0, 0.0 -1,-0.2 0.612 129.5 55.8 -68.4 -11.9 11.9 20.2 5.1 119 120 A F T 3 S+ 0 0 0 -16,-0.3 19,-0.4 -3,-0.3 -5,-0.1 0.300 72.0 125.4-107.7 10.6 10.2 16.9 4.2 120 121 A A X - 0 0 1 -3,-1.1 3,-1.5 1,-0.1 4,-0.4 -0.372 69.7-121.9 -66.0 147.0 6.9 17.2 6.1 121 122 A A G > S+ 0 0 23 -7,-0.7 3,-1.1 17,-0.3 5,-0.2 0.796 108.6 66.2 -62.0 -28.1 3.9 16.7 3.8 122 123 A S G 3 S+ 0 0 89 -8,-0.4 -1,-0.3 1,-0.2 -7,-0.1 0.618 88.2 67.1 -70.2 -14.1 2.6 20.2 4.7 123 124 A T G < S- 0 0 57 -3,-1.5 -1,-0.2 -6,-0.1 -2,-0.2 0.746 95.2-139.0 -77.4 -23.5 5.6 21.9 3.0 124 125 A G S < S+ 0 0 58 -3,-1.1 -3,-0.1 -4,-0.4 -2,-0.1 0.390 83.4 97.8 79.4 -5.0 4.4 20.7 -0.4 125 126 A N S S+ 0 0 87 -5,-0.4 -4,-0.1 1,-0.2 -100,-0.1 0.491 79.9 47.5 -91.7 -6.0 8.0 19.9 -1.2 126 127 A W + 0 0 1 -6,-0.4 12,-0.3 -5,-0.2 2,-0.3 -0.563 64.2 165.7-138.3 74.7 7.8 16.2 -0.3 127 128 A P - 0 0 56 0, 0.0 2,-0.9 0, 0.0 10,-0.2 -0.672 35.8-129.6 -88.7 146.1 4.8 14.3 -1.8 128 129 A I + 0 0 1 8,-2.7 3,-0.1 -2,-0.3 -2,-0.0 -0.832 40.6 157.9 -96.0 102.5 5.0 10.5 -1.7 129 130 A N + 0 0 86 -2,-0.9 2,-1.4 1,-0.2 -1,-0.2 0.822 62.7 64.2 -92.8 -37.9 4.2 9.4 -5.2 130 131 A V S S+ 0 0 17 6,-0.1 -1,-0.2 74,-0.1 2,-0.2 -0.708 80.2 152.8 -89.9 89.3 5.8 5.9 -5.1 131 132 A R - 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0 0 45 -3,-0.7 15,-0.1 -4,-0.5 68,-0.1 -0.495 56.5-164.3 -65.0 115.2 22.9 23.5 44.4 511 163 C S + 0 0 66 -2,-0.5 2,-0.4 13,-0.1 -1,-0.2 0.861 62.9 89.4 -71.2 -39.6 20.4 24.4 41.6 512 164 C A - 0 0 26 1,-0.2 13,-3.4 69,-0.1 14,-0.2 -0.474 64.3-156.5 -64.6 116.6 22.8 26.2 39.3 513 165 C Y S S- 0 0 4 -2,-0.4 13,-3.5 69,-0.3 2,-0.3 0.966 71.4 -33.5 -56.1 -54.0 24.4 23.5 37.0 514 166 C D - 0 0 2 68,-0.3 -1,-0.3 11,-0.2 10,-0.1 -0.952 64.2-153.0-161.0 163.9 27.4 25.8 36.4 515 167 C L > - 0 0 65 8,-0.5 3,-2.7 -2,-0.3 4,-0.3 -0.971 35.5 -44.0-146.3 158.3 28.0 29.5 36.1 516 168 C P T 3 S+ 0 0 92 0, 0.0 7,-0.3 0, 0.0 3,-0.0 -0.293 118.4 36.8 -55.4 147.4 30.5 32.0 34.5 517 169 C P T 3 S- 0 0 68 0, 0.0 3,-0.1 0, 0.0 5,-0.1 -0.897 89.6-151.4 -78.7 16.5 33.5 31.9 34.3 518 170 C Y < + 0 0 31 -3,-2.7 2,-0.3 1,-0.2 -4,-0.0 0.944 57.5 91.7 47.0 63.7 32.8 28.2 33.9 519 171 C N S > S- 0 0 14 -4,-0.3 3,-2.6 -115,-0.2 2,-0.8 -0.908 99.2 -53.2-162.8-172.4 36.1 26.9 35.4 520 172 C S T 3 S+ 0 0 0 -117,-0.4 145,-0.2 1,-0.3 -116,-0.1 0.216 131.1 54.7 -63.9 22.8 37.7 25.8 38.7 521 173 C A T 3 S+ 0 0 34 -2,-0.8 -1,-0.3 -118,-0.1 2,-0.1 0.339 82.5 109.2-133.8 -2.4 36.5 29.1 40.1 522 174 C S < - 0 0 1 -3,-2.6 2,-0.2 -5,-0.1 11,-0.1 -0.371 61.1-133.1 -78.5 157.6 32.8 29.0 39.4 523 175 C E + 0 0 115 -7,-0.3 -8,-0.5 -2,-0.1 4,-0.2 -0.576 61.3 72.5 -96.9 168.6 30.1 28.5 42.0 524 176 C G S > S- 0 0 2 -2,-0.2 4,-1.5 -10,-0.1 5,-0.2 -0.382 92.0 -59.4 113.5 167.7 27.4 25.9 41.2 525 177 C F H >> S+ 0 0 1 -13,-3.4 4,-3.1 1,-0.2 3,-1.3 0.962 121.0 54.5 -50.4 -70.3 26.8 22.2 41.0 526 178 C R H 3> S+ 0 0 0 -13,-3.5 4,-2.1 1,-0.3 -1,-0.2 0.832 112.9 42.1 -32.3 -61.3 29.4 21.2 38.3 527 179 C N H 3>>S+ 0 0 0 -14,-0.2 4,-1.7 1,-0.2 6,-1.0 0.754 115.6 48.2 -65.4 -29.0 32.3 22.7 40.1 528 180 C H H <<5S+ 0 0 22 -4,-1.5 9,-1.0 -3,-1.3 -1,-0.2 0.844 110.6 51.8 -80.9 -32.4 31.4 21.5 43.6 529 181 C L H <5S+ 0 0 0 -4,-3.1 9,-2.4 -5,-0.2 -2,-0.2 0.883 113.1 46.5 -67.0 -35.9 30.8 18.0 42.2 530 182 C E H <5S- 0 0 0 -4,-2.1 9,-2.2 -5,-0.4 -2,-0.2 0.858 111.1-129.0 -72.8 -37.1 34.3 18.3 40.7 531 183 C G T <5S+ 0 0 6 -4,-1.7 -3,-0.2 2,-0.3 -4,-0.1 0.435 73.2 118.7 106.5 -1.4 35.7 19.6 43.9 532 184 C W S S+ 0 0 47 -6,-1.0 3,-0.6 -9,-0.1 -2,-0.3 -0.880 113.5 11.5-125.2 155.9 35.3 24.8 45.2 534 186 C G T 3 S- 0 0 55 -2,-0.3 -6,-0.0 1,-0.2 -5,-0.0 -0.396 119.4 -17.9 82.9-155.3 33.3 23.8 48.3 535 187 C V T 3 S- 0 0 53 -32,-0.1 -1,-0.2 -2,-0.1 -31,-0.1 0.739 91.1-128.4 -62.3 -21.7 33.4 20.5 50.3 536 188 C N < + 0 0 35 -3,-0.6 -7,-0.1 -8,-0.2 -5,-0.1 0.880 37.8 172.9 71.4 104.0 35.2 18.9 47.4 537 189 C L > + 0 0 0 -9,-1.0 4,-1.6 3,-0.1 3,-0.5 0.751 69.5 26.8-101.9 -88.7 33.7 15.6 46.1 538 190 C H H > S+ 0 0 0 -9,-2.4 4,-1.6 1,-0.2 3,-0.4 0.876 122.9 50.5 -44.9 -52.4 35.2 14.1 42.9 539 191 C N H > S+ 0 0 2 -9,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.889 108.2 51.6 -56.5 -44.5 38.7 15.7 43.4 540 192 C R H > S+ 0 0 34 -3,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.806 104.7 58.6 -64.7 -31.2 39.1 14.5 47.0 541 193 C V H X S+ 0 0 0 -4,-1.6 4,-2.0 -3,-0.4 5,-0.2 0.935 103.4 49.8 -63.9 -49.1 38.3 11.0 46.0 542 194 C H H X S+ 0 0 0 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.926 112.8 49.0 -55.2 -45.0 41.1 10.7 43.5 543 195 C V H < S+ 0 0 9 -4,-1.6 -49,-0.5 1,-0.2 -48,-0.3 0.803 107.3 56.3 -63.7 -32.7 43.4 12.1 46.3 544 196 C W H < S+ 0 0 10 -4,-1.6 -52,-1.2 -3,-0.2 -51,-0.9 0.907 106.1 47.6 -68.6 -43.4 42.0 9.5 48.7 545 197 C V H < S- 0 0 0 -4,-2.0 -55,-3.3 -54,-0.2 -1,-0.2 0.817 91.0-175.8 -67.7 -30.6 42.9 6.5 46.6 546 198 C G >< + 0 0 9 -4,-1.4 3,-1.5 -5,-0.2 4,-0.4 -0.310 41.9 83.2 65.3-152.6 46.3 7.8 46.0 547 199 C G G > S- 0 0 7 1,-0.3 3,-0.7 2,-0.2 -58,-0.2 -0.289 118.1 -23.3 58.5-139.4 48.5 5.8 43.7 548 200 C Q G > S+ 0 0 6 -60,-1.0 3,-1.2 1,-0.2 -1,-0.3 0.605 131.2 75.7 -79.5 -13.4 48.0 6.6 40.0 549 201 C M G < S+ 0 0 0 -3,-1.5 -1,-0.2 -61,-0.4 -2,-0.2 0.760 92.3 51.7 -68.8 -26.7 44.5 7.8 40.9 550 202 C A G < S+ 0 0 19 -3,-0.7 125,-0.5 -4,-0.4 124,-0.3 0.087 108.2 65.7 -98.1 22.4 45.9 11.1 42.3 551 203 C T S X S- 0 0 2 -3,-1.2 3,-0.7 122,-0.2 121,-0.2 -0.677 98.4 -90.7-130.5-175.8 47.9 11.8 39.2 552 204 C G T 3 S+ 0 0 2 119,-2.4 2,-0.5 1,-0.3 -162,-0.2 0.850 121.4 53.9 -68.9 -35.9 47.4 12.6 35.5 553 205 C V T > S+ 0 0 2 118,-0.3 3,-1.4 1,-0.2 -1,-0.3 -0.279 71.4 140.4 -93.8 46.8 47.4 9.0 34.3 554 206 C S G X + 0 0 0 -3,-0.7 3,-2.3 -2,-0.5 6,-0.3 0.788 54.9 70.7 -62.5 -33.4 44.7 8.1 36.8 555 207 C P G 3 S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 6,-0.1 0.610 75.0 89.0 -63.7 -3.3 42.7 5.8 34.6 556 208 C N G < S+ 0 0 0 -3,-1.4 -2,-0.2 -8,-0.2 -7,-0.1 0.833 80.4 69.3 -57.8 -31.6 45.6 3.5 35.1 557 209 C D S X S- 0 0 0 -3,-2.3 3,-1.8 -4,-0.1 4,-0.3 -0.787 82.6-143.1 -92.2 125.3 43.6 2.3 38.1 558 210 C P T >> S+ 0 0 1 0, 0.0 3,-0.9 0, 0.0 4,-0.6 0.747 98.1 70.9 -58.4 -24.0 40.5 0.4 37.3 559 211 C V H >> S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 3,-1.0 0.813 78.8 81.3 -62.9 -26.6 38.7 2.1 40.2 560 212 C F H <> S+ 0 0 0 -3,-1.8 4,-2.3 -6,-0.3 -1,-0.2 0.885 92.3 46.5 -42.2 -51.7 38.8 5.2 38.1 561 213 C W H <> S+ 0 0 0 -3,-0.9 4,-0.9 -4,-0.3 -1,-0.3 0.753 110.9 50.4 -67.0 -28.9 35.7 4.1 36.2 562 214 C L H X S+ 0 0 0 -4,-2.8 3,-2.8 1,-0.2 4,-1.6 0.993 116.5 41.4 -53.9 -69.3 34.4 6.4 40.9 564 216 C H H 3X S+ 0 0 3 -4,-2.3 4,-2.2 1,-0.3 -1,-0.2 0.679 106.3 63.7 -54.1 -23.4 33.4 8.4 37.8 565 217 C A H 3X S+ 0 0 0 -4,-0.9 4,-0.9 -5,-0.2 -1,-0.3 0.767 107.9 44.3 -72.5 -24.0 30.5 6.0 37.2 566 218 C Y H - 0 0 35 1,-0.1 3,-1.1 3,-0.1 -1,-0.2 -0.508 49.9-131.2 -69.1 114.2 31.1 30.9 25.0 590 242 C P T 3 S+ 0 0 102 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.367 82.7 7.4 -69.4 144.9 34.7 30.7 23.8 591 243 C D T 3 S+ 0 0 78 1,-0.1 -192,-2.3 -193,-0.1 2,-0.4 0.419 113.6 92.2 70.2 -2.3 37.0 28.0 25.1 592 244 C V B < S-m 399 0J 3 -3,-1.1 2,-0.4 -194,-0.2 -1,-0.1 -0.985 83.4-114.6-126.9 133.6 34.1 26.3 26.8 593 245 C V - 0 0 8 -194,-0.6 2,-0.2 -2,-0.4 6,-0.1 -0.499 33.6-151.2 -67.6 121.1 31.8 23.6 25.3 594 246 C D > - 0 0 1 -2,-0.4 3,-3.1 4,-0.1 14,-0.2 -0.605 33.5 -93.6 -91.9 154.7 28.4 25.0 24.9 595 247 C L T 3 S+ 0 0 43 -10,-3.0 13,-2.0 1,-0.3 14,-0.2 0.797 125.5 34.9 -33.4 -48.9 25.3 22.8 25.1 596 248 C N T 3 S+ 0 0 99 11,-0.2 2,-0.4 10,-0.1 -1,-0.3 0.173 94.7 101.6-100.8 19.2 25.2 22.4 21.3 597 249 C E S < S- 0 0 78 -3,-3.1 11,-0.2 1,-0.0 2,-0.1 -0.830 73.7-117.0-100.8 142.3 28.9 22.4 20.5 598 250 C T - 0 0 59 -2,-0.4 2,-0.3 8,-0.2 8,-0.3 -0.383 29.0-126.5 -75.0 154.2 30.6 19.0 19.8 599 251 C M >> - 0 0 0 6,-2.8 4,-3.1 -2,-0.1 3,-0.6 -0.772 27.0 -90.9-106.6 148.4 33.4 17.8 22.1 600 252 C K T 34 S+ 0 0 94 -2,-0.3 0, 0.0 1,-0.3 0, 0.0 -0.610 101.4 30.1 -82.4 154.2 37.0 16.7 21.4 601 253 C P T 34 S+ 0 0 58 0, 0.0 -1,-0.3 0, 0.0 -216,-0.0 -0.974 131.0 35.7 -91.7 9.3 38.3 14.1 20.8 602 254 C W T <4 - 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