==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-MAR-09 3GRO . COMPND 2 MOLECULE: PALMITOYL-PROTEIN THIOESTERASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.DOBROVETSKY,A.SEITOVA,Y.TONG,W.TEMPEL,A.DONG, . 552 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20638.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 384 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 62 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.1 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 . 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 . 47 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 158 28.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.2 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 7 0 2 5 1 0 2 3 1 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 2 4 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 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 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 30 A P 0 0 188 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 109.8 -39.6 -15.5 21.7 2 31 A A - 0 0 93 1,-0.1 2,-0.2 33,-0.0 33,-0.1 -0.475 360.0-105.2 -91.5 158.5 -37.1 -12.5 21.5 3 32 A P - 0 0 41 0, 0.0 34,-0.2 0, 0.0 274,-0.1 -0.592 44.0-104.2 -75.7 146.3 -34.3 -11.8 18.9 4 33 A L - 0 0 52 273,-0.6 76,-0.2 272,-0.2 72,-0.1 -0.437 39.1-103.4 -66.8 142.2 -30.8 -12.4 20.1 5 34 A P - 0 0 16 0, 0.0 76,-3.3 0, 0.0 2,-0.4 -0.315 31.9-137.5 -59.3 151.8 -28.7 -9.4 21.0 6 35 A L E -ab 38 81A 1 31,-2.4 33,-2.6 74,-0.2 2,-0.5 -0.977 10.6-160.9-115.8 126.5 -26.0 -8.3 18.5 7 36 A V E -ab 39 82A 0 74,-2.9 76,-2.8 -2,-0.4 2,-0.4 -0.931 12.0-160.2-102.6 127.7 -22.5 -7.2 19.5 8 37 A I E -ab 40 83A 0 31,-3.3 33,-3.4 -2,-0.5 2,-0.5 -0.914 9.0-168.1-110.2 134.7 -20.6 -5.1 16.9 9 38 A W E - b 0 84A 1 74,-2.0 76,-2.7 -2,-0.4 79,-0.1 -0.976 18.8-143.0-121.3 116.5 -16.9 -4.6 16.8 10 39 A H - 0 0 2 -2,-0.5 6,-0.1 31,-0.5 3,-0.1 -0.100 13.7-119.5 -70.3 168.8 -15.7 -1.9 14.4 11 40 A G > - 0 0 3 1,-0.2 3,-0.9 4,-0.2 75,-0.1 -0.147 46.9 -51.7 -98.0-163.8 -12.5 -2.0 12.3 12 41 A X T 3 S+ 0 0 7 1,-0.2 -1,-0.2 -2,-0.1 3,-0.1 -0.397 119.4 17.5 -79.7 147.8 -9.4 0.2 12.1 13 42 A G T 3 S+ 0 0 15 38,-0.6 2,-0.3 1,-0.3 -1,-0.2 0.700 112.6 93.2 66.5 22.1 -9.6 4.0 11.7 14 43 A D < - 0 0 21 -3,-0.9 -1,-0.3 37,-0.2 2,-0.2 -0.862 60.9-143.5-140.2 165.5 -13.2 3.8 12.9 15 44 A S - 0 0 2 -2,-0.3 7,-0.3 -3,-0.1 3,-0.3 -0.612 31.3-101.8-122.0-176.6 -15.2 4.0 16.2 16 45 A C S S+ 0 0 3 -2,-0.2 26,-0.1 1,-0.2 25,-0.1 0.767 111.8 33.5 -68.7 -29.7 -18.3 2.4 17.8 17 46 A C + 0 0 66 5,-0.1 -1,-0.2 6,-0.1 30,-0.1 -0.109 66.1 138.4-138.9 29.0 -20.7 5.2 17.1 18 47 A N > > - 0 0 46 -3,-0.3 5,-2.7 1,-0.1 3,-1.8 -0.738 47.6-142.0 -78.5 122.8 -20.0 7.2 13.8 19 48 A P T 3 5S+ 0 0 102 0, 0.0 5,-0.3 0, 0.0 -1,-0.1 0.807 101.3 51.1 -55.5 -31.4 -23.5 7.8 12.3 20 49 A L T 3 5S+ 0 0 165 3,-0.1 -2,-0.0 4,-0.1 -3,-0.0 0.539 125.2 19.6 -83.1 -9.3 -22.0 7.2 8.8 21 50 A S T <>5S+ 0 0 33 -3,-1.8 4,-1.3 3,-0.0 5,-0.1 0.471 136.8 3.9-123.8 -95.7 -20.3 3.8 9.7 22 51 A X H >5S+ 0 0 4 -7,-0.3 4,-2.2 1,-0.2 5,-0.1 0.785 126.8 61.8 -72.0 -26.6 -21.3 1.6 12.7 23 52 A G H > S+ 0 0 47 -6,-0.6 4,-2.1 -5,-0.3 -2,-0.2 0.823 110.5 51.3 -65.9 -35.1 -25.7 3.3 10.2 25 54 A I H X S+ 0 0 16 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.916 110.5 49.7 -66.5 -42.8 -25.3 -0.5 10.7 26 55 A K H X S+ 0 0 55 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.918 113.9 43.5 -63.2 -47.0 -27.0 -0.3 14.1 27 56 A K H X S+ 0 0 54 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.916 112.6 54.2 -63.2 -44.1 -30.0 1.7 12.8 28 57 A X H X S+ 0 0 69 -4,-2.1 4,-1.2 1,-0.2 -2,-0.2 0.894 112.4 42.7 -57.7 -44.1 -30.2 -0.6 9.8 29 58 A V H X S+ 0 0 0 -4,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.883 111.5 54.7 -70.4 -39.9 -30.4 -3.6 12.1 30 59 A E H < S+ 0 0 79 -4,-2.3 5,-0.2 1,-0.2 6,-0.2 0.808 106.3 52.6 -66.0 -30.6 -32.8 -2.0 14.5 31 60 A K H < S+ 0 0 81 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.903 115.0 39.1 -70.5 -42.9 -35.3 -1.2 11.7 32 61 A K H < S+ 0 0 78 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.531 124.2 38.4 -89.8 -8.8 -35.5 -4.7 10.3 33 62 A I S >< S- 0 0 13 -4,-1.2 3,-1.4 -5,-0.1 -1,-0.2 -0.738 86.8-149.3-138.5 89.6 -35.4 -6.6 13.7 34 63 A P T 3 S+ 0 0 110 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.326 75.8 16.6 -73.1 141.1 -37.5 -4.6 16.3 35 64 A G T 3 S+ 0 0 81 1,-0.3 2,-0.1 -5,-0.2 -5,-0.1 0.403 86.3 148.0 82.7 -0.3 -36.6 -4.6 20.0 36 65 A I < - 0 0 12 -3,-1.4 2,-0.6 -6,-0.2 -1,-0.3 -0.419 45.1-135.0 -66.8 138.5 -33.1 -6.0 19.2 37 66 A Y - 0 0 68 -34,-0.2 -31,-2.4 38,-0.1 2,-0.5 -0.886 22.3-167.9 -95.8 123.5 -30.4 -4.9 21.6 38 67 A V E -a 6 0A 9 -2,-0.6 2,-0.6 -33,-0.2 -31,-0.2 -0.963 7.7-168.0-118.6 117.8 -27.2 -3.8 19.8 39 68 A L E -a 7 0A 40 -33,-2.6 -31,-3.3 -2,-0.5 2,-0.7 -0.932 4.8-162.9-103.9 114.2 -24.0 -3.2 21.6 40 69 A S E -a 8 0A 18 -2,-0.6 -31,-0.2 -33,-0.2 -24,-0.1 -0.877 28.4-122.5 -96.5 112.3 -21.3 -1.5 19.5 41 70 A L - 0 0 8 -33,-3.4 2,-0.5 -2,-0.7 -31,-0.5 -0.273 26.2-167.6 -65.8 133.9 -18.0 -2.1 21.3 42 71 A E - 0 0 81 -26,-0.1 2,-0.8 -27,-0.1 5,-0.1 -0.992 7.5-166.0-121.0 122.8 -16.0 1.0 22.3 43 72 A I + 0 0 8 -2,-0.5 10,-0.2 4,-0.1 2,-0.2 -0.832 66.6 30.6-109.4 90.3 -12.4 0.5 23.5 44 73 A G S S- 0 0 29 -2,-0.8 6,-0.1 1,-0.1 -2,-0.0 -0.671 89.5 -92.7 139.5 162.2 -11.6 3.8 25.1 45 74 A K S S+ 0 0 92 -2,-0.2 2,-0.3 358,-0.0 -1,-0.1 0.779 105.0 28.8 -78.0 -29.9 -13.2 6.6 27.0 46 75 A T S > S- 0 0 62 357,-0.1 4,-2.1 -3,-0.1 5,-0.1 -0.799 84.5-108.3-127.3 169.6 -14.0 8.8 23.9 47 76 A L H > S+ 0 0 67 -2,-0.3 4,-1.7 1,-0.2 5,-0.1 0.845 119.9 51.6 -66.8 -33.0 -14.6 8.2 20.2 48 77 A X H > S+ 0 0 36 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.854 109.6 48.7 -73.1 -34.6 -11.2 9.6 19.3 49 78 A E H > S+ 0 0 17 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.860 107.9 56.0 -70.0 -36.3 -9.4 7.3 21.8 50 79 A D H X S+ 0 0 1 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.927 108.7 48.1 -56.4 -44.9 -11.5 4.4 20.3 51 80 A V H < S+ 0 0 2 -4,-1.7 -38,-0.6 2,-0.2 3,-0.4 0.925 114.7 42.7 -65.2 -46.4 -10.0 5.3 16.9 52 81 A E H >X S+ 0 0 5 -4,-2.1 4,-2.2 1,-0.2 3,-1.3 0.850 109.0 58.7 -74.7 -27.8 -6.4 5.5 18.0 53 82 A N H 3X S+ 0 0 5 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.770 93.8 67.0 -66.2 -24.1 -6.7 2.4 20.1 54 83 A S H 3< S+ 0 0 2 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.646 115.6 28.4 -68.9 -14.7 -7.7 0.6 16.9 55 84 A F H <4 S+ 0 0 0 -3,-1.3 97,-2.7 -4,-0.3 98,-0.4 0.675 133.2 28.8-106.2 -31.1 -4.1 1.3 15.8 56 85 A F H < S+ 0 0 3 -4,-2.2 2,-0.5 95,-0.3 -3,-0.2 0.370 88.8 92.5-126.7 3.3 -2.1 1.4 19.0 57 86 A L S < S- 0 0 17 -4,-1.6 93,-0.1 -5,-0.2 5,-0.1 -0.917 81.9-105.7-105.4 125.3 -3.7 -0.8 21.8 58 87 A N >> - 0 0 22 -2,-0.5 4,-1.8 91,-0.4 3,-0.9 -0.209 25.3-140.6 -45.6 119.3 -2.4 -4.4 22.2 59 88 A V H 3> S+ 0 0 0 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.803 99.2 62.3 -61.9 -34.3 -5.2 -6.6 20.9 60 89 A N H 3> S+ 0 0 40 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.911 108.6 44.3 -58.5 -39.5 -4.8 -9.3 23.6 61 90 A S H <> S+ 0 0 54 -3,-0.9 4,-2.7 2,-0.2 -2,-0.2 0.878 110.6 54.8 -66.7 -40.9 -5.7 -6.5 26.1 62 91 A Q H X S+ 0 0 3 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.937 107.8 49.5 -58.0 -45.6 -8.6 -5.4 23.9 63 92 A V H X S+ 0 0 2 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.901 110.7 49.2 -61.8 -42.7 -9.9 -8.9 23.9 64 93 A T H X S+ 0 0 83 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.925 110.6 51.4 -60.8 -44.4 -9.7 -9.1 27.7 65 94 A T H X S+ 0 0 72 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.885 111.5 46.7 -59.5 -43.6 -11.5 -5.8 28.0 66 95 A V H X S+ 0 0 1 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.882 109.3 54.1 -68.3 -39.6 -14.3 -6.9 25.7 67 96 A a H X S+ 0 0 20 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.924 110.3 48.0 -58.5 -44.2 -14.6 -10.3 27.6 68 97 A Q H X S+ 0 0 108 -4,-2.4 4,-1.2 2,-0.2 -2,-0.2 0.906 111.9 49.6 -61.8 -41.6 -15.1 -8.3 30.8 69 98 A A H X S+ 0 0 39 -4,-2.0 4,-0.7 1,-0.2 3,-0.3 0.925 111.9 47.6 -64.2 -43.8 -17.7 -6.0 29.2 70 99 A L H < S+ 0 0 4 -4,-2.7 3,-0.4 1,-0.2 -1,-0.2 0.830 109.1 53.9 -67.6 -34.4 -19.6 -9.0 27.8 71 100 A A H < S+ 0 0 66 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.799 110.8 48.4 -66.3 -29.0 -19.6 -10.8 31.2 72 101 A K H < S+ 0 0 161 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.565 88.7 90.2 -89.1 -11.6 -21.1 -7.6 32.8 73 102 A D >< - 0 0 26 -4,-0.7 3,-2.0 -3,-0.4 4,-0.3 -0.766 59.2-161.4 -96.3 107.4 -23.9 -7.0 30.3 74 103 A P G > S+ 0 0 89 0, 0.0 3,-1.0 0, 0.0 4,-0.3 0.734 84.7 67.8 -63.1 -21.2 -27.1 -8.8 31.6 75 104 A K G 3 S+ 0 0 134 1,-0.2 3,-0.1 2,-0.1 -38,-0.1 0.578 100.3 49.9 -73.5 -9.3 -28.8 -8.6 28.1 76 105 A L G X S+ 0 0 0 -3,-2.0 3,-2.3 -6,-0.2 -1,-0.2 0.408 78.2 102.2-106.7 -3.4 -26.2 -11.1 26.7 77 106 A Q T < S+ 0 0 146 -3,-1.0 -2,-0.1 -4,-0.3 -1,-0.1 0.853 83.9 46.3 -52.2 -43.9 -26.4 -13.7 29.4 78 107 A Q T 3 S- 0 0 98 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.364 130.2 -79.3 -84.3 5.1 -28.6 -16.1 27.3 79 108 A G < - 0 0 1 -3,-2.3 2,-0.3 2,-0.0 -1,-0.3 -0.172 44.5-138.2 114.1 157.0 -26.2 -15.6 24.3 80 109 A Y E - c 0 104A 1 23,-2.1 25,-2.7 -76,-0.2 2,-0.3 -0.933 13.8-121.5-144.3 159.1 -25.5 -13.1 21.6 81 110 A N E -b 6 0A 4 -76,-3.3 -74,-2.9 -2,-0.3 2,-0.4 -0.832 30.8-152.4 -97.4 148.5 -24.7 -12.8 17.9 82 111 A A E -bc 7 107A 0 24,-2.7 26,-2.9 -2,-0.3 2,-0.4 -0.958 12.5-172.4-127.3 141.1 -21.5 -11.0 17.0 83 112 A X E -bc 8 108A 0 -76,-2.8 -74,-2.0 -2,-0.4 2,-0.4 -0.948 5.6-168.4-137.6 115.8 -20.5 -9.0 13.9 84 113 A G E -bc 9 109A 0 24,-2.4 26,-3.2 -2,-0.4 2,-0.5 -0.834 9.3-150.4-104.7 138.5 -17.0 -7.7 13.2 85 114 A F E > - c 0 110A 3 -76,-2.7 3,-2.1 -2,-0.4 26,-0.2 -0.927 63.4 -40.5-107.2 130.3 -16.1 -5.3 10.6 86 115 A S T >> S+ 0 0 0 24,-3.0 3,-3.0 -2,-0.5 4,-0.5 -0.260 138.8 4.5 51.6-133.2 -12.6 -5.5 9.1 87 116 A Q H 3> S+ 0 0 2 1,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.762 124.3 71.9 -54.3 -25.1 -10.0 -6.2 11.9 88 117 A G H <> S+ 0 0 0 -3,-2.1 4,-2.6 1,-0.2 -1,-0.3 0.759 88.0 65.9 -58.0 -26.2 -13.0 -6.5 14.3 89 118 A G H <> S+ 0 0 0 -3,-3.0 4,-1.6 2,-0.2 -1,-0.2 0.957 105.7 37.8 -59.5 -54.4 -13.8 -9.8 12.5 90 119 A Q H X S+ 0 0 0 -4,-0.5 4,-1.7 -3,-0.3 -2,-0.2 0.784 115.1 57.2 -71.2 -23.1 -10.6 -11.6 13.7 91 120 A F H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.937 107.5 45.7 -71.1 -46.1 -11.0 -9.8 17.1 92 121 A L H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.813 109.7 55.1 -65.6 -31.6 -14.5 -11.3 17.6 93 122 A R H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.920 106.3 52.4 -62.4 -41.0 -13.2 -14.7 16.5 94 123 A A H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 5,-0.3 0.896 107.6 51.1 -59.4 -43.5 -10.6 -14.2 19.3 95 124 A V H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.864 108.3 52.5 -59.9 -39.5 -13.4 -13.5 21.8 96 125 A A H < S+ 0 0 3 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.913 115.2 40.8 -63.8 -42.1 -15.2 -16.7 20.6 97 126 A Q H < S+ 0 0 0 -4,-2.2 92,-0.2 1,-0.1 -2,-0.2 0.812 124.0 35.3 -75.3 -32.1 -12.0 -18.8 21.2 98 127 A R H < S+ 0 0 68 -4,-2.2 -3,-0.2 1,-0.2 -2,-0.2 0.784 128.5 25.3-100.0 -36.2 -10.9 -17.2 24.5 99 128 A a < + 0 0 21 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.1 -0.752 60.8 170.4-129.4 89.2 -14.1 -16.3 26.4 100 129 A P + 0 0 61 0, 0.0 4,-0.1 0, 0.0 -4,-0.1 0.306 45.1 116.5 -79.7 12.8 -16.8 -18.7 25.2 101 130 A S + 0 0 92 2,-0.1 -24,-0.1 -22,-0.0 -30,-0.1 -0.975 66.7 31.7-142.4 116.3 -19.1 -17.4 28.0 102 131 A P S S- 0 0 18 0, 0.0 2,-0.3 0, 0.0 -24,-0.1 0.501 115.1-104.8 -64.7 160.6 -21.7 -15.9 27.5 103 132 A P - 0 0 56 0, 0.0 -23,-2.1 0, 0.0 2,-0.4 -0.446 22.1-147.7 -74.0 125.0 -22.2 -17.9 24.3 104 133 A X E -c 80 0A 13 -2,-0.3 -23,-0.2 -25,-0.2 3,-0.1 -0.747 17.8-176.7 -75.5 134.5 -21.6 -16.3 21.0 105 134 A I E + 0 0 48 -25,-2.7 89,-2.1 -2,-0.4 90,-1.2 0.858 66.2 19.7-104.3 -61.0 -24.1 -18.0 18.6 106 135 A N E - d 0 195A 12 -26,-0.3 -24,-2.7 88,-0.2 2,-0.6 -0.966 64.9-160.7-113.4 121.3 -23.4 -16.6 15.1 107 136 A L E -cd 82 196A 0 88,-2.1 90,-2.7 -2,-0.5 2,-0.5 -0.893 9.9-167.3 -92.8 121.1 -20.1 -14.9 14.4 108 137 A I E -cd 83 197A 0 -26,-2.9 -24,-2.4 -2,-0.6 2,-0.6 -0.968 1.5-163.5-112.6 120.0 -20.5 -12.7 11.3 109 138 A S E -cd 84 198A 0 88,-3.6 90,-3.3 -2,-0.5 2,-0.8 -0.917 1.3-164.5-107.9 117.0 -17.2 -11.5 9.8 110 139 A V E S-cd 85 199A 1 -26,-3.2 -24,-3.0 -2,-0.6 -21,-0.2 -0.828 77.7 -30.1-108.2 95.1 -17.4 -8.6 7.4 111 140 A G S S+ 0 0 0 88,-1.9 -1,-0.2 -2,-0.8 89,-0.1 0.812 93.6 167.2 67.9 32.7 -14.2 -8.3 5.4 112 141 A G - 0 0 0 101,-0.3 2,-0.5 87,-0.3 -25,-0.2 -0.163 38.1-130.7 -71.1 168.7 -12.2 -9.7 8.3 113 142 A Q > + 0 0 4 -27,-0.3 3,-1.0 1,-0.1 100,-0.2 -0.741 32.8 167.5-125.2 83.2 -8.6 -10.8 7.9 114 143 A H T 3 S+ 0 0 0 98,-1.8 -1,-0.1 -2,-0.5 99,-0.1 0.686 83.3 37.0 -79.0 -19.3 -8.5 -14.2 9.5 115 144 A Q T 3 S- 0 0 8 1,-0.4 -1,-0.3 101,-0.3 2,-0.1 0.199 115.7-124.1-107.0 14.0 -5.1 -15.1 8.1 116 145 A G < - 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0 0 0 -4,-1.4 4,-0.9 -3,-0.3 3,-0.8 -0.968 60.1-155.9-126.8 113.3 0.8 -1.5 16.9 152 181 A V G >4 S+ 0 0 0 -97,-2.7 3,-1.0 -2,-0.5 4,-0.3 0.887 92.9 52.6 -56.3 -43.4 -2.4 -3.4 16.3 153 182 A Q G >4 S+ 0 0 0 -98,-0.4 3,-0.8 1,-0.3 -1,-0.2 0.761 101.5 61.5 -71.7 -22.3 -1.8 -4.2 12.6 154 183 A A G X4 S+ 0 0 0 -3,-0.8 3,-1.0 -7,-0.2 -1,-0.3 0.828 94.4 65.3 -64.3 -31.3 1.7 -5.7 13.4 155 184 A E G << S+ 0 0 0 -3,-1.0 18,-2.5 -4,-0.9 17,-0.5 0.543 112.6 30.4 -80.6 -10.0 -0.1 -8.3 15.6 156 185 A Y G < S+ 0 0 3 -3,-0.8 -39,-1.6 -4,-0.3 2,-0.5 0.079 86.0 128.5-126.5 21.9 -1.9 -9.9 12.5 157 186 A W B < -f 117 0B 11 -3,-1.0 2,-0.6 -41,-0.2 -39,-0.2 -0.681 41.9-167.1 -72.0 122.4 0.9 -9.0 10.0 158 187 A H - 0 0 5 -41,-3.0 5,-0.1 -2,-0.5 3,-0.1 -0.900 11.1-163.0-128.1 98.8 1.5 -12.4 8.4 159 188 A D - 0 0 20 -2,-0.6 7,-0.3 3,-0.2 6,-0.1 -0.748 2.1-168.3 -81.7 115.7 4.6 -12.7 6.2 160 189 A P S S+ 0 0 0 0, 0.0 61,-3.4 0, 0.0 3,-0.4 0.695 86.9 50.4 -78.9 -19.8 4.2 -15.9 4.0 161 190 A I S S+ 0 0 93 60,-0.2 2,-1.9 1,-0.2 3,-0.3 0.971 116.6 36.2 -76.7 -67.2 7.9 -15.7 3.0 162 191 A K S >> S+ 0 0 88 1,-0.2 4,-1.8 2,-0.1 3,-0.6 -0.407 79.6 154.2 -83.9 62.6 9.5 -15.5 6.5 163 192 A E H 3> + 0 0 20 -2,-1.9 4,-2.0 -3,-0.4 -1,-0.2 0.820 64.9 54.4 -63.9 -37.4 6.8 -17.8 7.8 164 193 A D H 3> S+ 0 0 110 -3,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.755 106.4 51.6 -73.9 -26.2 8.8 -19.1 10.8 165 194 A V H <> S+ 0 0 59 -3,-0.6 4,-1.7 2,-0.2 5,-0.2 0.885 108.9 52.5 -71.4 -41.4 9.5 -15.6 12.0 166 195 A Y H X S+ 0 0 0 -4,-1.8 4,-1.9 -7,-0.3 -2,-0.2 0.910 110.8 47.1 -58.1 -43.6 5.8 -15.0 11.9 167 196 A R H < S+ 0 0 64 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.889 116.3 43.0 -66.2 -40.8 5.1 -18.1 14.0 168 197 A N H < S+ 0 0 117 -4,-1.5 -1,-0.2 1,-0.1 -2,-0.2 0.705 125.5 29.6 -81.6 -18.5 7.7 -17.3 16.6 169 198 A H H < S+ 0 0 95 -4,-1.7 2,-0.5 -3,-0.1 -2,-0.2 0.566 81.8 105.9-122.9 -14.1 7.0 -13.6 17.0 170 199 A S < - 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