==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 10-JUN-02 1LZL . COMPND 2 MOLECULE: HEROIN ESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOCOCCUS SP.; . AUTHOR X.ZHU,N.A.LARSEN,A.BASRAN,N.C.BRUCE,I.A.WILSON . 317 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12877.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 4.4 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 . 1 0.3 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 . 29 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 98 30.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 1 1 1 0 0 0 0 1 1 1 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 1 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 0 0 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 0 168 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -14.9 76.1 19.3 -25.3 2 3 A T + 0 0 117 1,-0.3 0, 0.0 2,-0.1 0, 0.0 0.873 360.0 19.9 -66.1 -39.6 75.2 22.7 -23.7 3 4 A F S > S+ 0 0 50 1,-0.1 3,-1.7 3,-0.0 -1,-0.3 -0.744 75.7 175.6-128.7 79.6 76.1 21.2 -20.3 4 5 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.761 74.7 61.2 -69.4 -16.7 78.4 18.3 -21.1 5 6 A T T 3 S+ 0 0 73 2,-0.1 252,-0.1 -4,-0.1 253,-0.0 0.595 79.1 117.4 -83.8 -6.1 79.1 17.6 -17.4 6 7 A L S < S- 0 0 15 -3,-1.7 281,-0.2 1,-0.1 280,-0.1 -0.267 79.6-104.8 -58.4 142.1 75.5 16.9 -16.6 7 8 A D >> - 0 0 39 279,-2.6 4,-2.6 1,-0.2 3,-1.5 -0.473 29.8-129.3 -58.0 126.2 74.5 13.5 -15.4 8 9 A P H 3> S+ 0 0 108 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.845 108.3 59.9 -50.9 -31.2 72.8 11.9 -18.5 9 10 A E H 3> S+ 0 0 96 1,-0.2 4,-0.6 2,-0.2 288,-0.1 0.821 112.9 36.8 -65.0 -32.5 69.9 11.0 -16.3 10 11 A L H X> S+ 0 0 0 -3,-1.5 3,-1.0 2,-0.2 4,-0.6 0.924 104.2 69.5 -84.9 -46.7 69.4 14.6 -15.4 11 12 A A H >< S+ 0 0 43 -4,-2.6 3,-0.9 1,-0.3 4,-0.4 0.782 96.3 57.9 -34.9 -46.7 70.2 15.9 -18.9 12 13 A A H >< S+ 0 0 64 -4,-1.4 3,-1.3 1,-0.2 4,-0.3 0.940 100.2 53.3 -49.8 -57.4 67.0 14.3 -20.0 13 14 A A H - 0 0 68 -2,-0.8 3,-1.4 3,-0.2 7,-0.4 -0.810 21.8-159.6 -96.8 115.9 62.1 34.0 -14.3 22 23 A F T 3 S+ 0 0 0 -2,-0.7 3,-0.3 1,-0.3 -1,-0.1 0.610 83.5 77.4 -64.1 -14.7 62.1 36.3 -11.3 23 24 A A T 3 S+ 0 0 71 1,-0.3 2,-0.7 2,-0.1 -1,-0.3 0.868 100.1 41.3 -69.3 -28.0 61.7 39.3 -13.5 24 25 A D S <> S- 0 0 76 -3,-1.4 4,-2.6 1,-0.2 -1,-0.3 -0.821 76.3-179.5-117.2 87.0 58.0 38.6 -13.9 25 26 A L H > S+ 0 0 17 -2,-0.7 4,-2.9 -3,-0.3 5,-0.3 0.891 74.6 54.0 -63.5 -42.0 57.1 37.5 -10.4 26 27 A P H > S+ 0 0 96 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.928 114.7 42.2 -58.3 -40.1 53.4 36.7 -10.9 27 28 A N H > S+ 0 0 84 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.930 112.4 53.5 -73.3 -37.2 54.3 34.4 -13.7 28 29 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 -7,-0.4 5,-0.3 0.915 109.1 50.0 -55.9 -47.2 57.2 32.9 -11.7 29 30 A R H X S+ 0 0 52 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.871 112.9 47.9 -59.6 -37.7 54.9 32.2 -8.9 30 31 A A H X S+ 0 0 54 -4,-1.7 4,-1.6 -5,-0.3 -2,-0.2 0.969 112.4 44.1 -77.3 -48.7 52.4 30.5 -11.2 31 32 A T H X S+ 0 0 35 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.924 118.3 46.8 -65.4 -31.8 54.7 28.3 -13.1 32 33 A Y H X S+ 0 0 41 -4,-2.2 4,-1.3 -5,-0.3 5,-0.3 0.974 109.8 51.9 -68.9 -45.2 56.4 27.3 -9.8 33 34 A D H X S+ 0 0 76 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.2 0.782 114.0 45.2 -61.1 -24.3 53.2 26.7 -8.0 34 35 A A H X S+ 0 0 63 -4,-1.6 4,-1.5 2,-0.2 -1,-0.3 0.837 106.2 57.4 -88.8 -31.2 52.2 24.4 -10.9 35 36 A L H < S+ 0 0 56 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.587 119.7 34.6 -69.8 -15.6 55.6 22.6 -11.1 36 37 A I H >X S+ 0 0 7 -4,-1.3 4,-1.6 -5,-0.2 3,-1.5 0.795 112.2 54.2-103.6 -53.6 54.9 21.7 -7.4 37 38 A G H 3X S+ 0 0 33 -4,-1.9 4,-1.4 1,-0.3 -3,-0.2 0.842 101.7 62.4 -56.1 -30.7 51.1 21.2 -7.1 38 39 A A H 3< S+ 0 0 70 -4,-1.5 4,-0.4 1,-0.2 -1,-0.3 0.918 107.7 44.4 -56.1 -39.1 51.3 18.7 -9.9 39 40 A M H X4 S+ 0 0 72 -3,-1.5 3,-0.5 1,-0.2 -2,-0.2 0.815 107.8 57.0 -78.1 -29.6 53.5 16.7 -7.5 40 41 A L H >< S+ 0 0 22 -4,-1.6 3,-1.1 1,-0.2 -1,-0.2 0.735 89.1 77.8 -74.9 -21.7 51.3 17.2 -4.4 41 42 A A T 3< S+ 0 0 74 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.1 0.863 105.3 28.1 -54.3 -41.4 48.3 15.7 -6.1 42 43 A D T < S+ 0 0 146 -3,-0.5 -1,-0.3 -4,-0.4 2,-0.2 0.209 87.9 137.2-108.9 13.7 49.3 12.1 -5.7 43 44 A L < - 0 0 46 -3,-1.1 2,-0.4 -4,-0.1 -3,-0.1 -0.408 49.4-132.5 -67.7 130.9 51.4 12.4 -2.6 44 45 A S - 0 0 66 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.690 21.5-175.6 -85.3 132.5 50.9 9.7 -0.0 45 46 A F > + 0 0 74 -2,-0.4 3,-2.0 3,-0.1 -1,-0.1 0.038 32.1 149.5-109.8 20.1 50.5 10.6 3.6 46 47 A D T 3 + 0 0 124 1,-0.3 3,-0.1 3,-0.0 -2,-0.0 -0.346 69.0 11.6 -56.6 134.8 50.4 6.9 4.7 47 48 A G T 3 S+ 0 0 31 1,-0.2 25,-2.6 24,-0.1 2,-0.3 0.441 118.2 74.8 75.3 6.4 51.8 6.5 8.2 48 49 A V E < -A 71 0A 9 -3,-2.0 2,-0.3 23,-0.3 -1,-0.2 -0.925 60.6-148.4-138.3 165.3 51.8 10.2 9.1 49 50 A S E -A 70 0A 57 21,-2.2 21,-2.9 -2,-0.3 2,-0.4 -0.968 7.6-152.7-133.0 152.9 49.4 13.0 10.0 50 51 A L E +A 69 0A 54 -2,-0.3 2,-0.3 19,-0.2 19,-0.2 -0.979 18.1 166.6-123.5 131.4 49.5 16.8 9.3 51 52 A R E -A 68 0A 130 17,-2.2 17,-2.7 -2,-0.4 2,-0.5 -0.968 34.8-109.4-139.6 161.5 47.9 19.5 11.4 52 53 A E E -A 67 0A 121 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.783 27.5-167.9 -96.1 130.4 48.3 23.2 11.4 53 54 A L E -A 66 0A 7 13,-2.6 13,-2.3 -2,-0.5 2,-0.5 -0.774 12.6-143.2-105.1 158.4 50.0 25.0 14.3 54 55 A S E -A 65 0A 45 -2,-0.3 11,-0.2 11,-0.2 9,-0.0 -0.923 13.2-167.7-125.1 106.8 50.0 28.8 14.8 55 56 A A E -A 64 0A 0 9,-2.7 9,-2.9 -2,-0.5 80,-0.1 -0.731 29.6-114.3 -90.6 128.6 53.2 30.4 16.2 56 57 A P - 0 0 91 0, 0.0 7,-0.2 0, 0.0 82,-0.1 -0.399 35.9-123.1 -58.7 133.5 52.9 34.0 17.4 57 58 A G - 0 0 17 4,-0.6 2,-0.1 1,-0.1 6,-0.1 -0.306 28.6 -94.3 -70.7 165.8 55.0 36.3 15.2 58 59 A L S > S- 0 0 38 69,-0.1 3,-2.8 4,-0.1 -1,-0.1 -0.429 91.6 -8.2 -73.3 156.8 57.8 38.6 16.4 59 60 A D T 3 S- 0 0 151 1,-0.3 -2,-0.0 -2,-0.1 0, 0.0 -0.220 134.6 -31.8 53.6-136.3 57.0 42.2 17.3 60 61 A G T 3 S+ 0 0 84 2,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.179 102.2 139.2 -97.4 25.0 53.4 42.9 16.1 61 62 A D < - 0 0 44 -3,-2.8 -4,-0.6 1,-0.1 3,-0.1 -0.257 57.8 -97.5 -69.9 155.2 53.7 40.5 13.2 62 63 A P - 0 0 73 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 -0.123 52.1 -77.7 -61.5 163.3 50.9 38.1 12.2 63 64 A E - 0 0 123 -7,-0.2 2,-0.6 -6,-0.1 68,-0.0 -0.284 42.7-133.3 -57.7 145.8 50.8 34.5 13.4 64 65 A V E -A 55 0A 3 -9,-2.9 -9,-2.7 -3,-0.1 2,-0.2 -0.947 17.7-140.1-106.4 116.1 53.1 32.1 11.5 65 66 A K E -A 54 0A 70 -2,-0.6 51,-2.8 51,-0.4 2,-0.4 -0.506 14.4-160.9 -79.7 149.4 51.4 28.9 10.4 66 67 A I E -AB 53 115A 0 -13,-2.3 -13,-2.6 49,-0.2 2,-0.9 -0.996 17.0-141.6-127.7 126.5 53.3 25.7 10.6 67 68 A R E -AB 52 114A 54 47,-2.9 47,-2.6 -2,-0.4 2,-0.7 -0.812 28.8-160.2 -86.5 107.0 52.4 22.4 8.7 68 69 A F E -AB 51 113A 1 -17,-2.7 -17,-2.2 -2,-0.9 2,-0.5 -0.822 7.5-167.9-106.2 108.6 53.2 20.0 11.6 69 70 A V E -AB 50 112A 0 43,-2.6 43,-2.4 -2,-0.7 -19,-0.2 -0.836 7.4-179.6-100.2 122.9 53.8 16.5 10.4 70 71 A T E -A 49 0A 34 -21,-2.9 -21,-2.2 -2,-0.5 2,-0.2 -0.947 28.4-117.5-126.8 146.5 54.0 13.7 12.9 71 72 A P E -A 48 0A 16 0, 0.0 3,-0.4 0, 0.0 -23,-0.3 -0.581 34.7-118.6 -78.0 143.4 54.5 9.9 12.5 72 73 A D S S+ 0 0 69 -25,-2.6 -26,-0.0 -2,-0.2 -23,-0.0 -0.361 89.7 22.6 -73.8 160.6 51.6 7.7 13.5 73 74 A N S S+ 0 0 170 1,-0.2 2,-0.6 2,-0.1 -1,-0.2 0.894 85.1 148.6 66.9 36.7 52.1 5.1 16.3 74 75 A T - 0 0 65 -3,-0.4 -1,-0.2 1,-0.2 4,-0.1 -0.910 47.6-147.9-127.7 121.6 55.0 6.8 18.0 75 76 A A - 0 0 108 -2,-0.6 -1,-0.2 2,-0.1 3,-0.1 0.825 54.3-173.1 -47.3 -46.9 55.7 6.8 21.6 76 77 A G S S+ 0 0 37 1,-0.2 2,-0.2 73,-0.0 72,-0.1 0.389 73.1 136.7 60.8 150.3 57.3 10.3 21.6 77 78 A P + 0 0 86 0, 0.0 71,-0.3 0, 0.0 -1,-0.2 0.289 64.0 177.5 -69.6 140.1 58.8 12.8 22.7 78 79 A V E -c 148 0A 21 69,-2.4 71,-2.5 -2,-0.2 74,-0.1 -0.831 33.1 -93.4-119.8 160.0 60.5 12.7 19.4 79 80 A P E - 0 0 5 0, 0.0 32,-2.4 0, 0.0 2,-0.4 -0.249 41.0-143.9 -60.8 160.7 63.1 14.9 17.7 80 81 A V E -cd 153 111A 0 72,-2.1 74,-2.9 69,-0.3 2,-0.6 -0.989 9.2-151.4-131.9 142.4 61.8 17.7 15.4 81 82 A L E -cd 154 112A 0 30,-2.2 32,-2.7 -2,-0.4 2,-0.6 -0.966 10.9-151.5-105.5 118.5 63.0 19.2 12.1 82 83 A L E -cd 155 113A 0 72,-3.2 74,-2.6 -2,-0.6 2,-0.4 -0.830 25.7-163.5 -83.3 120.1 62.0 22.8 11.6 83 84 A W E -cd 156 114A 2 30,-2.5 32,-2.8 -2,-0.6 2,-0.5 -0.902 15.4-165.8-117.6 140.9 61.9 23.0 7.8 84 85 A I E -c 157 0A 0 72,-1.4 74,-1.5 -2,-0.4 81,-0.1 -0.972 18.1-135.0-131.5 117.6 61.9 26.1 5.6 85 86 A H - 0 0 0 30,-0.5 9,-0.1 -2,-0.5 2,-0.1 -0.199 17.4-126.4 -72.3 162.4 61.1 25.8 1.9 86 87 A G + 0 0 4 74,-0.2 73,-0.2 75,-0.1 -1,-0.1 -0.099 47.8 132.1 -96.9-164.3 62.9 27.5 -0.9 87 88 A G S >> S- 0 0 11 71,-0.1 4,-1.9 3,-0.1 3,-1.6 0.553 86.2 -79.0 125.7 26.8 61.9 29.8 -3.8 88 89 A G T 34 S- 0 0 1 1,-0.3 132,-0.2 2,-0.2 131,-0.1 0.728 79.7 -73.0 61.2 23.0 64.5 32.6 -3.8 89 90 A F T 34 S+ 0 0 0 2,-0.3 31,-2.8 1,-0.1 -1,-0.3 0.208 133.8 64.5 77.0 -12.4 62.7 34.4 -0.9 90 91 A A T <4 S+ 0 0 0 -3,-1.6 2,-0.3 29,-0.2 -2,-0.2 0.524 96.8 41.1-122.5 -10.6 59.9 35.5 -3.2 91 92 A I S < S+ 0 0 5 -4,-1.9 -2,-0.3 -63,-0.0 29,-0.1 -0.881 75.8 56.9-133.4 167.6 58.1 32.3 -4.4 92 93 A G - 0 0 4 -2,-0.3 2,-0.3 -63,-0.1 -5,-0.1 -0.004 53.5-122.6 99.5 159.9 56.9 29.0 -2.9 93 94 A T > - 0 0 41 1,-0.1 3,-0.8 23,-0.0 4,-0.4 -0.922 27.2-111.2-133.3 155.6 54.7 27.7 -0.2 94 95 A A G > S+ 0 0 0 -2,-0.3 3,-2.3 1,-0.2 4,-0.2 0.909 115.7 62.6 -56.4 -38.9 55.2 25.5 2.8 95 96 A E G > S+ 0 0 84 1,-0.3 3,-2.3 2,-0.2 -1,-0.2 0.795 87.2 71.9 -62.2 -24.3 53.0 22.8 1.2 96 97 A S G < S+ 0 0 9 -3,-0.8 -1,-0.3 1,-0.3 -2,-0.2 0.783 98.3 50.4 -60.9 -21.6 55.5 22.6 -1.7 97 98 A S G <> S+ 0 0 12 -3,-2.3 4,-2.3 -4,-0.4 -1,-0.3 0.320 76.4 106.7 -96.8 7.2 57.8 20.8 0.8 98 99 A D H <> S+ 0 0 1 -3,-2.3 4,-2.9 1,-0.2 5,-0.3 0.884 72.4 60.1 -52.8 -39.3 55.2 18.3 2.0 99 100 A P H > S+ 0 0 39 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.945 110.7 39.6 -55.3 -48.4 56.9 15.4 0.1 100 101 A F H > S+ 0 0 36 -3,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.905 115.1 51.9 -67.3 -42.2 60.2 15.8 2.0 101 102 A C H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.909 110.6 48.4 -65.5 -39.1 58.5 16.5 5.4 102 103 A V H X S+ 0 0 1 -4,-2.9 4,-3.1 -5,-0.2 5,-0.3 0.927 109.9 53.9 -62.3 -43.1 56.3 13.4 5.0 103 104 A E H X S+ 0 0 66 -4,-2.2 4,-3.0 -5,-0.3 5,-0.5 0.934 109.7 46.3 -56.0 -46.6 59.5 11.4 4.1 104 105 A V H X>S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 6,-0.8 0.947 115.1 46.3 -63.5 -45.6 61.3 12.5 7.3 105 106 A A H X5S+ 0 0 0 -4,-2.3 4,-1.3 -5,-0.2 -2,-0.2 0.943 118.8 40.9 -65.0 -44.6 58.3 11.8 9.5 106 107 A R H <5S+ 0 0 88 -4,-3.1 -2,-0.2 -5,-0.2 -1,-0.2 0.951 123.6 35.0 -70.2 -45.0 57.6 8.4 8.0 107 108 A E H <5S+ 0 0 114 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.869 130.8 28.5 -84.6 -32.8 61.2 7.1 7.6 108 109 A L H <5S- 0 0 28 -4,-2.2 -3,-0.2 -5,-0.5 -1,-0.2 0.613 94.8-127.2-102.3 -17.2 62.8 8.6 10.7 109 110 A G << + 0 0 20 -4,-1.3 2,-0.3 -5,-0.6 -4,-0.2 0.805 63.4 136.1 74.6 28.2 59.9 8.9 13.1 110 111 A F - 0 0 17 -6,-0.8 -1,-0.3 -32,-0.1 -30,-0.2 -0.816 57.5-116.2-108.7 145.4 60.6 12.6 13.7 111 112 A A E - d 0 80A 1 -32,-2.4 -30,-2.2 -2,-0.3 2,-0.4 -0.495 27.3-152.2 -72.9 151.9 58.1 15.4 13.9 112 113 A V E -Bd 69 81A 0 -43,-2.4 -43,-2.6 -32,-0.2 2,-0.8 -0.987 9.8-162.2-132.6 124.5 58.5 18.1 11.2 113 114 A A E -Bd 68 82A 0 -32,-2.7 -30,-2.5 -2,-0.4 2,-0.7 -0.890 13.5-166.0-105.4 96.3 57.5 21.7 11.6 114 115 A N E -Bd 67 83A 0 -47,-2.6 -47,-2.9 -2,-0.8 2,-0.4 -0.789 17.0-138.0 -91.2 112.8 57.3 23.1 8.1 115 116 A V E -B 66 0A 0 -32,-2.8 2,-1.4 -2,-0.7 -30,-0.5 -0.592 12.5-152.1 -90.7 127.2 57.1 26.9 8.3 116 117 A E - 0 0 75 -51,-2.8 -51,-0.4 -2,-0.4 2,-0.2 -0.677 30.3-178.8 -86.7 82.7 54.9 29.2 6.3 117 118 A Y - 0 0 5 -2,-1.4 2,-0.2 -53,-0.1 -23,-0.1 -0.514 33.3 -97.7 -79.9 157.4 57.0 32.3 6.3 118 119 A R - 0 0 64 9,-0.2 2,-0.2 -2,-0.2 13,-0.1 -0.515 41.4-125.9 -74.0 142.8 56.0 35.5 4.6 119 120 A L > - 0 0 40 -2,-0.2 4,-1.9 -29,-0.1 -29,-0.2 -0.594 29.0 -93.8 -90.7 146.8 57.4 36.1 1.1 120 121 A A T 4 S+ 0 0 0 -31,-2.8 100,-0.2 1,-0.3 4,-0.1 -0.535 94.7 34.4 -82.6 161.6 59.3 39.0 -0.3 121 122 A P T 4 S+ 0 0 48 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 -1.000 122.2 50.8 -79.4 -7.5 59.0 41.6 -1.7 122 123 A E T 4 S+ 0 0 128 1,-0.3 2,-0.5 -3,-0.1 -2,-0.2 0.879 127.3 27.6 -59.0 -36.0 55.7 42.1 0.1 123 124 A T S < S- 0 0 30 -4,-1.9 -1,-0.3 3,-0.0 2,-0.1 -0.954 87.6-165.8-122.7 108.6 57.5 41.4 3.4 124 125 A T > - 0 0 54 -2,-0.5 3,-2.2 -3,-0.2 97,-0.2 -0.453 36.2 -37.0 -88.4 166.3 61.2 42.3 3.2 125 126 A F T 3 S+ 0 0 41 95,-3.2 -1,-0.2 1,-0.3 112,-0.0 -0.338 121.6 35.8 -48.3 138.6 63.9 41.3 5.6 126 127 A P T 3> S+ 0 0 63 0, 0.0 4,-2.8 0, 0.0 -1,-0.3 -0.986 108.4 70.5 -86.5 3.4 63.8 41.0 8.6 127 128 A G H <> S+ 0 0 5 -3,-2.2 4,-2.3 1,-0.2 -9,-0.2 0.876 96.9 46.8 -53.0 -52.5 60.3 39.6 8.3 128 129 A P H > S+ 0 0 0 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.914 116.4 43.2 -61.3 -43.1 60.9 36.2 6.8 129 130 A V H > S+ 0 0 0 -3,-0.2 4,-2.7 1,-0.2 5,-0.2 0.895 111.8 56.4 -70.8 -32.0 63.7 35.2 9.1 130 131 A N H X S+ 0 0 16 -4,-2.8 4,-2.9 1,-0.2 -1,-0.2 0.894 105.2 52.0 -61.9 -37.3 61.7 36.6 12.0 131 132 A D H X S+ 0 0 2 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.898 110.3 48.1 -64.6 -38.5 58.8 34.3 11.1 132 133 A C H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.913 113.7 46.2 -69.3 -39.6 61.2 31.3 11.1 133 134 A Y H X S+ 0 0 14 -4,-2.7 4,-3.0 1,-0.2 5,-0.2 0.899 110.0 54.6 -70.4 -35.5 62.7 32.3 14.4 134 135 A A H X S+ 0 0 3 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.896 108.3 48.9 -60.8 -40.0 59.2 32.9 15.8 135 136 A A H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.902 111.4 50.2 -66.1 -40.1 58.3 29.3 14.7 136 137 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.951 110.2 49.4 -62.8 -47.4 61.5 28.0 16.4 137 138 A L H X S+ 0 0 52 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.891 113.5 48.1 -55.6 -44.5 60.7 29.9 19.7 138 139 A Y H X S+ 0 0 29 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.936 111.2 46.6 -65.4 -51.7 57.2 28.5 19.6 139 140 A I H < S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.885 115.7 47.7 -62.1 -33.2 58.1 24.8 18.9 140 141 A H H >< S+ 0 0 53 -4,-2.2 3,-1.3 -5,-0.2 4,-0.2 0.943 114.2 45.3 -70.4 -46.4 60.8 25.0 21.7 141 142 A A H 3< S+ 0 0 76 -4,-2.5 3,-0.2 1,-0.3 -2,-0.2 0.786 121.6 38.0 -70.1 -31.0 58.5 26.6 24.2 142 143 A H T 3X S+ 0 0 67 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.3 0.114 80.8 121.4-101.6 22.9 55.6 24.3 23.5 143 144 A A H <>>S+ 0 0 4 -3,-1.3 5,-2.8 1,-0.2 4,-0.9 0.905 72.5 49.4 -60.4 -42.5 57.7 21.1 23.0 144 145 A E H >45S+ 0 0 190 -4,-0.2 3,-1.1 1,-0.2 -1,-0.2 0.956 112.5 46.5 -61.7 -48.2 56.1 19.0 25.7 145 146 A E H 345S+ 0 0 131 1,-0.3 -1,-0.2 2,-0.1 -2,-0.2 0.847 115.0 49.2 -60.7 -34.1 52.6 19.8 24.6 146 147 A L H 3<5S- 0 0 11 -4,-2.0 -1,-0.3 -7,-0.2 -2,-0.2 0.541 114.4-114.6 -88.5 -4.4 53.7 19.0 21.0 147 148 A G T <<5 + 0 0 30 -3,-1.1 -69,-2.4 -4,-0.9 2,-0.4 0.806 69.2 142.0 78.9 27.3 55.4 15.7 21.9 148 149 A I E < -c 78 0A 4 -5,-2.8 -1,-0.3 -71,-0.3 -2,-0.1 -0.815 55.8-130.9-106.2 139.0 58.8 17.1 20.9 149 150 A D E > - 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0 0 72 0, 0.0 2,-0.5 0, 0.0 -26,-0.3 -0.646 13.6-154.1 -80.1 132.2 69.3 25.2 21.7 180 181 A V - 0 0 25 -2,-0.4 -26,-0.2 1,-0.1 3,-0.1 -0.958 9.0-169.4-108.3 123.0 69.6 23.8 18.1 181 182 A A + 0 0 29 -28,-2.7 2,-0.3 -2,-0.5 -27,-0.2 0.724 68.8 10.8 -81.6 -27.0 71.0 20.3 17.9 182 183 A F E -e 154 0A 4 -29,-1.1 -27,-2.3 67,-0.2 2,-0.4 -0.989 57.6-149.7-158.8 143.7 71.6 20.1 14.1 183 184 A Q E -ef 155 251A 0 67,-2.5 69,-2.3 -2,-0.3 2,-0.5 -0.991 10.8-168.7-122.4 126.4 71.6 22.3 11.0 184 185 A F E +ef 156 252A 0 -29,-2.4 -27,-2.0 -2,-0.4 2,-0.6 -0.952 6.7 180.0-123.5 112.3 70.7 21.0 7.6 185 186 A L E -ef 157 253A 0 67,-3.2 69,-2.1 -2,-0.5 2,-0.6 -0.932 5.1-170.8-118.2 107.9 71.4 23.3 4.6 186 187 A E E S-ef 158 254A 33 -29,-2.7 -27,-2.6 -2,-0.6 -24,-0.3 -0.900 74.3 -30.2-104.5 125.5 70.5 22.1 1.1 187 188 A I S S- 0 0 4 67,-2.0 -1,-0.2 -2,-0.6 -25,-0.2 0.884 92.1-157.5 38.7 51.7 71.8 24.1 -1.8 188 189 A P - 0 0 1 0, 0.0 2,-0.7 0, 0.0 -28,-0.2 -0.266 21.3-138.5 -69.4 149.6 71.6 27.2 0.5 189 190 A E + 0 0 0 -30,-1.9 3,-0.1 1,-0.1 -3,-0.0 -0.902 45.5 146.3-101.8 104.3 71.3 30.8 -0.7 190 191 A L + 0 0 0 -2,-0.7 50,-2.0 1,-0.2 2,-0.5 0.607 43.7 56.9-121.2 -22.8 73.7 32.6 1.7 191 192 A D > - 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