==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-AUG-07 2V9Z . COMPND 2 MOLECULE: HALOALKANE DEHALOGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOCOCCUS RHODOCHROUS; . AUTHOR T.KOUDELAKOVA,Z.PROKOP,Y.SATO,M.LAPKOUSKI,E.CHOVANCOVA, . 302 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12094.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 209 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 2 0.7 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 . 22 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.0 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 3 1 0 0 1 1 1 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 0 2 1 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 PARALLEL BRIDGES PER LADDER . 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 3 A E 0 0 23 0, 0.0 286,-0.1 0, 0.0 47,-0.0 0.000 360.0 360.0 360.0 110.2 -6.6 -20.0 -14.7 2 4 A I + 0 0 165 2,-0.1 2,-0.3 46,-0.0 283,-0.0 0.703 360.0 116.5 -42.4 -27.4 -9.9 -19.1 -16.4 3 5 A G + 0 0 26 1,-0.2 45,-0.1 45,-0.1 44,-0.1 -0.276 32.4 161.5 -61.0 109.5 -8.5 -15.6 -17.2 4 6 A T + 0 0 60 -2,-0.3 2,-0.2 43,-0.1 -1,-0.2 0.573 38.9 80.9-110.2 -13.6 -8.4 -15.5 -21.0 5 7 A G - 0 0 38 42,-0.1 189,-0.0 1,-0.0 188,-0.0 -0.566 55.0-150.4-107.5 164.8 -8.2 -11.8 -22.1 6 8 A F + 0 0 38 -2,-0.2 38,-0.0 1,-0.1 42,-0.0 -0.557 28.5 159.1-133.2 65.7 -5.5 -9.2 -22.4 7 9 A P + 0 0 112 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.267 28.3 133.7 -78.6 9.1 -7.3 -5.8 -21.8 8 10 A F - 0 0 31 1,-0.1 17,-0.1 17,-0.0 -2,-0.1 -0.086 67.3 -87.7 -71.3 161.5 -4.2 -3.8 -20.9 9 11 A D - 0 0 97 15,-0.3 2,-1.9 1,-0.1 15,-0.5 -0.548 41.0-120.8 -72.0 125.0 -3.3 -0.4 -22.2 10 12 A P + 0 0 95 0, 0.0 2,-0.2 0, 0.0 13,-0.1 -0.442 44.7 174.3 -70.7 78.6 -1.3 -0.6 -25.5 11 13 A H E -A 22 0A 57 -2,-1.9 11,-1.4 11,-1.0 2,-0.3 -0.597 12.9-175.5 -90.0 150.4 1.9 1.2 -24.5 12 14 A Y E -A 21 0A 87 -2,-0.2 2,-0.2 9,-0.2 9,-0.2 -0.867 2.8-178.0-148.4 110.1 5.0 1.5 -26.6 13 15 A V E -A 20 0A 27 7,-1.8 7,-2.7 -2,-0.3 2,-0.4 -0.621 29.5-115.8 -97.1 166.4 8.4 3.0 -25.7 14 16 A E E -A 19 0A 113 5,-0.2 2,-0.4 -2,-0.2 5,-0.2 -0.873 30.3-173.3-107.3 137.7 11.4 3.3 -28.0 15 17 A V - 0 0 3 3,-3.4 3,-0.1 -2,-0.4 74,-0.1 -0.982 66.5 -22.2-141.4 123.7 14.6 1.5 -27.3 16 18 A L S S- 0 0 99 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.924 132.1 -47.6 39.9 49.1 18.0 1.7 -29.1 17 19 A G S S+ 0 0 62 1,-0.2 2,-0.3 -3,-0.0 -1,-0.2 0.841 122.6 100.9 69.7 38.9 15.9 3.0 -32.0 18 20 A E S S- 0 0 35 -3,-0.1 -3,-3.4 55,-0.0 2,-0.3 -0.997 72.3-107.1-159.8 140.1 13.2 0.3 -31.8 19 21 A R E -A 14 0A 108 -2,-0.3 52,-2.0 -5,-0.2 2,-0.4 -0.530 29.1-174.3 -81.1 134.6 9.7 -0.1 -30.6 20 22 A M E -A 13 0A 2 -7,-2.7 -7,-1.8 -2,-0.3 50,-0.1 -0.961 14.1-146.5-130.2 117.6 8.9 -2.2 -27.4 21 23 A H E +A 12 0A 5 -2,-0.4 42,-2.1 -9,-0.2 2,-0.3 -0.408 29.3 162.2 -73.5 154.1 5.4 -3.0 -26.2 22 24 A Y E -A 11 0A 24 -11,-1.4 -11,-1.0 40,-0.2 2,-0.5 -0.970 36.8-110.2-163.7 169.8 4.9 -3.2 -22.5 23 25 A V - 0 0 1 38,-0.4 38,-1.5 -2,-0.3 2,-0.5 -0.942 26.4-177.5-116.4 125.2 2.2 -3.1 -19.9 24 26 A D E +B 60 0B 23 -2,-0.5 2,-0.3 -15,-0.5 -15,-0.3 -0.977 20.2 143.1-127.1 116.5 1.9 -0.2 -17.5 25 27 A V E +B 59 0B 42 34,-2.1 34,-4.3 -2,-0.5 3,-0.2 -0.982 29.2 62.7-149.8 146.4 -0.8 -0.4 -14.9 26 28 A G S S- 0 0 27 -2,-0.3 32,-0.3 32,-0.3 28,-0.1 -0.435 95.2 -48.9 117.1 169.1 -1.0 0.7 -11.2 27 29 A P S S- 0 0 69 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.812 73.7-115.4 -47.7 -43.5 -0.8 3.9 -9.2 28 30 A R S S+ 0 0 151 1,-0.4 2,-0.3 -3,-0.2 -2,-0.1 0.724 82.1 30.7 105.0 35.5 2.4 5.1 -10.9 29 31 A D + 0 0 108 2,-0.1 29,-0.7 0, 0.0 -1,-0.4 -0.902 60.2 94.6-176.2-135.1 4.8 5.1 -8.0 30 32 A G S S- 0 0 67 -2,-0.3 27,-0.1 27,-0.1 26,-0.0 -0.463 111.4 -32.8 51.5-141.7 5.7 3.4 -4.8 31 33 A T S S- 0 0 13 -2,-0.1 27,-0.2 65,-0.0 67,-0.1 -0.895 78.0-124.1-105.9 116.4 8.3 0.9 -6.0 32 34 A P - 0 0 17 0, 0.0 67,-2.3 0, 0.0 2,-0.6 -0.264 13.9-136.5 -61.6 141.6 7.5 -0.4 -9.5 33 35 A V E -cd 59 99B 0 25,-3.2 27,-3.2 65,-0.2 2,-0.6 -0.876 13.1-157.9 -97.8 120.6 7.1 -4.1 -10.3 34 36 A L E -cd 60 100B 3 65,-2.4 67,-2.8 -2,-0.6 2,-0.7 -0.882 1.7-163.5 -98.8 115.0 8.8 -5.4 -13.4 35 37 A F E - d 0 101B 0 25,-3.2 2,-0.7 -2,-0.6 67,-0.2 -0.894 9.3-170.7 -96.5 113.8 7.3 -8.6 -14.8 36 38 A L E - d 0 102B 4 65,-1.8 67,-1.8 -2,-0.7 70,-0.1 -0.897 7.7-153.6-108.6 108.5 9.9 -10.1 -17.3 37 39 A H - 0 0 0 -2,-0.7 2,-0.1 25,-0.6 6,-0.1 -0.222 6.7-156.0 -72.7 167.0 8.6 -13.0 -19.3 38 40 A G > - 0 0 0 67,-0.1 3,-1.2 4,-0.1 26,-0.1 -0.057 41.8 -0.5-117.0-140.9 10.8 -15.7 -20.8 39 41 A N T 3 S- 0 0 1 1,-0.3 66,-0.1 -2,-0.1 65,-0.1 -0.853 121.0 -7.2-111.4 138.3 10.5 -18.2 -23.7 40 42 A P T 3 S+ 0 0 1 0, 0.0 -1,-0.3 0, 0.0 171,-0.1 -0.439 115.0 81.9-103.3 64.5 8.3 -18.5 -25.6 41 43 A T < - 0 0 2 -3,-1.2 2,-0.3 1,-0.1 27,-0.2 0.224 46.8-166.7-104.6-142.0 5.9 -16.1 -23.9 42 44 A S > - 0 0 7 -3,-0.1 3,-1.7 26,-0.1 4,-0.4 -0.937 60.3 -49.3 174.2-165.6 5.2 -12.4 -23.7 43 45 A S G > S+ 0 0 4 -2,-0.3 3,-1.6 1,-0.3 4,-0.3 0.848 124.4 75.7 -61.4 -27.4 3.2 -10.0 -21.6 44 46 A Y G > S+ 0 0 5 1,-0.3 3,-1.0 2,-0.2 -1,-0.3 0.766 86.1 65.4 -54.1 -25.1 0.3 -12.4 -22.1 45 47 A L G < S+ 0 0 1 -3,-1.7 3,-0.4 1,-0.2 -1,-0.3 0.863 105.0 39.6 -66.2 -40.9 2.1 -14.6 -19.6 46 48 A W G <> S+ 0 0 0 -3,-1.6 4,-2.4 -4,-0.4 3,-0.4 0.222 85.6 110.2 -91.8 15.5 1.6 -12.1 -16.7 47 49 A R T <4 S+ 0 0 3 -3,-1.0 -1,-0.2 -4,-0.3 -2,-0.1 0.794 83.6 32.5 -74.5 -32.4 -2.0 -11.1 -17.7 48 50 A N T 4 S+ 0 0 25 -3,-0.4 -1,-0.3 -4,-0.2 4,-0.2 0.482 118.3 54.8 -97.8 -7.1 -3.9 -12.8 -14.8 49 51 A I T >> S+ 0 0 0 -3,-0.4 3,-1.7 -4,-0.1 4,-0.6 0.889 98.1 61.7 -84.7 -47.2 -1.2 -12.2 -12.2 50 52 A I H >X S+ 0 0 3 -4,-2.4 4,-2.5 1,-0.3 3,-0.9 0.744 91.4 64.6 -51.0 -36.0 -0.8 -8.5 -12.7 51 53 A P H 34 S+ 0 0 69 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.811 96.4 58.7 -65.1 -24.7 -4.4 -7.6 -11.6 52 54 A H H <4 S+ 0 0 54 -3,-1.7 -2,-0.2 -4,-0.2 4,-0.1 0.794 115.7 36.1 -65.3 -27.0 -3.7 -8.9 -8.1 53 55 A V H XX S+ 0 0 0 -3,-0.9 4,-3.0 -4,-0.6 3,-2.3 0.796 97.7 73.9 -99.7 -35.5 -0.8 -6.3 -7.8 54 56 A A T 3< S+ 0 0 16 -4,-2.5 -2,-0.1 1,-0.3 -1,-0.1 0.821 81.4 74.7 -56.4 -33.3 -2.0 -3.2 -9.7 55 57 A P T 34 S+ 0 0 104 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.798 121.1 9.7 -47.7 -29.5 -4.4 -2.3 -6.9 56 58 A S T <4 S+ 0 0 58 -3,-2.3 2,-0.2 1,-0.1 -2,-0.2 0.680 127.3 45.2-121.9 -38.6 -1.3 -1.2 -4.9 57 59 A H S < S- 0 0 26 -4,-3.0 2,-0.7 -30,-0.1 -1,-0.1 -0.663 79.3-105.9-113.2 165.2 1.7 -1.2 -7.2 58 60 A R - 0 0 15 -29,-0.7 -25,-3.2 -32,-0.3 2,-0.5 -0.818 37.2-156.9 -85.3 117.6 2.7 -0.1 -10.6 59 61 A C E -Bc 25 33B 0 -34,-4.3 -34,-2.1 -2,-0.7 2,-0.4 -0.876 13.2-179.4-100.4 123.7 3.0 -3.2 -12.8 60 62 A I E -Bc 24 34B 0 -27,-3.2 -25,-3.2 -2,-0.5 -36,-0.2 -0.991 3.3-177.9-121.6 133.3 5.2 -3.0 -15.9 61 63 A A - 0 0 0 -38,-1.5 -38,-0.4 -2,-0.4 -25,-0.1 -0.784 10.9-160.3-136.8 87.6 5.5 -6.0 -18.1 62 64 A P - 0 0 4 0, 0.0 -25,-0.6 0, 0.0 2,-0.6 -0.317 16.2-131.7 -69.4 149.2 7.8 -5.6 -21.1 63 65 A D - 0 0 3 -42,-2.1 4,-0.2 -27,-0.1 -42,-0.2 -0.923 36.2-114.3 -97.9 116.9 7.7 -7.8 -24.2 64 66 A L > - 0 0 8 -2,-0.6 3,-1.7 1,-0.1 6,-0.3 0.014 43.1 -81.4 -50.5 157.3 11.2 -8.9 -24.9 65 67 A I T 3 S+ 0 0 1 1,-0.3 -1,-0.1 17,-0.1 7,-0.1 -0.290 118.9 12.9 -62.3 142.5 12.9 -7.7 -28.1 66 68 A G T 3 S+ 0 0 2 5,-2.0 2,-0.4 1,-0.2 -1,-0.3 0.391 116.7 106.3 70.3 -7.6 11.9 -9.6 -31.2 67 69 A M S X S- 0 0 0 -3,-1.7 3,-1.6 -4,-0.2 2,-0.2 -0.832 79.0 -26.0-114.9 143.4 9.3 -11.0 -29.0 68 70 A G T 3 S- 0 0 4 -2,-0.4 -26,-0.1 1,-0.2 -3,-0.0 -0.451 123.7 -16.5 69.6-130.7 5.5 -10.5 -28.7 69 71 A K T 3 S+ 0 0 85 -2,-0.2 -1,-0.2 -48,-0.0 3,-0.1 0.352 111.3 104.9 -94.8 5.9 4.2 -7.2 -29.9 70 72 A S S < S- 0 0 8 -3,-1.6 -50,-0.2 -6,-0.3 2,-0.2 0.028 83.9 -79.7 -65.7-173.6 7.6 -5.6 -29.8 71 73 A D - 0 0 45 -52,-2.0 -5,-2.0 -50,-0.0 -4,-0.2 -0.574 30.7-132.6 -89.5 156.9 9.6 -4.9 -33.0 72 74 A K - 0 0 69 -2,-0.2 3,-0.1 -7,-0.1 -7,-0.0 -0.428 26.3-170.3-107.5 59.0 11.5 -7.6 -34.8 73 75 A P - 0 0 13 0, 0.0 2,-1.0 0, 0.0 -55,-0.0 -0.114 38.0-104.2 -53.0 150.1 14.8 -5.8 -35.3 74 76 A D S S+ 0 0 166 2,-0.0 2,-0.3 3,-0.0 -2,-0.0 -0.692 72.8 123.0 -86.5 104.7 16.8 -8.1 -37.6 75 77 A L S S- 0 0 42 -2,-1.0 134,-0.0 -3,-0.1 0, 0.0 -0.974 72.7-105.2-152.6 166.3 19.3 -9.8 -35.3 76 78 A D - 0 0 91 -2,-0.3 137,-0.2 1,-0.0 -1,-0.1 0.798 48.3-135.7 -65.3 -29.2 20.6 -13.2 -34.1 77 79 A Y + 0 0 14 136,-0.1 -1,-0.0 -3,-0.0 -3,-0.0 0.930 38.0 169.0 68.6 48.2 18.9 -12.7 -30.7 78 80 A F - 0 0 73 1,-0.1 4,-0.4 139,-0.0 139,-0.1 0.242 52.3 -93.8 -58.4-159.8 21.7 -13.9 -28.6 79 81 A F S > S+ 0 0 1 2,-0.2 4,-2.5 3,-0.1 5,-0.1 0.696 124.1 56.1 -95.5 -24.8 21.4 -13.3 -24.8 80 82 A D H > S+ 0 0 81 1,-0.2 4,-3.1 2,-0.2 5,-0.1 0.836 98.4 62.3 -77.5 -30.2 23.4 -10.0 -24.9 81 83 A D H > S+ 0 0 16 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.868 110.8 39.8 -53.3 -42.1 20.9 -8.7 -27.4 82 84 A H H > S+ 0 0 1 -4,-0.4 4,-2.8 2,-0.2 5,-0.3 0.946 111.6 54.9 -77.8 -51.9 18.2 -9.1 -24.8 83 85 A V H X S+ 0 0 8 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.897 111.9 48.3 -37.3 -50.3 20.4 -7.9 -21.9 84 86 A R H X S+ 0 0 107 -4,-3.1 4,-1.5 1,-0.2 -2,-0.2 0.978 110.7 47.3 -60.4 -58.4 20.9 -4.8 -24.1 85 87 A Y H X S+ 0 0 17 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.802 113.5 47.4 -60.9 -35.1 17.3 -4.1 -25.0 86 88 A L H >X S+ 0 0 4 -4,-2.8 4,-2.5 2,-0.2 3,-0.9 0.995 109.0 52.8 -62.1 -62.8 16.0 -4.5 -21.4 87 89 A D H 3X S+ 0 0 41 -4,-1.9 4,-1.2 1,-0.3 -2,-0.2 0.723 112.5 47.1 -46.3 -28.4 18.7 -2.3 -19.9 88 90 A A H 3X S+ 0 0 23 -4,-1.5 4,-2.6 2,-0.2 -1,-0.3 0.858 112.4 48.7 -84.0 -41.5 17.8 0.4 -22.4 89 91 A F H S+ 0 0 3 -4,-2.5 5,-1.9 1,-0.3 -2,-0.2 0.902 116.1 39.6 -45.4 -48.3 14.5 0.2 -18.0 91 93 A E H ><5S+ 0 0 100 -4,-1.2 3,-1.5 -5,-0.3 -1,-0.3 0.887 111.8 58.8 -70.2 -38.0 16.4 3.5 -18.5 92 94 A A H 3<5S+ 0 0 47 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.929 108.8 42.9 -56.3 -45.6 13.9 4.5 -21.1 93 95 A L T 3<5S- 0 0 32 -4,-3.8 -1,-0.3 2,-0.1 -2,-0.2 0.497 108.1-135.6 -75.0 1.1 11.1 4.1 -18.5 94 96 A G T < 5 + 0 0 47 -3,-1.5 2,-0.4 -5,-0.3 -3,-0.2 0.799 43.3 165.3 45.3 34.5 13.5 6.0 -16.2 95 97 A L < - 0 0 9 -5,-1.9 -1,-0.2 1,-0.1 3,-0.1 -0.682 17.2-173.7 -84.7 137.1 12.6 3.5 -13.4 96 98 A E + 0 0 148 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.900 62.4 15.6 -94.6 -89.4 15.1 3.7 -10.5 97 99 A E S S+ 0 0 93 24,-0.1 -1,-0.3 25,-0.0 2,-0.3 -0.690 75.1 179.3 -87.9 145.8 14.5 0.9 -7.9 98 100 A V E - e 0 121B 2 22,-3.1 24,-4.2 -2,-0.3 25,-0.7 -0.911 32.6-131.6-135.6 161.2 12.3 -2.1 -8.7 99 101 A V E -de 33 123B 0 -67,-2.3 -65,-2.4 -2,-0.3 2,-0.5 -0.913 36.4-139.4-101.5 147.3 10.8 -5.3 -7.4 100 102 A L E -de 34 124B 2 23,-2.8 25,-3.3 -2,-0.4 2,-0.6 -0.931 23.8-177.6-119.5 124.4 11.3 -8.1 -9.9 101 103 A V E +de 35 125B 0 -67,-2.8 -65,-1.8 -2,-0.5 2,-0.4 -0.941 27.1 171.3-115.2 106.7 8.9 -10.8 -10.9 102 104 A I E -de 36 126B 0 23,-2.0 25,-1.0 -2,-0.6 -65,-0.2 -0.937 15.6-172.6-132.0 139.4 10.7 -13.0 -13.4 103 105 A H > - 0 0 0 -67,-1.8 4,-0.9 -2,-0.4 27,-0.4 0.113 52.2 -29.6-107.0-145.6 10.1 -16.3 -15.1 104 106 A D H >> S- 0 0 16 2,-0.2 3,-2.1 1,-0.2 26,-0.8 0.836 133.0 -4.6 -42.2-109.7 12.0 -18.8 -17.3 105 107 A W H 3> S+ 0 0 3 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.635 128.3 75.1 -60.6 -14.6 14.6 -16.9 -19.5 106 108 A G H 3> S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.589 90.8 55.1 -70.2 -11.9 13.1 -13.8 -18.0 107 109 A S H < S+ 0 0 0 -4,-1.7 3,-1.1 -5,-0.3 6,-0.2 0.919 106.1 54.1 -77.7 -44.3 20.0 -7.3 -10.4 115 117 A K H 3< S+ 0 0 72 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.779 117.0 40.9 -59.8 -27.5 23.6 -8.7 -9.9 116 118 A R T 3< S+ 0 0 86 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.510 126.6 34.1 -91.8 -10.6 24.7 -5.6 -11.8 117 119 A N S X> S+ 0 0 29 -3,-1.1 3,-1.8 -4,-0.3 4,-0.5 -0.247 71.6 154.7-143.0 47.3 22.3 -3.3 -10.1 118 120 A P G >4 S+ 0 0 57 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.850 72.1 51.5 -49.1 -53.8 22.0 -4.6 -6.5 119 121 A E G 34 S+ 0 0 137 1,-0.3 3,-0.1 -22,-0.0 -5,-0.0 0.260 107.7 57.9 -76.2 15.6 21.0 -1.4 -4.7 120 122 A R G <4 S+ 0 0 40 -3,-1.8 -22,-3.1 -6,-0.2 2,-0.9 0.520 85.4 85.0-117.8 -14.1 18.2 -1.0 -7.3 121 123 A V E << +e 98 0B 11 -3,-1.7 -22,-0.2 -4,-0.5 3,-0.1 -0.798 48.8 178.2 -95.3 104.7 16.5 -4.3 -6.7 122 124 A K E - 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