==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-SEP-12 4B9A . COMPND 2 MOLECULE: PROBABLE EPOXIDE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA PAO1; . AUTHOR J.W.SCHMIDBERGER,R.SCHNELL,G.SCHNEIDER . 298 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12788.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 33 11.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 5.0 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 . 1 0.3 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 . 20 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 109 36.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 2 2 3 0 1 0 0 1 3 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 T 0 0 187 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -16.8 12.2 60.9 11.9 2 4 A D - 0 0 139 1,-0.1 3,-0.0 4,-0.0 2,-0.0 -0.688 360.0-110.1 -73.5 142.0 11.3 59.0 15.2 3 5 A P - 0 0 90 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.369 33.6-100.2 -65.5 159.0 14.3 58.2 17.3 4 6 A L S S- 0 0 49 1,-0.2 4,-0.2 -2,-0.0 42,-0.1 -0.674 94.1 -15.2 -81.6 127.9 15.6 54.7 17.7 5 7 A L S > S- 0 0 6 -2,-0.5 3,-2.0 40,-0.3 -1,-0.2 0.896 81.2-151.0 46.9 58.6 14.5 53.0 20.9 6 8 A P T 3 S+ 0 0 59 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.300 75.5 7.5 -59.0 131.0 13.4 56.1 22.8 7 9 A G T 3 S+ 0 0 65 1,-0.3 2,-0.3 18,-0.0 19,-0.2 0.459 89.2 143.0 77.8 5.2 13.8 55.7 26.5 8 10 A F < - 0 0 18 -3,-2.0 2,-0.6 -4,-0.2 -1,-0.3 -0.590 44.8-138.5 -79.6 134.0 15.7 52.4 26.3 9 11 A D E -A 24 0A 102 15,-2.9 15,-2.2 -2,-0.3 2,-0.5 -0.868 14.5-140.5 -96.4 121.2 18.4 51.9 28.9 10 12 A Y E +A 23 0A 81 -2,-0.6 2,-0.3 13,-0.2 13,-0.2 -0.721 26.7 175.4 -91.1 126.2 21.5 50.3 27.6 11 13 A L E -A 22 0A 45 11,-3.0 11,-2.3 -2,-0.5 2,-0.5 -0.875 27.8-145.6-126.6 154.7 23.3 47.8 29.8 12 14 A T E -A 21 0A 43 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.983 23.1-156.3-121.3 112.7 26.2 45.4 29.6 13 15 A L E -A 20 0A 16 7,-2.9 7,-2.8 -2,-0.5 2,-0.7 -0.762 7.5-147.7 -93.3 137.7 25.6 42.2 31.6 14 16 A H E +A 19 0A 127 -2,-0.4 5,-0.2 5,-0.2 2,-0.2 -0.913 29.2 173.4-106.6 104.7 28.4 40.1 32.9 15 17 A T - 0 0 12 3,-2.7 3,-0.2 -2,-0.7 71,-0.1 -0.461 48.4 -88.6-109.3 178.1 27.2 36.5 32.9 16 18 A S S S+ 0 0 90 1,-0.2 3,-0.1 -2,-0.2 70,-0.0 0.856 122.0 10.7 -58.4 -34.5 29.0 33.3 33.6 17 19 A A S S+ 0 0 33 65,-0.1 54,-2.4 1,-0.1 55,-0.5 0.293 125.3 38.3-128.2 6.0 30.2 32.8 30.1 18 20 A A E - B 0 70A 0 52,-0.3 -3,-2.7 -3,-0.2 2,-0.5 -0.979 59.3-131.0-157.2 161.1 29.5 36.0 28.2 19 21 A R E -AB 14 69A 92 50,-2.8 50,-2.6 -2,-0.3 2,-0.4 -0.993 41.8-163.5-116.5 114.3 29.3 39.8 28.2 20 22 A L E -A 13 0A 2 -7,-2.8 -7,-2.9 -2,-0.5 2,-0.5 -0.890 19.1-139.1-115.7 134.6 25.9 40.7 26.8 21 23 A R E +A 12 0A 54 -2,-0.4 40,-2.3 40,-0.2 2,-0.3 -0.765 32.0 173.8 -89.7 125.6 24.5 43.9 25.4 22 24 A V E -AC 11 60A 0 -11,-2.3 -11,-3.0 -2,-0.5 2,-0.4 -0.943 20.1-162.0-130.7 147.8 21.0 44.4 26.6 23 25 A A E -AC 10 59A 0 36,-2.5 36,-2.9 -2,-0.3 2,-0.3 -0.998 17.9-172.3-134.5 130.8 18.5 47.4 26.2 24 26 A V E +AC 9 58A 29 -15,-2.2 -15,-2.9 -2,-0.4 2,-0.3 -0.930 14.4 156.7-128.3 151.4 15.5 47.6 28.5 25 27 A K E + C 0 57A 76 32,-2.1 32,-3.2 -2,-0.3 -17,-0.1 -0.953 37.7 30.2-163.5 146.3 12.4 49.7 28.9 26 28 A G - 0 0 44 -2,-0.3 2,-0.3 30,-0.2 30,-0.3 -0.301 58.1-103.9 106.4 176.2 8.9 49.5 30.5 27 29 A S + 0 0 90 25,-0.4 30,-0.0 28,-0.4 -2,-0.0 -0.943 67.2 53.0-142.1 163.6 7.1 47.9 33.4 28 30 A G S S+ 0 0 41 -2,-0.3 27,-0.2 27,-0.2 28,-0.1 -0.696 96.5 2.6 104.4-165.3 4.7 45.0 33.7 29 31 A P S S- 0 0 51 0, 0.0 27,-2.0 0, 0.0 2,-0.3 -0.271 84.3-107.4 -59.1 143.6 5.1 41.4 32.6 30 32 A P E -d 56 0A 18 0, 0.0 70,-2.5 0, 0.0 2,-0.4 -0.540 32.0-174.1 -84.7 140.8 8.5 40.7 31.0 31 33 A L E -de 57 100A 0 25,-3.0 27,-2.7 -2,-0.3 2,-0.5 -0.987 9.3-158.1-125.5 132.4 9.1 40.1 27.4 32 34 A L E -de 58 101A 0 68,-2.6 70,-3.0 -2,-0.4 2,-0.5 -0.953 9.9-160.6-111.7 121.7 12.5 39.0 26.0 33 35 A L E -de 59 102A 0 25,-2.6 27,-1.3 -2,-0.5 2,-0.5 -0.928 4.5-165.9-110.1 124.8 13.0 39.8 22.2 34 36 A L E -de 60 103A 0 68,-2.5 70,-2.4 -2,-0.5 73,-0.2 -0.949 6.2-152.7-121.9 112.5 15.7 37.9 20.4 35 37 A H - 0 0 0 25,-0.6 72,-0.3 -2,-0.5 2,-0.1 -0.069 11.8-140.5 -70.5 175.7 16.9 39.1 16.9 36 38 A G > - 0 0 0 4,-0.2 3,-2.0 70,-0.2 69,-0.1 -0.410 38.1 -10.4-124.6-160.4 18.4 36.9 14.2 37 39 A Y T 3 S+ 0 0 1 1,-0.3 3,-0.1 -2,-0.1 -1,-0.1 -0.658 117.1 0.9 -89.4 142.6 21.1 36.8 11.5 38 40 A P T 3 S+ 0 0 3 0, 0.0 -1,-0.3 0, 0.0 161,-0.1 -0.433 118.7 77.1-101.2 58.2 22.9 38.9 10.4 39 41 A Q < - 0 0 1 -3,-2.0 27,-0.3 159,-0.1 2,-0.3 -0.178 58.6-135.0-118.5-162.8 21.4 41.5 12.8 40 42 A T > - 0 0 1 25,-0.1 3,-2.2 -3,-0.1 -4,-0.2 -0.837 51.9 -70.8-146.8-177.6 21.3 42.8 16.3 41 43 A H G > S+ 0 0 3 1,-0.3 3,-2.0 -2,-0.3 20,-0.1 0.719 117.7 78.4 -60.1 -18.1 18.7 43.9 18.8 42 44 A L G > S+ 0 0 13 1,-0.3 3,-2.2 2,-0.2 -1,-0.3 0.692 71.3 81.5 -66.4 -15.6 18.1 47.0 16.7 43 45 A A G < S+ 0 0 0 -3,-2.2 3,-0.4 1,-0.3 -1,-0.3 0.726 87.7 58.0 -58.4 -22.5 16.0 44.8 14.4 44 46 A W G X> S+ 0 0 0 -3,-2.0 4,-3.1 1,-0.2 3,-2.0 0.310 70.4 112.6 -88.4 11.1 13.2 45.3 17.0 45 47 A H T <4 S+ 0 0 19 -3,-2.2 -40,-0.3 1,-0.3 -1,-0.2 0.722 78.0 46.9 -63.2 -24.9 13.2 49.1 16.7 46 48 A R T 34 S+ 0 0 86 -3,-0.4 -1,-0.3 229,-0.2 4,-0.1 0.514 123.8 32.3 -88.4 -7.9 9.7 49.3 15.1 47 49 A I T <> S+ 0 0 0 -3,-2.0 4,-1.9 2,-0.1 -2,-0.2 0.738 104.2 65.5-115.3 -47.3 8.2 46.9 17.6 48 50 A A H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 5,-0.2 0.852 96.1 56.9 -58.1 -41.6 9.9 47.2 21.0 49 51 A P H > S+ 0 0 34 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.955 109.1 46.3 -59.5 -43.4 8.7 50.8 21.8 50 52 A R H >4 S+ 0 0 83 1,-0.2 3,-1.4 2,-0.2 4,-0.4 0.924 112.4 50.4 -61.5 -45.8 5.0 49.9 21.4 51 53 A L H >X S+ 0 0 0 -4,-1.9 4,-1.9 1,-0.3 3,-1.8 0.873 101.6 62.4 -59.7 -36.6 5.5 46.8 23.5 52 54 A A H 3< S+ 0 0 6 -4,-2.3 -25,-0.4 1,-0.3 -1,-0.3 0.594 87.8 72.5 -71.7 -7.0 7.2 48.8 26.3 53 55 A E T << S+ 0 0 130 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.769 119.0 15.0 -68.5 -24.3 4.0 50.9 26.8 54 56 A D T <4 S+ 0 0 85 -3,-1.8 2,-0.3 -4,-0.4 -2,-0.2 0.554 125.9 42.2-128.7 -10.4 2.5 47.8 28.4 55 57 A Y S < S- 0 0 25 -4,-1.9 2,-0.7 -27,-0.2 -28,-0.4 -0.839 81.3 -99.7-138.3 161.6 5.3 45.4 29.3 56 58 A S E - d 0 30A 14 -27,-2.0 -25,-3.0 -30,-0.3 2,-0.5 -0.847 48.3-158.6 -78.8 111.4 8.8 45.1 30.6 57 59 A V E -Cd 25 31A 1 -32,-3.2 -32,-2.1 -2,-0.7 2,-0.5 -0.861 16.0-176.2-107.6 128.3 10.8 44.8 27.4 58 60 A V E -Cd 24 32A 3 -27,-2.7 -25,-2.6 -2,-0.5 2,-0.4 -0.983 3.1-171.5-122.7 122.4 14.3 43.3 27.3 59 61 A L E -Cd 23 33A 0 -36,-2.9 -36,-2.5 -2,-0.5 2,-0.3 -0.905 11.5-176.7-110.3 135.0 16.2 43.4 24.0 60 62 A A E -Cd 22 34A 1 -27,-1.3 -25,-0.6 -2,-0.4 2,-0.5 -0.991 28.9-127.7-133.8 147.0 19.5 41.4 23.8 61 63 A D - 0 0 2 -40,-2.3 -40,-0.2 -2,-0.3 3,-0.1 -0.800 42.4-114.2 -83.5 129.4 22.3 40.8 21.3 62 64 A L > - 0 0 0 -2,-0.5 3,-2.7 1,-0.2 6,-0.3 -0.358 48.5 -73.9 -60.3 151.2 22.8 37.1 20.9 63 65 A R T 3 S+ 0 0 15 1,-0.3 6,-0.2 6,-0.1 -1,-0.2 -0.194 122.7 7.8 -50.5 122.8 26.1 35.7 22.2 64 66 A G T 3 S+ 0 0 5 4,-0.4 143,-0.3 1,-0.4 -1,-0.3 0.174 109.6 101.3 89.0 -19.0 28.7 36.8 19.6 65 67 A Y S X S- 0 0 1 -3,-2.7 3,-2.3 142,-0.1 -1,-0.4 -0.652 89.2 -18.4 -91.3 157.4 26.4 39.0 17.6 66 68 A G T 3 S- 0 0 12 -27,-0.3 -26,-0.1 1,-0.3 138,-0.1 -0.282 131.6 -21.5 52.2-126.0 26.3 42.8 17.8 67 69 A E T 3 S+ 0 0 96 -46,-0.1 2,-0.3 2,-0.0 -1,-0.3 0.322 111.7 104.0-100.4 4.4 28.0 43.9 21.0 68 70 A S < + 0 0 3 -3,-2.3 -4,-0.4 -6,-0.3 2,-0.4 -0.695 48.4 180.0 -86.9 139.2 27.6 40.6 22.9 69 71 A R E -B 19 0A 97 -50,-2.6 -50,-2.8 -2,-0.3 2,-0.2 -0.996 29.7-117.8-141.7 144.6 30.7 38.4 23.2 70 72 A A E -B 18 0A 5 -2,-0.4 -52,-0.3 -52,-0.2 6,-0.1 -0.496 21.5-135.3 -65.8 145.5 31.6 35.1 24.7 71 73 A L S S+ 0 0 79 -54,-2.4 2,-1.1 -2,-0.2 -53,-0.1 0.835 94.1 76.8 -71.9 -30.2 34.2 35.3 27.4 72 74 A D > - 0 0 73 -55,-0.5 4,-0.8 1,-0.2 -2,-0.2 -0.715 63.9-175.4 -83.9 102.9 36.0 32.3 25.8 73 75 A E T 4 S+ 0 0 162 -2,-1.1 -1,-0.2 1,-0.2 -2,-0.1 0.410 75.4 42.4 -84.7 2.1 37.6 34.0 23.0 74 76 A E T 4 S+ 0 0 182 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.743 129.1 3.4-112.3 -40.5 39.0 30.7 21.6 75 77 A G T 4 S+ 0 0 53 2,-0.0 -2,-0.1 0, 0.0 -3,-0.0 -0.096 76.0 165.8-148.3 38.4 36.5 27.9 21.8 76 78 A A < - 0 0 12 -4,-0.8 2,-0.6 1,-0.1 -6,-0.0 -0.151 41.0-111.1 -63.2 156.0 33.2 29.2 23.1 77 79 A D + 0 0 76 1,-0.1 -1,-0.1 2,-0.0 -5,-0.1 -0.787 34.4 173.9 -85.1 116.6 29.9 27.3 22.9 78 80 A Y + 0 0 25 -2,-0.6 136,-0.1 132,-0.2 -1,-0.1 0.063 33.0 131.7-111.2 24.8 27.5 29.0 20.4 79 81 A S S > S- 0 0 8 1,-0.1 4,-2.3 135,-0.1 3,-0.3 -0.309 72.1-112.1 -69.4 157.9 24.9 26.3 20.5 80 82 A K H > S+ 0 0 4 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.871 118.3 57.7 -58.9 -36.4 21.2 27.3 21.0 81 83 A A H > S+ 0 0 20 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.894 107.0 47.2 -62.6 -39.5 21.3 25.6 24.5 82 84 A A H > S+ 0 0 2 -3,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.928 113.1 47.8 -67.4 -43.2 24.2 27.8 25.6 83 85 A L H X S+ 0 0 5 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.841 107.6 57.3 -67.9 -28.9 22.5 30.9 24.3 84 86 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 -5,-0.2 3,-0.3 0.927 104.4 51.4 -65.4 -39.3 19.4 29.8 26.0 85 87 A R H X S+ 0 0 109 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.868 104.4 58.1 -62.8 -39.8 21.3 29.7 29.3 86 88 A D H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.878 105.3 50.7 -52.9 -40.3 22.5 33.3 28.5 87 89 A Q H X S+ 0 0 2 -4,-1.4 4,-2.7 -3,-0.3 5,-0.3 0.898 108.3 50.7 -68.6 -41.7 18.8 34.3 28.4 88 90 A L H X S+ 0 0 48 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.925 114.4 44.4 -55.7 -50.3 18.1 32.7 31.8 89 91 A E H X S+ 0 0 59 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.888 113.9 50.7 -65.1 -40.5 21.0 34.5 33.3 90 92 A T H X S+ 0 0 0 -4,-2.5 4,-1.6 -5,-0.2 -2,-0.2 0.967 114.6 41.7 -60.2 -54.9 20.1 37.8 31.6 91 93 A M H X>S+ 0 0 0 -4,-2.7 5,-2.8 1,-0.2 4,-0.7 0.926 114.6 53.0 -63.9 -39.3 16.5 37.8 32.7 92 94 A G H ><5S+ 0 0 25 -4,-2.6 3,-1.1 -5,-0.3 -1,-0.2 0.902 106.2 51.9 -60.3 -45.8 17.5 36.6 36.2 93 95 A Q H 3<5S+ 0 0 103 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.854 109.9 50.5 -57.9 -36.3 19.9 39.4 36.6 94 96 A L H 3<5S- 0 0 53 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.514 129.5 -94.0 -82.0 -4.9 17.1 41.9 35.7 95 97 A G T <<5S+ 0 0 60 -3,-1.1 2,-0.5 -4,-0.7 -3,-0.2 0.545 86.1 118.0 108.1 11.4 14.7 40.4 38.2 96 98 A F < + 0 0 49 -5,-2.8 -1,-0.2 -6,-0.1 -2,-0.2 -0.946 27.1 168.9-122.0 120.6 12.8 37.8 36.1 97 99 A E S S+ 0 0 153 -2,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.544 81.8 34.5 -94.1 -13.8 12.6 34.0 36.6 98 100 A R S S+ 0 0 96 -7,-0.1 2,-0.3 199,-0.1 -1,-0.2 -0.989 74.5 148.1-147.1 132.0 9.7 33.6 34.2 99 101 A F E - f 0 122A 2 22,-2.6 24,-2.3 -2,-0.3 25,-0.6 -0.978 44.3 -98.5-162.2 159.0 9.1 35.6 31.0 100 102 A A E -ef 31 124A 1 -70,-2.5 -68,-2.6 -2,-0.3 2,-0.4 -0.665 33.6-148.7 -84.2 151.7 7.7 35.5 27.5 101 103 A V E -ef 32 125A 1 23,-2.5 25,-2.6 -2,-0.3 2,-0.5 -0.984 13.2-174.8-128.3 127.6 10.1 35.1 24.6 102 104 A I E +ef 33 126A 0 -70,-3.0 -68,-2.5 -2,-0.4 2,-0.3 -0.987 17.4 178.5-121.8 117.3 9.6 36.6 21.1 103 105 A G E -ef 34 127A 0 23,-3.0 25,-2.6 -2,-0.5 2,-0.4 -0.908 19.4-162.1-123.9 152.2 12.2 35.5 18.6 104 106 A H E > - f 0 128A 0 -70,-2.4 3,-1.9 -2,-0.3 25,-0.2 -0.998 64.4 -36.2-127.8 132.4 13.0 36.1 14.9 105 107 A D T >> S+ 0 0 12 23,-1.7 3,-1.3 -2,-0.4 4,-1.2 -0.275 136.8 5.2 59.2-133.7 15.2 33.9 12.8 106 108 A R H 3> S+ 0 0 3 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.837 131.4 60.1 -56.9 -32.5 18.2 32.6 14.9 107 109 A G H <> S+ 0 0 0 -3,-1.9 4,-2.2 -72,-0.3 -1,-0.3 0.835 100.5 53.2 -61.9 -32.6 16.6 34.2 18.0 108 110 A A H <> S+ 0 0 0 -3,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.820 106.2 55.2 -69.8 -28.8 13.5 32.1 17.7 109 111 A R H X S+ 0 0 13 -4,-1.2 4,-1.5 -3,-0.2 -2,-0.2 0.887 109.3 45.7 -70.0 -43.7 15.9 29.1 17.6 110 112 A V H X S+ 0 0 1 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.931 113.4 53.5 -56.5 -45.7 17.4 30.2 20.9 111 113 A G H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.894 108.4 44.2 -60.9 -48.4 13.9 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4.7 14.4 41.7 2.4 182 184 A Q T < 5S- 0 0 115 -3,-1.4 -3,-0.2 -4,-0.3 -2,-0.1 0.847 71.5 -60.0 55.7 33.3 13.5 40.8 -1.2 183 185 A G T 3 - 0 0 34 -2,-0.7 4,-2.8 1,-0.2 5,-0.2 -0.428 24.4-125.1 -59.1 133.3 16.7 52.2 8.8 189 191 A P H > S+ 0 0 89 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.832 108.8 47.5 -61.5 -29.4 20.0 53.7 7.8 190 192 A Q H > S+ 0 0 122 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.876 110.1 49.9 -78.2 -37.0 21.2 54.0 11.3 191 193 A A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 3,-0.3 0.913 108.6 57.0 -59.1 -43.6 20.3 50.4 12.3 192 194 A L H X S+ 0 0 28 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.892 101.4 53.8 -54.7 -44.0 22.1 49.4 9.1 193 195 A E H X S+ 0 0 94 -4,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.843 108.5 51.4 -61.7 -33.4 25.3 51.1 10.3 194 196 A S H X S+ 0 0 35 -4,-1.3 4,-2.2 -3,-0.3 -2,-0.2 0.946 110.1 46.7 -67.6 -46.4 25.0 49.1 13.5 195 197 A Y H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.908 113.6 51.2 -59.9 -41.4 24.6 45.8 11.6 196 198 A R H X S+ 0 0 47 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.916 107.7 50.6 -61.6 -47.2 27.6 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