==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-FEB-09 3G9Z . COMPND 2 MOLECULE: ESTERASE/LIPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: UNCULTURED BACTERIUM; . AUTHOR K.Y.HWANG,K.H.NAM . 297 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12481.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 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 . 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 . 19 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 34.7 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 1 0 0 0 0 0 1 1 0 2 0 2 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 1 2 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 PARALLEL BRIDGES PER LADDER . 0 0 0 1 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 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 1 A M 0 0 236 0, 0.0 263,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 123.8 -28.2 -25.4 13.8 2 2 A A - 0 0 53 1,-0.1 263,-0.1 2,-0.1 262,-0.0 -0.030 360.0-122.0 -80.0 155.2 -26.1 -22.3 14.4 3 3 A G > - 0 0 22 1,-0.1 4,-1.2 4,-0.0 5,-0.1 -0.397 27.6-122.0 -79.5 155.9 -26.4 -18.5 14.4 4 4 A P H > S+ 0 0 91 0, 0.0 4,-3.3 0, 0.0 5,-0.2 0.815 108.4 60.9 -74.9 -24.0 -24.2 -16.4 12.1 5 5 A E H > S+ 0 0 86 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.951 105.6 44.2 -69.6 -47.0 -22.8 -14.4 15.0 6 6 A I H > S+ 0 0 1 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.833 115.5 51.1 -67.5 -25.0 -21.3 -17.5 16.7 7 7 A V H X S+ 0 0 85 -4,-1.2 4,-1.7 2,-0.2 -2,-0.2 0.925 110.9 45.2 -77.8 -46.5 -20.0 -18.7 13.3 8 8 A K H X S+ 0 0 121 -4,-3.3 4,-1.8 1,-0.2 -2,-0.2 0.862 114.9 53.0 -62.8 -30.9 -18.4 -15.4 12.4 9 9 A L H X S+ 0 0 10 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.928 105.6 49.8 -69.2 -46.7 -17.0 -15.5 16.0 10 10 A K H X S+ 0 0 29 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.914 110.7 50.6 -62.2 -39.0 -15.4 -18.9 15.8 11 11 A K H X S+ 0 0 126 -4,-1.7 4,-3.3 2,-0.2 5,-0.2 0.952 110.2 49.5 -63.1 -48.1 -13.6 -18.1 12.6 12 12 A I H X S+ 0 0 72 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.912 111.6 49.1 -57.8 -43.8 -12.2 -14.9 14.0 13 13 A L H X S+ 0 0 26 -4,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.896 113.3 46.7 -62.7 -41.8 -11.0 -16.8 17.1 14 14 A R H < S+ 0 0 120 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.908 115.3 46.9 -61.7 -45.8 -9.4 -19.5 14.9 15 15 A E H < S+ 0 0 137 -4,-3.3 -2,-0.2 1,-0.2 -3,-0.2 0.959 118.2 39.7 -60.9 -52.1 -7.8 -16.7 12.7 16 16 A K H < S+ 0 0 166 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.567 97.9 96.3 -82.2 -12.6 -6.5 -14.6 15.6 17 17 A A S < S- 0 0 53 -4,-1.3 176,-0.0 -5,-0.2 -4,-0.0 -0.470 82.0 -97.3 -86.0 153.9 -5.3 -17.5 17.9 18 18 A V - 0 0 85 -2,-0.2 3,-0.1 1,-0.1 -1,-0.1 -0.433 49.8 -98.8 -66.8 131.9 -1.9 -19.0 18.4 19 19 A P > - 0 0 84 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 -0.072 52.5 -84.2 -56.3 157.6 -1.3 -22.2 16.4 20 20 A P T 3 S+ 0 0 128 0, 0.0 3,-0.1 0, 0.0 175,-0.0 -0.214 108.2 18.5 -73.8 149.5 -1.6 -25.4 18.2 21 21 A G T 3 S+ 0 0 75 175,-0.3 2,-0.3 1,-0.3 176,-0.0 0.235 89.1 132.6 89.2 -13.8 1.2 -26.8 20.3 22 22 A T < - 0 0 73 -3,-1.4 2,-0.7 -4,-0.1 -1,-0.3 -0.559 50.3-138.9 -84.8 138.5 3.1 -23.5 20.4 23 23 A E - 0 0 157 -2,-0.3 -1,-0.1 -3,-0.1 175,-0.0 -0.841 17.6-166.7-108.1 107.2 4.4 -22.3 23.8 24 24 A V - 0 0 42 -2,-0.7 5,-0.1 1,-0.1 -6,-0.0 -0.690 28.8-103.5 -96.5 130.2 4.1 -18.6 24.6 25 25 A P > - 0 0 79 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 -0.102 29.6-122.2 -46.0 156.0 5.9 -16.8 27.5 26 26 A L H > S+ 0 0 17 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.932 111.7 49.6 -70.9 -45.5 3.7 -16.1 30.5 27 27 A D H > S+ 0 0 86 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.790 109.5 53.2 -71.4 -20.6 4.2 -12.4 30.5 28 28 A V H > S+ 0 0 77 2,-0.2 4,-2.6 3,-0.2 -1,-0.2 0.885 111.9 45.7 -71.0 -41.4 3.3 -12.3 26.8 29 29 A M H X S+ 0 0 51 -4,-1.7 4,-2.2 2,-0.2 5,-0.3 0.973 111.7 50.7 -65.8 -52.9 0.1 -14.1 27.5 30 30 A R H X S+ 0 0 56 -4,-3.1 4,-1.8 1,-0.2 -2,-0.2 0.900 116.0 43.0 -47.5 -46.4 -0.7 -11.9 30.4 31 31 A K H X S+ 0 0 134 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.856 109.7 56.8 -73.9 -35.6 -0.1 -8.8 28.2 32 32 A G H X S+ 0 0 37 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.932 110.3 43.9 -55.7 -49.2 -1.9 -10.3 25.2 33 33 A M H X S+ 0 0 52 -4,-2.2 4,-0.8 1,-0.3 -2,-0.2 0.862 113.4 51.4 -71.2 -40.2 -5.1 -10.7 27.3 34 34 A E H < S+ 0 0 66 -4,-1.8 3,-0.3 -5,-0.3 -1,-0.3 0.869 109.2 52.2 -53.7 -39.6 -4.8 -7.3 28.9 35 35 A K H < S+ 0 0 189 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.796 113.5 38.0 -91.2 -21.2 -4.4 -5.6 25.6 36 36 A V H < S+ 0 0 89 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.412 84.3 133.3 -99.2 -2.5 -7.5 -7.0 23.8 37 37 A A < - 0 0 28 -4,-0.8 2,-0.1 -3,-0.3 49,-0.1 -0.201 62.6-111.6 -41.9 129.9 -9.7 -6.8 26.9 38 38 A F - 0 0 78 47,-0.3 50,-0.5 234,-0.1 2,-0.4 -0.429 27.2-115.2 -67.4 147.5 -13.1 -5.3 26.1 39 39 A K - 0 0 204 -2,-0.1 3,-0.1 48,-0.1 -1,-0.1 -0.727 33.8-112.4 -81.3 129.0 -13.9 -1.8 27.5 40 40 A A - 0 0 21 -2,-0.4 48,-0.1 1,-0.1 49,-0.1 -0.248 45.2 -83.4 -58.6 148.7 -16.8 -1.8 30.0 41 41 A A > - 0 0 34 47,-0.3 3,-2.0 1,-0.1 -1,-0.1 -0.169 39.7-115.3 -56.8 149.6 -20.0 0.0 28.9 42 42 A D T 3 S+ 0 0 170 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.657 113.8 60.1 -70.0 -13.3 -19.9 3.7 29.5 43 43 A D T 3 S+ 0 0 81 2,-0.1 2,-0.5 19,-0.0 -1,-0.3 0.356 83.6 99.3-101.4 9.4 -22.7 3.5 32.0 44 44 A I < - 0 0 18 -3,-2.0 2,-0.4 17,-0.1 17,-0.2 -0.797 60.2-156.8 -88.0 128.0 -20.7 1.1 34.3 45 45 A Q E -A 60 0A 138 15,-3.1 15,-3.4 -2,-0.5 2,-0.3 -0.870 6.1-162.3-122.7 153.7 -19.0 2.7 37.3 46 46 A V E -A 59 0A 54 -2,-0.4 2,-0.4 13,-0.2 13,-0.2 -0.886 9.7-167.5-135.7 148.7 -16.2 1.5 39.2 47 47 A E E -A 58 0A 83 11,-1.2 11,-2.0 -2,-0.3 2,-0.3 -0.984 23.1-129.2-142.7 122.1 -14.6 2.2 42.5 48 48 A Q E +A 57 0A 163 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.565 36.8 158.2 -79.6 137.0 -11.2 1.0 43.6 49 49 A V E -A 56 0A 33 7,-2.3 7,-2.4 -2,-0.3 2,-0.5 -0.962 36.3-126.8-141.1 160.0 -10.9 -0.8 47.0 50 50 A T E -A 55 0A 112 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.957 25.6-171.4-112.2 133.1 -8.4 -3.1 48.6 51 51 A V E > -A 54 0A 0 3,-3.0 3,-2.8 -2,-0.5 73,-0.2 -0.973 67.0 -21.2-126.8 122.2 -9.8 -6.4 49.9 52 52 A A T 3 S- 0 0 46 -2,-0.4 -1,-0.1 1,-0.3 72,-0.1 0.926 129.3 -48.4 49.0 47.4 -7.8 -8.9 52.0 53 53 A G T 3 S+ 0 0 82 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.387 119.4 108.9 74.2 -4.6 -4.6 -7.5 50.7 54 54 A C E < S-A 51 0A 9 -3,-2.8 -3,-3.0 66,-0.1 -1,-0.2 -0.793 73.2-112.9-103.6 148.9 -5.8 -7.6 47.0 55 55 A A E +A 50 0A 51 50,-0.4 50,-3.3 -2,-0.3 2,-0.3 -0.494 46.5 167.6 -63.2 141.5 -6.7 -4.8 44.6 56 56 A A E -AB 49 104A 2 -7,-2.4 -7,-2.3 48,-0.2 2,-0.4 -0.967 25.8-143.7-145.1 163.8 -10.4 -4.9 43.7 57 57 A E E -AB 48 103A 8 46,-1.7 46,-3.2 -2,-0.3 2,-0.6 -0.992 16.3-134.8-122.3 143.5 -13.2 -2.9 42.1 58 58 A W E -AB 47 102A 20 -11,-2.0 -11,-1.2 -2,-0.4 2,-0.6 -0.854 27.5-155.6 -79.3 122.5 -16.7 -2.5 42.9 59 59 A V E -AB 46 101A 0 42,-3.1 42,-2.1 -2,-0.6 2,-0.6 -0.913 14.0-175.2-108.2 109.3 -18.3 -2.8 39.5 60 60 A R E -A 45 0A 70 -15,-3.4 -15,-3.1 -2,-0.6 40,-0.1 -0.923 10.2-173.8-119.4 114.3 -21.8 -1.1 39.5 61 61 A A > - 0 0 7 -2,-0.6 3,-0.8 -17,-0.2 -17,-0.1 -0.384 47.2 -82.2 -80.6 172.0 -24.1 -1.1 36.5 62 62 A P T 3 S+ 0 0 65 0, 0.0 36,-0.2 0, 0.0 -1,-0.2 -0.455 114.2 44.8 -67.3 159.8 -27.3 1.0 36.7 63 63 A G T 3 S+ 0 0 51 1,-0.2 2,-0.2 -2,-0.1 37,-0.0 0.450 74.4 164.9 89.3 5.5 -30.1 -0.6 38.7 64 64 A C < - 0 0 39 -3,-0.8 2,-0.5 1,-0.1 35,-0.3 -0.336 32.9-134.6 -69.7 125.8 -28.0 -1.9 41.5 65 65 A Q > - 0 0 98 33,-3.9 3,-1.4 -2,-0.2 35,-0.4 -0.646 22.7-115.3 -74.5 122.8 -30.1 -2.9 44.5 66 66 A A T 3 S+ 0 0 85 -2,-0.5 3,-0.1 1,-0.2 -1,-0.1 -0.352 98.1 24.7 -47.1 130.1 -28.8 -1.6 47.9 67 67 A G T 3 S+ 0 0 41 1,-0.3 67,-0.4 -2,-0.0 2,-0.4 0.209 98.5 105.5 95.3 -14.5 -27.6 -4.5 50.2 68 68 A K < + 0 0 46 -3,-1.4 32,-0.7 30,-0.1 -1,-0.3 -0.777 41.3 170.2 -95.4 147.3 -26.8 -7.0 47.5 69 69 A A E -cd 100 138A 0 68,-1.6 70,-1.0 -2,-0.4 2,-0.4 -0.992 22.2-150.4-148.2 155.2 -23.4 -8.0 46.3 70 70 A I E -cd 101 139A 0 30,-1.7 32,-3.7 -2,-0.3 2,-0.6 -0.999 15.7-142.1-118.3 127.9 -21.7 -10.6 44.0 71 71 A L E -cd 102 140A 0 68,-2.7 70,-2.7 -2,-0.4 2,-0.5 -0.809 26.2-159.7 -81.5 116.4 -18.1 -11.8 44.7 72 72 A Y E -cd 103 141A 0 30,-3.4 32,-1.5 -2,-0.6 2,-0.5 -0.913 13.7-169.2-107.1 137.1 -16.7 -12.2 41.2 73 73 A L E - d 0 142A 0 68,-2.1 70,-1.1 -2,-0.5 77,-0.2 -0.974 20.4-140.4-129.2 110.1 -13.6 -14.4 40.5 74 74 A H - 0 0 0 -2,-0.5 4,-0.2 30,-0.5 75,-0.1 -0.186 12.0-116.7 -77.3 162.6 -12.2 -13.9 37.1 75 75 A G + 0 0 0 70,-0.2 69,-0.2 71,-0.1 -1,-0.1 -0.254 53.6 123.1 -90.8-176.5 -10.8 -16.5 34.7 76 76 A G S >> S- 0 0 10 -2,-0.1 3,-2.0 5,-0.1 4,-1.8 0.619 87.4 -80.1 125.9 25.3 -7.4 -16.9 33.3 77 77 A G T 34 S- 0 0 1 1,-0.3 129,-0.2 2,-0.2 -2,-0.1 0.571 77.2 -79.5 68.9 11.4 -6.0 -20.4 34.1 78 78 A Y T 34 S+ 0 0 1 2,-0.3 31,-2.7 -4,-0.2 -1,-0.3 0.517 131.4 74.6 64.4 10.3 -5.1 -19.2 37.7 79 79 A V T <4 S+ 0 0 1 -3,-2.0 2,-0.2 29,-0.2 -2,-0.2 0.391 100.2 13.9-129.3 -9.0 -2.0 -17.5 36.1 80 80 A M S < S+ 0 0 37 -4,-1.8 -2,-0.3 -51,-0.1 29,-0.1 -0.863 71.2 86.5-150.7-167.9 -3.4 -14.5 34.3 81 81 A G - 0 0 9 -2,-0.2 2,-0.3 -51,-0.2 -5,-0.1 -0.038 44.2-163.6 91.8 158.3 -6.4 -12.2 33.9 82 82 A S > - 0 0 17 1,-0.1 4,-1.3 23,-0.0 -7,-0.1 -0.920 42.0 -78.0-161.2-179.0 -7.1 -9.2 36.0 83 83 A I H >> S+ 0 0 19 -2,-0.3 4,-1.5 1,-0.2 3,-0.5 0.939 129.3 53.5 -50.7 -48.7 -9.8 -6.6 37.0 84 84 A N H 34 S+ 0 0 65 1,-0.2 4,-0.4 2,-0.2 3,-0.2 0.873 105.2 50.0 -60.9 -42.9 -9.1 -5.0 33.7 85 85 A T H 34 S+ 0 0 19 1,-0.2 -47,-0.3 2,-0.1 4,-0.2 0.772 122.0 33.6 -69.4 -24.4 -9.7 -8.1 31.6 86 86 A H H S+ 0 0 6 -50,-0.5 4,-1.8 -4,-0.4 -47,-0.3 0.972 112.7 36.9 -62.9 -57.6 -16.7 -5.5 30.9 89 89 A M H > S+ 0 0 7 -4,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.826 117.1 52.8 -62.4 -37.3 -18.5 -8.9 31.4 90 90 A V H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.916 106.0 55.7 -68.3 -33.9 -18.8 -8.3 35.2 91 91 A G H X S+ 0 0 0 -4,-2.2 4,-1.8 -5,-0.3 -2,-0.2 0.947 109.4 45.6 -56.9 -52.3 -20.4 -4.9 34.4 92 92 A E H X S+ 0 0 34 -4,-1.8 4,-2.6 1,-0.2 5,-0.3 0.911 111.6 51.8 -62.3 -36.4 -23.0 -6.7 32.3 93 93 A I H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 6,-0.3 0.901 108.1 51.6 -66.2 -37.7 -23.5 -9.3 35.0 94 94 A S H X>S+ 0 0 0 -4,-2.9 4,-1.3 2,-0.2 5,-1.1 0.907 110.0 51.4 -63.3 -35.3 -24.0 -6.5 37.5 95 95 A R H ><5S+ 0 0 76 -4,-1.8 3,-0.6 2,-0.2 -2,-0.2 0.964 113.5 41.5 -64.1 -55.4 -26.6 -5.1 35.0 96 96 A A H 3<5S+ 0 0 14 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.848 120.6 43.7 -63.6 -35.7 -28.6 -8.4 34.6 97 97 A S H 3<5S- 0 0 1 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.619 96.6-137.0 -88.1 -14.2 -28.4 -9.2 38.3 98 98 A Q T <<5S+ 0 0 81 -4,-1.3 -33,-3.9 -3,-0.6 2,-0.4 0.796 70.0 111.2 59.7 27.2 -29.2 -5.6 39.5 99 99 A A S - 0 0 25 -29,-0.1 4,-1.8 -3,-0.1 -29,-0.2 -0.755 16.6 -96.6-107.1 143.7 -1.9 -15.4 40.6 109 109 A A T 4 S+ 0 0 0 -31,-2.7 97,-0.2 -2,-0.3 96,-0.1 -0.519 94.5 38.8 -78.0 160.5 0.5 -18.3 40.0 110 110 A P T 4 S+ 0 0 57 0, 0.0 -1,-0.2 0, 0.0 -31,-0.1 -0.995 127.3 42.3 -79.8 -5.0 3.3 -19.0 39.4 111 111 A E T 4 S+ 0 0 107 1,-0.3 -2,-0.3 -3,-0.2 -32,-0.1 0.870 134.7 22.2 -67.2 -33.0 4.3 -16.2 41.8 112 112 A H S < S- 0 0 83 -4,-1.8 -1,-0.3 3,-0.0 5,-0.3 -0.872 88.7-166.6-129.9 94.2 1.6 -17.3 44.2 113 113 A P > - 0 0 42 0, 0.0 3,-2.2 0, 0.0 94,-0.2 -0.306 39.0 -27.8 -78.9 174.0 0.7 -21.0 43.6 114 114 A F T 3 S+ 0 0 24 92,-3.1 96,-0.1 1,-0.3 103,-0.1 -0.235 122.0 32.4 -42.2 143.5 -2.3 -22.9 44.9 115 115 A P T >> S+ 0 0 51 0, 0.0 4,-2.7 0, 0.0 3,-0.7 -0.893 99.7 84.9 -88.1 15.4 -3.9 -22.4 47.6 116 116 A A H <> S+ 0 0 5 -3,-2.2 4,-2.4 1,-0.3 -9,-0.2 0.906 90.2 49.2 -52.8 -51.4 -3.3 -18.6 47.3 117 117 A A H 3> S+ 0 0 1 -5,-0.3 4,-2.4 1,-0.2 -1,-0.3 0.866 113.6 48.4 -53.8 -37.6 -6.2 -17.9 45.0 118 118 A V H <> S+ 0 0 2 -3,-0.7 4,-2.9 2,-0.2 5,-0.3 0.921 108.8 52.9 -70.7 -40.2 -8.5 -19.8 47.4 119 119 A E H X S+ 0 0 104 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.930 112.8 45.1 -64.1 -39.9 -7.2 -18.0 50.5 120 120 A D H X S+ 0 0 10 -4,-2.4 4,-3.0 2,-0.2 -1,-0.2 0.887 111.8 50.6 -67.5 -46.3 -7.9 -14.7 48.8 121 121 A G H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.933 115.2 43.5 -58.9 -47.6 -11.4 -15.7 47.6 122 122 A V H X S+ 0 0 7 -4,-2.9 4,-2.5 2,-0.2 -1,-0.2 0.886 112.8 52.4 -66.0 -38.8 -12.4 -16.9 51.1 123 123 A A H X S+ 0 0 32 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.960 110.5 48.1 -68.0 -37.9 -10.8 -13.8 52.6 124 124 A A H X S+ 0 0 0 -4,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.886 110.2 51.2 -63.0 -40.1 -12.8 -11.6 50.3 125 125 A Y H X S+ 0 0 2 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.921 111.0 49.7 -66.9 -38.6 -16.0 -13.5 51.1 126 126 A R H X S+ 0 0 94 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.913 109.5 50.8 -60.7 -44.1 -15.2 -13.0 54.8 127 127 A W H X S+ 0 0 54 -4,-2.4 4,-2.3 2,-0.3 -1,-0.2 0.845 105.5 55.8 -65.2 -41.0 -14.6 -9.3 54.3 128 128 A L H X>S+ 0 0 1 -4,-2.3 5,-1.5 2,-0.2 4,-0.6 0.940 109.7 47.2 -54.5 -49.6 -18.0 -9.0 52.5 129 129 A L H ><5S+ 0 0 36 -4,-2.2 3,-1.2 1,-0.2 -2,-0.3 0.907 109.7 52.0 -63.1 -35.1 -19.5 -10.4 55.6 130 130 A D H 3<5S+ 0 0 125 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.841 103.7 61.0 -70.7 -24.0 -17.5 -8.0 57.9 131 131 A Q H 3<5S- 0 0 96 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.649 125.3 -98.2 -67.3 -21.6 -18.8 -5.1 55.7 132 132 A G T <<5S+ 0 0 44 -3,-1.2 2,-0.2 -4,-0.6 -3,-0.2 0.237 72.9 143.2 120.8 -16.1 -22.4 -5.9 56.6 133 133 A F < - 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0 0 23 -5,-2.3 -1,-0.3 -8,-0.1 2,-0.1 -0.741 53.1-109.6 -93.7 147.1 -18.6 -19.6 57.3 163 163 A P - 0 0 62 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.452 34.8-113.2 -79.6 149.3 -22.3 -19.3 56.2 164 164 A M - 0 0 38 -2,-0.1 -26,-0.1 62,-0.1 63,-0.0 -0.540 26.0-116.2 -86.2 150.3 -23.1 -19.9 52.5 165 165 A P - 0 0 8 0, 0.0 -29,-0.2 0, 0.0 -26,-0.2 0.013 33.0-100.0 -69.7 174.7 -24.3 -17.3 50.0 166 166 A A S S- 0 0 16 -28,-2.1 2,-0.3 -31,-0.7 -27,-0.2 0.771 94.4 -10.6 -68.5 -28.1 -27.7 -17.4 48.3 167 167 A S E -e 139 0A 0 -29,-0.7 -27,-1.3 61,-0.2 2,-0.4 -0.991 54.2-143.4-164.7 163.8 -26.4 -18.8 45.1 168 168 A A E -ef 140 230A 0 61,-2.0 63,-2.4 -2,-0.3 -27,-0.2 -0.993 6.8-169.1-146.8 138.1 -23.4 -19.6 43.0 169 169 A I E -e 141 0A 0 -29,-2.7 -27,-1.6 -2,-0.4 2,-0.4 -0.830 3.3-172.0-130.0 86.5 -22.8 -19.4 39.3 170 170 A P E -e 142 0A 0 0, 0.0 63,-1.6 0, 0.0 2,-0.6 -0.737 13.4-152.6 -73.2 137.5 -19.7 -21.0 37.9 171 171 A I E S-eg 143 233A 0 -29,-3.5 -27,-2.5 -2,-0.4 -24,-0.3 -0.930 71.5 -27.2-117.4 112.7 -19.3 -20.1 34.2 172 172 A S S S- 0 0 0 61,-3.3 -1,-0.2 -2,-0.6 -25,-0.2 0.954 92.7-160.2 54.8 49.8 -17.4 -22.7 32.0 173 173 A P - 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