==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-DEC-09 3L1I . COMPND 2 MOLECULE: ESTERASE/LIPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: UNCULTURED BACTERIUM; . AUTHOR K.H.NAM,K.Y.HWANG . 294 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12622.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 9.9 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 . 21 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 100 34.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 0 3 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 0 232 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -90.9 -5.6 1.4 -23.3 2 2 A A - 0 0 19 1,-0.1 261,-0.1 261,-0.0 5,-0.0 -0.872 360.0 -99.4 -97.2 140.7 -7.5 4.3 -21.6 3 3 A G > - 0 0 22 -2,-0.4 4,-1.6 1,-0.1 5,-0.1 -0.102 26.4-120.4 -54.9 156.3 -11.3 3.9 -21.4 4 4 A P H > S+ 0 0 96 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.859 108.7 56.9 -71.2 -31.0 -13.4 5.8 -23.9 5 5 A E H > S+ 0 0 74 2,-0.2 4,-3.5 1,-0.2 5,-0.2 0.917 106.7 47.7 -67.6 -44.7 -15.3 7.8 -21.3 6 6 A I H > S+ 0 0 1 2,-0.2 4,-4.0 1,-0.2 5,-0.2 0.931 111.5 50.4 -61.1 -47.6 -12.2 9.3 -19.7 7 7 A V H X S+ 0 0 92 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.917 115.4 45.0 -50.3 -50.4 -10.8 10.3 -23.2 8 8 A K H X S+ 0 0 144 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.945 115.0 46.0 -56.5 -58.2 -14.1 11.9 -23.9 9 9 A L H X S+ 0 0 8 -4,-3.5 4,-2.5 1,-0.2 5,-0.3 0.897 109.1 56.0 -57.2 -41.8 -14.3 13.6 -20.4 10 10 A K H X S+ 0 0 23 -4,-4.0 4,-1.8 -5,-0.2 -1,-0.2 0.930 109.8 47.0 -55.4 -41.6 -10.7 14.8 -20.8 11 11 A K H X S+ 0 0 136 -4,-1.8 4,-3.0 2,-0.2 -2,-0.2 0.955 110.7 49.4 -67.8 -52.3 -11.7 16.5 -24.1 12 12 A I H X S+ 0 0 69 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.906 112.7 49.3 -49.3 -46.5 -14.9 18.2 -22.7 13 13 A L H X S+ 0 0 33 -4,-2.5 4,-1.0 2,-0.2 -1,-0.2 0.852 111.2 48.2 -64.3 -37.1 -12.8 19.5 -19.7 14 14 A R H < S+ 0 0 127 -4,-1.8 3,-0.4 -5,-0.3 -2,-0.2 0.961 114.3 47.7 -66.3 -45.7 -10.1 20.9 -22.0 15 15 A E H < S+ 0 0 133 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.916 115.6 42.7 -56.9 -49.4 -12.7 22.5 -24.2 16 16 A K H < S+ 0 0 182 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.626 92.5 111.4 -75.1 -18.1 -14.7 24.1 -21.3 17 17 A A S < S- 0 0 53 -4,-1.0 176,-0.0 -3,-0.4 -3,-0.0 -0.248 72.4-119.0 -63.9 143.9 -11.6 25.3 -19.4 18 18 A V - 0 0 85 1,-0.1 3,-0.1 4,-0.1 -1,-0.1 -0.674 47.5 -96.1 -72.4 136.3 -10.7 28.9 -18.9 19 19 A P > - 0 0 83 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 -0.283 48.3 -83.1 -58.4 140.1 -7.2 29.5 -20.6 20 20 A P T 3 S+ 0 0 140 0, 0.0 3,-0.1 0, 0.0 2,-0.1 -0.112 111.5 17.7 -47.0 114.9 -3.9 29.4 -18.4 21 21 A G T 3 S+ 0 0 72 1,-0.4 -3,-0.0 -3,-0.1 0, 0.0 -0.370 84.5 123.6 122.9 -50.5 -3.2 32.6 -16.7 22 22 A T < - 0 0 84 -3,-1.1 2,-0.6 1,-0.1 -1,-0.4 -0.131 60.4-128.2 -51.5 129.1 -6.6 34.4 -16.9 23 23 A E - 0 0 176 -3,-0.1 -1,-0.1 173,-0.0 173,-0.0 -0.733 17.0-159.1 -91.2 115.6 -7.8 35.5 -13.4 24 24 A V - 0 0 49 -2,-0.6 5,-0.1 -6,-0.0 -6,-0.0 -0.846 25.0-119.7 -94.7 122.8 -11.3 34.4 -12.6 25 25 A P > - 0 0 76 0, 0.0 4,-2.1 0, 0.0 3,-0.3 -0.230 25.5-114.7 -60.6 154.4 -12.8 36.5 -9.7 26 26 A L H > S+ 0 0 16 1,-0.3 4,-3.0 2,-0.2 3,-0.4 0.953 112.0 48.8 -65.9 -51.5 -13.7 34.5 -6.7 27 27 A D H > S+ 0 0 84 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.792 111.4 54.4 -62.9 -21.1 -17.5 34.9 -6.6 28 28 A V H > S+ 0 0 78 -3,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.903 109.0 46.1 -74.1 -42.3 -17.4 34.0 -10.4 29 29 A M H X S+ 0 0 56 -4,-2.1 4,-1.9 -3,-0.4 -2,-0.2 0.928 113.7 51.9 -62.5 -42.1 -15.5 30.7 -9.6 30 30 A R H X S+ 0 0 53 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.919 110.9 44.9 -57.2 -48.7 -18.0 30.1 -6.8 31 31 A K H X S+ 0 0 126 -4,-2.1 4,-3.1 1,-0.2 5,-0.2 0.885 110.3 55.0 -69.2 -37.1 -21.1 30.6 -8.9 32 32 A G H X S+ 0 0 28 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.853 106.8 49.3 -64.1 -40.5 -19.8 28.5 -11.7 33 33 A M H X S+ 0 0 50 -4,-1.9 4,-0.5 2,-0.2 -1,-0.2 0.900 114.3 47.0 -63.8 -40.9 -19.1 25.5 -9.5 34 34 A E H >< S+ 0 0 67 -4,-1.8 3,-1.6 1,-0.2 -2,-0.2 0.980 112.7 48.0 -61.3 -57.8 -22.7 25.8 -8.1 35 35 A K H 3< S+ 0 0 168 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.774 115.5 44.0 -57.3 -33.7 -24.3 26.2 -11.5 36 36 A V H 3< S+ 0 0 90 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.437 84.6 123.2 -94.2 0.3 -22.5 23.2 -13.0 37 37 A A << - 0 0 35 -3,-1.6 2,-0.3 -4,-0.5 49,-0.1 -0.269 67.3-110.1 -64.1 142.6 -22.9 20.7 -10.0 38 38 A F - 0 0 76 47,-0.4 50,-0.5 232,-0.2 2,-0.2 -0.588 30.4-115.9 -69.7 135.8 -24.6 17.4 -10.7 39 39 A K - 0 0 189 -2,-0.3 3,-0.1 1,-0.1 -1,-0.1 -0.497 38.2-107.9 -63.6 133.7 -28.1 17.0 -9.2 40 40 A A - 0 0 18 -2,-0.2 48,-0.1 1,-0.1 -1,-0.1 -0.322 46.8 -81.1 -62.1 150.0 -28.1 14.1 -6.6 41 41 A A > - 0 0 37 47,-0.3 3,-2.0 1,-0.1 -1,-0.1 -0.156 40.2-114.5 -53.3 147.7 -29.8 10.8 -7.5 42 42 A D T 3 S+ 0 0 158 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.686 113.3 55.3 -59.0 -25.6 -33.5 10.8 -7.1 43 43 A D T 3 S+ 0 0 76 2,-0.1 2,-0.5 19,-0.0 -1,-0.3 0.349 80.4 111.2 -96.1 7.1 -33.5 8.2 -4.3 44 44 A I < - 0 0 19 -3,-2.0 2,-0.4 17,-0.1 17,-0.2 -0.709 57.7-151.2 -81.9 124.2 -31.1 10.3 -2.1 45 45 A Q E -A 60 0A 132 15,-2.5 15,-2.8 -2,-0.5 2,-0.3 -0.774 12.7-163.1 -99.0 140.9 -32.9 11.6 1.0 46 46 A V E -A 59 0A 48 -2,-0.4 2,-0.3 13,-0.2 13,-0.2 -0.946 13.1-174.4-130.9 144.1 -31.7 14.8 2.5 47 47 A E E -A 58 0A 88 11,-1.8 11,-2.3 -2,-0.3 2,-0.2 -0.915 21.9-134.7-139.4 116.9 -32.2 16.5 5.9 48 48 A Q E +A 57 0A 162 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.491 33.9 165.8 -71.1 130.6 -30.9 20.0 6.8 49 49 A V E -A 56 0A 27 7,-2.5 7,-2.1 -2,-0.2 2,-0.5 -0.909 35.1-123.1-137.1 161.8 -29.2 20.4 10.2 50 50 A T E -A 55 0A 104 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.954 29.3-178.5-109.0 132.2 -27.0 22.9 12.0 51 51 A V E > -A 54 0A 0 3,-3.0 3,-1.9 -2,-0.5 73,-0.2 -0.978 68.7 -21.3-136.7 119.6 -23.7 21.5 13.3 52 52 A A T 3 S- 0 0 47 -2,-0.4 -1,-0.1 1,-0.3 72,-0.1 0.931 127.5 -53.1 41.1 52.8 -21.2 23.6 15.2 53 53 A G T 3 S+ 0 0 74 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.641 117.7 112.7 63.9 13.4 -22.9 26.7 13.8 54 54 A C E < S-A 51 0A 9 -3,-1.9 -3,-3.0 66,-0.1 -1,-0.2 -0.917 72.5-111.1-112.8 149.5 -22.5 25.5 10.2 55 55 A A E +A 50 0A 53 50,-0.4 50,-2.7 -2,-0.4 2,-0.3 -0.472 47.8 166.3 -64.9 140.9 -25.2 24.5 7.8 56 56 A A E -AB 49 104A 3 -7,-2.1 -7,-2.5 48,-0.2 2,-0.4 -0.951 26.9-141.9-146.6 167.2 -25.1 20.8 7.0 57 57 A E E -AB 48 103A 11 46,-1.2 46,-3.7 -2,-0.3 2,-0.5 -0.990 15.0-135.8-127.7 139.9 -27.2 18.0 5.4 58 58 A W E -AB 47 102A 24 -11,-2.3 -11,-1.8 -2,-0.4 2,-0.6 -0.829 27.8-156.8 -78.9 129.0 -27.6 14.4 6.5 59 59 A V E -AB 46 101A 0 42,-2.6 42,-2.8 -2,-0.5 2,-0.6 -0.963 13.0-176.5-121.6 110.3 -27.3 12.7 3.1 60 60 A R E -A 45 0A 75 -15,-2.8 -15,-2.5 -2,-0.6 40,-0.1 -0.876 8.9-169.7-121.8 98.3 -29.0 9.3 3.1 61 61 A A > - 0 0 6 -2,-0.6 3,-0.5 38,-0.3 2,-0.2 -0.161 50.5 -76.4 -56.9 170.5 -28.9 7.0 0.2 62 62 A P T 3 S+ 0 0 63 0, 0.0 36,-0.1 0, 0.0 -1,-0.1 -0.602 116.6 39.4 -68.4 139.4 -31.2 3.9 0.3 63 63 A G T 3 S+ 0 0 50 -2,-0.2 2,-0.2 1,-0.2 -2,-0.1 0.712 73.5 169.8 99.6 25.6 -29.8 1.2 2.7 64 64 A C < - 0 0 36 -3,-0.5 2,-0.5 35,-0.1 35,-0.2 -0.481 30.8-128.4 -77.2 135.1 -28.4 3.2 5.5 65 65 A Q > - 0 0 101 33,-2.0 3,-1.5 -2,-0.2 35,-0.4 -0.711 23.2-116.3 -81.3 127.4 -27.3 1.4 8.6 66 66 A A T 3 S+ 0 0 93 -2,-0.5 3,-0.1 1,-0.2 -1,-0.1 -0.367 101.4 22.8 -43.3 130.0 -28.6 2.6 11.9 67 67 A G T 3 S+ 0 0 40 1,-0.3 67,-0.4 -2,-0.1 -1,-0.2 0.159 99.2 110.7 91.2 -17.2 -25.6 3.9 14.0 68 68 A K < + 0 0 44 -3,-1.5 32,-0.5 30,-0.1 -1,-0.3 -0.585 38.7 167.5 -93.5 151.3 -23.3 4.5 11.1 69 69 A A E -cd 100 138A 0 68,-1.6 70,-1.1 -2,-0.2 2,-0.5 -0.942 24.5-149.5-161.6 145.5 -22.1 8.0 9.9 70 70 A I E -cd 101 139A 0 30,-2.1 32,-4.5 -2,-0.3 2,-0.7 -0.967 12.9-147.1-114.4 125.3 -19.6 9.7 7.6 71 71 A L E -cd 102 140A 0 68,-2.7 70,-2.5 -2,-0.5 2,-0.5 -0.889 27.3-161.3 -82.6 115.4 -18.2 13.2 8.3 72 72 A Y E -cd 103 141A 0 30,-2.8 32,-1.5 -2,-0.7 2,-0.6 -0.935 11.4-165.0-109.1 123.7 -17.8 14.4 4.7 73 73 A L E -cd 104 142A 0 68,-3.3 70,-0.9 -2,-0.5 77,-0.2 -0.927 19.9-138.9-110.0 110.2 -15.5 17.4 4.0 74 74 A H - 0 0 0 -2,-0.6 4,-0.2 30,-0.5 75,-0.1 -0.183 9.6-118.1 -73.0 158.4 -16.0 18.8 0.6 75 75 A G + 0 0 0 70,-0.2 69,-0.2 71,-0.1 -1,-0.1 -0.168 54.6 121.4 -82.4-179.0 -13.4 20.1 -2.0 76 76 A G S >> S- 0 0 11 67,-0.1 4,-3.0 5,-0.1 3,-2.1 0.607 88.2 -83.9 128.1 33.4 -13.0 23.6 -3.4 77 77 A G T 34 S- 0 0 4 1,-0.3 127,-0.2 2,-0.2 -2,-0.1 0.621 77.3 -76.1 55.8 17.7 -9.5 24.8 -2.6 78 78 A Y T 34 S+ 0 0 1 2,-0.3 31,-2.7 -4,-0.2 -1,-0.3 0.414 134.0 73.9 68.6 2.6 -10.7 26.0 0.9 79 79 A V T <4 S+ 0 0 0 -3,-2.1 2,-0.3 29,-0.2 -2,-0.2 0.509 99.9 19.4-119.6 -17.4 -12.3 29.0 -1.0 80 80 A M S < S+ 0 0 23 -4,-3.0 -2,-0.3 -51,-0.0 2,-0.1 -0.827 72.2 83.8-147.4-175.8 -15.3 27.4 -2.8 81 81 A G - 0 0 6 -2,-0.3 2,-0.3 -51,-0.2 -5,-0.1 -0.208 41.2-169.2 96.7 161.5 -17.6 24.4 -2.8 82 82 A S > - 0 0 16 -2,-0.1 4,-1.2 1,-0.1 -7,-0.1 -0.941 46.4 -74.8-166.2-179.7 -20.8 23.8 -0.8 83 83 A I H > S+ 0 0 14 -2,-0.3 4,-1.1 1,-0.2 3,-0.2 0.897 129.6 52.8 -50.3 -48.3 -23.3 21.2 0.2 84 84 A N H 4 S+ 0 0 82 1,-0.2 3,-0.5 2,-0.2 4,-0.4 0.888 103.5 53.1 -55.2 -51.3 -24.8 21.7 -3.3 85 85 A T H 4 S+ 0 0 20 1,-0.2 -47,-0.4 2,-0.1 4,-0.2 0.828 122.7 30.0 -60.8 -27.9 -21.6 21.1 -5.3 86 86 A H H X S+ 0 0 8 -4,-1.2 4,-2.4 -3,-0.2 5,-0.3 0.442 85.8 99.4-115.9 -1.2 -21.0 17.8 -3.5 87 87 A R H X S+ 0 0 56 -4,-1.1 4,-1.8 -3,-0.5 -1,-0.1 0.874 86.8 53.1 -56.6 -38.2 -24.5 16.4 -2.6 88 88 A S H > S+ 0 0 6 -50,-0.5 4,-1.7 -4,-0.4 -47,-0.3 0.949 111.8 39.3 -63.9 -59.4 -24.3 14.1 -5.7 89 89 A M H > S+ 0 0 6 -4,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.865 116.5 52.6 -57.5 -40.3 -21.0 12.4 -5.1 90 90 A V H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.843 103.4 57.8 -72.4 -28.2 -21.7 12.1 -1.3 91 91 A G H X S+ 0 0 0 -4,-1.8 4,-2.2 -5,-0.3 -1,-0.2 0.948 107.4 48.3 -61.0 -44.5 -25.1 10.5 -2.1 92 92 A E H X S+ 0 0 31 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.859 109.2 51.3 -67.4 -37.0 -23.2 7.8 -4.0 93 93 A I H X S+ 0 0 1 -4,-1.8 4,-2.1 2,-0.2 6,-0.2 0.899 110.0 50.6 -66.6 -38.6 -20.6 7.2 -1.1 94 94 A S H X>S+ 0 0 0 -4,-2.2 5,-1.4 2,-0.2 4,-0.8 0.925 110.1 50.8 -63.2 -38.6 -23.5 6.9 1.2 95 95 A R H ><5S+ 0 0 80 -4,-2.2 3,-0.5 1,-0.2 -2,-0.2 0.937 115.3 41.9 -57.3 -51.9 -25.0 4.3 -1.2 96 96 A A H 3<5S+ 0 0 15 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.707 120.1 40.8 -71.0 -31.2 -21.8 2.3 -1.4 97 97 A S H 3<5S- 0 0 1 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.387 98.6-132.4-100.2 -1.7 -20.9 2.5 2.3 98 98 A Q T <<5S+ 0 0 76 -4,-0.8 -33,-2.0 -3,-0.5 2,-0.3 0.892 70.4 114.5 43.8 50.1 -24.5 1.9 3.5 99 99 A A S - 0 0 25 -29,-0.1 4,-1.7 -3,-0.1 -29,-0.2 -0.799 19.0 -88.9-109.6 148.9 -14.5 29.1 3.6 109 109 A A T 4 S+ 0 0 0 -31,-2.7 95,-0.2 -2,-0.3 94,-0.1 -0.537 96.0 35.5 -83.7 162.5 -11.6 31.5 3.0 110 110 A P T 4 S+ 0 0 57 0, 0.0 -1,-0.2 0, 0.0 -31,-0.1 -0.996 126.0 45.9 -77.6 -6.5 -10.8 34.4 2.4 111 111 A E T 4 S+ 0 0 109 1,-0.3 -2,-0.2 -3,-0.1 -32,-0.0 0.896 135.1 18.2 -61.5 -38.1 -13.8 35.5 4.6 112 112 A H S < S- 0 0 85 -4,-1.7 -1,-0.3 3,-0.0 5,-0.3 -0.822 88.6-164.7-134.6 95.1 -12.6 32.9 7.2 113 113 A P > - 0 0 35 0, 0.0 3,-2.3 0, 0.0 92,-0.2 -0.123 39.1 -25.8 -73.3 168.7 -8.9 31.8 6.7 114 114 A F T 3 S+ 0 0 23 90,-2.5 94,-0.1 1,-0.3 101,-0.1 -0.289 123.4 30.5 -40.7 132.3 -7.1 28.9 8.2 115 115 A P T 3> S+ 0 0 54 0, 0.0 4,-2.6 0, 0.0 3,-0.4 -0.873 97.6 86.5-102.9 27.4 -7.8 27.4 10.8 116 116 A A H <> S+ 0 0 6 -3,-2.3 4,-2.7 1,-0.2 -9,-0.2 0.911 93.6 48.0 -49.4 -53.2 -11.5 28.2 10.5 117 117 A A H > S+ 0 0 0 -5,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.841 111.5 50.0 -57.6 -40.3 -12.2 25.0 8.4 118 118 A V H > S+ 0 0 3 -3,-0.4 4,-3.2 2,-0.2 5,-0.3 0.932 110.4 50.3 -63.4 -46.3 -10.2 22.8 10.8 119 119 A E H X S+ 0 0 106 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.933 112.1 48.0 -56.8 -47.6 -12.2 24.2 13.8 120 120 A D H X S+ 0 0 8 -4,-2.7 4,-2.9 -5,-0.2 -2,-0.2 0.963 112.8 48.7 -60.1 -43.9 -15.4 23.4 11.9 121 121 A G H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.943 114.1 44.7 -59.6 -51.3 -14.2 19.9 11.0 122 122 A V H X S+ 0 0 6 -4,-3.2 4,-3.0 2,-0.2 -1,-0.2 0.923 114.5 48.1 -60.8 -47.7 -13.1 19.1 14.6 123 123 A A H X S+ 0 0 32 -4,-2.5 4,-3.5 -5,-0.3 -1,-0.2 0.926 109.7 53.8 -60.9 -41.7 -16.3 20.5 16.1 124 124 A A H X S+ 0 0 0 -4,-2.9 4,-1.7 -5,-0.2 -1,-0.2 0.869 110.4 46.9 -56.0 -44.1 -18.4 18.6 13.6 125 125 A Y H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.928 111.4 50.3 -64.1 -48.2 -16.7 15.4 14.7 126 126 A R H X S+ 0 0 97 -4,-3.0 4,-3.5 1,-0.2 -2,-0.2 0.937 107.7 55.9 -56.6 -43.8 -17.2 16.3 18.3 127 127 A W H X S+ 0 0 53 -4,-3.5 4,-1.3 2,-0.2 -1,-0.2 0.870 106.0 50.1 -54.7 -43.5 -20.9 16.9 17.5 128 128 A L H >X>S+ 0 0 1 -4,-1.7 5,-1.8 2,-0.2 3,-0.6 0.956 112.0 46.2 -62.2 -54.2 -21.2 13.4 16.1 129 129 A L H ><5S+ 0 0 33 -4,-2.2 3,-1.7 1,-0.2 -2,-0.2 0.943 112.8 52.0 -47.7 -53.8 -19.6 11.8 19.2 130 130 A D H 3<5S+ 0 0 124 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.772 102.4 59.4 -52.6 -28.8 -21.9 14.0 21.3 131 131 A Q H <<5S- 0 0 107 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.592 126.6 -99.1 -81.4 -10.8 -25.0 12.8 19.3 132 132 A G T <<5S+ 0 0 53 -3,-1.7 2,-0.2 -4,-0.5 -3,-0.2 0.383 74.3 143.1 110.9 -0.3 -24.2 9.3 20.4 133 133 A F < - 0 0 48 -5,-1.8 -1,-0.3 1,-0.1 -65,-0.1 -0.519 49.2-126.8 -71.9 135.2 -22.3 7.9 17.4 134 134 A K > - 0 0 119 -67,-0.4 3,-2.8 -2,-0.2 4,-0.2 -0.673 14.0-119.8 -85.0 142.5 -19.6 5.6 18.5 135 135 A P G > S+ 0 0 30 0, 0.0 3,-1.6 0, 0.0 31,-1.1 0.828 115.3 55.7 -39.5 -44.2 -16.0 6.1 17.2 136 136 A Q G 3 S+ 0 0 105 1,-0.3 -3,-0.0 29,-0.2 -68,-0.0 0.569 105.2 53.2 -74.9 -6.9 -16.0 2.6 15.7 137 137 A H G < S+ 0 0 66 -3,-2.8 -68,-1.6 -70,-0.1 2,-0.3 0.231 98.7 87.7-106.6 11.3 -19.1 3.5 13.7 138 138 A L E < +d 69 0A 2 -3,-1.6 28,-2.0 -70,-0.2 29,-0.7 -0.763 47.0 177.8-116.9 154.4 -17.6 6.7 12.2 139 139 A S E -de 70 167A 1 -70,-1.1 -68,-2.7 -2,-0.3 2,-0.4 -0.962 16.2-146.2-146.9 150.7 -15.6 7.5 9.2 140 140 A I E +de 71 168A 0 27,-1.5 29,-2.5 -2,-0.3 2,-0.3 -0.985 25.2 164.5-125.8 135.8 -14.2 10.7 7.8 141 141 A S E +de 72 169A 0 -70,-2.5 -68,-3.3 -2,-0.4 2,-0.3 -0.974 4.1 148.4-146.8 159.5 -13.9 11.4 4.1 142 142 A G E -de 73 170A 0 27,-1.5 29,-2.8 -2,-0.3 2,-0.4 -0.919 31.3-116.7 176.6 167.5 -13.4 14.4 1.7 143 143 A D E > - e 0 171A 7 -70,-0.9 3,-2.0 -2,-0.3 29,-0.2 -0.918 67.3 -25.0-128.1 139.9 -11.8 15.3 -1.6 144 144 A S T 3> S+ 0 0 15 27,-2.6 30,-2.7 -2,-0.4 4,-1.4 -0.455 138.9 3.4 68.7-124.7 -9.1 17.7 -2.8 145 145 A A H 3> S+ 0 0 0 1,-0.2 4,-2.8 28,-0.2 -1,-0.3 0.855 137.2 54.4 -54.3 -44.9 -8.8 20.4 -0.1 146 146 A G H <> S+ 0 0 0 -3,-2.0 4,-2.7 1,-0.2 -2,-0.3 0.881 102.7 57.8 -58.8 -36.2 -11.4 18.6 2.0 147 147 A G H > S+ 0 0 0 24,-0.3 4,-1.1 2,-0.2 -1,-0.2 0.832 108.2 45.2 -69.8 -30.0 -9.2 15.5 1.7 148 148 A G H X S+ 0 0 0 -4,-1.4 4,-2.7 -3,-0.2 -2,-0.2 0.893 109.7 55.7 -68.8 -44.3 -6.4 17.5 3.3 149 149 A L H X S+ 0 0 0 -4,-2.8 4,-3.7 2,-0.2 5,-0.3 0.869 98.6 62.4 -56.4 -39.6 -8.9 18.7 5.9 150 150 A V H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.981 109.8 40.1 -42.6 -62.4 -9.7 15.0 6.6 151 151 A L H X S+ 0 0 0 -4,-1.1 4,-2.7 1,-0.2 -2,-0.2 0.888 115.2 50.8 -58.4 -43.8 -6.1 14.6 7.8 152 152 A A H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.3 0.933 109.3 51.3 -61.0 -49.9 -6.0 18.0 9.5 153 153 A V H X S+ 0 0 0 -4,-3.7 4,-2.8 1,-0.2 -2,-0.2 0.887 112.3 47.5 -52.9 -43.9 -9.3 17.2 11.4 154 154 A L H X S+ 0 0 0 -4,-2.4 4,-3.6 -5,-0.3 -2,-0.2 0.953 114.2 44.5 -61.2 -55.0 -7.8 13.8 12.6 155 155 A V H X S+ 0 0 2 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.973 116.7 46.0 -54.9 -55.4 -4.4 15.3 13.7 156 156 A S H X S+ 0 0 8 -4,-3.0 4,-1.6 1,-0.2 -2,-0.2 0.937 114.7 48.6 -55.2 -49.6 -6.1 18.2 15.4 157 157 A A H <>S+ 0 0 0 -4,-2.8 5,-2.0 -5,-0.3 3,-0.4 0.920 110.2 50.7 -53.7 -49.9 -8.7 15.8 17.0 158 158 A R H ><5S+ 0 0 56 -4,-3.6 3,-2.3 1,-0.2 -1,-0.2 0.966 107.7 54.4 -54.7 -50.3 -6.0 13.4 18.2 159 159 A D H 3<5S+ 0 0 84 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.770 108.0 49.8 -56.7 -31.8 -4.1 16.4 19.8 160 160 A Q T 3<5S- 0 0 103 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.185 121.9-102.6 -92.7 15.1 -7.2 17.4 21.8 161 161 A G T < 5S+ 0 0 64 -3,-2.3 -3,-0.2 1,-0.2 -2,-0.1 0.443 70.3 147.8 85.8 -1.2 -7.9 13.9 23.2 162 162 A L < - 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