==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-AUG-94 1PNT . COMPND 2 MOLECULE: ACID PHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR M.ZHANG,R.L.VAN ETTEN,C.V.STAUFFACHER . 157 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8217.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 114 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 12.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 9 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 33.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 1 0 0 1 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 2 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 A 0 0 153 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 120.0 24.5 8.9 42.7 2 2 A E + 0 0 173 36,-0.0 2,-0.1 2,-0.0 36,-0.0 -0.908 360.0 134.3-161.1 129.4 25.8 11.8 44.7 3 3 A Q - 0 0 88 -2,-0.3 2,-0.3 1,-0.0 0, 0.0 -0.380 52.0 -65.5-140.9-145.0 27.3 15.2 43.9 4 4 A V - 0 0 93 -2,-0.1 2,-0.6 34,-0.1 -1,-0.0 -0.791 48.1-105.4-116.2 163.4 26.9 18.9 44.9 5 5 A T - 0 0 88 -2,-0.3 2,-0.2 34,-0.1 34,-0.2 -0.821 36.1-177.0-102.2 122.9 24.0 21.2 44.3 6 6 A K E -a 39 0A 44 32,-2.7 34,-2.6 -2,-0.6 2,-0.4 -0.701 5.8-158.2-108.9 166.3 24.1 23.9 41.6 7 7 A S E -a 40 0A 9 -2,-0.2 80,-1.6 32,-0.2 79,-0.6 -0.996 8.3-171.9-149.7 141.0 21.7 26.6 40.7 8 8 A V E -ab 41 87A 0 32,-2.4 34,-1.6 -2,-0.4 2,-0.5 -0.997 7.9-160.1-137.4 137.1 20.8 28.8 37.8 9 9 A L E -ab 42 88A 0 78,-2.9 80,-2.6 -2,-0.4 2,-0.4 -0.961 13.5-150.3-111.2 118.4 18.5 31.7 37.3 10 10 A F E -ab 43 89A 0 32,-3.1 34,-2.2 -2,-0.5 2,-0.4 -0.761 20.1-159.8 -88.5 133.8 17.4 32.5 33.8 11 11 A V E +ab 44 90A 0 78,-3.1 80,-1.1 -2,-0.4 2,-0.3 -0.942 22.0 154.1-129.2 134.4 16.6 36.2 33.3 12 12 A C E -a 45 0A 3 32,-1.9 34,-2.2 -2,-0.4 35,-0.2 -0.813 52.7 -96.9-136.1 179.5 14.7 38.4 30.8 13 13 A L S S+ 0 0 79 -2,-0.3 34,-2.9 32,-0.2 33,-0.3 0.992 118.3 10.2 -65.9 -51.2 13.0 41.7 30.9 14 14 A G S S- 0 0 11 31,-0.2 31,-0.2 32,-0.2 -1,-0.1 0.610 85.2-135.6-103.5 -15.6 9.5 40.5 31.5 15 15 A N S S+ 0 0 1 29,-0.3 30,-0.1 59,-0.1 60,-0.1 0.903 82.4 98.1 58.0 34.9 10.0 36.9 32.3 16 16 A I S S+ 0 0 22 39,-0.1 40,-2.0 28,-0.1 43,-0.2 0.619 89.8 14.8-121.5 -30.4 7.1 36.1 30.0 17 17 A C S > S+ 0 0 6 38,-0.2 4,-0.6 42,-0.1 112,-0.0 0.823 127.9 25.4-108.7 -59.3 8.6 35.1 26.7 18 18 A R H > S+ 0 0 5 2,-0.2 4,-2.6 1,-0.1 3,-0.2 0.894 116.5 45.5 -77.7 -54.2 12.3 34.3 26.8 19 19 A S H > S+ 0 0 0 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.852 108.7 56.2 -71.3 -29.9 13.4 33.1 30.2 20 20 A P H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.862 109.7 49.0 -66.6 -32.4 10.5 30.8 30.7 21 21 A I H X S+ 0 0 0 -4,-0.6 4,-2.6 -3,-0.2 5,-0.3 0.971 113.5 45.2 -68.9 -49.5 11.6 29.1 27.5 22 22 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.920 113.8 49.7 -58.5 -49.5 15.2 28.9 28.7 23 23 A E H X S+ 0 0 7 -4,-3.2 4,-2.5 2,-0.2 -1,-0.2 0.918 112.9 45.7 -54.2 -46.5 14.2 27.6 32.1 24 24 A A H X S+ 0 0 5 -4,-1.9 4,-1.5 2,-0.2 -1,-0.2 0.883 113.2 49.8 -69.1 -40.3 11.9 24.9 30.7 25 25 A V H X S+ 0 0 5 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.954 111.8 49.7 -60.9 -48.1 14.5 23.8 28.2 26 26 A F H X S+ 0 0 0 -4,-2.9 4,-2.3 -5,-0.3 -2,-0.2 0.902 107.3 52.2 -62.4 -41.0 17.0 23.7 30.9 27 27 A R H X S+ 0 0 107 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.857 109.8 51.6 -60.8 -35.8 14.8 21.6 33.2 28 28 A K H X S+ 0 0 87 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.918 107.7 51.3 -68.3 -36.8 14.3 19.2 30.4 29 29 A L H X S+ 0 0 12 -4,-2.1 4,-1.1 1,-0.2 -2,-0.2 0.951 113.7 44.1 -64.2 -48.0 18.1 18.8 29.8 30 30 A V H <>S+ 0 0 0 -4,-2.3 5,-2.5 1,-0.2 6,-0.6 0.881 112.5 51.6 -64.3 -40.5 18.8 18.1 33.3 31 31 A T H ><5S+ 0 0 75 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.880 108.4 51.8 -64.0 -41.8 15.9 15.8 33.6 32 32 A D H 3<5S+ 0 0 94 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.665 110.5 49.6 -66.0 -25.5 17.1 13.8 30.6 33 33 A Q T 3<5S- 0 0 52 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.088 111.7-119.4-101.7 18.1 20.5 13.5 32.1 34 34 A N T < 5S+ 0 0 148 -3,-1.2 -3,-0.2 1,-0.1 3,-0.1 0.745 84.1 111.9 54.8 29.5 19.3 12.3 35.3 35 35 A I > < + 0 0 12 -5,-2.5 3,-2.6 -6,-0.2 -4,-0.2 0.305 28.8 112.4-116.0 14.4 20.7 15.2 37.2 36 36 A S G > S+ 0 0 50 -6,-0.6 3,-2.3 1,-0.3 -1,-0.1 0.857 70.4 68.1 -52.9 -38.3 17.6 17.1 38.4 37 37 A D G 3 S+ 0 0 150 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.654 102.3 46.2 -59.6 -14.0 18.3 16.2 42.0 38 38 A N G < S+ 0 0 24 -3,-2.6 -32,-2.7 -33,-0.1 2,-0.4 0.291 100.5 78.9-112.2 11.7 21.3 18.4 41.9 39 39 A W E < -a 6 0A 20 -3,-2.3 2,-0.5 -34,-0.2 -32,-0.2 -0.976 51.9-163.4-126.5 138.8 20.0 21.4 40.2 40 40 A V E -a 7 0A 80 -34,-2.6 -32,-2.4 -2,-0.4 2,-0.4 -0.960 25.6-175.5-110.4 122.2 17.9 24.3 41.4 41 41 A I E +a 8 0A 15 -2,-0.5 2,-0.3 -34,-0.2 -32,-0.2 -0.944 11.4 150.1-123.2 145.6 16.4 26.1 38.4 42 42 A D E -a 9 0A 37 -34,-1.6 -32,-3.1 -2,-0.4 2,-0.3 -0.980 26.5-141.9-163.4 166.4 14.4 29.3 38.1 43 43 A S E +a 10 0A 0 -2,-0.3 2,-0.3 -34,-0.2 -32,-0.2 -0.984 22.2 169.3-138.5 149.0 13.5 32.2 35.9 44 44 A G E -a 11 0A 0 -34,-2.2 -32,-1.9 -2,-0.3 2,-0.3 -0.943 24.0-113.1-150.8 174.8 12.8 35.9 36.7 45 45 A A E -ac 12 76A 1 30,-2.2 32,-2.9 -2,-0.3 -32,-0.2 -0.818 9.9-146.7-116.3 150.7 12.3 39.4 35.3 46 46 A V S S+ 0 0 21 -34,-2.2 -33,-0.2 -2,-0.3 -32,-0.2 0.934 92.7 60.5 -75.3 -41.2 14.2 42.7 35.4 47 47 A S - 0 0 33 -34,-2.9 3,-0.3 -35,-0.2 -2,-0.2 -0.426 66.6-153.9 -87.9 153.5 10.8 44.3 35.3 48 48 A D S > S+ 0 0 101 1,-0.2 3,-1.7 -2,-0.1 -1,-0.1 0.513 72.4 100.3-101.7 -1.0 7.9 44.0 37.8 49 49 A W T 3 S+ 0 0 202 1,-0.3 -1,-0.2 0, 0.0 -35,-0.1 0.613 89.3 33.8 -55.8 -29.7 5.3 44.8 35.1 50 50 A N T > S+ 0 0 26 -3,-0.3 3,-1.8 -36,-0.1 -1,-0.3 0.133 79.1 147.9-117.7 17.5 4.2 41.3 34.6 51 51 A V T < S+ 0 0 78 -3,-1.7 24,-0.2 1,-0.2 23,-0.1 -0.195 70.3 19.5 -59.4 149.2 4.6 39.6 37.9 52 52 A G T 3 S+ 0 0 33 22,-3.8 -1,-0.2 1,-0.2 2,-0.2 0.219 96.9 126.7 80.4 -16.8 2.1 36.8 38.6 53 53 A R < - 0 0 161 -3,-1.8 21,-2.9 20,-0.1 -1,-0.2 -0.494 59.8-121.6 -79.3 149.5 1.4 36.3 34.9 54 54 A S - 0 0 90 19,-0.2 19,-0.1 -2,-0.2 -1,-0.1 -0.315 46.7 -79.7 -74.5 165.3 1.6 33.1 33.0 55 55 A P - 0 0 15 0, 0.0 -38,-0.2 0, 0.0 -1,-0.2 -0.225 58.9 -79.5 -68.0 147.9 3.9 32.9 30.0 56 56 A D >> - 0 0 18 -40,-2.0 4,-2.2 1,-0.2 3,-0.7 -0.152 41.2-123.0 -44.8 141.2 3.0 34.3 26.6 57 57 A P H 3> S+ 0 0 101 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.806 112.0 57.1 -63.5 -25.8 0.7 31.8 24.9 58 58 A R H 3> S+ 0 0 56 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.786 105.8 49.4 -75.3 -30.0 3.1 31.6 22.0 59 59 A A H <> S+ 0 0 1 -3,-0.7 4,-2.4 2,-0.2 5,-0.2 0.912 111.1 50.7 -71.5 -44.0 5.9 30.6 24.3 60 60 A V H X S+ 0 0 49 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.977 114.0 43.1 -58.7 -49.1 3.6 27.9 25.8 61 61 A S H X S+ 0 0 54 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.864 109.8 56.9 -71.7 -24.8 2.7 26.5 22.5 62 62 A C H X S+ 0 0 6 -4,-1.4 4,-1.0 -5,-0.2 -1,-0.2 0.980 110.4 44.1 -64.9 -47.5 6.2 26.7 21.2 63 63 A L H ><>S+ 0 0 1 -4,-2.4 5,-3.0 1,-0.2 3,-0.6 0.893 110.8 55.3 -59.6 -41.6 7.4 24.5 24.1 64 64 A R H ><5S+ 0 0 70 -4,-2.3 3,-2.2 1,-0.3 -1,-0.2 0.901 100.0 59.7 -61.4 -37.0 4.5 22.2 23.6 65 65 A N H 3<5S+ 0 0 133 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.830 108.4 45.8 -58.5 -31.6 5.5 21.8 20.1 66 66 A H T <<5S- 0 0 64 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.200 124.0-103.7 -96.9 10.8 8.8 20.4 21.4 67 67 A G T < 5S+ 0 0 55 -3,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.626 81.9 125.5 79.5 16.0 7.1 18.2 24.0 68 68 A I < - 0 0 13 -5,-3.0 -1,-0.3 -6,-0.2 2,-0.3 -0.813 38.7-166.8-114.7 148.1 7.9 20.5 26.9 69 69 A N - 0 0 111 -2,-0.3 2,-0.3 -45,-0.1 -8,-0.0 -0.803 1.2-166.7-124.4 161.3 5.6 22.1 29.5 70 70 A T - 0 0 32 -2,-0.3 -49,-0.0 2,-0.1 -6,-0.0 -0.998 20.9-171.9-147.7 152.1 5.8 24.9 32.1 71 71 A A + 0 0 101 -2,-0.3 2,-0.1 2,-0.0 -1,-0.0 -0.008 41.1 150.2-127.1 24.5 3.9 26.1 35.0 72 72 A H - 0 0 20 -52,-0.1 2,-0.5 -56,-0.0 -2,-0.1 -0.369 32.3-159.0 -63.8 143.7 5.9 29.3 35.6 73 73 A K - 0 0 132 -19,-0.1 -19,-0.2 -2,-0.1 -20,-0.1 -0.967 34.1-104.8-117.8 130.1 4.5 32.5 37.1 74 74 A A + 0 0 6 -21,-2.9 -22,-3.8 -2,-0.5 2,-0.3 -0.185 46.3 175.1 -54.0 134.5 6.4 35.7 36.3 75 75 A R - 0 0 63 -24,-0.2 -30,-2.2 -32,-0.1 2,-0.3 -0.974 28.5-111.3-137.6 156.3 8.4 37.0 39.2 76 76 A Q B -c 45 0A 84 -2,-0.3 -30,-0.2 -32,-0.2 2,-0.1 -0.638 32.4-109.8 -87.1 149.4 10.8 39.8 39.7 77 77 A V - 0 0 0 -32,-2.9 2,-0.3 -2,-0.3 -1,-0.1 -0.448 42.8-163.7 -72.1 145.8 14.5 39.3 40.4 78 78 A T >> - 0 0 48 -2,-0.1 3,-1.0 1,-0.0 4,-0.6 -0.801 33.3 -98.8-127.9 173.4 15.4 40.2 43.9 79 79 A K T >4 S+ 0 0 116 -2,-0.3 3,-0.9 1,-0.3 4,-0.3 0.826 118.8 56.8 -62.1 -35.9 18.4 41.0 46.0 80 80 A E T >> S+ 0 0 111 1,-0.2 3,-1.4 2,-0.2 4,-1.4 0.751 90.1 74.8 -71.1 -21.4 18.7 37.6 47.5 81 81 A D H <> S+ 0 0 9 -3,-1.0 4,-2.1 1,-0.3 3,-0.4 0.877 92.3 56.5 -53.8 -39.8 18.8 36.1 44.0 82 82 A F H << S+ 0 0 1 -3,-0.9 28,-2.0 -4,-0.6 29,-1.4 0.624 112.2 38.9 -70.7 -17.9 22.4 37.4 43.8 83 83 A V H <4 S+ 0 0 51 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.567 118.6 46.6-108.2 -6.8 23.5 35.6 46.8 84 84 A T H < S+ 0 0 74 -4,-1.4 2,-0.3 -3,-0.4 -2,-0.2 0.732 96.8 70.6-105.5 -26.7 21.6 32.4 46.3 85 85 A F < - 0 0 13 -4,-2.1 27,-0.2 -5,-0.2 3,-0.1 -0.760 60.8-149.7 -94.8 142.6 22.2 31.4 42.6 86 86 A D S S+ 0 0 39 -79,-0.6 26,-2.0 -2,-0.3 2,-0.4 0.906 86.6 20.9 -69.5 -40.7 25.5 30.2 41.1 87 87 A Y E -bd 8 112A 48 -80,-1.6 -78,-2.9 24,-0.2 2,-0.5 -0.996 56.1-162.8-137.8 146.9 24.6 31.7 37.9 88 88 A I E -bd 9 113A 0 24,-2.7 26,-2.6 -2,-0.4 2,-0.6 -0.949 18.6-169.7-120.4 108.2 22.4 34.3 36.4 89 89 A L E -bd 10 114A 0 -80,-2.6 -78,-3.1 -2,-0.5 26,-0.2 -0.909 7.8-174.8-110.3 126.3 21.9 34.0 32.7 90 90 A C E -bd 11 115A 0 24,-2.1 26,-2.6 -2,-0.6 27,-0.5 -0.524 27.5-128.8-117.0 172.0 20.2 36.7 30.7 91 91 A M S S+ 0 0 0 -80,-1.1 36,-2.8 24,-0.2 2,-0.3 0.831 76.5 7.6 -89.8 -41.7 19.1 37.4 27.2 92 92 A D S > S- 0 0 24 34,-0.2 4,-2.2 1,-0.1 3,-0.2 -0.865 76.5 -93.7-141.5 176.2 20.5 40.7 26.1 93 93 A E H > S+ 0 0 100 -2,-0.3 4,-3.7 1,-0.3 5,-0.3 0.918 119.4 57.3 -63.9 -36.5 22.8 43.5 26.9 94 94 A S H > S+ 0 0 49 1,-0.3 4,-2.6 2,-0.2 -1,-0.3 0.917 107.3 46.8 -60.0 -44.1 20.1 45.5 28.6 95 95 A N H > S+ 0 0 2 2,-0.2 4,-2.9 -3,-0.2 -1,-0.3 0.904 113.1 52.4 -62.2 -39.9 19.3 42.8 31.0 96 96 A L H X S+ 0 0 46 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.979 109.9 45.0 -61.9 -51.0 23.0 42.5 31.6 97 97 A R H X S+ 0 0 137 -4,-3.7 4,-1.8 1,-0.2 -1,-0.2 0.933 113.8 52.8 -56.8 -44.6 23.5 46.1 32.4 98 98 A D H X S+ 0 0 33 -4,-2.6 4,-1.7 -5,-0.3 -2,-0.2 0.908 109.8 45.6 -60.4 -44.0 20.4 46.0 34.6 99 99 A L H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.878 109.5 55.1 -67.1 -40.0 21.5 43.1 36.7 100 100 A N H X S+ 0 0 73 -4,-2.4 4,-0.8 -5,-0.2 -1,-0.2 0.892 107.2 52.1 -61.0 -35.5 25.0 44.4 37.1 101 101 A R H X S+ 0 0 142 -4,-1.8 4,-0.5 -5,-0.3 3,-0.4 0.914 113.1 42.4 -66.1 -45.0 23.6 47.6 38.5 102 102 A K H >< S+ 0 0 45 -4,-1.7 3,-1.8 1,-0.2 -2,-0.2 0.901 106.1 61.2 -69.9 -40.8 21.4 45.9 41.0 103 103 A S H >< S+ 0 0 10 -4,-2.8 3,-1.4 1,-0.3 6,-0.2 0.725 93.5 68.5 -62.1 -19.5 24.0 43.4 42.1 104 104 A N H 3< S+ 0 0 125 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.837 90.4 58.3 -66.5 -36.0 26.0 46.4 43.1 105 105 A Q T << S+ 0 0 132 -3,-1.8 2,-0.6 -4,-0.5 -1,-0.3 0.315 93.7 92.7 -74.5 7.1 23.7 47.1 45.9 106 106 A V X - 0 0 19 -3,-1.4 3,-0.8 1,-0.2 -1,-0.0 -0.936 60.5-165.7-110.1 116.2 24.6 43.6 47.0 107 107 A K T 3 S+ 0 0 193 -2,-0.6 2,-0.3 1,-0.3 -1,-0.2 0.973 87.3 27.7 -63.4 -60.6 27.4 43.2 49.4 108 108 A N T 3 S+ 0 0 104 2,-0.0 2,-0.3 0, 0.0 -1,-0.3 -0.332 79.0 170.2-104.7 48.7 28.2 39.6 49.2 109 109 A C < + 0 0 46 -3,-0.8 -26,-0.2 -2,-0.3 -27,-0.1 -0.431 5.9 169.3 -61.8 120.0 27.1 39.0 45.6 110 110 A R + 0 0 125 -28,-2.0 2,-0.2 -2,-0.3 -27,-0.2 0.391 38.5 109.4-114.3 -3.0 28.2 35.5 44.7 111 111 A A - 0 0 13 -29,-1.4 2,-0.6 -24,-0.1 -24,-0.2 -0.535 61.6-139.7 -77.3 143.0 26.3 35.1 41.5 112 112 A K E -d 87 0A 107 -26,-2.0 -24,-2.7 -2,-0.2 2,-0.5 -0.891 21.9-157.4 -98.4 129.0 28.1 35.0 38.2 113 113 A I E +d 88 0A 25 -2,-0.6 2,-0.3 -26,-0.2 -24,-0.2 -0.932 24.1 146.0-113.1 125.3 26.1 37.0 35.7 114 114 A E E -d 89 0A 28 -26,-2.6 -24,-2.1 -2,-0.5 2,-0.4 -0.959 50.8 -85.8-151.2 168.8 26.4 36.5 32.0 115 115 A L E > -d 90 0A 25 -2,-0.3 3,-1.3 -26,-0.2 4,-0.2 -0.604 28.4-144.8 -73.1 132.4 24.8 36.4 28.6 116 116 A L G > S+ 0 0 0 -26,-2.6 3,-2.0 -2,-0.4 -1,-0.2 0.908 100.3 62.5 -63.5 -39.5 23.3 33.1 28.0 117 117 A G G > S+ 0 0 2 -27,-0.5 3,-2.0 8,-0.5 -1,-0.3 0.700 81.2 80.1 -62.2 -12.9 24.3 33.6 24.3 118 118 A S G < S+ 0 0 63 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.687 91.9 55.0 -67.9 -8.9 27.9 33.7 25.3 119 119 A Y G < S+ 0 0 25 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.493 79.1 121.6 -98.1 -7.5 27.5 30.0 25.4 120 120 A D X - 0 0 4 -3,-2.0 3,-3.4 1,-0.2 28,-0.1 -0.475 53.2-155.3 -64.6 115.7 26.3 29.7 21.8 121 121 A P T 3 S+ 0 0 83 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.778 101.4 52.8 -59.0 -23.3 28.5 27.5 19.6 122 122 A Q T 3 S- 0 0 114 22,-0.1 3,-0.1 2,-0.1 -2,-0.1 0.380 110.5-127.6 -92.2 -0.2 27.0 29.6 16.8 123 123 A K < + 0 0 171 -3,-3.4 2,-1.7 1,-0.2 3,-0.1 0.719 53.6 151.9 66.1 21.9 28.0 32.8 18.4 124 124 A Q - 0 0 87 1,-0.2 -1,-0.2 -7,-0.1 -5,-0.1 -0.641 25.1-172.0 -84.3 86.8 24.6 34.5 18.3 125 125 A L + 0 0 88 -2,-1.7 -8,-0.5 -3,-0.1 2,-0.4 0.812 54.9 58.6 -50.6 -44.4 25.2 36.6 21.3 126 126 A I - 0 0 48 -3,-0.1 2,-0.9 -9,-0.1 -34,-0.2 -0.814 64.1-147.8-103.0 141.7 21.9 38.0 21.8 127 127 A I - 0 0 0 -36,-2.8 2,-0.1 -2,-0.4 -109,-0.1 -0.871 32.7-137.0-101.7 104.4 18.5 36.5 22.3 128 128 A E - 0 0 125 -2,-0.9 13,-0.1 1,-0.1 -36,-0.0 -0.388 18.1-104.1 -67.2 143.4 16.1 38.8 20.7 129 129 A D - 0 0 78 1,-0.2 3,-0.3 -2,-0.1 -1,-0.1 -0.449 31.3-170.5 -65.7 121.9 12.8 39.8 22.3 130 130 A P > + 0 0 2 0, 0.0 3,-3.0 0, 0.0 -1,-0.2 0.512 52.6 109.5 -96.5 -4.8 10.1 38.0 20.4 131 131 A Y T 3 S+ 0 0 98 1,-0.3 7,-0.0 6,-0.1 -2,-0.0 0.824 88.6 32.1 -38.8 -51.5 7.1 39.8 22.0 132 132 A Y T 3 S+ 0 0 215 -3,-0.3 -1,-0.3 2,-0.0 2,-0.1 0.319 110.1 83.0 -94.3 8.3 6.2 41.6 18.8 133 133 A G S < S- 0 0 27 -3,-3.0 2,-0.2 1,-0.1 -4,-0.0 -0.135 77.0-106.9 -93.0-161.7 7.3 38.9 16.5 134 134 A N >> - 0 0 96 -2,-0.1 4,-1.5 -76,-0.0 3,-0.9 -0.510 44.0 -71.2-117.4-170.1 5.5 35.8 15.3 135 135 A D H 3> S+ 0 0 102 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.844 126.6 55.8 -54.1 -37.3 5.6 32.0 15.9 136 136 A A H 3> S+ 0 0 58 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.896 101.9 56.9 -67.6 -31.9 8.8 31.6 14.0 137 137 A D H <> S+ 0 0 64 -3,-0.9 4,-2.3 2,-0.2 -1,-0.2 0.926 106.9 49.5 -62.9 -37.1 10.5 34.1 16.2 138 138 A F H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.947 109.0 52.9 -66.0 -39.1 9.6 32.0 19.2 139 139 A E H X S+ 0 0 55 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.942 107.8 50.1 -62.4 -43.7 10.9 29.0 17.5 140 140 A T H X S+ 0 0 69 -4,-2.8 4,-2.7 1,-0.3 -1,-0.2 0.936 109.1 52.1 -66.0 -36.2 14.2 30.6 16.8 141 141 A V H X S+ 0 0 2 -4,-2.3 4,-2.4 2,-0.2 -1,-0.3 0.883 108.6 51.2 -60.7 -41.1 14.4 31.7 20.5 142 142 A Y H X S+ 0 0 30 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.974 109.5 51.0 -61.5 -48.5 13.8 28.1 21.5 143 143 A Q H X S+ 0 0 71 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.932 110.1 48.0 -53.8 -51.7 16.6 26.9 19.1 144 144 A Q H X S+ 0 0 10 -4,-2.7 4,-3.0 1,-0.2 -1,-0.2 0.930 111.2 52.0 -56.7 -46.6 19.1 29.4 20.5 145 145 A C H X S+ 0 0 0 -4,-2.4 4,-3.3 2,-0.2 5,-0.3 0.884 106.8 53.0 -56.4 -43.8 18.2 28.4 24.1 146 146 A V H X S+ 0 0 14 -4,-2.6 4,-2.6 2,-0.2 5,-0.3 0.970 112.4 43.7 -58.1 -54.2 18.7 24.7 23.3 147 147 A R H X S+ 0 0 57 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.943 118.2 44.5 -54.9 -54.1 22.2 25.4 21.9 148 148 A C H X S+ 0 0 0 -4,-3.0 4,-2.7 -5,-0.2 -1,-0.2 0.869 114.0 49.0 -60.4 -40.6 23.2 27.7 24.7 149 149 A C H X S+ 0 0 0 -4,-3.3 4,-2.0 -5,-0.2 -1,-0.2 0.870 111.5 48.0 -72.9 -33.8 21.7 25.5 27.5 150 150 A R H X S+ 0 0 135 -4,-2.6 4,-2.1 -5,-0.3 -2,-0.2 0.947 114.0 48.3 -67.2 -44.4 23.4 22.4 26.2 151 151 A A H X S+ 0 0 29 -4,-2.5 4,-1.6 -5,-0.3 -2,-0.2 0.940 112.3 48.3 -59.8 -45.2 26.7 24.3 25.9 152 152 A F H X S+ 0 0 0 -4,-2.7 4,-1.1 1,-0.2 5,-0.3 0.920 111.5 49.6 -57.7 -48.2 26.4 25.8 29.4 153 153 A L H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 3,-0.4 0.872 103.9 58.1 -63.3 -38.5 25.5 22.5 31.0 154 154 A E H < S+ 0 0 97 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.907 110.3 45.6 -63.9 -34.5 28.4 20.6 29.5 155 155 A K H < S+ 0 0 150 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.667 124.1 28.0 -84.1 -14.1 30.8 23.1 31.1 156 156 A V H < 0 0 16 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.460 360.0 360.0-120.5 -3.9 29.5 23.3 34.7 157 157 A R < 0 0 133 -4,-2.0 -4,-0.0 -5,-0.3 -3,-0.0 -0.331 360.0 360.0 -49.6 360.0 28.0 19.8 34.7