==== 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 23-OCT-08 2W22 . COMPND 2 MOLECULE: TRIACYLGLYCEROL LIPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS THERMOCATENULATUS; . AUTHOR C.CARRASCO-LOPEZ,C.GODOY,B.DE LAS RIVAS,G.FERNANDEZ-LORENTE, . 388 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16693.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 254 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 22 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 101 26.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.3 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 1 1 2 1 1 2 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 2 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 . 3 0 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 2 A A 0 0 139 0, 0.0 384,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-140.6 6.6 -34.7 1.6 2 3 A S - 0 0 73 2,-0.1 3,-0.2 3,-0.0 384,-0.0 0.985 360.0-143.8 65.7 82.0 9.0 -37.4 0.5 3 4 A P - 0 0 112 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.150 42.5 -31.8 -65.5-175.0 11.9 -36.9 3.1 4 5 A R + 0 0 120 1,-0.2 381,-0.3 383,-0.0 3,-0.1 -0.135 54.0 162.6 -45.8 112.6 15.7 -37.3 2.7 5 6 A A + 0 0 30 379,-3.2 2,-0.3 1,-0.3 380,-0.2 0.510 68.8 18.4-109.6 -12.2 16.6 -40.0 0.2 6 7 A N - 0 0 15 378,-1.6 -1,-0.3 381,-0.1 380,-0.1 -0.991 50.7-153.0-155.8 155.3 20.2 -38.9 -0.3 7 8 A D + 0 0 127 -2,-0.3 40,-0.2 -3,-0.1 377,-0.1 0.083 45.0 146.1-117.6 21.9 22.9 -36.8 1.4 8 9 A A - 0 0 14 375,-0.1 99,-0.2 1,-0.1 39,-0.1 -0.275 50.8-109.7 -59.4 143.2 24.8 -35.8 -1.7 9 10 A P - 0 0 2 0, 0.0 99,-3.2 0, 0.0 2,-0.4 -0.208 24.0-127.6 -73.4 167.3 26.3 -32.3 -1.6 10 11 A I E -ab 48 108A 3 37,-3.2 39,-2.4 97,-0.2 2,-0.4 -0.924 15.6-164.0-117.7 139.7 25.2 -29.3 -3.6 11 12 A V E -ab 49 109A 0 97,-2.6 99,-2.6 -2,-0.4 2,-0.4 -0.978 14.3-138.6-124.3 138.3 27.4 -27.0 -5.7 12 13 A L E -ab 50 110A 0 37,-2.5 39,-2.9 -2,-0.4 2,-0.5 -0.808 16.0-167.2 -96.9 134.1 26.3 -23.6 -6.9 13 14 A L E -ab 51 111A 0 97,-2.5 99,-2.1 -2,-0.4 102,-0.1 -0.922 7.9-151.6-130.0 107.9 27.2 -22.6 -10.5 14 15 A H - 0 0 2 37,-0.5 3,-0.1 -2,-0.5 39,-0.1 -0.130 10.0-139.3 -68.5 167.1 26.9 -19.0 -11.6 15 16 A G > - 0 0 0 1,-0.3 3,-1.5 99,-0.2 98,-0.1 0.131 57.0 -6.2-105.1-141.8 26.1 -17.8 -15.1 16 17 A F T 3 S- 0 0 87 1,-0.3 -1,-0.3 40,-0.1 40,-0.2 -0.343 133.7 -1.2 -60.8 129.1 27.4 -15.1 -17.4 17 18 A T T 3 S+ 0 0 53 38,-3.1 -1,-0.3 1,-0.2 39,-0.1 0.291 93.4 158.7 72.7 -6.9 29.7 -12.6 -15.6 18 19 A G < - 0 0 0 -3,-1.5 2,-0.3 37,-0.3 -1,-0.2 -0.095 24.0-156.0 -49.0 142.4 29.3 -14.6 -12.4 19 20 A W - 0 0 25 -3,-0.1 10,-0.4 4,-0.1 -1,-0.1 -0.836 14.0-106.4-122.7 158.4 32.0 -14.1 -9.8 20 21 A G > - 0 0 7 -2,-0.3 3,-2.0 185,-0.1 6,-0.2 -0.247 36.7 -97.8 -80.5 170.2 33.3 -16.2 -6.9 21 22 A R T 3 S+ 0 0 78 1,-0.3 5,-0.2 29,-0.1 -1,-0.1 0.796 122.1 54.5 -55.8 -32.1 32.9 -15.7 -3.1 22 23 A E T 3 S+ 0 0 163 3,-0.1 -1,-0.3 4,-0.1 3,-0.3 0.318 100.1 78.9 -88.7 10.6 36.3 -14.1 -2.8 23 24 A E S X S+ 0 0 12 -3,-2.0 3,-1.6 1,-0.2 180,-0.2 -0.651 79.4 32.4-112.6 170.8 35.5 -11.5 -5.5 24 25 A M G > S- 0 0 68 179,-3.1 3,-2.0 1,-0.3 -1,-0.2 0.792 124.9 -70.9 54.8 32.3 33.5 -8.2 -5.5 25 26 A L G 3 S- 0 0 159 177,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.784 95.3 -53.3 58.3 29.8 34.4 -7.5 -1.9 26 27 A G G < S+ 0 0 27 -3,-1.6 2,-0.5 1,-0.3 -1,-0.3 0.310 93.8 144.2 91.5 -11.5 32.2 -10.4 -0.7 27 28 A F < - 0 0 71 -3,-2.0 -1,-0.3 -4,-0.1 2,-0.3 -0.534 50.4-131.7 -64.0 116.7 29.0 -9.2 -2.5 28 29 A K > - 0 0 40 -2,-0.5 4,-2.4 4,-0.4 3,-0.3 -0.557 20.8-155.7 -82.0 134.1 27.6 -12.7 -3.4 29 30 A Y T 4 S+ 0 0 14 -10,-0.4 2,-1.4 -2,-0.3 335,-0.2 0.920 99.4 56.1 -66.5 -42.7 26.4 -13.7 -6.8 30 31 A W T 4 S+ 0 0 7 1,-0.2 7,-1.9 333,-0.1 8,-0.5 -0.620 128.6 6.9 -91.0 78.4 24.3 -16.3 -5.0 31 32 A G T >> S- 0 0 0 331,-2.5 3,-2.0 -2,-1.4 4,-0.7 -0.107 79.5-177.5 145.5 -42.1 22.4 -14.0 -2.6 32 33 A G G >< S- 0 0 10 -4,-2.4 3,-0.6 1,-0.3 -4,-0.4 -0.200 74.4 -14.4 52.4-132.7 23.2 -10.4 -3.5 33 34 A V G 34 S+ 0 0 87 330,-2.1 -1,-0.3 1,-0.2 331,-0.1 0.589 135.3 65.4 -77.5 -10.0 21.6 -7.9 -1.2 34 35 A R G <4 S- 0 0 69 -3,-2.0 2,-0.3 329,-0.7 -1,-0.2 0.730 111.0 -99.4 -84.8 -24.0 19.3 -10.5 0.2 35 36 A G << - 0 0 29 -4,-0.7 2,-0.5 -3,-0.6 -1,-0.2 -0.996 50.8 -37.9 147.9-151.3 22.1 -12.6 1.8 36 37 A D > - 0 0 32 -2,-0.3 4,-2.3 -5,-0.2 3,-0.3 -0.856 39.4-174.3-123.4 93.2 24.3 -15.7 1.4 37 38 A I H > S+ 0 0 0 -7,-1.9 4,-2.4 -2,-0.5 5,-0.2 0.867 85.7 54.3 -54.6 -44.1 22.4 -18.6 -0.2 38 39 A E H > S+ 0 0 23 -8,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.918 111.1 47.0 -58.1 -42.9 25.3 -21.1 0.3 39 40 A Q H > S+ 0 0 76 -3,-0.3 4,-3.3 2,-0.2 -2,-0.2 0.896 108.5 53.3 -66.6 -42.4 25.3 -20.3 4.0 40 41 A W H X S+ 0 0 40 -4,-2.3 4,-0.9 1,-0.2 -1,-0.2 0.934 112.9 45.6 -58.1 -45.8 21.6 -20.6 4.4 41 42 A L H ><>S+ 0 0 0 -4,-2.4 5,-2.3 1,-0.2 3,-0.7 0.928 113.8 47.9 -63.9 -45.4 21.8 -24.0 2.9 42 43 A N H ><5S+ 0 0 56 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.920 107.4 55.7 -62.6 -42.8 24.8 -25.0 5.0 43 44 A D H 3<5S+ 0 0 113 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.732 107.0 53.5 -61.5 -20.1 23.1 -23.8 8.2 44 45 A N T <<5S- 0 0 76 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.248 126.7 -94.3 -99.9 11.7 20.2 -26.1 7.3 45 46 A G T < 5S+ 0 0 50 -3,-2.0 2,-0.7 1,-0.2 -3,-0.2 0.628 85.1 126.3 89.4 12.2 22.2 -29.3 6.9 46 47 A Y < - 0 0 36 -5,-2.3 2,-0.3 -6,-0.1 -1,-0.2 -0.901 61.0-131.8-107.3 106.6 22.8 -29.2 3.2 47 48 A R - 0 0 91 -2,-0.7 -37,-3.2 -40,-0.2 2,-0.4 -0.399 38.6-179.8 -56.2 114.0 26.5 -29.5 2.4 48 49 A T E +a 10 0A 5 -2,-0.3 2,-0.3 -39,-0.2 -37,-0.2 -0.963 17.2 176.3-129.2 141.4 27.0 -26.7 -0.1 49 50 A Y E -a 11 0A 68 -39,-2.4 -37,-2.5 -2,-0.4 2,-0.5 -0.921 22.9-129.4-133.9 158.5 30.0 -25.3 -2.1 50 51 A T E -a 12 0A 26 -2,-0.3 2,-0.3 -39,-0.2 -37,-0.2 -0.944 12.8-150.4-118.2 129.3 30.3 -22.6 -4.7 51 52 A L E -a 13 0A 0 -39,-2.9 -37,-0.5 -2,-0.5 2,-0.3 -0.658 5.6-165.7 -92.6 150.0 32.0 -23.0 -8.1 52 53 A A + 0 0 20 -2,-0.3 2,-0.2 -39,-0.1 -32,-0.1 -0.775 23.0 156.7-139.5 91.3 33.7 -20.0 -9.8 53 54 A V - 0 0 0 -2,-0.3 9,-0.1 1,-0.2 10,-0.0 -0.552 56.0 -42.4-109.4 175.6 34.5 -20.6 -13.4 54 55 A G - 0 0 0 -2,-0.2 3,-0.2 1,-0.2 -1,-0.2 -0.081 47.3-159.2 -40.8 113.8 35.1 -18.4 -16.4 55 56 A P S S+ 0 0 0 0, 0.0 -38,-3.1 0, 0.0 -37,-0.3 0.778 93.2 26.2 -69.4 -26.2 32.4 -15.6 -16.2 56 57 A L S S+ 0 0 28 150,-0.5 184,-1.9 -40,-0.2 185,-0.4 0.300 103.1 108.8-118.8 7.8 32.8 -14.8 -20.0 57 58 A S S S- 0 0 3 -3,-0.2 182,-0.2 182,-0.2 -40,-0.1 -0.291 74.5 -89.8 -86.5 168.5 34.0 -18.2 -21.3 58 59 A S > - 0 0 1 180,-0.5 4,-2.6 1,-0.1 182,-0.2 -0.306 37.9-112.7 -69.5 158.2 32.3 -20.8 -23.4 59 60 A N H > S+ 0 0 0 180,-0.3 4,-2.5 1,-0.2 5,-0.2 0.844 117.6 59.0 -63.0 -31.5 30.4 -23.6 -21.6 60 61 A W H > S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.976 109.4 41.5 -60.7 -55.3 33.1 -26.0 -22.7 61 62 A D H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.931 116.5 49.7 -56.6 -47.5 35.9 -24.1 -21.0 62 63 A R H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.835 109.5 52.2 -61.8 -34.3 33.7 -23.5 -17.9 63 64 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.921 109.8 47.9 -68.6 -43.8 32.8 -27.2 -17.8 64 65 A C H X S+ 0 0 2 -4,-2.4 4,-1.9 2,-0.2 12,-0.3 0.887 114.0 47.6 -63.7 -38.2 36.5 -28.3 -17.9 65 66 A E H X S+ 0 0 10 -4,-2.3 4,-2.7 -5,-0.2 -2,-0.2 0.920 110.5 51.5 -68.9 -42.4 37.2 -25.7 -15.2 66 67 A A H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.915 107.9 53.4 -59.4 -44.3 34.2 -27.0 -13.1 67 68 A Y H X S+ 0 0 36 -4,-2.6 4,-2.4 1,-0.2 5,-0.4 0.916 111.9 43.9 -57.0 -47.0 35.5 -30.5 -13.4 68 69 A A H X S+ 0 0 4 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.900 111.1 53.7 -67.3 -40.9 39.0 -29.6 -12.1 69 70 A Q H < S+ 0 0 12 -4,-2.7 28,-2.2 2,-0.2 -1,-0.2 0.814 114.0 44.6 -62.8 -29.9 37.5 -27.5 -9.3 70 71 A L H < S+ 0 0 0 -4,-1.8 28,-3.1 26,-0.2 -2,-0.2 0.956 128.3 21.2 -80.2 -55.5 35.4 -30.4 -8.2 71 72 A V H < S- 0 0 10 -4,-2.4 -3,-0.2 25,-0.2 -2,-0.2 0.568 109.6-119.7 -92.5 -9.4 37.9 -33.4 -8.3 72 73 A G < + 0 0 17 -4,-2.3 2,-0.2 -5,-0.4 -1,-0.2 0.057 60.8 93.8 88.3 157.1 41.1 -31.3 -8.1 73 74 A G E S-H 94 0B 32 21,-3.6 21,-3.0 -4,-0.1 2,-0.5 -0.678 77.3 -38.3 119.0-173.7 43.9 -31.1 -10.5 74 75 A T E -H 93 0B 66 19,-0.3 19,-0.3 -2,-0.2 18,-0.1 -0.779 64.9-105.3 -94.3 130.3 45.0 -28.9 -13.4 75 76 A V E - 0 0 1 17,-3.1 16,-2.3 -2,-0.5 2,-0.5 -0.282 36.1-167.1 -53.1 129.6 42.3 -27.6 -15.8 76 77 A D E -H 90 0B 18 -12,-0.3 14,-0.2 14,-0.2 13,-0.1 -0.927 13.9-177.1-125.8 104.3 42.6 -29.5 -19.1 77 78 A Y - 0 0 7 12,-3.0 4,-0.2 -2,-0.5 13,-0.1 0.599 56.2 -94.8 -76.4 -10.6 40.5 -28.0 -21.9 78 79 A G > - 0 0 1 11,-0.4 4,-3.1 3,-0.1 5,-0.2 0.312 19.7-114.9 101.3 128.5 41.5 -30.8 -24.3 79 80 A A H > S+ 0 0 15 64,-0.3 4,-2.0 2,-0.2 5,-0.2 0.855 117.0 48.2 -63.4 -36.1 44.3 -30.9 -26.8 80 81 A A H > S+ 0 0 6 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.954 115.4 44.2 -68.6 -49.4 41.9 -31.1 -29.7 81 82 A H H > S+ 0 0 7 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.920 113.6 50.0 -60.9 -47.1 39.8 -28.2 -28.4 82 83 A A H X>S+ 0 0 7 -4,-3.1 5,-1.4 1,-0.2 4,-1.4 0.928 113.6 45.8 -58.7 -46.6 42.9 -26.1 -27.5 83 84 A A H <5S+ 0 0 63 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.904 111.9 52.7 -62.7 -43.7 44.4 -26.6 -31.0 84 85 A K H <5S+ 0 0 121 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.897 119.4 31.5 -61.5 -44.6 41.1 -25.9 -32.7 85 86 A H H <5S- 0 0 39 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.510 106.8-116.8 -96.7 -3.9 40.4 -22.5 -31.0 86 87 A G T <5S+ 0 0 45 -4,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.856 70.3 112.9 77.1 35.5 44.0 -21.3 -30.4 87 88 A H S + 0 0 0 -28,-3.1 3,-3.1 -29,-0.2 4,-0.2 -0.342 61.2 161.2-142.1 59.0 34.7 -32.8 -3.7 99 100 A P G > + 0 0 40 0, 0.0 3,-2.2 0, 0.0 4,-0.2 0.672 69.9 82.8 -53.5 -15.2 37.3 -35.5 -4.6 100 101 A E G > >S+ 0 0 60 1,-0.3 5,-2.1 2,-0.2 3,-1.4 0.722 75.0 71.4 -61.5 -21.3 34.7 -37.9 -3.1 101 102 A L G X 5S+ 0 0 9 -3,-3.1 3,-0.6 1,-0.3 -1,-0.3 0.684 87.5 65.2 -69.0 -15.9 33.1 -37.7 -6.6 102 103 A K G < 5S+ 0 0 129 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.617 107.6 38.6 -80.6 -14.5 36.1 -39.8 -7.8 103 104 A R G < 5S- 0 0 176 -3,-1.4 -1,-0.2 -4,-0.2 -2,-0.1 -0.170 135.7 -56.2-133.6 48.4 35.1 -42.8 -5.7 104 105 A G T < 5S+ 0 0 69 -3,-0.6 -3,-0.2 1,-0.3 -4,-0.1 0.067 90.4 128.5 110.7 -26.8 31.3 -43.2 -5.7 105 106 A G < - 0 0 23 -5,-2.1 -1,-0.3 -6,-0.1 2,-0.3 -0.180 39.8-155.2 -63.5 159.1 30.0 -39.8 -4.5 106 107 A R - 0 0 54 49,-0.1 2,-0.3 50,-0.0 49,-0.2 -0.854 4.8-150.2-129.6 164.4 27.4 -37.9 -6.4 107 108 A V E - c 0 155A 0 47,-1.7 49,-2.0 -2,-0.3 50,-1.4 -0.992 12.0-136.5-143.5 149.0 26.5 -34.2 -6.5 108 109 A H E -bc 10 157A 2 -99,-3.2 -97,-2.6 -2,-0.3 2,-0.5 -0.869 22.2-156.6-100.0 132.9 23.5 -31.8 -7.0 109 110 A I E -bc 11 158A 0 48,-2.3 50,-3.0 -2,-0.5 2,-0.6 -0.953 8.1-169.6-115.4 123.5 24.2 -28.8 -9.2 110 111 A I E -bc 12 159A 0 -99,-2.6 -97,-2.5 -2,-0.5 2,-0.3 -0.954 18.8-177.5-110.4 115.2 22.1 -25.7 -8.9 111 112 A A E -bc 13 160A 0 48,-3.5 50,-2.1 -2,-0.6 2,-0.4 -0.858 19.3-146.5-119.5 151.6 22.9 -23.3 -11.7 112 113 A H E > - c 0 161A 2 -99,-2.1 3,-2.5 -2,-0.3 50,-0.2 -0.935 60.1 -46.1-117.1 136.9 21.7 -19.8 -12.8 113 114 A S T > S+ 0 0 6 48,-3.1 3,-3.0 -2,-0.4 4,-0.5 -0.135 135.3 13.5 44.3-123.7 21.3 -18.7 -16.3 114 115 A Q T >> S+ 0 0 0 1,-0.3 4,-1.8 2,-0.2 3,-1.4 0.789 117.6 73.8 -49.4 -31.1 24.4 -19.7 -18.4 115 116 A G H <> S+ 0 0 0 -3,-2.5 4,-2.7 1,-0.3 -1,-0.3 0.795 87.1 64.8 -53.2 -28.0 25.4 -22.0 -15.5 116 117 A G H <> S+ 0 0 0 -3,-3.0 4,-1.8 1,-0.2 -1,-0.3 0.865 102.3 45.7 -63.5 -38.6 22.6 -24.2 -16.8 117 118 A Q H <> S+ 0 0 0 -3,-1.4 4,-2.3 -4,-0.5 -1,-0.2 0.889 112.3 51.4 -71.0 -40.6 24.3 -24.8 -20.1 118 119 A T H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.937 109.8 49.5 -61.9 -46.6 27.6 -25.5 -18.3 119 120 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.914 110.9 48.9 -58.7 -47.3 26.0 -28.0 -16.0 120 121 A R H X S+ 0 0 3 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.912 113.2 48.1 -59.8 -42.9 24.3 -29.9 -18.8 121 122 A M H X S+ 0 0 4 -4,-2.3 4,-2.9 2,-0.2 5,-0.3 0.887 107.7 54.1 -67.4 -39.4 27.6 -30.0 -20.7 122 123 A L H X S+ 0 0 1 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.936 111.2 46.8 -59.4 -45.2 29.6 -31.2 -17.7 123 124 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.918 112.3 49.8 -62.9 -44.0 27.1 -34.1 -17.4 124 125 A S H X>S+ 0 0 4 -4,-2.3 4,-3.2 1,-0.2 5,-0.6 0.918 113.6 45.3 -62.3 -43.7 27.2 -34.9 -21.1 125 126 A L H X5S+ 0 0 0 -4,-2.9 4,-2.2 3,-0.2 -2,-0.2 0.916 112.8 50.6 -66.7 -42.9 31.0 -34.9 -21.1 126 127 A L H <5S+ 0 0 2 -4,-2.7 26,-2.3 -5,-0.3 -2,-0.2 0.943 119.0 38.3 -58.3 -47.1 31.2 -37.0 -17.9 127 128 A E H <5S+ 0 0 25 -4,-2.6 24,-2.3 24,-0.2 -2,-0.2 0.917 136.8 14.8 -70.4 -49.9 28.7 -39.5 -19.4 128 129 A N H <5S- 0 0 100 -4,-3.2 -3,-0.2 22,-0.2 -2,-0.2 0.613 86.5-158.4-105.6 -15.3 29.9 -39.6 -23.0 129 130 A G << - 0 0 7 -4,-2.2 2,-0.4 -5,-0.6 -1,-0.2 -0.353 42.6 -62.0 67.1-153.4 33.3 -38.0 -22.9 130 131 A S > - 0 0 16 18,-1.9 4,-2.5 1,-0.1 5,-0.2 -0.928 33.7-165.4-137.1 111.0 34.5 -36.6 -26.2 131 132 A Q H > S+ 0 0 134 -2,-0.4 4,-3.0 1,-0.2 5,-0.2 0.909 95.5 54.1 -57.8 -42.6 35.1 -38.8 -29.2 132 133 A E H > S+ 0 0 96 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.888 110.2 45.5 -59.8 -42.3 37.0 -36.0 -30.9 133 134 A E H > S+ 0 0 4 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.876 113.5 50.3 -70.2 -37.2 39.3 -35.6 -27.9 134 135 A R H X S+ 0 0 64 -4,-2.5 4,-2.2 14,-0.2 5,-0.2 0.940 112.9 45.3 -65.6 -47.4 39.8 -39.4 -27.6 135 136 A E H X S+ 0 0 97 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.919 114.5 48.8 -62.8 -43.3 40.7 -39.7 -31.3 136 137 A Y H X S+ 0 0 76 -4,-2.2 4,-2.3 -5,-0.2 5,-0.2 0.933 110.5 50.5 -63.1 -45.4 43.0 -36.7 -31.2 137 138 A A H X>S+ 0 0 7 -4,-2.5 5,-2.2 1,-0.2 4,-0.6 0.910 115.2 42.0 -59.6 -45.2 44.8 -37.9 -28.1 138 139 A K H <5S+ 0 0 141 -4,-2.2 -1,-0.2 3,-0.2 -2,-0.2 0.883 114.5 51.8 -70.9 -38.0 45.4 -41.4 -29.5 139 140 A A H <5S+ 0 0 78 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.829 122.1 30.0 -68.7 -34.0 46.4 -40.0 -33.0 140 141 A H H <5S- 0 0 110 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.357 107.2-122.7-106.7 4.8 48.9 -37.6 -31.7 141 142 A N T <5 + 0 0 148 -4,-0.6 2,-0.3 -5,-0.2 -3,-0.2 0.943 61.9 138.9 52.5 57.2 49.9 -39.7 -28.7 142 143 A V < - 0 0 57 -5,-2.2 -1,-0.2 -6,-0.2 -2,-0.1 -0.862 57.8 -85.7-123.7 161.3 49.1 -37.0 -26.0 143 144 A S - 0 0 77 -2,-0.3 2,-0.4 1,-0.1 -64,-0.3 -0.191 37.2-142.2 -65.1 157.4 47.5 -37.5 -22.6 144 145 A L - 0 0 52 -66,-0.1 5,-0.1 -65,-0.1 -1,-0.1 -0.983 14.5-121.4-126.5 131.7 43.7 -37.4 -22.2 145 146 A S > - 0 0 9 -2,-0.4 3,-2.3 1,-0.1 4,-0.3 -0.451 24.0-124.6 -67.9 139.4 41.7 -35.9 -19.4 146 147 A P G >> S+ 0 0 57 0, 0.0 3,-1.9 0, 0.0 4,-0.7 0.825 108.2 72.5 -53.7 -29.1 39.5 -38.5 -17.6 147 148 A L G 34 S+ 0 0 0 1,-0.3 -18,-0.2 2,-0.2 5,-0.1 0.745 95.8 49.2 -58.7 -25.1 36.6 -36.1 -18.4 148 149 A F G <4 S+ 0 0 1 -3,-2.3 -18,-1.9 -19,-0.2 -1,-0.3 0.414 93.3 78.5 -96.6 3.4 36.8 -37.0 -22.1 149 150 A E T <4 S- 0 0 101 -3,-1.9 -2,-0.2 -4,-0.3 -1,-0.1 0.907 85.4-144.9 -76.3 -43.8 36.8 -40.8 -21.4 150 151 A G < + 0 0 16 -4,-0.7 -22,-0.2 -25,-0.2 -23,-0.2 -0.259 65.9 92.4 96.3 169.6 33.1 -41.2 -20.8 151 152 A G + 0 0 50 -24,-2.3 2,-0.4 1,-0.3 -24,-0.2 0.584 59.1 122.7 84.4 9.1 31.6 -43.7 -18.3 152 153 A H + 0 0 64 -26,-2.3 -1,-0.3 -27,-0.2 -23,-0.1 -0.870 29.4 171.7-107.8 140.9 31.4 -41.3 -15.3 153 154 A H + 0 0 85 -2,-0.4 -1,-0.1 -52,-0.1 -30,-0.1 -0.126 27.4 133.1-138.8 41.7 28.2 -40.4 -13.5 154 155 A F + 0 0 15 -48,-0.1 -47,-1.7 -53,-0.1 2,-0.7 0.600 52.5 88.5 -75.5 -5.5 29.0 -38.4 -10.4 155 156 A V E +c 107 0A 2 -49,-0.2 -47,-0.2 1,-0.2 3,-0.1 -0.811 49.4 178.5 -94.3 114.9 26.3 -35.7 -11.1 156 157 A L E + 0 0 1 -49,-2.0 107,-2.4 -2,-0.7 2,-0.3 0.877 65.2 5.4 -81.7 -40.0 23.0 -36.8 -9.6 157 158 A S E -cd 108 263A 0 -50,-1.4 -48,-2.3 105,-0.2 2,-0.4 -0.993 51.8-155.7-148.6 154.7 20.9 -33.7 -10.5 158 159 A V E -cd 109 264A 0 105,-2.4 107,-2.8 -2,-0.3 2,-0.5 -0.992 13.2-173.0-130.2 120.3 21.1 -30.5 -12.5 159 160 A T E -cd 110 265A 0 -50,-3.0 -48,-3.5 -2,-0.4 2,-0.4 -0.969 6.9-163.6-116.0 125.7 18.7 -27.6 -11.6 160 161 A T E -cd 111 266A 0 105,-3.0 107,-2.6 -2,-0.5 2,-0.5 -0.913 5.1-163.8-114.1 137.8 18.6 -24.6 -13.8 161 162 A I E S-cd 112 267A 0 -50,-2.1 -48,-3.1 -2,-0.4 107,-0.2 -0.973 77.1 -19.2-121.4 118.7 17.2 -21.2 -12.9 162 163 A A S S+ 0 0 0 105,-2.4 -1,-0.1 -2,-0.5 106,-0.1 0.806 89.3 169.9 56.9 31.9 16.4 -18.7 -15.7 163 164 A T - 0 0 0 104,-0.4 2,-2.1 162,-0.3 3,-0.2 -0.591 38.5-135.3 -80.2 129.9 18.7 -20.7 -18.0 164 165 A P > + 0 0 0 0, 0.0 3,-1.8 0, 0.0 161,-0.2 -0.467 36.0 166.0 -81.0 71.3 18.6 -19.7 -21.7 165 166 A H T 3 S+ 0 0 0 -2,-2.1 160,-0.1 159,-1.2 88,-0.1 0.778 83.0 33.1 -57.5 -29.3 18.6 -23.3 -23.0 166 167 A D T 3 S- 0 0 3 158,-0.5 -1,-0.3 1,-0.5 84,-0.2 0.184 124.8-106.8-110.0 13.4 17.6 -22.1 -26.4 167 168 A G < - 0 0 0 -3,-1.8 -1,-0.5 157,-0.2 2,-0.4 -0.251 32.4 -89.6 89.3 179.2 19.6 -18.9 -26.1 168 169 A T > - 0 0 8 76,-1.9 3,-1.4 152,-0.1 4,-0.4 -0.996 14.1-136.9-133.3 138.8 18.4 -15.4 -25.6 169 170 A T T >> S+ 0 0 0 -2,-0.4 4,-1.3 1,-0.3 3,-0.7 0.582 93.0 88.4 -69.6 -7.6 17.5 -12.8 -28.3 170 171 A L H 3> S+ 0 0 29 149,-0.4 4,-1.7 1,-0.3 -1,-0.3 0.858 82.9 57.8 -57.5 -33.6 19.5 -10.3 -26.2 171 172 A V H <> S+ 0 0 13 -3,-1.4 4,-2.0 1,-0.2 -1,-0.3 0.858 98.3 60.1 -65.1 -33.1 22.5 -11.4 -28.2 172 173 A N H <> S+ 0 0 24 -3,-0.7 4,-1.4 -4,-0.4 -1,-0.2 0.877 102.9 50.8 -62.3 -37.1 20.6 -10.4 -31.3 173 174 A M H X S+ 0 0 34 -4,-1.3 4,-2.3 -3,-0.3 3,-0.3 0.915 107.8 52.9 -66.0 -41.4 20.5 -6.8 -30.0 174 175 A V H X S+ 0 0 27 -4,-1.7 4,-1.0 1,-0.2 9,-0.2 0.864 103.9 57.7 -60.6 -35.8 24.2 -7.0 -29.4 175 176 A D H < S+ 0 0 71 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.888 107.6 46.7 -62.6 -38.9 24.6 -8.1 -33.0 176 177 A F H >< S+ 0 0 95 -4,-1.4 3,-1.3 -3,-0.3 -2,-0.2 0.919 110.2 51.6 -68.2 -44.9 22.9 -4.9 -34.2 177 178 A T H >< S+ 0 0 61 -4,-2.3 3,-1.3 1,-0.2 -1,-0.2 0.654 93.5 77.7 -66.4 -15.3 24.9 -2.6 -31.9 178 179 A D T 3< S+ 0 0 43 -4,-1.0 -1,-0.2 1,-0.3 -2,-0.2 0.804 73.1 75.7 -65.9 -29.4 28.1 -4.3 -33.3 179 180 A R T < S+ 0 0 179 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.776 123.5 2.7 -52.3 -24.2 27.8 -2.2 -36.5 180 181 A F S < S+ 0 0 166 -3,-1.3 2,-0.6 1,-0.3 -2,-0.1 0.337 134.2 35.5-123.8-102.5 29.1 0.6 -34.2 181 182 A F S S- 0 0 127 1,-0.1 2,-1.2 -4,-0.0 -1,-0.3 -0.457 70.5-154.2 -63.4 107.6 30.0 -0.1 -30.5 182 183 A D > - 0 0 51 -2,-0.6 4,-1.7 1,-0.2 5,-0.2 -0.728 10.4-171.4 -88.2 96.3 31.4 -3.7 -30.5 183 184 A L H > S+ 0 0 75 -2,-1.2 4,-2.5 -9,-0.2 5,-0.2 0.881 77.8 51.0 -55.5 -49.0 30.7 -4.8 -27.0 184 185 A Q H > S+ 0 0 35 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.937 111.3 47.0 -59.0 -49.1 32.7 -8.1 -27.0 185 186 A K H > S+ 0 0 78 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.846 112.4 52.0 -61.7 -33.4 35.9 -6.5 -28.3 186 187 A A H X S+ 0 0 33 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.925 109.3 48.3 -68.6 -44.6 35.5 -3.7 -25.7 187 188 A V H X S+ 0 0 49 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.871 111.3 51.3 -63.2 -38.0 35.1 -6.1 -22.8 188 189 A L H X S+ 0 0 15 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.908 108.1 50.6 -66.2 -43.2 38.2 -8.1 -24.0 189 190 A K H X S+ 0 0 124 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.899 110.6 50.1 -61.7 -40.9 40.4 -5.0 -24.2 190 191 A A H X S+ 0 0 54 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.900 110.6 49.3 -63.8 -41.5 39.3 -4.0 -20.6 191 192 A A H X S+ 0 0 2 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.857 107.7 55.5 -65.6 -35.2 40.1 -7.5 -19.5 192 193 A A H < S+ 0 0 7 -4,-2.2 4,-0.4 2,-0.2 -2,-0.2 0.934 110.0 45.4 -62.6 -46.1 43.5 -7.2 -21.2 193 194 A V H >X S+ 0 0 94 -4,-2.2 3,-1.9 1,-0.2 4,-0.8 0.959 111.8 51.3 -61.2 -52.5 44.3 -4.1 -19.3 194 195 A A H >< S+ 0 0 15 -4,-2.6 3,-0.7 1,-0.3 7,-0.3 0.826 97.1 67.5 -55.0 -37.1 43.1 -5.5 -15.9 195 196 A S T 3< S+ 0 0 36 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.701 105.5 44.2 -59.4 -18.5 45.3 -8.6 -16.3 196 197 A N T <4 S+ 0 0 55 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.659 92.3 92.4-100.1 -20.2 48.3 -6.3 -16.0 197 198 A V S << S- 0 0 70 -4,-0.8 4,-0.5 -3,-0.7 3,-0.4 -0.671 78.2-127.1 -82.1 126.5 47.0 -4.2 -13.0 198 199 A P S S+ 0 0 102 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.818 91.8 19.0 -31.2 -77.4 48.2 -5.6 -9.6 199 200 A Y S >> S+ 0 0 194 1,-0.2 3,-2.3 2,-0.1 4,-0.6 0.555 91.4 101.1 -86.9 -8.9 45.1 -6.1 -7.3 200 201 A T H >> S+ 0 0 44 -3,-0.4 4,-2.5 1,-0.3 3,-2.4 0.862 75.2 61.4 -41.7 -52.9 42.2 -6.1 -9.9 201 202 A S H 34 S+ 0 0 62 -4,-0.5 -1,-0.3 -3,-0.3 4,-0.2 0.703 94.3 64.8 -51.6 -22.7 41.8 -9.9 -9.9 202 203 A Q H <4 S+ 0 0 120 -3,-2.3 -177,-0.4 2,-0.2 -1,-0.3 0.803 113.3 32.3 -71.1 -29.1 41.0 -9.7 -6.1 203 204 A V H << S+ 0 0 65 -3,-2.4 -179,-3.1 -4,-0.6 2,-0.3 0.850 141.7 3.3 -93.1 -46.0 37.8 -7.7 -7.0 204 205 A Y < - 0 0 48 -4,-2.5 2,-0.7 -181,-0.2 -1,-0.3 -0.848 64.9-163.0-148.7 108.8 37.0 -9.2 -10.4 205 206 A D - 0 0 32 -2,-0.3 -185,-0.1 -4,-0.2 -4,-0.1 -0.828 3.2-164.3 -95.8 111.2 39.0 -12.1 -11.9 206 207 A F - 0 0 45 -2,-0.7 -150,-0.5 -15,-0.1 -1,-0.1 0.729 18.3-151.2 -65.9 -24.7 38.3 -12.4 -15.6 207 208 A K + 0 0 12 1,-0.1 -151,-0.1 -153,-0.1 3,-0.1 0.942 50.2 134.4 49.4 58.4 39.8 -15.9 -15.7 208 209 A L > + 0 0 13 1,-0.1 3,-2.4 -17,-0.1 5,-0.5 -0.030 16.5 133.7-121.7 25.3 40.9 -15.7 -19.3 209 210 A D G > + 0 0 85 1,-0.3 3,-2.3 2,-0.2 5,-0.1 0.822 60.7 68.4 -43.8 -43.6 44.4 -17.1 -18.6 210 211 A Q G 3 S+ 0 0 9 1,-0.3 -122,-2.2 -3,-0.1 -1,-0.3 0.691 97.3 52.8 -55.3 -21.8 44.1 -19.4 -21.7 211 212 A W G < S- 0 0 23 -3,-2.4 -1,-0.3 -124,-0.2 -2,-0.2 0.521 101.8-132.6 -93.2 -5.5 44.3 -16.5 -24.0 212 213 A G < + 0 0 30 -3,-2.3 -3,-0.1 -4,-0.4 4,-0.1 0.919 43.1 163.3 55.1 49.2 47.4 -15.0 -22.5 213 214 A L + 0 0 11 -5,-0.5 2,-0.2 2,-0.1 -1,-0.1 0.703 46.8 81.5 -71.7 -22.1 46.0 -11.5 -22.3 214 215 A R S S- 0 0 148 -5,-0.1 2,-0.2 -19,-0.1 -21,-0.1 -0.613 92.1 -99.7 -90.6 149.2 48.6 -10.2 -19.9 215 216 A R - 0 0 95 -2,-0.2 -1,-0.1 -23,-0.2 -2,-0.1 -0.444 43.7-124.5 -64.1 127.4 52.1 -9.0 -20.8 216 217 A Q > - 0 0 95 -2,-0.2 3,-2.0 -4,-0.1 8,-0.1 -0.349 33.9 -83.9 -74.3 156.1 54.6 -11.8 -20.1 217 218 A P T 3 S+ 0 0 127 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 0.707 120.2 14.4 -19.7 -77.7 57.7 -11.3 -17.9 218 219 A G T 3 S+ 0 0 81 2,-0.0 2,-0.3 0, 0.0 -2,-0.1 0.243 95.2 129.8 -96.7 16.1 60.4 -9.8 -20.1 219 220 A E < - 0 0 12 -3,-2.0 2,-0.1 1,-0.1 -4,-0.0 -0.520 53.2-134.5 -75.1 128.9 58.0 -8.9 -22.9 220 221 A S > - 0 0 67 -2,-0.3 4,-3.1 1,-0.1 5,-0.2 -0.457 21.8-114.7 -78.9 155.1 58.2 -5.3 -24.2 221 222 A F H > S+ 0 0 148 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.886 117.5 55.7 -55.9 -40.0 55.0 -3.3 -24.7 222 223 A D H > S+ 0 0 117 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.926 112.2 40.3 -59.0 -48.1 55.8 -3.2 -28.4 223 224 A H H > S+ 0 0 101 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.922 115.2 53.7 -67.2 -43.8 56.0 -7.0 -28.6 224 225 A Y H X S+ 0 0 14 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.921 108.4 48.4 -55.8 -49.8 53.0 -7.4 -26.3 225 226 A F H X S+ 0 0 106 -4,-3.2 4,-1.8 1,-0.2 -1,-0.2 0.889 112.5 48.8 -60.1 -42.4 50.8 -5.1 -28.5 226 227 A E H X S+ 0 0 58 -4,-1.7 4,-1.1 -5,-0.2 -1,-0.2 0.887 110.5 50.7 -66.3 -40.1 51.8 -7.0 -31.6 227 228 A R H >< S+ 0 0 63 -4,-2.6 3,-0.6 1,-0.2 4,-0.5 0.932 108.9 51.7 -64.0 -45.0 51.1 -10.4 -30.0 228 229 A L H >< S+ 0 0 23 -4,-2.5 3,-1.4 1,-0.2 -1,-0.2 0.877 103.5 57.3 -59.2 -41.0 47.7 -9.3 -28.9 229 230 A K H 3< S+ 0 0 114 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.834 107.7 49.2 -60.2 -31.9 46.7 -8.1 -32.3 230 231 A R T << S+ 0 0 177 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.503 84.1 119.6 -86.3 -4.9 47.3 -11.6 -33.6 231 232 A S X - 0 0 22 -3,-1.4 3,-0.7 -4,-0.5 4,-0.2 -0.340 60.2-145.0 -63.0 137.7 45.3 -13.3 -30.9 232 233 A P G > S+ 0 0 56 0, 0.0 3,-0.6 0, 0.0 4,-0.2 0.521 83.5 90.3 -81.4 -2.4 42.4 -15.3 -32.2 233 234 A V G > S+ 0 0 3 1,-0.2 3,-0.9 2,-0.2 -5,-0.0 0.825 75.4 63.3 -62.6 -33.6 40.3 -14.4 -29.2 234 235 A W G < S+ 0 0 42 -3,-0.7 -1,-0.2 1,-0.2 -49,-0.1 0.849 116.1 28.4 -60.9 -37.1 38.9 -11.3 -30.8 235 236 A T G < S+ 0 0 116 -3,-0.6 -1,-0.2 -4,-0.2 -2,-0.2 0.155 94.2 130.1-110.8 17.2 37.1 -13.3 -33.5 236 237 A S < - 0 0 15 -3,-0.9 6,-0.1 -4,-0.2 -3,-0.1 -0.439 46.5-161.7 -78.0 145.4 36.5 -16.5 -31.5 237 238 A T S S+ 0 0 74 -2,-0.1 2,-2.0 1,-0.1 6,-0.2 0.403 75.1 96.6 -98.2 -3.1 33.2 -18.3 -31.2 238 239 A D + 0 0 9 -153,-0.1 -180,-0.5 4,-0.1 2,-0.3 -0.481 68.1 100.8 -85.5 65.8 34.7 -20.1 -28.2 239 240 A T S > S- 0 0 14 -2,-2.0 4,-1.6 -182,-0.2 -180,-0.3 -0.930 85.9-110.8-144.3 164.3 33.0 -17.6 -25.9 240 241 A A H > S+ 0 0 0 -184,-1.9 4,-2.2 -2,-0.3 5,-0.2 0.905 114.2 62.9 -65.6 -40.7 29.9 -17.3 -23.7 241 242 A R H > S+ 0 0 52 -185,-0.4 4,-1.0 1,-0.2 -1,-0.2 0.873 105.5 45.5 -52.0 -41.8 28.4 -14.8 -26.1 242 243 A Y H >4 S+ 0 0 59 1,-0.2 3,-0.5 2,-0.2 6,-0.3 0.927 112.8 47.9 -70.1 -46.1 28.3 -17.4 -28.9 243 244 A D H 3< S+ 0 0 21 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.775 112.7 52.1 -64.8 -25.5 26.9 -20.3 -26.7 244 245 A L H 3< S+ 0 0 14 -4,-2.2 -76,-1.9 -5,-0.2 -1,-0.2 0.701 92.3 91.9 -84.2 -20.9 24.3 -17.8 -25.4 245 246 A S S S+ 0 0 8 -78,-0.2 4,-1.4 2,-0.2 5,-0.1 0.949 120.0 38.5 -64.6 -51.1 20.2 -18.4 -30.7 247 248 A P H > S+ 0 0 69 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.893 117.5 51.1 -69.2 -35.3 22.3 -20.3 -33.2 248 249 A G H > S+ 0 0 1 -6,-0.3 4,-1.5 1,-0.2 -2,-0.2 0.870 107.7 51.9 -67.7 -37.0 25.1 -21.0 -30.7 249 250 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.847 109.0 50.8 -68.3 -34.6 22.6 -22.5 -28.1 250 251 A E H X S+ 0 0 61 -4,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.908 106.2 53.7 -70.1 -42.7 21.1 -24.8 -30.7 251 252 A K H X S+ 0 0 115 -4,-1.9 4,-0.6 1,-0.2 -1,-0.2 0.891 110.6 48.8 -57.7 -37.2 24.5 -26.1 -31.7 252 253 A L H >X S+ 0 0 3 -4,-1.5 4,-2.5 1,-0.2 3,-1.0 0.908 108.7 52.6 -68.4 -42.0 25.1 -26.9 -28.0 253 254 A N H 3< S+ 0 0 0 -4,-2.1 80,-0.3 1,-0.2 -1,-0.2 0.764 96.1 70.4 -65.3 -25.4 21.7 -28.6 -27.8 254 255 A Q H 3< S+ 0 0 110 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.815 118.7 15.0 -63.9 -29.9 22.6 -30.8 -30.8 255 256 A W H << S+ 0 0 104 -3,-1.0 2,-1.1 -4,-0.6 -2,-0.2 0.627 108.3 81.8-118.6 -19.6 25.2 -32.7 -28.7 256 257 A V < + 0 0 0 -4,-2.5 2,-0.3 -5,-0.2 -1,-0.1 -0.754 64.9 171.3 -92.5 99.0 24.5 -31.9 -25.1 257 258 A Q - 0 0 93 -2,-1.1 2,-0.3 -137,-0.1 -3,-0.0 -0.716 39.9 -90.1-111.6 159.3 21.6 -34.2 -24.2 258 259 A A - 0 0 20 -2,-0.3 -1,-0.1 88,-0.1 90,-0.0 -0.472 41.0-133.0 -67.7 123.6 19.8 -35.2 -21.0 259 260 A S > - 0 0 6 -2,-0.3 3,-1.4 1,-0.1 87,-0.6 -0.582 5.4-137.6 -78.3 138.2 21.5 -38.2 -19.3 260 261 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 87,-0.1 0.667 103.4 58.0 -69.5 -13.7 19.1 -41.0 -18.2 261 262 A N T 3 S+ 0 0 66 84,-0.1 2,-0.4 85,-0.1 -2,-0.0 0.389 98.8 73.7 -95.1 2.6 21.0 -41.3 -15.0 262 263 A T S < S- 0 0 0 -3,-1.4 84,-2.4 -105,-0.0 2,-0.3 -0.945 72.6-134.1-125.0 140.3 20.5 -37.7 -14.0 263 264 A Y E -dE 157 345A 21 -107,-2.4 -105,-2.4 -2,-0.4 2,-0.4 -0.673 22.2-158.0 -85.5 141.1 17.5 -35.7 -12.7 264 265 A Y E -df 158 348A 1 83,-0.9 85,-3.1 80,-0.7 2,-0.4 -0.983 11.2-179.0-126.9 126.1 16.9 -32.4 -14.4 265 266 A L E -df 159 349A 0 -107,-2.8 -105,-3.0 -2,-0.4 2,-0.4 -0.967 4.8-169.1-122.9 139.0 14.9 -29.5 -12.8 266 267 A S E -df 160 350A 0 83,-2.0 85,-2.4 -2,-0.4 2,-0.4 -0.981 7.7-164.4-131.0 141.3 14.2 -26.2 -14.5 267 268 A F E -d 161 0A 3 -107,-2.6 -105,-2.4 -2,-0.4 -104,-0.4 -0.988 12.3-155.8-123.2 131.1 12.8 -23.0 -13.1 268 269 A S E - 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