==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-DEC-04 2BFN . COMPND 2 MOLECULE: HALOGENALKANE DEHALOGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SPHINGOMONAS PAUCIMOBILIS; . AUTHOR P.BANAS,M.OTYEPKA,P.JERABEK,J.VEVODOVA,M.BOHAC,J.DAMBORSKY . 294 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11407.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 198 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 12.2 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 . 1 0.3 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 . 2 0.7 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 . 15 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 14.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.0 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 0 2 1 1 0 0 1 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 1 1 0 1 1 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 . 1 0 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 3 A L 0 0 132 0, 0.0 2,-0.2 0, 0.0 273,-0.0 0.000 360.0 360.0 360.0 -28.7 4.9 3.2 7.5 2 4 A G - 0 0 28 1,-0.1 43,-0.1 0, 0.0 42,-0.0 -0.520 360.0-130.5 150.3 154.9 8.1 3.5 5.6 3 5 A A S S+ 0 0 33 -2,-0.2 -1,-0.1 2,-0.1 184,-0.1 0.472 72.0 109.2 -96.4 -8.3 11.7 4.1 5.0 4 6 A K - 0 0 175 1,-0.1 180,-0.0 40,-0.0 179,-0.0 -0.518 69.8-119.5 -73.9 139.2 11.4 6.6 2.1 5 7 A P - 0 0 91 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.253 24.9-112.5 -68.0 163.0 12.2 10.2 2.8 6 8 A F S S- 0 0 43 34,-0.1 37,-0.1 2,-0.0 39,-0.1 -0.832 73.8 -22.2 -96.9 132.8 9.7 13.0 2.4 7 9 A G S S- 0 0 38 -2,-0.5 2,-0.4 37,-0.1 15,-0.1 -0.141 91.1 -70.0 69.5-168.2 10.3 15.5 -0.4 8 10 A E - 0 0 164 15,-0.1 15,-0.4 13,-0.0 2,-0.2 -0.969 50.3-100.0-124.3 153.0 13.7 16.1 -1.8 9 11 A K - 0 0 56 -2,-0.4 2,-0.3 13,-0.1 13,-0.2 -0.454 34.1-166.5 -73.2 134.2 16.6 17.8 -0.2 10 12 A K E -A 21 0A 86 11,-3.0 11,-2.4 -2,-0.2 2,-0.3 -0.824 8.7-147.4-113.1 154.8 17.3 21.5 -1.0 11 13 A F E +A 20 0A 103 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.957 15.6 178.4-128.7 147.3 20.5 23.3 -0.0 12 14 A I E -A 19 0A 43 7,-2.1 7,-2.9 -2,-0.3 2,-0.5 -0.996 31.3-114.7-147.8 140.5 21.4 26.9 0.9 13 15 A E E +A 18 0A 117 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.667 34.7 176.2 -81.5 128.1 24.7 28.5 1.9 14 16 A I E > -A 17 0A 10 3,-3.8 3,-2.6 -2,-0.5 76,-0.1 -0.995 69.3 -17.8-134.2 121.2 24.8 29.8 5.5 15 17 A K T 3 S- 0 0 123 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.883 129.4 -51.3 48.9 42.3 27.9 31.4 7.0 16 18 A G T 3 S+ 0 0 56 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.477 122.6 100.4 78.8 1.5 30.0 29.8 4.3 17 19 A R E < S-A 14 0A 60 -3,-2.6 -3,-3.8 51,-0.1 2,-0.5 -0.891 73.2-119.0-119.2 151.7 28.6 26.3 4.8 18 20 A R E -A 13 0A 117 -2,-0.3 50,-3.1 -5,-0.2 2,-0.4 -0.760 28.1-166.6 -90.3 126.4 25.9 24.4 2.9 19 21 A M E -A 12 0A 0 -7,-2.9 -7,-2.1 -2,-0.5 2,-0.3 -0.911 9.5-141.9-110.0 144.1 22.8 23.5 5.0 20 22 A A E +A 11 0A 0 -2,-0.4 40,-2.8 40,-0.3 2,-0.3 -0.779 27.2 157.0-106.4 148.9 20.2 20.9 3.8 21 23 A Y E -AB 10 59A 25 -11,-2.4 -11,-3.0 -2,-0.3 2,-0.4 -0.989 38.2-119.4-162.9 156.7 16.5 21.1 4.3 22 24 A I E + B 0 58A 5 36,-2.5 36,-1.9 -2,-0.3 2,-0.3 -0.870 28.9 172.9 -97.6 139.8 13.1 20.0 3.1 23 25 A D E + B 0 57A 20 -15,-0.4 2,-0.4 -2,-0.4 34,-0.2 -0.770 11.1 164.3-150.7 97.4 10.7 22.7 1.9 24 26 A E E + B 0 56A 65 32,-2.5 32,-3.4 -2,-0.3 2,-0.1 -0.957 39.3 3.8-124.4 134.6 7.4 21.4 0.3 25 27 A G S S- 0 0 56 -2,-0.4 2,-0.3 30,-0.2 30,-0.2 -0.338 75.3 -76.9 95.1-175.0 4.2 23.1 -0.4 26 28 A T S S+ 0 0 125 28,-0.3 2,-0.2 -2,-0.1 -2,-0.0 -0.886 72.9 41.6-129.6 156.9 2.8 26.7 -0.1 27 29 A G S S- 0 0 52 -2,-0.3 27,-0.1 27,-0.2 26,-0.1 -0.688 95.1 -7.8 112.2-161.1 1.5 28.9 2.7 28 30 A D S S- 0 0 66 -2,-0.2 27,-1.6 25,-0.2 72,-0.1 -0.471 84.5 -98.5 -71.8 143.5 2.5 29.6 6.3 29 31 A P E -c 55 0A 1 0, 0.0 72,-2.4 0, 0.0 2,-0.5 -0.316 23.2-163.0 -70.7 145.7 5.3 27.3 7.5 30 32 A I E -cd 56 101A 0 25,-2.8 27,-2.5 70,-0.2 2,-0.6 -0.990 24.8-159.7-119.0 111.0 5.0 24.2 9.6 31 33 A L E -cd 57 102A 0 70,-3.1 72,-2.9 -2,-0.5 2,-0.5 -0.873 8.7-165.3-111.0 113.1 8.5 23.8 10.8 32 34 A F E -cd 58 103A 0 25,-3.2 27,-0.7 -2,-0.6 2,-0.6 -0.873 7.0-167.4-102.8 120.3 9.7 20.4 12.0 33 35 A Q E -cd 59 104A 0 70,-2.7 72,-1.4 -2,-0.5 75,-0.2 -0.925 2.9-158.2-121.7 114.2 13.0 20.4 14.0 34 36 A H - 0 0 0 -2,-0.6 2,-0.1 25,-0.5 6,-0.1 -0.246 6.6-160.2 -71.7 166.2 14.9 17.2 14.8 35 37 A G > + 0 0 0 72,-0.2 3,-1.3 4,-0.1 26,-0.1 -0.171 43.7 9.0-123.6-140.6 17.4 16.7 17.6 36 38 A N T 3 S- 0 0 2 1,-0.3 3,-0.1 -2,-0.1 -1,-0.1 -0.750 121.7 -10.8 -99.8 135.4 20.2 14.3 18.4 37 39 A P T 3 S+ 0 0 1 0, 0.0 -1,-0.3 0, 0.0 165,-0.1 -0.537 115.9 81.9-107.8 50.4 21.3 12.1 16.5 38 40 A T < - 0 0 3 -3,-1.3 27,-0.3 26,-0.1 2,-0.3 0.051 52.8-155.5-100.9-161.0 18.6 12.4 13.9 39 41 A S > - 0 0 8 25,-0.1 3,-2.1 -3,-0.1 4,-0.3 -0.884 54.8 -59.3-157.0-171.2 17.9 14.6 10.9 40 42 A S G > S+ 0 0 2 1,-0.3 3,-2.0 -2,-0.3 4,-0.2 0.780 121.8 78.8 -50.8 -27.3 14.9 15.8 8.8 41 43 A Y G > S+ 0 0 19 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.784 76.3 73.6 -53.2 -30.8 14.4 12.0 8.1 42 44 A L G < S+ 0 0 2 -3,-2.1 3,-0.3 1,-0.3 -1,-0.3 0.792 98.4 45.6 -54.0 -30.6 12.8 11.7 11.6 43 45 A W G X> S+ 0 0 0 -3,-2.0 4,-2.8 -4,-0.3 3,-1.7 0.328 76.7 112.1 -99.5 8.4 9.7 13.4 10.3 44 46 A R T <4 S+ 0 0 6 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.758 84.9 37.8 -59.7 -32.8 9.3 11.5 7.0 45 47 A N T 34 S+ 0 0 19 -3,-0.3 -1,-0.3 -4,-0.2 236,-0.1 0.447 118.9 50.0 -97.5 -0.7 6.1 9.7 8.0 46 48 A I T X4 S+ 0 0 1 -3,-1.7 3,-1.5 2,-0.1 4,-0.4 0.814 97.3 62.8-100.8 -47.8 4.7 12.7 10.0 47 49 A M G >< S+ 0 0 0 -4,-2.8 3,-2.1 1,-0.3 -3,-0.1 0.835 92.1 66.7 -51.3 -41.2 5.0 15.5 7.5 48 50 A P G > S+ 0 0 57 0, 0.0 3,-1.7 0, 0.0 -1,-0.3 0.793 89.8 65.3 -50.8 -33.9 2.6 13.8 4.9 49 51 A H G < S+ 0 0 61 -3,-1.5 -2,-0.2 1,-0.3 -3,-0.1 0.737 99.1 53.7 -61.6 -21.9 -0.3 14.3 7.3 50 52 A C G X S+ 0 0 0 -3,-2.1 3,-2.5 -4,-0.4 4,-0.4 0.266 76.2 146.2 -97.7 10.4 0.0 18.1 6.9 51 53 A A T < S+ 0 0 71 -3,-1.7 4,-0.1 1,-0.3 -26,-0.1 -0.224 74.1 8.0 -50.8 131.3 -0.2 18.1 3.1 52 54 A G T 3 S+ 0 0 82 2,-0.3 -1,-0.3 1,-0.1 3,-0.1 0.291 105.8 95.9 78.6 -4.7 -1.9 21.2 1.8 53 55 A L S < S- 0 0 50 -3,-2.5 2,-0.3 1,-0.2 -25,-0.2 0.552 96.9 -43.1 -92.1 -9.1 -2.0 22.8 5.3 54 56 A G S S- 0 0 2 -4,-0.4 2,-0.7 -27,-0.1 -28,-0.3 -0.982 80.7 -48.2 169.7-175.2 1.2 24.9 4.9 55 57 A R E - c 0 29A 41 -27,-1.6 -25,-2.8 -2,-0.3 2,-0.7 -0.788 57.2-143.9 -86.7 117.0 4.7 25.1 3.7 56 58 A L E +Bc 24 30A 6 -32,-3.4 -32,-2.5 -2,-0.7 2,-0.4 -0.780 25.2 177.9 -98.2 113.5 6.3 21.9 5.2 57 59 A I E +Bc 23 31A 0 -27,-2.5 -25,-3.2 -2,-0.7 2,-0.4 -0.930 16.3 172.2-123.3 134.5 9.8 22.5 6.3 58 60 A A E -Bc 22 32A 0 -36,-1.9 -36,-2.5 -2,-0.4 2,-0.3 -0.910 16.8-160.4-142.0 113.1 12.4 20.3 8.0 59 61 A C E -Bc 21 33A 0 -27,-0.7 2,-0.6 -2,-0.4 -25,-0.5 -0.690 15.8-131.2 -95.1 146.0 16.0 21.5 8.4 60 62 A D - 0 0 0 -40,-2.8 -40,-0.3 -2,-0.3 3,-0.1 -0.840 32.0-121.7 -90.5 121.6 19.1 19.4 9.0 61 63 A L > - 0 0 1 -2,-0.6 3,-2.3 1,-0.1 6,-0.3 -0.198 43.9 -78.6 -58.6 154.4 21.1 20.9 11.8 62 64 A I T 3 S+ 0 0 1 1,-0.3 7,-0.2 21,-0.2 -1,-0.1 -0.244 121.4 16.4 -57.6 139.8 24.7 21.9 11.0 63 65 A G T 3 S+ 0 0 0 5,-2.3 2,-0.3 1,-0.2 -1,-0.3 0.475 115.5 90.7 74.5 0.8 26.9 18.8 11.0 64 66 A M S X S- 0 0 0 -3,-2.3 3,-2.3 4,-0.2 -1,-0.2 -0.824 84.9 -6.5-127.5 162.4 23.9 16.5 10.8 65 67 A G T 3 S- 0 0 11 -27,-0.3 -26,-0.1 -2,-0.3 -44,-0.0 -0.252 129.2 -27.3 55.2-131.7 21.8 15.0 8.0 66 68 A D T 3 S+ 0 0 66 2,-0.0 -1,-0.3 -46,-0.0 2,-0.2 0.261 109.4 115.6 -98.8 10.5 23.0 16.4 4.6 67 69 A S S < S- 0 0 7 -3,-2.3 -48,-0.2 -6,-0.3 -6,-0.1 -0.509 75.5 -92.3 -75.3 150.8 24.2 19.6 6.2 68 70 A D - 0 0 57 -50,-3.1 -5,-2.3 -2,-0.2 -4,-0.2 -0.247 34.8-116.7 -61.8 148.0 28.0 20.4 6.0 69 71 A K - 0 0 47 -6,-0.2 2,-0.9 -7,-0.2 -51,-0.1 -0.546 27.1-118.1 -73.1 149.5 30.4 19.5 8.8 70 72 A L - 0 0 0 -2,-0.2 -1,-0.0 -8,-0.1 7,-0.0 -0.726 39.1-136.0 -93.6 94.8 32.1 22.3 10.6 71 73 A D S S+ 0 0 97 -2,-0.9 2,-0.0 1,-0.2 3,-0.0 -0.655 86.0 43.0-102.8 142.0 35.8 22.0 10.1 72 74 A P S S- 0 0 111 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.419 88.9-174.1 -77.6 132.3 38.1 22.2 11.9 73 75 A S + 0 0 23 4,-0.1 124,-0.1 3,-0.0 -2,-0.1 -0.601 17.8 128.0 -96.8 157.7 36.0 20.2 14.4 74 76 A G S > S- 0 0 13 -2,-0.2 3,-2.0 123,-0.1 0, 0.0 -0.955 71.4 -52.7 177.9-173.1 36.8 19.4 18.0 75 77 A P T 3 S+ 0 0 96 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.668 128.6 54.3 -60.9 -18.7 35.5 19.6 21.6 76 78 A E T 3 S+ 0 0 187 3,-0.0 3,-0.5 2,-0.0 2,-0.2 0.558 94.1 91.4 -89.4 -9.7 34.7 23.3 21.3 77 79 A R S < S+ 0 0 48 -3,-2.0 -4,-0.1 1,-0.2 127,-0.0 -0.495 77.3 24.5 -91.3 153.8 32.5 22.8 18.2 78 80 A Y S S+ 0 0 0 1,-0.2 -1,-0.2 -2,-0.2 2,-0.1 0.712 74.3 155.7 68.6 27.3 28.8 22.2 17.9 79 81 A A > - 0 0 27 -3,-0.5 4,-2.4 1,-0.1 3,-0.4 -0.329 60.9 -97.6 -68.5 164.7 27.8 23.7 21.2 80 82 A Y H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.907 123.3 54.6 -52.6 -46.2 24.2 24.9 21.5 81 83 A A H > S+ 0 0 33 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.880 108.8 47.9 -62.2 -36.5 25.1 28.5 20.7 82 84 A E H > S+ 0 0 41 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.938 111.7 49.3 -69.4 -45.7 26.9 27.6 17.5 83 85 A H H X S+ 0 0 1 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.908 110.4 52.4 -54.9 -43.8 23.9 25.4 16.3 84 86 A R H X S+ 0 0 51 -4,-2.8 4,-3.1 -5,-0.2 5,-0.3 0.890 105.3 54.2 -61.9 -41.3 21.6 28.4 17.2 85 87 A D H X S+ 0 0 86 -4,-1.9 4,-1.6 -5,-0.2 -1,-0.2 0.928 114.4 41.2 -59.7 -44.3 23.7 30.8 15.0 86 88 A Y H X S+ 0 0 13 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.936 117.6 46.0 -69.6 -47.2 23.4 28.4 12.0 87 89 A L H X S+ 0 0 3 -4,-3.1 4,-3.0 1,-0.2 5,-0.2 0.913 111.1 51.9 -65.8 -40.3 19.7 27.6 12.5 88 90 A D H X S+ 0 0 42 -4,-3.1 4,-2.2 -5,-0.2 -1,-0.2 0.923 112.4 47.5 -58.1 -45.2 18.7 31.2 13.2 89 91 A A H X S+ 0 0 35 -4,-1.6 4,-2.3 -5,-0.3 -2,-0.2 0.895 112.0 48.4 -68.1 -38.3 20.4 32.2 9.9 90 92 A L H X S+ 0 0 0 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.950 111.8 49.5 -65.0 -47.1 18.8 29.4 7.9 91 93 A W H <>S+ 0 0 1 -4,-3.0 5,-0.6 1,-0.2 4,-0.3 0.885 111.4 50.0 -61.4 -35.2 15.4 30.2 9.3 92 94 A E H ><5S+ 0 0 118 -4,-2.2 3,-1.4 -5,-0.2 -1,-0.2 0.924 109.8 51.2 -63.7 -45.5 15.9 33.9 8.4 93 95 A A H 3<5S+ 0 0 45 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.747 100.5 63.2 -66.2 -25.9 17.0 32.9 4.9 94 96 A L T 3<5S- 0 0 7 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.516 100.2-132.9 -80.1 -6.1 13.9 30.8 4.4 95 97 A D T < 5 + 0 0 127 -3,-1.4 -3,-0.1 -4,-0.3 -2,-0.1 0.968 34.4 176.2 55.5 64.7 11.6 33.8 4.6 96 98 A L < - 0 0 4 -5,-0.6 3,-0.5 1,-0.2 -1,-0.1 0.653 21.1-150.6 -80.9 -18.8 9.1 32.2 7.0 97 99 A G - 0 0 39 1,-0.2 -1,-0.2 -69,-0.1 3,-0.2 -0.357 37.1 -60.1 75.4-160.8 6.8 35.2 7.6 98 100 A D S S+ 0 0 104 1,-0.2 -1,-0.2 -2,-0.1 -70,-0.0 0.174 114.5 65.4-119.8 21.1 4.9 35.8 10.8 99 101 A R + 0 0 89 -3,-0.5 2,-0.3 24,-0.1 24,-0.2 -0.492 65.2 161.1-136.4 67.3 2.5 32.8 11.4 100 102 A V E - e 0 123A 0 22,-3.1 24,-2.5 -3,-0.2 25,-1.2 -0.677 29.3-153.1 -91.3 136.3 4.8 29.8 11.9 101 103 A V E -de 30 125A 0 -72,-2.4 -70,-3.1 -2,-0.3 2,-0.4 -0.955 16.3-152.7-102.9 124.3 3.8 26.5 13.6 102 104 A L E -de 31 126A 0 23,-2.3 25,-3.2 -2,-0.5 2,-0.4 -0.824 12.1-172.0 -96.3 136.7 6.8 24.8 15.3 103 105 A V E +de 32 127A 0 -72,-2.9 -70,-2.7 -2,-0.4 2,-0.3 -0.984 24.3 178.7-127.8 113.8 6.9 21.0 15.7 104 106 A V E -de 33 128A 0 23,-2.5 25,-1.3 -2,-0.4 2,-0.3 -0.870 22.7-177.9-134.6 154.5 9.9 20.1 17.9 105 107 A H E > - e 0 129A 1 -72,-1.4 3,-2.0 -2,-0.3 4,-0.4 -0.993 58.3 -36.7-147.7 136.1 11.7 17.2 19.5 106 108 A D E >> S+ e 0 131A 17 24,-2.0 3,-1.5 23,-0.7 4,-1.4 -0.150 132.6 1.6 53.8-129.7 14.8 16.9 21.8 107 109 A W H 3> S+ 0 0 2 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.797 129.9 65.3 -64.7 -24.2 17.4 19.5 20.8 108 110 A G H <> S+ 0 0 0 -3,-2.0 4,-2.4 1,-0.2 -1,-0.3 0.812 100.9 51.4 -62.2 -30.5 15.0 20.7 18.2 109 111 A S H <> S+ 0 0 0 -3,-1.5 4,-3.2 -4,-0.4 5,-0.3 0.882 107.9 49.6 -73.7 -40.0 12.8 21.8 21.1 110 112 A A H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 5,-0.2 0.960 118.0 41.2 -59.8 -48.6 15.5 23.7 22.9 111 113 A L H X S+ 0 0 4 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.934 119.7 43.9 -63.0 -49.1 16.4 25.5 19.7 112 114 A G H X S+ 0 0 1 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.891 113.0 50.3 -67.2 -40.5 12.7 26.0 18.7 113 115 A F H X S+ 0 0 0 -4,-3.2 4,-2.4 2,-0.2 -1,-0.2 0.913 113.3 47.0 -62.4 -43.4 11.5 27.1 22.2 114 116 A D H X S+ 0 0 0 -4,-2.0 4,-2.0 -5,-0.3 -2,-0.2 0.932 113.5 47.8 -63.0 -45.5 14.4 29.6 22.4 115 117 A W H X S+ 0 0 5 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.930 111.1 51.8 -61.6 -41.7 13.6 30.9 18.9 116 118 A A H < S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.922 107.8 51.4 -63.9 -42.5 9.9 31.1 19.7 117 119 A R H >< S+ 0 0 48 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.914 115.6 42.4 -58.8 -41.1 10.7 33.1 22.9 118 120 A R H 3< S+ 0 0 80 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.728 126.8 31.9 -78.1 -22.2 12.8 35.5 20.8 119 121 A H T >< S+ 0 0 51 -4,-1.9 3,-2.5 -3,-0.2 4,-0.3 -0.157 75.2 145.4-126.4 36.9 10.4 35.7 17.9 120 122 A R G X + 0 0 110 -3,-0.7 3,-1.4 1,-0.3 -1,-0.1 0.745 64.2 62.2 -57.4 -30.0 7.1 35.3 19.8 121 123 A E G 3 S+ 0 0 174 1,-0.3 -1,-0.3 -3,-0.1 -4,-0.1 0.681 104.3 51.4 -68.6 -16.6 5.0 37.6 17.5 122 124 A R G < S+ 0 0 52 -3,-2.5 -22,-3.1 -6,-0.2 2,-0.7 0.390 87.9 98.0 -98.5 -1.7 5.7 35.2 14.6 123 125 A V E < +e 100 0A 3 -3,-1.4 -22,-0.2 -4,-0.3 3,-0.1 -0.816 39.4 174.4-103.5 113.2 4.7 32.0 16.4 124 126 A Q E - 0 0 25 -24,-2.5 2,-0.3 -2,-0.7 -23,-0.2 0.753 69.2 -17.3 -82.2 -29.4 1.2 30.7 15.7 125 127 A G E -e 101 0A 0 -25,-1.2 -23,-2.3 109,-0.1 2,-0.4 -0.955 53.3-139.1-173.0 156.5 1.5 27.5 17.6 126 128 A I E -ef 102 236A 1 109,-2.1 111,-2.6 -2,-0.3 2,-0.5 -0.981 10.3-172.9-133.2 120.9 3.9 25.0 19.1 127 129 A A E +ef 103 237A 0 -25,-3.2 -23,-2.5 -2,-0.4 2,-0.3 -0.948 20.6 174.5-108.3 128.8 3.7 21.2 19.0 128 130 A Y E +ef 104 238A 0 109,-2.6 111,-2.7 -2,-0.5 2,-0.3 -0.969 15.0 174.1-139.9 154.9 6.3 19.4 21.1 129 131 A M E +e 105 0A 0 -25,-1.3 -23,-0.7 -2,-0.3 111,-0.1 -0.974 69.6 3.7-158.5 140.3 7.3 16.0 22.3 130 132 A E E S+ 0 0 2 109,-0.5 -24,-2.0 -2,-0.3 2,-0.2 0.914 94.2 167.4 45.5 59.4 10.1 14.4 24.2 131 133 A A E -e 106 0A 0 -26,-0.2 2,-1.0 -22,-0.1 -1,-0.1 -0.528 54.3-117.9-107.1 163.9 11.5 17.9 24.7 132 134 A I + 0 0 4 -26,-0.7 115,-0.0 -2,-0.2 -27,-0.0 -0.794 47.3 163.7-100.1 84.7 14.0 19.7 26.8 133 135 A A - 0 0 0 -2,-1.0 -1,-0.2 1,-0.2 96,-0.1 0.595 58.8 -9.7 -87.2 -13.6 11.4 21.9 28.5 134 136 A M S S- 0 0 10 -3,-0.1 -1,-0.2 76,-0.1 89,-0.1 -0.954 87.3 -71.5-168.8 163.8 13.5 23.1 31.5 135 137 A P - 0 0 12 0, 0.0 2,-0.2 0, 0.0 76,-0.2 -0.420 57.3-167.2 -62.7 144.7 16.8 22.6 33.3 136 138 A I B -h 211 0B 5 74,-2.6 76,-2.4 -2,-0.1 77,-0.5 -0.762 18.0-123.4-129.2 177.0 16.8 19.3 35.1 137 139 A E >> - 0 0 101 74,-0.3 3,-1.7 -2,-0.2 4,-0.5 -0.751 37.9-102.0-115.5 164.6 18.8 17.3 37.7 138 140 A W G >4 S+ 0 0 55 1,-0.3 3,-1.4 -2,-0.3 -1,-0.0 0.858 120.5 61.9 -57.5 -35.5 20.3 13.8 37.4 139 141 A A G 34 S+ 0 0 84 1,-0.3 -1,-0.3 7,-0.0 4,-0.1 0.728 102.4 52.9 -61.4 -21.2 17.4 12.3 39.3 140 142 A D G <4 S+ 0 0 32 -3,-1.7 -1,-0.3 2,-0.1 108,-0.2 0.566 88.0 97.9 -86.8 -14.5 15.1 13.5 36.6 141 143 A F S << S- 0 0 11 -3,-1.4 5,-0.1 -4,-0.5 105,-0.1 -0.584 93.8 -91.0 -80.0 140.1 17.0 11.9 33.8 142 144 A P >> - 0 0 31 0, 0.0 4,-0.7 0, 0.0 3,-0.5 -0.222 31.3-135.6 -54.8 135.3 15.7 8.5 32.7 143 145 A E G >4 S+ 0 0 142 1,-0.2 3,-0.7 2,-0.2 4,-0.5 0.840 94.3 68.3 -61.9 -36.4 17.2 5.7 34.7 144 146 A Q G 34 S+ 0 0 122 1,-0.2 -1,-0.2 2,-0.1 4,-0.2 0.881 118.1 19.1 -53.1 -46.7 17.9 3.4 31.7 145 147 A D G <> S+ 0 0 16 -3,-0.5 4,-2.5 1,-0.1 5,-0.3 0.315 91.1 109.2-114.5 13.2 20.6 5.6 30.2 146 148 A R H S+ 0 0 125 -4,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.890 112.7 52.9 -62.2 -36.9 25.1 6.2 33.6 148 150 A L H > S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.931 109.5 47.1 -64.7 -43.9 25.7 6.3 29.8 149 151 A F H X S+ 0 0 15 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.849 109.5 54.2 -66.6 -34.7 24.9 10.0 29.6 150 152 A Q H < S+ 0 0 70 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.931 108.8 50.0 -61.7 -39.6 27.1 10.7 32.6 151 153 A A H >< S+ 0 0 29 -4,-2.2 3,-1.2 1,-0.2 6,-0.5 0.883 105.5 55.3 -66.5 -39.0 29.9 8.9 30.6 152 154 A F H 3< S+ 0 0 0 -4,-2.4 2,-0.3 1,-0.3 -1,-0.2 0.903 105.3 54.6 -55.5 -37.2 29.2 11.0 27.6 153 155 A R T 3< S+ 0 0 54 -4,-1.6 2,-0.3 -5,-0.1 -1,-0.3 -0.162 106.4 65.7 -92.0 35.7 29.8 14.1 29.8 154 156 A S S X S- 0 0 50 -3,-1.2 3,-2.0 -2,-0.3 4,-0.2 -0.871 107.3 -85.0-143.0 176.8 33.2 12.7 30.9 155 157 A Q T > S+ 0 0 189 -2,-0.3 3,-0.7 1,-0.3 4,-0.4 0.694 120.6 70.9 -62.8 -19.5 36.5 12.1 29.2 156 158 A A T 3> S+ 0 0 45 -5,-0.3 4,-2.0 1,-0.2 -1,-0.3 0.599 76.6 85.9 -67.9 -15.6 35.1 8.6 28.1 157 159 A G H <>>S+ 0 0 0 -3,-2.0 4,-2.7 -6,-0.5 5,-0.6 0.847 78.9 58.1 -61.9 -37.7 32.8 10.3 25.7 158 160 A E H <>>S+ 0 0 56 -3,-0.7 5,-1.6 -4,-0.2 4,-1.3 0.941 110.2 43.0 -61.5 -44.7 35.2 10.6 22.8 159 161 A E H 4>S+ 0 0 119 -4,-0.4 5,-1.9 3,-0.2 4,-0.3 0.950 115.5 49.7 -65.9 -46.0 35.8 6.8 22.6 160 162 A L H <5S+ 0 0 43 -4,-2.0 6,-2.4 3,-0.2 -2,-0.2 0.929 129.2 17.7 -56.7 -47.8 32.1 6.0 23.1 161 163 A V H X5S+ 0 0 0 -4,-2.7 4,-1.6 4,-0.2 -3,-0.2 0.921 128.5 40.4 -97.3 -55.5 30.9 8.4 20.4 162 164 A L T <> + 0 0 14 -6,-2.4 4,-2.3 1,-0.2 5,-2.2 0.788 65.4 57.6 -61.1 -32.8 27.2 4.8 20.5 167 169 A F H 4>S+ 0 0 10 3,-0.2 5,-2.0 1,-0.2 -1,-0.2 0.962 116.6 34.0 -65.4 -46.3 24.6 7.6 20.1 168 170 A V H 45S+ 0 0 0 -3,-0.3 -2,-0.2 3,-0.2 -1,-0.2 0.906 127.6 37.0 -68.0 -45.5 23.6 6.5 16.7 169 171 A E H <5S+ 0 0 75 -4,-2.7 -3,-0.2 3,-0.1 -2,-0.2 0.699 132.6 15.7 -91.9 -22.3 24.1 2.7 17.1 170 172 A Q T X5S+ 0 0 102 -4,-2.3 4,-2.0 -5,-0.3 -3,-0.2 0.726 124.5 44.3-114.2 -53.2 23.0 2.1 20.7 171 173 A V H >44 S+ 0 0 48 0, 0.0 3,-1.7 0, 0.0 -1,-0.2 0.894 112.1 62.2 -60.5 -31.9 17.6 2.0 18.6 174 176 A G H 3< S+ 0 0 41 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.1 0.650 104.7 47.2 -68.1 -17.2 17.4 1.6 22.4 175 177 A L T << S+ 0 0 15 -3,-1.4 96,-1.8 -4,-0.8 95,-1.6 0.026 96.0 82.6-116.1 26.8 14.8 4.3 22.6 176 178 A I < - 0 0 13 -3,-1.7 4,-0.1 94,-0.1 96,-0.1 -0.999 65.3-153.2-125.3 129.2 12.5 3.1 19.8 177 179 A L S S+ 0 0 100 -2,-0.4 -1,-0.1 94,-0.1 98,-0.1 0.771 75.2 58.1 -78.2 -30.0 10.1 0.4 20.8 178 180 A R S S- 0 0 74 1,-0.1 2,-0.2 96,-0.0 -2,-0.0 -0.702 96.3 -94.5 -99.8 153.2 9.7 -1.3 17.3 179 181 A P - 0 0 115 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.497 36.6-134.1 -70.0 133.1 12.5 -2.8 15.2 180 182 A L - 0 0 36 -2,-0.2 2,-0.1 -4,-0.1 -4,-0.0 -0.567 19.8-121.1 -80.1 146.5 14.1 -0.5 12.6 181 183 A S > - 0 0 51 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.362 26.1-104.1 -78.6 168.4 14.7 -1.7 9.1 182 184 A E H > S+ 0 0 177 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.901 122.2 48.5 -56.2 -44.9 18.0 -1.9 7.3 183 185 A A H > S+ 0 0 53 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.858 109.1 52.4 -68.6 -38.8 17.1 1.1 5.2 184 186 A E H > S+ 0 0 6 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.949 112.1 44.9 -63.9 -46.1 16.0 3.2 8.2 185 187 A M H X S+ 0 0 22 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.885 110.1 56.3 -65.9 -34.9 19.2 2.6 10.1 186 188 A A H X S+ 0 0 47 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.924 106.4 50.0 -61.4 -40.6 21.2 3.3 7.0 187 189 A A H < S+ 0 0 27 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.874 114.4 44.1 -64.4 -38.9 19.5 6.7 6.7 188 190 A Y H < S+ 0 0 3 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.852 116.8 45.9 -74.7 -33.7 20.3 7.5 10.4 189 191 A R H >< S+ 0 0 73 -4,-2.6 3,-2.5 1,-0.2 -2,-0.2 0.767 90.6 87.1 -74.4 -28.2 23.9 6.2 10.2 190 192 A E G >< S+ 0 0 119 -4,-1.9 3,-1.1 1,-0.3 4,-0.2 0.816 87.1 46.6 -53.5 -45.0 24.8 7.9 6.9 191 193 A P G 3 S+ 0 0 23 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.663 120.0 43.5 -69.1 -10.2 26.0 11.3 8.2 192 194 A F G < S+ 0 0 1 -3,-2.5 -2,-0.2 -4,-0.1 7,-0.1 -0.025 72.2 116.3-126.3 24.2 28.1 9.4 10.8 193 195 A L < + 0 0 110 -3,-1.1 2,-0.4 5,-0.1 -1,-0.1 0.808 65.1 73.7 -66.6 -31.3 29.7 6.6 8.8 194 196 A A S S- 0 0 59 -4,-0.2 5,-0.2 -3,-0.1 4,-0.1 -0.714 83.6-126.5 -89.4 130.9 33.2 8.0 9.4 195 197 A A S S+ 0 0 69 -2,-0.4 3,-0.3 3,-0.1 2,-0.3 -0.361 72.7 28.9 -65.1 156.7 34.8 7.6 12.7 196 198 A G S > S+ 0 0 26 -34,-2.4 3,-2.3 1,-0.2 4,-0.2 -0.699 119.6 0.7 95.9-144.5 36.2 10.7 14.4 197 199 A E G > S+ 0 0 63 -2,-0.3 3,-2.0 1,-0.3 -1,-0.2 0.696 113.9 75.3 -62.9 -21.5 35.0 14.3 14.1 198 200 A A G 3 S+ 0 0 22 -3,-0.3 -1,-0.3 1,-0.3 4,-0.1 0.799 100.8 47.5 -52.4 -31.3 32.2 13.5 11.7 199 201 A R G X> S+ 0 0 24 -3,-2.3 3,-1.5 -5,-0.2 4,-0.6 0.443 80.8 104.9 -90.1 -2.2 30.4 12.2 14.8 200 202 A R H X> S+ 0 0 7 -3,-2.0 4,-3.1 1,-0.3 3,-1.5 0.838 71.6 60.8 -52.5 -40.9 31.2 15.2 17.0 201 203 A P H 3> S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.861 100.6 55.5 -56.0 -31.5 27.7 16.7 16.9 202 204 A T H <4 S+ 0 0 0 -3,-1.5 -2,-0.2 1,-0.2 -3,-0.1 0.627 115.0 38.8 -80.0 -12.9 26.3 13.5 18.5 203 205 A L H X S+ 0 0 0 -4,-1.8 3,-1.9 -5,-0.3 4,-0.6 0.952 102.9 43.9 -57.4 -56.1 24.8 17.5 22.2 206 208 A P H >4 S+ 0 0 0 0, 0.0 3,-0.8 0, 0.0 -1,-0.2 0.856 110.0 59.2 -59.6 -28.5 24.6 15.3 25.3 207 209 A R H 3< S+ 0 0 58 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.1 0.602 103.8 52.8 -70.3 -13.3 27.4 17.6 26.8 208 210 A Q H << S+ 0 0 25 -3,-1.9 -1,-0.2 -4,-0.6 -3,-0.1 0.536 75.7 120.6 -97.6 -10.0 25.0 20.6 26.3 209 211 A I S << S- 0 0 12 -3,-0.8 2,-1.6 -4,-0.6 5,-0.1 -0.307 72.9-119.1 -62.2 132.7 22.0 19.2 28.1 210 212 A P + 0 0 1 0, 0.0 -74,-2.6 0, 0.0 2,-0.4 -0.577 58.6 148.0 -76.4 87.9 21.1 21.5 31.0 211 213 A I B > -hI 136 214B 0 3,-1.8 3,-1.6 -2,-1.6 -74,-0.3 -0.996 63.9 -7.5-128.6 132.1 21.5 19.1 33.9 212 214 A A T 3 S- 0 0 47 -76,-2.4 -75,-0.1 -2,-0.4 -1,-0.1 0.818 128.1 -55.6 53.4 35.4 22.7 19.8 37.4 213 215 A G T 3 S+ 0 0 40 -77,-0.5 -1,-0.3 1,-0.1 6,-0.1 0.363 98.8 141.1 89.5 -4.6 23.6 23.4 36.5 214 216 A T B < +I 211 0B 82 -3,-1.6 -3,-1.8 1,-0.2 -1,-0.1 -0.968 53.4 32.1-135.2 148.7 25.9 22.9 33.6 215 217 A P S > S- 0 0 24 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.530 78.2-158.4 -69.9 139.9 26.5 24.1 31.0 216 218 A A H > S+ 0 0 69 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.845 85.7 56.2 -62.3 -34.9 25.5 27.3 32.7 217 219 A D H > S+ 0 0 78 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.943 111.5 42.2 -63.0 -45.9 24.7 29.1 29.4 218 220 A V H > S+ 0 0 2 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.892 111.0 56.9 -70.0 -36.7 22.3 26.5 28.2 219 221 A V H X S+ 0 0 29 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.931 108.9 46.8 -53.9 -46.3 20.8 26.3 31.7 220 222 A A H X S+ 0 0 59 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.910 111.2 50.9 -65.3 -41.9 20.0 30.0 31.6 221 223 A I H X S+ 0 0 23 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.929 113.5 45.1 -59.6 -47.7 18.5 29.8 28.1 222 224 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.868 110.0 54.2 -66.7 -37.3 16.2 26.9 29.1 223 225 A R H X S+ 0 0 134 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.926 110.0 50.1 -59.6 -41.4 15.3 28.7 32.4 224 226 A D H X S+ 0 0 81 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.936 114.6 40.1 -62.7 -52.6 14.3 31.7 30.2 225 227 A Y H X S+ 0 0 2 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.845 112.6 57.2 -70.9 -27.5 12.1 29.7 27.7 226 228 A A H X S+ 0 0 0 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.948 109.7 44.7 -62.8 -49.1 10.7 27.6 30.5 227 229 A G H < S+ 0 0 31 -4,-2.3 4,-0.5 -5,-0.2 -2,-0.2 0.933 115.5 47.8 -60.6 -45.9 9.5 30.7 32.3 228 230 A W H >X S+ 0 0 22 -4,-2.2 4,-1.9 1,-0.2 3,-1.6 0.942 111.1 48.9 -62.8 -48.7 8.1 32.2 29.1 229 231 A L H 3< S+ 0 0 0 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.849 103.8 61.3 -61.7 -32.4 6.3 29.0 27.9 230 232 A S T 3< S+ 0 0 40 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.645 118.1 29.1 -70.8 -13.2 4.7 28.6 31.3 231 233 A E T <4 S+ 0 0 151 -3,-1.6 -2,-0.2 -4,-0.5 -1,-0.2 0.567 93.1 110.0-114.9 -18.4 3.0 32.0 30.9 232 234 A S < - 0 0 5 -4,-1.9 -4,-0.0 1,-0.1 -3,-0.0 -0.368 54.4-152.4 -71.3 136.0 2.6 32.4 27.1 233 235 A P + 0 0 98 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.409 54.5 127.2 -84.6 6.8 -0.9 32.2 25.6 234 236 A I S S- 0 0 20 1,-0.1 -109,-0.1 -109,-0.0 -110,-0.1 -0.367 73.9 -99.1 -61.1 133.4 0.4 30.8 22.3 235 237 A P - 0 0 35 0, 0.0 -109,-2.1 0, 0.0 2,-0.3 -0.350 46.7-166.6 -58.1 138.2 -1.5 27.6 21.4 236 238 A K E -fg 126 261A 1 24,-2.3 26,-2.4 -111,-0.2 2,-0.5 -0.956 20.3-159.3-130.8 145.0 0.4 24.4 22.3 237 239 A L E -fg 127 262A 3 -111,-2.6 -109,-2.6 -2,-0.3 2,-0.7 -0.982 11.9-163.4-121.1 113.8 0.1 20.7 21.5 238 240 A F E -fg 128 263A 1 24,-3.0 26,-1.8 -2,-0.5 2,-1.0 -0.892 2.7-161.3 -97.5 111.5 1.9 18.4 24.0 239 241 A I E - g 0 264A 1 -111,-2.7 -109,-0.5 -2,-0.7 26,-0.2 -0.851 16.1-163.3 -93.8 97.9 2.4 15.0 22.5 240 242 A N E - g 0 265A 7 24,-2.8 26,-2.4 -2,-1.0 2,-0.3 -0.495 4.4-142.9 -75.1 152.8 3.1 12.9 25.6 241 243 A A E - g 0 266A 2 6,-0.4 26,-0.2 24,-0.2 28,-0.1 -0.921 9.9-118.4-122.1 149.7 4.6 9.5 25.3 242 244 A E E S- g 0 267A 116 24,-2.0 26,-2.2 -2,-0.3 27,-0.0 -0.989 106.3 -0.5-127.8 118.3 4.1 6.2 27.2 243 245 A P E S+ g 0 268A 66 0, 0.0 -1,-0.2 0, 0.0 26,-0.2 -0.991 101.3 173.8 -72.5 -17.3 6.5 5.2 28.7 244 246 A G - 0 0 10 24,-3.1 26,-0.2 22,-0.1 4,-0.1 -0.185 21.1-145.7 69.0-174.4 8.3 8.2 27.3 245 247 A A S S+ 0 0 8 24,-0.3 3,-0.2 25,-0.1 25,-0.1 0.276 78.6 22.3-149.8 -75.0 11.8 9.0 28.4 246 248 A L S S+ 0 0 15 1,-0.2 2,-1.5 23,-0.2 5,-0.2 0.871 117.5 57.5 -78.1 -45.8 12.9 12.6 28.8 247 249 A T S S+ 0 0 2 4,-0.1 -6,-0.4 5,-0.1 2,-0.2 -0.555 88.4 97.9 -92.4 73.0 9.5 14.3 29.2 248 250 A T S >> S+ 0 0 29 -2,-1.5 4,-1.3 -3,-0.2 3,-1.0 -0.767 70.1 15.1-137.5 178.4 8.4 12.3 32.3 249 251 A G H 3> S- 0 0 42 -2,-0.2 4,-2.3 1,-0.2 5,-0.2 -0.132 128.4 -3.5 54.0-138.3 8.5 13.0 36.0 250 252 A R H 3> S+ 0 0 122 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.836 134.5 55.1 -61.1 -38.3 9.0 16.6 37.1 251 253 A M H <> S+ 0 0 4 -3,-1.0 4,-2.8 2,-0.2 -1,-0.2 0.932 110.4 45.2 -62.8 -43.3 9.5 17.9 33.5 252 254 A R H X S+ 0 0 39 -4,-1.3 4,-2.3 1,-0.2 -2,-0.2 0.896 110.0 55.2 -64.8 -40.6 6.2 16.4 32.4 253 255 A D H < S+ 0 0 102 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.902 111.5 45.3 -56.5 -41.5 4.6 17.8 35.6 254 256 A F H >< S+ 0 0 45 -4,-2.2 3,-2.0 1,-0.2 4,-0.3 0.942 109.9 52.7 -69.1 -49.1 5.9 21.3 34.5 255 257 A C H >< S+ 0 0 0 -4,-2.8 3,-1.9 1,-0.3 -2,-0.2 0.871 101.4 62.1 -55.2 -36.6 4.8 20.9 30.9 256 258 A R T 3< S+ 0 0 116 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.617 96.3 60.7 -70.4 -8.7 1.3 20.1 32.0 257 259 A T T < S+ 0 0 87 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.490 78.6 117.0 -86.3 -9.2 1.0 23.5 33.7 258 260 A W < - 0 0 10 -3,-1.9 3,-0.4 -4,-0.3 -28,-0.2 -0.378 67.4-113.3 -70.9 141.7 1.5 25.3 30.4 259 261 A P S S+ 0 0 44 0, 0.0 -1,-0.1 0, 0.0 -23,-0.1 -0.285 86.8 12.8 -71.3 155.8 -1.4 27.5 29.2 260 262 A N S S+ 0 0 103 1,-0.2 -24,-2.3 -25,-0.1 2,-0.4 0.878 92.5 146.7 53.8 47.2 -3.6 27.0 26.2 261 263 A Q E -g 236 0A 42 -3,-0.4 2,-0.3 -26,-0.2 -24,-0.2 -0.924 37.5-161.9-125.0 135.1 -2.4 23.5 25.7 262 264 A T E -g 237 0A 63 -26,-2.4 -24,-3.0 -2,-0.4 2,-0.4 -0.850 16.8-156.0-108.1 152.2 -4.0 20.3 24.4 263 265 A E E +g 238 0A 72 -2,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.987 16.0 176.5-131.4 138.9 -2.4 16.9 25.1 264 266 A I E -g 239 0A 60 -26,-1.8 -24,-2.8 -2,-0.4 2,-0.4 -0.945 21.7-137.4-127.0 159.3 -2.5 13.5 23.6 265 267 A T E +g 240 0A 80 -2,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.963 22.4 178.7-116.7 131.9 -0.6 10.4 24.6 266 268 A V E -g 241 0A 9 -26,-2.4 -24,-2.0 -2,-0.4 2,-0.2 -0.899 36.3 -94.7-124.8 158.4 1.1 8.1 22.1 267 269 A A E S+g 242 0A 53 -2,-0.3 2,-0.2 -26,-0.2 8,-0.1 -0.519 72.1 94.2 -71.2 136.7 3.2 4.9 22.5 268 270 A G E -g 243 0A 0 -26,-2.2 -24,-3.1 -2,-0.2 -92,-0.1 -0.833 56.9-132.4 158.4 166.4 6.9 5.5 22.5 269 271 A A S S- 0 0 9 -94,-0.5 -24,-0.3 -2,-0.2 3,-0.2 0.652 80.5 -41.9-102.8 -94.0 10.1 6.0 24.5 270 272 A H S S+ 0 0 10 -95,-1.6 2,-1.9 -26,-0.2 3,-0.2 0.830 134.5 49.8-104.8 -53.2 12.2 8.9 23.1 271 273 A F > + 0 0 2 -96,-1.8 3,-2.1 -99,-0.2 4,-0.3 -0.431 69.1 161.6 -87.6 64.9 12.2 8.7 19.3 272 274 A I G >> + 0 0 0 -2,-1.9 4,-2.7 1,-0.3 3,-1.2 0.676 57.2 76.6 -70.4 -17.5 8.5 8.4 19.3 273 275 A Q G 34 S+ 0 0 2 1,-0.3 -1,-0.3 -3,-0.2 -228,-0.1 0.745 94.9 52.7 -60.6 -25.9 8.1 9.4 15.6 274 276 A E G <4 S+ 0 0 4 -3,-2.1 -1,-0.3 2,-0.1 -2,-0.2 0.622 115.6 39.0 -85.5 -14.3 9.3 5.9 14.8 275 277 A D T <4 S+ 0 0 33 -3,-1.2 -2,-0.2 -4,-0.3 3,-0.1 0.813 131.5 16.5-100.7 -39.9 6.7 4.2 17.0 276 278 A S X + 0 0 5 -4,-2.7 4,-2.4 1,-0.1 5,-0.2 -0.297 69.5 144.9-133.1 49.1 3.5 6.3 16.5 277 279 A P H > S+ 0 0 15 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.854 75.3 49.1 -62.7 -35.6 4.0 8.4 13.4 278 280 A D H > S+ 0 0 72 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.908 112.3 47.1 -73.0 -37.5 0.3 8.3 12.3 279 281 A E H > S+ 0 0 105 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.910 116.8 45.1 -63.7 -43.5 -1.0 9.2 15.6 280 282 A I H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.941 114.1 47.9 -67.1 -48.7 1.5 12.1 15.9 281 283 A G H X S+ 0 0 0 -4,-3.0 4,-2.6 -5,-0.2 -2,-0.2 0.909 111.4 50.7 -58.6 -44.5 0.9 13.2 12.3 282 284 A A H X S+ 0 0 47 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.891 111.3 48.7 -61.3 -40.0 -2.9 13.2 12.7 283 285 A A H X S+ 0 0 16 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.910 112.1 47.5 -69.0 -43.4 -2.7 15.2 16.0 284 286 A I H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.939 111.9 50.4 -60.7 -46.3 -0.4 17.8 14.4 285 287 A A H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.908 110.5 49.5 -60.2 -42.3 -2.6 18.1 11.4 286 288 A A H X S+ 0 0 26 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.910 110.9 50.4 -63.2 -42.5 -5.7 18.6 13.5 287 289 A F H X S+ 0 0 6 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.951 112.2 47.0 -58.5 -49.5 -3.9 21.3 15.6 288 290 A V H X S+ 0 0 1 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.912 108.5 54.7 -61.7 -42.0 -2.9 23.1 12.4 289 291 A R H < S+ 0 0 139 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.890 110.0 47.9 -60.2 -35.5 -6.4 22.9 11.0 290 292 A R H < S+ 0 0 144 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.809 113.5 47.1 -71.3 -35.8 -7.8 24.5 14.1 291 293 A L H < S+ 0 0 34 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.698 119.5 41.0 -74.1 -23.8 -5.1 27.2 14.0 292 294 A R S < S+ 0 0 48 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.1 -0.547 77.3 171.6-128.6 63.4 -5.8 27.8 10.3 293 295 A P 0 0 99 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 -0.383 360.0 360.0 -72.4 153.2 -9.5 27.8 9.7 294 296 A A 0 0 174 -5,-0.1 -2,-0.0 -2,-0.1 -5,-0.0 -0.449 360.0 360.0 -72.3 360.0 -10.9 28.8 6.3