==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-JAN-09 2ZXO . COMPND 2 MOLECULE: SINGLE-STRANDED DNA SPECIFIC EXONUCLEASE RECJ; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR T.WAKAMATSU,Y.KITAMURA,N.NAKAGAWA,R.MASUI,S.KURAMITSU . 648 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29739.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 449 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 56 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 5 0.8 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 . 47 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 207 31.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.2 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 0 0 1 2 1 4 5 0 0 4 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 1 0 RESIDUES PER ALPHA HELIX . 1 4 3 1 4 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 PARALLEL BRIDGES PER LADDER . 0 0 1 1 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 3 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 50 0, 0.0 3,-1.0 0, 0.0 416,-0.2 0.000 360.0 360.0 360.0 -58.7 32.1 0.4 105.5 2 2 A R T 3 + 0 0 153 1,-0.2 345,-0.0 2,-0.1 344,-0.0 -0.038 360.0 53.9 -89.8 30.8 30.8 -0.4 102.0 3 3 A D T 3 S+ 0 0 112 3,-0.0 -1,-0.2 0, 0.0 413,-0.0 0.204 94.8 65.3-142.5 -1.1 27.5 0.9 103.2 4 4 A R S < S+ 0 0 17 -3,-1.0 413,-1.9 2,-0.0 2,-0.5 -0.035 77.1 109.8-116.0 29.1 28.6 4.3 104.4 5 5 A V E -a 417 0A 20 411,-0.2 2,-0.4 413,-0.0 413,-0.2 -0.922 50.1-163.5-109.2 123.0 29.5 5.5 100.9 6 6 A R E -a 418 0A 103 411,-3.3 413,-2.5 -2,-0.5 2,-0.6 -0.892 9.2-148.3-111.3 136.2 27.4 8.2 99.3 7 7 A W E -a 419 0A 1 -2,-0.4 518,-3.0 516,-0.4 2,-0.4 -0.892 18.6-173.9-102.3 121.0 27.4 9.1 95.6 8 8 A R E -ab 420 525A 96 411,-2.5 413,-3.4 -2,-0.6 2,-0.4 -0.942 19.0-142.7-116.9 132.2 26.7 12.8 94.8 9 9 A V E -a 421 0A 9 516,-3.4 518,-0.3 -2,-0.4 2,-0.2 -0.781 32.8-117.2 -89.2 134.8 26.2 14.3 91.4 10 10 A L - 0 0 40 411,-3.0 -1,-0.0 -2,-0.4 27,-0.0 -0.488 33.3 -99.7 -75.1 145.1 27.7 17.7 91.3 11 11 A S - 0 0 60 -2,-0.2 -1,-0.1 1,-0.1 625,-0.0 -0.072 32.3-113.8 -59.9 159.1 25.5 20.7 90.7 12 12 A L - 0 0 20 1,-0.1 -1,-0.1 0, 0.0 3,-0.1 -0.699 31.6-125.9 -93.0 145.5 25.2 22.4 87.4 13 13 A P - 0 0 5 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.392 38.6 -76.6 -89.4 172.3 26.4 26.0 87.1 14 14 A P >> - 0 0 71 0, 0.0 4,-2.8 0, 0.0 3,-1.1 -0.492 45.0-127.2 -62.2 131.7 24.5 29.0 85.9 15 15 A L H 3> S+ 0 0 13 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.774 107.5 56.9 -54.0 -28.6 24.4 28.6 82.1 16 16 A A H 3> S+ 0 0 67 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.865 112.8 40.8 -73.1 -31.4 25.8 32.1 81.6 17 17 A Q H <> S+ 0 0 62 -3,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.888 111.9 56.5 -78.3 -39.1 28.8 31.3 83.7 18 18 A W H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.943 110.8 43.8 -55.4 -50.6 29.1 27.8 82.1 19 19 A R H X S+ 0 0 80 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.841 108.6 58.5 -65.4 -32.9 29.3 29.4 78.7 20 20 A E H X S+ 0 0 133 -4,-1.2 4,-2.4 1,-0.2 -1,-0.2 0.930 109.8 44.5 -62.5 -43.1 31.8 32.0 79.9 21 21 A V H < S+ 0 0 2 -4,-2.4 6,-0.3 1,-0.2 -2,-0.2 0.921 110.4 53.2 -67.2 -45.0 34.1 29.2 81.0 22 22 A M H <>S+ 0 0 20 -4,-2.6 5,-1.8 -5,-0.2 -2,-0.2 0.912 112.2 46.4 -56.6 -42.6 33.6 27.2 77.8 23 23 A A H ><5S+ 0 0 73 -4,-2.4 3,-1.1 3,-0.2 -2,-0.2 0.969 113.5 47.3 -65.4 -58.9 34.6 30.3 75.7 24 24 A A G ><5S+ 0 0 39 -4,-2.4 3,-0.5 1,-0.2 18,-0.1 -0.402 121.2 29.9 -70.4 166.3 37.6 31.3 77.7 25 25 A L G 3 5S- 0 0 10 1,-0.2 -1,-0.2 -2,-0.1 -2,-0.1 0.374 108.8-125.7 64.8 -16.4 39.6 28.1 78.2 26 26 A E G < 5 + 0 0 149 -3,-1.1 2,-0.3 -5,-0.1 -1,-0.2 0.854 62.0 127.3 39.3 63.8 38.1 27.1 74.8 27 27 A V < < - 0 0 20 -5,-1.8 -1,-0.1 -3,-0.5 407,-0.1 -0.889 58.2 -92.0-140.5 170.9 36.6 23.7 75.8 28 28 A G > - 0 0 4 -2,-0.3 4,-2.0 405,-0.1 5,-0.1 -0.075 47.7 -93.0 -72.8 179.4 33.4 21.7 75.8 29 29 A P H > S+ 0 0 1 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.801 118.4 53.6 -66.9 -31.7 30.7 21.6 78.5 30 30 A E H > S+ 0 0 1 2,-0.2 4,-1.7 1,-0.2 3,-0.2 0.964 114.4 40.7 -71.5 -47.7 32.0 18.5 80.5 31 31 A A H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.912 112.8 56.1 -64.9 -39.2 35.4 19.9 80.9 32 32 A A H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.846 103.7 55.5 -61.3 -32.7 34.0 23.4 81.6 33 33 A L H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.955 110.5 43.3 -62.6 -53.8 31.9 21.9 84.4 34 34 A A H X S+ 0 0 1 -4,-1.7 4,-1.8 1,-0.2 6,-0.2 0.909 115.1 50.2 -59.0 -44.6 35.1 20.5 86.1 35 35 A Y H <>S+ 0 0 1 -4,-3.0 5,-2.6 1,-0.2 4,-0.4 0.922 111.0 49.2 -61.7 -41.2 36.8 23.7 85.5 36 36 A W H ><5S+ 0 0 48 -4,-2.8 3,-0.5 1,-0.2 -2,-0.2 0.841 110.4 50.6 -67.4 -34.4 33.9 25.7 87.0 37 37 A H H 3<5S+ 0 0 53 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.816 111.0 48.0 -73.3 -29.3 33.8 23.4 90.1 38 38 A R T 3<5S- 0 0 65 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.439 120.0-107.8 -89.9 -0.2 37.6 23.9 90.7 39 39 A G T < 5S+ 0 0 34 -3,-0.5 2,-0.6 -4,-0.4 -3,-0.2 0.581 70.8 141.6 88.4 7.7 37.3 27.6 90.3 40 40 A F < + 0 0 13 -5,-2.6 -1,-0.3 -6,-0.2 -2,-0.1 -0.760 9.0 137.6 -86.0 122.6 39.1 27.9 86.9 41 41 A R + 0 0 96 -2,-0.6 2,-0.3 1,-0.3 -17,-0.2 0.577 55.7 51.6-137.4 -26.3 37.3 30.6 84.8 42 42 A R S > S- 0 0 135 1,-0.1 3,-2.0 -18,-0.1 4,-0.5 -0.783 87.8-112.9-110.4 158.9 39.9 32.8 83.1 43 43 A K G >> S+ 0 0 111 -2,-0.3 4,-0.8 1,-0.3 3,-0.8 0.747 118.1 69.9 -60.5 -18.6 42.7 31.3 81.0 44 44 A E G 34 S+ 0 0 121 1,-0.2 -1,-0.3 2,-0.2 -4,-0.0 0.691 86.0 61.9 -71.3 -24.1 44.7 32.8 83.8 45 45 A D G <4 S+ 0 0 42 -3,-2.0 -1,-0.2 1,-0.2 173,-0.2 0.666 99.9 55.1 -78.3 -17.2 43.5 30.3 86.4 46 46 A L T <4 S+ 0 0 11 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.2 0.766 120.9 27.0 -85.4 -30.5 45.1 27.4 84.4 47 47 A D S < S- 0 0 105 -4,-0.8 -1,-0.2 178,-0.0 -2,-0.1 -0.567 81.7-173.0-129.9 70.3 48.5 28.9 84.4 48 48 A P - 0 0 23 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.202 38.1 -91.6 -58.3 159.4 48.7 31.1 87.4 49 49 A P - 0 0 104 0, 0.0 2,-1.3 0, 0.0 173,-0.2 -0.528 26.0-134.3 -75.4 135.1 52.0 33.1 87.6 50 50 A L + 0 0 38 -2,-0.2 2,-0.3 172,-0.1 169,-0.0 -0.795 52.4 151.9 -88.1 99.6 54.9 31.6 89.4 51 51 A A - 0 0 47 -2,-1.3 2,-1.2 146,-0.0 172,-0.1 -0.794 57.3 -82.1-128.1 170.0 55.8 34.7 91.4 52 52 A L - 0 0 45 -2,-0.3 -2,-0.0 135,-0.1 132,-0.0 -0.597 45.8-140.2 -75.2 97.3 57.4 35.6 94.7 53 53 A L - 0 0 16 -2,-1.2 2,-2.1 1,-0.1 -1,-0.0 -0.399 17.6-125.1 -56.6 129.1 54.5 35.3 97.2 54 54 A P - 0 0 103 0, 0.0 -1,-0.1 0, 0.0 118,-0.1 -0.307 39.4-179.3 -79.4 60.7 54.9 38.2 99.6 55 55 A L > - 0 0 6 -2,-2.1 3,-1.2 1,-0.1 4,-0.5 -0.234 36.4 -99.0 -60.7 148.6 55.0 36.2 102.9 56 56 A K T 3 S+ 0 0 117 109,-0.3 109,-0.6 1,-0.2 -1,-0.1 -0.550 108.5 15.0 -72.0 121.2 55.4 38.1 106.1 57 57 A G T 3> S+ 0 0 19 -2,-0.4 4,-2.3 107,-0.1 5,-0.3 0.154 92.2 113.3 100.2 -16.8 59.0 38.1 107.3 58 58 A L H <> S+ 0 0 4 -3,-1.2 4,-2.0 1,-0.2 5,-0.2 0.897 75.6 48.7 -54.6 -45.1 60.3 37.0 104.0 59 59 A R H > S+ 0 0 212 -4,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.897 110.4 50.3 -66.3 -38.0 62.1 40.3 103.2 60 60 A E H > S+ 0 0 121 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.940 110.8 48.5 -67.9 -41.9 63.8 40.5 106.6 61 61 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.887 110.8 52.6 -62.9 -35.8 65.1 36.9 106.4 62 62 A A H X S+ 0 0 2 -4,-2.0 4,-2.3 -5,-0.3 -1,-0.2 0.930 111.0 46.1 -67.1 -40.2 66.4 37.7 102.9 63 63 A A H X S+ 0 0 27 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.945 111.6 52.1 -64.6 -45.6 68.2 40.8 104.3 64 64 A L H X S+ 0 0 34 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.860 110.9 48.0 -59.7 -37.2 69.5 38.8 107.2 65 65 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.891 105.4 56.9 -73.1 -37.9 70.8 36.2 104.8 66 66 A E H X S+ 0 0 46 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.955 109.4 48.3 -53.9 -48.8 72.5 38.7 102.5 67 67 A E H X S+ 0 0 66 -4,-2.2 4,-2.7 1,-0.2 6,-0.3 0.891 107.6 54.5 -56.5 -46.3 74.4 39.9 105.5 68 68 A A H <>S+ 0 0 5 -4,-1.8 5,-2.5 1,-0.2 -1,-0.2 0.928 112.3 44.1 -56.6 -47.0 75.4 36.3 106.5 69 69 A L H ><5S+ 0 0 24 -4,-2.6 3,-1.1 3,-0.2 -2,-0.2 0.908 114.4 46.0 -65.1 -48.2 76.9 35.7 103.0 70 70 A R H 3<5S+ 0 0 171 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.901 117.3 45.4 -63.1 -40.8 78.7 39.0 102.6 71 71 A Q T 3<5S- 0 0 101 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.295 109.5-121.9 -86.6 8.9 80.1 38.7 106.1 72 72 A G T < 5 + 0 0 51 -3,-1.1 -3,-0.2 1,-0.2 -4,-0.1 0.767 48.2 171.1 57.9 30.4 81.1 35.0 105.8 73 73 A K < - 0 0 84 -5,-2.5 29,-0.8 -6,-0.3 2,-0.5 -0.338 37.9-109.4 -69.7 153.9 79.0 33.9 108.7 74 74 A R E -i 102 0B 101 27,-0.1 47,-2.9 29,-0.1 48,-2.3 -0.757 35.4-159.3 -89.4 124.3 78.5 30.1 109.3 75 75 A I E -ij 103 122B 0 27,-3.3 29,-2.3 -2,-0.5 2,-0.5 -0.890 9.3-163.2-111.3 135.7 75.0 28.9 108.5 76 76 A R E -ij 104 123B 25 46,-2.1 48,-3.4 -2,-0.4 2,-0.8 -0.964 8.8-152.7-117.6 120.5 73.3 25.7 109.7 77 77 A V E -ij 105 124B 0 27,-2.6 29,-2.6 -2,-0.5 2,-0.8 -0.841 11.4-168.8 -98.8 108.9 70.2 24.5 107.9 78 78 A H E +ij 106 125B 29 46,-4.0 48,-3.8 -2,-0.8 2,-0.3 -0.866 17.5 179.6 -98.3 104.6 68.1 22.5 110.4 79 79 A G E - j 0 126B 0 27,-1.5 48,-0.2 -2,-0.8 7,-0.1 -0.752 32.7-103.0-116.8 161.3 65.4 20.7 108.5 80 80 A D - 0 0 26 46,-1.6 9,-0.2 -2,-0.3 8,-0.1 -0.298 33.7-127.2 -65.7 156.7 62.5 18.4 109.0 81 81 A Y S S+ 0 0 113 4,-0.1 186,-0.1 5,-0.1 -1,-0.1 0.549 78.2 88.1 -91.9 -6.5 63.2 14.7 108.1 82 82 A D S > S- 0 0 15 185,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.196 100.0 -87.6 -79.4-178.7 60.3 13.9 105.7 83 83 A A H > S+ 0 0 0 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.906 128.3 52.1 -58.1 -42.8 60.5 14.6 102.0 84 84 A D H > S+ 0 0 0 124,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.926 113.1 45.7 -59.9 -46.0 59.3 18.3 102.3 85 85 A G H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.889 115.6 45.5 -66.0 -39.7 61.9 18.9 105.0 86 86 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.922 113.6 46.9 -74.4 -40.4 64.7 17.3 103.1 87 87 A T H X S+ 0 0 1 -4,-3.4 4,-2.2 -5,-0.2 -2,-0.2 0.902 113.5 50.4 -67.3 -34.4 64.0 18.9 99.7 88 88 A G H X S+ 0 0 0 -4,-2.1 4,-2.3 -5,-0.3 5,-0.2 0.914 109.9 50.0 -67.0 -41.0 63.6 22.3 101.4 89 89 A T H X S+ 0 0 3 -4,-1.9 4,-2.9 1,-0.2 -1,-0.2 0.890 110.9 49.7 -62.9 -39.9 66.9 21.8 103.2 90 90 A A H X>S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.5 0.892 107.2 55.3 -68.2 -37.9 68.6 20.9 99.9 91 91 A I H X5S+ 0 0 0 -4,-2.2 4,-3.0 1,-0.2 -2,-0.2 0.976 115.0 38.1 -57.2 -54.9 67.1 24.0 98.3 92 92 A L H X5S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.880 117.7 49.1 -65.6 -40.3 68.7 26.2 100.9 93 93 A V H X5S+ 0 0 12 -4,-2.9 4,-2.3 -5,-0.2 5,-0.2 0.969 119.5 36.9 -66.8 -50.0 71.9 24.4 101.2 94 94 A R H X5S+ 0 0 24 -4,-2.8 4,-2.5 -5,-0.2 5,-0.2 0.970 118.2 53.4 -64.3 -49.6 72.5 24.2 97.5 95 95 A G H <<>S+ 0 0 0 -4,-2.8 5,-2.3 1,-0.2 3,-1.2 0.878 113.2 56.1 -71.1 -38.3 73.3 29.3 99.6 97 97 A A H ><5S+ 0 0 54 -4,-2.3 3,-2.0 -5,-0.3 -1,-0.2 0.906 102.0 58.7 -59.5 -38.8 76.4 27.3 98.7 98 98 A A T 3<5S+ 0 0 75 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.732 105.3 51.0 -63.8 -21.2 76.0 28.5 95.1 99 99 A L T < 5S- 0 0 48 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.228 126.1 -95.9-102.3 16.1 76.3 32.0 96.4 100 100 A G T < 5S+ 0 0 63 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.620 71.5 152.9 84.9 12.2 79.5 31.6 98.4 101 101 A A < - 0 0 16 -5,-2.3 2,-1.0 -6,-0.1 -1,-0.2 -0.410 51.0-126.7 -72.8 152.5 77.8 31.0 101.8 102 102 A D E +i 74 0B 70 -29,-0.8 -27,-3.3 -34,-0.1 2,-0.4 -0.894 57.5 154.4 -98.2 96.2 79.6 28.8 104.5 103 103 A V E +i 75 0B 23 -2,-1.0 -27,-0.2 -29,-0.2 -29,-0.1 -0.992 25.1 170.9-140.6 138.6 76.7 26.5 105.0 104 104 A H E -i 76 0B 30 -29,-2.3 -27,-2.6 -2,-0.4 2,-0.1 -0.947 28.5-112.9-140.0 156.8 76.0 22.9 106.1 105 105 A P E -i 77 0B 51 0, 0.0 2,-0.3 0, 0.0 -27,-0.2 -0.446 19.8-171.1 -92.0 164.7 72.9 20.9 106.9 106 106 A F E +i 78 0B 29 -29,-2.6 -27,-1.5 -2,-0.1 -30,-0.0 -0.864 6.6 178.1-154.8 117.5 71.6 19.4 110.2 107 107 A I 0 0 34 -2,-0.3 -27,-0.1 -29,-0.2 166,-0.1 -0.981 360.0 360.0-127.3 133.7 68.6 17.0 110.5 108 108 A P 0 0 84 0, 0.0 164,-0.1 0, 0.0 -2,-0.0 -0.234 360.0 360.0 -55.9 360.0 67.2 15.3 113.7 109 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 110 119 A M > 0 0 120 0, 0.0 3,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -44.1 67.5 21.1 123.6 111 120 A E T 3 + 0 0 170 1,-0.2 4,-0.1 2,-0.1 0, 0.0 0.676 360.0 43.1 -65.4 -16.4 70.2 18.4 124.0 112 121 A R T >> S+ 0 0 114 1,-0.1 4,-1.9 2,-0.1 3,-1.7 0.543 86.9 92.7-105.0 -10.2 71.6 19.4 120.7 113 122 A V H <> S+ 0 0 12 -3,-0.7 4,-2.1 1,-0.3 -2,-0.1 0.854 82.5 56.3 -51.1 -42.6 71.3 23.2 121.2 114 123 A P H 3> S+ 0 0 88 0, 0.0 4,-1.2 0, 0.0 -1,-0.3 0.735 108.1 49.0 -65.2 -20.0 74.9 23.4 122.5 115 124 A E H <> S+ 0 0 87 -3,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.850 108.7 51.1 -82.5 -41.9 76.1 21.8 119.2 116 125 A H H X S+ 0 0 8 -4,-1.9 4,-1.2 1,-0.2 -3,-0.1 0.878 109.0 55.2 -61.2 -37.2 74.1 24.2 117.1 117 126 A L H < S+ 0 0 45 -4,-2.1 3,-0.2 -5,-0.2 -2,-0.2 0.912 110.9 40.3 -63.2 -49.4 75.7 27.0 119.2 118 127 A E H < S+ 0 0 161 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.859 119.3 46.3 -70.4 -36.9 79.4 26.0 118.6 119 128 A A H < S+ 0 0 11 -4,-2.2 2,-0.4 -5,-0.1 -1,-0.2 0.594 109.7 50.7 -86.0 -8.1 78.8 25.2 114.9 120 129 A S < - 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0 0 4 -109,-0.6 3,-1.8 -2,-0.5 -109,-0.3 -0.971 40.0-148.4-125.5 127.8 55.1 31.5 108.2 166 175 A P G > S+ 0 0 10 0, 0.0 3,-2.2 0, 0.0 -110,-0.1 0.915 102.9 55.1 -53.3 -49.9 52.3 31.5 105.6 167 176 A A G 3 S+ 0 0 68 1,-0.3 -16,-0.0 -15,-0.1 8,-0.0 0.216 102.8 59.3 -72.5 16.1 49.6 31.4 108.3 168 177 A L G < S+ 0 0 48 -3,-1.8 -1,-0.3 2,-0.1 -5,-0.0 0.186 85.2 89.5-124.1 7.9 51.2 34.4 109.8 169 178 A T S < S- 0 0 19 -3,-2.2 -114,-0.0 3,-0.1 -1,-0.0 -0.933 81.5-129.4-109.8 109.2 50.7 36.5 106.7 170 179 A P S S+ 0 0 102 0, 0.0 2,-1.3 0, 0.0 -2,-0.1 -0.119 81.4 2.3 -54.2 154.6 47.3 38.2 106.9 171 180 A D S S+ 0 0 158 1,-0.1 -2,-0.1 2,-0.1 0, 0.0 -0.536 90.5 126.0 70.5 -95.0 45.0 37.9 103.9 172 181 A L - 0 0 28 -2,-1.3 -3,-0.1 1,-0.1 -1,-0.1 0.583 39.4-168.6 5.9 115.4 47.2 35.5 101.7 173 182 A K + 0 0 174 -3,-0.1 2,-0.2 2,-0.0 -1,-0.1 0.263 49.5 107.0-109.2 16.0 45.3 32.4 100.8 174 183 A E - 0 0 49 -8,-0.1 44,-0.1 44,-0.0 0, 0.0 -0.492 56.0-151.2 -86.1 158.8 48.1 30.3 99.4 175 184 A K - 0 0 128 42,-0.3 5,-0.1 40,-0.2 42,-0.1 -0.544 19.0-179.2-131.0 68.9 49.4 27.4 101.4 176 185 A P - 0 0 1 0, 0.0 2,-0.0 0, 0.0 43,-0.0 -0.376 19.4-133.9 -69.3 150.2 53.1 26.8 100.6 177 186 A T > - 0 0 0 28,-0.1 4,-3.0 1,-0.1 5,-0.2 -0.172 34.2 -86.0 -87.7-172.5 54.9 24.0 102.3 178 187 A G H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -51,-0.2 0.940 132.3 44.6 -61.4 -49.1 58.3 23.9 104.0 179 188 A A H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.915 112.7 53.5 -64.3 -38.9 60.1 23.3 100.7 180 189 A G H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.945 110.9 45.2 -60.2 -44.2 57.9 25.9 99.1 181 190 A V H X S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 -1,-0.2 0.892 110.4 53.8 -65.6 -38.7 58.9 28.5 101.8 182 191 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.908 110.4 49.3 -59.6 -41.5 62.5 27.5 101.5 183 192 A F H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.890 109.9 48.7 -64.9 -44.4 62.1 28.2 97.7 184 193 A L H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.941 110.6 52.3 -63.4 -43.8 60.5 31.6 98.2 185 194 A L H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.3 -2,-0.2 0.877 108.8 48.5 -61.2 -41.5 63.3 32.6 100.7 186 195 A L H X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.3 0.907 111.6 52.5 -65.0 -36.8 66.0 31.6 98.3 187 196 A W H X S+ 0 0 16 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.949 107.3 50.3 -60.1 -51.8 64.0 33.7 95.7 188 197 A A H X S+ 0 0 8 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.884 110.2 50.6 -55.1 -42.1 63.9 36.8 97.9 189 198 A L H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.901 108.6 52.3 -65.4 -39.6 67.7 36.5 98.5 190 199 A H H X>S+ 0 0 20 -4,-2.3 5,-3.3 2,-0.2 4,-0.5 0.904 107.4 53.0 -63.9 -38.2 68.1 36.3 94.7 191 200 A E H ><5S+ 0 0 115 -4,-2.6 3,-1.9 1,-0.2 -2,-0.2 0.980 109.1 48.5 -60.0 -53.9 66.0 39.5 94.3 192 201 A R H 3<5S+ 0 0 121 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.875 112.2 48.6 -53.9 -39.2 68.2 41.3 96.8 193 202 A L H 3<5S- 0 0 67 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.479 116.7-110.4 -83.2 1.9 71.4 40.2 95.1 194 203 A G T <<5S+ 0 0 64 -3,-1.9 -3,-0.2 -4,-0.5 -2,-0.1 0.827 72.1 138.8 76.0 30.7 70.2 41.2 91.6 195 204 A L < - 0 0 65 -5,-3.3 -1,-0.2 -6,-0.2 -2,-0.0 -0.667 56.0-102.2-107.2 163.7 69.9 37.6 90.5 196 205 A P - 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.398 56.4 -73.3 -78.4 163.9 67.2 35.9 88.4 197 206 A P - 0 0 60 0, 0.0 2,-2.7 0, 0.0 3,-0.3 -0.210 45.9-116.2 -52.0 139.6 64.5 33.6 90.0 198 207 A P > + 0 0 3 0, 0.0 3,-2.2 0, 0.0 4,-0.3 -0.280 54.4 156.6 -76.7 59.4 66.0 30.2 91.2 199 208 A L G > + 0 0 52 -2,-2.7 3,-1.6 1,-0.3 4,-0.3 0.787 62.1 68.5 -60.6 -23.9 63.8 28.3 88.8 200 209 A E G 3 S+ 0 0 79 -3,-0.3 3,-0.4 1,-0.3 35,-0.4 0.669 95.5 57.6 -69.9 -11.1 66.1 25.4 88.7 201 210 A Y G <> S+ 0 0 10 -3,-2.2 4,-2.1 1,-0.2 -1,-0.3 0.476 80.2 89.7 -95.0 -2.4 65.1 24.7 92.4 202 211 A A H <> S+ 0 0 0 -3,-1.6 4,-2.2 -4,-0.3 25,-0.4 0.737 79.7 59.6 -65.9 -23.5 61.4 24.4 91.5 203 212 A D H > S+ 0 0 1 -3,-0.4 4,-2.3 -4,-0.3 -1,-0.2 0.967 108.6 43.7 -71.1 -47.7 61.7 20.6 90.9 204 213 A L H > S+ 0 0 0 -4,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.899 114.8 50.5 -59.5 -40.1 62.9 20.1 94.5 205 214 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.899 108.9 52.5 -63.2 -40.7 60.2 22.5 95.8 206 215 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 17,-0.2 5,-0.2 0.899 106.2 52.5 -63.2 -45.4 57.6 20.6 93.8 207 216 A V H X S+ 0 0 1 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.946 112.0 44.7 -56.6 -50.7 58.5 17.2 95.3 208 217 A G H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -124,-0.3 0.870 111.6 54.7 -61.4 -37.6 58.2 18.5 98.8 209 218 A T H <>S+ 0 0 0 -4,-2.0 5,-1.8 2,-0.2 -1,-0.2 0.894 112.2 41.7 -65.1 -40.8 55.0 20.3 98.0 210 219 A I H ><5S+ 0 0 16 -4,-2.4 3,-1.9 1,-0.2 -2,-0.2 0.923 113.0 55.6 -71.1 -45.4 53.4 17.0 96.7 211 220 A A H 3<5S+ 0 0 22 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.850 106.5 48.5 -56.3 -40.6 54.9 15.0 99.5 212 221 A D T 3<5S- 0 0 41 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.330 109.9-125.1 -84.5 9.2 53.3 17.2 102.2 213 222 A V T < 5 + 0 0 86 -3,-1.9 -3,-0.2 1,-0.1 -2,-0.1 0.883 45.6 172.2 51.3 48.1 50.0 17.0 100.4 214 223 A A < - 0 0 8 -5,-1.8 233,-0.5 1,-0.1 232,-0.4 -0.502 45.4 -84.2 -81.9 157.6 49.5 20.7 100.1 215 224 A P - 0 0 23 0, 0.0 2,-1.5 0, 0.0 -40,-0.2 -0.445 36.3-135.7 -64.1 128.9 46.5 22.0 98.0 216 225 A L + 0 0 5 -2,-0.2 2,-0.3 4,-0.1 232,-0.2 -0.349 65.3 104.0 -86.2 58.4 47.5 22.1 94.3 217 226 A W S >> S- 0 0 126 -2,-1.5 3,-1.1 230,-0.1 4,-0.6 -0.899 72.7 -7.7-133.7 165.3 46.0 25.5 93.5 218 227 A G H 3> S- 0 0 25 -2,-0.3 4,-2.5 1,-0.3 5,-0.2 -0.252 132.3 -1.3 55.4-133.6 47.2 29.0 92.9 219 228 A W H 3> S+ 0 0 6 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.918 135.9 55.4 -53.4 -49.3 50.9 29.4 93.7 220 229 A N H <> S+ 0 0 2 -3,-1.1 4,-2.1 1,-0.2 -1,-0.2 0.920 109.6 47.7 -53.8 -43.7 51.3 25.8 94.7 221 230 A R H X S+ 0 0 0 -4,-0.6 4,-2.1 2,-0.2 -1,-0.2 0.932 112.9 48.2 -62.3 -46.5 49.8 24.7 91.3 222 231 A A H X S+ 0 0 6 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.931 110.6 51.8 -57.6 -47.8 52.2 27.1 89.5 223 232 A L H X S+ 0 0 0 -4,-3.4 4,-2.5 1,-0.2 -17,-0.2 0.903 109.7 48.5 -58.5 -43.8 55.2 25.9 91.4 224 233 A V H X S+ 0 0 0 -4,-2.1 4,-3.9 -5,-0.3 5,-0.3 0.889 108.0 53.2 -67.8 -38.6 54.5 22.2 90.7 225 234 A K H X S+ 0 0 51 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.929 111.6 46.9 -62.6 -41.8 54.0 22.8 87.0 226 235 A E H X S+ 0 0 54 -4,-2.2 4,-0.8 -5,-0.2 -2,-0.2 0.964 118.8 41.8 -62.3 -50.0 57.4 24.5 86.8 227 236 A G H >X S+ 0 0 0 -4,-2.5 4,-1.3 -25,-0.4 3,-0.6 0.884 108.6 54.6 -66.1 -44.5 59.0 21.7 88.9 228 237 A L H 3< S+ 0 0 13 -4,-3.9 3,-0.3 1,-0.3 -1,-0.2 0.906 110.8 50.3 -59.2 -35.2 57.4 18.7 87.3 229 238 A A H 3< S+ 0 0 77 -4,-1.5 4,-0.3 -5,-0.3 -1,-0.3 0.736 108.3 50.5 -74.7 -24.3 58.7 19.9 84.0 230 239 A R H << S+ 0 0 91 -4,-0.8 3,-0.4 -3,-0.6 -1,-0.2 0.642 90.0 83.6 -90.1 -10.4 62.3 20.5 85.2 231 240 A I S >< S+ 0 0 0 -4,-1.3 3,-1.9 -3,-0.3 -1,-0.2 0.889 80.7 57.9 -59.7 -46.4 62.7 17.0 86.7 232 241 A P T 3 S+ 0 0 64 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.867 123.0 26.7 -56.3 -34.4 63.6 15.1 83.5 233 242 A A T 3 S+ 0 0 77 -3,-0.4 -2,-0.2 -4,-0.3 4,-0.1 -0.110 94.5 171.3-116.6 37.5 66.6 17.4 83.0 234 243 A S < - 0 0 12 -3,-1.9 -3,-0.1 1,-0.2 -33,-0.1 0.068 41.9-134.9 -47.8 153.6 67.1 18.3 86.7 235 244 A S S S+ 0 0 58 -35,-0.4 2,-0.8 1,-0.2 -1,-0.2 0.591 98.1 72.5 -83.0 -11.5 70.1 20.3 87.8 236 245 A W S >> S- 0 0 13 1,-0.1 4,-2.1 -36,-0.1 3,-1.3 -0.860 70.5-163.6-108.4 96.4 70.3 17.7 90.6 237 246 A V H 3> S+ 0 0 35 -2,-0.8 4,-2.2 1,-0.3 5,-0.2 0.774 87.8 60.4 -52.4 -30.5 71.4 14.5 89.1 238 247 A G H 3> S+ 0 0 0 43,-0.6 4,-1.8 40,-0.3 -1,-0.3 0.880 107.6 43.7 -65.9 -38.0 70.2 12.6 92.3 239 248 A L H <> S+ 0 0 1 -3,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.920 114.2 49.6 -73.4 -42.6 66.6 13.8 91.7 240 249 A R H X S+ 0 0 106 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.930 113.0 47.7 -59.4 -43.3 66.7 13.1 88.0 241 250 A L H X S+ 0 0 42 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.860 110.9 50.1 -67.8 -38.3 68.1 9.6 88.6 242 251 A L H X S+ 0 0 0 -4,-1.8 4,-1.1 2,-0.2 -1,-0.2 0.903 111.7 50.1 -66.1 -40.3 65.5 8.7 91.3 243 252 A A H <>S+ 0 0 2 -4,-2.3 5,-3.0 2,-0.2 -2,-0.2 0.881 112.0 45.5 -66.2 -42.2 62.7 9.9 88.9 244 253 A E H ><5S+ 0 0 102 -4,-2.2 3,-3.5 1,-0.2 -2,-0.2 0.972 105.1 61.7 -67.9 -47.2 64.0 7.8 86.1 245 254 A A H 3<5S+ 0 0 51 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.826 110.2 42.3 -47.0 -32.0 64.4 4.8 88.4 246 255 A V T 3<5S- 0 0 15 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.330 119.6-109.1 -98.6 8.1 60.7 4.9 89.0 247 256 A G T < 5 - 0 0 43 -3,-3.5 -3,-0.2 1,-0.2 -2,-0.1 0.828 44.1-165.9 73.3 30.9 59.7 5.6 85.4 248 257 A Y < + 0 0 27 -5,-3.0 -1,-0.2 1,-0.1 -5,-0.0 -0.194 18.4 179.0 -51.1 136.6 58.7 9.2 85.8 249 258 A T - 0 0 106 2,-0.1 -1,-0.1 0, 0.0 -5,-0.0 -0.035 63.9 -84.0-128.8 25.9 56.7 10.6 82.9 250 259 A G S S+ 0 0 28 1,-0.2 2,-0.4 -22,-0.1 -2,-0.1 0.573 85.4 136.0 85.7 10.3 56.1 14.1 84.3 251 260 A K >> - 0 0 85 1,-0.1 3,-1.2 192,-0.0 4,-1.1 -0.763 55.8-140.1 -98.9 132.9 53.0 13.3 86.4 252 261 A A H 3> S+ 0 0 3 -2,-0.4 4,-2.4 1,-0.3 3,-0.2 0.819 102.3 62.7 -55.2 -30.9 52.4 14.6 89.9 253 262 A V H 3> S+ 0 0 82 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.818 98.8 55.9 -66.7 -30.2 50.9 11.2 90.9 254 263 A E H <>>S+ 0 0 15 -3,-1.2 4,-2.6 2,-0.2 5,-1.5 0.854 108.2 47.5 -68.5 -37.4 54.2 9.5 90.2 255 264 A V H <>S+ 0 0 0 -4,-1.1 5,-2.5 3,-0.2 4,-0.4 0.963 113.4 47.2 -66.5 -53.9 55.9 11.9 92.7 256 265 A A H <5S+ 0 0 35 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.865 127.2 27.0 -58.5 -35.9 53.3 11.4 95.4 257 266 A F H <5S+ 0 0 155 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.669 134.3 20.8-107.3 -15.5 53.4 7.6 95.0 258 267 A R T X5S+ 0 0 121 -4,-2.6 4,-0.5 -5,-0.2 -3,-0.2 0.698 124.1 36.8-120.2 -38.0 56.9 6.7 93.7 259 268 A I H >> S+ 0 0 30 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.889 103.9 51.4 -59.4 -39.6 57.9 7.4 99.4 262 271 A R H <>S+ 0 0 0 -4,-1.3 5,-2.5 2,-0.2 3,-0.9 0.952 114.7 44.3 -58.4 -48.9 65.1 6.3 104.2 267 276 A S H ><5S+ 0 0 13 -4,-1.6 3,-2.2 4,-0.3 5,-0.4 0.958 110.5 50.8 -61.8 -55.9 64.1 8.8 106.8 268 277 A R H 3<5S+ 0 0 87 -4,-3.4 -1,-0.3 1,-0.3 -2,-0.2 0.546 110.5 53.9 -62.5 -4.5 61.6 6.6 108.6 269 278 A L T <<5S- 0 0 29 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.190 122.1-101.0-115.7 17.2 64.3 3.9 108.8 270 279 A G T < 5S+ 0 0 55 -3,-2.2 3,-0.2 1,-0.1 -3,-0.2 0.416 100.1 99.9 82.2 -2.0 67.0 6.0 110.4 271 280 A E >>< + 0 0 58 -5,-2.5 3,-1.2 -6,-0.3 4,-0.8 -0.218 31.9 134.2-112.5 47.5 68.9 6.7 107.2 272 281 A A H 3> + 0 0 8 -5,-0.4 4,-2.3 1,-0.3 -5,-0.2 0.732 66.3 66.2 -62.9 -26.7 67.7 10.2 106.3 273 282 A E H 3> S+ 0 0 104 -3,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.765 96.2 59.9 -68.1 -22.8 71.2 11.4 105.6 274 283 A K H <> S+ 0 0 47 -3,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.962 106.0 43.5 -68.4 -48.1 71.1 9.1 102.7 275 284 A A H X S+ 0 0 1 -4,-0.8 4,-1.4 1,-0.2 -2,-0.2 0.916 114.8 51.4 -62.2 -43.5 68.1 10.8 101.1 276 285 A L H >X S+ 0 0 10 -4,-2.3 4,-1.1 1,-0.2 3,-0.6 0.941 107.6 50.6 -60.2 -48.2 69.6 14.2 101.8 277 286 A R H 3X S+ 0 0 110 -4,-2.3 4,-2.5 1,-0.2 3,-0.4 0.858 104.9 58.7 -59.0 -34.3 73.0 13.3 100.2 278 287 A L H 3< S+ 0 0 1 -4,-1.8 -40,-0.3 1,-0.2 -1,-0.2 0.886 108.8 45.2 -60.4 -40.9 71.1 12.0 97.1 279 288 A L H << S+ 0 0 0 -4,-1.4 -1,-0.2 -3,-0.6 -2,-0.2 0.639 118.8 43.4 -76.4 -19.7 69.6 15.5 96.7 280 289 A L H < S+ 0 0 31 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.629 90.2 93.7-103.0 -21.3 73.0 17.2 97.3 281 290 A T < - 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