==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE, LYASE/DNA 25-OCT-06 2NOF . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR C.T.RADOM,A.BANERJEE,G.L.VERDINE . 312 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14158.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 9.0 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 . 1 0.3 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 . 13 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 37.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 2 0 1 1 2 2 3 0 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 0 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 9 A S 0 0 105 0, 0.0 9,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -53.1 28.4 -13.8 36.6 2 10 A E + 0 0 146 4,-0.1 2,-0.3 73,-0.0 4,-0.1 0.536 360.0 68.7 -77.3 -7.5 24.7 -14.0 37.3 3 11 A F S S+ 0 0 171 2,-0.1 160,-0.1 160,-0.1 2,-0.0 -0.781 86.4 18.4-114.2 157.2 25.3 -11.4 40.0 4 12 A G S S- 0 0 11 -2,-0.3 2,-0.2 158,-0.2 158,-0.0 -0.152 105.0 -28.1 80.3-178.6 26.2 -7.8 39.9 5 13 A H S S- 0 0 27 158,-0.1 -2,-0.1 1,-0.1 2,-0.1 -0.509 71.9-122.0 -71.5 137.7 26.0 -5.3 37.1 6 14 A R - 0 0 30 -2,-0.2 2,-0.3 -4,-0.1 -1,-0.1 -0.283 19.6-157.5 -78.3 164.8 26.3 -6.9 33.7 7 15 A T > - 0 0 42 1,-0.1 4,-1.7 -2,-0.1 8,-0.1 -0.946 32.0-114.6-137.5 152.9 28.9 -6.2 30.9 8 16 A L T 4 S+ 0 0 51 -2,-0.3 7,-0.1 1,-0.2 6,-0.1 0.846 119.2 44.3 -58.7 -32.3 28.6 -6.9 27.2 9 17 A A T 4 S+ 0 0 82 2,-0.1 -1,-0.2 1,-0.1 -3,-0.0 0.917 110.2 50.8 -78.1 -47.7 31.5 -9.4 27.7 10 18 A S T 4 S+ 0 0 59 1,-0.2 -2,-0.2 2,-0.1 -1,-0.1 0.768 129.0 17.2 -65.6 -29.4 30.4 -11.2 30.9 11 19 A T S >< S+ 0 0 17 -4,-1.7 3,-2.7 1,-0.1 4,-0.2 -0.278 70.2 162.4-141.7 55.5 26.8 -12.0 29.7 12 20 A P G > S+ 0 0 80 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.760 74.2 60.2 -42.9 -39.4 26.8 -11.6 25.8 13 21 A A G 3 S+ 0 0 74 1,-0.2 64,-0.4 -3,-0.1 -5,-0.1 0.674 98.6 58.8 -69.2 -17.1 23.5 -13.6 25.5 14 22 A L G < S+ 0 0 34 -3,-2.7 55,-0.4 62,-0.1 2,-0.3 0.387 91.0 86.6 -94.6 4.0 21.6 -11.1 27.7 15 23 A W < - 0 0 12 -3,-1.3 2,-0.3 -4,-0.2 53,-0.2 -0.801 52.0-170.4-107.8 148.2 22.3 -8.0 25.5 16 24 A A E -A 67 0A 13 51,-2.4 51,-3.2 -2,-0.3 2,-0.3 -0.972 16.6-137.9-131.0 145.3 20.4 -6.7 22.5 17 25 A S E -A 66 0A 53 -2,-0.3 49,-0.2 49,-0.2 43,-0.1 -0.756 7.3-154.5-112.1 156.1 21.5 -3.9 20.2 18 26 A I E -A 65 0A 7 47,-1.6 47,-2.0 -2,-0.3 2,-0.1 -0.994 36.7-108.6-122.9 125.8 19.9 -0.9 18.6 19 27 A P E +A 64 0A 99 0, 0.0 45,-0.2 0, 0.0 44,-0.0 -0.372 62.4 142.5 -55.7 122.8 21.4 0.4 15.4 20 28 A C - 0 0 5 43,-2.4 41,-0.2 -2,-0.1 2,-0.1 -0.699 39.8-142.1-170.2 112.6 23.0 3.7 16.5 21 29 A P >> - 0 0 38 0, 0.0 3,-2.1 0, 0.0 4,-1.0 -0.426 27.9-117.3 -77.8 152.6 26.2 5.4 15.5 22 30 A R T 34 S+ 0 0 88 40,-1.5 41,-0.1 1,-0.3 3,-0.1 0.748 115.3 66.0 -57.4 -23.0 28.4 7.3 17.9 23 31 A S T 34 S+ 0 0 50 39,-0.3 96,-1.1 1,-0.2 -1,-0.3 0.727 104.2 43.0 -72.3 -22.8 27.7 10.3 15.7 24 32 A E T <4 S+ 0 0 22 -3,-2.1 2,-0.3 1,-0.3 -1,-0.2 0.586 129.5 11.6 -96.2 -15.4 24.0 10.1 16.7 25 33 A L < - 0 0 0 -4,-1.0 2,-0.5 -3,-0.1 -1,-0.3 -0.886 48.9-172.3-167.2 132.8 24.6 9.5 20.4 26 34 A R >> - 0 0 63 93,-2.0 3,-1.9 -2,-0.3 4,-1.3 -0.912 10.5-162.9-129.7 102.8 27.5 9.5 22.9 27 35 A L H >> S+ 0 0 2 -2,-0.5 4,-2.4 1,-0.3 3,-0.6 0.881 90.5 55.6 -50.0 -46.1 26.5 8.1 26.3 28 36 A D H 34 S+ 0 0 69 1,-0.2 -1,-0.3 2,-0.2 13,-0.0 0.636 112.0 44.6 -66.4 -13.1 29.4 9.6 28.1 29 37 A L H <4 S+ 0 0 20 -3,-1.9 -1,-0.2 90,-0.1 -2,-0.2 0.614 122.3 34.3-102.7 -17.3 28.4 13.0 26.8 30 38 A V H X< S+ 0 0 0 -4,-1.3 3,-0.7 -3,-0.6 5,-0.5 0.842 109.2 54.5-106.4 -43.5 24.7 12.8 27.6 31 39 A L T 3< S+ 0 0 2 -4,-2.4 8,-0.4 1,-0.2 3,-0.2 0.782 117.0 32.6 -67.4 -32.2 24.1 10.7 30.7 32 40 A P T 3 S+ 0 0 57 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.263 93.7 96.2-109.3 16.2 26.2 12.6 33.2 33 41 A S S < S- 0 0 27 -3,-0.7 -2,-0.1 1,-0.0 4,-0.1 0.097 105.5 -88.6 -94.2 23.9 25.8 16.1 31.7 34 42 A G S S+ 0 0 14 2,-0.4 3,-0.1 -3,-0.2 -3,-0.1 0.718 104.1 98.1 83.4 19.2 23.0 17.5 33.8 35 43 A Q S S+ 0 0 10 1,-0.6 2,-0.4 -5,-0.5 -4,-0.1 0.823 96.6 11.6 -97.1 -61.2 19.9 16.2 31.9 36 44 A S - 0 0 2 -6,-0.4 -1,-0.6 -5,-0.2 -2,-0.4 -0.889 60.3-164.2-113.4 146.2 19.1 13.2 33.9 37 45 A F S S+ 0 0 11 -2,-0.4 113,-0.1 -3,-0.1 -1,-0.1 0.300 73.2 82.5-113.1 10.3 20.8 12.5 37.3 38 46 A R + 0 0 30 12,-0.1 2,-0.5 -7,-0.0 12,-0.3 0.295 67.9 97.0 -97.4 7.9 19.9 8.8 37.6 39 47 A W - 0 0 12 -8,-0.4 2,-0.4 -3,-0.2 10,-0.2 -0.873 46.1-178.4-107.5 133.0 22.7 7.3 35.5 40 48 A R E -B 48 0A 105 8,-2.5 8,-2.9 -2,-0.5 2,-1.7 -0.968 30.8-134.5-126.2 138.6 26.0 5.9 36.8 41 49 A E E +B 47 0A 98 -2,-0.4 6,-0.2 6,-0.2 4,-0.1 -0.664 33.0 173.7 -88.3 82.5 28.9 4.4 35.0 42 50 A Q E S+ 0 0 77 -2,-1.7 -1,-0.2 4,-0.6 5,-0.1 0.714 71.4 15.0 -65.8 -22.3 29.2 1.4 37.3 43 51 A S E > S-B 46 0A 30 3,-1.1 3,-3.0 -3,-0.2 -1,-0.2 -0.961 113.6 -67.4-150.9 136.1 31.9 -0.2 35.2 44 52 A P T 3 S- 0 0 112 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 0.167 118.8 -4.1 -28.5 123.9 33.9 1.6 32.4 45 53 A A T 3 S+ 0 0 53 1,-0.1 2,-0.6 -4,-0.1 15,-0.4 0.469 110.4 111.7 66.0 3.1 31.8 2.6 29.4 46 54 A H E < -B 43 0A 18 -3,-3.0 -3,-1.1 13,-0.1 -4,-0.6 -0.922 50.3-163.8-112.2 117.8 28.8 0.8 31.0 47 55 A W E -BC 41 58A 17 11,-3.3 11,-2.7 -2,-0.6 2,-0.4 -0.870 5.0-172.0-108.7 126.4 25.9 3.0 32.3 48 56 A S E +BC 40 57A 1 -8,-2.9 -8,-2.5 -2,-0.5 2,-0.3 -0.889 23.7 117.7-115.7 144.2 23.2 1.8 34.6 49 57 A G E - C 0 56A 0 7,-1.8 7,-2.8 -2,-0.4 2,-0.5 -0.969 60.4 -68.9-179.3-179.1 20.0 3.5 35.7 50 58 A V E + C 0 55A 15 -12,-0.3 2,-0.4 -2,-0.3 5,-0.2 -0.813 46.1 167.4 -97.7 130.1 16.2 3.3 35.7 51 59 A L E > S- C 0 54A 8 3,-2.9 3,-1.8 -2,-0.5 35,-0.1 -0.994 70.1 -3.2-142.2 132.5 14.3 3.7 32.4 52 60 A A T 3 S- 0 0 54 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.936 130.5 -57.4 47.2 53.1 10.6 2.9 31.9 53 61 A D T 3 S+ 0 0 134 1,-0.1 2,-0.3 -3,-0.1 -1,-0.3 0.583 121.9 89.0 55.9 17.3 10.4 1.7 35.5 54 62 A Q E < S-C 51 0A 54 -3,-1.8 -3,-2.9 -5,-0.0 2,-0.4 -0.906 79.4-105.6-135.1 165.3 13.1 -1.0 35.1 55 63 A V E +CD 50 70A 1 15,-0.9 15,-2.3 -2,-0.3 2,-0.3 -0.757 39.7 178.8 -94.5 139.2 16.9 -1.0 35.5 56 64 A W E -CD 49 69A 1 -7,-2.8 -7,-1.8 -2,-0.4 2,-0.4 -0.910 22.9-149.6-133.7 161.8 19.1 -1.1 32.4 57 65 A T E -CD 48 68A 0 11,-1.9 11,-1.6 -2,-0.3 2,-0.4 -0.995 21.2-167.9-129.9 133.4 22.8 -1.1 31.6 58 66 A L E +CD 47 67A 0 -11,-2.7 -11,-3.3 -2,-0.4 2,-0.3 -0.964 15.1 159.4-127.4 144.0 23.8 0.6 28.4 59 67 A T E - D 0 66A 8 7,-2.2 7,-2.7 -2,-0.4 2,-0.3 -0.971 19.9-148.3-157.0 149.5 27.1 0.5 26.5 60 68 A Q E - D 0 65A 27 -15,-0.4 5,-0.2 -2,-0.3 2,-0.2 -0.904 11.0-164.5-131.2 157.1 28.0 1.2 22.9 61 69 A T - 0 0 60 3,-2.6 -39,-0.0 -2,-0.3 -41,-0.0 -0.465 57.5 -74.0-114.6-169.7 30.4 0.3 20.2 62 70 A E S S+ 0 0 102 1,-0.2 -40,-1.5 -2,-0.2 -39,-0.3 0.846 128.2 13.7 -61.7 -35.1 31.0 2.2 17.0 63 71 A E S S+ 0 0 112 -42,-0.2 -43,-2.4 -41,-0.1 2,-0.4 0.441 119.5 65.3-120.4 -2.5 27.7 1.3 15.3 64 72 A Q E -A 19 0A 57 -45,-0.2 -3,-2.6 -47,-0.0 2,-0.7 -0.945 56.6-150.1-131.7 148.9 25.6 -0.2 18.1 65 73 A L E -AD 18 60A 0 -47,-2.0 -47,-1.6 -2,-0.4 2,-0.5 -0.940 27.8-152.2-111.3 103.2 23.9 0.8 21.3 66 74 A H E -AD 17 59A 29 -7,-2.7 -7,-2.2 -2,-0.7 2,-0.3 -0.701 15.3-172.2 -84.8 125.3 24.0 -2.4 23.5 67 75 A C E -AD 16 58A 0 -51,-3.2 -51,-2.4 -2,-0.5 2,-0.3 -0.895 12.4-178.8-120.4 146.3 21.2 -2.6 26.0 68 76 A T E - D 0 57A 0 -11,-1.6 -11,-1.9 -2,-0.3 2,-0.4 -0.994 10.6-157.5-143.7 134.1 20.4 -5.1 28.8 69 77 A V E - D 0 56A 0 -55,-0.4 2,-0.5 7,-0.3 7,-0.4 -0.905 6.7-148.8-118.0 144.8 17.4 -5.0 31.2 70 78 A Y E D 0 55A 15 -15,-2.3 -15,-0.9 -2,-0.4 -2,-0.0 -0.944 360.0 360.0-112.3 118.6 17.0 -6.5 34.7 71 79 A R 0 0 97 -2,-0.5 -1,-0.1 -17,-0.1 3,-0.1 0.442 360.0 360.0-106.9 360.0 13.5 -7.7 35.6 72 ! 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 73 83 A S 0 0 154 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-177.7 12.2 -13.0 36.9 74 84 A Q - 0 0 82 -3,-0.1 0, 0.0 2,-0.0 0, 0.0 0.867 360.0-104.8 92.0 85.1 14.3 -15.3 34.6 75 85 A A + 0 0 70 -4,-0.1 2,-0.3 -73,-0.1 -5,-0.1 0.135 52.6 160.3 -34.5 144.5 17.1 -13.4 32.9 76 86 A S - 0 0 52 -7,-0.4 -7,-0.3 -62,-0.1 -62,-0.1 -0.884 43.9 -96.8-174.7 139.8 16.6 -12.6 29.2 77 87 A R - 0 0 134 -64,-0.4 -62,-0.2 -2,-0.3 -9,-0.1 -0.197 63.2 -81.1 -56.1 149.0 17.8 -10.3 26.5 78 88 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 -61,-0.1 -0.188 46.0-122.3 -54.9 144.8 15.5 -7.2 26.0 79 89 A T > - 0 0 56 -3,-0.1 4,-2.6 1,-0.1 3,-0.3 -0.527 26.2-105.7 -86.3 158.0 12.4 -7.7 23.9 80 90 A P H > S+ 0 0 107 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.823 122.1 49.6 -50.6 -35.9 11.7 -5.6 20.8 81 91 A D H > S+ 0 0 134 2,-0.2 4,-1.1 1,-0.2 3,-0.1 0.885 108.4 50.3 -73.2 -40.6 9.1 -3.6 22.7 82 92 A E H >> S+ 0 0 29 -3,-0.3 4,-1.1 1,-0.2 3,-0.7 0.918 108.4 54.9 -63.7 -40.2 11.4 -2.9 25.7 83 93 A L H 3X S+ 0 0 25 -4,-2.6 4,-2.4 1,-0.3 -1,-0.2 0.819 100.7 58.7 -62.2 -31.3 14.0 -1.7 23.2 84 94 A E H 3X S+ 0 0 106 -4,-1.0 4,-2.9 1,-0.2 -1,-0.3 0.838 99.1 58.5 -66.4 -32.2 11.6 0.8 21.8 85 95 A A H S+ 0 0 65 -4,-2.4 5,-2.0 1,-0.2 6,-0.3 0.907 111.1 47.2 -56.4 -44.4 14.7 4.3 21.5 88 98 A K H ><5S+ 0 0 51 -4,-2.9 3,-1.0 1,-0.2 -1,-0.2 0.866 106.3 58.8 -66.4 -35.4 12.0 6.7 22.7 89 99 A Y H 3<5S+ 0 0 27 -4,-1.6 35,-2.7 1,-0.3 -1,-0.2 0.884 113.7 37.0 -62.3 -38.3 14.1 7.8 25.7 90 100 A F T 3<5S- 0 0 0 -4,-1.8 -1,-0.3 33,-0.2 -2,-0.2 0.338 105.1-130.7 -94.5 7.0 16.9 8.9 23.4 91 101 A Q T X 5 + 0 0 35 -3,-1.0 3,-2.6 -4,-0.2 -3,-0.2 0.873 37.1 176.7 44.0 46.6 14.4 10.3 20.8 92 102 A L T 3 < + 0 0 18 -5,-2.0 -1,-0.2 1,-0.3 -4,-0.1 0.557 67.1 74.3 -57.6 -9.7 16.4 8.4 18.2 93 103 A D T 3 S+ 0 0 135 -6,-0.3 2,-0.8 2,-0.1 -1,-0.3 0.705 78.4 83.7 -76.7 -19.5 13.9 9.5 15.6 94 104 A V S < S- 0 0 30 -3,-2.6 2,-0.5 -4,-0.1 -1,-0.0 -0.784 84.1-139.7 -86.3 111.1 15.5 12.9 15.8 95 105 A T > - 0 0 68 -2,-0.8 4,-1.4 1,-0.2 5,-0.1 -0.629 14.2-165.8 -76.1 117.6 18.5 12.7 13.4 96 106 A L H > S+ 0 0 0 -2,-0.5 4,-3.4 2,-0.2 5,-0.3 0.880 85.7 61.1 -72.5 -38.8 21.4 14.5 14.9 97 107 A A H > S+ 0 0 59 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.910 106.7 48.6 -53.6 -43.0 23.5 14.5 11.7 98 108 A Q H > S+ 0 0 131 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.888 113.9 45.0 -65.3 -40.8 20.6 16.6 10.2 99 109 A L H X S+ 0 0 22 -4,-1.4 4,-3.2 2,-0.2 5,-0.4 0.955 111.3 51.1 -69.3 -49.7 20.5 19.0 13.1 100 110 A Y H X S+ 0 0 25 -4,-3.4 4,-2.8 1,-0.2 -2,-0.2 0.907 110.5 52.3 -53.7 -41.4 24.2 19.5 13.3 101 111 A H H X S+ 0 0 133 -4,-2.0 4,-1.3 -5,-0.3 -1,-0.2 0.931 112.1 43.8 -61.9 -46.3 24.3 20.2 9.6 102 112 A H H X S+ 0 0 78 -4,-1.9 4,-1.1 2,-0.2 3,-0.3 0.939 117.5 43.9 -65.6 -47.6 21.5 22.9 9.9 103 113 A W H X S+ 0 0 2 -4,-3.2 4,-1.0 1,-0.2 3,-0.4 0.899 113.8 52.7 -64.0 -38.3 23.0 24.5 13.0 104 114 A G H < S+ 0 0 7 -4,-2.8 7,-0.3 -5,-0.4 -1,-0.2 0.749 107.0 52.1 -69.2 -24.1 26.5 24.3 11.5 105 115 A S H < S+ 0 0 75 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.705 116.1 37.6 -85.9 -21.6 25.4 26.0 8.3 106 116 A V H < S+ 0 0 67 -4,-1.1 2,-0.3 -3,-0.4 -2,-0.2 0.457 122.3 45.5-104.8 -4.8 23.7 29.0 9.9 107 117 A D X - 0 0 11 -4,-1.0 4,-1.9 -5,-0.2 3,-0.3 -0.811 58.3-169.1-145.4 101.4 26.4 29.3 12.7 108 118 A S H > S+ 0 0 94 -2,-0.3 4,-1.5 1,-0.2 -1,-0.1 0.886 91.5 53.4 -53.0 -47.1 30.1 29.1 12.0 109 119 A H H > S+ 0 0 35 1,-0.2 4,-1.8 2,-0.2 5,-0.3 0.880 105.7 53.2 -59.5 -40.4 31.0 28.9 15.6 110 120 A F H > S+ 0 0 1 -3,-0.3 4,-2.9 -7,-0.2 5,-0.2 0.960 106.4 53.5 -59.8 -48.2 28.7 25.9 16.2 111 121 A Q H X S+ 0 0 127 -4,-1.9 4,-1.1 -7,-0.3 -1,-0.2 0.816 107.1 52.8 -55.4 -34.9 30.3 24.1 13.3 112 122 A E H >X S+ 0 0 139 -4,-1.5 3,-0.6 2,-0.2 4,-0.5 0.990 117.3 33.0 -65.4 -61.7 33.8 24.5 14.9 113 123 A V H >X S+ 0 0 33 -4,-1.8 4,-0.8 1,-0.2 3,-0.7 0.807 111.8 64.3 -66.3 -31.8 33.0 23.1 18.3 114 124 A A H >< S+ 0 0 6 -4,-2.9 3,-0.8 -5,-0.3 -1,-0.2 0.839 87.6 71.4 -62.0 -34.1 30.5 20.6 17.1 115 125 A Q H << S+ 0 0 70 -4,-1.1 3,-0.3 -3,-0.6 -1,-0.2 0.891 106.9 35.7 -49.5 -44.1 33.2 18.8 15.1 116 126 A K H << S+ 0 0 70 -3,-0.7 -1,-0.3 -4,-0.5 -2,-0.2 0.582 118.3 52.6 -89.2 -10.0 34.7 17.5 18.3 117 127 A F << + 0 0 49 -4,-0.8 3,-0.5 -3,-0.8 -1,-0.2 -0.490 68.0 152.5-127.9 66.6 31.5 17.0 20.2 118 128 A Q + 0 0 97 -3,-0.3 -94,-0.2 1,-0.2 3,-0.1 -0.406 53.4 47.9 -85.8 166.3 29.1 14.9 18.2 119 129 A G + 0 0 0 -96,-1.1 -93,-2.0 1,-0.2 2,-0.7 0.560 68.4 137.8 82.1 6.9 26.4 12.7 19.7 120 130 A V + 0 0 3 -3,-0.5 2,-0.3 -95,-0.2 -1,-0.2 -0.797 25.9 148.4 -89.7 114.0 25.0 15.3 22.1 121 131 A R - 0 0 0 -2,-0.7 2,-0.4 -95,-0.1 -30,-0.1 -0.830 46.9 -90.0-136.7 175.0 21.2 15.0 22.1 122 132 A L - 0 0 3 -2,-0.3 2,-0.2 -31,-0.1 181,-0.0 -0.766 29.6-136.3 -97.8 134.6 18.2 15.5 24.4 123 133 A L - 0 0 0 -2,-0.4 2,-0.9 -93,-0.1 -33,-0.2 -0.549 16.7-130.3 -79.1 148.4 16.8 12.8 26.6 124 134 A R - 0 0 78 -35,-2.7 124,-0.2 -2,-0.2 2,-0.1 -0.830 38.3-170.7-103.6 94.0 13.0 12.6 26.7 125 135 A Q - 0 0 3 122,-2.8 -89,-0.0 -2,-0.9 -3,-0.0 -0.451 29.2 -97.4 -89.3 156.9 12.4 12.4 30.4 126 136 A D > - 0 0 64 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.494 35.1-127.3 -68.4 134.3 9.2 11.8 32.5 127 137 A P H > S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.856 104.1 50.2 -52.0 -43.3 7.6 15.1 33.6 128 138 A I H > S+ 0 0 9 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.951 112.3 44.7 -65.3 -50.3 7.5 14.3 37.3 129 139 A E H > S+ 0 0 22 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.934 117.1 46.8 -59.7 -45.0 11.1 13.2 37.6 130 140 A C H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.912 110.3 52.6 -64.0 -45.0 12.3 16.1 35.6 131 141 A L H X S+ 0 0 0 -4,-2.8 4,-0.8 -5,-0.2 -2,-0.2 0.953 118.0 34.9 -57.5 -52.4 10.1 18.6 37.5 132 142 A F H X S+ 0 0 1 -4,-2.3 4,-1.1 2,-0.2 -1,-0.2 0.789 114.0 57.4 -76.3 -27.5 11.4 17.6 41.0 133 143 A S H >< S+ 0 0 0 -4,-2.3 3,-0.6 -5,-0.3 -2,-0.2 0.959 113.2 40.7 -66.5 -47.8 15.0 16.9 39.9 134 144 A F H >< S+ 0 0 11 -4,-2.3 3,-0.7 1,-0.2 4,-0.4 0.655 103.4 66.1 -76.6 -11.9 15.3 20.4 38.6 135 145 A I H >< S+ 0 0 3 -4,-0.8 3,-0.6 1,-0.2 -1,-0.2 0.847 105.2 48.3 -71.2 -30.6 13.5 21.9 41.5 136 146 A C T << S+ 0 0 1 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.404 94.2 81.3 -85.3 0.8 16.5 20.6 43.4 137 147 A S T X + 0 0 22 -3,-0.7 3,-1.2 57,-0.1 -1,-0.2 0.694 59.0 109.4 -83.2 -18.9 18.9 22.2 40.8 138 148 A S T < S- 0 0 47 -3,-0.6 3,-0.1 -4,-0.4 56,-0.1 -0.398 94.9 -1.6 -64.2 127.7 19.0 25.8 42.1 139 149 A C T 3 S+ 0 0 118 1,-0.2 2,-0.3 -2,-0.2 -1,-0.3 0.877 112.8 105.0 60.7 42.5 22.3 26.7 43.7 140 150 A N < - 0 0 46 -3,-1.2 -1,-0.2 4,-0.0 2,-0.2 -0.995 63.2-130.4-149.2 150.0 23.8 23.2 43.2 141 151 A N > - 0 0 102 -2,-0.3 4,-2.6 -3,-0.1 3,-0.3 -0.523 43.0 -94.6 -94.0 167.7 26.3 21.6 40.9 142 152 A I H > S+ 0 0 68 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.855 124.0 52.7 -48.8 -42.4 25.6 18.3 39.0 143 153 A A H > S+ 0 0 72 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.917 111.3 43.7 -63.5 -46.6 27.2 16.2 41.8 144 154 A R H > S+ 0 0 34 -3,-0.3 4,-2.4 2,-0.2 3,-0.2 0.949 114.7 50.0 -64.0 -48.3 25.2 17.8 44.6 145 155 A I H X S+ 0 0 9 -4,-2.6 4,-2.4 1,-0.2 5,-0.3 0.923 108.2 54.5 -55.0 -45.4 22.0 17.5 42.6 146 156 A T H X S+ 0 0 20 -4,-2.6 4,-1.4 -5,-0.3 -1,-0.2 0.869 109.4 47.8 -57.8 -39.5 22.8 13.9 41.9 147 157 A G H X S+ 0 0 16 -4,-1.7 4,-2.3 -3,-0.2 5,-0.3 0.953 110.9 48.6 -67.9 -50.3 23.2 13.1 45.5 148 158 A M H X S+ 0 0 13 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.900 112.4 48.9 -56.4 -44.7 20.0 14.8 46.7 149 159 A V H X S+ 0 0 3 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.831 110.1 52.9 -64.9 -33.7 17.9 13.1 43.9 150 160 A E H X S+ 0 0 69 -4,-1.4 4,-1.9 -5,-0.3 -2,-0.2 0.920 111.7 42.9 -69.9 -45.2 19.4 9.7 44.9 151 161 A R H X S+ 0 0 94 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.907 112.0 56.2 -68.3 -38.6 18.5 10.0 48.6 152 162 A L H X S+ 0 0 3 -4,-2.3 4,-2.6 -5,-0.3 5,-0.2 0.910 110.0 44.7 -57.8 -43.9 15.1 11.3 47.7 153 163 A C H X S+ 0 0 2 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.867 112.7 49.8 -70.9 -37.3 14.4 8.3 45.5 154 164 A Q H < S+ 0 0 103 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.907 115.5 46.4 -65.9 -39.9 15.7 5.8 48.1 155 165 A A H < S+ 0 0 41 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.923 133.5 10.5 -68.5 -48.4 13.5 7.5 50.7 156 166 A F H < S+ 0 0 43 -4,-2.6 17,-0.5 -5,-0.2 -3,-0.2 0.385 104.5 96.6-118.1 4.6 10.3 7.8 48.8 157 167 A G S < S- 0 0 12 -4,-2.4 14,-0.1 -5,-0.2 3,-0.0 -0.698 78.5 -97.9-101.2 152.0 10.6 5.7 45.7 158 168 A P - 0 0 79 0, 0.0 12,-2.4 0, 0.0 2,-0.4 -0.320 40.7-116.8 -60.7 138.8 9.6 2.0 45.0 159 169 A R E +E 169 0B 145 10,-0.2 10,-0.3 1,-0.2 3,-0.1 -0.653 37.3 174.9 -79.2 131.2 12.4 -0.5 45.4 160 170 A L E - 0 0 51 8,-3.5 2,-0.3 -2,-0.4 -1,-0.2 0.865 49.7 -39.5-101.2 -69.5 13.1 -2.2 42.1 161 171 A I E - 0 0 28 7,-0.5 7,-3.0 2,-0.0 2,-0.5 -0.956 47.3-117.4-153.7 170.3 16.1 -4.5 42.3 162 172 A Q E -E 167 0B 110 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.967 20.4-174.9-122.1 124.2 19.5 -4.8 43.9 163 173 A L E > -E 166 0B 15 3,-2.9 3,-2.3 -2,-0.5 2,-0.1 -0.969 68.0 -44.8-118.6 115.7 22.7 -5.1 41.8 164 174 A D T 3 S- 0 0 98 -2,-0.5 -160,-0.1 1,-0.3 0, 0.0 -0.470 124.8 -25.8 60.1-129.6 25.9 -5.6 43.9 165 175 A D T 3 S+ 0 0 142 -2,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.118 119.8 100.3-100.3 21.7 25.5 -3.1 46.8 166 176 A V E < -E 163 0B 37 -3,-2.3 -3,-2.9 2,-0.0 2,-0.6 -0.926 54.6-163.0-110.8 120.5 23.3 -0.8 44.8 167 177 A T E -E 162 0B 47 -2,-0.5 2,-0.3 -5,-0.2 -5,-0.2 -0.898 15.4-144.6-102.4 120.8 19.5 -0.9 45.3 168 178 A Y E - 0 0 19 -7,-3.0 -8,-3.5 -2,-0.6 -7,-0.5 -0.634 15.1-169.3 -88.1 143.5 17.6 0.8 42.5 169 179 A H E -E 159 0B 27 -2,-0.3 -10,-0.2 -10,-0.3 -119,-0.1 -0.966 21.9-122.0-129.1 145.6 14.4 2.8 43.2 170 180 A G - 0 0 6 -12,-2.4 3,-0.1 -2,-0.3 -14,-0.1 -0.382 50.6 -82.9 -76.5 164.5 11.8 4.2 40.8 171 181 A F - 0 0 30 -14,-0.1 -1,-0.1 1,-0.1 -42,-0.1 -0.445 57.1 -94.8 -69.5 143.7 11.2 7.9 41.0 172 182 A P - 0 0 2 0, 0.0 -15,-0.2 0, 0.0 -1,-0.1 -0.223 38.5-123.7 -58.3 145.7 8.8 8.9 43.8 173 183 A S > - 0 0 57 -17,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.368 23.2-108.6 -83.8 168.5 5.1 9.4 42.9 174 184 A L H > S+ 0 0 5 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.910 120.4 54.5 -63.4 -42.6 3.2 12.7 43.5 175 185 A Q H > S+ 0 0 121 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.926 111.2 44.9 -56.4 -46.6 1.2 10.9 46.3 176 186 A A H >4 S+ 0 0 32 1,-0.2 3,-0.9 2,-0.2 -2,-0.2 0.930 115.5 46.2 -64.3 -46.7 4.5 9.9 48.0 177 187 A L H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 26,-0.2 0.723 112.2 51.6 -70.0 -21.7 6.1 13.4 47.6 178 188 A A H 3< S+ 0 0 13 -4,-2.1 -1,-0.3 24,-0.2 -2,-0.2 0.526 88.6 119.8 -90.9 -6.4 2.9 15.1 48.8 179 189 A G S X< S- 0 0 16 -3,-0.9 3,-0.9 -4,-0.6 4,-0.3 0.112 75.3 -79.8 -52.2 168.8 2.8 12.9 51.9 180 190 A P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.545 110.0 6.8 -78.7 139.2 3.0 14.3 55.4 181 191 A E T 3> S+ 0 0 161 -2,-0.2 4,-2.3 -3,-0.1 5,-0.2 0.573 83.8 131.3 68.4 11.4 6.3 15.3 56.9 182 192 A V H <> S+ 0 0 3 -3,-0.9 4,-2.9 1,-0.2 5,-0.2 0.930 70.7 54.4 -57.8 -44.0 8.0 14.8 53.6 183 193 A E H > S+ 0 0 59 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.950 107.5 46.6 -55.5 -55.5 9.7 18.2 53.9 184 194 A A H > S+ 0 0 56 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.911 114.2 49.7 -53.9 -44.1 11.2 17.5 57.3 185 195 A H H X S+ 0 0 83 -4,-2.3 4,-0.7 1,-0.2 3,-0.4 0.919 109.3 50.9 -61.5 -45.0 12.4 14.1 56.0 186 196 A L H ><>S+ 0 0 0 -4,-2.9 5,-2.0 1,-0.2 3,-0.6 0.825 104.6 57.9 -63.3 -32.6 14.0 15.7 52.9 187 197 A R H ><5S+ 0 0 110 -4,-2.1 3,-1.7 1,-0.3 5,-0.4 0.860 100.7 55.9 -67.4 -33.6 15.8 18.3 55.1 188 198 A K H 3<5S+ 0 0 189 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.717 102.9 57.0 -68.9 -18.6 17.5 15.5 56.9 189 199 A L T <<5S- 0 0 36 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.288 123.3-109.1 -92.5 8.1 18.7 14.3 53.5 190 200 A G T < 5S+ 0 0 42 -3,-1.7 -3,-0.2 1,-0.1 -2,-0.1 0.654 77.2 134.6 76.3 17.9 20.3 17.7 53.1 191 201 A L > < - 0 0 0 -5,-2.0 3,-1.7 1,-0.2 -4,-0.2 0.583 44.9-168.1 -74.2 -6.2 17.9 19.1 50.4 192 202 A G T > - 0 0 27 -5,-0.4 3,-2.3 1,-0.3 4,-0.4 -0.158 62.0 -9.7 55.7-145.5 17.8 22.3 52.4 193 203 A Y T >> S+ 0 0 98 1,-0.3 4,-0.8 2,-0.2 3,-0.7 0.675 126.4 75.4 -58.8 -16.2 15.2 24.9 51.4 194 204 A R H <> S+ 0 0 21 -3,-1.7 4,-2.0 1,-0.2 -1,-0.3 0.729 79.7 71.9 -68.8 -22.8 14.5 22.8 48.3 195 205 A A H <> S+ 0 0 0 -3,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.899 94.2 53.3 -59.2 -41.6 12.7 20.3 50.5 196 206 A R H <> S+ 0 0 87 -3,-0.7 4,-2.8 -4,-0.4 -1,-0.2 0.870 107.7 49.5 -62.7 -39.9 9.8 22.8 51.0 197 207 A Y H X S+ 0 0 84 -4,-0.8 4,-3.2 2,-0.2 5,-0.3 0.891 108.4 53.0 -68.8 -39.7 9.3 23.3 47.2 198 208 A V H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.954 115.3 40.4 -59.2 -51.1 9.2 19.6 46.6 199 209 A S H X S+ 0 0 5 -4,-2.1 4,-2.2 1,-0.2 5,-0.2 0.939 118.2 48.1 -62.7 -46.7 6.5 19.1 49.2 200 210 A A H X S+ 0 0 31 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.859 113.2 46.2 -64.8 -37.3 4.7 22.3 48.1 201 211 A S H X S+ 0 0 0 -4,-3.2 4,-1.9 33,-0.2 -1,-0.2 0.853 110.5 53.4 -75.0 -34.3 4.8 21.5 44.4 202 212 A A H X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.3 -24,-0.2 0.966 114.3 41.0 -63.5 -49.6 3.7 17.9 44.9 203 213 A R H X S+ 0 0 97 -4,-2.2 4,-2.9 -26,-0.2 5,-0.3 0.879 112.3 56.4 -66.8 -37.0 0.6 19.0 46.9 204 214 A A H X>S+ 0 0 11 -4,-2.0 4,-1.6 -5,-0.2 5,-1.2 0.871 108.9 45.8 -63.0 -38.7 -0.1 21.9 44.5 205 215 A I H <5S+ 0 0 0 -4,-1.9 6,-3.3 3,-0.2 4,-0.4 0.919 120.2 39.0 -69.5 -43.6 -0.3 19.7 41.5 206 216 A L H <5S+ 0 0 55 -4,-1.8 -2,-0.2 4,-0.2 -1,-0.2 0.799 126.8 33.4 -77.1 -32.8 -2.5 17.1 43.2 207 217 A E H <5S+ 0 0 145 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.598 132.5 19.1-105.1 -10.1 -4.7 19.5 45.1 208 218 A E T <5S+ 0 0 146 -4,-1.6 -3,-0.2 -5,-0.3 -2,-0.1 0.627 122.8 43.7-130.1 -24.9 -5.0 22.6 42.9 209 219 A Q S - 0 0 61 -5,-0.3 3,-0.5 -6,-0.2 4,-0.5 0.702 60.8-104.2 98.1 18.8 -5.8 18.4 38.6 211 221 A G T >> S- 0 0 7 -6,-3.3 4,-0.9 1,-0.2 3,-0.8 -0.125 74.8 -14.3 69.7-157.2 -2.9 16.1 39.4 212 222 A L H 3> S+ 0 0 84 1,-0.2 4,-2.4 2,-0.2 3,-0.5 0.821 127.5 62.6 -53.3 -39.4 -0.6 14.1 37.1 213 223 A A H <> S+ 0 0 69 -3,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.884 97.4 57.8 -56.9 -41.7 -2.9 14.6 34.1 214 224 A W H <4 S+ 0 0 40 -3,-0.8 4,-0.3 -4,-0.5 -1,-0.2 0.873 112.5 40.8 -57.1 -39.4 -2.4 18.3 34.2 215 225 A L H >< S+ 0 0 0 -4,-0.9 3,-1.8 -3,-0.5 4,-0.3 0.976 116.7 44.2 -74.2 -59.2 1.4 17.8 33.9 216 226 A Q H >< S+ 0 0 66 -4,-2.4 3,-2.4 1,-0.3 4,-0.3 0.912 108.0 60.6 -51.6 -49.2 1.6 15.0 31.3 217 227 A Q G >X S+ 0 0 100 -4,-2.4 3,-1.1 1,-0.3 4,-0.6 0.680 85.3 78.3 -55.2 -19.8 -1.1 16.8 29.2 218 228 A L G <4 S+ 0 0 5 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.693 78.7 71.9 -66.0 -16.1 1.3 19.8 28.9 219 229 A R G <4 S+ 0 0 55 -3,-2.4 -1,-0.2 -4,-0.3 -2,-0.2 0.875 100.1 44.1 -65.0 -37.2 3.2 17.8 26.2 220 230 A E T <4 S+ 0 0 100 -3,-1.1 -1,-0.2 -4,-0.3 -2,-0.2 0.604 104.1 87.5 -81.4 -12.7 0.3 18.3 23.8 221 231 A S S < S- 0 0 26 -4,-0.6 2,-0.0 -3,-0.1 -3,-0.0 -0.424 89.8 -93.5 -83.7 161.0 0.2 21.9 24.9 222 232 A S > - 0 0 59 -2,-0.1 4,-3.7 1,-0.1 5,-0.2 -0.325 31.0-111.4 -74.8 159.1 2.3 24.7 23.3 223 233 A Y H > S+ 0 0 22 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.913 117.4 47.5 -54.3 -50.7 5.6 25.9 24.6 224 234 A E H > S+ 0 0 128 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.896 116.9 44.0 -60.1 -40.6 4.4 29.3 25.8 225 235 A E H > S+ 0 0 95 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.921 114.6 49.0 -70.6 -44.5 1.4 27.7 27.5 226 236 A A H X S+ 0 0 0 -4,-3.7 4,-2.4 1,-0.2 -2,-0.2 0.936 111.9 48.8 -60.8 -47.8 3.5 24.9 29.0 227 237 A H H X S+ 0 0 32 -4,-3.1 4,-1.5 -5,-0.2 -1,-0.2 0.922 111.7 49.3 -58.6 -46.4 6.1 27.3 30.3 228 238 A K H < S+ 0 0 131 -4,-1.9 4,-0.4 -5,-0.2 -1,-0.2 0.905 111.4 49.3 -59.9 -45.8 3.5 29.6 31.9 229 239 A A H >X S+ 0 0 18 -4,-2.3 3,-1.7 1,-0.2 4,-0.6 0.944 107.8 52.5 -60.4 -51.5 1.7 26.7 33.6 230 240 A L H >< S+ 0 0 0 -4,-2.4 3,-0.9 1,-0.3 -1,-0.2 0.838 100.5 65.8 -54.7 -34.3 4.9 25.2 35.1 231 241 A C T 3< S+ 0 0 46 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.628 86.5 66.4 -67.0 -16.1 5.7 28.6 36.6 232 242 A I T <4 S+ 0 0 95 -3,-1.7 -1,-0.2 -4,-0.4 -2,-0.2 0.856 82.3 94.8 -73.9 -30.9 2.8 28.7 39.0 233 243 A L S X< S- 0 0 5 -3,-0.9 3,-1.6 -4,-0.6 2,-0.3 -0.284 90.1-103.8 -60.1 139.0 4.3 25.8 41.0 234 244 A P T 3 S+ 0 0 45 0, 0.0 -33,-0.2 0, 0.0 -1,-0.1 -0.480 105.4 20.5 -69.9 127.8 6.4 26.8 44.0 235 245 A G T 3 S+ 0 0 27 -2,-0.3 2,-0.6 1,-0.2 -97,-0.1 0.330 100.3 108.4 97.9 -6.2 10.1 26.5 43.4 236 246 A V < + 0 0 8 -3,-1.6 -1,-0.2 -5,-0.1 2,-0.2 -0.910 40.2 160.8-111.0 112.7 9.7 26.6 39.6 237 247 A G > - 0 0 36 -2,-0.6 4,-3.1 -3,-0.1 5,-0.3 -0.443 59.1 -69.3-114.2-170.6 10.8 29.7 37.8 238 248 A T H > S+ 0 0 87 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.874 130.7 48.2 -46.1 -48.9 11.6 30.6 34.2 239 249 A K H > S+ 0 0 74 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.959 115.5 40.0 -59.5 -59.3 14.9 28.6 34.3 240 250 A V H > S+ 0 0 12 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.865 114.6 55.6 -60.9 -36.8 13.4 25.4 35.8 241 251 A A H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 -1,-0.2 0.877 108.4 47.2 -64.7 -38.2 10.4 25.7 33.6 242 252 A D H X S+ 0 0 8 -4,-2.0 4,-3.1 -5,-0.3 5,-0.3 0.935 110.1 52.1 -68.9 -45.9 12.5 25.9 30.5 243 253 A C H X S+ 0 0 8 -4,-2.4 4,-2.9 1,-0.2 5,-0.3 0.931 113.3 45.6 -54.7 -46.2 14.6 22.9 31.6 244 254 A I H X>S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-1.4 0.930 113.2 48.6 -63.8 -47.0 11.3 20.9 32.1 245 255 A C H <5S+ 0 0 0 -4,-2.5 6,-2.2 3,-0.2 4,-0.4 0.910 117.3 42.6 -58.8 -44.4 9.8 22.1 28.8 246 256 A L H <5S+ 0 0 10 -4,-3.1 -2,-0.2 4,-0.2 -1,-0.2 0.916 124.3 33.5 -68.9 -45.0 13.0 21.2 26.9 247 257 A M H <5S+ 0 0 16 -4,-2.9 -122,-2.8 -5,-0.3 -2,-0.2 0.698 135.3 12.2 -89.4 -21.9 13.7 17.9 28.6 248 258 A A T <5S+ 0 0 0 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.1 0.610 119.1 55.0-130.5 -20.0 10.2 16.4 29.3 249 259 A L S + 0 0 9 -6,-2.2 3,-1.7 -7,-0.2 -1,-0.2 -0.737 19.1 170.5-114.5 78.4 9.7 21.8 23.6 252 262 A P T 3 S+ 0 0 23 0, 0.0 50,-2.3 0, 0.0 51,-0.8 0.677 73.2 64.0 -63.6 -17.7 13.0 21.7 21.7 253 263 A Q T 3 S+ 0 0 53 48,-0.2 2,-0.3 47,-0.2 47,-0.1 0.557 77.6 111.5 -82.8 -7.9 12.9 25.5 21.1 254 264 A A < - 0 0 0 -3,-1.7 -3,-0.0 45,-0.1 -12,-0.0 -0.513 48.9-168.4 -71.5 128.9 13.2 26.1 24.9 255 265 A V - 0 0 1 -2,-0.3 2,-1.2 47,-0.0 -12,-0.1 -0.955 13.8-146.1-121.1 110.3 16.5 27.6 26.0 256 266 A P - 0 0 13 0, 0.0 2,-0.2 0, 0.0 5,-0.2 -0.623 21.3-152.0 -78.9 96.8 17.2 27.6 29.8 257 267 A V + 0 0 15 -2,-1.2 2,-0.3 29,-0.1 -15,-0.1 -0.493 29.8 144.9 -76.0 133.8 19.1 30.8 30.3 258 268 A D >> - 0 0 37 -2,-0.2 4,-1.7 28,-0.0 3,-0.5 -0.910 64.6 -80.7-151.8 174.9 21.6 31.0 33.2 259 269 A V H 3> S+ 0 0 101 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.804 126.0 57.2 -54.2 -33.2 25.0 32.6 34.0 260 270 A H H 3> S+ 0 0 121 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.930 105.2 50.6 -64.7 -43.6 26.8 29.8 32.2 261 271 A M H <> S+ 0 0 0 -3,-0.5 4,-2.9 1,-0.2 -1,-0.2 0.877 107.6 54.5 -62.0 -37.3 24.9 30.5 29.0 262 272 A W H X S+ 0 0 6 -4,-1.7 4,-3.2 2,-0.2 5,-0.3 0.951 103.1 55.2 -60.9 -49.4 25.8 34.2 29.3 263 273 A H H X S+ 0 0 91 -4,-2.1 4,-2.5 1,-0.2 5,-0.3 0.910 113.0 43.2 -49.2 -46.9 29.5 33.4 29.5 264 274 A I H X S+ 0 0 2 -4,-1.8 4,-2.7 2,-0.2 5,-0.4 0.929 112.5 51.0 -67.0 -46.0 29.1 31.5 26.2 265 275 A A H X S+ 0 0 0 -4,-2.9 6,-2.0 1,-0.2 4,-1.2 0.924 116.7 41.6 -58.1 -44.2 27.0 34.1 24.5 266 276 A Q H X S+ 0 0 93 -4,-3.2 4,-0.8 4,-0.3 -2,-0.2 0.902 120.8 39.7 -71.0 -43.6 29.4 36.9 25.5 267 277 A R H < S+ 0 0 124 -4,-2.5 -2,-0.2 -5,-0.3 -3,-0.2 0.895 127.0 30.7 -75.0 -42.8 32.7 35.0 24.7 268 278 A D H < S+ 0 0 41 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.554 136.8 21.3 -97.3 -8.1 31.7 33.2 21.5 269 279 A Y H < S- 0 0 47 -4,-1.2 -3,-0.2 -5,-0.4 -2,-0.1 0.385 90.5-126.1-135.5 -2.0 29.2 35.6 20.1 270 280 A S < + 0 0 104 -4,-0.8 -4,-0.3 -6,-0.2 2,-0.1 0.863 50.4 176.4 55.4 35.1 30.0 39.0 21.7 271 281 A W + 0 0 24 -6,-2.0 -1,-0.2 -9,-0.2 -2,-0.1 -0.428 12.8 168.1 -75.6 145.2 26.4 39.1 22.7 272 282 A H - 0 0 129 -2,-0.1 8,-0.1 -3,-0.1 7,-0.1 -0.972 40.8 -84.3-152.1 153.3 24.9 41.9 24.8 273 283 A P + 0 0 20 0, 0.0 12,-0.1 0, 0.0 13,-0.0 -0.326 36.1 175.1 -62.8 140.3 21.4 43.0 25.7 274 284 A T S S+ 0 0 121 11,-0.1 11,-0.1 -2,-0.1 5,-0.0 0.764 74.5 35.1-110.7 -53.0 19.4 45.3 23.4 275 285 A T S S+ 0 0 82 9,-0.1 10,-0.1 10,-0.1 9,-0.0 0.997 105.8 60.9 -68.6 -77.3 15.9 45.6 24.8 276 286 A S S S- 0 0 22 8,-0.2 6,-0.0 1,-0.1 0, 0.0 -0.132 75.1-135.6 -55.4 148.1 16.3 45.7 28.6 277 287 A Q S S+ 0 0 103 2,-0.0 -1,-0.1 0, 0.0 -2,-0.0 0.993 79.4 87.8 -67.8 -65.0 18.4 48.4 30.3 278 288 A A - 0 0 52 1,-0.2 4,-0.1 3,-0.0 -2,-0.0 0.028 66.3-152.1 -35.9 137.6 20.4 46.3 32.7 279 289 A K S S+ 0 0 83 2,-0.1 -1,-0.2 -7,-0.1 3,-0.1 0.298 72.0 63.3-101.2 8.0 23.5 45.0 31.1 280 290 A G S S- 0 0 30 1,-0.1 5,-0.2 -8,-0.1 6,-0.1 -0.579 103.9 -52.5-120.5-175.8 23.7 41.9 33.2 281 291 A P S S+ 0 0 74 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.382 71.9 135.4 -62.6 133.4 21.6 38.8 33.9 282 292 A S > - 0 0 26 -2,-0.1 4,-3.1 -4,-0.1 5,-0.3 -0.956 68.6 -89.7-166.2 167.2 18.0 39.6 34.7 283 293 A P H > S+ 0 0 114 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.918 126.0 43.0 -55.1 -44.4 14.5 38.4 33.8 284 294 A Q H > S+ 0 0 51 2,-0.2 4,-1.2 1,-0.2 -8,-0.2 0.927 118.2 42.5 -68.9 -47.1 14.3 40.9 30.9 285 295 A T H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 3,-0.2 0.895 112.3 54.2 -68.2 -38.9 17.8 40.3 29.5 286 296 A N H X S+ 0 0 42 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.886 103.4 57.1 -61.6 -37.6 17.6 36.5 30.0 287 297 A K H X S+ 0 0 77 -4,-1.5 4,-1.7 -5,-0.3 -1,-0.2 0.887 108.5 48.1 -60.1 -37.9 14.4 36.6 27.9 288 298 A E H X S+ 0 0 29 -4,-1.2 4,-3.2 2,-0.2 3,-0.4 0.973 107.4 52.1 -66.2 -55.9 16.5 38.2 25.1 289 299 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.3 5,-0.3 0.930 109.6 52.6 -45.7 -49.1 19.4 35.8 25.2 290 300 A G H X S+ 0 0 2 -4,-2.5 4,-1.3 1,-0.2 -1,-0.3 0.903 111.8 44.5 -53.9 -44.1 16.8 33.1 24.9 291 301 A N H X S+ 0 0 85 -4,-1.7 4,-2.8 -3,-0.4 -1,-0.2 0.836 107.0 61.1 -70.2 -34.1 15.3 34.8 21.8 292 302 A F H X S+ 0 0 68 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.958 109.2 40.3 -57.0 -53.7 18.7 35.4 20.4 293 303 A F H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 5,-0.4 0.788 113.6 54.2 -68.6 -27.7 19.6 31.7 20.2 294 304 A R H X S+ 0 0 57 -4,-1.3 4,-2.0 -5,-0.3 -1,-0.2 0.920 111.7 45.2 -71.9 -41.1 16.1 30.8 19.0 295 305 A S H < S+ 0 0 108 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.880 118.2 45.4 -67.4 -36.6 16.5 33.3 16.2 296 306 A L H < S+ 0 0 43 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.973 126.8 22.5 -71.8 -55.6 20.0 32.0 15.5 297 307 A W H < S- 0 0 1 -4,-2.9 3,-0.4 1,-0.2 -3,-0.2 0.694 96.7-140.4 -90.4 -20.9 19.5 28.2 15.6 298 308 A G >< - 0 0 18 -4,-2.0 3,-1.8 -5,-0.4 -1,-0.2 -0.569 58.2 -11.6 99.1-164.1 15.7 27.7 14.9 299 309 A P T 3 S+ 0 0 94 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.676 135.3 47.6 -48.7 -28.2 13.1 25.3 16.4 300 310 A Y T >> + 0 0 77 -3,-0.4 4,-2.3 1,-0.2 3,-0.6 -0.026 67.3 131.1-108.7 31.3 15.7 23.2 18.1 301 311 A A H <> S+ 0 0 0 -3,-1.8 4,-2.1 1,-0.3 -48,-0.2 0.800 72.6 57.4 -52.1 -32.6 17.7 26.0 19.7 302 312 A G H 3> S+ 0 0 2 -50,-2.3 4,-1.5 -3,-0.3 -1,-0.3 0.923 107.0 46.6 -65.5 -44.3 17.5 24.1 23.0 303 313 A W H <> S+ 0 0 5 -51,-0.8 4,-1.3 -3,-0.6 -2,-0.2 0.929 110.5 53.6 -63.0 -44.3 19.2 21.1 21.5 304 314 A A H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 3,-0.4 0.902 106.2 52.0 -59.0 -42.7 21.8 23.2 19.9 305 315 A F H X S+ 0 0 14 -4,-2.1 4,-3.4 1,-0.2 -1,-0.2 0.878 100.3 62.5 -63.5 -35.2 22.8 24.8 23.1 306 316 A A H X S+ 0 0 14 -4,-1.5 4,-1.4 1,-0.2 -1,-0.2 0.900 102.6 52.7 -54.8 -39.6 23.2 21.4 24.8 307 317 A V H >X S+ 0 0 0 -4,-1.3 4,-2.2 -3,-0.4 3,-0.8 0.966 111.9 42.1 -62.1 -52.9 26.0 20.8 22.3 308 318 A L H 3X S+ 0 0 6 -4,-1.6 4,-1.6 1,-0.2 -2,-0.2 0.901 110.0 59.9 -60.3 -39.3 27.8 24.0 23.1 309 319 A F H 3< S+ 0 0 77 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.783 109.8 42.3 -58.6 -29.9 27.1 23.4 26.8 310 320 A S H X< S+ 0 0 17 -4,-1.4 3,-2.3 -3,-0.8 -1,-0.2 0.849 107.7 57.9 -84.8 -39.5 29.1 20.1 26.6 311 321 A A H 3< S+ 0 0 23 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.1 0.789 102.6 56.0 -61.0 -27.3 31.9 21.4 24.4 312 322 A D T 3< 0 0 61 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.1 0.215 360.0 360.0 -87.1 13.1 32.5 23.9 27.2 313 323 A L < 0 0 184 -3,-2.3 -1,-0.1 -5,-0.1 -2,-0.1 -0.344 360.0 360.0 69.0 360.0 32.8 20.7 29.4