==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 28-JUN-02 1M3Q . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.J.CHUNG,G.L.VERDINE . 314 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14116.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 214 68.2 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 . 27 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 14 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 39.2 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 2 0 1 1 1 1 1 4 0 0 2 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 1 1 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 G 0 0 92 0, 0.0 9,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -68.0 29.0 -13.3 36.6 2 10 A S + 0 0 110 4,-0.1 2,-0.3 73,-0.0 4,-0.1 0.448 360.0 78.7 -86.9 0.6 25.2 -13.2 37.1 3 11 A E S S+ 0 0 151 2,-0.1 160,-0.1 160,-0.1 0, 0.0 -0.736 82.5 14.8-108.4 157.6 25.7 -10.7 39.9 4 12 A G S S- 0 0 12 -2,-0.3 2,-0.1 158,-0.2 158,-0.0 -0.044 105.4 -29.5 75.2 179.6 26.5 -7.0 39.8 5 13 A H S S- 0 0 20 158,-0.1 2,-0.1 1,-0.1 -2,-0.1 -0.469 71.3-121.7 -70.0 140.6 26.1 -4.5 37.0 6 14 A R - 0 0 30 -2,-0.1 2,-0.3 -4,-0.1 -1,-0.1 -0.386 18.9-157.9 -82.6 159.4 26.6 -6.1 33.5 7 15 A T > - 0 0 36 -2,-0.1 4,-1.8 1,-0.1 8,-0.1 -0.924 31.8-114.4-129.6 154.8 29.2 -5.2 30.9 8 16 A L T 4 S+ 0 0 50 -2,-0.3 7,-0.2 1,-0.2 6,-0.1 0.886 117.9 46.5 -57.5 -38.6 28.8 -6.0 27.2 9 17 A A T 4 S+ 0 0 91 1,-0.2 -1,-0.2 2,-0.1 -3,-0.0 0.830 109.7 52.4 -73.9 -34.7 31.8 -8.4 27.4 10 18 A S T 4 S+ 0 0 66 1,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.882 124.3 19.7 -72.7 -40.4 30.8 -10.2 30.6 11 19 A T >< + 0 0 22 -4,-1.8 3,-2.1 1,-0.1 4,-0.3 -0.464 69.2 168.3-133.1 65.0 27.3 -11.2 29.6 12 20 A P G > S+ 0 0 85 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.807 73.5 57.2 -40.8 -51.8 27.0 -11.1 25.8 13 21 A A G 3 S+ 0 0 88 1,-0.3 64,-0.4 64,-0.0 -5,-0.0 0.614 98.9 61.6 -64.6 -13.3 23.7 -13.0 25.4 14 22 A L G < S+ 0 0 31 -3,-2.1 55,-0.4 -6,-0.1 2,-0.3 0.512 89.9 83.3 -93.3 -3.4 21.9 -10.5 27.6 15 23 A W < - 0 0 20 -3,-1.6 2,-0.3 -4,-0.3 53,-0.2 -0.730 54.8-167.6-102.8 151.4 22.5 -7.4 25.4 16 24 A A E -A 67 0A 20 51,-2.3 51,-2.9 -2,-0.3 2,-0.2 -0.975 17.8-129.5-132.9 145.5 20.5 -6.3 22.4 17 25 A S E -A 66 0A 56 -2,-0.3 49,-0.2 49,-0.2 47,-0.1 -0.619 11.4-162.3-101.3 157.3 21.6 -3.6 19.8 18 26 A I E -A 65 0A 5 47,-1.3 47,-2.4 -2,-0.2 -2,-0.0 -0.985 35.6-112.5-134.1 118.0 19.9 -0.6 18.4 19 27 A P E +A 64 0A 104 0, 0.0 45,-0.2 0, 0.0 44,-0.0 -0.322 59.3 142.8 -52.6 124.6 21.4 0.9 15.2 20 28 A C - 0 0 5 43,-2.4 41,-0.2 41,-0.0 -2,-0.1 -0.620 41.5-140.1-170.9 103.8 22.8 4.2 16.2 21 29 A P >> - 0 0 57 0, 0.0 3,-2.9 0, 0.0 4,-0.8 -0.386 27.2-118.5 -68.7 145.9 26.0 5.9 15.0 22 30 A R T 34 S+ 0 0 81 40,-2.2 3,-0.5 1,-0.3 41,-0.1 0.789 115.5 67.7 -53.3 -27.0 28.1 7.7 17.6 23 31 A S T 34 S+ 0 0 67 39,-0.3 96,-1.1 1,-0.2 -1,-0.3 0.731 101.7 45.9 -66.7 -20.9 27.5 10.7 15.4 24 32 A E T <4 S+ 0 0 23 -3,-2.9 2,-0.3 1,-0.3 -1,-0.2 0.613 128.1 10.3 -95.1 -16.7 23.8 10.5 16.5 25 33 A L < - 0 0 0 -4,-0.8 2,-0.5 -3,-0.5 -1,-0.3 -0.885 49.2-170.4-166.5 130.5 24.4 10.0 20.2 26 34 A R >> - 0 0 61 93,-2.3 3,-1.5 -2,-0.3 4,-1.3 -0.949 11.3-162.8-122.8 104.8 27.3 10.2 22.6 27 35 A L H >> S+ 0 0 2 -2,-0.5 4,-2.5 1,-0.3 3,-0.5 0.902 89.8 57.7 -53.8 -42.8 26.2 8.7 25.9 28 36 A D H 34 S+ 0 0 45 1,-0.2 -1,-0.3 2,-0.2 13,-0.0 0.679 111.0 42.2 -64.7 -17.3 29.2 10.4 27.7 29 37 A L H <4 S+ 0 0 1 -3,-1.5 -1,-0.2 90,-0.1 -2,-0.2 0.614 122.4 38.3-101.9 -15.8 28.1 13.8 26.5 30 38 A V H X< S+ 0 0 0 -4,-1.3 3,-1.0 -3,-0.5 5,-0.4 0.879 108.5 52.2-100.1 -49.4 24.4 13.3 27.2 31 39 A L T 3< S+ 0 0 2 -4,-2.5 8,-0.4 1,-0.2 3,-0.2 0.766 116.2 34.3 -66.8 -30.5 23.9 11.3 30.4 32 40 A P T 3 S+ 0 0 56 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.260 92.7 96.1-108.0 16.4 26.0 13.4 32.9 33 41 A S S < S- 0 0 9 -3,-1.0 -2,-0.1 1,-0.0 4,-0.1 0.210 104.7 -91.7 -91.9 15.8 25.3 16.8 31.4 34 42 A G S S+ 0 0 15 2,-0.5 3,-0.2 -3,-0.2 -3,-0.1 0.756 102.6 101.6 85.3 21.7 22.5 18.0 33.5 35 43 A Q S S+ 0 0 12 1,-0.6 2,-0.4 -5,-0.4 -4,-0.1 0.815 98.1 9.9 -95.3 -61.6 19.6 16.8 31.4 36 44 A S - 0 0 3 -6,-0.4 -1,-0.6 -5,-0.2 -2,-0.5 -0.916 62.5-162.3-114.8 143.8 18.9 13.8 33.6 37 45 A F S S+ 0 0 9 -2,-0.4 113,-0.1 -3,-0.2 -1,-0.1 0.236 74.1 82.6-108.4 15.0 20.6 13.3 37.0 38 46 A R + 0 0 28 12,-0.1 12,-0.4 -7,-0.1 2,-0.4 0.239 65.6 90.8-107.5 15.9 19.8 9.6 37.2 39 47 A W - 0 0 8 -8,-0.4 2,-0.4 -3,-0.3 10,-0.2 -0.892 48.1-173.5-113.3 142.2 22.5 7.9 35.2 40 48 A R E -B 48 0A 117 8,-2.0 8,-2.8 -2,-0.4 2,-1.8 -0.996 29.5-131.4-135.5 138.6 25.9 6.6 36.5 41 49 A E E + 0 0 100 -2,-0.4 6,-0.2 6,-0.2 4,-0.1 -0.616 36.1 168.7 -85.6 78.9 28.9 5.2 34.7 42 50 A Q E S+ 0 0 82 -2,-1.8 -1,-0.2 4,-0.4 5,-0.1 0.748 71.2 23.5 -65.9 -26.0 29.2 2.2 37.1 43 51 A S E > S-B 46 0A 27 3,-1.2 3,-2.6 -3,-0.2 -1,-0.1 -0.958 112.8 -75.1-134.4 150.2 31.7 0.5 34.7 44 52 A P T 3 S- 0 0 113 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.242 117.9 -3.9 -51.5 126.2 33.8 2.3 32.1 45 53 A A T 3 S+ 0 0 53 1,-0.2 2,-0.5 -4,-0.1 15,-0.5 0.435 111.0 109.8 69.5 1.3 31.7 3.3 29.2 46 54 A H E < -B 43 0A 23 -3,-2.6 -3,-1.2 13,-0.1 2,-0.5 -0.940 50.4-165.4-112.2 121.8 28.6 1.6 30.7 47 55 A W E - C 0 58A 18 11,-3.2 11,-3.1 -2,-0.5 2,-0.4 -0.902 4.8-170.5-110.4 126.7 25.8 3.8 32.0 48 56 A S E +BC 40 57A 1 -8,-2.8 -8,-2.0 -2,-0.5 2,-0.3 -0.882 22.9 117.8-119.2 148.6 23.1 2.4 34.3 49 57 A G E - C 0 56A 1 7,-2.1 7,-3.0 -2,-0.4 2,-0.5 -0.977 61.7 -63.0 178.1-179.4 19.8 4.0 35.5 50 58 A V E + C 0 55A 18 -12,-0.4 2,-0.4 -2,-0.3 5,-0.2 -0.773 45.8 172.7 -93.6 124.8 16.1 3.7 35.5 51 59 A L E > S- C 0 54A 4 3,-3.0 3,-0.8 -2,-0.5 35,-0.1 -0.977 71.9 -11.9-134.4 117.5 14.4 4.0 32.1 52 60 A A T 3 S- 0 0 67 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.942 129.0 -52.9 57.8 49.9 10.6 3.4 31.8 53 61 A D T 3 S+ 0 0 133 1,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.600 121.9 89.8 64.7 15.7 10.3 1.9 35.3 54 62 A Q E < S-C 51 0A 55 -3,-0.8 -3,-3.0 17,-0.1 2,-0.4 -0.961 79.8-109.4-137.3 154.8 13.1 -0.7 34.9 55 63 A V E +CD 50 70A 0 15,-1.1 15,-2.6 -2,-0.3 2,-0.3 -0.697 40.7 179.7 -86.1 135.0 16.9 -0.6 35.5 56 64 A W E -CD 49 69A 1 -7,-3.0 -7,-2.1 -2,-0.4 2,-0.4 -0.929 22.8-150.8-132.0 157.2 19.0 -0.6 32.3 57 65 A T E -CD 48 68A 2 11,-1.8 11,-1.5 -2,-0.3 2,-0.4 -0.998 21.3-168.1-126.4 132.1 22.7 -0.5 31.5 58 66 A L E +CD 47 67A 0 -11,-3.1 -11,-3.2 -2,-0.4 2,-0.3 -0.934 14.4 160.2-124.6 146.4 23.7 1.2 28.2 59 67 A T E - D 0 66A 8 7,-2.1 7,-3.3 -2,-0.4 2,-0.3 -0.979 20.8-141.2-157.3 154.4 27.0 1.2 26.3 60 68 A Q E - D 0 65A 23 -15,-0.5 5,-0.2 -2,-0.3 2,-0.2 -0.918 11.7-165.8-131.8 155.4 27.9 2.0 22.7 61 69 A T - 0 0 54 3,-2.6 -39,-0.1 -2,-0.3 -41,-0.0 -0.580 57.3 -79.4-114.0-178.8 30.2 0.9 19.9 62 70 A E S S+ 0 0 123 1,-0.2 -40,-2.2 -2,-0.2 -39,-0.3 0.863 127.4 15.8 -56.4 -38.8 30.8 3.0 16.8 63 71 A E S S+ 0 0 54 -42,-0.2 -43,-2.4 -41,-0.1 2,-0.4 0.460 119.4 65.2-115.6 -0.5 27.6 2.0 15.0 64 72 A Q E -A 19 0A 61 -45,-0.2 -3,-2.6 -47,-0.1 2,-0.7 -0.955 57.1-149.0-133.2 144.5 25.5 0.4 17.8 65 73 A L E -AD 18 60A 0 -47,-2.4 -47,-1.3 -2,-0.4 2,-0.4 -0.937 29.4-152.7-102.6 111.2 23.8 1.4 21.1 66 74 A H E -AD 17 59A 22 -7,-3.3 -7,-2.1 -2,-0.7 2,-0.3 -0.753 15.3-172.8 -91.0 132.8 24.0 -1.7 23.2 67 75 A C E +AD 16 58A 0 -51,-2.9 -51,-2.3 -2,-0.4 2,-0.3 -0.942 14.4 178.5-129.6 148.3 21.2 -2.2 25.9 68 76 A T E - D 0 57A 0 -11,-1.5 -11,-1.8 -2,-0.3 2,-0.4 -0.987 13.4-153.6-143.3 146.9 20.5 -4.6 28.7 69 77 A V E - D 0 56A 1 -55,-0.4 2,-0.6 7,-0.4 7,-0.3 -0.965 9.0-153.4-129.8 142.4 17.6 -4.6 31.2 70 78 A Y E D 0 55A 15 -15,-2.6 -15,-1.1 -2,-0.4 5,-0.0 -0.941 360.0 360.0-113.5 109.4 17.1 -6.0 34.7 71 79 A R 0 0 112 -2,-0.6 -17,-0.1 -17,-0.1 4,-0.0 -0.363 360.0 360.0 -86.2 360.0 13.5 -6.8 35.4 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 0 170 0, 0.0 -2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 4.1 12.2 -13.5 35.8 74 84 A Q - 0 0 84 1,-0.1 -3,-0.1 0, 0.0 2,-0.0 -0.345 360.0-100.3 -58.7 133.7 14.9 -15.4 34.1 75 85 A A + 0 0 65 -5,-0.0 2,-0.3 -73,-0.0 -1,-0.1 -0.339 60.2 157.1 -56.8 132.4 17.6 -13.0 32.9 76 86 A S - 0 0 51 -7,-0.3 -7,-0.4 -62,-0.1 -62,-0.1 -0.980 44.4 -83.6-155.2 162.2 17.1 -12.3 29.1 77 87 A R - 0 0 37 -64,-0.4 -62,-0.2 -2,-0.3 -9,-0.1 -0.195 60.5 -85.7 -64.2 159.0 17.9 -9.8 26.4 78 88 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 -11,-0.1 -0.383 45.1-120.0 -66.9 146.6 15.6 -6.8 26.0 79 89 A T > - 0 0 62 1,-0.1 4,-2.7 -3,-0.1 5,-0.2 -0.435 26.3-105.5 -83.1 161.5 12.5 -7.4 23.8 80 90 A P H > S+ 0 0 102 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.888 123.3 51.1 -53.7 -37.9 11.9 -5.3 20.6 81 91 A D H > S+ 0 0 135 2,-0.2 4,-1.0 1,-0.2 3,-0.1 0.904 108.7 48.4 -67.0 -42.6 9.2 -3.4 22.5 82 92 A E H >> S+ 0 0 29 1,-0.2 4,-1.2 2,-0.2 3,-0.8 0.915 109.0 55.8 -63.4 -40.4 11.4 -2.6 25.5 83 93 A L H 3X S+ 0 0 23 -4,-2.7 4,-2.6 1,-0.3 -1,-0.2 0.838 100.6 58.0 -60.1 -33.4 14.1 -1.5 23.0 84 94 A E H 3X S+ 0 0 96 -4,-1.4 4,-2.7 1,-0.2 -1,-0.3 0.827 98.6 60.3 -66.4 -29.0 11.5 1.0 21.6 85 95 A A H S+ 0 0 62 -4,-2.6 5,-2.3 1,-0.2 6,-0.2 0.911 112.8 46.9 -54.3 -41.4 14.6 4.6 21.2 88 98 A K H ><5S+ 0 0 141 -4,-2.7 3,-1.0 2,-0.2 -1,-0.2 0.883 106.9 55.4 -68.6 -39.6 11.8 6.8 22.5 89 99 A Y H 3<5S+ 0 0 30 -4,-2.0 35,-2.9 1,-0.3 -1,-0.2 0.886 116.3 38.8 -59.9 -39.2 13.7 8.0 25.6 90 100 A F T 3<5S- 0 0 0 -4,-2.3 -1,-0.3 33,-0.2 -2,-0.2 0.368 105.0-131.0 -92.6 4.0 16.5 9.2 23.2 91 101 A Q T X 5 + 0 0 40 -3,-1.0 3,-2.3 -4,-0.2 -3,-0.2 0.885 38.0 174.7 47.5 45.8 14.1 10.4 20.6 92 102 A L T 3 < + 0 0 23 -5,-2.3 -1,-0.2 1,-0.3 -4,-0.1 0.530 65.6 72.7 -62.5 -7.3 16.1 8.5 18.0 93 103 A D T 3 S+ 0 0 131 -6,-0.2 2,-0.6 2,-0.1 -1,-0.3 0.723 80.4 85.4 -78.7 -20.2 13.6 9.4 15.2 94 104 A V S < S- 0 0 32 -3,-2.3 2,-0.8 -4,-0.1 3,-0.1 -0.731 83.8-136.5 -81.9 119.3 15.0 12.9 15.3 95 105 A T > - 0 0 70 -2,-0.6 4,-1.5 1,-0.2 3,-0.5 -0.689 15.1-166.7 -82.3 109.3 18.1 12.9 13.1 96 106 A L H > S+ 0 0 0 -2,-0.8 4,-3.1 1,-0.2 5,-0.3 0.874 85.7 61.7 -62.6 -38.2 20.8 14.8 14.9 97 107 A A H > S+ 0 0 57 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.851 103.9 49.7 -57.5 -36.6 22.9 15.0 11.7 98 108 A Q H > S+ 0 0 132 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.919 113.1 45.9 -69.4 -43.0 20.1 17.0 10.0 99 109 A L H X S+ 0 0 27 -4,-1.5 4,-2.8 2,-0.2 5,-0.3 0.932 111.4 50.6 -65.6 -46.9 19.8 19.4 12.9 100 110 A Y H X S+ 0 0 32 -4,-3.1 4,-2.8 1,-0.2 5,-0.2 0.891 109.1 54.0 -58.3 -39.8 23.6 19.9 13.3 101 111 A H H X S+ 0 0 133 -4,-1.7 4,-1.8 -5,-0.3 -1,-0.2 0.960 111.3 43.9 -59.2 -51.9 23.8 20.7 9.6 102 112 A H H X S+ 0 0 86 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.931 115.8 45.9 -60.4 -49.3 21.1 23.4 9.8 103 113 A W H >X S+ 0 0 2 -4,-2.8 4,-1.3 1,-0.2 3,-0.6 0.941 113.2 50.1 -60.7 -47.6 22.5 25.0 12.9 104 114 A G H 3< S+ 0 0 5 -4,-2.8 7,-0.3 -5,-0.3 -1,-0.2 0.807 107.5 55.3 -61.5 -29.3 26.0 25.0 11.6 105 115 A S H 3< S+ 0 0 73 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.809 116.4 34.6 -76.0 -28.3 24.8 26.5 8.3 106 116 A V H << S+ 0 0 68 -4,-1.4 2,-0.3 -3,-0.6 -2,-0.2 0.482 122.9 46.3-102.1 -4.2 23.2 29.5 10.0 107 117 A D X - 0 0 11 -4,-1.3 4,-2.1 -5,-0.2 3,-0.3 -0.784 58.8-170.2-143.7 96.7 25.8 29.8 12.8 108 118 A S H > S+ 0 0 98 -2,-0.3 4,-1.5 1,-0.2 -1,-0.1 0.814 91.3 54.5 -54.5 -34.5 29.5 29.7 12.0 109 119 A H H > S+ 0 0 48 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.934 106.1 51.9 -67.2 -43.1 30.4 29.5 15.7 110 120 A F H > S+ 0 0 0 -3,-0.3 4,-3.4 1,-0.2 5,-0.3 0.941 105.2 55.9 -57.0 -48.0 28.1 26.5 16.2 111 121 A Q H X S+ 0 0 120 -4,-2.1 4,-1.4 -7,-0.3 -1,-0.2 0.890 107.3 49.6 -52.5 -42.2 29.7 24.7 13.3 112 122 A E H X S+ 0 0 57 -4,-1.5 4,-0.6 2,-0.2 3,-0.3 0.942 116.1 40.7 -63.6 -48.9 33.1 25.0 14.9 113 123 A V H >X S+ 0 0 16 -4,-2.1 3,-1.2 1,-0.2 4,-0.8 0.937 109.8 59.6 -65.0 -46.8 32.0 23.7 18.3 114 124 A A H >< S+ 0 0 10 -4,-3.4 3,-0.6 1,-0.3 -1,-0.2 0.794 90.7 70.2 -52.6 -34.5 29.8 21.0 16.8 115 125 A Q H 3< S+ 0 0 88 -4,-1.4 3,-0.3 -3,-0.3 -1,-0.3 0.901 110.4 32.0 -52.2 -44.3 32.8 19.4 15.0 116 126 A K H << S+ 0 0 136 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.486 119.8 52.9 -94.2 -4.4 34.2 18.2 18.4 117 127 A F S X< S+ 0 0 36 -4,-0.8 3,-0.5 -3,-0.6 -1,-0.2 -0.469 71.2 156.9-131.1 64.0 30.9 17.7 20.2 118 128 A Q T 3 + 0 0 32 -3,-0.3 -94,-0.1 1,-0.2 3,-0.1 -0.363 53.1 39.0 -81.7 163.5 28.8 15.4 18.0 119 129 A G T 3 + 0 0 0 -96,-1.1 -93,-2.3 1,-0.2 2,-0.9 0.640 67.8 142.0 74.3 15.3 26.0 13.2 19.3 120 130 A V < + 0 0 1 -3,-0.5 2,-0.2 -95,-0.2 -1,-0.2 -0.817 23.9 155.3 -92.4 106.7 24.5 15.7 21.9 121 131 A R - 0 0 0 -2,-0.9 2,-0.4 -95,-0.1 -30,-0.1 -0.726 43.0 -95.9-123.1 174.4 20.8 15.2 21.6 122 132 A L - 0 0 1 -2,-0.2 2,-0.2 -32,-0.1 181,-0.1 -0.805 27.3-133.5-100.8 135.1 17.9 15.7 24.1 123 133 A L - 0 0 0 -2,-0.4 2,-0.9 -93,-0.1 -33,-0.2 -0.495 17.2-130.2 -76.6 149.4 16.3 13.0 26.3 124 134 A R - 0 0 22 -35,-2.9 124,-0.2 -2,-0.2 2,-0.2 -0.887 39.9-167.2-103.1 99.9 12.5 12.9 26.3 125 135 A Q - 0 0 5 122,-3.1 -89,-0.0 -2,-0.9 -3,-0.0 -0.487 25.8 -98.5 -95.1 160.7 11.9 12.8 30.0 126 136 A D > - 0 0 74 -2,-0.2 4,-2.9 1,-0.1 5,-0.2 -0.548 33.1-129.7 -72.5 132.9 8.9 12.1 32.3 127 137 A P H > S+ 0 0 2 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.868 103.4 48.0 -51.6 -46.7 7.2 15.3 33.5 128 138 A I H > S+ 0 0 11 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.961 115.1 43.3 -63.9 -51.5 7.1 14.5 37.1 129 139 A E H > S+ 0 0 25 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.945 116.8 49.0 -58.9 -44.6 10.8 13.4 37.4 130 140 A C H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.934 110.3 50.9 -60.8 -48.2 11.7 16.4 35.2 131 141 A L H X S+ 0 0 0 -4,-3.0 4,-1.3 -5,-0.2 -1,-0.2 0.933 116.3 37.8 -55.9 -53.1 9.7 18.9 37.3 132 142 A F H X S+ 0 0 0 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.851 113.7 55.2 -74.4 -30.0 11.1 17.9 40.7 133 143 A S H X S+ 0 0 1 -4,-2.5 4,-0.5 -5,-0.3 3,-0.3 0.955 112.8 42.7 -66.5 -46.0 14.7 17.3 39.5 134 144 A F H X S+ 0 0 4 -4,-2.4 4,-0.7 -5,-0.3 -1,-0.2 0.746 105.4 62.3 -73.2 -19.9 14.8 20.8 38.1 135 145 A I H >< S+ 0 0 0 -4,-1.3 3,-0.5 1,-0.2 -1,-0.2 0.890 107.0 47.2 -66.1 -35.4 13.1 22.3 41.1 136 146 A C H 3< S+ 0 0 0 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.628 101.2 70.3 -77.3 -13.5 16.2 20.9 42.9 137 147 A S H >< + 0 0 14 -4,-0.5 3,-0.9 -3,-0.2 -1,-0.2 0.706 68.5 110.6 -79.3 -22.9 18.5 22.4 40.3 138 148 A S T << S- 0 0 33 -4,-0.7 3,-0.1 -3,-0.5 56,-0.1 -0.254 92.7 -3.5 -59.5 135.6 18.2 26.1 41.0 139 149 A N T 3 S+ 0 0 137 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.910 118.2 104.5 50.0 48.1 21.1 28.0 42.5 140 150 A N < - 0 0 38 -3,-0.9 2,-0.3 4,-0.0 -1,-0.2 -0.951 69.2-113.6-152.4 165.8 23.0 24.7 42.6 141 151 A N > - 0 0 85 -2,-0.3 4,-3.0 -3,-0.1 5,-0.2 -0.813 29.7-116.1-108.6 150.5 25.6 22.5 40.9 142 152 A I H > S+ 0 0 52 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.827 112.6 54.4 -49.6 -41.0 25.1 19.3 39.0 143 153 A A H > S+ 0 0 75 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.959 113.9 39.4 -61.3 -52.4 27.2 17.2 41.4 144 154 A R H > S+ 0 0 91 1,-0.2 4,-2.8 2,-0.2 3,-0.2 0.936 114.6 54.4 -63.4 -46.0 25.1 18.3 44.5 145 155 A I H X S+ 0 0 5 -4,-3.0 4,-2.9 1,-0.2 5,-0.2 0.916 105.3 53.6 -53.3 -47.1 21.9 18.1 42.5 146 156 A T H X S+ 0 0 13 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.890 110.3 47.2 -56.9 -40.9 22.6 14.5 41.5 147 157 A G H X S+ 0 0 14 -4,-1.6 4,-2.5 -3,-0.2 5,-0.3 0.958 111.2 50.7 -65.8 -49.4 23.1 13.6 45.2 148 158 A M H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.924 110.9 48.8 -53.1 -48.3 19.9 15.4 46.2 149 159 A V H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.876 110.3 51.1 -62.9 -39.1 17.9 13.6 43.5 150 160 A E H X S+ 0 0 72 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.944 111.3 46.8 -64.1 -46.3 19.3 10.2 44.5 151 161 A R H X S+ 0 0 91 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.872 110.4 54.0 -63.8 -36.7 18.5 10.6 48.2 152 162 A L H X S+ 0 0 1 -4,-2.2 4,-2.2 -5,-0.3 5,-0.3 0.912 111.4 44.8 -62.6 -45.3 15.0 11.8 47.3 153 163 A C H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.876 111.4 51.9 -69.1 -37.5 14.3 8.7 45.2 154 164 A Q H < S+ 0 0 55 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.918 115.7 41.9 -65.6 -41.1 15.7 6.3 47.8 155 165 A A H < S+ 0 0 41 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.846 134.4 14.4 -75.7 -34.5 13.5 7.8 50.5 156 166 A F H < S+ 0 0 46 -4,-2.2 17,-0.5 -5,-0.2 -3,-0.2 0.501 103.5 89.6-122.8 -3.6 10.3 8.2 48.5 157 167 A G S < S- 0 0 13 -4,-2.5 14,-0.2 -5,-0.3 2,-0.1 -0.604 83.3 -90.1 -96.7 159.0 10.5 6.2 45.3 158 168 A P - 0 0 81 0, 0.0 12,-2.7 0, 0.0 2,-0.3 -0.380 43.4-115.9 -63.5 137.6 9.5 2.5 44.7 159 169 A R E +E 169 0B 183 10,-0.2 10,-0.2 1,-0.2 3,-0.1 -0.608 39.2 174.6 -75.9 130.8 12.3 0.1 45.3 160 170 A L E - 0 0 54 8,-3.3 2,-0.3 -2,-0.3 -1,-0.2 0.775 47.1 -39.5-100.7 -89.5 13.2 -1.7 42.0 161 171 A I E - 0 0 40 7,-0.1 7,-2.9 -91,-0.0 2,-0.4 -0.919 47.6-125.0-139.3 167.6 16.2 -4.0 42.0 162 172 A Q E -E 167 0B 116 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.946 18.6-175.9-118.7 135.7 19.7 -4.1 43.6 163 173 A L E > -E 166 0B 15 3,-2.5 3,-2.6 -2,-0.4 2,-0.1 -0.997 68.6 -36.1-131.5 125.1 23.0 -4.5 41.7 164 174 A D T 3 S- 0 0 97 -2,-0.4 -160,-0.1 1,-0.3 -2,-0.0 -0.451 127.0 -29.6 57.6-129.8 26.2 -4.8 43.7 165 175 A D T 3 S+ 0 0 145 -2,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.207 117.6 102.9-101.6 17.0 25.6 -2.4 46.6 166 176 A V E < -E 163 0B 37 -3,-2.6 -3,-2.5 2,-0.0 2,-0.6 -0.873 53.1-162.1-104.7 123.4 23.3 -0.1 44.6 167 177 A T E -E 162 0B 51 -2,-0.5 -5,-0.2 -5,-0.2 2,-0.2 -0.909 16.4-143.7-104.9 116.5 19.5 -0.2 45.1 168 178 A Y E - 0 0 18 -7,-2.9 -8,-3.3 -2,-0.6 2,-0.3 -0.560 15.9-167.6 -81.9 141.7 17.6 1.4 42.3 169 179 A H E -E 159 0B 27 -10,-0.2 -10,-0.2 -2,-0.2 -119,-0.1 -0.955 20.1-123.9-127.4 147.0 14.4 3.4 43.0 170 180 A G - 0 0 4 -12,-2.7 -14,-0.1 -2,-0.3 3,-0.1 -0.389 49.0 -85.0 -77.9 167.3 11.8 4.7 40.6 171 181 A F - 0 0 28 -14,-0.2 -1,-0.1 1,-0.1 -42,-0.1 -0.523 56.5 -97.9 -74.0 142.7 11.1 8.4 40.9 172 182 A P - 0 0 3 0, 0.0 -15,-0.2 0, 0.0 -1,-0.1 -0.167 36.1-117.3 -59.6 153.0 8.6 9.3 43.6 173 183 A S > - 0 0 58 -17,-0.5 4,-2.3 1,-0.1 5,-0.2 -0.372 23.4-110.0 -85.9 168.0 4.9 9.9 42.9 174 184 A L H > S+ 0 0 7 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.934 120.1 54.8 -62.0 -45.7 3.0 13.1 43.4 175 185 A Q H 4 S+ 0 0 121 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.905 109.5 47.2 -55.4 -42.9 1.1 11.5 46.3 176 186 A A H >4 S+ 0 0 30 1,-0.2 3,-1.1 2,-0.2 -1,-0.2 0.919 113.0 46.2 -67.0 -45.0 4.4 10.5 48.0 177 187 A L H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 26,-0.2 0.765 111.3 54.1 -69.3 -23.8 6.0 13.9 47.6 178 188 A A T 3< S+ 0 0 16 -4,-2.1 -1,-0.2 24,-0.2 -2,-0.2 0.497 89.0 119.9 -86.7 -4.7 2.8 15.6 48.8 179 189 A G S X S- 0 0 15 -3,-1.1 3,-1.4 -4,-0.4 4,-0.3 0.008 75.5 -77.7 -61.0 163.8 2.8 13.5 52.0 180 190 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.380 111.6 4.7 -65.2 134.3 2.9 14.7 55.6 181 191 A E T 3> S+ 0 0 161 -3,-0.1 4,-1.7 -2,-0.1 5,-0.1 0.651 84.4 130.6 68.6 17.8 6.4 15.7 56.9 182 192 A V H <> + 0 0 3 -3,-1.4 4,-2.8 2,-0.2 5,-0.2 0.918 69.3 56.6 -66.9 -41.1 8.1 15.3 53.5 183 193 A E H > S+ 0 0 64 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.931 107.5 47.2 -54.9 -50.1 9.6 18.8 53.8 184 194 A A H > S+ 0 0 56 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.902 112.7 48.8 -59.8 -42.8 11.3 17.9 57.1 185 195 A H H X S+ 0 0 82 -4,-1.7 4,-0.9 1,-0.2 -1,-0.2 0.921 109.7 52.1 -65.3 -42.0 12.6 14.6 55.8 186 196 A L H <>S+ 0 0 0 -4,-2.8 5,-2.1 1,-0.2 6,-0.3 0.839 105.6 55.4 -63.0 -33.6 14.0 16.3 52.6 187 197 A R H ><5S+ 0 0 109 -4,-1.9 3,-1.5 1,-0.2 5,-0.3 0.889 105.1 51.6 -67.3 -37.1 15.8 18.9 54.8 188 198 A K H 3<5S+ 0 0 192 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.708 106.6 56.3 -70.4 -17.8 17.6 16.1 56.7 189 199 A L T 3<5S- 0 0 35 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.2 0.394 122.9-109.6 -92.0 2.0 18.5 14.8 53.2 190 200 A G T < 5S+ 0 0 29 -3,-1.5 -3,-0.2 -5,-0.1 -2,-0.1 0.664 74.6 135.6 83.0 19.6 20.1 18.1 52.4 191 201 A L > < - 0 0 0 -5,-2.1 3,-1.3 1,-0.2 -4,-0.2 0.606 47.2-160.6 -74.3 -8.3 17.8 19.7 49.9 192 202 A G T > - 0 0 29 -5,-0.3 3,-2.0 -6,-0.3 4,-0.3 -0.308 61.3 -14.4 64.3-147.7 18.0 23.0 51.7 193 203 A Y T >> S+ 0 0 93 1,-0.3 4,-0.8 2,-0.2 3,-0.7 0.663 128.5 71.8 -63.9 -16.6 15.3 25.5 51.1 194 204 A R H <> S+ 0 0 9 -3,-1.3 4,-2.2 1,-0.2 -1,-0.3 0.627 77.1 81.8 -75.0 -10.6 14.2 23.6 48.0 195 205 A A H <> S+ 0 0 0 -3,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.925 94.0 45.4 -57.4 -43.9 12.8 21.0 50.4 196 206 A R H <> S+ 0 0 112 -3,-0.7 4,-3.3 -4,-0.3 5,-0.3 0.866 107.2 58.1 -68.7 -36.1 9.7 23.2 50.8 197 207 A Y H X S+ 0 0 56 -4,-0.8 4,-2.7 2,-0.2 5,-0.2 0.914 106.9 49.2 -59.9 -41.6 9.5 23.8 47.1 198 208 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.965 116.0 40.0 -62.4 -54.7 9.2 20.1 46.5 199 209 A S H X S+ 0 0 4 -4,-1.9 4,-2.3 1,-0.2 5,-0.2 0.955 117.7 49.2 -59.9 -50.5 6.5 19.5 49.1 200 210 A A H X S+ 0 0 28 -4,-3.3 4,-2.5 1,-0.2 -1,-0.2 0.891 112.7 46.8 -58.6 -42.0 4.6 22.7 48.2 201 211 A S H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.3 -1,-0.2 0.863 109.6 53.2 -70.5 -35.0 4.6 22.0 44.5 202 212 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 -5,-0.2 -24,-0.2 0.948 114.1 43.0 -64.1 -45.2 3.5 18.4 44.9 203 213 A R H X S+ 0 0 93 -4,-2.3 4,-3.7 -26,-0.2 5,-0.4 0.919 110.4 56.2 -66.3 -42.1 0.5 19.5 47.0 204 214 A A H X>S+ 0 0 11 -4,-2.5 4,-1.9 -5,-0.2 5,-1.4 0.892 110.5 44.3 -57.4 -42.1 -0.2 22.4 44.6 205 215 A I H <5S+ 0 0 0 -4,-2.1 6,-3.2 3,-0.2 5,-0.4 0.911 120.5 40.3 -69.0 -42.6 -0.5 20.1 41.6 206 216 A L H <5S+ 0 0 55 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.861 129.4 27.2 -75.4 -36.9 -2.6 17.5 43.5 207 217 A E H <5S+ 0 0 146 -4,-3.7 -3,-0.2 -5,-0.2 -2,-0.2 0.549 133.8 23.2-107.3 -8.1 -4.8 19.9 45.5 208 218 A E T <5S+ 0 0 149 -4,-1.9 -3,-0.2 -5,-0.4 -4,-0.1 0.603 121.3 42.8-129.7 -22.5 -5.0 23.1 43.3 209 219 A Q S > S- 0 0 9 -6,-3.2 3,-1.7 1,-0.2 4,-0.9 -0.205 73.4 -25.8 84.3-172.0 -3.5 16.4 39.5 212 222 A L H >> S+ 0 0 75 1,-0.3 4,-2.6 2,-0.2 3,-0.5 0.823 128.2 65.4 -48.6 -39.2 -1.1 14.5 37.2 213 223 A A H 3> S+ 0 0 67 -3,-0.4 4,-1.5 1,-0.2 -1,-0.3 0.839 94.5 59.4 -55.3 -37.2 -3.4 15.0 34.3 214 224 A W H <> S+ 0 0 43 -3,-1.7 4,-0.5 2,-0.2 -1,-0.2 0.906 111.6 39.3 -59.0 -43.7 -2.8 18.8 34.5 215 225 A L H X< S+ 0 0 0 -4,-0.9 3,-1.8 -3,-0.5 4,-0.4 0.962 114.6 50.2 -72.2 -54.1 1.0 18.3 34.0 216 226 A Q H >< S+ 0 0 90 -4,-2.6 3,-0.9 1,-0.3 4,-0.2 0.738 103.1 64.8 -57.8 -23.0 0.8 15.6 31.4 217 227 A Q H >X S+ 0 0 46 -4,-1.5 3,-1.6 -5,-0.3 4,-0.8 0.771 83.4 74.5 -71.9 -27.3 -1.7 17.8 29.5 218 228 A L T << S+ 0 0 10 -3,-1.8 -1,-0.2 -4,-0.5 8,-0.2 0.722 79.7 74.1 -60.0 -20.0 1.0 20.4 28.9 219 229 A R T <4 S+ 0 0 76 -3,-0.9 -1,-0.3 -4,-0.4 -2,-0.2 0.854 102.3 39.5 -62.7 -33.2 2.5 18.2 26.2 220 230 A E T <4 S+ 0 0 164 -3,-1.6 -1,-0.2 -4,-0.2 -2,-0.2 0.617 104.5 86.3 -90.1 -14.8 -0.3 19.0 23.8 221 231 A S S < S- 0 0 44 -4,-0.8 2,-0.1 -3,-0.2 -3,-0.0 -0.275 89.3 -91.6 -78.4 170.1 -0.4 22.6 24.8 222 232 A S > - 0 0 53 1,-0.1 4,-3.2 -2,-0.0 5,-0.3 -0.426 33.3-108.9 -81.9 159.8 1.7 25.3 23.2 223 233 A Y H > S+ 0 0 18 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.911 120.7 50.2 -52.0 -48.0 5.1 26.4 24.6 224 234 A E H > S+ 0 0 126 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.919 114.6 43.5 -58.2 -47.5 3.7 29.7 25.8 225 235 A E H > S+ 0 0 120 2,-0.2 4,-2.6 1,-0.2 3,-0.4 0.988 116.7 46.2 -60.8 -60.8 0.8 28.0 27.5 226 236 A A H X S+ 0 0 0 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.907 112.4 50.0 -48.1 -53.4 2.9 25.3 29.1 227 237 A H H X S+ 0 0 30 -4,-3.2 4,-1.3 -5,-0.3 -1,-0.2 0.848 111.6 48.8 -57.9 -37.4 5.6 27.7 30.3 228 238 A K H < S+ 0 0 156 -4,-1.7 4,-0.4 -3,-0.4 -1,-0.2 0.924 109.6 51.6 -69.3 -44.6 3.1 29.9 31.9 229 239 A A H >< S+ 0 0 18 -4,-2.6 3,-1.6 1,-0.2 4,-0.4 0.939 108.0 52.3 -57.4 -49.3 1.3 27.1 33.7 230 240 A L H >< S+ 0 0 0 -4,-2.3 3,-1.6 1,-0.3 -1,-0.2 0.847 97.3 64.5 -57.6 -39.3 4.6 25.8 35.2 231 241 A C T 3< S+ 0 0 48 -4,-1.3 -1,-0.3 1,-0.3 5,-0.2 0.644 87.8 73.5 -62.2 -12.2 5.6 29.1 36.7 232 242 A I T < S+ 0 0 100 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.854 80.9 89.7 -68.1 -34.5 2.6 28.8 38.9 233 243 A L S X S- 0 0 4 -3,-1.6 3,-1.8 -4,-0.4 2,-0.1 -0.348 91.1 -99.6 -69.2 141.8 4.3 26.1 41.0 234 244 A P T 3 S+ 0 0 42 0, 0.0 -33,-0.2 0, 0.0 -1,-0.1 -0.372 107.7 16.3 -62.7 128.1 6.5 27.0 44.0 235 245 A G T 3 S+ 0 0 23 1,-0.2 2,-0.7 -2,-0.1 -97,-0.2 0.416 99.4 115.2 88.4 -1.9 10.2 27.1 43.2 236 246 A V < + 0 0 9 -3,-1.8 -1,-0.2 -5,-0.2 2,-0.1 -0.872 36.8 165.7-108.5 106.5 9.6 27.2 39.5 237 247 A G > - 0 0 38 -2,-0.7 4,-2.5 -3,-0.1 5,-0.2 -0.299 57.4 -76.6-101.0-169.5 10.7 30.3 37.7 238 248 A T H > S+ 0 0 83 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.844 129.7 49.4 -59.9 -35.6 11.1 31.0 34.0 239 249 A K H > S+ 0 0 55 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.967 112.0 44.6 -69.4 -54.7 14.4 29.1 33.8 240 250 A V H > S+ 0 0 6 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.924 114.0 52.8 -55.9 -42.5 13.2 25.9 35.6 241 251 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 -1,-0.2 0.904 107.6 50.6 -59.6 -43.3 10.0 26.1 33.5 242 252 A D H X S+ 0 0 17 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.926 108.4 51.9 -62.5 -43.9 12.1 26.3 30.3 243 253 A C H X S+ 0 0 8 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.941 113.4 44.8 -56.6 -47.1 14.2 23.3 31.3 244 254 A I H X>S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-1.4 0.924 113.0 50.4 -64.3 -44.1 11.0 21.3 31.9 245 255 A C H X5S+ 0 0 0 -4,-3.0 6,-2.0 3,-0.2 4,-0.6 0.937 116.4 41.8 -58.7 -46.8 9.3 22.5 28.6 246 256 A L H <5S+ 0 0 5 -4,-3.0 -2,-0.2 4,-0.2 -1,-0.2 0.891 124.6 32.6 -67.6 -43.5 12.4 21.6 26.6 247 257 A M H <5S+ 0 0 12 -4,-2.7 -122,-3.1 -5,-0.3 -2,-0.2 0.604 134.4 15.5 -97.2 -10.3 13.2 18.2 28.2 248 258 A A H <5S+ 0 0 1 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.1 0.561 121.0 51.1-135.0 -19.1 9.8 16.8 29.2 249 259 A L S < + 0 0 11 -6,-2.0 3,-1.9 -7,-0.2 -1,-0.2 -0.763 23.0 177.2-113.6 81.5 8.9 22.2 23.3 252 262 A P T 3 S+ 0 0 24 0, 0.0 50,-2.4 0, 0.0 51,-0.8 0.620 75.0 62.1 -62.1 -9.9 12.1 22.0 21.3 253 263 A Q T 3 S+ 0 0 55 48,-0.2 2,-0.2 47,-0.2 47,-0.1 0.552 75.4 112.5 -92.4 -8.1 12.2 25.8 21.0 254 264 A A < - 0 0 0 -3,-1.9 -3,-0.0 45,-0.1 -12,-0.0 -0.485 50.0-165.1 -67.7 129.7 12.5 26.4 24.7 255 265 A V - 0 0 1 -2,-0.2 2,-0.4 50,-0.1 -12,-0.1 -0.904 11.5-144.2-122.2 102.2 15.9 27.9 25.7 256 266 A P - 0 0 3 0, 0.0 2,-0.6 0, 0.0 5,-0.2 -0.477 17.6-155.6 -66.0 119.0 16.8 27.8 29.4 257 267 A V + 0 0 10 -2,-0.4 2,-0.2 4,-0.1 -18,-0.1 -0.869 34.3 124.0-107.5 117.7 18.7 30.9 30.2 258 268 A E S > S- 0 0 42 -2,-0.6 4,-1.8 -19,-0.1 5,-0.2 -0.677 75.7 -54.7-143.6-162.8 21.1 30.9 33.2 259 269 A V H > S+ 0 0 112 1,-0.2 4,-2.2 -2,-0.2 5,-0.2 0.880 127.5 53.6 -53.1 -45.7 24.8 31.7 33.9 260 270 A H H > S+ 0 0 56 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.917 110.4 44.2 -57.9 -49.3 26.2 29.2 31.3 261 271 A M H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.825 111.2 55.4 -67.7 -31.4 24.2 30.6 28.3 262 272 A W H X S+ 0 0 11 -4,-1.8 4,-2.4 2,-0.2 5,-0.2 0.918 108.9 47.6 -65.4 -42.7 25.0 34.2 29.3 263 273 A H H X S+ 0 0 90 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.922 113.5 47.8 -62.4 -46.9 28.7 33.4 29.3 264 274 A I H X S+ 0 0 3 -4,-2.2 4,-2.6 1,-0.2 5,-0.5 0.923 111.2 51.3 -60.0 -47.2 28.3 31.7 25.9 265 275 A A H X S+ 0 0 0 -4,-2.8 6,-2.3 1,-0.2 4,-1.2 0.919 116.5 39.0 -57.5 -47.5 26.3 34.6 24.5 266 276 A Q H X S+ 0 0 88 -4,-2.4 4,-0.7 4,-0.3 -2,-0.2 0.918 122.5 39.6 -71.9 -44.7 28.8 37.2 25.6 267 277 A R H < S+ 0 0 123 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.908 127.1 29.3 -74.0 -43.7 32.0 35.3 24.8 268 278 A D H < S+ 0 0 43 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.605 135.0 23.8 -97.6 -11.8 31.1 33.7 21.5 269 279 A Y H < S- 0 0 45 -4,-1.2 -3,-0.2 -5,-0.5 -2,-0.1 0.383 91.1-127.1-129.8 -1.1 28.5 36.1 20.0 270 280 A S < + 0 0 93 -4,-0.7 -4,-0.3 -6,-0.2 2,-0.1 0.861 48.6 178.9 53.9 37.2 29.5 39.4 21.7 271 281 A W + 0 0 22 -6,-2.3 -1,-0.2 -7,-0.1 -2,-0.1 -0.421 15.5 174.8 -75.6 146.1 25.8 39.6 22.7 272 282 A H - 0 0 126 -2,-0.1 8,-0.1 -3,-0.1 7,-0.1 -0.983 38.0-100.2-145.7 146.0 24.4 42.5 24.7 273 283 A P + 0 0 21 0, 0.0 12,-0.1 0, 0.0 13,-0.0 -0.361 39.1 172.8 -65.3 149.3 20.7 43.2 25.7 274 284 A T S S+ 0 0 117 11,-0.1 11,-0.0 -2,-0.0 5,-0.0 0.659 74.4 32.3-124.2 -51.0 19.1 45.9 23.5 275 285 A T S S+ 0 0 125 9,-0.1 10,-0.1 10,-0.1 9,-0.0 0.796 103.3 88.6 -80.9 -29.3 15.4 46.2 24.3 276 286 A S S S- 0 0 16 1,-0.1 9,-0.0 8,-0.1 0, 0.0 -0.190 76.1-132.7 -67.4 161.6 15.9 45.3 28.0 277 287 A Q S S+ 0 0 155 2,-0.0 -1,-0.1 0, 0.0 5,-0.0 0.905 83.0 66.4 -81.1 -46.5 16.6 48.0 30.6 278 288 A A - 0 0 41 1,-0.1 4,-0.1 2,-0.1 -2,-0.1 -0.148 66.1-147.3 -73.6 169.5 19.5 46.2 32.4 279 289 A K S S+ 0 0 82 2,-0.1 -1,-0.1 -7,-0.1 3,-0.1 0.604 83.4 40.6-108.7 -24.0 22.9 45.4 31.0 280 290 A G S S- 0 0 28 1,-0.2 5,-0.2 -8,-0.1 -2,-0.1 -0.407 111.6 -41.1-112.3-169.8 23.4 42.2 33.0 281 291 A P S S+ 0 0 93 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.280 72.4 133.0 -58.7 135.4 21.2 39.3 33.9 282 292 A S S > S- 0 0 24 -4,-0.1 4,-3.0 -3,-0.1 5,-0.3 -0.939 71.2 -87.4-170.3 164.9 17.6 40.2 35.0 283 293 A P H > S+ 0 0 114 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.883 127.6 46.1 -54.5 -36.9 14.1 38.9 34.1 284 294 A Q H > S+ 0 0 29 2,-0.2 4,-1.6 1,-0.2 -8,-0.1 0.925 116.4 42.3 -71.8 -44.9 14.0 41.3 31.1 285 295 A T H > S+ 0 0 0 -5,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.829 111.5 55.6 -72.2 -32.2 17.4 40.5 29.7 286 296 A N H X S+ 0 0 38 -4,-3.0 4,-1.8 2,-0.2 -1,-0.2 0.906 108.8 47.5 -65.9 -40.7 17.1 36.8 30.3 287 297 A K H X S+ 0 0 151 -4,-1.5 4,-1.7 -5,-0.3 -1,-0.2 0.881 110.9 52.8 -66.9 -36.6 13.9 36.7 28.3 288 298 A E H X S+ 0 0 26 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.911 106.8 51.4 -64.6 -42.9 15.7 38.7 25.6 289 299 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.903 107.0 54.4 -61.5 -41.9 18.6 36.3 25.4 290 300 A G H X S+ 0 0 4 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.899 108.9 48.0 -59.5 -39.9 16.2 33.4 25.0 291 301 A N H X S+ 0 0 80 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.888 107.3 56.9 -68.2 -36.0 14.6 35.2 22.0 292 302 A F H X S+ 0 0 57 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.947 108.2 46.5 -59.1 -49.3 18.0 35.8 20.6 293 303 A F H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.4 0.856 111.9 50.3 -64.7 -34.0 18.8 32.1 20.5 294 304 A R H X S+ 0 0 51 -4,-1.7 4,-2.3 -5,-0.2 -1,-0.2 0.919 110.5 50.1 -69.8 -38.9 15.5 31.2 19.0 295 305 A S H < S+ 0 0 107 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.864 115.9 43.8 -64.9 -35.2 16.0 33.8 16.3 296 306 A L H < S+ 0 0 42 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.935 127.5 23.4 -75.8 -49.6 19.5 32.4 15.6 297 307 A W H < S- 0 0 2 -4,-2.6 3,-0.4 1,-0.2 -3,-0.2 0.670 95.8-145.3 -95.9 -21.2 18.8 28.6 15.6 298 308 A G >< - 0 0 21 -4,-2.3 3,-1.7 -5,-0.4 -1,-0.2 -0.558 56.6 -10.3 96.5-159.9 15.1 28.3 14.9 299 309 A P T 3 S+ 0 0 95 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.663 136.0 46.1 -53.0 -27.7 12.4 25.9 16.1 300 310 A Y T >> S+ 0 0 84 -3,-0.4 4,-1.8 1,-0.2 3,-0.8 -0.057 70.7 129.6-110.7 33.5 14.9 23.5 17.7 301 311 A A H <> + 0 0 0 -3,-1.7 4,-2.4 1,-0.3 -48,-0.2 0.799 69.4 59.5 -55.2 -33.6 16.9 26.3 19.5 302 312 A G H 3> S+ 0 0 0 -50,-2.4 4,-1.5 -3,-0.3 -1,-0.3 0.892 105.0 48.3 -64.6 -39.7 16.6 24.4 22.8 303 313 A W H <> S+ 0 0 5 -51,-0.8 4,-1.1 -3,-0.8 -2,-0.2 0.882 110.9 49.9 -67.2 -39.9 18.4 21.4 21.3 304 314 A A H >X S+ 0 0 0 -4,-1.8 4,-1.7 1,-0.2 3,-0.6 0.918 106.9 56.6 -63.8 -41.5 21.1 23.6 19.8 305 315 A Q H 3X S+ 0 0 14 -4,-2.4 4,-3.1 1,-0.3 5,-0.3 0.880 101.0 57.7 -55.1 -40.8 21.4 25.1 23.3 306 316 A A H 3X S+ 0 0 6 -4,-1.5 4,-2.6 2,-0.2 -1,-0.3 0.851 102.9 54.2 -60.9 -35.2 22.1 21.6 24.7 307 317 A V H X S+ 0 0 2 -4,-2.6 4,-1.8 -5,-0.3 3,-0.7 0.936 113.9 49.0 -58.2 -46.7 27.1 20.4 27.3 311 321 A A H 3X S+ 0 0 12 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.818 107.8 54.9 -64.4 -30.4 30.3 21.6 25.6 312 322 A D H 3< S+ 0 0 16 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.738 104.7 53.8 -76.1 -22.0 30.6 24.5 28.1 313 323 A L H << S+ 0 0 51 -4,-1.3 -2,-0.2 -3,-0.7 -1,-0.2 0.934 107.8 48.9 -74.0 -48.2 30.4 22.0 31.0 314 324 A R H < 0 0 147 -4,-1.8 -2,-0.2 -5,-0.1 -1,-0.2 0.892 360.0 360.0 -56.1 -40.4 33.2 20.0 29.7 315 325 A Q < 0 0 119 -4,-1.6 -3,-0.0 -5,-0.2 0, 0.0 0.014 360.0 360.0 -67.5 360.0 35.1 23.3 29.3