==== 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 2NOB . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR C.T.RADOM,A.BANERJEE,G.L.VERDINE . 314 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14011.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 206 65.6 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 8.9 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 . 12 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 119 37.9 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 1 0 1 1 2 2 2 0 1 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 1 1 1 1 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 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 0 126 0, 0.0 9,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 166.6 28.8 -13.1 36.6 2 10 A E + 0 0 171 4,-0.0 2,-0.3 73,-0.0 4,-0.1 0.454 360.0 68.0 -85.8 -1.6 25.1 -13.1 37.4 3 11 A F S S+ 0 0 155 2,-0.1 160,-0.1 160,-0.1 0, 0.0 -0.756 82.3 24.5-117.4 165.0 25.5 -10.3 40.0 4 12 A G S S- 0 0 9 -2,-0.3 2,-0.2 158,-0.2 158,-0.0 -0.052 104.1 -32.4 76.3 177.6 26.5 -6.7 39.8 5 13 A H S S- 0 0 25 158,-0.1 2,-0.1 1,-0.1 -2,-0.1 -0.504 70.8-123.4 -71.1 137.1 26.1 -4.3 36.9 6 14 A R - 0 0 26 -2,-0.2 2,-0.3 -4,-0.1 37,-0.1 -0.385 20.1-158.2 -81.2 157.5 26.5 -6.0 33.6 7 15 A T > - 0 0 33 1,-0.1 4,-1.9 -2,-0.1 8,-0.1 -0.906 31.8-112.0-128.7 158.4 29.0 -5.1 30.8 8 16 A L T 4 S+ 0 0 50 -2,-0.3 7,-0.1 1,-0.2 6,-0.1 0.922 118.5 45.6 -56.6 -44.6 28.8 -5.9 27.1 9 17 A A T 4 S+ 0 0 90 1,-0.2 -1,-0.2 2,-0.1 -3,-0.0 0.902 111.0 50.9 -66.3 -45.1 31.8 -8.2 27.5 10 18 A S T 4 S+ 0 0 58 1,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.918 123.9 21.8 -64.0 -48.3 30.7 -10.1 30.6 11 19 A T >< + 0 0 22 -4,-1.9 3,-1.9 1,-0.2 4,-0.3 -0.519 69.4 168.6-125.0 68.1 27.1 -11.1 29.7 12 20 A P G > S+ 0 0 85 0, 0.0 3,-1.5 0, 0.0 -1,-0.2 0.822 74.0 54.8 -41.7 -53.1 27.0 -11.1 25.8 13 21 A A G 3 S+ 0 0 87 1,-0.2 64,-0.5 64,-0.0 -5,-0.0 0.647 98.9 64.1 -64.8 -15.0 23.6 -12.8 25.4 14 22 A L G < S+ 0 0 31 -3,-1.9 55,-0.4 62,-0.1 2,-0.3 0.500 88.1 84.2 -90.4 -1.2 21.8 -10.3 27.6 15 23 A W < - 0 0 21 -3,-1.5 2,-0.3 -4,-0.3 53,-0.2 -0.761 52.8-171.0-105.1 148.5 22.3 -7.3 25.4 16 24 A A E -A 67 0A 20 51,-2.6 51,-3.5 -2,-0.3 2,-0.2 -0.961 17.6-131.9-131.6 149.1 20.3 -6.1 22.4 17 25 A S E -A 66 0A 49 -2,-0.3 49,-0.2 49,-0.2 47,-0.1 -0.653 11.9-161.3-107.9 161.4 21.2 -3.3 20.0 18 26 A I E -A 65 0A 6 47,-1.2 47,-2.1 -2,-0.2 2,-0.0 -0.988 38.6-110.4-135.0 120.1 19.6 -0.3 18.4 19 27 A P E +A 64 0A 98 0, 0.0 45,-0.2 0, 0.0 44,-0.1 -0.331 58.5 147.1 -53.4 125.2 21.2 1.1 15.2 20 28 A C - 0 0 4 43,-2.6 41,-0.2 41,-0.1 43,-0.1 -0.642 37.3-146.2-168.3 103.4 22.7 4.4 16.3 21 29 A P >> - 0 0 35 0, 0.0 3,-2.7 0, 0.0 4,-0.9 -0.406 30.5-115.8 -71.2 149.6 25.9 6.1 15.0 22 30 A R T 34 S+ 0 0 77 1,-0.3 40,-0.1 2,-0.2 3,-0.1 0.709 115.7 68.1 -58.7 -17.6 27.9 8.1 17.5 23 31 A S T 34 S+ 0 0 46 1,-0.2 96,-1.0 95,-0.1 -1,-0.3 0.698 103.0 45.2 -74.5 -16.9 27.0 11.1 15.3 24 32 A E T <4 S+ 0 0 25 -3,-2.7 2,-0.3 1,-0.3 -2,-0.2 0.619 128.5 9.5 -98.0 -16.9 23.4 10.7 16.4 25 33 A L < - 0 0 0 -4,-0.9 2,-0.5 95,-0.1 -1,-0.3 -0.893 47.6-172.0-167.7 132.5 24.2 10.1 20.1 26 34 A R >> - 0 0 40 93,-2.2 3,-1.3 -2,-0.3 4,-0.9 -0.947 11.4-163.7-125.8 104.8 27.1 10.4 22.6 27 35 A L H >> S+ 0 0 2 -2,-0.5 4,-2.2 1,-0.3 3,-1.0 0.912 90.1 56.3 -56.2 -44.0 26.0 8.9 26.0 28 36 A D H 34 S+ 0 0 45 1,-0.3 -1,-0.3 2,-0.2 13,-0.0 0.687 111.3 44.2 -63.9 -17.0 28.9 10.6 27.7 29 37 A L H <4 S+ 0 0 1 -3,-1.3 -1,-0.3 90,-0.1 -2,-0.2 0.535 123.3 34.1-102.6 -8.5 27.8 14.0 26.4 30 38 A V H X< S+ 0 0 0 -3,-1.0 3,-1.3 -4,-0.9 5,-0.5 0.804 110.2 52.8-109.2 -55.4 24.1 13.5 27.2 31 39 A L T 3< S+ 0 0 2 -4,-2.2 8,-0.4 1,-0.2 3,-0.3 0.793 116.7 34.0 -60.0 -35.7 23.6 11.5 30.3 32 40 A P T 3 S+ 0 0 55 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.270 94.0 95.3-104.8 16.8 25.8 13.4 32.8 33 41 A S S < S- 0 0 12 -3,-1.3 -2,-0.1 1,-0.0 4,-0.1 0.176 104.6 -89.0 -94.5 18.2 25.2 16.9 31.4 34 42 A G S S+ 0 0 11 2,-0.5 3,-0.2 -3,-0.3 -3,-0.1 0.764 103.2 98.5 86.9 22.4 22.4 18.2 33.5 35 43 A Q S S+ 0 0 11 1,-0.6 2,-0.4 -5,-0.5 -4,-0.1 0.783 98.0 11.2 -99.5 -61.7 19.3 17.0 31.5 36 44 A S - 0 0 4 -6,-0.4 -1,-0.6 -5,-0.2 -2,-0.5 -0.896 62.9-161.5-114.0 146.3 18.6 13.9 33.6 37 45 A F S S+ 0 0 8 -2,-0.4 113,-0.1 -3,-0.2 -1,-0.1 0.201 72.7 83.9-112.1 16.6 20.3 13.4 37.0 38 46 A R + 0 0 26 12,-0.1 12,-0.5 -7,-0.1 2,-0.4 0.202 66.0 91.3-108.4 17.1 19.6 9.7 37.2 39 47 A W - 0 0 11 -8,-0.4 2,-0.4 -3,-0.2 10,-0.2 -0.917 45.6-178.2-117.1 139.5 22.4 8.1 35.2 40 48 A R E -B 48 0A 103 8,-2.1 8,-3.1 -2,-0.4 2,-1.8 -0.997 32.0-129.8-137.3 139.8 25.8 6.8 36.4 41 49 A E E + 0 0 98 -2,-0.4 6,-0.2 6,-0.3 4,-0.1 -0.625 34.6 171.0 -83.7 78.8 28.7 5.3 34.7 42 50 A Q E S+ 0 0 80 -2,-1.8 -1,-0.2 4,-0.3 5,-0.1 0.805 73.4 24.2 -62.8 -28.7 29.0 2.4 37.1 43 51 A S E > S-B 46 0A 29 3,-1.2 3,-3.1 -3,-0.2 -1,-0.1 -0.980 112.7 -77.7-133.8 143.7 31.5 0.8 34.8 44 52 A P T 3 S- 0 0 103 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.156 117.6 -1.5 -46.6 126.8 33.7 2.6 32.2 45 53 A A T 3 S+ 0 0 54 1,-0.2 2,-0.5 -4,-0.1 15,-0.5 0.477 112.1 107.7 69.1 3.9 31.5 3.5 29.1 46 54 A H E < -B 43 0A 22 -3,-3.1 -3,-1.2 13,-0.1 2,-0.5 -0.957 52.2-163.9-116.6 122.3 28.5 1.7 30.7 47 55 A W E - C 0 58A 18 11,-3.3 11,-2.6 -2,-0.5 2,-0.4 -0.898 3.8-169.4-111.2 127.0 25.7 3.9 32.1 48 56 A S E +BC 40 57A 3 -8,-3.1 -8,-2.1 -2,-0.5 2,-0.3 -0.907 24.7 120.1-117.3 141.4 23.0 2.6 34.4 49 57 A G E - C 0 56A 0 7,-2.0 7,-2.6 -2,-0.4 2,-0.5 -0.970 61.0 -69.0-175.9 178.9 19.8 4.2 35.5 50 58 A V E + C 0 55A 13 -12,-0.5 2,-0.4 -2,-0.3 5,-0.2 -0.774 45.0 174.3 -92.9 127.1 16.0 3.9 35.5 51 59 A L E > S- C 0 54A 4 3,-3.2 3,-1.0 -2,-0.5 35,-0.1 -0.982 70.1 -12.5-135.6 119.6 14.2 4.2 32.2 52 60 A A T 3 S- 0 0 63 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.944 129.7 -51.0 54.5 52.8 10.5 3.6 31.8 53 61 A D T 3 S+ 0 0 135 1,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.528 123.0 86.5 66.0 11.7 10.2 2.1 35.3 54 62 A Q E < S-C 51 0A 52 -3,-1.0 -3,-3.2 17,-0.0 2,-0.3 -0.945 79.9-107.8-136.5 157.8 13.0 -0.4 35.0 55 63 A V E +CD 50 70A 1 15,-1.0 15,-2.4 -2,-0.3 2,-0.3 -0.677 40.4 178.6 -87.4 140.2 16.8 -0.4 35.5 56 64 A W E -CD 49 69A 1 -7,-2.6 -7,-2.0 -2,-0.3 2,-0.4 -0.948 22.7-149.3-137.1 156.7 18.9 -0.4 32.3 57 65 A T E -CD 48 68A 0 11,-1.9 11,-1.6 -2,-0.3 2,-0.4 -0.987 21.4-167.3-125.6 137.3 22.6 -0.3 31.5 58 66 A L E +CD 47 67A 0 -11,-2.6 -11,-3.3 -2,-0.4 2,-0.3 -0.970 14.9 159.8-130.5 145.4 23.6 1.3 28.2 59 67 A T E - D 0 66A 7 7,-1.9 7,-2.7 -2,-0.4 2,-0.4 -0.982 20.4-143.2-156.9 152.4 26.8 1.4 26.3 60 68 A Q E - D 0 65A 32 -15,-0.5 2,-0.2 -2,-0.3 5,-0.2 -0.927 14.3-175.9-132.2 154.8 27.8 2.1 22.7 61 69 A T E > - D 0 64A 59 3,-2.8 3,-0.8 -2,-0.4 2,-0.2 -0.611 61.1 -60.2-121.0-177.4 30.1 1.0 20.0 62 70 A E T 3 S- 0 0 110 1,-0.3 -1,-0.1 -2,-0.2 3,-0.0 -0.515 125.9 -0.1 -69.9 136.3 30.3 2.7 16.6 63 71 A E T 3 S+ 0 0 109 -2,-0.2 -43,-2.6 -43,-0.1 2,-0.4 0.328 121.7 89.5 71.1 -11.9 27.0 2.5 14.9 64 72 A Q E < -AD 19 61A 56 -3,-0.8 -3,-2.8 -45,-0.2 2,-0.7 -0.965 52.9-166.4-131.3 133.0 25.5 0.6 17.8 65 73 A L E -AD 18 60A 0 -47,-2.1 -47,-1.2 -2,-0.4 2,-0.4 -0.931 25.2-153.6-108.9 105.9 23.7 1.5 21.1 66 74 A H E -AD 17 59A 25 -7,-2.7 -7,-1.9 -2,-0.7 2,-0.4 -0.683 12.6-169.4 -85.9 134.0 23.7 -1.7 23.2 67 75 A C E +AD 16 58A 0 -51,-3.5 -51,-2.6 -2,-0.4 2,-0.3 -0.949 12.9 177.1-128.3 144.4 21.0 -2.1 25.8 68 76 A T E - D 0 57A 0 -11,-1.6 -11,-1.9 -2,-0.4 2,-0.4 -0.995 13.6-154.4-142.6 141.3 20.4 -4.5 28.7 69 77 A V E - D 0 56A 2 -55,-0.4 2,-0.6 7,-0.4 7,-0.3 -0.930 10.0-151.6-124.8 145.3 17.5 -4.5 31.2 70 78 A Y E D 0 55A 19 -15,-2.4 -15,-1.0 -2,-0.4 5,-0.0 -0.932 360.0 360.0-113.6 106.4 17.1 -5.8 34.8 71 79 A R 0 0 111 -2,-0.6 -17,-0.0 -17,-0.1 4,-0.0 -0.206 360.0 360.0 -92.2 360.0 13.4 -6.7 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 0 173 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 -10.2 12.0 -13.3 36.1 74 84 A Q - 0 0 106 1,-0.1 2,-0.1 0, 0.0 -3,-0.1 -0.574 360.0-102.5 -76.7 137.8 14.8 -15.1 34.3 75 85 A A + 0 0 61 -2,-0.3 2,-0.3 -5,-0.0 -1,-0.1 -0.399 57.2 153.2 -63.3 130.4 17.5 -12.8 32.9 76 86 A S - 0 0 54 -7,-0.3 -7,-0.4 -2,-0.1 -62,-0.1 -0.984 47.5 -80.6-155.5 159.1 17.1 -12.2 29.1 77 87 A R - 0 0 35 -64,-0.5 -62,-0.2 -2,-0.3 -9,-0.1 -0.161 61.9 -87.2 -58.0 154.7 18.0 -9.7 26.4 78 88 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 -61,-0.1 -0.310 44.8-123.7 -63.8 149.9 15.6 -6.7 26.1 79 89 A T > - 0 0 58 -3,-0.1 4,-3.2 1,-0.1 5,-0.2 -0.488 24.9-103.1 -91.8 165.4 12.6 -7.2 23.8 80 90 A P H > S+ 0 0 104 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.853 122.9 50.4 -54.7 -38.2 11.6 -5.0 20.8 81 91 A D H > S+ 0 0 137 2,-0.2 4,-1.3 1,-0.2 3,-0.0 0.960 113.0 44.3 -65.3 -51.1 8.9 -3.3 22.8 82 92 A E H >> S+ 0 0 31 1,-0.2 4,-1.2 2,-0.2 3,-0.5 0.907 113.0 52.8 -58.6 -42.6 11.2 -2.5 25.7 83 93 A L H 3X S+ 0 0 23 -4,-3.2 4,-2.3 1,-0.3 3,-0.3 0.872 102.3 59.1 -60.9 -37.1 13.8 -1.5 23.2 84 94 A E H 3X S+ 0 0 105 -4,-1.9 4,-2.3 1,-0.2 -1,-0.3 0.843 99.3 58.6 -61.3 -33.0 11.2 0.9 21.7 85 95 A A H S+ 0 0 66 -4,-2.3 5,-2.1 1,-0.2 6,-0.2 0.903 111.1 47.3 -53.4 -44.7 14.3 4.7 21.3 88 98 A K H ><5S+ 0 0 89 -4,-2.3 3,-1.5 1,-0.2 -1,-0.2 0.910 107.4 55.2 -65.3 -42.6 11.5 7.0 22.6 89 99 A Y H 3<5S+ 0 0 13 -4,-2.2 35,-2.9 1,-0.3 -1,-0.2 0.881 115.1 39.6 -58.4 -39.7 13.5 8.2 25.6 90 100 A F T 3<5S- 0 0 1 -4,-2.1 -1,-0.3 33,-0.2 -2,-0.2 0.288 105.7-131.9 -92.5 9.3 16.4 9.3 23.3 91 101 A Q T X 5 + 0 0 33 -3,-1.5 3,-1.9 -5,-0.2 -3,-0.2 0.852 37.3 175.0 40.2 49.4 13.9 10.6 20.7 92 102 A L T 3 < + 0 0 21 -5,-2.1 -1,-0.2 1,-0.3 -4,-0.1 0.525 65.6 72.8 -62.8 -8.2 15.8 8.8 18.0 93 103 A D T 3 S+ 0 0 138 -6,-0.2 2,-0.6 -5,-0.1 -1,-0.3 0.795 80.0 84.6 -75.8 -27.0 13.3 9.7 15.3 94 104 A V S < S- 0 0 28 -3,-1.9 2,-0.9 -4,-0.1 -1,-0.0 -0.667 85.4-135.8 -76.6 115.8 14.7 13.2 15.5 95 105 A T >> - 0 0 69 -2,-0.6 4,-1.5 1,-0.2 3,-0.6 -0.640 16.8-167.7 -79.6 105.9 17.7 13.2 13.2 96 106 A L H 3> S+ 0 0 0 -2,-0.9 4,-2.9 1,-0.2 5,-0.2 0.844 84.7 60.0 -62.7 -34.7 20.5 15.0 14.9 97 107 A A H 3> S+ 0 0 54 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.850 105.4 49.7 -62.4 -33.9 22.7 15.2 11.7 98 108 A Q H <> S+ 0 0 132 -3,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.880 113.0 46.1 -71.4 -40.3 19.9 17.2 10.0 99 109 A L H X S+ 0 0 25 -4,-1.5 4,-3.1 2,-0.2 5,-0.3 0.924 111.5 50.2 -69.0 -45.3 19.6 19.6 12.9 100 110 A Y H X S+ 0 0 29 -4,-2.9 4,-3.1 2,-0.2 5,-0.2 0.921 109.8 52.7 -58.3 -45.3 23.4 20.1 13.3 101 111 A H H X S+ 0 0 132 -4,-1.8 4,-1.6 -5,-0.2 -1,-0.2 0.968 112.7 43.7 -54.0 -56.6 23.6 20.8 9.6 102 112 A H H X S+ 0 0 82 -4,-2.0 4,-1.4 1,-0.2 3,-0.4 0.929 115.7 46.3 -56.8 -50.8 20.9 23.4 9.8 103 113 A W H X S+ 0 0 1 -4,-3.1 4,-1.3 1,-0.2 3,-0.3 0.915 112.9 51.6 -60.1 -41.3 22.2 25.1 12.9 104 114 A G H < S+ 0 0 3 -4,-3.1 7,-0.3 -5,-0.3 -1,-0.2 0.761 106.4 54.4 -67.3 -24.6 25.7 25.1 11.5 105 115 A S H < S+ 0 0 79 -4,-1.6 -1,-0.2 -3,-0.4 -2,-0.2 0.796 116.3 35.8 -80.4 -27.5 24.6 26.7 8.3 106 116 A V H < S+ 0 0 66 -4,-1.4 2,-0.3 -3,-0.3 -2,-0.2 0.527 122.0 45.9-100.8 -7.9 22.9 29.7 10.1 107 117 A D X - 0 0 9 -4,-1.3 4,-2.4 -5,-0.2 -1,-0.2 -0.809 59.3-169.4-142.1 97.6 25.5 30.0 12.9 108 118 A S H > S+ 0 0 92 -2,-0.3 4,-1.5 1,-0.2 -1,-0.1 0.802 91.7 52.1 -54.8 -35.2 29.2 29.9 12.1 109 119 A H H > S+ 0 0 39 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.939 107.7 51.3 -69.1 -44.1 30.1 29.6 15.8 110 120 A F H > S+ 0 0 0 1,-0.2 4,-3.4 -7,-0.2 5,-0.2 0.931 105.9 56.7 -56.8 -44.3 27.8 26.7 16.3 111 121 A Q H X S+ 0 0 96 -4,-2.4 4,-1.2 -7,-0.3 -1,-0.2 0.892 107.2 48.7 -53.6 -42.9 29.4 25.0 13.3 112 122 A E H X S+ 0 0 138 -4,-1.5 4,-0.7 -3,-0.2 3,-0.5 0.959 115.7 41.4 -63.0 -52.0 32.8 25.2 15.0 113 123 A V H >X S+ 0 0 27 -4,-2.3 3,-1.2 1,-0.2 4,-1.2 0.924 108.4 60.5 -62.0 -45.9 31.6 23.8 18.3 114 124 A A H 3< S+ 0 0 8 -4,-3.4 -1,-0.2 1,-0.3 3,-0.2 0.806 93.6 67.3 -51.8 -34.4 29.4 21.1 16.7 115 125 A Q H 3< S+ 0 0 135 -4,-1.2 3,-0.3 -3,-0.5 -1,-0.3 0.896 109.5 34.0 -54.3 -44.9 32.6 19.7 15.0 116 126 A K H << S+ 0 0 68 -3,-1.2 -1,-0.2 -4,-0.7 -2,-0.2 0.583 120.8 48.8 -89.9 -12.2 34.0 18.6 18.4 117 127 A F < + 0 0 24 -4,-1.2 3,-0.5 -3,-0.2 -1,-0.2 -0.536 68.6 161.9-131.6 71.8 30.8 17.7 20.1 118 128 A Q + 0 0 98 -3,-0.3 -94,-0.1 -2,-0.2 3,-0.1 -0.394 55.8 40.2 -81.6 163.1 28.6 15.5 18.0 119 129 A G + 0 0 0 -96,-1.0 -93,-2.2 1,-0.2 2,-0.8 0.621 66.7 142.1 76.7 13.9 25.7 13.4 19.4 120 130 A V + 0 0 1 -3,-0.5 2,-0.3 -95,-0.2 -1,-0.2 -0.811 24.8 153.7 -90.6 113.2 24.2 15.9 21.9 121 131 A R - 0 0 0 -2,-0.8 2,-0.4 -95,-0.2 -30,-0.1 -0.790 44.2 -92.1-130.8 174.1 20.5 15.4 21.8 122 132 A L - 0 0 1 -2,-0.3 2,-0.2 -31,-0.1 181,-0.1 -0.773 28.0-137.3 -96.7 132.3 17.5 15.9 24.1 123 133 A L - 0 0 0 -2,-0.4 2,-0.9 -93,-0.1 -33,-0.2 -0.547 17.8-130.5 -77.6 147.2 16.1 13.1 26.3 124 134 A R - 0 0 50 -35,-2.9 124,-0.2 -2,-0.2 2,-0.2 -0.884 39.6-167.7-100.8 102.8 12.3 13.0 26.4 125 135 A Q - 0 0 2 122,-3.1 -89,-0.0 -2,-0.9 -3,-0.0 -0.540 27.1 -97.3 -98.4 160.8 11.7 12.9 30.1 126 136 A D > - 0 0 80 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.520 34.7-130.2 -69.5 130.7 8.8 12.1 32.4 127 137 A P H > S+ 0 0 4 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.879 102.3 48.8 -50.5 -49.0 7.1 15.4 33.5 128 138 A I H > S+ 0 0 11 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.959 114.1 44.1 -59.8 -53.3 7.0 14.7 37.2 129 139 A E H > S+ 0 0 21 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.910 116.7 48.6 -58.7 -40.8 10.7 13.6 37.5 130 140 A C H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.952 110.8 49.7 -65.1 -49.3 11.7 16.6 35.3 131 141 A L H X S+ 0 0 0 -4,-3.2 4,-1.1 -5,-0.2 -2,-0.2 0.931 117.0 38.5 -56.1 -51.7 9.7 19.1 37.3 132 142 A F H X S+ 0 0 0 -4,-2.4 4,-1.1 -5,-0.2 -1,-0.2 0.844 112.8 56.2 -74.1 -30.7 11.0 18.1 40.7 133 143 A S H >< S+ 0 0 3 -4,-2.1 3,-0.5 -5,-0.3 4,-0.3 0.949 111.6 43.7 -64.7 -45.0 14.5 17.5 39.6 134 144 A F H 3< S+ 0 0 9 -4,-2.5 4,-0.4 1,-0.2 3,-0.4 0.716 101.9 64.7 -75.9 -16.7 14.8 21.0 38.2 135 145 A I H >< S+ 0 0 1 -4,-1.1 3,-0.7 1,-0.2 -1,-0.2 0.851 105.4 49.2 -67.4 -31.3 13.1 22.5 41.2 136 146 A C T << S+ 0 0 0 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.599 93.1 76.3 -80.6 -11.9 16.2 21.2 43.0 137 147 A S T > + 0 0 15 -3,-0.4 3,-1.4 -4,-0.3 -1,-0.2 0.671 65.1 124.5 -73.5 -16.3 18.5 22.7 40.3 138 148 A S T < S- 0 0 39 -3,-0.7 3,-0.1 -4,-0.4 56,-0.1 -0.196 93.1 -17.9 -47.3 125.7 18.0 26.2 41.9 139 149 A C T 3 S+ 0 0 110 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.875 116.2 120.9 36.2 57.7 21.4 27.7 42.7 140 150 A N < - 0 0 32 -3,-1.4 2,-0.3 4,-0.0 -1,-0.2 -0.947 60.0-125.2-144.6 161.0 23.0 24.3 42.5 141 151 A N > - 0 0 89 -2,-0.3 4,-3.1 -3,-0.1 5,-0.3 -0.792 33.6-108.3-109.1 153.9 25.6 22.3 40.6 142 152 A I H > S+ 0 0 45 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.872 117.0 50.0 -46.9 -48.1 25.1 19.1 38.7 143 153 A A H > S+ 0 0 72 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.936 115.0 42.9 -60.5 -46.6 26.9 16.9 41.2 144 154 A R H > S+ 0 0 106 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.915 113.0 52.7 -65.8 -43.0 25.0 18.3 44.2 145 155 A I H X S+ 0 0 8 -4,-3.1 4,-2.7 1,-0.2 5,-0.2 0.929 106.9 53.8 -56.3 -45.5 21.7 18.2 42.3 146 156 A T H X S+ 0 0 14 -4,-2.6 4,-2.2 -5,-0.3 -1,-0.2 0.880 108.2 50.3 -58.1 -38.9 22.4 14.5 41.5 147 157 A G H X S+ 0 0 11 -4,-1.6 4,-2.4 2,-0.2 5,-0.2 0.946 110.5 48.1 -64.7 -48.9 22.9 13.9 45.2 148 158 A M H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.919 113.2 48.5 -57.5 -46.9 19.7 15.5 46.3 149 159 A V H X S+ 0 0 2 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.898 111.0 48.6 -62.8 -44.0 17.7 13.6 43.6 150 160 A E H X S+ 0 0 63 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.919 113.4 47.5 -63.5 -41.4 19.1 10.2 44.5 151 161 A R H X S+ 0 0 90 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.871 111.4 52.3 -66.8 -36.1 18.5 10.8 48.2 152 162 A L H X S+ 0 0 2 -4,-2.2 4,-2.5 -5,-0.2 5,-0.3 0.924 112.3 43.4 -65.4 -46.8 14.9 12.0 47.3 153 163 A C H X S+ 0 0 2 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.868 111.8 55.1 -67.6 -36.6 14.1 8.9 45.3 154 164 A Q H < S+ 0 0 124 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.942 115.0 39.0 -60.1 -48.2 15.7 6.6 47.9 155 165 A A H < S+ 0 0 41 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.832 134.4 16.9 -73.5 -37.5 13.5 8.1 50.6 156 166 A F H < S+ 0 0 44 -4,-2.5 17,-0.5 -5,-0.2 -3,-0.2 0.456 104.2 88.3-120.0 0.0 10.2 8.4 48.7 157 167 A G S < S- 0 0 12 -4,-2.5 14,-0.1 -5,-0.3 2,-0.1 -0.693 81.9 -93.6-102.7 156.7 10.4 6.3 45.6 158 168 A P - 0 0 82 0, 0.0 12,-2.7 0, 0.0 2,-0.3 -0.371 41.3-115.1 -65.5 138.3 9.5 2.6 45.0 159 169 A R E +E 169 0B 145 10,-0.2 10,-0.2 1,-0.2 3,-0.1 -0.583 37.2 175.4 -74.1 130.4 12.4 0.2 45.4 160 170 A L E - 0 0 48 8,-3.3 2,-0.3 1,-0.4 -1,-0.2 0.826 50.1 -41.3-100.2 -79.5 13.2 -1.5 42.1 161 171 A I E - 0 0 36 7,-0.4 7,-2.9 2,-0.0 2,-0.4 -0.953 46.8-122.8-149.3 166.6 16.2 -3.8 42.2 162 172 A Q E -E 167 0B 109 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.945 18.2-174.5-117.8 135.9 19.7 -3.8 43.7 163 173 A L E > -E 166 0B 18 3,-2.7 3,-2.6 -2,-0.4 -158,-0.1 -0.997 69.8 -37.1-129.6 123.4 23.0 -4.3 41.7 164 174 A D T 3 S- 0 0 96 -2,-0.4 -160,-0.1 1,-0.3 -2,-0.0 -0.418 127.5 -28.8 56.3-134.1 26.1 -4.6 43.7 165 175 A D T 3 S+ 0 0 145 -3,-0.1 2,-0.5 2,-0.0 -1,-0.3 0.144 118.0 104.4 -97.1 21.7 25.6 -2.2 46.6 166 176 A V E < -E 163 0B 34 -3,-2.6 -3,-2.7 2,-0.0 2,-0.6 -0.895 51.6-164.2-108.3 123.6 23.3 0.1 44.6 167 177 A T E -E 162 0B 52 -2,-0.5 2,-0.3 -5,-0.2 -5,-0.2 -0.922 13.6-147.1-106.5 120.3 19.5 0.1 45.1 168 178 A Y E - 0 0 20 -7,-2.9 -8,-3.3 -2,-0.6 -7,-0.4 -0.663 13.7-168.1 -88.0 141.4 17.5 1.7 42.3 169 179 A H E -E 159 0B 26 -2,-0.3 -10,-0.2 -10,-0.2 -119,-0.1 -0.945 21.4-121.7-126.2 147.1 14.3 3.5 43.1 170 180 A G - 0 0 6 -12,-2.7 -14,-0.1 -2,-0.3 3,-0.1 -0.369 49.5 -84.7 -76.6 167.7 11.6 4.8 40.7 171 181 A F - 0 0 31 -14,-0.1 -1,-0.1 1,-0.1 -42,-0.1 -0.548 56.5 -99.3 -73.9 141.5 10.9 8.5 41.0 172 182 A P - 0 0 2 0, 0.0 -15,-0.2 0, 0.0 -1,-0.1 -0.137 36.6-115.5 -58.8 155.1 8.4 9.3 43.7 173 183 A S > - 0 0 59 -17,-0.5 4,-2.3 1,-0.1 5,-0.2 -0.346 24.9-107.7 -84.5 171.3 4.8 9.9 42.9 174 184 A L H > S+ 0 0 5 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.917 120.5 54.3 -63.9 -44.7 2.9 13.2 43.4 175 185 A Q H 4 S+ 0 0 125 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.920 109.7 47.0 -57.2 -45.0 1.0 11.6 46.4 176 186 A A H >4 S+ 0 0 32 1,-0.2 3,-1.3 2,-0.2 -1,-0.2 0.930 112.9 47.4 -64.4 -45.6 4.3 10.7 48.1 177 187 A L H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.3 26,-0.2 0.772 111.5 52.9 -67.4 -24.3 5.9 14.1 47.5 178 188 A A T 3< S+ 0 0 18 -4,-2.0 -1,-0.3 24,-0.2 -2,-0.2 0.482 89.5 118.7 -88.3 -3.0 2.7 15.7 48.8 179 189 A G S X S- 0 0 16 -3,-1.3 3,-1.1 -4,-0.4 4,-0.3 0.037 74.3 -77.9 -61.3 168.4 2.8 13.7 52.0 180 190 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.396 110.0 4.9 -69.8 141.7 3.1 14.9 55.6 181 191 A E T 3> S+ 0 0 163 -3,-0.1 4,-2.0 -2,-0.1 5,-0.2 0.626 85.9 130.1 62.1 14.1 6.4 16.0 56.9 182 192 A V H <> + 0 0 2 -3,-1.1 4,-3.2 2,-0.2 5,-0.3 0.945 69.7 53.8 -62.6 -46.7 8.1 15.5 53.5 183 193 A E H > S+ 0 0 60 -4,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.934 109.4 48.1 -52.3 -50.2 9.7 18.9 53.7 184 194 A A H > S+ 0 0 54 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.895 113.0 47.4 -59.6 -42.1 11.3 18.2 57.0 185 195 A H H X S+ 0 0 81 -4,-2.0 4,-0.9 1,-0.2 3,-0.2 0.918 111.5 50.7 -67.6 -40.9 12.6 14.8 55.8 186 196 A L H ><>S+ 0 0 0 -4,-3.2 5,-1.9 1,-0.2 3,-0.5 0.864 104.9 57.5 -64.0 -35.3 14.0 16.4 52.6 187 197 A R H ><5S+ 0 0 109 -4,-2.4 3,-1.2 -5,-0.3 5,-0.4 0.867 104.4 52.1 -63.8 -33.0 15.7 19.0 54.7 188 198 A K H 3<5S+ 0 0 188 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.737 103.6 58.1 -73.7 -20.3 17.5 16.2 56.6 189 199 A L T <<5S- 0 0 34 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.358 124.6-105.5 -88.6 5.7 18.5 14.9 53.2 190 200 A G T < 5S+ 0 0 39 -3,-1.2 -3,-0.2 -4,-0.1 -2,-0.1 0.673 80.2 131.0 83.2 19.7 20.2 18.2 52.5 191 201 A L > < - 0 0 0 -5,-1.9 3,-1.7 1,-0.2 -4,-0.2 0.590 44.6-167.3 -79.5 -8.5 17.9 19.8 50.0 192 202 A G T > - 0 0 31 -5,-0.4 3,-2.4 -6,-0.3 4,-0.4 -0.214 65.4 -9.6 56.9-147.5 17.8 23.1 52.0 193 203 A Y T >> S+ 0 0 91 1,-0.3 4,-0.9 2,-0.2 3,-0.8 0.666 126.2 75.1 -56.2 -18.7 15.1 25.5 51.0 194 204 A R H <> S+ 0 0 9 -3,-1.7 4,-2.0 1,-0.2 -1,-0.3 0.789 80.7 71.5 -66.2 -25.6 14.3 23.4 48.0 195 205 A A H <> S+ 0 0 0 -3,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.887 94.7 53.7 -56.2 -40.2 12.6 21.0 50.3 196 206 A R H <> S+ 0 0 108 -3,-0.8 4,-3.2 -4,-0.4 -1,-0.2 0.923 107.8 48.9 -62.4 -44.9 9.8 23.5 50.7 197 207 A Y H X S+ 0 0 62 -4,-0.9 4,-3.0 2,-0.2 5,-0.3 0.840 108.4 53.1 -66.2 -34.0 9.2 23.9 47.0 198 208 A V H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.969 116.2 39.2 -64.3 -51.9 9.1 20.1 46.4 199 209 A S H X S+ 0 0 5 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.969 119.4 47.3 -60.2 -54.6 6.4 19.7 49.1 200 210 A A H X S+ 0 0 31 -4,-3.2 4,-2.8 1,-0.2 -2,-0.2 0.904 114.0 46.0 -56.1 -47.3 4.6 22.9 48.1 201 211 A S H X S+ 0 0 0 -4,-3.0 4,-2.2 -5,-0.2 -1,-0.2 0.848 110.8 53.4 -67.8 -32.5 4.6 22.1 44.4 202 212 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.3 5,-0.2 0.965 114.7 40.4 -65.5 -49.2 3.5 18.6 45.0 203 213 A R H X S+ 0 0 95 -4,-2.6 4,-3.2 -26,-0.2 5,-0.2 0.900 111.8 57.7 -65.6 -38.4 0.5 19.7 47.0 204 214 A A H X>S+ 0 0 9 -4,-2.8 5,-1.5 -5,-0.3 4,-1.1 0.935 109.8 44.0 -57.2 -47.4 -0.2 22.6 44.7 205 215 A I H <5S+ 0 0 0 -4,-2.2 6,-3.0 3,-0.2 5,-0.4 0.914 120.4 39.1 -64.2 -46.1 -0.6 20.3 41.7 206 216 A L H <5S+ 0 0 54 -4,-2.1 4,-0.2 4,-0.2 -2,-0.2 0.915 125.9 33.4 -73.1 -44.1 -2.7 17.7 43.5 207 217 A E H <5S+ 0 0 153 -4,-3.2 -1,-0.2 -5,-0.2 -2,-0.2 0.350 134.1 18.1 -98.1 6.0 -4.9 20.0 45.6 208 218 A E T <5S+ 0 0 144 -4,-1.1 -3,-0.2 -5,-0.2 -2,-0.1 0.560 120.6 46.3-141.3 -38.4 -5.2 23.0 43.2 209 219 A Q S > S- 0 0 7 -6,-3.0 3,-1.7 1,-0.2 4,-0.8 -0.254 74.4 -23.2 87.8-174.1 -3.5 16.6 39.6 212 222 A L H >> S+ 0 0 72 1,-0.3 4,-2.3 2,-0.2 3,-1.0 0.813 127.4 64.3 -41.6 -45.0 -1.1 14.7 37.4 213 223 A A H 3> S+ 0 0 62 -3,-0.4 4,-2.3 1,-0.3 -1,-0.3 0.874 96.3 58.1 -50.8 -42.8 -3.4 15.1 34.4 214 224 A W H <4 S+ 0 0 38 -3,-1.7 -1,-0.3 1,-0.2 4,-0.2 0.857 110.8 42.7 -56.5 -38.2 -3.0 18.8 34.5 215 225 A L H X< S+ 0 0 0 -3,-1.0 3,-1.5 -4,-0.8 -2,-0.2 0.955 113.9 48.1 -75.3 -51.2 0.8 18.4 34.1 216 226 A Q H >< S+ 0 0 87 -4,-2.3 3,-1.8 1,-0.3 4,-0.2 0.830 103.3 60.4 -60.8 -37.3 0.8 15.7 31.4 217 227 A Q G >X S+ 0 0 80 -4,-2.3 3,-1.5 1,-0.3 4,-0.6 0.617 84.3 81.1 -68.7 -9.7 -1.7 17.4 29.1 218 228 A L G <4 S+ 0 0 5 -3,-1.5 -1,-0.3 1,-0.3 8,-0.2 0.703 77.5 72.0 -67.5 -17.2 0.7 20.3 28.9 219 229 A R G <4 S+ 0 0 53 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.782 99.9 44.1 -67.5 -27.1 2.5 18.2 26.3 220 230 A E T <4 S+ 0 0 153 -3,-1.5 -1,-0.2 -4,-0.2 -2,-0.2 0.586 102.3 88.0 -91.5 -14.0 -0.4 19.0 23.9 221 231 A S S < S- 0 0 32 -4,-0.6 2,-0.1 -3,-0.2 -3,-0.0 -0.288 88.4 -94.1 -79.1 168.8 -0.5 22.6 24.9 222 232 A S > - 0 0 48 1,-0.1 4,-3.5 -2,-0.1 5,-0.2 -0.465 33.7-110.0 -81.6 157.2 1.6 25.4 23.2 223 233 A Y H > S+ 0 0 20 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.916 121.2 51.3 -51.1 -48.6 5.0 26.4 24.6 224 234 A E H > S+ 0 0 123 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.925 114.7 43.5 -54.4 -49.0 3.5 29.8 25.7 225 235 A E H > S+ 0 0 122 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.975 116.3 45.9 -60.2 -59.3 0.7 28.0 27.4 226 236 A A H X S+ 0 0 0 -4,-3.5 4,-2.7 1,-0.2 5,-0.2 0.914 112.4 49.6 -52.1 -52.5 2.9 25.3 29.0 227 237 A H H X S+ 0 0 27 -4,-3.3 4,-1.5 -5,-0.2 -1,-0.2 0.861 112.8 48.0 -58.7 -38.1 5.6 27.7 30.2 228 238 A K H < S+ 0 0 82 -4,-1.7 4,-0.4 -5,-0.3 -2,-0.2 0.951 111.5 49.3 -68.2 -49.4 2.9 30.0 31.8 229 239 A A H >X S+ 0 0 16 -4,-2.8 3,-1.8 1,-0.2 4,-0.6 0.937 110.1 51.7 -54.8 -49.6 1.1 27.1 33.6 230 240 A L H >< S+ 0 0 0 -4,-2.7 3,-0.9 1,-0.3 -1,-0.2 0.844 100.1 61.7 -57.5 -38.6 4.4 25.8 35.0 231 241 A C T 3< S+ 0 0 47 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.586 89.9 72.8 -67.0 -7.8 5.4 29.1 36.4 232 242 A I T <4 S+ 0 0 97 -3,-1.8 -1,-0.2 -4,-0.4 -2,-0.2 0.921 80.6 88.6 -69.5 -43.1 2.3 28.9 38.6 233 243 A L S X< S- 0 0 3 -3,-0.9 3,-1.7 -4,-0.6 2,-0.1 -0.228 92.5 -99.6 -59.7 140.9 3.9 26.2 40.8 234 244 A P T 3 S+ 0 0 45 0, 0.0 -33,-0.2 0, 0.0 -1,-0.1 -0.396 107.7 17.8 -63.3 128.5 6.0 27.3 43.8 235 245 A G T 3 S+ 0 0 29 1,-0.2 2,-0.7 -2,-0.1 -97,-0.1 0.371 96.9 116.3 90.7 -4.8 9.7 27.2 43.1 236 246 A V < + 0 0 10 -3,-1.7 -1,-0.2 -6,-0.1 2,-0.1 -0.861 36.8 164.8-104.5 107.5 9.2 27.2 39.4 237 247 A G > - 0 0 39 -2,-0.7 4,-2.3 -3,-0.1 5,-0.2 -0.230 55.6 -76.1-102.5-165.1 10.6 30.3 37.6 238 248 A T H > S+ 0 0 76 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.896 128.3 47.6 -64.2 -41.9 11.3 31.0 34.0 239 249 A Q H > S+ 0 0 77 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.948 115.3 43.6 -65.7 -49.5 14.6 29.0 33.8 240 250 A V H > S+ 0 0 12 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.908 113.5 52.5 -62.1 -41.4 13.1 25.9 35.5 241 251 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.887 109.1 49.7 -62.7 -39.1 9.9 26.2 33.5 242 252 A D H X S+ 0 0 18 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.894 107.6 53.4 -68.1 -38.7 12.0 26.3 30.3 243 253 A C H X S+ 0 0 8 -4,-2.1 4,-3.0 1,-0.2 5,-0.3 0.939 112.0 46.4 -59.5 -45.4 14.0 23.2 31.2 244 254 A I H X>S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 5,-1.8 0.917 112.0 49.2 -63.7 -46.1 10.8 21.3 31.8 245 255 A C H <5S+ 0 0 0 -4,-2.5 6,-2.4 3,-0.2 4,-0.3 0.950 118.0 40.9 -58.1 -50.0 9.2 22.5 28.5 246 256 A L H <5S+ 0 0 3 -4,-2.6 -2,-0.2 4,-0.2 -1,-0.2 0.912 125.6 32.9 -64.0 -47.0 12.2 21.6 26.5 247 257 A M H <5S+ 0 0 11 -4,-3.0 -122,-3.1 -5,-0.3 -2,-0.2 0.680 136.2 12.2 -91.8 -17.6 13.1 18.3 28.3 248 258 A A T <5S+ 0 0 0 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.1 0.650 120.4 53.3-130.0 -28.0 9.7 16.9 29.2 249 259 A L S + 0 0 9 -6,-2.4 3,-2.0 -7,-0.2 -1,-0.2 -0.738 21.5 176.8-108.3 81.3 8.7 22.2 23.4 252 262 A P T 3 S+ 0 0 27 0, 0.0 50,-2.3 0, 0.0 51,-0.8 0.613 77.4 59.0 -61.6 -9.5 11.9 22.1 21.3 253 263 A Q T 3 S+ 0 0 52 48,-0.2 2,-0.3 47,-0.2 47,-0.1 0.525 77.4 110.8 -95.4 -8.3 11.9 25.9 21.0 254 264 A A < - 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0 0 128 -2,-0.2 8,-0.1 -3,-0.1 7,-0.1 -0.978 41.4 -92.3-146.5 150.8 24.0 42.5 24.8 273 283 A P - 0 0 27 0, 0.0 12,-0.1 0, 0.0 13,-0.0 -0.398 35.7-174.0 -63.9 143.5 20.4 43.3 25.8 274 284 A T S S+ 0 0 111 11,-0.1 11,-0.0 -2,-0.0 3,-0.0 0.499 80.7 17.3-118.3 -9.3 18.8 45.7 23.3 275 285 A T S S+ 0 0 117 9,-0.1 2,-0.1 10,-0.0 10,-0.1 0.450 103.7 93.6-135.9 -15.8 15.4 46.4 24.9 276 286 A S - 0 0 18 1,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.446 67.3-138.1 -81.2 157.2 16.0 45.4 28.5 277 287 A Q S S+ 0 0 89 -2,-0.1 -1,-0.1 -3,-0.0 5,-0.0 0.951 77.9 72.4 -79.2 -55.3 17.1 47.9 31.1 278 288 A A - 0 0 40 1,-0.1 4,-0.1 2,-0.1 -2,-0.1 -0.069 67.9-144.8 -60.0 161.3 19.6 45.9 33.1 279 289 A K S S+ 0 0 83 2,-0.1 -1,-0.1 -7,-0.1 3,-0.1 0.738 81.6 39.6 -98.0 -31.0 23.0 45.0 31.8 280 290 A G S S- 0 0 29 1,-0.2 5,-0.2 -8,-0.1 6,-0.1 -0.292 112.0 -37.9-106.5-168.0 23.3 41.6 33.4 281 291 A P S S+ 0 0 82 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.278 72.0 137.9 -56.5 130.7 20.9 38.7 34.0 282 292 A S > - 0 0 21 -4,-0.1 4,-3.3 -3,-0.1 5,-0.4 -0.946 68.5 -92.3-164.3 161.1 17.4 39.8 35.0 283 293 A P H > S+ 0 0 104 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.864 126.1 46.9 -53.1 -35.7 13.9 38.6 34.0 284 294 A Q H > S+ 0 0 112 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.960 117.2 40.5 -69.6 -53.0 13.8 41.2 31.2 285 295 A T H > S+ 0 0 0 -5,-0.2 4,-3.1 2,-0.2 5,-0.2 0.859 113.4 54.4 -65.5 -36.8 17.2 40.4 29.8 286 296 A N H X S+ 0 0 34 -4,-3.3 4,-2.3 2,-0.2 -1,-0.2 0.931 109.8 47.3 -62.9 -44.9 16.8 36.6 30.3 287 297 A K H X S+ 0 0 73 -4,-1.6 4,-1.9 -5,-0.4 -2,-0.2 0.926 112.9 50.1 -61.2 -43.7 13.6 36.7 28.3 288 298 A E H X S+ 0 0 24 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.933 109.3 49.9 -60.8 -46.9 15.4 38.8 25.6 289 299 A L H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 5,-0.2 0.898 108.0 55.5 -59.6 -40.2 18.4 36.4 25.4 290 300 A G H X S+ 0 0 4 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.905 108.3 46.6 -59.3 -42.7 15.9 33.5 25.0 291 301 A N H X S+ 0 0 84 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.833 107.6 59.6 -68.1 -31.7 14.3 35.1 22.0 292 302 A F H X S+ 0 0 53 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.950 107.2 43.6 -61.9 -49.6 17.7 35.8 20.6 293 303 A F H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 5,-0.4 0.846 113.2 53.6 -65.7 -30.8 18.6 32.1 20.5 294 304 A R H X S+ 0 0 55 -4,-1.5 4,-2.1 -5,-0.2 -1,-0.2 0.919 109.7 45.9 -70.1 -42.4 15.2 31.3 19.1 295 305 A S H < S+ 0 0 100 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.789 117.6 46.9 -71.6 -23.5 15.6 33.8 16.3 296 306 A L H < S+ 0 0 42 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.923 126.4 21.5 -81.6 -47.3 19.1 32.5 15.6 297 307 A W H < S- 0 0 2 -4,-2.9 3,-0.4 1,-0.2 -3,-0.2 0.663 96.1-145.3 -99.3 -20.4 18.5 28.7 15.7 298 308 A G >< - 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