==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-DEC-09 3KZN . COMPND 2 MOLECULE: N-ACETYLORNITHINE CARBAMOYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOMONAS CAMPESTRIS PV. CAMPESTRIS; . AUTHOR D.SHI,X.YU,N.M.ALLEWELL,M.TUCHMAN . 332 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14450.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 236 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 49 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 23 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 3 3 0 0 0 1 0 1 1 1 1 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 1 2 0 5 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 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 3 A L 0 0 137 0, 0.0 2,-0.4 0, 0.0 135,-0.1 0.000 360.0 360.0 360.0 136.3 81.8 49.5 80.5 2 4 A K - 0 0 90 329,-0.2 2,-0.3 2,-0.0 136,-0.0 -0.808 360.0-178.6 -98.8 134.3 85.0 51.3 81.4 3 5 A H - 0 0 33 -2,-0.4 2,-0.5 134,-0.2 3,-0.2 -0.771 30.9-129.1-122.3 166.7 88.3 49.4 81.6 4 6 A F B +a 139 0A 0 134,-2.8 136,-2.6 -2,-0.3 3,-0.1 -0.732 57.2 132.4-117.5 80.4 91.9 50.5 82.5 5 7 A L S S- 0 0 30 -2,-0.5 2,-0.3 1,-0.4 -1,-0.1 0.781 76.2 -3.2 -96.5 -35.4 93.7 49.0 79.5 6 8 A N > - 0 0 16 -3,-0.2 3,-1.0 140,-0.1 -1,-0.4 -0.983 56.4-129.3-156.8 148.3 95.9 52.0 78.6 7 9 A T G > S+ 0 0 0 -2,-0.3 3,-1.9 1,-0.2 8,-0.1 0.831 106.9 70.5 -69.1 -28.9 96.2 55.6 79.8 8 10 A Q G 3 S+ 0 0 36 1,-0.3 -1,-0.2 -3,-0.1 4,-0.1 0.757 92.5 57.6 -59.0 -24.7 95.9 56.6 76.1 9 11 A D G < S+ 0 0 86 -3,-1.0 2,-0.3 2,-0.1 -1,-0.3 0.604 98.2 75.2 -81.2 -13.3 92.2 55.5 76.3 10 12 A W S < S- 0 0 14 -3,-1.9 2,-0.0 -4,-0.3 -6,-0.0 -0.734 85.4-114.1-101.4 150.7 91.5 58.0 79.2 11 13 A S > - 0 0 51 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.316 29.1-110.8 -75.2 164.5 91.2 61.7 78.9 12 14 A R H > S+ 0 0 85 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.876 120.5 53.7 -63.5 -37.5 93.7 64.0 80.5 13 15 A A H > S+ 0 0 71 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.908 109.3 47.9 -63.6 -42.4 91.1 65.1 83.1 14 16 A E H > S+ 0 0 81 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.911 113.0 47.4 -65.7 -43.3 90.4 61.5 84.0 15 17 A L H X S+ 0 0 5 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.933 110.1 52.8 -63.6 -44.6 94.1 60.7 84.4 16 18 A D H X S+ 0 0 71 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.880 108.4 51.8 -57.9 -37.2 94.6 63.8 86.5 17 19 A A H X S+ 0 0 59 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.901 108.9 49.9 -66.2 -41.7 91.7 62.6 88.7 18 20 A L H X S+ 0 0 7 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.931 111.1 48.3 -62.5 -47.0 93.4 59.2 89.1 19 21 A L H X S+ 0 0 10 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.887 112.8 48.7 -62.2 -38.7 96.7 60.7 90.0 20 22 A T H X S+ 0 0 88 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.875 110.9 49.3 -69.8 -36.9 95.0 63.0 92.5 21 23 A Q H X S+ 0 0 65 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.885 108.8 54.6 -68.0 -35.2 93.1 60.1 94.1 22 24 A A H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.912 106.8 50.6 -62.4 -40.6 96.3 58.2 94.3 23 25 A A H X S+ 0 0 39 -4,-1.9 4,-1.0 1,-0.2 -1,-0.2 0.863 109.7 51.2 -64.6 -36.0 97.8 61.1 96.2 24 26 A L H X S+ 0 0 92 -4,-1.7 4,-1.3 1,-0.2 3,-0.4 0.902 107.9 50.6 -68.4 -42.5 94.8 61.1 98.6 25 27 A F H < S+ 0 0 6 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.834 105.3 58.2 -64.4 -30.8 95.2 57.3 99.2 26 28 A K H < S+ 0 0 64 -4,-1.6 3,-0.3 1,-0.2 -1,-0.2 0.827 109.5 44.4 -68.2 -29.6 98.9 57.9 100.0 27 29 A R H < S+ 0 0 222 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.686 132.8 19.3 -86.5 -19.8 97.8 60.4 102.7 28 30 A N < + 0 0 113 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.1 -0.685 69.3 175.9-151.0 88.9 95.1 58.0 104.1 29 31 A K + 0 0 111 -3,-0.3 2,-0.4 -2,-0.2 -4,-0.1 0.727 57.9 75.2 -73.6 -24.2 95.6 54.4 103.0 30 32 A L + 0 0 107 31,-0.1 2,-0.3 2,-0.0 31,-0.2 -0.750 60.8 127.2 -93.6 136.4 92.7 52.7 104.8 31 33 A G - 0 0 32 29,-2.4 3,-0.1 -2,-0.4 -2,-0.0 -0.907 59.9-111.9-163.0-170.4 89.2 53.1 103.5 32 34 A S > + 0 0 79 -2,-0.3 3,-2.1 1,-0.1 29,-0.1 0.166 69.2 118.3-125.8 18.2 86.0 51.4 102.4 33 35 A E T 3 S+ 0 0 93 1,-0.3 29,-0.1 30,-0.0 -1,-0.1 0.716 91.6 32.1 -58.0 -21.6 85.9 52.2 98.6 34 36 A L T > S+ 0 0 5 27,-2.2 3,-2.7 24,-0.1 -1,-0.3 0.054 83.8 159.9-122.7 23.7 86.1 48.4 97.9 35 37 A K T < S- 0 0 156 -3,-2.1 28,-0.2 1,-0.3 27,-0.1 -0.270 79.0 -5.8 -54.6 116.8 84.2 47.2 101.0 36 38 A G T 3 S+ 0 0 71 26,-2.3 -1,-0.3 1,-0.3 2,-0.2 0.463 110.9 120.1 77.0 1.4 82.9 43.7 100.2 37 39 A K < - 0 0 93 -3,-2.7 27,-1.6 21,-0.1 2,-0.3 -0.521 45.0-158.3 -94.0 164.3 84.2 43.9 96.7 38 40 A S E -b 64 0A 26 25,-0.2 67,-1.9 -2,-0.2 68,-1.0 -0.973 11.3-155.5-144.9 157.8 86.8 41.7 95.0 39 41 A I E -bc 65 106A 2 25,-1.9 27,-2.7 -2,-0.3 2,-0.6 -0.992 15.6-139.2-133.1 138.4 89.3 41.5 92.2 40 42 A A E -bc 66 107A 0 66,-2.5 68,-3.3 -2,-0.4 2,-0.9 -0.897 14.0-154.0 -98.3 119.3 90.7 38.5 90.4 41 43 A L E -bc 67 108A 0 25,-2.9 27,-2.8 -2,-0.6 2,-0.9 -0.838 12.3-164.2 -95.2 101.5 94.4 38.9 89.7 42 44 A V E -bc 68 109A 5 66,-2.7 68,-2.3 -2,-0.9 2,-0.8 -0.787 4.9-170.8 -95.6 105.7 95.1 36.7 86.7 43 45 A F E + c 0 110A 8 25,-3.0 28,-0.6 -2,-0.9 68,-0.1 -0.822 23.3 166.8 -99.9 103.8 98.8 36.1 86.2 44 46 A F S S+ 0 0 52 66,-2.8 67,-0.2 -2,-0.8 -1,-0.2 0.693 90.5 29.6 -82.3 -18.4 99.8 34.4 83.0 45 47 A N S S- 0 0 54 65,-0.6 -1,-0.3 -3,-0.1 2,-0.1 -0.993 100.4-114.9-135.9 133.7 103.3 35.5 84.0 46 48 A P + 0 0 82 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 -0.326 31.7 174.4 -73.0 153.3 104.2 35.8 87.8 47 49 A S > - 0 0 17 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.777 17.8-166.2-159.4 109.4 105.1 39.1 89.5 48 50 A M H > S+ 0 0 164 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.907 93.2 49.9 -65.2 -41.1 105.7 39.4 93.3 49 51 A R H > S+ 0 0 99 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.866 113.6 45.6 -66.6 -36.3 105.5 43.2 93.3 50 52 A T H > S+ 0 0 0 2,-0.2 4,-2.3 3,-0.2 5,-0.3 0.907 114.2 47.3 -73.2 -42.5 102.3 43.3 91.3 51 53 A R H X S+ 0 0 99 -4,-2.3 4,-2.4 2,-0.2 5,-0.3 0.942 115.2 47.5 -63.0 -45.8 100.6 40.5 93.4 52 54 A T H X S+ 0 0 72 -4,-2.6 4,-2.3 -5,-0.2 5,-0.3 0.942 114.3 43.9 -61.8 -50.7 101.8 42.3 96.6 53 55 A S H X S+ 0 0 13 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.927 118.4 42.3 -64.6 -46.0 100.6 45.8 95.7 54 56 A F H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.938 114.5 51.1 -66.1 -46.0 97.2 44.8 94.3 55 57 A E H X S+ 0 0 74 -4,-2.4 4,-2.1 -5,-0.3 10,-0.2 0.925 115.3 41.8 -57.9 -46.2 96.5 42.3 97.1 56 58 A L H X S+ 0 0 75 -4,-2.3 4,-3.1 -5,-0.3 -1,-0.2 0.880 111.0 57.1 -69.3 -37.6 97.3 44.9 99.8 57 59 A G H X S+ 0 0 0 -4,-2.2 4,-0.9 -5,-0.3 6,-0.2 0.905 109.1 45.6 -59.7 -41.5 95.5 47.6 97.9 58 60 A A H ><>S+ 0 0 1 -4,-2.5 5,-3.1 2,-0.2 3,-0.7 0.947 113.8 49.6 -65.8 -48.2 92.3 45.5 97.9 59 61 A F H ><5S+ 0 0 145 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.912 107.0 54.1 -55.8 -47.9 92.7 44.7 101.6 60 62 A Q H 3<5S+ 0 0 17 -4,-3.1 -29,-2.4 1,-0.3 -1,-0.2 0.718 109.4 48.2 -63.7 -22.3 93.3 48.3 102.6 61 63 A L T <<5S- 0 0 0 -4,-0.9 -27,-2.2 -3,-0.7 -1,-0.3 0.197 125.7 -97.4-103.1 14.8 90.0 49.4 101.0 62 64 A G T < 5S+ 0 0 37 -3,-1.8 -26,-2.3 1,-0.2 -3,-0.2 0.565 89.7 108.0 84.7 9.6 87.9 46.7 102.5 63 65 A G < - 0 0 13 -5,-3.1 2,-0.3 -28,-0.2 -1,-0.2 -0.273 59.9-124.0-105.2-166.2 88.0 44.3 99.5 64 66 A H E -b 38 0A 125 -27,-1.6 -25,-1.9 -30,-0.2 2,-0.4 -0.995 8.7-147.6-146.7 135.9 89.7 41.0 98.7 65 67 A A E -b 39 0A 8 -2,-0.3 2,-0.6 -10,-0.2 -25,-0.2 -0.874 7.2-153.6-106.1 136.3 92.0 39.9 95.9 66 68 A V E -b 40 0A 57 -27,-2.7 -25,-2.9 -2,-0.4 2,-0.6 -0.944 14.5-144.5-108.3 119.4 92.0 36.4 94.5 67 69 A V E +b 41 0A 35 -2,-0.6 2,-0.4 -27,-0.2 -25,-0.2 -0.769 21.6 179.8 -91.0 118.7 95.3 35.3 93.0 68 70 A L E -b 42 0A 62 -27,-2.8 -25,-3.0 -2,-0.6 -2,-0.0 -0.939 16.0-170.1-120.1 140.0 95.1 33.1 90.0 69 71 A Q >> - 0 0 50 -2,-0.4 4,-2.4 -27,-0.2 3,-2.3 -0.717 1.6-174.5-132.2 82.0 97.9 31.6 87.9 70 72 A P H 3> S+ 0 0 19 0, 0.0 4,-1.0 0, 0.0 -26,-0.1 0.740 82.3 58.9 -43.2 -38.6 96.6 29.9 84.7 71 73 A G H 34 S+ 0 0 66 -28,-0.6 -27,-0.1 1,-0.2 -26,-0.0 0.735 120.6 25.9 -70.5 -20.8 100.0 28.6 83.6 72 74 A K H <4 S+ 0 0 145 -3,-2.3 -1,-0.2 3,-0.1 3,-0.1 0.622 125.4 43.6-115.5 -20.0 100.3 26.6 86.9 73 75 A D H < S+ 0 0 129 -4,-2.4 2,-0.3 1,-0.1 -2,-0.1 0.370 115.7 20.6-110.4 5.2 96.8 25.9 88.1 74 76 A A S < S- 0 0 58 -4,-1.0 -1,-0.1 -5,-0.3 3,-0.1 -0.993 81.1 -87.3-164.8 164.2 95.0 24.9 84.8 75 77 A W - 0 0 176 -2,-0.3 14,-0.1 1,-0.2 16,-0.1 -0.286 69.7 -69.7 -69.8 162.8 95.3 23.6 81.3 76 78 A P - 0 0 69 0, 0.0 14,-2.0 0, 0.0 15,-0.9 -0.160 49.2-126.3 -57.1 148.7 95.9 26.3 78.5 77 79 A I E -e 91 0B 27 12,-0.2 2,-0.5 13,-0.2 15,-0.2 -0.780 15.8-127.9 -99.4 140.7 93.0 28.6 77.6 78 80 A E E +e 92 0B 26 13,-3.0 15,-2.7 -2,-0.4 16,-0.3 -0.768 31.6 166.3 -91.3 126.6 91.8 29.0 74.1 79 81 A F + 0 0 22 -2,-0.5 -1,-0.1 13,-0.2 13,-0.1 0.647 47.6 95.5-109.3 -24.0 91.6 32.6 72.7 80 82 A N S S- 0 0 84 1,-0.1 3,-0.3 2,-0.0 2,-0.2 -0.265 71.0-122.6 -68.0 157.4 91.1 32.0 69.0 81 83 A L S S+ 0 0 105 1,-0.2 -1,-0.1 11,-0.0 -2,-0.1 -0.667 77.7 12.4-104.2 157.5 87.6 32.0 67.5 82 84 A G S S+ 0 0 92 -2,-0.2 2,-0.2 1,-0.2 -1,-0.2 0.779 88.3 139.2 52.6 35.0 85.7 29.3 65.6 83 85 A T - 0 0 65 -3,-0.3 2,-0.8 2,-0.0 -1,-0.2 -0.638 59.7-118.4-105.9 165.6 88.1 26.5 66.3 84 86 A V - 0 0 115 -2,-0.2 2,-2.3 1,-0.0 3,-0.1 -0.920 27.6-143.0-100.0 110.6 87.6 22.9 67.2 85 87 A M + 0 0 70 -2,-0.8 -7,-0.0 1,-0.2 -1,-0.0 -0.371 61.0 123.0 -77.1 64.5 89.1 22.6 70.7 86 88 A D + 0 0 135 -2,-2.3 -1,-0.2 0, 0.0 4,-0.1 0.019 62.2 69.0-109.5 25.6 90.5 19.1 70.3 87 89 A G S S- 0 0 51 2,-0.3 -2,-0.1 -3,-0.1 0, 0.0 0.087 110.0 -48.3-113.0-135.9 94.1 20.2 71.1 88 90 A D S S+ 0 0 144 -11,-0.0 2,-0.2 -2,-0.0 -3,-0.1 0.793 104.1 90.3 -76.8 -32.2 95.9 21.5 74.2 89 91 A T - 0 0 21 1,-0.1 -2,-0.3 -14,-0.1 -12,-0.2 -0.495 48.2-177.4 -73.4 134.5 93.4 24.1 75.2 90 92 A E + 0 0 115 -14,-2.0 2,-0.3 1,-0.2 -13,-0.2 0.691 65.9 27.2-101.7 -26.6 90.7 22.9 77.7 91 93 A E E S-e 77 0B 92 -15,-0.9 -13,-3.0 -16,-0.1 2,-0.3 -0.993 73.0-122.8-141.8 147.4 88.5 26.0 78.1 92 94 A H E >> -e 78 0B 26 -2,-0.3 4,-1.9 -15,-0.2 3,-0.8 -0.629 23.8-122.9 -89.9 147.5 87.7 29.1 76.0 93 95 A I H 3> S+ 0 0 0 -15,-2.7 4,-2.9 -2,-0.3 5,-0.3 0.795 109.3 66.4 -57.5 -29.7 88.3 32.6 77.2 94 96 A A H 3> S+ 0 0 7 -16,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.933 107.1 39.9 -58.8 -44.4 84.6 33.5 76.8 95 97 A E H <> S+ 0 0 87 -3,-0.8 4,-2.3 2,-0.2 5,-0.3 0.874 113.8 54.2 -72.5 -37.8 83.7 31.0 79.5 96 98 A V H X S+ 0 0 20 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.952 114.7 39.5 -60.9 -49.2 86.7 32.0 81.7 97 99 A A H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.882 114.9 51.8 -69.3 -40.4 85.7 35.7 81.7 98 100 A R H < S+ 0 0 134 -4,-2.0 4,-0.3 -5,-0.3 -1,-0.2 0.907 113.9 43.8 -65.2 -41.1 82.0 35.2 81.9 99 101 A V H >X S+ 0 0 63 -4,-2.3 3,-2.1 2,-0.2 4,-0.7 0.949 112.7 50.4 -69.7 -48.2 82.3 32.9 85.0 100 102 A L H >X S+ 0 0 23 -4,-2.3 4,-2.9 -5,-0.3 3,-1.5 0.889 104.9 60.8 -55.8 -36.9 84.9 35.1 86.7 101 103 A G H 3< S+ 0 0 13 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.640 99.9 54.3 -64.5 -16.3 82.5 38.0 86.1 102 104 A R H <4 S+ 0 0 211 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 0.570 118.2 35.6 -90.7 -12.8 79.9 36.2 88.2 103 105 A Y H << S+ 0 0 173 -3,-1.5 -2,-0.2 -4,-0.7 2,-0.2 0.838 115.6 40.4-104.0 -53.2 82.3 36.0 91.1 104 106 A V < - 0 0 9 -4,-2.9 -65,-0.2 1,-0.1 -1,-0.1 -0.567 58.9-141.8-103.1 165.5 84.5 39.1 91.2 105 107 A D S S+ 0 0 56 -67,-1.9 2,-0.3 1,-0.2 -66,-0.2 0.601 88.9 23.7 -95.9 -16.6 83.9 42.9 90.6 106 108 A L E -c 39 0A 3 -68,-1.0 -66,-2.5 30,-0.1 2,-0.4 -0.986 63.9-151.4-148.2 151.7 87.2 43.5 88.8 107 109 A I E -cd 40 138A 0 30,-2.2 32,-2.8 -2,-0.3 2,-0.4 -0.980 7.1-162.7-131.5 120.2 89.7 41.4 86.8 108 110 A G E -cd 41 139A 0 -68,-3.3 -66,-2.7 -2,-0.4 2,-0.4 -0.807 11.1-162.4 -98.8 142.2 93.4 42.2 86.5 109 111 A V E +cd 42 140A 0 30,-2.8 32,-3.1 -2,-0.4 2,-0.5 -0.984 15.0 178.8-133.4 126.6 95.4 40.6 83.7 110 112 A R E +c 43 0A 22 -68,-2.3 -66,-2.8 -2,-0.4 -65,-0.6 -0.989 18.2 152.5-123.8 120.5 99.2 40.2 83.2 111 113 A A - 0 0 11 31,-1.7 16,-0.2 -2,-0.5 15,-0.1 -0.861 27.1-149.4-154.1 113.0 100.3 38.4 80.1 112 114 A F - 0 0 58 -2,-0.3 32,-0.1 1,-0.1 31,-0.1 -0.353 29.5 -96.2 -81.3 159.0 103.7 38.9 78.4 113 115 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.259 26.8-130.5 -66.2 164.5 104.4 38.6 74.7 114 116 A K - 0 0 174 3,-0.2 4,-0.1 4,-0.0 -2,-0.0 0.537 28.9-134.8 -94.6 -7.8 105.8 35.2 73.6 115 117 A F S S+ 0 0 49 2,-0.1 144,-1.7 1,-0.1 3,-0.1 0.635 80.9 97.1 63.9 20.3 108.7 36.8 71.6 116 118 A V S S+ 0 0 102 1,-0.3 2,-0.3 142,-0.2 -1,-0.1 0.771 95.5 10.0-102.0 -37.1 108.3 34.6 68.6 117 119 A D >> - 0 0 64 1,-0.1 4,-2.3 142,-0.1 3,-1.1 -0.877 55.6-163.7-148.9 109.4 106.3 36.9 66.4 118 120 A W H 3> S+ 0 0 21 -2,-0.3 4,-3.0 137,-0.3 5,-0.2 0.785 90.7 66.8 -64.7 -27.3 105.6 40.6 67.2 119 121 A S H 34 S+ 0 0 71 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.823 111.1 37.0 -63.3 -27.4 102.7 40.8 64.7 120 122 A K H X4 S+ 0 0 153 -3,-1.1 3,-1.3 2,-0.1 5,-0.5 0.892 116.9 49.1 -88.6 -46.4 100.9 38.4 67.0 121 123 A D H >< S+ 0 0 23 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.894 103.7 61.6 -60.9 -39.7 102.2 39.8 70.4 122 124 A R T 3< S+ 0 0 62 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.1 0.628 88.0 72.8 -65.4 -11.2 101.3 43.4 69.4 123 125 A E T < S- 0 0 94 -3,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.574 92.5-141.3 -79.6 -8.0 97.6 42.5 69.0 124 126 A D <> + 0 0 15 -3,-1.9 4,-2.8 -4,-0.2 5,-0.3 0.869 34.9 170.3 51.7 42.6 97.3 42.2 72.8 125 127 A Q H > + 0 0 87 -5,-0.5 4,-2.0 1,-0.2 5,-0.2 0.846 66.8 49.5 -53.7 -46.5 95.0 39.2 72.4 126 128 A V H > S+ 0 0 30 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.975 116.7 40.5 -61.5 -54.2 94.8 38.0 76.0 127 129 A L H > S+ 0 0 1 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.915 116.2 49.8 -61.2 -45.6 93.9 41.4 77.4 128 130 A K H X S+ 0 0 100 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.828 109.0 53.5 -64.4 -31.6 91.6 42.4 74.6 129 131 A S H X S+ 0 0 15 -4,-2.0 4,-2.5 -5,-0.3 5,-0.3 0.900 108.8 47.9 -70.3 -41.5 89.7 39.0 75.0 130 132 A F H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.946 112.4 49.9 -63.0 -45.0 89.2 39.6 78.7 131 133 A A H < S+ 0 0 19 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.852 112.8 48.3 -61.1 -35.3 87.9 43.1 77.9 132 134 A K H < S+ 0 0 133 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.925 122.6 28.8 -71.3 -46.5 85.6 41.7 75.2 133 135 A Y H < S+ 0 0 37 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.671 95.0 99.6 -91.9 -20.7 84.0 38.9 77.3 134 136 A S < - 0 0 9 -4,-2.7 -36,-0.1 -5,-0.3 4,-0.1 -0.490 54.7-157.6 -73.5 133.4 84.2 40.2 80.8 135 137 A P S S+ 0 0 74 0, 0.0 -1,-0.1 0, 0.0 -37,-0.1 0.461 80.1 59.5 -86.2 -0.4 81.0 41.7 82.3 136 138 A V S S- 0 0 18 -39,-0.1 -30,-0.1 -135,-0.1 -2,-0.1 -0.879 103.1 -75.3-125.4 158.1 83.2 43.6 84.8 137 139 A P - 0 0 12 0, 0.0 -30,-2.2 0, 0.0 2,-0.4 -0.200 43.8-146.5 -55.4 137.2 86.1 46.1 84.5 138 140 A V E - d 0 107A 0 -32,-0.2 -134,-2.8 -4,-0.1 2,-0.4 -0.860 6.6-156.3-109.1 140.7 89.4 44.8 83.3 139 141 A I E -ad 4 108A 0 -32,-2.8 -30,-2.8 -2,-0.4 2,-0.7 -0.973 17.2-129.4-121.9 129.1 92.8 46.2 84.5 140 142 A N E + d 0 109A 0 -136,-2.6 8,-0.5 -2,-0.4 -30,-0.2 -0.664 22.6 179.8 -76.7 111.2 96.1 45.8 82.5 141 143 A M S S- 0 0 0 -32,-3.1 -31,-0.2 -2,-0.7 -1,-0.1 0.044 73.0 -52.4 -99.9 22.2 98.7 44.4 85.0 142 144 A E S S+ 0 0 11 -33,-0.3 -31,-1.7 3,-0.1 -1,-0.2 0.515 75.4 143.4 104.9 116.7 101.2 44.5 82.1 143 145 A T S S- 0 0 2 2,-2.0 42,-0.3 -33,-0.2 3,-0.1 0.207 90.0 -25.4-133.2 -96.3 101.0 43.0 78.7 144 146 A I S S+ 0 0 4 -32,-0.1 2,-0.3 41,-0.1 44,-0.2 0.354 140.5 33.7-106.5 2.5 102.6 45.0 75.8 145 147 A T - 0 0 0 43,-0.1 -2,-2.0 -140,-0.1 41,-0.2 -0.910 69.7-146.7-144.1 164.6 102.1 48.3 77.8 146 148 A H >> + 0 0 5 39,-0.6 4,-1.9 -2,-0.3 3,-0.7 -0.548 24.3 166.7-138.9 68.7 102.3 48.9 81.6 147 149 A P H 3> S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.761 77.2 57.5 -56.6 -30.6 99.8 51.7 82.4 148 150 A C H 3> S+ 0 0 0 -8,-0.5 4,-1.8 2,-0.2 5,-0.2 0.899 108.0 47.8 -68.8 -37.2 99.9 51.0 86.2 149 151 A Q H <> S+ 0 0 5 -3,-0.7 4,-2.7 1,-0.2 5,-0.2 0.893 106.1 60.2 -68.1 -38.2 103.6 51.6 86.0 150 152 A E H X S+ 0 0 3 -4,-1.9 4,-3.0 1,-0.2 -2,-0.2 0.923 108.9 41.3 -54.1 -49.2 103.0 54.8 84.0 151 153 A L H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.866 113.0 52.1 -71.6 -35.0 100.9 56.4 86.7 152 154 A A H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.915 115.1 44.7 -64.1 -40.3 103.2 55.3 89.5 153 155 A H H X S+ 0 0 2 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.937 112.6 50.2 -66.4 -50.4 106.1 56.8 87.6 154 156 A A H X S+ 0 0 0 -4,-3.0 4,-2.3 -5,-0.2 -2,-0.2 0.914 111.7 48.6 -56.3 -45.5 104.1 60.0 86.7 155 157 A L H X S+ 0 0 6 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.919 109.0 52.6 -63.1 -43.4 103.2 60.5 90.4 156 158 A A H X S+ 0 0 4 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.902 110.6 48.2 -59.3 -41.5 106.8 60.0 91.6 157 159 A L H X S+ 0 0 1 -4,-2.2 4,-2.7 2,-0.2 6,-0.2 0.919 111.0 49.4 -66.1 -44.4 108.0 62.6 89.1 158 160 A Q H X>S+ 0 0 25 -4,-2.3 5,-1.5 1,-0.2 4,-1.1 0.918 113.1 48.1 -61.3 -41.1 105.3 65.1 90.2 159 161 A E H <5S+ 0 0 79 -4,-2.6 3,-0.2 2,-0.2 -2,-0.2 0.912 111.4 50.3 -65.7 -41.5 106.2 64.5 93.8 160 162 A H H <5S+ 0 0 87 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.922 117.0 39.0 -62.9 -45.3 109.9 64.9 93.1 161 163 A F H <5S- 0 0 54 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.558 106.8-125.5 -83.0 -7.5 109.5 68.2 91.3 162 164 A G T <5S+ 0 0 69 -4,-1.1 -3,-0.2 -3,-0.2 -4,-0.1 0.740 79.6 79.4 71.1 23.7 106.8 69.4 93.7 163 165 A T S + 0 0 1 -2,-0.9 3,-1.7 31,-0.3 -1,-0.1 0.263 23.1 139.7-104.2 10.5 105.9 68.8 84.2 167 169 A R T 3 + 0 0 151 1,-0.2 32,-0.2 32,-0.1 31,-0.1 -0.241 68.9 22.3 -56.0 140.2 105.7 70.6 80.8 168 170 A G T 3 S+ 0 0 49 30,-1.4 -1,-0.2 1,-0.3 31,-0.1 0.024 87.5 129.2 93.1 -29.6 109.0 71.8 79.5 169 171 A K < - 0 0 47 -3,-1.7 31,-2.5 1,-0.1 2,-0.7 -0.323 64.4-117.7 -60.9 140.9 111.1 69.3 81.5 170 172 A K E -f 200 0C 49 73,-0.3 75,-2.6 29,-0.2 76,-1.9 -0.748 32.7-165.5 -85.8 116.5 113.6 67.3 79.4 171 173 A Y E -fg 201 246C 0 29,-2.1 31,-2.5 -2,-0.7 2,-0.6 -0.898 6.2-165.2-108.9 122.1 112.7 63.6 79.6 172 174 A V E -fg 202 247C 0 74,-2.8 76,-2.8 -2,-0.5 2,-0.9 -0.905 5.3-169.6-110.5 112.5 115.2 61.0 78.4 173 175 A L E -fg 203 248C 0 29,-2.4 31,-2.6 -2,-0.6 2,-0.4 -0.877 22.9-170.1 -96.8 105.5 113.8 57.4 77.9 174 176 A T E -fg 204 249C 0 74,-2.3 76,-2.0 -2,-0.9 31,-0.2 -0.852 22.3-134.3-108.6 135.1 117.0 55.5 77.4 175 177 A W E - g 0 250C 0 29,-2.9 2,-0.3 -2,-0.4 76,-0.3 -0.461 30.8-169.9 -71.1 150.7 117.6 51.9 76.3 176 178 A T - 0 0 0 74,-0.7 76,-0.3 -2,-0.1 124,-0.1 -0.937 24.1 -85.5-140.6 164.8 120.0 50.1 78.5 177 179 A Y + 0 0 23 122,-0.5 74,-0.1 -2,-0.3 122,-0.1 -0.374 41.5 161.4 -77.5 150.8 121.8 46.8 78.4 178 180 A H - 0 0 15 -2,-0.1 74,-0.1 74,-0.1 4,-0.1 -0.935 45.1-121.1-158.6 142.9 120.6 43.3 79.5 179 181 A P S S+ 0 0 46 0, 0.0 90,-0.1 0, 0.0 89,-0.1 0.761 97.0 47.4 -63.7 -20.9 122.0 39.9 78.4 180 182 A K S S- 0 0 130 88,-0.1 2,-0.4 -3,-0.0 71,-0.0 -0.846 92.7-102.6-122.0 156.1 118.5 39.0 77.1 181 183 A P - 0 0 27 0, 0.0 2,-0.2 0, 0.0 71,-0.1 -0.628 47.0-163.7 -76.7 128.0 115.9 40.6 74.8 182 184 A L - 0 0 39 -2,-0.4 71,-2.7 1,-0.1 2,-0.0 -0.600 25.8 -76.8-112.4 172.5 113.0 42.0 77.0 183 185 A N - 0 0 6 -2,-0.2 3,-0.3 69,-0.2 4,-0.2 -0.339 27.7-146.4 -63.4 140.4 109.4 43.2 76.6 184 186 A T S >> S+ 0 0 1 1,-0.2 4,-2.9 2,-0.1 3,-0.7 0.552 72.4 106.2 -85.8 -7.6 109.1 46.8 75.2 185 187 A A H 3> S+ 0 0 0 -42,-0.3 4,-2.4 1,-0.3 -39,-0.6 0.819 77.9 44.3 -37.6 -57.1 106.0 47.3 77.4 186 188 A V H 3> S+ 0 0 5 -3,-0.3 4,-2.4 1,-0.2 -1,-0.3 0.877 115.7 48.3 -63.6 -36.9 107.5 49.6 80.0 187 189 A A H <> S+ 0 0 0 -3,-0.7 4,-2.5 -4,-0.2 5,-0.3 0.912 109.9 51.6 -69.3 -42.3 109.3 51.7 77.3 188 190 A N H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.938 114.2 45.6 -57.7 -44.8 106.1 51.9 75.2 189 191 A S H X S+ 0 0 2 -4,-2.4 4,-2.8 -5,-0.3 5,-0.3 0.880 110.4 51.5 -66.2 -41.3 104.3 53.2 78.4 190 192 A A H X S+ 0 0 3 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.938 111.0 48.2 -63.2 -45.3 107.1 55.6 79.4 191 193 A L H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 5,-0.2 0.924 113.7 49.7 -59.6 -43.9 107.1 57.2 76.0 192 194 A T H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.3 -2,-0.2 0.939 116.2 37.8 -61.0 -52.7 103.3 57.4 76.2 193 195 A I H X S+ 0 0 6 -4,-2.8 4,-1.6 2,-0.2 -2,-0.2 0.872 113.1 56.2 -72.1 -36.2 102.9 59.0 79.6 194 196 A A H <>S+ 0 0 1 -4,-2.7 5,-1.9 -5,-0.3 -1,-0.2 0.916 113.7 40.4 -62.2 -42.7 106.0 61.3 79.3 195 197 A T H ><5S+ 0 0 0 -4,-1.8 3,-1.8 -5,-0.3 34,-0.3 0.850 109.9 58.7 -74.2 -33.5 104.5 62.9 76.1 196 198 A R H 3<5S+ 0 0 22 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.832 104.5 53.5 -63.9 -28.6 101.0 62.9 77.5 197 199 A M T 3<5S- 0 0 16 -4,-1.6 -31,-0.3 -5,-0.1 -1,-0.3 0.408 119.0-114.7 -85.8 1.6 102.5 65.1 80.3 198 200 A G T < 5 + 0 0 1 -3,-1.8 -30,-1.4 1,-0.2 -3,-0.2 0.707 62.3 149.0 75.4 22.0 103.9 67.5 77.8 199 201 A M < - 0 0 0 -5,-1.9 31,-1.5 -32,-0.2 2,-1.2 -0.391 58.9-104.8 -83.5 165.6 107.6 66.9 78.4 200 202 A D E -fh 170 230C 55 -31,-2.5 -29,-2.1 29,-0.3 2,-0.3 -0.784 50.2-161.6 -92.0 95.8 110.3 67.2 75.8 201 203 A V E -fh 171 231C 1 29,-2.4 31,-1.7 -2,-1.2 2,-0.5 -0.628 18.9-171.5 -90.4 136.7 111.0 63.6 75.2 202 204 A T E -fh 172 232C 9 -31,-2.5 -29,-2.4 -2,-0.3 2,-0.9 -0.992 14.6-149.5-124.7 123.1 114.0 61.9 73.7 203 205 A L E -fh 173 233C 0 29,-3.4 31,-2.7 -2,-0.5 2,-0.6 -0.843 19.2-164.4 -93.7 105.4 114.0 58.2 72.9 204 206 A L E +fh 174 234C 0 -31,-2.6 -29,-2.9 -2,-0.9 31,-0.2 -0.829 22.3 149.0 -96.7 116.4 117.7 57.2 73.3 205 207 A C - 0 0 0 29,-2.3 6,-0.1 -2,-0.6 -2,-0.0 -0.974 53.6-110.6-144.0 157.9 118.6 53.8 71.8 206 208 A P S S- 0 0 8 0, 0.0 -1,-0.1 0, 0.0 31,-0.0 0.880 91.4 -7.5 -53.8 -48.4 121.6 52.1 70.1 207 209 A T S > S- 0 0 24 27,-0.1 3,-2.1 -3,-0.0 4,-0.2 -0.912 75.9 -93.3-145.9 171.3 120.3 51.9 66.5 208 210 A P G > S+ 0 0 86 0, 0.0 3,-1.3 0, 0.0 -1,-0.0 0.732 117.4 71.5 -59.8 -21.2 117.1 52.4 64.4 209 211 A D G 3 S+ 0 0 69 1,-0.3 46,-0.4 45,-0.1 48,-0.2 0.721 94.0 54.8 -66.7 -21.7 116.4 48.7 65.0 210 212 A Y G < S+ 0 0 1 -3,-2.1 -1,-0.3 44,-0.2 2,-0.1 0.382 76.3 121.4 -94.7 3.2 115.6 49.6 68.6 211 213 A I < - 0 0 53 -3,-1.3 44,-0.3 -4,-0.2 3,-0.1 -0.418 69.4-107.5 -65.9 141.7 112.9 52.2 67.9 212 214 A L - 0 0 6 1,-0.2 -1,-0.1 -2,-0.1 5,-0.1 -0.104 48.7 -66.6 -67.0 168.1 109.6 51.3 69.5 213 215 A D >> - 0 0 15 1,-0.1 4,-1.8 3,-0.1 3,-1.0 -0.224 45.1-118.0 -56.2 142.3 106.5 50.1 67.6 214 216 A E H 3> S+ 0 0 153 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.814 111.0 67.4 -51.1 -35.0 104.9 52.7 65.3 215 217 A R H 3> S+ 0 0 52 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.919 107.8 36.5 -53.4 -47.5 101.8 52.5 67.3 216 218 A Y H <> S+ 0 0 2 -3,-1.0 4,-2.6 2,-0.2 -1,-0.2 0.812 112.3 57.5 -78.5 -31.4 103.5 54.1 70.4 217 219 A M H X S+ 0 0 32 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.877 111.1 46.2 -65.2 -34.8 105.6 56.4 68.3 218 220 A D H X S+ 0 0 91 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.876 108.9 53.0 -74.3 -38.4 102.3 57.7 66.9 219 221 A W H X S+ 0 0 42 -4,-1.7 4,-2.5 -5,-0.2 -2,-0.2 0.951 111.6 48.2 -58.9 -46.3 100.7 57.9 70.4 220 222 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.894 110.3 50.4 -59.8 -44.6 103.6 60.0 71.5 221 223 A A H X S+ 0 0 46 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.914 112.2 47.5 -61.4 -44.2 103.4 62.3 68.4 222 224 A Q H X S+ 0 0 97 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.898 110.6 52.3 -64.0 -41.5 99.7 62.8 69.0 223 225 A N H X S+ 0 0 1 -4,-2.5 4,-2.9 -5,-0.2 5,-0.3 0.881 108.3 50.1 -62.9 -40.5 100.3 63.5 72.7 224 226 A V H X S+ 0 0 24 -4,-2.2 4,-2.8 1,-0.2 5,-0.4 0.913 108.2 53.2 -64.1 -43.2 103.0 66.2 72.0 225 227 A A H < S+ 0 0 84 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.823 118.2 37.4 -61.8 -31.7 100.7 67.9 69.5 226 228 A E H < S+ 0 0 134 -4,-1.4 -2,-0.2 -5,-0.1 -1,-0.2 0.791 124.8 36.4 -90.9 -32.3 98.0 68.1 72.2 227 229 A S H < S- 0 0 15 -4,-2.9 -3,-0.2 -32,-0.2 -2,-0.2 0.667 104.0-118.1 -95.9 -20.9 100.2 68.8 75.3 228 230 A G S < S+ 0 0 65 -4,-2.8 -3,-0.1 -5,-0.3 -4,-0.1 0.645 72.6 113.0 94.6 15.6 102.8 71.0 73.8 229 231 A G - 0 0 14 -5,-0.4 2,-0.3 -34,-0.3 -29,-0.3 0.288 58.2-114.1 -92.7-138.3 106.0 69.0 74.3 230 232 A S E -h 200 0C 46 -31,-1.5 -29,-2.4 2,-0.0 2,-0.4 -0.982 9.5-144.7-162.4 155.4 108.2 67.3 71.8 231 233 A L E +h 201 0C 54 -2,-0.3 2,-0.3 -31,-0.2 -29,-0.2 -0.994 23.3 165.0-130.6 132.1 109.4 63.9 70.6 232 234 A Q E -h 202 0C 106 -31,-1.7 -29,-3.4 -2,-0.4 2,-0.4 -0.999 25.6-143.7-148.1 142.8 112.8 63.0 69.3 233 235 A V E +h 203 0C 53 -2,-0.3 2,-0.3 -31,-0.2 -29,-0.2 -0.887 25.5 179.6-106.7 137.7 114.8 59.8 68.6 234 236 A S E -h 204 0C 11 -31,-2.7 -29,-2.3 -2,-0.4 -27,-0.1 -0.990 31.4-173.8-140.9 148.3 118.5 59.8 69.3 235 237 A H + 0 0 80 -2,-0.3 2,-0.6 -31,-0.2 -31,-0.1 0.190 69.2 92.6-119.9 9.6 121.4 57.4 69.0 236 238 A D > - 0 0 85 1,-0.2 4,-1.6 2,-0.0 5,-0.2 -0.914 58.4-162.6-111.9 109.9 123.9 59.7 70.6 237 239 A I H > S+ 0 0 16 -2,-0.6 4,-2.6 1,-0.2 5,-0.3 0.924 84.2 48.8 -53.4 -57.9 124.3 59.3 74.4 238 240 A D H > S+ 0 0 69 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.872 111.7 46.9 -56.3 -44.2 125.9 62.6 75.3 239 241 A S H 4 S+ 0 0 59 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.857 113.7 50.8 -68.4 -33.1 123.6 64.9 73.4 240 242 A A H < S+ 0 0 1 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.955 112.8 43.1 -68.6 -50.7 120.6 63.1 74.8 241 243 A Y H >< S+ 0 0 0 -4,-2.6 3,-2.7 -5,-0.2 44,-0.2 0.821 86.4 114.2 -65.3 -32.0 121.7 63.2 78.5 242 244 A A T 3< S- 0 0 46 -4,-1.8 42,-0.3 1,-0.3 41,-0.1 -0.166 96.2 -9.5 -47.1 115.7 122.8 66.9 78.2 243 245 A G T 3 S+ 0 0 39 40,-2.3 -73,-0.3 1,-0.2 -1,-0.3 0.530 92.3 162.2 72.5 6.9 120.5 69.0 80.4 244 246 A A < - 0 0 0 -3,-2.7 41,-2.4 1,-0.1 43,-0.4 -0.262 30.0-166.5 -61.1 144.2 118.1 66.2 81.1 245 247 A D S S+ 0 0 24 -75,-2.6 43,-2.1 1,-0.3 2,-0.3 0.664 78.1 27.0-100.0 -26.8 115.7 66.6 84.0 246 248 A V E -gi 171 288C 2 -76,-1.9 -74,-2.8 41,-0.3 2,-0.4 -1.000 59.6-170.6-140.7 139.1 114.7 62.9 84.0 247 249 A V E -gi 172 289C 0 41,-2.0 43,-1.6 -2,-0.3 2,-0.5 -0.972 7.5-179.2-131.5 114.7 116.3 59.7 82.9 248 250 A Y E -gi 173 290C 4 -76,-2.8 -74,-2.3 -2,-0.4 2,-0.3 -0.971 12.3-159.9-117.1 119.1 114.3 56.6 82.7 249 251 A A E +g 174 0C 0 41,-1.6 43,-0.5 -2,-0.5 2,-0.3 -0.744 18.9 158.3-103.0 149.2 116.1 53.4 81.6 250 252 A K E -g 175 0C 11 -76,-2.0 -74,-0.7 -2,-0.3 2,-0.3 -0.918 27.6-138.9-164.2 137.7 114.7 50.2 80.3 251 253 A S + 0 0 0 -2,-0.3 2,-0.3 -76,-0.3 -64,-0.1 -0.767 27.6 168.5-100.5 148.9 116.1 47.4 78.2 252 254 A W - 0 0 1 -2,-0.3 2,-0.3 -76,-0.3 -69,-0.2 -0.989 36.4-103.2-157.3 152.3 114.2 45.7 75.3 253 255 A G - 0 0 0 -71,-2.7 2,-0.2 -2,-0.3 5,-0.1 -0.585 47.3-100.4 -79.2 138.2 114.7 43.3 72.4 254 256 A A > - 0 0 0 -2,-0.3 3,-2.1 1,-0.2 -44,-0.2 -0.395 29.3-137.6 -59.8 122.1 114.8 44.9 69.0 255 257 A L G > S+ 0 0 21 -46,-0.4 3,-1.7 -44,-0.3 -137,-0.3 0.835 98.4 63.4 -52.1 -40.9 111.4 44.3 67.4 256 258 A P G 3 S+ 0 0 82 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.695 99.6 58.3 -62.3 -12.0 112.7 43.4 64.0 257 259 A F G X + 0 0 31 -3,-2.1 3,-2.3 -48,-0.2 -2,-0.2 0.217 68.2 137.3-102.9 16.1 114.4 40.3 65.6 258 260 A F T < S+ 0 0 25 -3,-1.7 -142,-0.2 1,-0.3 -140,-0.1 -0.410 81.7 12.6 -61.8 134.5 111.3 38.6 67.1 259 261 A G T 3 S+ 0 0 50 -144,-1.7 -1,-0.3 -2,-0.1 -143,-0.1 0.579 125.6 68.0 74.3 9.2 111.6 34.9 66.5 260 262 A N < + 0 0 86 -3,-2.3 4,-0.3 2,-0.0 -2,-0.1 -0.310 51.6 144.3-155.7 58.1 115.2 35.4 65.5 261 263 A W > + 0 0 36 1,-0.2 4,-1.3 2,-0.2 3,-0.5 0.636 53.0 83.5 -77.3 -17.2 117.2 36.5 68.6 262 264 A E T >4 S+ 0 0 137 1,-0.2 3,-0.8 2,-0.2 -1,-0.2 0.947 97.4 39.9 -52.9 -54.3 120.5 34.7 67.7 263 265 A P T 3> S+ 0 0 50 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.661 108.7 63.8 -71.1 -14.3 121.7 37.5 65.5 264 266 A E H 3> S+ 0 0 0 -3,-0.5 4,-2.3 -4,-0.3 5,-0.2 0.752 90.0 69.3 -79.6 -23.9 120.4 40.1 67.9 265 267 A K H < S+ 0 0 36 -4,-0.5 3,-1.3 2,-0.2 4,-0.2 0.958 109.1 41.6 -73.1 -51.6 124.2 43.5 68.4 268 270 A R H >< S+ 0 0 0 -4,-2.3 3,-2.0 1,-0.3 -1,-0.2 0.852 106.7 64.8 -65.0 -32.3 123.1 44.2 72.0 269 271 A D G >< S+ 0 0 70 -4,-2.2 3,-0.6 1,-0.3 -1,-0.3 0.652 93.7 62.1 -65.3 -14.1 126.5 43.1 73.3 270 272 A Q G < S+ 0 0 134 -3,-1.3 -1,-0.3 -4,-0.3 3,-0.2 0.561 101.5 53.1 -86.6 -8.8 128.1 46.0 71.4 271 273 A Y G X + 0 0 54 -3,-2.0 3,-2.0 -4,-0.2 -1,-0.2 -0.014 59.8 122.3-118.2 32.4 126.1 48.5 73.5 272 274 A Q G X + 0 0 110 -3,-0.6 3,-1.4 1,-0.3 -95,-0.2 0.754 66.8 75.4 -62.3 -20.8 126.9 47.5 77.0 273 275 A H G 3 S+ 0 0 98 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.468 70.5 83.7 -71.9 0.3 128.2 51.1 77.4 274 276 A F G < + 0 0 4 -3,-2.0 -1,-0.3 2,-0.1 -2,-0.1 0.484 62.9 128.7 -79.7 -0.9 124.5 52.3 77.5 275 277 A I S < S- 0 0 28 -3,-1.4 2,-0.8 1,-0.1 26,-0.2 -0.271 71.0-113.7 -54.5 134.2 124.7 51.5 81.2 276 278 A V B +k 301 0D 0 24,-2.4 26,-2.2 -102,-0.1 29,-0.2 -0.650 53.4 162.1 -77.3 110.6 123.5 54.5 83.2 277 279 A D > - 0 0 36 -2,-0.8 4,-2.2 24,-0.2 5,-0.2 -0.665 54.2 -92.2-122.5 178.9 126.6 55.7 85.1 278 280 A E H > S+ 0 0 132 1,-0.2 4,-2.0 -2,-0.2 5,-0.1 0.866 119.8 58.3 -59.9 -39.8 127.8 58.7 87.0 279 281 A R H > S+ 0 0 122 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.947 109.6 43.5 -56.3 -51.1 129.5 60.2 83.9 280 282 A K H >4 S+ 0 0 7 1,-0.2 3,-1.4 2,-0.2 4,-0.4 0.926 114.4 48.3 -62.1 -47.4 126.2 60.2 82.0 281 283 A M H >< S+ 0 0 28 -4,-2.2 3,-1.2 1,-0.3 6,-0.3 0.788 101.2 66.2 -65.1 -26.0 124.1 61.6 84.9 282 284 A A H 3< S+ 0 0 82 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.731 95.9 58.4 -66.5 -20.3 126.8 64.3 85.4 283 285 A L T << S+ 0 0 64 -3,-1.4 -40,-2.3 -4,-0.6 -1,-0.3 0.658 94.0 86.2 -81.9 -17.9 125.7 65.6 82.0 284 286 A T S < S- 0 0 16 -3,-1.2 2,-1.5 -4,-0.4 -39,-0.2 -0.209 96.5 -98.9 -79.5 172.6 122.1 66.1 83.1 285 287 A N S S- 0 0 106 -41,-2.4 -1,-0.1 -44,-0.2 3,-0.1 -0.446 83.1 -68.5 -88.8 60.4 120.6 69.1 84.9 286 288 A N S S- 0 0 126 -2,-1.5 -1,-0.2 -5,-0.3 -41,-0.1 0.896 89.4-179.1 54.5 39.7 120.8 67.4 88.3 287 289 A G - 0 0 3 -43,-0.4 -41,-0.3 -6,-0.3 2,-0.2 -0.211 25.7-113.9 -73.0 160.7 118.2 65.1 86.9 288 290 A V E -i 246 0C 1 -43,-2.1 -41,-2.0 -3,-0.1 2,-0.4 -0.546 23.2-149.1 -90.3 158.9 116.5 62.2 88.6 289 291 A F E +ij 247 311C 2 21,-2.2 23,-2.4 -2,-0.2 24,-0.4 -0.961 20.6 164.4-128.1 144.9 116.9 58.5 87.6 290 292 A S E -i 248 0C 2 -43,-1.6 -41,-1.6 -2,-0.4 2,-0.3 -0.971 16.0-167.1-153.9 165.8 114.4 55.7 87.8 291 293 A H - 0 0 1 -2,-0.3 26,-0.1 -43,-0.2 -41,-0.1 -0.965 31.4-124.4-153.5 147.9 113.7 52.2 86.6 292 294 A C - 0 0 10 -43,-0.5 3,-0.1 -2,-0.3 -42,-0.1 0.729 68.5-113.1 -68.1 -23.1 110.6 50.1 86.8 293 295 A L S S+ 0 0 29 1,-0.2 2,-0.1 -3,-0.0 -1,-0.0 0.287 91.0 101.0 72.4 152.2 112.5 47.2 88.5 294 296 A P - 0 0 94 0, 0.0 2,-0.5 0, 0.0 -1,-0.2 0.499 63.2-175.6 -72.4 144.2 113.8 44.5 88.7 295 297 A L - 0 0 27 -2,-0.1 2,-0.8 -3,-0.1 -4,-0.0 -0.950 26.5-136.8-120.7 129.1 117.2 46.0 87.9 296 298 A R >>> - 0 0 124 -2,-0.5 4,-2.4 1,-0.0 3,-1.4 -0.701 32.8-128.7 -81.5 110.2 120.5 44.2 87.4 297 299 A R B 345S+l 301 0D 105 -2,-0.8 5,-0.2 1,-0.2 -1,-0.0 -0.334 86.3 11.8 -63.7 138.5 123.1 46.3 89.2 298 300 A N T 345S+ 0 0 85 3,-3.1 -1,-0.2 -22,-0.1 4,-0.2 0.682 125.0 63.9 67.1 21.6 126.2 47.4 87.3 299 301 A V T <45S+ 0 0 44 -3,-1.4 -122,-0.5 2,-0.6 -2,-0.2 0.486 115.8 18.4-132.5 -55.9 124.6 46.2 84.1 300 302 A X T <5S- 0 0 11 -4,-2.4 -24,-2.4 1,-0.4 2,-0.3 0.817 144.5 -4.0 -88.0 -35.9 121.6 48.5 83.6 301 303 A A B - 0 0 26 -26,-2.2 4,-2.6 -2,-0.3 3,-0.4 -0.326 32.0-110.4 -74.0 160.0 125.9 51.3 88.3 303 305 A D H > S+ 0 0 62 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.889 118.6 57.9 -54.8 -41.9 125.6 51.0 92.1 304 306 A A H 4 S+ 0 0 41 1,-0.2 -1,-0.2 2,-0.2 4,-0.2 0.877 110.1 42.1 -58.1 -41.3 126.6 54.7 92.4 305 307 A V H >4 S+ 0 0 7 -3,-0.4 3,-1.1 -29,-0.2 -2,-0.2 0.927 114.5 51.1 -72.3 -45.4 123.6 55.7 90.2 306 308 A M H 3< S+ 0 0 26 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.850 116.6 39.8 -60.7 -37.3 121.2 53.3 91.9 307 309 A D T 3< S+ 0 0 107 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.352 89.6 120.0 -96.5 7.2 122.1 54.4 95.4 308 310 A S S X S- 0 0 40 -3,-1.1 3,-2.2 -4,-0.2 -19,-0.1 -0.371 75.6-121.2 -68.7 148.0 122.3 58.1 94.5 309 311 A P T 3 S+ 0 0 128 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.683 113.6 64.6 -64.5 -12.6 119.9 60.5 96.3 310 312 A N T 3 S+ 0 0 41 -5,-0.1 -21,-2.2 -22,-0.1 2,-0.6 0.414 78.2 99.4 -89.2 0.4 118.7 61.3 92.8 311 313 A C B < +j 289 0C 24 -3,-2.2 3,-0.2 -23,-0.2 -21,-0.2 -0.806 43.6 175.2 -91.1 119.9 117.4 57.8 92.2 312 314 A I > + 0 0 11 -23,-2.4 4,-2.5 -2,-0.6 3,-0.4 0.187 41.5 116.4-109.2 16.6 113.6 57.7 92.9 313 315 A A H > S+ 0 0 2 -24,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.818 76.2 51.5 -55.1 -35.8 113.0 54.1 91.8 314 316 A I H > S+ 0 0 125 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.871 110.6 48.5 -72.2 -34.3 111.9 53.0 95.3 315 317 A D H > S+ 0 0 77 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.899 111.7 48.8 -69.9 -40.4 109.4 55.9 95.5 316 318 A E H X S+ 0 0 1 -4,-2.5 4,-0.6 2,-0.2 -2,-0.2 0.910 110.7 53.0 -64.1 -39.1 108.0 55.0 92.1 317 319 A A H >< S+ 0 0 33 -4,-2.1 3,-1.5 -5,-0.3 4,-0.5 0.938 107.8 49.4 -61.4 -47.6 107.8 51.4 93.3 318 320 A E H >X S+ 0 0 91 -4,-2.4 3,-1.9 1,-0.3 4,-0.7 0.926 102.3 63.6 -57.4 -43.5 105.8 52.4 96.3 319 321 A N H 3X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.3 5,-0.3 0.637 82.2 77.0 -59.3 -14.9 103.4 54.4 94.2 320 322 A R H S+ 0 0 28 -3,-1.9 4,-1.5 -4,-0.5 -1,-0.2 0.952 112.6 42.9 -61.2 -50.9 100.2 50.6 95.5 322 324 A H H X S+ 0 0 8 -4,-0.7 4,-1.7 1,-0.2 -2,-0.2 0.881 114.9 46.4 -66.9 -43.0 98.6 54.0 95.5 323 325 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.860 110.6 53.3 -70.8 -34.1 97.8 54.4 91.8 324 326 A Q H X S+ 0 0 1 -4,-1.7 4,-2.7 -5,-0.3 5,-0.2 0.866 107.1 52.0 -69.0 -33.0 96.4 50.9 91.6 325 327 A K H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 5,-0.2 0.924 109.5 50.1 -66.9 -41.2 94.0 51.6 94.5 326 328 A A H X S+ 0 0 2 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.899 111.8 48.9 -62.0 -40.0 92.9 54.8 92.6 327 329 A I H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.950 113.1 45.0 -65.5 -50.5 92.3 52.7 89.5 328 330 A M H X S+ 0 0 0 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.931 113.6 50.4 -60.2 -45.8 90.3 50.0 91.3 329 331 A A H < S+ 0 0 21 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.870 110.8 50.2 -60.5 -37.1 88.2 52.5 93.2 330 332 A A H < S+ 0 0 57 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.871 110.0 49.7 -70.1 -36.7 87.5 54.4 90.0 331 333 A L H < 0 0 19 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.735 360.0 360.0 -77.3 -24.8 86.3 51.3 88.1 332 334 A V < 0 0 75 -4,-1.6 -226,-0.0 -5,-0.2 -298,-0.0 -0.536 360.0 360.0 -85.6 360.0 83.9 50.0 90.7