==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 04-DEC-10 3PUE . COMPND 2 MOLECULE: DIHYDRODIPICOLINATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ACINETOBACTER BAUMANNII; . AUTHOR O.JITHESH,S.YAMINI,N.KAUR,A.GAUTAM,R.TEWARI,G.S.KUSHWAHA,P.K . 583 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21762.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 424 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 75 12.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 34 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 218 37.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.6 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 2 3 1 3 2 1 2 3 5 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 6 6 2 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 . 2 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 . 0 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A T 0 0 166 0, 0.0 2,-0.9 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -35.5 41.8 5.1 -11.4 2 2 A I + 0 0 31 2,-0.0 2,-0.2 199,-0.0 36,-0.1 -0.790 360.0 173.6 -77.3 116.9 40.5 3.4 -14.5 3 3 A Q + 0 0 92 -2,-0.9 198,-0.2 34,-0.1 2,-0.1 -0.762 17.6 12.9-128.0 167.4 36.8 3.9 -13.6 4 4 A G E S+a 201 0A 4 196,-1.4 198,-2.4 -2,-0.2 2,-0.9 -0.360 100.0 10.5 79.4-148.2 33.3 3.5 -14.9 5 5 A S E -a 202 0A 0 196,-0.2 32,-1.6 30,-0.2 33,-1.2 -0.668 59.8-177.0 -80.6 103.6 31.9 1.7 -17.9 6 6 A I E -ab 203 38A 0 196,-2.1 198,-1.6 -2,-0.9 2,-0.2 -0.877 16.5-145.7-105.9 105.0 34.5 -0.5 -19.4 7 7 A V E -ab 204 39A 0 31,-1.6 33,-2.6 -2,-0.7 2,-1.3 -0.513 7.0-145.6 -74.7 131.8 33.2 -2.3 -22.6 8 8 A A E - b 0 40A 4 196,-2.8 2,-0.2 -2,-0.2 200,-0.1 -0.823 38.0-145.5 -91.6 90.0 34.6 -5.8 -23.2 9 9 A I - 0 0 2 -2,-1.3 33,-0.5 31,-1.2 34,-0.4 -0.424 2.2-126.7 -75.2 135.5 34.5 -5.1 -26.9 10 10 A V - 0 0 0 -2,-0.2 36,-0.3 195,-0.1 -1,-0.1 -0.211 19.2-121.5 -67.6 158.8 33.7 -7.7 -29.5 11 11 A T - 0 0 1 34,-0.5 -1,-0.1 30,-0.1 10,-0.1 -0.905 32.5-136.8-107.4 100.4 36.0 -8.3 -32.5 12 12 A P - 0 0 0 0, 0.0 8,-2.6 0, 0.0 2,-0.3 -0.254 25.1-166.5 -56.9 138.5 33.8 -7.7 -35.5 13 13 A M B -Ij 19 264B 0 250,-0.5 252,-1.1 252,-0.4 250,-0.3 -0.959 19.7-120.8-135.3 152.7 34.1 -10.2 -38.4 14 14 A L > - 0 0 71 4,-2.6 3,-3.3 -2,-0.3 252,-0.2 -0.375 47.3 -93.1 -78.3 164.6 33.2 -10.6 -42.0 15 15 A K T 3 S+ 0 0 151 1,-0.3 251,-0.3 250,-0.2 -1,-0.1 0.865 129.3 54.7 -46.3 -42.0 31.0 -13.6 -43.1 16 16 A D T 3 S- 0 0 122 249,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.465 123.2-106.4 -75.0 -0.9 34.2 -15.6 -43.9 17 17 A G S < S+ 0 0 5 -3,-3.3 2,-0.2 1,-0.3 -2,-0.1 0.558 71.7 142.0 88.7 8.8 35.4 -14.9 -40.3 18 18 A G - 0 0 18 1,-0.1 -4,-2.6 248,-0.1 2,-0.4 -0.538 65.5 -92.4 -81.4 150.8 38.1 -12.4 -41.1 19 19 A V B -I 13 0B 11 -6,-0.2 2,-1.5 -2,-0.2 -6,-0.3 -0.471 35.2-141.9 -62.8 118.8 38.6 -9.5 -38.7 20 20 A D > - 0 0 22 -8,-2.6 4,-1.7 -2,-0.4 5,-0.1 -0.665 22.8-177.3 -84.7 88.5 36.4 -6.7 -40.1 21 21 A W H > S+ 0 0 80 -2,-1.5 4,-2.8 1,-0.2 3,-0.3 0.933 74.1 50.1 -52.1 -59.0 38.8 -3.8 -39.4 22 22 A K H > S+ 0 0 165 1,-0.3 4,-2.4 2,-0.2 5,-0.3 0.934 110.0 49.7 -51.2 -53.8 36.6 -0.9 -40.6 23 23 A S H > S+ 0 0 27 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.874 110.2 53.1 -54.8 -35.1 33.5 -2.0 -38.6 24 24 A L H >X S+ 0 0 1 -4,-1.7 4,-2.0 -3,-0.3 3,-1.3 0.992 107.1 52.2 -59.9 -57.0 35.8 -2.3 -35.6 25 25 A E H 3X S+ 0 0 70 -4,-2.8 4,-2.3 1,-0.3 5,-0.3 0.875 106.2 52.0 -43.7 -52.2 37.0 1.3 -36.2 26 26 A K H 3X S+ 0 0 166 -4,-2.4 4,-2.5 1,-0.2 -1,-0.3 0.846 110.2 52.3 -57.9 -31.4 33.4 2.6 -36.3 27 27 A L H S+ 0 0 0 -4,-3.3 4,-1.1 1,-0.2 5,-1.0 0.924 108.0 53.4 -65.1 -45.2 32.1 4.1 -28.0 32 32 A I H <5S+ 0 0 29 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.766 114.6 43.1 -61.8 -26.2 34.4 7.1 -27.4 33 33 A E H <5S+ 0 0 125 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.755 109.0 56.2 -90.5 -27.6 31.5 9.4 -28.4 34 34 A Q H <5S- 0 0 66 -4,-1.8 -2,-0.2 -5,-0.2 181,-0.2 0.602 121.9 -94.9 -81.2 -12.8 28.7 7.6 -26.5 35 35 A G T <5 + 0 0 32 -4,-1.1 -30,-0.2 1,-0.3 -3,-0.1 0.123 65.1 156.3 124.4 -25.4 30.4 7.9 -23.1 36 36 A T < - 0 0 5 -5,-1.0 -1,-0.3 -6,-0.2 -30,-0.1 -0.053 33.1-150.3 -39.0 128.5 32.2 4.6 -22.7 37 37 A N - 0 0 66 -32,-1.6 2,-0.3 1,-0.2 -31,-0.2 0.750 65.0 -17.1 -79.0 -26.9 35.0 5.2 -20.2 38 38 A S E -b 6 0A 1 -33,-1.2 -31,-1.6 33,-0.2 2,-0.4 -0.985 60.8-119.3-169.8 168.4 37.5 2.6 -21.5 39 39 A I E -bc 7 73A 1 33,-1.7 35,-3.9 -2,-0.3 2,-0.6 -0.966 1.6-153.9-131.1 139.4 38.0 -0.5 -23.6 40 40 A V E -bc 8 74A 1 -33,-2.6 -31,-1.2 -2,-0.4 2,-0.4 -0.937 24.3-158.1-104.5 116.9 39.1 -4.1 -23.1 41 41 A A E + c 0 75A 0 33,-2.8 35,-3.1 -2,-0.6 -31,-0.1 -0.844 66.0 3.4-103.2 133.5 40.5 -5.5 -26.4 42 42 A V S S+ 0 0 1 -33,-0.5 -1,-0.2 -2,-0.4 2,-0.2 0.927 89.5 138.5 63.0 47.8 40.7 -9.2 -27.2 43 43 A G S > >S- 0 0 11 -34,-0.4 5,-1.6 -3,-0.4 3,-0.9 -0.354 77.2 -71.1-102.2-168.5 39.1 -10.4 -24.0 44 44 A T G > 5S+ 0 0 14 1,-0.3 3,-1.6 3,-0.2 5,-0.2 0.905 138.3 50.0 -52.0 -45.5 36.6 -13.2 -23.9 45 45 A T G 3 5S+ 0 0 3 1,-0.3 -34,-0.5 2,-0.1 -1,-0.3 0.744 107.5 54.5 -67.2 -24.2 34.0 -11.1 -25.6 46 46 A G G < 5S- 0 0 0 -3,-0.9 -1,-0.3 -36,-0.3 -2,-0.2 0.070 118.2-113.2 -96.9 22.5 36.5 -10.2 -28.2 47 47 A E T X 5 + 0 0 5 -3,-1.6 3,-1.1 1,-0.1 4,-0.4 0.831 49.6 170.4 49.5 46.5 37.1 -13.9 -28.9 48 48 A A G > - 0 0 53 -2,-0.5 4,-1.9 1,-0.1 3,-0.4 -0.167 31.9-105.5 -59.5 157.6 45.9 -15.8 -33.9 53 53 A M H > S+ 0 0 97 1,-0.3 4,-1.3 2,-0.2 -1,-0.1 0.737 124.9 49.7 -57.8 -23.5 48.7 -14.3 -31.8 54 54 A E H > S+ 0 0 129 2,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.802 106.9 52.7 -85.7 -32.5 49.2 -11.8 -34.7 55 55 A E H > S+ 0 0 33 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.794 105.0 58.0 -71.3 -25.4 45.6 -11.0 -34.9 56 56 A H H X S+ 0 0 24 -4,-1.9 4,-3.0 2,-0.2 5,-0.2 0.981 111.6 40.2 -63.0 -56.5 45.7 -10.2 -31.1 57 57 A T H X S+ 0 0 42 -4,-1.3 4,-3.1 1,-0.2 5,-0.2 0.954 116.2 49.2 -55.8 -57.9 48.4 -7.6 -31.7 58 58 A Q H X S+ 0 0 72 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.860 115.2 45.0 -53.7 -38.7 46.9 -6.2 -34.9 59 59 A V H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.918 113.4 48.4 -73.3 -42.4 43.5 -5.9 -33.2 60 60 A I H X S+ 0 0 8 -4,-3.0 4,-2.0 -5,-0.2 -2,-0.2 0.891 114.1 49.8 -61.8 -39.6 44.9 -4.4 -30.0 61 61 A K H X S+ 0 0 108 -4,-3.1 4,-3.2 2,-0.2 5,-0.2 0.910 106.4 51.8 -65.2 -49.7 46.9 -2.0 -32.1 62 62 A E H X S+ 0 0 40 -4,-2.1 4,-2.8 -5,-0.2 5,-0.2 0.927 112.3 48.4 -55.0 -45.1 44.0 -0.8 -34.3 63 63 A I H X S+ 0 0 2 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.908 112.1 46.9 -64.8 -44.3 42.0 -0.0 -31.2 64 64 A I H X S+ 0 0 34 -4,-2.0 4,-2.2 2,-0.2 5,-0.4 0.949 113.5 50.0 -64.3 -45.5 44.9 1.9 -29.5 65 65 A R H < S+ 0 0 137 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.938 114.5 42.9 -55.4 -51.1 45.5 3.8 -32.7 66 66 A V H < S+ 0 0 12 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.828 110.0 56.7 -68.2 -32.3 41.8 4.8 -33.1 67 67 A A H < S- 0 0 0 -4,-2.4 3,-0.5 -5,-0.2 -1,-0.2 0.965 87.9-161.7 -62.1 -50.0 41.4 5.6 -29.4 68 68 A N < - 0 0 111 -4,-2.2 -3,-0.1 1,-0.2 -4,-0.1 0.975 63.0 -58.8 65.2 59.0 44.2 8.1 -29.7 69 69 A K S S+ 0 0 210 -5,-0.4 -1,-0.2 1,-0.1 -4,-0.1 0.610 111.0 118.3 49.0 15.6 45.0 8.4 -26.0 70 70 A R S S+ 0 0 111 -3,-0.5 -1,-0.1 1,-0.2 -2,-0.1 0.863 80.9 10.3 -78.4 -38.5 41.4 9.5 -25.4 71 71 A I S S- 0 0 23 -32,-0.0 -1,-0.2 0, 0.0 -33,-0.2 -0.971 93.4 -96.5-135.1 150.5 40.3 6.7 -23.1 72 72 A P - 0 0 40 0, 0.0 -33,-1.7 0, 0.0 2,-0.5 -0.404 36.8-147.1 -68.8 148.9 42.5 4.1 -21.5 73 73 A I E -c 39 0A 4 -35,-0.2 25,-1.6 -2,-0.1 26,-1.2 -0.964 6.8-158.0-118.0 133.9 42.7 0.9 -23.4 74 74 A I E -cd 40 99A 0 -35,-3.9 -33,-2.8 -2,-0.5 2,-0.4 -0.920 9.0-144.3-111.3 133.5 43.1 -2.5 -21.6 75 75 A A E -cd 41 100A 1 24,-3.7 26,-2.7 -2,-0.4 2,-0.5 -0.833 12.5-131.4-101.8 130.2 44.5 -5.5 -23.4 76 76 A G E + d 0 101A 8 -35,-3.1 26,-0.2 -2,-0.4 -16,-0.1 -0.675 43.3 153.1 -74.4 121.4 43.3 -9.1 -22.7 77 77 A T + 0 0 6 24,-2.2 12,-0.3 -2,-0.5 25,-0.2 0.236 18.4 129.8-137.5 13.8 46.5 -11.0 -22.3 78 78 A G + 0 0 18 23,-1.0 2,-0.3 10,-0.1 26,-0.1 -0.337 24.0 164.2 -71.6 156.4 45.7 -14.0 -20.0 79 79 A A - 0 0 1 24,-0.4 6,-0.1 2,-0.1 -2,-0.0 -0.941 47.1-115.6-161.8 161.2 46.7 -17.5 -20.9 80 80 A N S S+ 0 0 9 -2,-0.3 2,-0.4 25,-0.2 261,-0.1 0.428 98.4 73.5 -88.7 3.4 46.9 -20.8 -19.0 81 81 A S S > S- 0 0 6 1,-0.1 4,-1.2 480,-0.1 5,-0.1 -0.924 71.2-151.0-111.2 139.1 50.7 -20.9 -19.6 82 82 A T H > S+ 0 0 7 478,-1.4 4,-2.5 -2,-0.4 5,-0.2 0.940 95.9 51.6 -77.5 -45.1 52.8 -18.6 -17.6 83 83 A R H > S+ 0 0 108 477,-0.4 4,-1.4 1,-0.2 -1,-0.2 0.928 115.5 45.4 -54.0 -44.5 55.7 -18.2 -20.0 84 84 A E H > S+ 0 0 68 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.753 108.4 53.5 -71.7 -29.0 53.0 -17.3 -22.7 85 85 A A H X S+ 0 0 0 -4,-1.2 4,-2.3 2,-0.2 5,-0.2 0.893 107.5 54.1 -72.6 -36.8 51.0 -14.9 -20.5 86 86 A I H X S+ 0 0 31 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.885 108.6 48.8 -62.0 -38.4 54.3 -13.1 -19.9 87 87 A E H X S+ 0 0 82 -4,-1.4 4,-2.7 -5,-0.2 5,-0.2 0.964 111.7 47.4 -66.6 -51.1 54.8 -12.8 -23.7 88 88 A L H X S+ 0 0 19 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.860 113.4 48.0 -58.0 -40.1 51.3 -11.5 -24.4 89 89 A T H X S+ 0 0 0 -4,-2.3 4,-2.3 -12,-0.3 -1,-0.2 0.891 110.6 51.8 -69.6 -38.4 51.5 -8.9 -21.6 90 90 A K H X S+ 0 0 96 -4,-1.8 4,-3.0 1,-0.2 5,-0.2 0.951 109.4 49.1 -62.0 -49.1 54.9 -7.8 -22.8 91 91 A A H X S+ 0 0 28 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.802 109.3 55.2 -59.3 -29.4 53.6 -7.4 -26.3 92 92 A A H <>S+ 0 0 4 -4,-1.3 5,-2.1 -5,-0.2 -1,-0.2 0.902 110.2 43.7 -70.8 -44.0 50.7 -5.4 -24.8 93 93 A K H ><5S+ 0 0 81 -4,-2.3 3,-4.0 1,-0.2 -2,-0.2 0.983 111.2 53.7 -63.5 -56.7 53.0 -3.0 -23.0 94 94 A D H 3<5S+ 0 0 126 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.727 106.2 53.9 -50.7 -25.2 55.3 -2.6 -26.1 95 95 A L T 3<5S- 0 0 44 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.2 0.403 120.7-115.2 -89.0 1.3 52.1 -1.7 -28.1 96 96 A G T < 5 + 0 0 46 -3,-4.0 2,-0.3 1,-0.2 -3,-0.2 0.920 53.5 166.6 68.2 43.9 51.5 0.9 -25.4 97 97 A A < - 0 0 5 -5,-2.1 -1,-0.2 1,-0.1 -23,-0.2 -0.656 39.5-131.3 -85.8 151.7 48.3 -0.4 -23.9 98 98 A D S S- 0 0 76 -25,-1.6 2,-0.3 -2,-0.3 -24,-0.2 0.828 78.2 -9.5 -74.7 -28.4 47.3 1.2 -20.7 99 99 A A E -d 74 0A 1 -26,-1.2 -24,-3.7 29,-0.1 2,-0.4 -0.985 60.3-122.9-162.0 168.0 46.7 -2.1 -18.9 100 100 A A E -de 75 130A 0 29,-2.0 31,-3.0 -2,-0.3 2,-0.6 -0.969 11.2-153.5-124.4 131.3 46.3 -5.9 -19.2 101 101 A L E -de 76 131A 6 -26,-2.7 -24,-2.2 -2,-0.4 -23,-1.0 -0.921 18.3-171.1-103.7 117.3 43.4 -8.0 -18.2 102 102 A L E - e 0 132A 0 29,-2.7 31,-1.2 -2,-0.6 -26,-0.1 -0.913 11.5-149.0-116.9 111.9 44.5 -11.5 -17.4 103 103 A V E - e 0 133A 8 -2,-0.6 -24,-0.4 29,-0.2 31,-0.2 -0.373 38.3 -92.5 -70.7 153.6 42.0 -14.4 -16.8 104 104 A T - 0 0 0 29,-1.8 -1,-0.1 1,-0.2 37,-0.1 -0.316 58.2 -80.5 -63.6 145.3 43.1 -17.1 -14.4 105 105 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 -25,-0.2 -0.257 57.6-149.0 -47.9 131.6 44.7 -20.0 -16.1 106 106 A Y + 0 0 27 -3,-0.1 2,-1.6 2,-0.1 34,-0.2 -0.733 62.6 12.0-106.0 156.5 41.9 -22.1 -17.4 107 107 A Y S S+ 0 0 16 32,-2.2 -1,-0.1 323,-0.7 324,-0.1 -0.136 110.8 72.0 75.7 -43.0 41.7 -25.8 -17.9 108 108 A N S S- 0 0 4 -2,-1.6 -1,-0.2 233,-0.0 -2,-0.1 0.415 87.9-142.0 -87.9 8.5 44.8 -26.8 -16.0 109 109 A K - 0 0 34 30,-0.4 430,-0.3 321,-0.2 -3,-0.1 0.844 21.0-161.8 37.2 57.8 43.3 -26.0 -12.6 110 110 A P - 0 0 4 0, 0.0 452,-0.1 0, 0.0 -1,-0.1 -0.244 20.5-107.1 -63.6 160.0 46.4 -24.5 -10.9 111 111 A T > - 0 0 24 450,-0.3 4,-2.6 428,-0.1 5,-0.2 -0.259 32.4-100.5 -78.0 172.5 46.4 -24.3 -7.1 112 112 A Q H > S+ 0 0 64 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.922 126.4 50.3 -59.7 -44.2 46.0 -21.1 -5.2 113 113 A E H > S+ 0 0 72 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.844 110.9 50.5 -62.2 -34.1 49.7 -20.9 -4.6 114 114 A G H > S+ 0 0 0 2,-0.2 4,-3.4 1,-0.2 -1,-0.2 0.902 107.6 50.9 -70.5 -42.4 50.2 -21.5 -8.3 115 115 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.888 111.9 50.8 -60.1 -36.9 47.8 -18.8 -9.2 116 116 A Y H X S+ 0 0 29 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.929 113.0 42.7 -67.2 -46.6 49.8 -16.6 -6.9 117 117 A Q H X S+ 0 0 60 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.896 112.6 56.1 -65.8 -39.2 53.1 -17.5 -8.5 118 118 A H H X S+ 0 0 0 -4,-3.4 4,-1.9 1,-0.2 -2,-0.2 0.962 114.2 36.7 -56.1 -58.1 51.5 -17.2 -11.9 119 119 A Y H X S+ 0 0 1 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.870 117.3 51.5 -65.2 -39.8 50.4 -13.6 -11.4 120 120 A K H X S+ 0 0 56 -4,-2.4 4,-2.4 -5,-0.2 5,-0.2 0.902 108.0 53.9 -64.3 -40.2 53.5 -12.6 -9.3 121 121 A A H X S+ 0 0 26 -4,-2.9 4,-2.0 -5,-0.2 -2,-0.2 0.941 111.7 44.1 -59.3 -48.6 55.7 -14.0 -12.1 122 122 A I H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.896 111.6 52.7 -65.3 -41.9 54.0 -11.8 -14.7 123 123 A A H < S+ 0 0 4 -4,-2.4 5,-0.2 1,-0.2 -1,-0.2 0.919 113.0 43.9 -60.6 -45.2 53.9 -8.7 -12.6 124 124 A E H < S+ 0 0 137 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.865 115.5 50.1 -67.4 -35.8 57.7 -8.9 -11.9 125 125 A A H < S+ 0 0 48 -4,-2.0 2,-0.4 -5,-0.2 -2,-0.2 0.788 113.4 43.3 -75.5 -32.4 58.4 -9.7 -15.6 126 126 A V < - 0 0 4 -4,-2.4 2,-1.4 -5,-0.1 -1,-0.1 -0.967 69.3-142.8-124.2 136.8 56.4 -6.9 -17.1 127 127 A E + 0 0 139 -2,-0.4 -3,-0.1 2,-0.1 -4,-0.1 -0.631 65.5 101.7 -93.6 76.0 56.2 -3.2 -16.1 128 128 A L S S- 0 0 13 -2,-1.4 2,-0.5 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138 138 A R H <4 S+ 0 0 14 -3,-2.1 261,-0.8 3,-0.1 -1,-0.2 0.826 125.6 43.6 -90.8 -36.0 34.7 -20.8 -17.7 139 139 A T H < S- 0 0 0 -4,-1.7 -32,-2.2 2,-0.3 -30,-0.4 0.749 87.9-130.2 -87.6 -28.3 38.0 -21.5 -16.2 140 140 A G S < S+ 0 0 24 -4,-2.1 2,-0.3 1,-0.3 -3,-0.1 0.356 81.8 86.5 91.6 -9.7 37.7 -24.5 -13.8 141 141 A V - 0 0 12 -37,-0.1 2,-0.5 -6,-0.1 -1,-0.3 -0.906 62.7-152.0-123.8 154.4 39.5 -22.5 -11.1 142 142 A D - 0 0 69 -2,-0.3 2,-0.4 -3,-0.1 -8,-0.1 -0.950 13.9-143.6-128.6 108.2 38.3 -20.1 -8.5 143 143 A L - 0 0 3 -2,-0.5 2,-0.1 1,-0.1 -9,-0.0 -0.606 29.5-129.6 -70.0 123.0 40.8 -17.4 -7.4 144 144 A S > - 0 0 37 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.421 10.7-120.5 -78.1 152.2 40.0 -17.0 -3.7 145 145 A N H > S+ 0 0 31 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.933 116.7 55.8 -51.8 -47.5 39.4 -13.6 -2.0 146 146 A D H > S+ 0 0 128 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.927 108.9 44.6 -49.2 -55.1 42.3 -14.5 0.2 147 147 A T H > S+ 0 0 10 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.881 111.8 52.2 -60.6 -41.7 44.6 -15.1 -2.8 148 148 A A H X S+ 0 0 2 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.890 109.2 50.8 -61.1 -40.7 43.4 -11.9 -4.5 149 149 A V H < S+ 0 0 33 -4,-2.8 4,-0.4 -5,-0.2 -1,-0.2 0.891 107.1 54.5 -64.4 -38.8 44.2 -10.0 -1.3 150 150 A R H >< S+ 0 0 115 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.881 110.8 45.1 -60.0 -41.8 47.7 -11.6 -1.3 151 151 A L H >< S+ 0 0 0 -4,-2.0 3,-2.5 1,-0.2 6,-0.3 0.781 94.0 77.0 -74.5 -28.7 48.3 -10.3 -4.8 152 152 A A T 3< S+ 0 0 8 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.707 84.4 69.0 -55.6 -18.5 46.9 -6.9 -4.0 153 153 A E T < S+ 0 0 117 -3,-0.9 -1,-0.3 -4,-0.4 -2,-0.2 0.739 76.3 92.8 -71.2 -25.7 50.3 -6.3 -2.3 154 154 A I S X S- 0 0 28 -3,-2.5 3,-2.3 -4,-0.2 -3,-0.0 -0.626 79.7-136.8 -74.4 114.8 52.1 -6.3 -5.6 155 155 A P T 3 S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.771 98.2 44.5 -40.5 -42.1 52.3 -2.6 -6.7 156 156 A N T 3 S+ 0 0 23 -27,-0.1 -26,-3.7 1,-0.1 2,-1.1 0.344 86.3 90.6 -97.5 8.5 51.4 -3.3 -10.4 157 157 A I E < +f 130 0A 2 -3,-2.3 -26,-0.2 -6,-0.3 -1,-0.1 -0.879 55.0 166.8 -90.8 96.8 48.5 -5.7 -9.8 158 158 A V E - 0 0 55 -28,-1.6 24,-2.7 -2,-1.1 2,-0.3 0.519 45.6 -2.3 -96.9 -5.0 46.0 -2.9 -9.7 159 159 A G E -fg 131 182A 0 -29,-1.2 -27,-3.4 22,-0.3 2,-0.3 -0.997 48.0-135.4-170.3 175.9 42.6 -4.6 -10.0 160 160 A I E -fg 132 183A 6 22,-1.3 24,-2.8 -2,-0.3 2,-0.7 -0.987 15.0-140.3-149.3 133.5 40.4 -7.6 -10.4 161 161 A K E -fg 133 184A 10 -29,-3.2 -27,-2.4 -2,-0.3 2,-0.8 -0.853 20.7-156.8 -95.0 115.1 37.4 -8.3 -12.6 162 162 A D E +fg 134 185A 10 22,-3.1 24,-2.0 -2,-0.7 25,-0.4 -0.849 22.6 167.1 -97.3 103.8 35.0 -10.3 -10.4 163 163 A A + 0 0 19 -29,-2.2 -1,-0.1 -2,-0.8 -28,-0.1 0.349 48.9 101.5 -96.3 3.9 32.7 -12.2 -12.7 164 164 A T S S- 0 0 45 -30,-0.2 -1,-0.2 1,-0.1 3,-0.1 0.919 73.8-146.0 -53.7 -46.6 31.3 -14.5 -10.0 165 165 A G + 0 0 23 -3,-0.3 2,-1.1 1,-0.3 -1,-0.1 0.465 55.7 134.8 87.7 1.3 28.1 -12.4 -9.8 166 166 A D > - 0 0 75 1,-0.2 4,-1.8 2,-0.1 -1,-0.3 -0.747 36.5-172.4 -86.0 97.8 28.2 -13.3 -6.1 167 167 A V H > S+ 0 0 28 -2,-1.1 4,-2.6 2,-0.2 5,-0.3 0.943 79.4 49.4 -59.7 -55.6 27.5 -10.0 -4.5 168 168 A P H > S+ 0 0 92 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.916 114.0 48.4 -51.1 -44.3 28.1 -10.8 -0.8 169 169 A R H > S+ 0 0 47 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.855 111.0 52.1 -63.1 -36.2 31.4 -12.4 -1.8 170 170 A G H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.871 108.9 47.6 -70.0 -37.7 32.2 -9.2 -3.8 171 171 A K H X S+ 0 0 95 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.914 110.6 53.4 -68.4 -41.3 31.5 -6.9 -0.9 172 172 A A H X S+ 0 0 48 -4,-2.3 4,-3.1 -5,-0.3 -2,-0.2 0.933 110.1 48.3 -57.8 -45.7 33.6 -9.1 1.3 173 173 A L H X S+ 0 0 2 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.895 111.0 49.3 -62.0 -42.7 36.4 -8.8 -1.2 174 174 A I H < S+ 0 0 27 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.918 115.7 43.4 -65.0 -43.6 36.1 -5.0 -1.5 175 175 A D H < S+ 0 0 103 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.941 107.8 57.8 -68.1 -46.2 36.1 -4.6 2.2 176 176 A A H < S+ 0 0 61 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.801 112.5 46.6 -54.1 -32.8 39.0 -7.1 2.8 177 177 A L S < S- 0 0 1 -4,-1.4 2,-0.3 -5,-0.2 -28,-0.0 -0.203 77.9-154.6 -89.5-166.3 41.1 -4.9 0.5 178 178 A N S > S- 0 0 125 -2,-0.1 2,-3.8 3,-0.1 3,-1.2 -0.652 70.1 -48.8-149.0-167.5 41.2 -1.2 0.9 179 179 A G T 3 S+ 0 0 91 1,-0.3 3,-0.2 -2,-0.3 -5,-0.0 0.070 107.4 120.9 -63.2 38.2 42.0 0.9 -2.1 180 180 A K T 3 S- 0 0 101 -2,-3.8 2,-0.3 1,-0.4 -1,-0.3 0.904 89.2 -13.1 -66.8 -38.5 44.8 -1.7 -2.2 181 181 A M S < S- 0 0 10 -3,-1.2 -1,-0.4 -7,-0.1 -22,-0.3 -0.969 81.9-102.4-160.0 147.7 43.5 -2.7 -5.6 182 182 A A E -g 159 0A 12 -24,-2.7 -22,-1.3 -2,-0.3 2,-0.4 -0.324 23.5-143.3 -74.9 158.7 40.4 -1.9 -7.5 183 183 A V E -g 160 0A 3 15,-0.2 17,-2.8 -24,-0.2 18,-0.5 -0.992 14.5-168.6-124.8 125.8 37.4 -4.2 -8.0 184 184 A Y E -g 161 0A 5 -24,-2.8 -22,-3.1 -2,-0.4 18,-0.2 -0.946 23.4-119.6-117.1 135.0 35.5 -4.3 -11.3 185 185 A S E -gh 162 202A 1 16,-2.3 18,-2.3 -2,-0.4 -22,-0.2 -0.419 24.0-178.8 -70.7 145.8 32.2 -6.1 -11.9 186 186 A G + 0 0 21 -24,-2.0 2,-0.5 16,-0.2 -23,-0.2 0.240 65.7 78.8-125.6 6.5 32.2 -8.8 -14.5 187 187 A D >> - 0 0 39 -25,-0.4 4,-2.1 1,-0.2 3,-1.6 -0.828 61.1-164.2-121.6 91.7 28.5 -9.6 -14.1 188 188 A D H 3> S+ 0 0 3 -2,-0.5 4,-0.6 1,-0.3 3,-0.3 0.849 88.4 58.9 -38.8 -49.8 26.3 -7.1 -16.0 189 189 A E H 34 S+ 0 0 114 51,-0.2 -1,-0.3 1,-0.2 4,-0.1 0.832 120.7 24.2 -53.5 -38.9 23.2 -8.3 -14.1 190 190 A T H X> S+ 0 0 18 -3,-1.6 4,-1.9 1,-0.1 3,-1.1 0.501 92.7 102.2-106.2 -7.0 24.7 -7.5 -10.6 191 191 A A H 3X S+ 0 0 2 -4,-2.1 4,-2.7 1,-0.3 5,-0.2 0.827 76.0 58.5 -45.9 -44.4 27.2 -4.8 -11.6 192 192 A W H 3X S+ 0 0 35 -4,-0.6 4,-1.6 1,-0.2 -1,-0.3 0.895 110.3 43.9 -57.4 -39.1 25.0 -1.9 -10.4 193 193 A E H <> S+ 0 0 70 -3,-1.1 4,-1.6 2,-0.2 -1,-0.2 0.888 111.0 53.1 -71.6 -41.6 24.9 -3.4 -6.9 194 194 A L H <>S+ 0 0 8 -4,-1.9 5,-2.3 1,-0.2 -2,-0.2 0.920 111.6 47.5 -60.1 -42.6 28.6 -4.2 -6.8 195 195 A M H ><5S+ 0 0 1 -4,-2.7 3,-1.3 1,-0.2 -1,-0.2 0.843 106.7 55.0 -68.4 -35.3 29.4 -0.6 -7.8 196 196 A L H 3<5S+ 0 0 30 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.836 109.3 51.5 -64.8 -29.7 27.0 0.8 -5.1 197 197 A L T 3<5S- 0 0 60 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.375 137.4 -78.0 -88.0 1.7 29.0 -1.3 -2.7 198 198 A G T < 5S+ 0 0 22 -3,-1.3 -3,-0.2 1,-0.3 -15,-0.2 0.144 78.0 143.5 128.3 -27.5 32.4 0.1 -3.8 199 199 A A < - 0 0 0 -5,-2.3 -1,-0.3 1,-0.1 -15,-0.2 -0.155 48.5-134.6 -46.6 146.0 33.4 -1.6 -7.1 200 200 A D - 0 0 42 -17,-2.8 -196,-1.4 1,-0.1 2,-0.3 0.300 66.0 -37.8 -92.3 7.8 35.2 0.9 -9.3 201 201 A G E -a 4 0A 0 -18,-0.5 -16,-2.3 -198,-0.2 2,-0.4 -0.945 61.4 -92.7 159.7-175.7 33.4 0.2 -12.6 202 202 A N E -ah 5 185A 0 -198,-2.4 -196,-2.1 -2,-0.3 2,-1.6 -0.959 12.4-147.3-138.9 117.7 32.0 -2.6 -14.7 203 203 A I E -a 6 0A 3 -18,-2.3 -196,-0.2 -2,-0.4 2,-0.2 -0.696 45.9-159.6 -82.0 93.1 33.8 -4.5 -17.5 204 204 A S E -a 7 0A 0 -2,-1.6 -196,-2.8 -198,-1.6 -18,-0.0 -0.447 45.0-174.9 -89.8 147.1 30.5 -4.8 -19.4 205 205 A V S > S+ 0 0 13 -198,-0.2 3,-2.2 -2,-0.2 4,-0.3 0.785 96.4 56.1 -95.3 -45.8 29.1 -7.0 -22.2 206 206 A T G >> S+ 0 0 0 1,-0.3 3,-2.5 2,-0.2 4,-1.8 0.803 89.8 75.3 -55.9 -31.1 26.0 -5.0 -22.4 207 207 A A G 34 S+ 0 0 0 1,-0.3 -1,-0.3 2,-0.2 -200,-0.1 0.721 80.4 73.1 -56.2 -20.9 28.1 -1.8 -23.0 208 208 A N G <4 S+ 0 0 1 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.778 114.8 20.3 -64.9 -24.9 28.6 -3.2 -26.6 209 209 A I T <4 S+ 0 0 2 -3,-2.5 -2,-0.2 -4,-0.3 -1,-0.2 0.566 135.0 34.6-122.0 -12.8 25.0 -2.3 -27.4 210 210 A A X + 0 0 3 -4,-1.8 4,-2.3 1,-0.1 5,-0.2 -0.438 64.7 152.1-137.2 60.2 24.0 0.3 -24.8 211 211 A P H > S+ 0 0 2 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.938 76.0 43.6 -59.3 -48.6 27.2 2.3 -24.1 212 212 A K H > S+ 0 0 112 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.948 114.7 49.9 -62.5 -47.9 25.5 5.6 -23.1 213 213 A A H > S+ 0 0 28 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.886 114.6 45.0 -58.5 -38.9 22.9 3.9 -20.9 214 214 A M H X S+ 0 0 3 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.818 107.9 57.0 -74.8 -32.9 25.7 1.9 -19.2 215 215 A S H X S+ 0 0 15 -4,-2.3 4,-2.8 -5,-0.2 5,-0.2 0.986 109.7 46.4 -58.0 -54.3 28.0 5.0 -18.8 216 216 A E H X S+ 0 0 102 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.833 110.4 53.2 -56.8 -36.6 25.2 6.7 -16.9 217 217 A V H X S+ 0 0 2 -4,-1.4 4,-2.4 -5,-0.2 -1,-0.2 0.932 112.5 43.6 -67.9 -43.9 24.5 3.6 -14.8 218 218 A C H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.926 113.1 50.1 -67.7 -45.8 28.1 3.3 -13.7 219 219 A A H X S+ 0 0 61 -4,-2.8 4,-1.8 -5,-0.2 -2,-0.2 0.967 115.4 44.4 -56.7 -51.5 28.6 7.0 -13.0 220 220 A V H <>S+ 0 0 21 -4,-2.1 5,-2.5 -5,-0.2 -1,-0.2 0.860 115.2 46.8 -62.0 -39.9 25.5 7.0 -10.9 221 221 A A H ><5S+ 0 0 0 -4,-2.4 3,-1.2 3,-0.2 -1,-0.2 0.871 110.5 50.7 -72.5 -38.6 26.2 3.8 -9.0 222 222 A I H 3<5S+ 0 0 38 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.870 107.5 55.8 -66.0 -32.2 29.8 4.7 -8.2 223 223 A A T 3<5S- 0 0 75 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.541 118.8-119.7 -74.5 -8.4 28.4 8.0 -6.9 224 224 A K T < 5 + 0 0 107 -3,-1.2 2,-1.5 1,-0.2 -3,-0.2 0.760 60.2 151.5 76.6 27.2 26.2 5.8 -4.7 225 225 A D >< + 0 0 62 -5,-2.5 4,-2.4 1,-0.2 -1,-0.2 -0.676 16.2 176.1 -90.2 84.0 22.8 7.0 -6.0 226 226 A E H > S+ 0 0 102 -2,-1.5 4,-2.3 2,-0.2 5,-0.2 0.902 73.9 52.9 -55.2 -46.1 21.0 3.8 -5.2 227 227 A Q H > S+ 0 0 142 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.962 115.4 37.7 -56.7 -57.8 17.6 5.1 -6.3 228 228 A Q H > S+ 0 0 91 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.799 113.3 58.6 -66.0 -29.6 18.8 6.3 -9.7 229 229 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.935 107.2 45.9 -65.4 -45.7 21.0 3.3 -10.2 230 230 A K H X S+ 0 0 102 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.886 117.4 46.5 -63.2 -39.9 18.1 0.9 -9.8 231 231 A T H X S+ 0 0 76 -4,-1.8 4,-1.2 -5,-0.2 -2,-0.2 0.910 113.5 43.8 -72.5 -44.4 16.1 3.0 -12.1 232 232 A L H < S+ 0 0 24 -4,-3.1 4,-0.2 1,-0.2 3,-0.2 0.910 117.7 47.5 -66.9 -39.9 18.6 3.5 -14.9 233 233 A N H >< S+ 0 0 9 -4,-2.2 3,-2.1 -5,-0.3 4,-0.4 0.873 102.7 63.1 -67.8 -38.8 19.7 -0.1 -14.8 234 234 A N H >< S+ 0 0 95 -4,-1.8 3,-1.2 1,-0.3 4,-0.5 0.875 93.6 62.1 -56.2 -36.6 16.0 -1.3 -14.8 235 235 A K T 3< S+ 0 0 140 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.663 119.1 27.5 -65.6 -12.4 15.6 0.2 -18.3 236 236 A I T <> S+ 0 0 9 -3,-2.1 4,-1.3 -4,-0.2 -1,-0.3 0.176 87.9 108.7-132.2 16.3 18.2 -2.2 -19.5 237 237 A A H X> S+ 0 0 29 -3,-1.2 4,-1.3 -4,-0.4 3,-0.5 0.947 75.8 55.9 -60.1 -52.2 17.9 -5.1 -17.0 238 238 A N H >> S+ 0 0 110 -4,-0.5 4,-2.8 1,-0.2 3,-0.5 0.882 102.0 59.5 -47.8 -44.7 16.4 -7.6 -19.6 239 239 A L H 3> S+ 0 0 3 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.921 100.1 53.9 -51.5 -50.6 19.4 -7.0 -21.8 240 240 A H H << S+ 0 0 7 -4,-1.3 -1,-0.3 -3,-0.5 -51,-0.2 0.867 114.2 44.3 -52.1 -38.6 21.8 -8.3 -19.2 241 241 A N H X< S+ 0 0 109 -4,-1.3 3,-1.0 -3,-0.5 -2,-0.2 0.950 117.3 40.6 -71.9 -50.0 19.7 -11.4 -19.0 242 242 A I H >< S+ 0 0 26 -4,-2.8 3,-1.0 1,-0.3 -2,-0.2 0.555 96.8 74.4 -82.9 -10.5 19.1 -12.1 -22.6 243 243 A L T 3< S+ 0 0 1 -4,-2.1 9,-0.5 -5,-0.3 -1,-0.3 0.400 102.7 47.1 -78.6 4.7 22.6 -11.3 -23.8 244 244 A F T < + 0 0 80 -3,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.181 69.4 115.6-127.2 13.8 23.5 -14.6 -22.2 245 245 A C S < S+ 0 0 39 -3,-1.0 2,-0.3 2,-0.1 -2,-0.1 0.772 96.8 14.8 -56.0 -23.8 20.8 -16.8 -23.6 246 246 A E S S- 0 0 31 -4,-0.2 27,-0.0 -3,-0.0 157,-0.0 -0.864 122.5 -57.5-139.8 163.9 23.6 -18.6 -25.3 247 247 A S S > S- 0 0 22 -2,-0.3 3,-2.1 154,-0.3 156,-0.1 -0.213 74.6 -85.0 -54.5 128.4 27.3 -18.2 -24.5 248 248 A N T 3 S+ 0 0 8 1,-0.3 -1,-0.1 2,-0.2 -4,-0.1 -0.458 113.2 31.9 -61.8 144.2 28.7 -14.6 -24.6 249 249 A P T 3> S+ 0 0 3 0, 0.0 4,-3.0 0, 0.0 -1,-0.3 -0.956 105.7 76.4 -88.8 15.6 29.7 -13.2 -27.1 250 250 A I H <> S+ 0 0 1 -3,-2.1 4,-1.1 1,-0.2 23,-0.5 0.899 102.6 38.0 -53.4 -54.9 27.3 -15.1 -29.3 251 251 A P H > S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 3,-0.3 0.931 115.7 51.7 -65.4 -41.9 24.2 -13.1 -28.4 252 252 A V H > S+ 0 0 0 -9,-0.5 4,-2.2 1,-0.2 -2,-0.2 0.887 107.2 54.2 -63.5 -36.8 26.0 -9.8 -28.2 253 253 A K H X S+ 0 0 7 -4,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.830 111.8 44.4 -67.5 -28.8 27.5 -10.3 -31.7 254 254 A W H X S+ 0 0 24 -4,-1.1 4,-3.0 -3,-0.3 -2,-0.2 0.900 109.2 55.9 -78.9 -40.7 24.0 -10.9 -33.1 255 255 A A H < S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.916 109.0 48.2 -53.5 -47.1 22.4 -8.0 -31.3 256 256 A L H ><>S+ 0 0 0 -4,-2.2 3,-2.0 1,-0.2 5,-1.7 0.913 109.9 51.4 -61.3 -44.6 25.0 -5.8 -32.9 257 257 A H H ><5S+ 0 0 64 -4,-1.5 3,-2.5 1,-0.3 -2,-0.2 0.916 103.5 57.9 -59.5 -41.6 24.3 -7.3 -36.3 258 258 A E T 3<5S+ 0 0 31 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.451 106.2 52.6 -67.8 3.9 20.6 -6.6 -35.7 259 259 A M T < 5S- 0 0 31 -3,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.151 112.5-120.5-121.5 11.1 21.8 -3.0 -35.3 260 260 A G T < 5S+ 0 0 67 -3,-2.5 -3,-0.2 2,-0.2 -2,-0.1 0.583 85.6 112.5 60.5 8.9 23.7 -2.9 -38.6 261 261 A L S - 0 0 7 -2,-0.3 3,-2.2 4,-0.1 -217,-0.1 -0.581 39.1 -82.0 -88.7 135.1 34.6 -18.2 -35.3 268 268 A L T 3 S+ 0 0 61 1,-0.4 106,-1.3 -2,-0.3 107,-0.4 -0.344 114.3 46.3 -59.5 151.5 34.1 -21.9 -34.5 269 269 A P T 3 S+ 0 0 0 0, 0.0 -1,-0.4 0, 0.0 134,-0.4 -0.992 116.5 68.6 -57.3 -6.6 33.7 -23.4 -32.0 270 270 A L S < S- 0 0 4 -3,-2.2 -4,-0.1 132,-0.1 131,-0.0 -0.508 70.9-162.3 -80.0 153.4 31.4 -20.5 -31.6 271 271 A T - 0 0 15 -2,-0.2 3,-0.1 -3,-0.1 -4,-0.1 -0.920 30.3 -83.8-133.5 157.7 28.3 -20.2 -33.9 272 272 A P - 0 0 61 0, 0.0 3,-0.1 0, 0.0 -22,-0.1 -0.349 68.6 -82.0 -60.6 134.7 25.8 -17.5 -35.0 273 273 A L - 0 0 1 -23,-0.5 5,-0.1 1,-0.1 2,-0.0 0.004 60.1 -96.7 -36.5 135.0 23.1 -17.0 -32.4 274 274 A A >> - 0 0 34 -3,-0.1 3,-2.3 1,-0.1 4,-0.8 -0.355 27.7-117.5 -62.9 139.2 20.5 -19.8 -33.0 275 275 A E H >> S+ 0 0 134 1,-0.3 3,-1.7 2,-0.2 4,-0.6 0.877 110.4 68.1 -36.8 -56.4 17.4 -18.7 -35.0 276 276 A Q H 34 S+ 0 0 134 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.689 103.0 43.0 -39.0 -34.0 15.2 -19.4 -32.1 277 277 A Y H <> S+ 0 0 63 -3,-2.3 4,-1.4 1,-0.1 -1,-0.3 0.654 90.8 86.3 -94.4 -17.3 16.6 -16.5 -30.1 278 278 A R H S+ 0 0 65 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.821 112.5 46.9 -53.6 -27.2 13.2 -12.4 -28.7 281 281 A L H X S+ 0 0 2 -4,-1.4 4,-2.7 2,-0.2 5,-0.2 0.914 109.2 50.2 -79.3 -47.9 16.4 -10.3 -29.1 282 282 A R H X S+ 0 0 78 -4,-2.6 4,-1.5 1,-0.2 -3,-0.2 0.969 112.9 50.1 -53.3 -50.7 15.1 -7.9 -31.7 283 283 A N H X S+ 0 0 73 -4,-3.4 4,-3.0 1,-0.2 3,-0.3 0.888 108.0 52.6 -53.0 -43.3 12.2 -7.5 -29.3 284 284 A A H X S+ 0 0 9 -4,-1.4 4,-1.6 -5,-0.3 -1,-0.2 0.913 107.6 51.0 -61.8 -43.8 14.6 -6.9 -26.4 285 285 A L H <>S+ 0 0 0 -4,-2.7 5,-3.1 2,-0.2 6,-1.4 0.748 114.6 44.8 -65.8 -25.5 16.4 -4.2 -28.4 286 286 A K H ><5S+ 0 0 115 -4,-1.5 3,-4.3 -3,-0.3 -2,-0.2 0.955 107.0 54.9 -81.8 -57.5 13.0 -2.5 -29.1 287 287 A D H 3<5S+ 0 0 137 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.817 114.2 45.6 -42.7 -33.9 11.6 -2.7 -25.6 288 288 A A T 3<5S- 0 0 27 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.128 113.8-119.9 -99.3 20.1 14.8 -0.9 -24.6 289 289 A G T < 5S+ 0 0 67 -3,-4.3 -3,-0.2 2,-0.1 -2,-0.1 0.742 74.9 128.8 49.8 30.0 14.6 1.6 -27.4 290 290 A I < 0 0 46 -5,-3.1 -4,-0.2 1,-0.2 -1,-0.1 0.812 360.0 360.0 -82.2 -30.7 18.0 0.6 -28.8 291 291 A I 0 0 105 -6,-1.4 -1,-0.2 -9,-0.2 -2,-0.1 -0.942 360.0 360.0-152.3 360.0 16.5 0.2 -32.3 292 !* 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 0.0 293 1 B T 0 0 131 0, 0.0 2,-0.2 0, 0.0 158,-0.0 0.000 360.0 360.0 360.0 116.0 39.6 -49.8 -32.0 294 2 B I - 0 0 32 2,-0.0 2,-0.3 180,-0.0 36,-0.1 -0.467 360.0-175.1 -73.7 130.2 42.2 -49.4 -29.2 295 3 B Q + 0 0 100 -2,-0.2 2,-0.3 34,-0.1 198,-0.2 -0.890 32.9 26.1-126.6 157.5 41.5 -51.3 -26.1 296 4 B G E S-k 493 0C 5 196,-1.8 198,-2.2 -2,-0.3 2,-0.7 -0.679 98.6 -4.4 105.5-154.3 43.1 -51.7 -22.7 297 5 B S E -k 494 0C 0 -2,-0.3 33,-1.5 30,-0.3 32,-1.4 -0.762 57.7-171.9 -86.0 117.0 45.1 -49.5 -20.4 298 6 B I E -kl 495 330C 0 196,-2.9 198,-0.9 -2,-0.7 2,-0.4 -0.902 15.6-142.9-110.5 107.2 46.0 -46.2 -22.2 299 7 B V E -kl 496 331C 0 31,-2.4 33,-3.1 -2,-0.7 2,-1.8 -0.568 7.6-147.4 -79.0 128.1 48.5 -44.2 -20.2 300 8 B A E - l 0 332C 4 196,-2.5 33,-0.1 -2,-0.4 200,-0.1 -0.667 38.2-148.8 -85.3 76.7 48.1 -40.4 -20.2 301 9 B I - 0 0 1 -2,-1.8 34,-0.4 31,-0.6 33,-0.2 -0.152 2.2-125.4 -55.1 140.6 51.8 -40.1 -19.9 302 10 B V - 0 0 0 195,-0.1 36,-0.3 36,-0.1 -1,-0.1 -0.363 18.7-120.9 -78.2 163.9 53.4 -37.2 -18.1 303 11 B T - 0 0 1 34,-0.5 10,-0.1 -2,-0.1 -1,-0.0 -0.893 33.0-134.5-110.6 99.1 56.1 -35.1 -19.8 304 12 B P - 0 0 0 0, 0.0 8,-2.9 0, 0.0 2,-0.3 -0.203 25.7-165.5 -52.7 135.8 59.2 -35.5 -17.6 305 13 B M B -S 311 0D 0 252,-0.4 252,-1.3 250,-0.3 250,-0.3 -0.966 18.6-127.0-133.3 146.3 61.0 -32.2 -16.8 306 14 B L > - 0 0 71 4,-3.1 3,-3.6 -2,-0.3 252,-0.1 -0.485 48.7 -89.7 -80.7 159.4 64.4 -31.2 -15.4 307 15 B K T 3 S+ 0 0 144 1,-0.3 251,-0.3 -2,-0.1 -1,-0.1 0.821 128.3 51.4 -36.3 -49.8 64.4 -28.8 -12.5 308 16 B D T 3 S- 0 0 142 249,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.407 124.2-100.4 -76.5 4.8 64.5 -25.7 -14.7 309 17 B G S < S+ 0 0 13 -3,-3.6 -2,-0.1 1,-0.3 250,-0.1 0.321 75.2 137.2 99.0 -10.2 61.5 -26.9 -16.7 310 18 B G - 0 0 22 1,-0.1 -4,-3.1 -5,-0.1 -1,-0.3 -0.420 66.0 -92.9 -72.0 148.9 63.1 -28.3 -19.8 311 19 B V B -S 305 0D 8 -6,-0.2 2,-1.5 1,-0.1 -6,-0.3 -0.425 30.5-136.8 -63.6 125.0 61.7 -31.7 -21.1 312 20 B D > + 0 0 16 -8,-2.9 4,-2.1 -2,-0.2 5,-0.1 -0.697 27.6 178.8 -83.6 89.5 63.8 -34.5 -19.7 313 21 B W H > S+ 0 0 83 -2,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.853 75.1 55.2 -64.0 -37.1 64.0 -36.5 -23.0 314 22 B K H > S+ 0 0 154 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.951 110.1 46.5 -61.6 -48.8 66.1 -39.3 -21.5 315 23 B S H > S+ 0 0 15 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.908 110.5 52.9 -59.4 -44.8 63.5 -40.0 -18.8 316 24 B L H X S+ 0 0 2 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.926 107.3 52.0 -57.3 -47.3 60.7 -39.9 -21.4 317 25 B E H X S+ 0 0 80 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.922 112.3 45.8 -55.5 -46.3 62.4 -42.5 -23.5 318 26 B K H X S+ 0 0 140 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.888 110.1 53.4 -67.7 -37.3 62.8 -44.7 -20.5 319 27 B L H X S+ 0 0 5 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.973 109.7 47.6 -61.0 -53.3 59.2 -44.2 -19.4 320 28 B V H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 5,-0.2 0.924 114.5 47.7 -50.7 -48.9 57.8 -45.2 -22.8 321 29 B E H X S+ 0 0 54 -4,-2.2 4,-1.8 -5,-0.2 -1,-0.2 0.893 110.4 51.3 -59.8 -43.6 60.1 -48.2 -22.8 322 30 B W H X S+ 0 0 60 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.886 108.6 52.8 -61.5 -41.3 59.1 -49.2 -19.3 323 31 B H H X>S+ 0 0 0 -4,-2.7 5,-2.1 2,-0.2 4,-1.2 0.890 108.0 48.1 -62.5 -44.8 55.4 -49.0 -20.2 324 32 B I H <5S+ 0 0 30 -4,-1.9 -1,-0.2 1,-0.2 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2,-0.2 -2,-0.2 0.933 105.6 48.7 -66.9 -47.4 51.8 -40.2 -1.0 574 282 B R H X S+ 0 0 80 -4,-1.8 4,-3.4 1,-0.2 5,-0.2 0.926 111.8 51.5 -60.4 -40.5 55.0 -42.1 -0.2 575 283 B N H X S+ 0 0 71 -4,-2.5 4,-3.4 2,-0.2 -1,-0.2 0.919 109.5 49.1 -61.0 -43.9 52.9 -44.2 2.3 576 284 B A H X S+ 0 0 14 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.915 113.5 47.9 -59.7 -44.2 50.3 -44.9 -0.4 577 285 B L H X>S+ 0 0 1 -4,-2.8 5,-2.3 2,-0.2 4,-0.8 0.938 113.3 46.5 -63.1 -49.1 53.1 -45.9 -2.8 578 286 B K H ><5S+ 0 0 105 -4,-3.4 3,-1.6 1,-0.2 -2,-0.2 0.966 112.8 49.6 -60.3 -50.3 54.7 -48.1 -0.2 579 287 B D H 3<5S+ 0 0 139 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.870 109.3 52.3 -56.1 -38.3 51.4 -49.7 0.8 580 288 B A H 3<5S- 0 0 36 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.602 116.5-114.2 -74.7 -11.7 50.5 -50.4 -2.9 581 289 B G T <<5S+ 0 0 63 -3,-1.6 -3,-0.2 -4,-0.8 -2,-0.1 0.701 83.7 118.9 86.9 19.8 53.9 -52.1 -3.4 582 290 B I < 0 0 42 -5,-2.3 -4,-0.2 -6,-0.2 -5,-0.1 0.666 360.0 360.0 -90.8 -21.1 55.3 -49.6 -5.8 583 291 B I 0 0 92 -6,-0.8 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