==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 13-NOV-09 3KOM . COMPND 2 MOLECULE: TRANSKETOLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: FRANCISELLA TULARENSIS SUBSP. TULARENS . AUTHOR S.M.ANDERSON,Z.WAWRZAK,T.SKARINA,E.GORDON,K.KWON,A.SAVCHENKO . 1302 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43724.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 912 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 133 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 90 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 156 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 447 34.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 1.8 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 4 2 8 4 2 2 2 2 6 6 2 2 1 3 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 2 4 10 6 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 PARALLEL BRIDGES PER LADDER . 3 1 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 4 0 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 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 0 195 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -8.4 23.5 4.6 2.5 2 4 A S - 0 0 108 1,-0.1 0, 0.0 216,-0.0 0, 0.0 -0.417 360.0-124.8 -73.3 144.2 24.9 6.6 -0.4 3 5 A I - 0 0 9 -2,-0.1 2,-0.2 3,-0.0 214,-0.2 -0.813 18.3-141.7 -93.5 119.3 22.6 9.0 -2.3 4 6 A P >> - 0 0 57 0, 0.0 3,-1.6 0, 0.0 4,-0.7 -0.550 19.1-124.0 -75.3 145.5 22.4 8.5 -6.1 5 7 A R H >> S+ 0 0 86 1,-0.3 4,-2.6 -2,-0.2 3,-0.5 0.797 105.7 77.4 -61.4 -25.1 22.2 11.7 -8.2 6 8 A E H 3> S+ 0 0 46 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.867 91.1 52.7 -44.1 -46.1 19.0 10.2 -9.7 7 9 A F H <4 S+ 0 0 33 -3,-1.6 4,-0.4 1,-0.2 3,-0.3 0.857 112.4 42.5 -66.4 -36.3 17.1 11.1 -6.5 8 10 A S H XX S+ 0 0 0 -4,-0.7 4,-1.3 -3,-0.5 3,-1.1 0.803 104.2 66.9 -78.8 -27.2 18.2 14.8 -6.6 9 11 A N H 3X S+ 0 0 4 -4,-2.6 4,-3.0 1,-0.3 5,-0.2 0.782 85.5 70.9 -67.7 -21.2 17.6 14.9 -10.4 10 12 A A H 3X S+ 0 0 0 -4,-0.9 4,-2.3 -3,-0.3 -1,-0.3 0.886 99.3 48.6 -56.0 -42.6 13.9 14.5 -9.7 11 13 A I H <> S+ 0 0 0 -3,-1.1 4,-2.1 -4,-0.4 -1,-0.2 0.935 110.2 51.6 -61.1 -46.8 14.0 18.1 -8.3 12 14 A R H X S+ 0 0 0 -4,-1.3 4,-2.7 1,-0.2 -2,-0.2 0.936 113.7 42.4 -58.4 -48.8 15.9 19.3 -11.4 13 15 A F H X S+ 0 0 1 -4,-3.0 4,-3.1 2,-0.2 5,-0.3 0.901 112.0 51.5 -72.2 -38.1 13.4 17.8 -13.9 14 16 A L H X S+ 0 0 1 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.916 114.6 46.8 -59.5 -38.8 10.2 18.8 -12.0 15 17 A S H X S+ 0 0 0 -4,-2.1 4,-1.9 -5,-0.2 5,-0.2 0.935 115.3 43.6 -71.8 -43.5 11.5 22.3 -11.9 16 18 A I H X S+ 0 0 0 -4,-2.7 4,-2.3 -5,-0.2 245,-0.2 0.964 116.8 46.5 -62.8 -51.7 12.6 22.4 -15.5 17 19 A D H X S+ 0 0 8 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.891 113.4 48.5 -60.3 -42.0 9.3 20.8 -16.8 18 20 A A H X S+ 0 0 2 -4,-2.2 4,-2.2 -5,-0.3 -1,-0.2 0.896 112.5 46.7 -66.0 -42.4 7.1 23.0 -14.7 19 21 A T H X>S+ 0 0 0 -4,-1.9 4,-1.4 2,-0.2 5,-1.3 0.884 110.5 53.4 -72.1 -36.2 8.8 26.3 -15.7 20 22 A L H <5S+ 0 0 46 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.912 111.4 46.4 -59.0 -45.7 8.7 25.3 -19.4 21 23 A K H <5S+ 0 0 107 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.923 115.0 45.3 -64.9 -43.3 4.9 24.6 -19.2 22 24 A A H <5S- 0 0 17 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.723 94.2-143.1 -71.4 -20.3 4.2 27.9 -17.3 23 25 A K T <5S+ 0 0 184 -4,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.860 77.9 78.1 51.8 40.7 6.4 29.9 -19.7 24 26 A S < + 0 0 18 -5,-1.3 -2,-0.2 -6,-0.2 -1,-0.2 -0.956 66.0 49.1-171.1 152.5 7.3 31.8 -16.5 25 27 A G S S- 0 0 5 -2,-0.3 74,-0.0 -3,-0.1 1090,-0.0 -0.216 75.4 -87.0 89.2 175.9 9.5 31.2 -13.5 26 28 A H - 0 0 33 1,-0.1 41,-0.5 -2,-0.1 43,-0.3 -0.972 23.2-175.4-135.0 131.3 13.1 30.1 -13.2 27 29 A P > + 0 0 0 0, 0.0 4,-2.0 0, 0.0 217,-0.2 0.596 67.9 86.4 -99.9 -11.8 14.9 26.7 -13.2 28 30 A G H > S+ 0 0 0 228,-1.7 4,-2.0 1,-0.2 216,-2.0 0.932 90.9 41.8 -55.2 -56.4 18.5 27.7 -12.6 29 31 A X H > S+ 0 0 4 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.893 113.4 52.0 -66.4 -40.9 18.6 28.0 -8.8 30 32 A P H > S+ 0 0 0 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.911 110.5 50.4 -60.4 -37.6 16.6 24.8 -8.2 31 33 A X H < S+ 0 0 0 -4,-2.0 4,-0.3 1,-0.2 -2,-0.2 0.874 113.1 47.0 -64.9 -35.5 19.1 23.0 -10.5 32 34 A G H < S+ 0 0 0 -4,-2.0 210,-0.3 1,-0.2 4,-0.2 0.822 119.6 36.2 -71.3 -34.2 22.0 24.5 -8.5 33 35 A X H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.419 84.0 102.6-103.8 2.0 20.6 23.7 -5.0 34 36 A A H X S+ 0 0 0 -4,-1.0 4,-2.2 1,-0.2 -1,-0.2 0.840 82.6 48.2 -60.4 -37.3 19.0 20.3 -5.7 35 37 A D H > S+ 0 0 0 -4,-0.3 4,-2.2 -3,-0.2 -1,-0.2 0.923 112.4 48.3 -70.9 -39.7 21.8 18.2 -4.1 36 38 A I H > S+ 0 0 0 178,-0.4 4,-2.5 -4,-0.2 5,-0.2 0.939 113.4 48.3 -60.2 -49.0 22.0 20.3 -1.0 37 39 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.890 108.6 54.6 -59.3 -41.2 18.2 20.2 -0.6 38 40 A T H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.3 5,-0.3 0.932 110.9 44.0 -60.8 -44.2 18.2 16.4 -1.1 39 41 A V H X>S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 5,-0.6 0.961 116.9 45.9 -66.6 -47.9 20.7 15.9 1.7 40 42 A L H X>S+ 0 0 0 -4,-2.5 5,-2.7 1,-0.2 4,-1.4 0.952 119.1 39.4 -59.8 -50.8 19.0 18.3 4.1 41 43 A W H <5S+ 0 0 9 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.866 123.4 36.7 -72.2 -36.6 15.5 17.0 3.5 42 44 A T H <5S+ 0 0 29 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.715 127.2 30.5 -94.4 -20.1 16.2 13.2 3.2 43 45 A K H <5S+ 0 0 78 -4,-2.1 -3,-0.2 -5,-0.3 -2,-0.2 0.610 134.0 11.1-110.5 -17.4 18.9 12.8 5.9 44 46 A F T < - 0 0 7 3,-0.3 3,-2.0 -2,-0.3 6,-0.3 -0.909 5.8-162.1-131.6 104.2 5.6 15.1 9.1 49 51 A P T 3 S+ 0 0 2 0, 0.0 32,-0.4 0, 0.0 -1,-0.1 0.774 93.6 60.1 -58.1 -25.1 4.0 15.6 5.7 50 52 A N T 3 S+ 0 0 92 1,-0.3 3,-0.1 243,-0.2 243,-0.0 0.688 117.2 30.5 -76.7 -12.9 0.7 14.4 7.1 51 53 A N X + 0 0 44 -3,-2.0 3,-2.0 1,-0.1 -3,-0.3 -0.657 59.2 174.0-144.4 85.2 0.8 17.3 9.6 52 54 A P T 3 S+ 0 0 26 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.598 83.8 61.6 -64.3 -10.7 2.5 20.5 8.4 53 55 A H T 3 + 0 0 143 -5,-0.1 2,-0.0 -3,-0.1 4,-0.0 0.335 66.9 138.4 -98.5 4.4 1.4 22.1 11.7 54 56 A W X - 0 0 9 -3,-2.0 3,-1.8 -6,-0.3 -6,-0.1 -0.297 51.9-141.0 -52.6 122.2 3.3 19.7 14.0 55 57 A I T 3 S+ 0 0 31 1,-0.3 -1,-0.2 -2,-0.0 -2,-0.0 0.734 94.4 48.4 -70.4 -20.4 4.6 22.1 16.7 56 58 A N T 3 S+ 0 0 20 89,-0.1 -1,-0.3 2,-0.0 90,-0.1 0.241 82.3 125.2-103.0 16.0 8.0 20.4 17.1 57 59 A R S < S- 0 0 25 -3,-1.8 -10,-0.2 1,-0.1 2,-0.1 -0.393 70.1-105.8 -63.9 146.7 8.8 20.2 13.4 58 60 A D - 0 0 8 -12,-2.5 2,-0.5 89,-0.1 91,-0.2 -0.433 38.2-127.4 -58.0 146.4 12.1 21.7 12.1 59 61 A R E -a 149 0A 6 89,-2.0 91,-3.1 -2,-0.1 2,-0.4 -0.901 22.7-165.9-103.6 133.6 11.3 24.9 10.2 60 62 A F E -a 150 0A 12 -2,-0.5 50,-0.5 89,-0.2 2,-0.4 -0.968 3.5-171.8-116.4 133.0 12.6 25.4 6.6 61 63 A V E -a 151 0A 3 89,-2.3 91,-2.4 -2,-0.4 2,-0.9 -0.994 16.1-155.3-124.2 129.4 12.6 28.8 4.8 62 64 A L E +a 152 0A 7 -2,-0.4 91,-0.1 89,-0.2 89,-0.1 -0.851 25.1 166.5 -96.2 99.6 13.5 29.4 1.1 63 65 A S + 0 0 2 89,-2.2 51,-0.4 -2,-0.9 56,-0.3 0.840 42.3 92.5 -85.0 -32.7 14.6 33.0 1.3 64 66 A N S S- 0 0 10 88,-0.8 49,-0.1 1,-0.1 88,-0.1 -0.293 77.0-108.6 -77.6 148.9 16.2 33.3 -2.1 65 67 A G S S+ 0 0 17 49,-0.1 -1,-0.1 35,-0.1 -36,-0.1 -0.100 78.8 11.0 -73.3 166.5 14.4 34.5 -5.1 66 68 A H S S+ 0 0 53 1,-0.1 191,-0.0 48,-0.1 192,-0.0 -0.030 91.2 87.8 55.2-176.1 13.2 32.6 -8.2 67 69 A G >> + 0 0 1 -41,-0.5 3,-1.8 1,-0.1 4,-0.7 0.699 40.2 144.7 65.1 19.0 13.5 28.9 -7.6 68 70 A S H >> + 0 0 4 31,-0.3 4,-2.1 1,-0.3 3,-0.5 0.830 66.2 68.6 -53.1 -35.4 10.1 28.4 -6.0 69 71 A X H 3> S+ 0 0 1 -43,-0.3 4,-2.6 1,-0.2 -1,-0.3 0.748 86.6 67.4 -61.3 -21.1 10.0 25.1 -7.8 70 72 A L H <> S+ 0 0 0 -3,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.969 106.8 39.4 -58.5 -48.4 12.7 23.8 -5.5 71 73 A L H S+ 0 0 0 -4,-2.6 5,-2.5 1,-0.2 4,-0.7 0.925 115.5 45.9 -66.1 -40.9 6.9 19.1 -0.7 76 78 A H H ><5S+ 0 0 21 -4,-2.6 3,-1.0 -5,-0.2 -2,-0.2 0.948 113.8 47.2 -64.9 -50.3 5.5 17.0 -3.6 77 79 A L H 3<5S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.867 110.7 51.4 -64.9 -37.3 8.3 14.3 -3.5 78 80 A T H 3<5S- 0 0 1 -4,-2.1 214,-2.4 -5,-0.2 -1,-0.3 0.559 122.9-100.7 -81.3 -7.9 8.1 13.9 0.3 79 81 A G T <<5 + 0 0 9 -3,-1.0 -3,-0.2 -4,-0.7 -2,-0.1 0.623 66.4 148.9 103.5 18.1 4.3 13.4 0.3 80 82 A Y < - 0 0 19 -5,-2.5 2,-2.5 -6,-0.2 -1,-0.2 -0.303 68.0 -88.3 -69.2 166.8 2.7 16.7 1.3 81 83 A D S S+ 0 0 103 -32,-0.4 2,-0.3 2,-0.0 -1,-0.1 -0.457 93.0 113.1 -79.6 72.3 -0.7 17.5 -0.2 82 84 A L - 0 0 3 -2,-2.5 -3,-0.2 -7,-0.2 -2,-0.1 -0.933 56.3-151.8-143.9 113.0 0.8 19.2 -3.3 83 85 A S > - 0 0 37 -2,-0.3 4,-2.0 1,-0.1 5,-0.1 -0.312 29.1-112.2 -95.1 168.8 0.1 17.1 -6.5 84 86 A I H > S+ 0 0 31 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.868 121.8 54.7 -61.7 -37.5 1.7 16.6 -9.8 85 87 A E H 4 S+ 0 0 115 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.899 104.9 52.8 -61.4 -41.5 -1.3 18.4 -11.3 86 88 A D H >4 S+ 0 0 35 2,-0.2 3,-1.1 1,-0.2 -2,-0.2 0.905 109.4 49.9 -58.1 -43.3 -0.6 21.4 -9.0 87 89 A I H >< S+ 0 0 1 -4,-2.0 3,-1.5 1,-0.3 -2,-0.2 0.912 104.9 56.4 -62.7 -41.5 3.0 21.3 -10.3 88 90 A K T 3< S+ 0 0 80 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.583 109.1 49.5 -64.9 -8.6 1.6 21.3 -13.9 89 91 A N T X S+ 0 0 70 -3,-1.1 3,-2.2 -4,-0.4 -1,-0.3 0.017 75.7 157.7-122.3 29.6 -0.3 24.5 -12.9 90 92 A F T < S+ 0 0 5 -3,-1.5 3,-0.1 1,-0.3 -3,-0.1 -0.319 73.1 10.0 -50.2 128.7 2.6 26.4 -11.4 91 93 A R T 3 S+ 0 0 3 6,-3.1 -1,-0.3 1,-0.2 2,-0.2 0.566 103.2 117.4 69.9 16.8 1.8 30.2 -11.6 92 94 A Q S X S- 0 0 53 -3,-2.2 3,-1.1 5,-0.2 -1,-0.2 -0.630 73.6 -48.2-107.0 174.1 -1.9 29.8 -12.6 93 95 A L T 3 S- 0 0 71 1,-0.2 -1,-0.1 -2,-0.2 1191,-0.1 -0.040 109.5 -22.6 -47.5 122.6 -5.2 30.8 -10.8 94 96 A H T 3 S+ 0 0 116 1189,-0.3 -1,-0.2 1,-0.2 1190,-0.1 0.274 93.4 150.3 70.7 -6.8 -5.6 29.9 -7.0 95 97 A S < - 0 0 25 -3,-1.1 -1,-0.2 1188,-0.2 11,-0.1 0.145 63.2-118.8 -56.9 163.6 -3.2 27.1 -7.1 96 98 A K S S+ 0 0 42 1,-0.2 6,-0.2 9,-0.1 -1,-0.1 0.443 107.3 67.4 -72.1 -3.4 -1.1 25.7 -4.4 97 99 A T + 0 0 0 -8,-0.2 -6,-3.1 -5,-0.2 -5,-0.2 -0.386 64.3 166.8-125.6 59.5 1.8 26.7 -6.7 98 100 A P - 0 0 6 0, 0.0 1017,-0.1 0, 0.0 4,-0.1 -0.222 52.7-102.2 -64.2 159.1 2.1 30.5 -7.0 99 101 A G S S+ 0 0 0 1015,-0.7 -31,-0.3 1,-0.1 1016,-0.1 0.804 113.6 33.7 -57.6 -31.2 5.2 32.0 -8.6 100 102 A H S S- 0 0 9 1014,-0.2 1183,-0.1 1015,-0.1 1018,-0.1 -0.977 105.1-100.8-120.0 138.8 6.5 33.0 -5.1 101 103 A P - 0 0 3 0, 0.0 12,-1.4 0, 0.0 2,-0.4 -0.313 38.4-158.6 -63.5 140.2 5.7 30.7 -2.2 102 104 A E >> - 0 0 62 10,-0.2 3,-0.6 -6,-0.2 4,-0.5 -0.964 11.0-131.3-123.2 131.9 2.8 32.0 0.0 103 105 A Y T 34 S+ 0 0 83 -2,-0.4 7,-0.1 1,-0.2 9,-0.1 -0.612 79.6 47.2 -76.3 140.9 2.2 31.0 3.6 104 106 A G T 34 S+ 0 0 62 5,-0.5 -1,-0.2 2,-0.4 6,-0.0 0.005 113.2 26.8 128.1 -22.5 -1.3 30.0 4.6 105 107 A Y T <4 S+ 0 0 165 -3,-0.6 -2,-0.1 1,-0.2 -9,-0.1 0.629 93.7 80.6-129.9 -52.8 -2.7 27.5 2.1 106 108 A T S >< S- 0 0 8 -4,-0.5 3,-1.6 -11,-0.1 -2,-0.4 -0.446 89.7-114.0 -60.3 122.4 0.1 25.5 0.4 107 109 A P T 3 S+ 0 0 22 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.401 94.2 14.1 -65.9 132.7 1.0 22.8 3.0 108 110 A G T 3 S+ 0 0 16 1,-0.3 2,-0.7 -2,-0.1 -48,-0.2 0.432 84.2 129.2 87.8 -0.2 4.5 23.2 4.4 109 111 A V < - 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0 0 3 -5,-2.3 2,-0.5 27,-0.1 -1,-0.3 -0.594 57.6-115.9 -86.7 153.8 28.5 33.1 13.4 207 213 A H E -d 235 0A 46 27,-2.9 29,-2.5 -2,-0.2 2,-0.5 -0.823 37.1-155.8 -81.8 128.3 30.2 29.8 12.9 208 214 A V E -d 236 0A 7 -2,-0.5 2,-0.7 27,-0.2 29,-0.2 -0.951 15.4-162.6-117.1 127.7 31.2 29.7 9.2 209 215 A I E -d 237 0A 13 27,-2.9 29,-2.9 -2,-0.5 3,-0.3 -0.922 24.1-160.9-105.5 107.3 31.8 26.5 7.1 210 216 A E E + 0 0 102 -2,-0.7 29,-0.1 1,-0.2 27,-0.0 -0.507 55.1 14.7 -86.4 158.2 33.7 27.6 4.0 211 217 A N E + 0 0 125 1,-0.2 2,-0.6 -2,-0.2 -1,-0.2 0.851 67.7 170.5 57.8 47.0 34.2 25.9 0.7 212 218 A V E -d 239 0A 10 26,-2.3 28,-2.6 -3,-0.3 2,-0.8 -0.822 37.1-126.2 -91.0 123.3 31.5 23.1 0.8 213 219 A D E > -d 240 0A 74 -2,-0.6 3,-1.8 26,-0.2 7,-0.2 -0.609 18.9-158.5 -67.9 109.1 31.1 21.4 -2.6 214 220 A G T 3 S+ 0 0 0 26,-2.3 -178,-0.4 -2,-0.8 -179,-0.2 0.452 88.9 52.1 -75.9 -0.4 27.4 21.8 -3.1 215 221 A H T 3 S+ 0 0 19 25,-0.3 2,-0.7 -180,-0.1 -1,-0.3 0.253 89.3 88.7-111.6 10.9 27.3 18.9 -5.6 216 222 A D <> - 0 0 65 -3,-1.8 4,-2.1 1,-0.2 5,-0.2 -0.914 60.5-162.3-112.4 104.9 29.0 16.4 -3.2 217 223 A F H > S+ 0 0 20 -2,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.849 89.7 50.7 -55.7 -40.3 26.5 14.6 -1.1 218 224 A V H > S+ 0 0 82 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.904 109.8 49.1 -68.0 -42.5 29.1 13.5 1.5 219 225 A A H > S+ 0 0 23 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.871 110.7 50.9 -61.4 -39.3 30.6 16.9 1.9 220 226 A I H X S+ 0 0 2 -4,-2.1 4,-2.3 -7,-0.2 -2,-0.2 0.931 109.7 50.3 -65.8 -43.0 27.1 18.4 2.4 221 227 A E H X S+ 0 0 64 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.924 109.4 50.7 -62.1 -44.7 26.3 15.8 5.1 222 228 A K H X S+ 0 0 139 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.901 108.5 52.5 -59.3 -40.2 29.5 16.5 7.0 223 229 A A H X S+ 0 0 4 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.906 109.2 48.9 -62.7 -43.3 28.8 20.3 7.0 224 230 A I H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.927 109.4 52.8 -63.6 -41.0 25.3 19.7 8.4 225 231 A N H X S+ 0 0 81 -4,-2.4 4,-1.0 2,-0.2 -2,-0.2 0.917 110.4 48.6 -56.2 -43.5 26.9 17.4 11.1 226 232 A E H >X S+ 0 0 80 -4,-2.2 3,-0.7 1,-0.2 4,-0.5 0.927 109.5 51.7 -64.8 -43.7 29.3 20.2 12.0 227 233 A A H >< S+ 0 0 0 -4,-2.6 3,-1.5 1,-0.2 -2,-0.2 0.915 106.5 54.7 -59.7 -41.6 26.5 22.7 12.1 228 234 A H H 3< S+ 0 0 55 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.740 99.4 61.4 -63.1 -24.5 24.6 20.5 14.5 229 235 A S H << S+ 0 0 72 -4,-1.0 2,-0.3 -3,-0.7 -1,-0.3 0.637 77.7 113.3 -79.0 -11.9 27.5 20.3 16.9 230 236 A Q << + 0 0 32 -3,-1.5 5,-0.1 -4,-0.5 -3,-0.0 -0.439 38.6 178.4 -67.3 125.0 27.4 24.1 17.5 231 237 A Q S S+ 0 0 134 -2,-0.3 -55,-0.2 3,-0.1 -1,-0.1 0.599 76.9 19.0 -98.0 -16.2 26.4 25.0 21.1 232 238 A Q S S+ 0 0 141 1,-0.2 -56,-0.2 -56,-0.1 -55,-0.1 0.687 110.1 55.2-127.9 -33.3 26.7 28.8 20.9 233 239 A K S S- 0 0 95 -57,-0.2 -1,-0.2 -58,-0.1 -27,-0.1 -0.861 71.4-117.0-117.4 146.8 26.6 30.3 17.4 234 240 A P - 0 0 0 0, 0.0 -27,-2.9 0, 0.0 2,-0.4 -0.420 40.4-127.5 -68.0 155.2 24.3 30.1 14.4 235 241 A T E -cd 179 207A 0 -57,-2.3 -55,-3.2 -29,-0.2 2,-0.5 -0.905 16.9-160.4-116.6 137.9 26.0 28.5 11.3 236 242 A L E -cd 180 208A 0 -29,-2.5 -27,-2.9 -2,-0.4 2,-0.6 -0.974 10.7-158.7-110.5 120.5 26.5 29.7 7.7 237 243 A I E -cd 181 209A 2 -57,-3.2 -55,-2.8 -2,-0.5 2,-1.0 -0.902 9.3-148.6-100.1 116.4 27.3 26.9 5.2 238 244 A C E -c 182 0A 4 -29,-2.9 -26,-2.3 -2,-0.6 2,-0.7 -0.773 16.8-165.4 -93.3 105.4 28.9 28.4 2.1 239 245 A C E -cd 183 212A 1 -57,-2.3 -55,-2.4 -2,-1.0 2,-0.6 -0.817 11.5-148.8-103.2 110.2 27.9 26.1 -0.7 240 246 A K E +cd 184 213A 99 -28,-2.6 -26,-2.3 -2,-0.7 2,-0.3 -0.651 33.5 167.8 -75.6 118.4 29.8 26.3 -4.0 241 247 A T - 0 0 13 -57,-1.8 2,-0.6 -2,-0.6 -209,-0.1 -0.877 39.4-125.9-132.2 162.2 27.2 25.5 -6.7 242 248 A V > - 0 0 61 -2,-0.3 3,-1.6 -210,-0.3 -57,-0.1 -0.942 31.3-130.7-105.7 112.9 26.8 25.6 -10.5 243 249 A I T 3 S+ 0 0 8 -2,-0.6 9,-3.3 -58,-0.3 10,-0.2 -0.435 95.5 16.1 -62.4 137.4 23.6 27.4 -11.4 244 250 A G T > S- 0 0 0 -216,-2.0 3,-2.1 7,-0.3 -1,-0.3 0.765 89.3-170.1 68.2 25.1 21.7 25.3 -13.9 245 251 A F T < + 0 0 45 -3,-1.6 -1,-0.2 -217,-0.3 -212,-0.0 -0.230 67.8 33.6 -49.4 126.4 23.8 22.2 -13.0 246 252 A G T 3 S+ 0 0 10 1,-0.2 -1,-0.3 26,-0.0 26,-0.2 0.102 90.7 104.7 110.2 -18.9 23.1 19.4 -15.5 247 253 A S <> - 0 0 1 -3,-2.1 4,-2.5 1,-0.2 -1,-0.2 -0.842 52.2-164.6 -96.4 109.1 22.5 21.6 -18.5 248 254 A P T 4 S+ 0 0 71 0, 0.0 -1,-0.2 0, 0.0 17,-0.0 0.873 93.3 39.3 -56.6 -35.8 25.6 21.5 -20.9 249 255 A E T 4 S+ 0 0 102 16,-0.1 -2,-0.0 1,-0.1 16,-0.0 0.819 127.7 28.2 -83.0 -34.1 24.2 24.6 -22.6 250 256 A K T >4 S+ 0 0 57 -6,-0.2 3,-1.6 15,-0.1 4,-0.4 0.557 79.8 124.1-110.4 -14.6 22.9 26.7 -19.7 251 257 A A T 3< S+ 0 0 41 -4,-2.5 -7,-0.3 1,-0.2 -6,-0.1 -0.312 85.8 5.2 -56.1 123.7 25.0 25.6 -16.6 252 258 A G T 3 S+ 0 0 53 -9,-3.3 -1,-0.2 -224,-0.1 -8,-0.1 0.657 98.4 106.2 81.9 20.5 26.6 28.7 -15.1 253 259 A T < - 0 0 66 -3,-1.6 -2,-0.1 -10,-0.2 -9,-0.1 0.742 65.8-144.3-104.1 -26.4 25.0 31.5 -17.2 254 260 A A S S+ 0 0 24 -4,-0.4 -3,-0.1 1,-0.1 -225,-0.1 0.420 89.9 92.0 69.4 -7.8 22.5 33.2 -15.0 255 261 A S S > S+ 0 0 63 -5,-0.2 3,-1.3 2,-0.2 4,-0.4 0.731 84.2 55.1 -74.4 -29.3 20.5 33.5 -18.2 256 262 A V T 3 S+ 0 0 1 -6,-0.4 -228,-1.7 1,-0.3 -227,-0.2 0.581 94.3 67.3 -71.9 -12.5 19.2 30.2 -16.8 257 263 A H T 3 S+ 0 0 37 -229,-0.2 -1,-0.3 -230,-0.1 -2,-0.2 0.486 112.7 33.6 -80.6 -6.1 18.5 32.5 -13.8 258 264 A G S < S+ 0 0 26 -3,-1.3 -230,-0.2 1,-0.3 -2,-0.1 0.432 110.7 29.6-109.7-109.1 15.9 34.0 -16.1 259 265 A S S S- 0 0 67 -4,-0.4 -1,-0.3 -233,-0.1 -231,-0.2 0.018 78.1-103.1 -58.0 156.2 13.9 32.2 -18.8 260 266 A P - 0 0 39 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.286 47.1 -90.7 -65.0 163.5 12.8 28.6 -18.8 261 267 A L - 0 0 6 -245,-0.2 2,-0.0 1,-0.1 -5,-0.0 -0.441 37.6-115.4 -76.6 151.7 14.6 26.0 -20.9 262 268 A S > - 0 0 45 -2,-0.1 4,-1.6 1,-0.1 5,-0.1 -0.297 33.4-102.5 -73.5 169.3 13.6 25.2 -24.5 263 269 A D H > S+ 0 0 104 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.882 124.0 51.0 -58.8 -38.6 12.3 21.7 -25.4 264 270 A Q H > S+ 0 0 139 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.851 107.3 51.4 -71.8 -34.0 15.7 20.9 -26.9 265 271 A E H > S+ 0 0 35 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.830 106.8 55.1 -71.7 -32.1 17.6 22.0 -23.8 266 272 A R H X S+ 0 0 32 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.944 109.3 46.2 -64.2 -48.6 15.4 19.8 -21.6 267 273 A A H X S+ 0 0 58 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.856 112.7 51.4 -61.8 -36.9 16.2 16.7 -23.7 268 274 A S H X S+ 0 0 28 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.887 109.0 49.6 -67.2 -41.5 19.9 17.7 -23.6 269 275 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.868 109.6 53.0 -62.0 -38.3 19.8 18.1 -19.8 270 276 A A H <>S+ 0 0 10 -4,-2.1 5,-2.7 2,-0.2 4,-0.5 0.850 110.0 47.5 -67.3 -36.5 18.2 14.6 -19.7 271 277 A K H ><5S+ 0 0 169 -4,-1.8 3,-1.1 3,-0.2 -2,-0.2 0.944 111.1 50.4 -64.3 -51.5 21.0 13.1 -21.8 272 278 A E H 3<5S+ 0 0 115 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.858 119.1 37.6 -56.2 -35.0 23.7 14.7 -19.7 273 279 A L T 3<5S- 0 0 21 -4,-1.8 -1,-0.2 -27,-0.2 -2,-0.2 0.409 106.8-119.6-102.5 2.9 22.1 13.5 -16.4 274 280 A N T < 5 + 0 0 126 -3,-1.1 2,-0.6 -4,-0.5 -3,-0.2 0.906 53.2 163.8 55.4 43.8 21.0 10.0 -17.7 275 281 A W < - 0 0 9 -5,-2.7 -1,-0.2 -6,-0.2 -2,-0.1 -0.860 19.6-172.2 -95.1 116.8 17.4 11.0 -16.8 276 282 A D + 0 0 136 -2,-0.6 2,-0.3 -3,-0.1 -1,-0.1 0.402 48.7 98.7 -89.7 -0.1 15.1 8.4 -18.7 277 283 A Y - 0 0 47 4,-0.1 3,-0.1 1,-0.1 -2,-0.1 -0.666 63.5-129.4-108.4 144.9 11.7 10.0 -18.0 278 284 A Q > - 0 0 143 -2,-0.3 3,-2.3 1,-0.2 -1,-0.1 -0.158 60.5 -44.6 -77.7 178.5 9.4 12.3 -19.9 279 285 A A T 3 S- 0 0 52 1,-0.3 -1,-0.2 -262,-0.1 3,-0.1 -0.162 126.4 -5.8 -52.3 128.5 7.8 15.6 -18.6 280 286 A F T 3 S+ 0 0 25 -267,-0.2 2,-0.5 1,-0.2 -1,-0.3 0.429 96.8 135.7 68.3 2.9 6.5 15.3 -15.1 281 287 A E < + 0 0 83 -3,-2.3 -1,-0.2 -268,-0.0 -4,-0.1 -0.730 27.8 177.9 -84.8 123.1 7.2 11.5 -15.0 282 288 A I - 0 0 17 -2,-0.5 5,-0.0 -3,-0.1 -3,-0.0 -0.994 28.1-125.2-124.1 122.7 8.8 10.4 -11.7 283 289 A P >> - 0 0 17 0, 0.0 4,-1.8 0, 0.0 3,-1.2 -0.342 19.5-116.4 -73.0 156.1 9.4 6.6 -11.3 284 290 A Q H 3> S+ 0 0 126 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.813 113.9 62.3 -60.3 -33.4 8.0 4.8 -8.4 285 291 A D H 3> S+ 0 0 79 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.850 105.4 46.8 -56.5 -40.4 11.6 3.9 -7.2 286 292 A V H <> S+ 0 0 0 -3,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.917 111.0 49.8 -73.0 -44.3 12.2 7.7 -6.8 287 293 A Y H X S+ 0 0 50 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.901 107.1 58.3 -58.0 -37.9 9.0 8.3 -4.9 288 294 A K H < S+ 0 0 153 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.913 108.6 43.4 -61.3 -43.6 9.9 5.4 -2.7 289 295 A Y H < S+ 0 0 73 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.933 120.7 41.9 -62.7 -45.9 13.2 7.0 -1.6 290 296 A W H < S+ 0 0 4 -4,-2.3 -2,-0.2 -5,-0.1 -1,-0.2 0.790 82.3 106.5 -75.6 -32.0 11.6 10.4 -1.1 291 297 A D < - 0 0 77 -4,-2.7 4,-0.2 -5,-0.2 -213,-0.2 -0.319 39.7-179.3 -65.6 129.3 8.2 9.8 0.6 292 298 A A > + 0 0 3 -214,-2.4 4,-2.1 1,-0.1 5,-0.2 0.147 49.0 105.0-113.5 17.8 8.4 10.8 4.2 293 299 A R H > S+ 0 0 72 2,-0.2 4,-2.1 3,-0.2 -243,-0.2 0.930 84.3 41.0 -69.6 -44.9 4.9 9.9 5.3 294 300 A E H > S+ 0 0 169 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.957 119.4 44.5 -68.1 -49.1 5.8 6.7 7.3 295 301 A K H > S+ 0 0 90 -4,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.874 113.6 52.0 -62.2 -38.3 8.9 8.2 8.9 296 302 A G H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.880 107.0 51.4 -70.2 -40.9 7.1 11.5 9.6 297 303 A Q H X S+ 0 0 125 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.918 111.8 48.6 -57.5 -41.9 4.2 9.7 11.4 298 304 A A H X S+ 0 0 63 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.895 109.8 51.9 -66.3 -38.3 6.8 7.9 13.5 299 305 A L H X S+ 0 0 28 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.927 112.7 43.7 -65.4 -47.0 8.6 11.1 14.3 300 306 A E H X S+ 0 0 39 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.900 111.7 54.7 -65.6 -39.6 5.5 12.9 15.5 301 307 A A H X S+ 0 0 62 -4,-2.4 4,-1.0 -5,-0.2 -2,-0.2 0.903 107.3 50.4 -59.5 -40.6 4.4 9.7 17.4 302 308 A N H >X S+ 0 0 119 -4,-2.4 3,-1.0 1,-0.2 4,-0.7 0.954 112.3 46.7 -61.3 -46.0 7.7 9.7 19.2 303 309 A W H >X S+ 0 0 11 -4,-2.1 4,-2.2 1,-0.3 3,-0.6 0.824 101.2 65.9 -64.4 -32.0 7.3 13.4 20.1 304 310 A Q H 3X S+ 0 0 68 -4,-2.3 4,-2.6 1,-0.3 -1,-0.3 0.821 92.7 63.1 -62.0 -28.1 3.7 12.8 21.2 305 311 A G H X S+ 0 0 45 -4,-2.2 4,-0.8 1,-0.2 3,-0.6 0.907 108.3 52.6 -62.8 -37.5 3.6 15.9 25.0 308 314 A N H >< S+ 0 0 72 -4,-2.6 3,-0.8 1,-0.2 -1,-0.2 0.898 105.8 53.5 -65.4 -37.0 1.8 13.2 27.0 309 315 A L H 3< S+ 0 0 123 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.752 106.3 55.4 -64.9 -23.3 4.5 13.5 29.7 310 316 A F H X< S+ 0 0 8 -4,-1.0 3,-2.1 -3,-0.6 -1,-0.2 0.637 80.8 117.3 -84.5 -17.4 3.7 17.2 29.8 311 317 A K T << S+ 0 0 110 -4,-0.8 -3,-0.0 -3,-0.8 5,-0.0 -0.199 83.6 7.7 -57.0 137.8 -0.0 16.7 30.4 312 318 A D T 3 S+ 0 0 153 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.502 93.0 140.1 70.4 4.2 -1.2 18.1 33.7 313 319 A S S X S- 0 0 35 -3,-2.1 3,-1.6 1,-0.1 4,-0.5 -0.335 70.2 -96.5 -74.3 163.9 2.1 19.9 34.4 314 320 A P T 3 S+ 0 0 136 0, 0.0 3,-0.2 0, 0.0 4,-0.2 0.813 122.9 34.3 -52.4 -39.8 2.0 23.4 36.0 315 321 A K T 3> S+ 0 0 85 1,-0.2 4,-2.5 2,-0.1 5,-0.2 0.270 89.6 101.5-100.7 5.9 2.3 25.3 32.7 316 322 A F H <> S+ 0 0 28 -3,-1.6 4,-2.5 1,-0.2 5,-0.2 0.925 81.2 48.8 -56.4 -47.2 0.4 22.8 30.5 317 323 A D H > S+ 0 0 129 -4,-0.5 4,-2.3 -3,-0.2 -1,-0.2 0.910 112.6 48.6 -63.3 -39.9 -2.8 24.9 30.5 318 324 A E H > S+ 0 0 50 -4,-0.2 4,-3.0 2,-0.2 5,-0.3 0.921 109.5 52.8 -63.0 -43.9 -0.9 28.0 29.5 319 325 A F H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 5,-0.2 0.942 111.4 46.1 -57.1 -50.5 1.0 26.2 26.7 320 326 A E H X S+ 0 0 72 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.928 114.1 49.7 -58.4 -44.1 -2.3 24.9 25.2 321 327 A R H X>S+ 0 0 45 -4,-2.3 5,-1.3 -5,-0.2 4,-0.9 0.955 110.6 46.1 -64.4 -49.3 -3.8 28.4 25.5 322 328 A V H <5S+ 0 0 5 -4,-3.0 98,-0.6 1,-0.2 3,-0.4 0.870 112.8 51.2 -64.2 -34.0 -1.0 30.3 23.9 323 329 A L H <5S+ 0 0 44 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.897 108.4 51.9 -68.1 -37.9 -0.8 27.8 21.0 324 330 A S H <5S- 0 0 63 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.641 108.0-131.3 -68.4 -16.4 -4.6 28.1 20.4 325 331 A K T <5 + 0 0 86 -4,-0.9 2,-0.2 -3,-0.4 -3,-0.2 0.594 56.7 144.2 73.6 13.7 -4.1 31.9 20.3 326 332 A E < - 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0 0 0 53,-0.8 3,-2.3 -2,-0.3 4,-0.3 -0.956 58.6 -24.2-133.2 159.3 -8.1 61.7 15.5 551 558 A G T > S+ 0 0 1 -65,-1.5 3,-1.9 -2,-0.3 4,-0.5 -0.072 129.7 7.3 50.5-131.7 -5.4 61.4 18.2 552 559 A S T 3> S+ 0 0 5 1,-0.3 4,-0.5 2,-0.2 -1,-0.3 0.627 125.2 64.7 -61.5 -15.4 -3.9 64.6 19.4 553 560 A E H <> S+ 0 0 5 -3,-2.3 4,-2.3 1,-0.2 -1,-0.3 0.627 83.0 75.8 -87.1 -9.7 -6.4 66.7 17.4 554 561 A V H <> S+ 0 0 0 -3,-1.9 4,-2.2 -4,-0.3 -1,-0.2 0.921 94.8 48.9 -67.0 -40.9 -9.5 65.5 19.4 555 562 A E H > S+ 0 0 33 -4,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.835 109.7 53.3 -64.4 -32.0 -8.6 67.7 22.4 556 563 A L H X S+ 0 0 11 -4,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.931 108.3 50.6 -66.3 -44.6 -8.2 70.6 20.0 557 564 A A H X S+ 0 0 2 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.884 109.3 50.6 -58.0 -42.1 -11.7 69.9 18.6 558 565 A V H X S+ 0 0 13 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.934 107.7 52.8 -63.0 -45.5 -13.1 69.8 22.2 559 566 A K H X S+ 0 0 77 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.911 111.5 47.0 -58.5 -41.7 -11.6 73.2 23.0 560 567 A V H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.918 109.7 52.0 -65.7 -44.9 -13.2 74.7 19.9 561 568 A A H X S+ 0 0 6 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.890 107.8 54.7 -56.4 -38.2 -16.5 73.1 20.7 562 569 A N H X S+ 0 0 75 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.890 106.7 50.4 -59.9 -42.2 -16.2 74.7 24.2 563 570 A E H X S+ 0 0 70 -4,-1.7 4,-0.7 1,-0.2 3,-0.2 0.886 111.7 46.6 -65.8 -40.5 -15.7 78.1 22.7 564 571 A F H ><>S+ 0 0 5 -4,-2.1 5,-2.8 1,-0.2 3,-0.7 0.854 104.2 61.8 -72.2 -32.9 -18.7 77.8 20.4 565 572 A E H ><5S+ 0 0 94 -4,-2.2 3,-1.3 1,-0.2 -1,-0.2 0.844 100.1 56.0 -56.0 -36.9 -20.8 76.6 23.4 566 573 A K H 3<5S+ 0 0 155 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.789 106.2 50.1 -67.6 -28.8 -20.2 79.9 25.1 567 574 A K T <<5S- 0 0 131 -4,-0.7 -1,-0.3 -3,-0.7 -2,-0.2 0.244 124.8-103.8 -94.0 9.5 -21.6 81.7 22.0 568 575 A G T < 5S+ 0 0 60 -3,-1.3 2,-0.5 1,-0.2 -3,-0.2 0.673 82.2 126.9 78.7 19.3 -24.7 79.5 22.1 569 576 A I < - 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0 0 4 -3,-2.3 4,-1.9 1,-0.1 -1,-0.3 -0.809 54.1-159.0 -94.7 118.4 32.2 66.4 32.6 903 254 B P T 4 S+ 0 0 71 0, 0.0 -1,-0.1 0, 0.0 13,-0.0 0.865 95.7 34.0 -59.0 -36.8 32.9 65.1 36.1 904 255 B E T 4 S+ 0 0 103 12,-0.1 -2,-0.0 1,-0.1 12,-0.0 0.753 130.4 28.3 -90.8 -27.2 29.3 63.9 36.5 905 256 B K T 4 S+ 0 0 111 -6,-0.2 2,-0.2 11,-0.1 -5,-0.1 0.605 78.1 123.4-115.4 -17.8 28.3 62.9 33.0 906 257 B A < 0 0 44 -4,-1.9 -7,-0.3 -7,-0.3 -8,-0.1 -0.310 360.0 360.0 -56.7 117.0 31.5 61.7 31.1 907 258 B G 0 0 58 -9,-3.7 -10,-0.1 -2,-0.2 -66,-0.0 -0.266 360.0 360.0 87.6 360.0 31.0 58.2 29.9 908 ! 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 0.0 909 264 B G 0 0 81 0, 0.0 -228,-0.2 0, 0.0 -187,-0.0 0.000 360.0 360.0 360.0 64.2 21.0 63.0 25.4 910 265 B S - 0 0 73 -230,-0.1 -228,-0.1 -228,-0.0 -234,-0.1 -0.981 360.0-105.4-123.4 134.1 20.0 65.6 27.9 911 266 B P - 0 0 39 0, 0.0 -239,-0.1 0, 0.0 2,-0.1 -0.222 41.8-107.2 -50.0 139.7 21.4 69.1 28.2 912 267 B L - 0 0 12 -240,-0.2 2,-0.0 1,-0.1 -230,-0.0 -0.375 34.9-113.4 -66.0 148.7 23.8 69.7 31.2 913 268 B S > - 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0 0 61 1,-0.1 3,-0.1 4,-0.1 -2,-0.1 -0.850 67.2-117.5-115.3 149.2 34.8 81.7 29.9 929 284 B Q > - 0 0 147 -2,-0.3 3,-1.9 1,-0.2 2,-0.1 -0.070 58.2 -53.3 -72.7 179.1 31.0 82.3 30.4 930 285 B A T 3 S- 0 0 57 1,-0.3 -1,-0.2 -257,-0.1 3,-0.1 -0.366 127.5 -1.1 -55.5 124.3 28.2 80.9 28.3 931 286 B F T 3 S+ 0 0 29 1,-0.2 2,-0.6 -262,-0.2 -1,-0.3 0.437 95.7 137.2 73.1 4.7 29.0 81.6 24.6 932 287 B E < + 0 0 79 -3,-1.9 -1,-0.2 -263,-0.0 -4,-0.1 -0.733 27.6 179.5 -86.0 120.5 32.2 83.5 25.3 933 288 B I - 0 0 22 -2,-0.6 -3,-0.0 -3,-0.1 2,-0.0 -0.986 20.4-134.5-124.7 122.5 35.1 82.6 22.9 934 289 B P >> - 0 0 22 0, 0.0 4,-1.4 0, 0.0 3,-0.8 -0.233 23.2-106.4 -76.0 161.4 38.5 84.3 23.4 935 290 B Q H 3> S+ 0 0 152 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.843 114.3 59.4 -54.3 -46.3 40.7 85.8 20.6 936 291 B D H 3> S+ 0 0 106 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.838 103.7 53.2 -60.5 -30.7 43.3 83.1 20.6 937 292 B V H <> S+ 0 0 0 -3,-0.8 4,-2.5 2,-0.2 -1,-0.2 0.946 110.9 45.2 -68.4 -46.8 40.6 80.5 19.7 938 293 B Y H X S+ 0 0 74 -4,-1.4 4,-2.8 1,-0.2 -2,-0.2 0.861 110.9 55.4 -63.9 -32.9 39.4 82.5 16.8 939 294 B K H < S+ 0 0 159 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.922 112.3 42.0 -66.6 -42.5 43.0 83.1 15.7 940 295 B Y H < S+ 0 0 65 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.925 124.4 36.0 -63.7 -43.2 43.7 79.4 15.7 941 296 B W H < S+ 0 0 5 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.798 81.6 107.3 -86.6 -36.8 40.4 78.5 14.0 942 297 B D < + 0 0 74 -4,-2.8 4,-0.2 -5,-0.2 -208,-0.2 -0.263 37.8 178.8 -59.7 130.4 39.5 81.1 11.5 943 298 B A > + 0 0 1 -209,-2.6 4,-2.2 1,-0.1 5,-0.2 0.230 47.1 104.7-117.9 13.1 40.0 79.8 7.9 944 299 B R H > S+ 0 0 88 2,-0.2 4,-2.9 -210,-0.2 5,-0.2 0.935 82.1 47.1 -63.9 -48.2 39.0 82.8 5.7 945 300 B E H > S+ 0 0 172 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.947 118.1 40.5 -58.8 -52.2 42.5 83.9 4.7 946 301 B K H > S+ 0 0 95 -4,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.858 117.3 51.4 -68.4 -31.2 43.7 80.4 3.8 947 302 B G H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.900 105.3 52.2 -70.6 -44.8 40.4 79.6 2.2 948 303 B Q H X S+ 0 0 130 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.860 113.2 46.7 -59.5 -34.8 40.1 82.6 -0.1 949 304 B A H X S+ 0 0 59 -4,-1.4 4,-2.8 -5,-0.2 -1,-0.2 0.896 107.4 56.1 -76.5 -41.3 43.6 81.8 -1.4 950 305 B L H X S+ 0 0 47 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.920 114.0 40.9 -51.2 -49.9 42.8 78.1 -1.9 951 306 B E H X S+ 0 0 22 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.937 111.6 53.5 -70.7 -48.2 39.9 79.0 -4.1 952 307 B A H X S+ 0 0 64 -4,-2.3 4,-0.9 1,-0.2 -2,-0.2 0.932 109.7 50.8 -51.5 -48.6 41.5 81.9 -6.0 953 308 B N H >X S+ 0 0 109 -4,-2.8 4,-1.1 1,-0.2 3,-1.0 0.937 111.2 47.5 -51.3 -50.1 44.4 79.5 -6.9 954 309 B W H >X S+ 0 0 12 -4,-1.8 4,-2.9 1,-0.3 3,-0.5 0.890 101.3 63.1 -64.8 -37.3 41.9 76.9 -8.2 955 310 B Q H 3X S+ 0 0 65 -4,-2.8 4,-1.4 1,-0.3 -1,-0.3 0.767 101.5 55.7 -61.7 -20.5 39.9 79.4 -10.2 956 311 B G H < S+ 0 0 97 -4,-1.4 3,-1.6 1,-0.2 -1,-0.2 0.860 104.0 56.3 -69.4 -30.6 40.8 79.2 -16.4 960 315 B L H >< S+ 0 0 111 -4,-1.8 3,-0.7 1,-0.3 -1,-0.2 0.791 101.6 59.5 -64.9 -28.3 43.6 76.9 -17.8 961 316 B F G >< S+ 0 0 6 -4,-1.3 3,-1.6 -3,-0.4 -1,-0.3 0.571 80.3 94.4 -72.4 -7.3 40.8 74.5 -18.6 962 317 B K G < S+ 0 0 100 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.733 82.8 47.3 -63.2 -25.4 39.1 77.3 -20.8 963 318 B D G < S+ 0 0 124 -3,-0.7 -1,-0.3 -4,-0.2 -2,-0.1 0.510 88.0 111.9 -93.9 -5.8 40.6 76.1 -24.1 964 319 B S S X S- 0 0 39 -3,-1.6 3,-1.7 1,-0.1 4,-0.4 -0.336 76.1-121.5 -74.6 149.1 39.8 72.4 -23.6 965 320 B P T 3 S+ 0 0 136 0, 0.0 4,-0.2 0, 0.0 3,-0.2 0.798 112.4 47.0 -60.1 -26.4 37.2 70.7 -25.8 966 321 B K T 3> S+ 0 0 93 1,-0.2 4,-2.3 2,-0.1 5,-0.1 0.335 84.2 96.7 -97.4 6.8 35.1 69.7 -22.7 967 322 B F H <> S+ 0 0 39 -3,-1.7 4,-2.5 1,-0.2 5,-0.2 0.922 80.6 49.9 -64.6 -47.2 35.1 73.1 -21.0 968 323 B D H > S+ 0 0 125 -4,-0.4 4,-2.0 -3,-0.2 -1,-0.2 0.880 113.3 48.0 -60.3 -38.2 31.8 74.4 -22.3 969 324 B E H > S+ 0 0 51 -4,-0.2 4,-2.8 2,-0.2 5,-0.3 0.933 108.3 54.5 -66.0 -47.2 30.1 71.2 -21.2 970 325 B F H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.945 111.9 44.5 -52.0 -50.6 31.8 71.4 -17.7 971 326 B E H X S+ 0 0 42 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.879 112.7 52.2 -64.9 -35.4 30.4 74.9 -17.2 972 327 B R H X>S+ 0 0 37 -4,-2.0 5,-2.1 -5,-0.2 4,-0.6 0.939 111.1 44.3 -69.6 -45.8 27.0 73.9 -18.4 973 328 B V H ><5S+ 0 0 5 -4,-2.8 3,-0.8 1,-0.2 99,-0.6 0.882 112.4 51.5 -69.1 -36.9 26.5 70.9 -16.2 974 329 B L H 3<5S+ 0 0 35 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.898 109.9 51.4 -64.7 -36.7 27.8 72.7 -13.1 975 330 B S H 3<5S- 0 0 68 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.632 110.4-127.8 -69.6 -14.2 25.4 75.5 -13.9 976 331 B K T <<5 + 0 0 117 -3,-0.8 2,-0.3 -4,-0.6 -3,-0.2 0.792 56.8 149.6 65.2 31.9 22.5 72.9 -14.1 977 332 B E < - 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0 0 44 -3,-1.5 5,-0.1 -4,-0.3 -3,-0.0 -0.356 57.0-123.9 -58.7 127.6 -15.3 64.0 -7.3 1268 623 B P > - 0 0 6 0, 0.0 3,-2.2 0, 0.0 -16,-0.2 -0.300 22.0-106.2 -70.4 160.9 -17.4 66.5 -9.2 1269 624 B K T 3 S+ 0 0 181 1,-0.3 -20,-0.2 -21,-0.2 3,-0.1 0.859 120.9 61.5 -49.0 -38.8 -20.4 68.2 -7.7 1270 625 B A T 3 S- 0 0 48 -22,-1.9 -1,-0.3 -20,-0.3 2,-0.2 0.583 105.8-136.2 -70.1 -11.0 -22.6 65.9 -9.9 1271 626 B G < + 0 0 24 -3,-2.2 -19,-2.2 -21,-0.2 2,-0.3 -0.541 38.4 159.1 95.3-160.2 -21.2 62.8 -8.2 1272 627 B G E -h 1252 0L 25 -21,-0.3 2,-0.3 -2,-0.2 -19,-0.2 -0.910 32.8-100.8 128.7-153.6 -19.9 59.4 -9.4 1273 628 B E E -h 1253 0L 51 -21,-1.6 -19,-2.1 -2,-0.3 2,-0.3 -0.945 18.7-106.6-161.1 169.1 -17.7 56.8 -7.9 1274 629 B V E -h 1254 0L 18 -2,-0.3 2,-0.4 -21,-0.2 -19,-0.2 -0.868 15.2-165.5-111.1 147.0 -14.2 55.3 -7.7 1275 630 B K E +h 1255 0L 47 -21,-2.7 -19,-2.0 -2,-0.3 2,-0.2 -0.910 38.9 121.0-130.3 102.8 -13.0 51.9 -9.1 1276 631 B G - 0 0 9 -2,-0.4 2,-0.4 -21,-0.2 -17,-0.2 -0.436 61.7 -78.6-134.2-149.9 -9.6 50.9 -7.7 1277 632 B I + 0 0 4 -19,-1.9 4,-0.1 -2,-0.2 -2,-0.0 -0.996 32.6 171.1-128.6 130.8 -8.2 48.0 -5.8 1278 633 B Y + 0 0 106 -2,-0.4 2,-0.2 -19,-0.1 -1,-0.1 0.384 62.3 65.0-116.3 -3.9 -8.5 47.4 -2.0 1279 634 B S S S- 0 0 56 1,-0.1 2,-0.1 -799,-0.1 -2,-0.0 -0.652 90.3 -89.5-110.4 172.2 -7.1 43.9 -1.7 1280 635 B F - 0 0 24 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.351 50.3-103.4 -67.1 162.2 -3.6 42.4 -2.2 1281 636 B G - 0 0 7 -161,-0.4 2,-0.3 -164,-0.3 -1,-0.1 0.060 31.5-132.7 -74.3-168.4 -2.8 41.1 -5.6 1282 637 B E - 0 0 48 -166,-0.1 2,-0.9 -169,-0.1 -166,-0.4 -0.987 18.4-105.1-149.8 150.4 -2.7 37.5 -6.8 1283 638 B S S S+ 0 0 10 -2,-0.3 -1189,-0.3 -168,-0.2 -169,-0.2 -0.733 73.3 98.6 -82.0 103.6 -0.4 35.1 -8.7 1284 639 B A S S- 0 0 0 -2,-0.9 -168,-0.2 -171,-0.4 -1192,-0.2 -0.955 80.3 -66.7-169.0 163.7 -1.9 34.5 -12.2 1285 640 B P >> - 0 0 26 0, 0.0 4,-1.8 0, 0.0 3,-0.6 -0.303 52.0-112.3 -58.4 147.8 -1.6 35.7 -15.7 1286 641 B A H 3> S+ 0 0 23 1,-0.2 4,-2.5 -175,-0.2 5,-0.2 0.851 113.9 56.2 -50.8 -47.6 -2.6 39.4 -16.2 1287 642 B E H 3> S+ 0 0 134 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.896 108.4 49.0 -55.4 -41.7 -5.7 38.7 -18.3 1288 643 B D H <> S+ 0 0 44 -3,-0.6 4,-1.9 1,-0.2 -1,-0.2 0.884 110.6 50.3 -66.7 -39.9 -7.1 36.4 -15.6 1289 644 B L H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 6,-0.2 0.879 105.1 55.9 -64.6 -40.4 -6.5 39.0 -12.9 1290 645 B F H X>S+ 0 0 50 -4,-2.5 5,-1.8 1,-0.2 4,-0.8 0.895 108.2 49.6 -61.0 -37.0 -8.2 41.8 -14.8 1291 646 B K H <5S+ 0 0 133 -4,-1.5 3,-0.4 -5,-0.2 -1,-0.2 0.926 113.2 45.6 -65.1 -46.7 -11.3 39.6 -15.0 1292 647 B R H <5S+ 0 0 121 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.850 117.5 42.7 -65.3 -35.7 -11.3 38.9 -11.2 1293 648 B F H <5S- 0 0 22 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.498 113.3-113.5 -94.4 -4.9 -10.6 42.5 -10.2 1294 649 B G T <5 + 0 0 10 -4,-0.8 2,-1.4 -3,-0.4 -3,-0.2 0.636 68.7 137.9 86.8 17.1 -13.1 44.1 -12.6 1295 650 B F < + 0 0 11 -5,-1.8 2,-0.3 -6,-0.2 -1,-0.1 -0.564 40.2 114.6 -95.3 71.8 -10.7 46.0 -15.0 1296 651 B T S > S- 0 0 39 -2,-1.4 4,-2.5 1,-0.1 5,-0.3 -0.938 78.9-115.1-134.8 155.9 -12.5 45.0 -18.2 1297 652 B V H > S+ 0 0 41 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.926 117.2 53.4 -57.4 -42.5 -14.5 46.9 -20.8 1298 653 B E H > S+ 0 0 148 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.943 112.1 40.8 -59.1 -49.0 -17.6 44.9 -19.7 1299 654 B N H > S+ 0 0 50 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.926 115.3 49.2 -70.6 -43.4 -17.4 45.8 -16.0 1300 655 B I H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.904 110.9 52.4 -63.3 -34.6 -16.4 49.4 -16.4 1301 656 B S H X S+ 0 0 20 -4,-2.2 4,-3.0 -5,-0.3 -1,-0.2 0.909 106.1 53.6 -65.7 -39.0 -19.3 49.8 -18.9 1302 657 B N H < S+ 0 0 95 -4,-2.0 4,-0.4 2,-0.2 -1,-0.2 0.871 109.7 48.1 -62.3 -36.9 -21.7 48.3 -16.3 1303 658 B I H >< S+ 0 0 17 -4,-1.9 3,-1.3 2,-0.2 4,-0.2 0.935 113.2 47.1 -66.7 -47.7 -20.5 50.9 -13.8 1304 659 B V H >X S+ 0 0 0 -4,-2.5 3,-2.4 1,-0.2 4,-0.9 0.906 102.2 65.4 -59.7 -40.6 -20.9 53.7 -16.3 1305 660 B A T 3< S+ 0 0 52 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.661 87.3 69.9 -60.7 -17.2 -24.3 52.4 -17.3 1306 661 B K T <4 S+ 0 0 129 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.676 109.0 34.9 -68.2 -17.2 -25.6 53.2 -13.8 1307 662 B Y T <4 0 0 76 -3,-2.4 -2,-0.2 -4,-0.2 -1,-0.2 0.625 360.0 360.0-111.9 -22.7 -25.3 56.9 -14.7 1308 663 B V < 0 0 76 -4,-0.9 -87,-0.0 -87,-0.0 -111,-0.0 -0.477 360.0 360.0-120.9 360.0 -26.2 57.2 -18.3