==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN, TRANSFERASE/TRANSFERASE INHIBITOR03-JUL-12 4FXQ . COMPND 2 MOLECULE: PUTATIVE ADP-RIBOSYLTRANSFERASE CERTHRAX; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; . AUTHOR D.D.VISSCHEDYK,S.DIMOV,M.S.KIMBER,H.W.PARK,A.R.MERRILL . 890 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46000.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 663 74.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 101 11.3 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 0.2 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 . 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 . 63 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 116 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 314 35.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 0 6 2 0 4 4 4 2 0 0 2 4 0 2 0 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 0 2 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 PARALLEL BRIDGES PER LADDER . 5 3 4 6 0 0 2 2 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 . 5 2 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 19 A E > 0 0 99 0, 0.0 4,-2.2 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0-111.3 -21.4 -95.5 46.2 2 20 A N H > + 0 0 60 1,-0.2 4,-2.0 2,-0.2 79,-0.7 0.803 360.0 60.3 -55.6 -29.9 -20.1 -92.0 45.6 3 21 A S H > S+ 0 0 36 77,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.878 104.6 47.5 -64.7 -38.7 -22.3 -92.3 42.5 4 22 A K H > S+ 0 0 127 -3,-0.4 4,-2.8 2,-0.2 -2,-0.2 0.919 110.5 50.1 -68.5 -45.0 -25.3 -92.8 44.9 5 23 A K H X S+ 0 0 87 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.860 109.9 52.1 -62.9 -36.7 -24.4 -89.9 47.1 6 24 A T H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.926 110.5 48.1 -63.1 -45.9 -24.1 -87.7 44.1 7 25 A Q H X S+ 0 0 96 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.921 109.9 51.9 -58.7 -45.3 -27.6 -88.8 43.0 8 26 A E H X S+ 0 0 112 -4,-2.8 4,-0.6 1,-0.2 -1,-0.2 0.865 105.1 57.3 -61.2 -36.9 -28.9 -88.2 46.5 9 27 A L H >< S+ 0 0 6 -4,-2.0 3,-0.6 1,-0.2 4,-0.3 0.914 110.7 41.9 -59.3 -45.1 -27.4 -84.7 46.3 10 28 A V H >< S+ 0 0 11 -4,-1.7 3,-1.8 1,-0.2 -2,-0.2 0.898 107.4 61.4 -69.7 -38.9 -29.4 -83.9 43.1 11 29 A E H 3< S+ 0 0 127 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.561 89.8 70.0 -70.3 -8.6 -32.6 -85.5 44.4 12 30 A K T << S+ 0 0 160 -3,-0.6 -1,-0.3 -4,-0.6 -2,-0.2 0.751 83.4 92.8 -73.0 -25.6 -32.7 -83.0 47.3 13 31 A L S < S- 0 0 7 -3,-1.8 -3,-0.0 -4,-0.3 5,-0.0 -0.272 97.9 -82.7 -67.9 154.3 -33.6 -80.4 44.7 14 32 A P >> - 0 0 21 0, 0.0 4,-1.6 0, 0.0 3,-0.5 -0.311 30.7-131.4 -62.4 140.4 -37.3 -79.7 44.0 15 33 A H H 3> S+ 0 0 99 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.852 106.1 61.5 -58.1 -33.1 -38.8 -82.1 41.5 16 34 A E H 3> S+ 0 0 40 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.852 101.1 50.3 -63.5 -39.2 -40.2 -79.1 39.6 17 35 A V H <> S+ 0 0 1 -3,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.935 111.5 47.7 -67.2 -44.6 -36.8 -77.7 38.8 18 36 A L H X S+ 0 0 33 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.816 108.8 57.4 -63.3 -30.2 -35.6 -81.1 37.5 19 37 A E H X S+ 0 0 74 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.915 104.4 49.4 -65.7 -46.9 -38.9 -81.3 35.5 20 38 A L H X S+ 0 0 2 -4,-1.9 4,-0.8 2,-0.2 6,-0.2 0.883 111.9 49.1 -61.3 -39.7 -38.2 -78.0 33.7 21 39 A Y H ><>S+ 0 0 5 -4,-1.6 5,-2.4 1,-0.2 3,-0.7 0.903 111.0 50.0 -66.4 -42.5 -34.7 -79.1 32.8 22 40 A K H ><5S+ 0 0 71 -4,-2.1 3,-1.9 1,-0.2 -2,-0.2 0.856 100.4 65.8 -62.7 -36.0 -36.0 -82.5 31.5 23 41 A N H 3<5S+ 0 0 40 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.790 102.8 45.8 -58.6 -30.7 -38.6 -80.7 29.4 24 42 A V T <<5S- 0 0 5 -4,-0.8 -1,-0.3 -3,-0.7 209,-0.3 0.274 130.5 -91.8 -98.6 12.2 -36.0 -79.1 27.1 25 43 A G T < 5 + 0 0 5 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.2 0.607 69.2 166.8 87.2 13.3 -34.0 -82.4 26.8 26 44 A G < - 0 0 2 -5,-2.4 2,-0.4 -6,-0.2 -1,-0.3 -0.411 14.1-168.0 -61.0 131.8 -31.8 -81.6 29.8 27 45 A E E -a 75 0A 81 47,-1.4 49,-2.7 -2,-0.1 2,-0.5 -0.972 14.1-147.1-126.2 143.5 -29.8 -84.6 30.9 28 46 A I E -a 76 0A 39 -2,-0.4 2,-0.5 47,-0.2 49,-0.2 -0.939 16.3-167.4-111.9 122.0 -27.8 -85.1 34.1 29 47 A Y E -a 77 0A 63 47,-3.2 49,-2.8 -2,-0.5 2,-0.5 -0.933 8.9-160.5-114.3 132.8 -24.8 -87.3 33.9 30 48 A I E +a 78 0A 46 -2,-0.5 2,-0.4 47,-0.2 49,-0.2 -0.944 22.2 179.8-111.3 119.2 -22.8 -88.7 36.9 31 49 A T E -a 79 0A 20 47,-2.5 49,-2.3 -2,-0.5 4,-0.1 -0.941 37.8-156.7-130.5 145.1 -19.3 -89.8 35.9 32 50 A D S S+ 0 0 109 -2,-0.4 2,-0.1 47,-0.2 -1,-0.1 0.515 81.5 73.8 -88.1 -9.0 -16.2 -91.3 37.6 33 51 A K S S- 0 0 137 1,-0.2 47,-0.1 2,-0.1 -2,-0.1 -0.409 100.7 -73.0 -97.3 175.8 -13.9 -89.9 34.9 34 52 A R > - 0 0 94 -2,-0.1 3,-1.6 1,-0.1 4,-0.5 -0.379 43.5-119.2 -63.8 148.9 -12.8 -86.4 34.2 35 53 A L G > S+ 0 0 0 29,-0.5 3,-1.8 26,-0.3 6,-0.3 0.903 113.4 58.0 -56.3 -42.3 -15.5 -84.1 32.8 36 54 A T G 3 S+ 0 0 28 1,-0.3 -1,-0.3 25,-0.1 26,-0.1 0.547 100.9 56.8 -71.5 -6.1 -13.4 -83.6 29.6 37 55 A Q G < S+ 0 0 95 -3,-1.6 -1,-0.3 25,-0.1 -2,-0.2 0.506 85.0 108.7 -95.9 -8.5 -13.4 -87.3 28.9 38 56 A H S X S- 0 0 33 -3,-1.8 3,-1.3 -4,-0.5 39,-0.0 -0.388 81.1-118.8 -70.5 148.3 -17.2 -87.5 29.0 39 57 A E G > S+ 0 0 161 1,-0.3 3,-0.7 2,-0.1 -1,-0.1 0.815 112.1 56.2 -51.1 -36.2 -19.0 -88.1 25.7 40 58 A E G 3 S+ 0 0 28 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.713 107.0 48.3 -76.9 -21.7 -20.8 -84.7 26.0 41 59 A L G < S+ 0 0 2 -3,-1.3 -1,-0.3 -6,-0.3 -2,-0.1 -0.383 75.8 115.5-113.7 52.2 -17.6 -82.7 26.2 42 60 A S < + 0 0 93 -3,-0.7 -1,-0.1 -2,-0.1 5,-0.1 0.859 36.0 114.1 -89.4 -39.7 -15.7 -84.3 23.3 43 61 A D S > S- 0 0 85 -3,-0.2 3,-1.4 1,-0.2 4,-0.4 0.048 78.0-119.7 -35.3 134.5 -15.4 -81.3 21.0 44 62 A S G > S+ 0 0 86 1,-0.3 3,-0.8 2,-0.2 4,-0.5 0.712 111.0 67.2 -53.9 -21.7 -11.8 -80.3 20.6 45 63 A S G > S+ 0 0 45 1,-0.2 3,-0.7 2,-0.2 -1,-0.3 0.882 86.2 64.7 -68.8 -40.2 -12.8 -76.9 22.1 46 64 A H G X S+ 0 0 24 -3,-1.4 3,-0.9 1,-0.2 -1,-0.2 0.646 88.8 74.9 -59.8 -14.1 -13.6 -78.3 25.6 47 65 A K G < S+ 0 0 162 -3,-0.8 15,-0.3 -4,-0.4 -1,-0.2 0.962 103.6 31.3 -64.1 -54.6 -9.9 -79.2 25.8 48 66 A D G < S+ 0 0 130 -3,-0.7 2,-0.3 -4,-0.5 -1,-0.2 -0.075 96.2 126.2 -96.7 34.9 -8.6 -75.6 26.5 49 67 A M < - 0 0 60 -3,-0.9 12,-2.6 0, 0.0 13,-0.4 -0.670 41.9-157.1 -95.6 150.4 -11.7 -74.4 28.3 50 68 A F E -C 60 0B 140 -2,-0.3 2,-0.3 10,-0.3 8,-0.1 -0.880 1.8-157.5-120.9 153.4 -11.9 -72.8 31.7 51 69 A I E -C 59 0B 12 8,-2.8 8,-2.4 -2,-0.3 2,-0.5 -0.870 11.8-135.9-123.7 160.2 -14.7 -72.5 34.2 52 70 A V E -C 58 0B 67 -2,-0.3 6,-0.2 6,-0.2 -2,-0.0 -0.985 20.5-136.9-120.4 125.8 -15.4 -70.1 37.0 53 71 A S > - 0 0 9 4,-2.7 3,-2.5 -2,-0.5 38,-0.0 -0.171 36.5 -91.3 -72.5 170.6 -16.6 -71.4 40.4 54 72 A S T 3 S+ 0 0 2 1,-0.3 -1,-0.1 2,-0.1 124,-0.1 0.797 128.8 50.4 -53.9 -31.3 -19.4 -69.7 42.5 55 73 A E T 3 S- 0 0 129 2,-0.1 -1,-0.3 92,-0.0 -2,-0.0 0.330 125.2 -99.4 -93.7 8.1 -16.7 -67.6 44.3 56 74 A G S < S+ 0 0 51 -3,-2.5 2,-0.4 1,-0.3 -2,-0.1 0.663 72.5 145.3 89.2 17.2 -15.1 -66.4 41.1 57 75 A K - 0 0 122 1,-0.0 -4,-2.7 2,-0.0 2,-0.4 -0.757 41.6-135.6 -93.1 134.5 -12.1 -68.8 40.9 58 76 A S E +C 52 0B 62 -2,-0.4 -6,-0.2 -6,-0.2 -8,-0.0 -0.709 28.7 167.2 -90.7 132.8 -10.9 -70.1 37.5 59 77 A F E -C 51 0B 74 -8,-2.4 -8,-2.8 -2,-0.4 2,-0.2 -0.978 43.0 -98.9-134.8 152.8 -10.1 -73.7 36.8 60 78 A P E >> -C 50 0B 50 0, 0.0 3,-1.9 0, 0.0 4,-0.6 -0.503 34.6-124.9 -62.4 137.4 -9.4 -75.7 33.7 61 79 A L G >4 S+ 0 0 0 -12,-2.6 3,-1.4 1,-0.3 -26,-0.3 0.897 112.1 61.1 -49.1 -43.7 -12.6 -77.6 32.9 62 80 A R G 34 S+ 0 0 109 -13,-0.4 -1,-0.3 -15,-0.3 -27,-0.2 0.735 106.0 46.5 -54.8 -25.7 -10.5 -80.8 32.9 63 81 A E G <4 S+ 0 0 122 -3,-1.9 -1,-0.3 -29,-0.1 -2,-0.2 0.518 98.0 88.0 -96.9 -8.8 -9.7 -80.2 36.6 64 82 A H << - 0 0 20 -3,-1.4 -29,-0.5 -4,-0.6 3,-0.1 -0.363 66.6-140.3 -97.3 172.1 -13.2 -79.3 37.8 65 83 A F S S+ 0 0 33 1,-0.2 14,-3.7 -2,-0.1 2,-0.3 0.459 78.1 32.9-116.0 -1.6 -16.0 -81.6 39.1 66 84 A V E +B 78 0A 1 12,-0.2 2,-0.3 -5,-0.1 -1,-0.2 -0.966 55.0 173.0-155.1 143.4 -19.2 -80.1 37.6 67 85 A F E -B 77 0A 24 10,-2.3 10,-2.7 -2,-0.3 2,-0.8 -0.961 23.6-146.0-152.7 125.8 -20.2 -78.4 34.4 68 86 A A E -B 76 0A 0 -2,-0.3 2,-0.6 8,-0.2 8,-0.2 -0.853 20.3-154.5 -88.6 106.1 -23.5 -77.3 32.9 69 87 A K E -B 75 0A 50 6,-3.1 6,-2.1 -2,-0.8 -2,-0.0 -0.747 17.8-163.8 -80.5 118.4 -23.1 -77.7 29.1 70 88 A G + 0 0 25 -2,-0.6 3,-0.4 4,-0.2 2,-0.2 0.011 37.9 71.7 -89.6-164.1 -25.5 -75.2 27.5 71 89 A G S S- 0 0 49 1,-0.2 160,-0.0 31,-0.1 -2,-0.0 -0.635 101.0 -26.3 99.1-151.1 -26.9 -75.0 24.0 72 90 A K S S+ 0 0 83 1,-0.3 160,-1.7 -2,-0.2 161,-0.8 0.600 138.3 36.4 -88.1 -12.2 -29.4 -77.0 22.1 73 91 A E S S- 0 0 54 -3,-0.4 -1,-0.3 158,-0.2 -48,-0.1 -0.621 86.3-159.3-136.0 75.4 -28.7 -80.2 24.0 74 92 A P + 0 0 0 0, 0.0 -47,-1.4 0, 0.0 2,-0.3 -0.256 13.8 177.9 -62.1 139.5 -28.2 -79.1 27.6 75 93 A S E -aB 27 69A 0 -6,-2.1 -6,-3.1 -49,-0.2 2,-0.6 -0.995 23.6-150.7-141.9 141.1 -26.3 -81.5 29.9 76 94 A L E -aB 28 68A 0 -49,-2.7 -47,-3.2 -2,-0.3 2,-0.5 -0.973 18.4-165.3-111.3 112.9 -25.2 -81.3 33.5 77 95 A I E -aB 29 67A 0 -10,-2.7 -10,-2.3 -2,-0.6 2,-0.4 -0.875 7.4-174.9-100.8 128.6 -22.0 -83.4 34.0 78 96 A I E -aB 30 66A 0 -49,-2.8 -47,-2.5 -2,-0.5 2,-0.4 -0.984 24.3-131.6-129.3 126.1 -21.1 -84.1 37.6 79 97 A H E -a 31 0A 55 -14,-3.7 -47,-0.2 -2,-0.4 2,-0.2 -0.589 37.2-113.6 -71.4 127.2 -18.0 -85.9 38.9 80 98 A A + 0 0 5 -49,-2.3 2,-0.3 -2,-0.4 -77,-0.2 -0.449 56.9 140.8 -66.2 129.9 -19.1 -88.5 41.4 81 99 A E - 0 0 53 -79,-0.7 -75,-0.1 -2,-0.2 -76,-0.0 -0.900 64.7 -85.6-153.4 179.9 -18.0 -87.7 44.9 82 100 A D - 0 0 94 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.0 0.941 42.2-169.1 -56.6 -53.6 -19.0 -87.7 48.6 83 101 A Y + 0 0 14 1,-0.1 -1,-0.1 -3,-0.1 6,-0.0 0.698 53.5 117.1 56.8 22.2 -20.7 -84.3 48.4 84 102 A A + 0 0 59 4,-0.0 2,-0.3 5,-0.0 -1,-0.1 0.820 56.6 91.0 -73.4 -35.2 -20.9 -84.4 52.2 85 103 A S S > S- 0 0 58 1,-0.2 4,-2.2 2,-0.1 3,-0.3 -0.428 70.9-155.2 -58.9 121.0 -18.7 -81.3 51.8 86 104 A H H > S+ 0 0 77 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.810 93.4 62.4 -69.9 -30.2 -20.9 -78.2 51.6 87 105 A L H > S+ 0 0 127 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.837 111.1 40.1 -60.5 -33.2 -18.1 -76.4 49.6 88 106 A S H >> S+ 0 0 22 -3,-0.3 4,-1.4 2,-0.2 3,-0.5 0.903 112.9 52.6 -80.9 -44.5 -18.5 -79.0 46.9 89 107 A S H 3X S+ 0 0 3 -4,-2.2 4,-2.0 1,-0.2 5,-0.2 0.862 102.8 59.0 -60.3 -39.8 -22.3 -79.3 47.0 90 108 A V H 3X S+ 0 0 1 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.862 102.6 53.5 -63.1 -34.3 -22.8 -75.6 46.6 91 109 A E H S+ 0 0 38 -4,-2.2 4,-2.7 2,-0.2 5,-0.6 0.921 107.0 55.5 -61.4 -43.0 -27.0 -71.8 35.7 99 117 A A H X5S+ 0 0 1 -4,-2.5 4,-1.2 1,-0.2 5,-0.5 0.874 111.8 46.2 -58.7 -35.2 -28.5 -74.7 33.7 100 118 A I H X5S+ 0 0 0 -4,-2.1 4,-1.3 3,-0.2 8,-0.3 0.977 119.1 34.9 -70.5 -56.7 -31.9 -73.4 34.7 101 119 A I H <5S+ 0 0 2 -4,-2.6 -2,-0.2 1,-0.2 11,-0.2 0.804 129.5 34.2 -75.0 -26.8 -31.6 -69.7 34.1 102 120 A R H <5S+ 0 0 66 -4,-2.7 -3,-0.2 -5,-0.3 -1,-0.2 0.843 129.2 25.2 -92.6 -38.0 -29.4 -70.0 31.0 103 121 A D H <> S+ 0 0 15 0, 0.0 3,-1.8 0, 0.0 4,-1.4 -0.998 124.4 51.9 -91.7 -2.9 -39.2 -70.4 29.6 107 125 A L H 3> S+ 0 0 4 1,-0.3 4,-1.4 -3,-0.2 5,-0.5 0.893 104.6 58.4 -59.6 -38.5 -37.0 -69.1 32.3 108 126 A N H 3< S+ 0 0 42 -4,-2.7 -1,-0.3 -8,-0.3 -3,-0.2 0.423 110.7 43.9 -75.5 7.3 -34.1 -68.4 29.9 109 127 A Q H <4 S+ 0 0 112 -3,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.733 129.8 9.3-112.5 -36.3 -36.3 -66.1 27.9 110 128 A K H >X S+ 0 0 118 -4,-1.4 3,-1.1 -3,-0.2 4,-0.6 0.696 100.4 85.1-119.3 -32.0 -38.2 -63.9 30.4 111 129 A E G >< S+ 0 0 6 -4,-1.4 3,-1.4 -5,-0.4 6,-0.4 0.841 88.3 49.1 -58.1 -46.9 -37.0 -64.4 33.9 112 130 A L G 34 S+ 0 0 14 -5,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.747 114.3 47.4 -72.2 -18.2 -34.1 -61.9 34.2 113 131 A G G <4 S+ 0 0 33 -3,-1.1 -1,-0.3 4,-0.1 -2,-0.2 0.453 88.5 117.3 -92.2 -4.4 -36.2 -59.1 32.7 114 132 A N S XX S- 0 0 41 -3,-1.4 4,-2.3 -4,-0.6 3,-0.8 -0.422 75.8-124.4 -64.6 132.9 -39.0 -60.0 35.1 115 133 A P H 3> S+ 0 0 87 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.830 110.4 60.8 -43.3 -38.9 -40.0 -57.2 37.5 116 134 A K H 3> S+ 0 0 80 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.909 108.9 39.1 -62.6 -44.8 -39.4 -59.8 40.3 117 135 A F H <> S+ 0 0 0 -3,-0.8 4,-2.9 -6,-0.4 5,-0.2 0.964 118.2 47.7 -68.3 -51.5 -35.8 -60.3 39.5 118 136 A I H X S+ 0 0 24 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.867 113.0 49.5 -57.5 -39.4 -35.1 -56.7 38.7 119 137 A N H X S+ 0 0 104 -4,-3.0 4,-2.1 -5,-0.3 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149 167 A E H > S+ 0 0 101 1,-0.2 4,-1.9 2,-0.2 3,-0.4 0.894 111.9 52.6 -56.1 -43.7 -16.9 -57.6 36.6 150 168 A L H > S+ 0 0 1 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.863 106.1 53.5 -60.3 -38.1 -20.5 -56.8 37.6 151 169 A K H < S+ 0 0 79 -4,-2.1 -1,-0.2 -3,-0.3 -2,-0.2 0.783 110.0 50.1 -67.8 -25.1 -19.3 -54.8 40.6 152 170 A K H < S+ 0 0 133 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.859 115.8 39.9 -77.1 -38.1 -17.1 -52.9 38.2 153 171 A N H < S+ 0 0 85 -4,-1.9 2,-0.4 1,-0.2 -2,-0.2 0.624 118.5 48.0 -88.4 -15.4 -19.9 -52.1 35.8 154 172 A L S < S- 0 0 1 -4,-1.7 2,-0.2 -5,-0.2 -1,-0.2 -0.989 72.4-154.0-131.1 122.6 -22.6 -51.4 38.4 155 173 A E > - 0 0 143 -2,-0.4 3,-1.2 1,-0.1 2,-0.1 -0.562 36.3 -85.6 -91.5 160.7 -22.1 -49.2 41.4 156 174 A H T 3 S+ 0 0 19 1,-0.2 -30,-0.2 -2,-0.2 -1,-0.1 -0.424 116.8 16.2 -61.6 133.4 -24.0 -49.4 44.7 157 175 A G T 3 S+ 0 0 39 -32,-2.5 -1,-0.2 1,-0.4 -31,-0.1 0.063 94.7 129.3 89.4 -25.5 -27.3 -47.5 44.6 158 176 A Q < - 0 0 81 -3,-1.2 -1,-0.4 -33,-0.2 2,-0.3 -0.291 63.3-110.0 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0.875 69.8 45.2 -56.7 -53.0 -26.3 -61.1 30.6 170 188 A S H 3> S+ 0 0 78 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.833 110.4 57.2 -64.1 -30.0 -23.9 -63.8 31.9 171 189 A E H 3> S+ 0 0 49 -3,-0.4 4,-1.4 2,-0.2 -24,-0.3 0.828 109.7 43.4 -70.4 -32.0 -23.2 -61.6 35.0 172 190 A F H X S- 0 0 9 -4,-1.9 3,-2.3 -5,-0.2 4,-1.3 -0.784 78.4-143.2 -85.6 116.9 -27.5 -75.6 50.2 186 204 A P T 34 S+ 0 0 88 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.776 95.1 52.3 -59.4 -27.1 -28.7 -75.7 53.8 187 205 A H T 34 S+ 0 0 141 1,-0.2 -4,-0.1 2,-0.1 -5,-0.1 0.346 113.3 43.2 -96.0 11.6 -25.5 -74.3 55.2 188 206 A Y T <> S+ 0 0 49 -3,-2.3 4,-1.8 -6,-0.4 3,-0.3 0.482 92.3 84.2-117.3 -17.8 -25.5 -71.3 52.9 189 207 A K H X S+ 0 0 71 -4,-1.3 4,-2.2 1,-0.2 5,-0.1 0.859 86.2 52.8 -57.7 -43.4 -29.2 -70.4 53.1 190 208 A E H > S+ 0 0 110 -4,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.865 108.1 51.4 -67.1 -35.3 -29.0 -68.3 56.3 191 209 A A H > S+ 0 0 35 -3,-0.3 4,-3.0 2,-0.2 5,-0.4 0.893 107.8 51.9 -66.6 -43.4 -26.2 -66.1 54.9 192 210 A L H X S+ 0 0 0 -4,-1.8 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X S+ 0 0 12 -4,-1.5 4,-1.6 -5,-0.2 -1,-0.2 0.923 112.8 40.8 -56.8 -46.7 -37.1 -63.8 45.4 203 221 A M H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.842 109.8 59.2 -74.8 -32.0 -35.7 -67.4 45.5 204 222 A L H X S+ 0 0 62 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.924 106.1 48.9 -61.4 -43.6 -38.1 -68.4 48.3 205 223 A E H X>S+ 0 0 57 -4,-2.3 5,-2.5 2,-0.2 4,-1.4 0.902 112.1 47.7 -62.3 -44.3 -41.1 -67.5 46.1 206 224 A L H <>S+ 0 0 0 -4,-1.6 5,-2.7 4,-0.2 6,-0.5 0.940 116.8 44.1 -58.2 -48.2 -39.7 -69.5 43.2 207 225 A D H <5S+ 0 0 39 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.898 117.9 43.0 -64.5 -41.4 -39.0 -72.4 45.5 208 226 A Q H <5S- 0 0 135 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.584 139.6 -23.7 -89.4 -11.5 -42.3 -72.3 47.4 209 227 A M T X5S+ 0 0 111 -4,-1.4 4,-1.9 -3,-0.2 -3,-0.2 0.373 118.0 66.9-159.9 -44.8 -44.7 -71.7 44.4 210 228 A R H > S+ 0 0 81 -6,-0.5 4,-2.7 1,-0.2 -2,-0.2 0.893 110.5 50.6 -57.4 -42.4 -44.1 -75.1 40.3 213 231 A E H X S+ 0 0 116 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.907 111.4 47.2 -65.3 -44.8 -46.4 -72.6 38.5 214 232 A I H X S+ 0 0 24 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.914 113.6 50.3 -61.1 -41.7 -44.0 -72.3 35.6 215 233 A S H X S+ 0 0 6 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.905 109.1 48.2 -66.8 -44.1 -43.8 -76.1 35.5 216 234 A D H X S+ 0 0 68 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.882 109.4 55.0 -64.2 -36.7 -47.6 -76.8 35.5 217 235 A D H X S+ 0 0 60 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.884 107.7 49.0 -63.9 -40.1 -48.0 -74.2 32.8 218 236 A V H X S+ 0 0 14 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.939 110.3 51.5 -60.0 -48.2 -45.5 -76.0 30.6 219 237 A K H X S+ 0 0 93 -4,-2.3 4,-0.8 1,-0.2 -2,-0.2 0.891 109.3 51.0 -56.6 -42.9 -47.3 -79.3 31.3 220 238 A E H >X S+ 0 0 113 -4,-2.5 3,-1.0 2,-0.2 4,-0.7 0.943 110.9 47.2 -61.0 -48.4 -50.6 -77.7 30.2 221 239 A K H >X S+ 0 0 99 -4,-2.2 4,-2.0 1,-0.3 3,-1.6 0.929 106.8 56.9 -62.0 -43.6 -49.1 -76.4 27.0 222 240 A N H 3< S+ 0 0 80 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.708 98.8 62.7 -60.5 -19.2 -47.5 -79.8 26.2 223 241 A K H << S+ 0 0 170 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.761 110.5 38.1 -74.8 -25.9 -51.0 -81.3 26.4 224 242 A N H << S+ 0 0 112 -3,-1.6 2,-0.3 -4,-0.7 -2,-0.2 0.817 127.6 4.2 -94.6 -38.4 -52.2 -79.2 23.5 225 243 A V < - 0 0 36 -4,-2.0 2,-0.6 92,-0.1 -1,-0.3 -0.994 61.1-125.0-150.1 153.9 -49.2 -79.2 21.1 226 244 A L B +e 319 0D 32 92,-2.1 94,-2.6 -2,-0.3 2,-0.4 -0.899 35.1 170.0-102.1 120.9 -45.7 -80.7 20.7 227 245 A D - 0 0 44 -2,-0.6 94,-0.1 92,-0.2 146,-0.1 -0.944 20.2-175.4-139.7 109.7 -43.1 -77.9 20.3 228 246 A F > - 0 0 18 144,-0.5 3,-1.7 92,-0.4 7,-0.1 0.583 22.4-165.6 -83.4 -8.1 -39.4 -78.7 20.4 229 247 A K T 3 - 0 0 37 1,-0.2 145,-2.4 143,-0.1 -1,-0.2 -0.322 64.4 -34.8 52.8-135.5 -38.3 -75.0 20.1 230 248 A W T 3 S+ 0 0 51 143,-0.2 2,-0.3 145,-0.0 -1,-0.2 0.420 109.5 112.6 -95.5 2.8 -34.6 -74.9 19.2 231 249 A Y < - 0 0 10 -3,-1.7 4,-0.4 1,-0.1 -158,-0.2 -0.593 43.8-172.9 -85.8 135.2 -33.7 -78.0 21.3 232 250 A T > + 0 0 7 -160,-1.7 4,-2.6 -2,-0.3 5,-0.3 0.674 63.5 76.1-104.4 -18.3 -32.5 -81.0 19.3 233 251 A R H > S+ 0 0 33 -161,-0.8 4,-1.5 -209,-0.3 -208,-0.1 0.953 105.6 32.2 -66.0 -54.4 -32.2 -83.9 21.7 234 252 A K H > S+ 0 0 85 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.867 117.6 58.3 -69.0 -37.3 -35.8 -84.8 22.2 235 253 A A H > S+ 0 0 0 -4,-0.4 4,-3.1 2,-0.2 5,-0.2 0.951 106.9 45.5 -55.6 -53.1 -36.7 -83.7 18.7 236 254 A E H X S+ 0 0 91 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.907 113.8 50.2 -61.5 -41.3 -34.3 -86.2 17.0 237 255 A S H X S+ 0 0 84 -4,-1.5 4,-2.0 -5,-0.3 5,-0.2 0.918 113.9 44.4 -61.7 -45.4 -35.4 -89.0 19.3 238 256 A W H X S+ 0 0 32 -4,-2.7 4,-2.8 2,-0.2 5,-0.3 0.947 114.0 50.3 -64.1 -46.9 -39.1 -88.4 18.6 239 257 A G H X S+ 0 0 0 -4,-3.1 4,-1.4 -5,-0.2 162,-0.2 0.938 114.5 42.6 -58.1 -50.4 -38.5 -88.0 14.8 240 258 A V H X S+ 0 0 61 -4,-2.5 4,-0.6 -5,-0.2 -1,-0.2 0.934 119.3 42.5 -63.9 -46.7 -36.5 -91.2 14.5 241 259 A Q H >< S+ 0 0 118 -4,-2.0 3,-0.6 -5,-0.3 4,-0.4 0.911 113.1 50.9 -70.1 -41.1 -38.8 -93.3 16.6 242 260 A T H 3< S+ 0 0 38 -4,-2.8 4,-0.2 -5,-0.2 -1,-0.2 0.787 119.5 34.1 -71.1 -26.8 -42.1 -92.0 15.3 243 261 A F H 3X S+ 0 0 7 -4,-1.4 4,-2.5 -5,-0.3 -1,-0.2 0.321 86.6 101.6-114.0 7.3 -41.3 -92.6 11.7 244 262 A K H S+ 0 0 103 -4,-0.4 4,-0.5 1,-0.2 3,-0.3 0.929 111.1 51.2 -59.9 -45.3 -42.0 -97.9 10.8 246 264 A W H >4 S+ 0 0 12 -4,-0.2 3,-1.5 1,-0.2 -1,-0.2 0.914 106.5 55.6 -57.7 -43.4 -43.0 -95.7 7.9 247 265 A K H >< S+ 0 0 56 -4,-2.5 3,-1.1 1,-0.3 -1,-0.2 0.865 104.6 52.4 -60.5 -37.0 -39.3 -95.7 6.7 248 266 A E H 3< S+ 0 0 89 -4,-1.6 452,-1.9 -3,-0.3 -1,-0.3 0.582 105.7 57.8 -72.4 -10.9 -39.3 -99.5 6.6 249 267 A N T << S+ 0 0 43 -3,-1.5 2,-0.3 -4,-0.5 -1,-0.2 0.220 85.2 104.0-108.2 13.4 -42.4 -99.4 4.4 250 268 A L < - 0 0 0 -3,-1.1 449,-2.6 -4,-0.1 450,-0.2 -0.637 68.0-124.8 -89.4 151.0 -41.0 -97.2 1.7 251 269 A T B > -M 698 0E 3 447,-0.3 4,-2.6 -2,-0.3 5,-0.2 -0.488 28.5-107.9 -83.5 165.5 -39.9 -98.5 -1.7 252 270 A I H > S+ 0 0 83 445,-0.6 4,-2.6 1,-0.2 5,-0.2 0.924 121.8 50.9 -57.0 -46.6 -36.4 -97.9 -3.1 253 271 A S H > S+ 0 0 49 442,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.895 109.6 50.3 -58.3 -45.0 -37.8 -95.4 -5.6 254 272 A E H > S+ 0 0 7 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.924 111.6 47.1 -61.5 -45.9 -39.6 -93.5 -2.8 255 273 A K H X S+ 0 0 60 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.931 110.8 53.4 -62.8 -41.5 -36.5 -93.4 -0.6 256 274 A D H X S+ 0 0 105 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.907 111.0 44.6 -59.2 -44.2 -34.4 -92.2 -3.6 257 275 A I H X S+ 0 0 10 -4,-2.2 4,-3.1 2,-0.2 -1,-0.2 0.860 108.0 57.1 -75.2 -32.2 -36.7 -89.3 -4.4 258 276 A I H X S+ 0 0 0 -4,-2.1 4,-1.2 2,-0.2 -1,-0.2 0.966 113.7 41.7 -55.7 -49.7 -37.1 -88.2 -0.8 259 277 A T H >X S+ 0 0 46 -4,-2.2 3,-0.9 1,-0.2 4,-0.6 0.962 115.6 48.8 -60.6 -50.2 -33.3 -87.9 -0.8 260 278 A G H ><>S+ 0 0 10 -4,-3.0 5,-2.1 1,-0.3 3,-1.4 0.880 105.5 59.2 -59.8 -37.3 -33.1 -86.3 -4.2 261 279 A Y H 3<5S+ 0 0 0 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.811 100.5 53.8 -63.3 -31.6 -35.9 -83.8 -3.2 262 280 A T H <<5S+ 0 0 14 -4,-1.2 -1,-0.3 -3,-0.9 -2,-0.2 0.582 122.3 33.7 -78.2 -9.4 -33.8 -82.4 -0.4 263 281 A G T X<5S- 0 0 16 -3,-1.4 3,-1.6 -4,-0.6 4,-0.3 0.148 130.8 -21.9-112.2-128.6 -31.1 -81.9 -3.0 264 282 A S T 3 5S+ 0 0 93 1,-0.3 -3,-0.2 2,-0.1 3,-0.1 0.571 125.0 63.5 -69.6 -12.4 -31.2 -81.0 -6.7 265 283 A K T 3> S+ 0 0 62 -3,-1.6 4,-2.5 -6,-0.6 5,-0.2 0.924 90.0 38.7 -50.9 -58.8 -36.2 -79.6 -4.9 267 285 A D H > S+ 0 0 94 -4,-0.3 4,-2.8 1,-0.2 5,-0.3 0.928 114.4 49.7 -66.8 -50.0 -36.6 -76.6 -7.3 268 286 A P H > S+ 0 0 51 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.895 115.2 46.9 -58.4 -36.2 -37.8 -78.4 -10.5 269 287 A I H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.967 115.7 41.6 -69.6 -50.0 -40.5 -80.2 -8.4 270 288 A N H X S+ 0 0 10 -4,-2.5 4,-1.9 -5,-0.3 -1,-0.2 0.849 113.8 53.1 -71.5 -31.3 -41.8 -77.3 -6.5 271 289 A E H X S+ 0 0 129 -4,-2.8 4,-0.9 -5,-0.2 -1,-0.2 0.923 109.3 49.1 -65.8 -45.4 -41.7 -74.9 -9.5 272 290 A Y H >< S+ 0 0 91 -4,-1.8 3,-0.7 -5,-0.3 4,-0.2 0.918 112.3 49.0 -55.4 -47.2 -43.8 -77.4 -11.5 273 291 A L H 3< S+ 0 0 21 -4,-2.1 5,-0.4 1,-0.2 3,-0.3 0.844 111.8 47.4 -65.0 -37.5 -46.3 -77.8 -8.7 274 292 A R H >< S+ 0 0 122 -4,-1.9 3,-2.0 1,-0.2 -1,-0.2 0.613 81.4 115.4 -80.7 -10.1 -46.7 -74.0 -8.2 275 293 A K T << S+ 0 0 146 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.1 0.706 89.0 10.8 -29.9 -65.2 -47.2 -73.4 -12.0 276 294 A Y T > S- 0 0 97 -3,-0.3 3,-1.6 -4,-0.2 -1,-0.3 0.175 102.0-109.2-110.4 18.2 -50.7 -72.1 -12.2 277 295 A D T < S- 0 0 126 -3,-2.0 -2,-0.1 1,-0.3 -3,-0.1 0.916 80.7 -50.3 54.5 44.1 -51.5 -71.5 -8.5 278 296 A G T 3 S+ 0 0 50 -5,-0.4 -1,-0.3 1,-0.3 2,-0.2 0.255 104.9 129.6 84.9 -12.8 -53.9 -74.5 -8.5 279 297 A E < - 0 0 138 -3,-1.6 2,-0.9 1,-0.1 -1,-0.3 -0.508 62.3-123.4 -71.5 142.6 -55.9 -73.5 -11.5 280 298 A I + 0 0 158 -2,-0.2 -1,-0.1 -3,-0.1 -3,-0.0 -0.802 43.4 159.8 -92.1 105.1 -56.4 -76.3 -14.1 281 299 A I - 0 0 75 -2,-0.9 -2,-0.0 2,-0.0 -1,-0.0 -0.790 26.6-151.5-128.7 87.9 -55.0 -74.9 -17.4 282 300 A P - 0 0 96 0, 0.0 2,-0.7 0, 0.0 -2,-0.0 -0.279 13.4-128.3 -63.0 141.2 -54.2 -77.7 -19.8 283 301 A N + 0 0 139 3,-0.0 2,-0.4 0, 0.0 -2,-0.0 -0.832 37.4 179.2 -90.0 116.9 -51.4 -77.1 -22.4 284 302 A I + 0 0 142 -2,-0.7 3,-0.1 3,-0.0 2,-0.1 -0.970 34.5 33.1-132.2 126.1 -52.9 -78.1 -25.7 285 303 A G S S+ 0 0 59 1,-0.5 0, 0.0 -2,-0.4 0, 0.0 0.053 94.5 26.8 108.9 141.4 -51.5 -78.0 -29.3 286 304 A G S S- 0 0 68 -2,-0.1 -1,-0.5 2,-0.0 2,-0.3 -0.081 78.9-109.6 65.0-175.2 -47.9 -78.6 -30.4 287 305 A D - 0 0 147 -3,-0.1 2,-0.3 0, 0.0 3,-0.1 -0.965 20.2-100.3-150.1 159.3 -45.5 -80.8 -28.5 288 306 A L - 0 0 88 -2,-0.3 5,-0.0 1,-0.1 -2,-0.0 -0.644 45.4-103.6 -82.3 141.6 -42.4 -80.6 -26.3 289 307 A D > - 0 0 102 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.201 45.5 -95.8 -55.8 160.3 -39.0 -81.4 -27.9 290 308 A K H > S+ 0 0 180 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.807 121.6 46.7 -56.7 -38.5 -37.8 -84.8 -26.8 291 309 A K H > S+ 0 0 175 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.910 113.3 47.3 -72.9 -42.1 -35.5 -83.6 -24.0 292 310 A S H > S+ 0 0 58 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.883 113.3 50.1 -65.5 -36.5 -38.1 -81.3 -22.4 293 311 A K H X S+ 0 0 91 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.927 111.3 47.7 -66.8 -44.4 -40.7 -84.0 -22.6 294 312 A K H X S+ 0 0 139 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.912 111.9 50.6 -62.3 -42.7 -38.4 -86.5 -21.0 295 313 A A H X S+ 0 0 54 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.903 111.1 48.4 -62.0 -41.5 -37.5 -84.0 -18.3 296 314 A L H X S+ 0 0 57 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.917 110.1 50.7 -65.5 -44.7 -41.2 -83.3 -17.6 297 315 A E H X S+ 0 0 102 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.875 109.0 53.2 -60.1 -37.0 -42.1 -87.0 -17.4 298 316 A K H X S+ 0 0 113 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.923 109.1 47.8 -66.2 -42.8 -39.3 -87.5 -15.0 299 317 A I H X S+ 0 0 30 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.907 110.6 52.1 -64.3 -40.8 -40.6 -84.7 -12.7 300 318 A E H X S+ 0 0 80 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.897 109.6 49.4 -62.5 -40.3 -44.1 -86.2 -12.9 301 319 A N H X S+ 0 0 86 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.870 108.5 52.9 -66.4 -36.0 -42.8 -89.6 -11.9 302 320 A Q H X S+ 0 0 16 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.912 109.8 49.1 -64.9 -40.1 -40.9 -88.1 -8.9 303 321 A I H X S+ 0 0 11 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.924 108.4 53.1 -67.6 -43.3 -44.1 -86.4 -7.8 304 322 A K H X S+ 0 0 104 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.932 112.8 45.4 -52.2 -47.1 -46.0 -89.7 -8.1 305 323 A N H X S+ 0 0 15 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.906 114.0 46.6 -67.5 -41.3 -43.3 -91.3 -5.9 306 324 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.908 112.0 51.7 -67.4 -41.6 -43.3 -88.5 -3.3 307 325 A D H X S+ 0 0 31 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.915 111.4 47.9 -56.4 -47.0 -47.1 -88.5 -3.2 308 326 A A H X S+ 0 0 33 -4,-2.1 4,-0.8 -5,-0.3 -2,-0.2 0.904 112.4 48.6 -64.7 -42.5 -47.1 -92.2 -2.6 309 327 A A H >< S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.2 -2,-0.2 0.968 114.0 44.5 -61.3 -52.3 -44.4 -92.1 0.2 310 328 A L H >< S+ 0 0 0 -4,-2.7 3,-1.5 1,-0.3 -1,-0.2 0.786 103.5 64.0 -70.5 -27.0 -46.1 -89.2 2.1 311 329 A Q H 3< S+ 0 0 97 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.778 97.9 58.7 -61.8 -27.1 -49.6 -90.7 1.9 312 330 A K T << S+ 0 0 93 -3,-1.1 2,-0.5 -4,-0.8 -1,-0.3 0.521 99.0 73.1 -79.7 -4.5 -48.3 -93.6 3.9 313 331 A S < - 0 0 4 -3,-1.5 2,-0.4 -4,-0.2 86,-0.3 -0.933 56.4-179.0-119.1 132.0 -47.3 -91.3 6.7 314 332 A K - 0 0 113 -2,-0.5 2,-0.3 84,-0.2 84,-0.2 -0.993 28.7-127.4-128.2 131.1 -49.6 -89.5 9.2 315 333 A I - 0 0 1 82,-3.1 81,-3.1 -2,-0.4 82,-0.2 -0.619 21.6-157.0 -74.6 129.8 -48.6 -87.1 11.9 316 334 A T + 0 0 83 -2,-0.3 2,-0.3 79,-0.2 79,-0.1 0.413 63.5 25.7-100.2 4.0 -50.2 -88.5 15.1 317 335 A E S S- 0 0 74 77,-0.1 79,-0.1 76,-0.1 76,-0.1 -0.986 96.3 -74.1-159.4 158.3 -50.4 -85.4 17.3 318 336 A N - 0 0 68 -2,-0.3 -92,-2.1 -94,-0.2 2,-0.3 -0.340 59.6-175.1 -57.9 125.9 -50.5 -81.7 17.1 319 337 A L E -eF 226 393D 0 74,-2.6 74,-3.5 -94,-0.2 2,-0.5 -0.957 25.5-141.6-131.8 143.2 -47.0 -80.5 16.2 320 338 A I E + F 0 392D 8 -94,-2.6 -92,-0.4 -2,-0.3 2,-0.3 -0.916 25.3 178.4 -99.1 127.8 -45.2 -77.2 15.7 321 339 A V E - F 0 391D 0 70,-2.6 70,-2.8 -2,-0.5 2,-0.4 -0.861 16.1-137.1-122.4 167.9 -42.7 -77.0 12.8 322 340 A Y E +GF 371 390D 1 49,-2.6 49,-3.8 -2,-0.3 2,-0.3 -0.944 18.0 177.4-129.7 142.5 -40.6 -74.2 11.6 323 341 A R E - F 0 389D 42 66,-2.2 66,-3.5 -2,-0.4 2,-0.4 -0.960 18.1-145.8-149.3 128.1 -39.7 -72.7 8.3 324 342 A R E + F 0 388D 17 -2,-0.3 2,-0.3 64,-0.2 64,-0.2 -0.757 31.4 158.3 -90.8 138.1 -37.6 -69.7 7.2 325 343 A V E - F 0 387D 12 62,-2.1 62,-1.3 -2,-0.4 2,-0.2 -0.895 33.3-118.5-146.7 171.0 -38.7 -67.8 4.1 326 344 A S > - 0 0 34 -2,-0.3 3,-2.4 59,-0.2 4,-0.1 -0.523 49.5 -82.7-104.6-177.1 -38.3 -64.4 2.4 327 345 A E G > S+ 0 0 24 1,-0.3 3,-2.2 8,-0.2 7,-0.1 0.648 116.5 84.4 -64.1 -16.6 -41.0 -61.9 1.6 328 346 A L G > + 0 0 69 1,-0.3 3,-1.7 7,-0.2 -1,-0.3 0.671 69.6 83.6 -58.5 -16.5 -41.7 -63.9 -1.6 329 347 A Q G < S+ 0 0 28 -3,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.838 90.5 48.1 -50.6 -34.2 -43.9 -65.9 0.8 330 348 A F G < S- 0 0 13 -3,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.360 130.2 -65.9 -95.3 5.4 -46.6 -63.3 0.2 331 349 A G X - 0 0 30 -3,-1.7 3,-2.2 -4,-0.1 -1,-0.3 -0.347 51.5 -77.8 125.0 156.2 -46.3 -63.3 -3.6 332 350 A K G > S+ 0 0 186 1,-0.3 3,-1.5 2,-0.2 -1,-0.1 0.794 121.3 63.0 -56.2 -32.1 -43.9 -62.4 -6.4 333 351 A K G 3 S+ 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4,-2.1 1,-0.2 3,-0.6 0.912 102.0 57.8 -59.6 -43.6 -23.2 -121.5 -46.7 537 108 B V H 3X S+ 0 0 2 -4,-2.4 4,-2.4 1,-0.3 -1,-0.2 0.868 102.3 54.6 -60.7 -34.1 -23.6 -125.2 -46.4 538 109 B E H 3> S+ 0 0 18 -4,-0.5 4,-2.1 -3,-0.3 -1,-0.3 0.836 106.3 51.8 -67.9 -31.9 -21.8 -125.2 -43.0 539 110 B V H S+ 0 0 37 -4,-2.2 4,-2.7 2,-0.2 5,-0.6 0.935 107.2 54.4 -62.8 -45.6 -27.8 -129.5 -35.6 546 117 B A H X5S+ 0 0 0 -4,-2.6 4,-1.6 3,-0.2 5,-0.5 0.877 112.2 46.9 -55.8 -39.1 -29.4 -126.8 -33.5 547 118 B I H X5S+ 0 0 0 -4,-2.3 4,-1.3 3,-0.2 8,-0.2 0.989 118.6 35.4 -65.7 -60.2 -32.8 -128.1 -34.7 548 119 B I H <5S+ 0 0 2 -4,-2.6 -2,-0.2 1,-0.2 11,-0.2 0.774 130.6 32.7 -70.0 -23.4 -32.4 -131.8 -34.1 549 120 B R H <5S+ 0 0 68 -4,-2.7 -3,-0.2 -5,-0.3 -1,-0.2 0.808 129.4 24.9-100.4 -38.0 -30.2 -131.4 -31.0 550 121 B D H <> S+ 0 0 14 0, 0.0 4,-1.7 0, 0.0 3,-1.6 -0.995 124.3 54.1 -93.8 -0.1 -40.0 -131.3 -29.6 554 125 B L H 3>>S+ 0 0 3 -3,-0.4 4,-0.9 1,-0.3 5,-0.5 0.872 104.7 56.5 -57.2 -40.4 -37.7 -132.4 -32.4 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111.0 51.2 -64.8 -44.3 -35.2 -143.4 -44.3 568 139 B I H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.910 112.7 46.3 -59.6 -43.8 -31.9 -144.3 -42.6 569 140 B N H X S+ 0 0 12 -4,-2.1 4,-1.0 2,-0.2 -1,-0.2 0.904 110.6 51.6 -66.4 -42.0 -32.4 -148.0 -43.3 570 141 B E H < S+ 0 0 113 -4,-2.3 3,-0.2 1,-0.2 -1,-0.2 0.874 113.4 45.3 -63.7 -36.8 -33.5 -147.5 -46.9 571 142 B V H >< S+ 0 0 0 -4,-2.2 3,-0.8 1,-0.2 18,-0.4 0.835 110.1 55.3 -71.7 -32.9 -30.3 -145.4 -47.5 572 143 B N H 3< S+ 0 0 0 -4,-1.9 32,-2.9 1,-0.3 -2,-0.2 0.630 111.2 45.5 -77.1 -14.2 -28.3 -148.1 -45.6 573 144 B Q T 3< S+ 0 0 97 -4,-1.0 2,-0.3 -3,-0.2 -1,-0.3 -0.345 77.1 139.4-125.8 52.7 -29.5 -150.8 -47.9 574 145 B Q < - 0 0 27 -3,-0.8 11,-1.0 11,-0.3 2,-0.4 -0.728 33.3-160.5 -89.3 146.1 -29.2 -149.2 -51.3 575 146 B K E -R 584 0I 125 -2,-0.3 2,-0.3 9,-0.3 9,-0.3 -0.991 20.3-138.9-136.6 132.6 -27.9 -151.4 -54.1 576 147 B E E S+R 583 0I 125 7,-2.8 7,-2.3 -2,-0.4 2,-0.2 -0.663 82.2 38.8 -76.8 145.3 -26.3 -151.1 -57.5 577 148 B G S S- 0 0 58 -2,-0.3 5,-0.1 5,-0.2 -2,-0.1 -0.662 76.2-126.8 101.8-166.9 -27.9 -153.6 -59.8 578 149 B K S S+ 0 0 214 -2,-0.2 2,-0.2 3,-0.1 -1,-0.1 0.271 76.1 43.5-167.1 3.3 -31.5 -154.6 -59.9 579 150 B G S > S- 0 0 48 2,-0.0 3,-0.6 0, 0.0 -1,-0.0 -0.676 107.3 -50.8-141.3-165.0 -31.6 -158.4 -59.6 580 151 B V T 3 S+ 0 0 147 1,-0.3 2,-1.4 -2,-0.2 -3,-0.0 0.844 127.0 58.8 -43.4 -45.1 -30.1 -161.4 -57.8 581 152 B N T 3 S+ 0 0 154 2,-0.0 2,-0.3 0, 0.0 -1,-0.3 -0.340 77.6 147.1 -86.9 55.9 -26.6 -160.2 -58.5 582 153 B A < - 0 0 27 -2,-1.4 2,-0.4 -3,-0.6 -5,-0.2 -0.707 29.8-163.3 -89.9 142.6 -27.1 -156.9 -56.7 583 154 B K E -R 576 0I 170 -7,-2.3 -7,-2.8 -2,-0.3 -2,-0.0 -0.995 27.9-104.8-127.7 134.4 -24.1 -155.2 -55.0 584 155 B A E -R 575 0I 35 -2,-0.4 2,-0.5 -9,-0.3 -9,-0.3 -0.238 23.5-146.3 -59.7 136.0 -24.5 -152.5 -52.4 585 156 B D > - 0 0 20 -11,-1.0 3,-0.5 1,-0.1 -11,-0.3 -0.931 1.4-158.1-100.4 126.2 -23.6 -148.9 -53.4 586 157 B E T 3> + 0 0 71 -2,-0.5 4,-4.2 1,-0.2 5,-0.3 0.358 62.6 112.6 -81.0 6.0 -22.2 -146.9 -50.5 587 158 B D H 3> S+ 0 0 64 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.847 78.4 42.3 -52.0 -44.6 -23.2 -143.7 -52.3 588 159 B G H <> S+ 0 0 0 -3,-0.5 4,-2.1 -17,-0.3 5,-0.4 0.952 118.7 44.7 -65.8 -50.7 -25.8 -142.8 -49.7 589 160 B R H > S+ 0 0 15 -18,-0.4 4,-2.4 -4,-0.3 -2,-0.2 0.899 112.1 54.4 -59.5 -40.5 -23.6 -143.8 -46.8 590 161 B D H < S+ 0 0 90 -4,-4.2 -1,-0.2 1,-0.2 -2,-0.2 0.872 112.1 42.8 -63.2 -38.7 -20.6 -142.0 -48.4 591 162 B L H < S+ 0 0 37 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.884 131.1 18.0 -73.0 -39.4 -22.5 -138.7 -48.7 592 163 B L H < S+ 0 0 0 -4,-2.1 2,-0.3 -5,-0.1 -3,-0.2 0.714 98.4 87.6-113.7 -28.7 -24.2 -138.6 -45.3 593 164 B F < - 0 0 11 -4,-2.4 26,-0.1 -5,-0.4 25,-0.0 -0.602 67.5-128.0 -85.9 139.2 -22.6 -141.0 -42.7 594 165 B G > - 0 0 22 24,-0.3 4,-1.2 -2,-0.3 -1,-0.1 -0.237 29.7-102.5 -72.9 169.0 -19.7 -139.9 -40.5 595 166 B K H > S+ 0 0 138 1,-0.2 4,-1.5 2,-0.2 3,-0.5 0.927 121.4 45.8 -58.2 -47.7 -16.5 -141.9 -40.2 596 167 B E H > S+ 0 0 81 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.794 105.6 59.3 -71.3 -28.9 -17.4 -143.4 -36.8 597 168 B L H > S+ 0 0 1 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.802 104.6 53.5 -67.3 -28.0 -21.0 -144.3 -37.9 598 169 B K H < S+ 0 0 62 -4,-1.2 3,-0.3 -3,-0.5 -2,-0.2 0.937 106.5 49.8 -68.0 -48.7 -19.4 -146.4 -40.6 599 170 B K H < S+ 0 0 137 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.701 119.3 38.6 -65.7 -20.7 -17.2 -148.3 -38.1 600 171 B N H < S+ 0 0 89 -4,-1.1 2,-0.4 1,-0.2 -1,-0.2 0.584 120.2 45.1-103.2 -14.1 -20.3 -149.0 -36.0 601 172 B L < - 0 0 0 -4,-1.1 -1,-0.2 -3,-0.3 2,-0.1 -0.916 68.5-162.0-137.9 109.8 -22.8 -149.6 -38.8 602 173 B E > - 0 0 147 -2,-0.4 3,-0.7 1,-0.1 2,-0.1 -0.364 38.2 -81.5 -83.2 166.9 -22.2 -151.8 -41.8 603 174 B H T 3 S+ 0 0 40 1,-0.2 -30,-0.2 -2,-0.1 -1,-0.1 -0.404 113.7 18.2 -70.2 143.8 -24.2 -151.6 -45.0 604 175 B G T 3 S+ 0 0 37 -32,-2.9 -1,-0.2 1,-0.3 -31,-0.1 0.007 93.5 132.8 86.0 -28.5 -27.5 -153.6 -45.2 605 176 B Q < - 0 0 82 -3,-0.7 2,-0.4 -33,-0.2 -1,-0.3 -0.151 60.6-112.9 -56.3 149.4 -27.5 -153.7 -41.4 606 177 B L - 0 0 113 -3,-0.1 2,-0.7 -33,-0.0 -1,-0.1 -0.705 19.2-142.7 -93.4 136.2 -30.7 -152.7 -39.7 607 178 B V + 0 0 2 -2,-0.4 2,-0.2 -42,-0.2 -38,-0.1 -0.864 23.9 178.9-102.3 110.8 -31.0 -149.5 -37.6 608 179 B D >> - 0 0 80 -2,-0.7 4,-1.6 1,-0.1 3,-0.6 -0.700 47.7 -99.2-106.8 162.1 -33.2 -149.9 -34.5 609 180 B L H 3> S+ 0 0 99 -2,-0.2 4,-1.5 1,-0.2 -1,-0.1 0.766 117.6 67.8 -48.2 -25.2 -34.0 -147.3 -31.8 610 181 B D H 3> S+ 0 0 119 2,-0.2 4,-1.0 1,-0.2 3,-0.4 0.961 101.5 37.3 -65.2 -57.3 -31.3 -149.1 -29.8 611 182 B L H <> S+ 0 0 31 -3,-0.6 4,-1.6 1,-0.2 -1,-0.2 0.801 111.1 63.1 -70.8 -26.4 -28.1 -148.2 -31.7 612 183 B I H < S+ 0 0 5 -4,-1.6 7,-0.2 1,-0.2 -1,-0.2 0.914 103.1 49.5 -56.7 -42.8 -29.6 -144.8 -32.4 613 184 B S H < S+ 0 0 79 -4,-1.5 3,-0.5 -3,-0.4 -1,-0.2 0.780 113.0 46.3 -68.9 -27.6 -29.5 -144.2 -28.6 614 185 B G H < S+ 0 0 63 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.650 122.7 35.5 -88.5 -17.7 -25.9 -145.4 -28.4 615 186 B N S X S+ 0 0 22 -4,-1.6 4,-1.7 -3,-0.2 -1,-0.2 -0.348 74.6 143.2-128.3 51.5 -24.8 -143.3 -31.4 616 187 B L H > S+ 0 0 81 -3,-0.5 4,-2.4 1,-0.2 3,-0.3 0.926 72.0 46.3 -61.1 -52.1 -27.0 -140.2 -30.9 617 188 B S H > S+ 0 0 77 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.824 110.7 55.9 -63.3 -30.3 -24.6 -137.5 -32.1 618 189 B E H > S+ 0 0 51 2,-0.2 4,-1.3 1,-0.2 -24,-0.3 0.859 111.5 42.1 -69.1 -37.1 -23.7 -139.6 -35.1 619 190 B F H X S+ 0 0 0 -4,-1.7 4,-2.2 -3,-0.3 -2,-0.2 0.781 109.2 58.2 -81.5 -26.5 -27.4 -139.8 -36.2 620 191 B Q H X S+ 0 0 28 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.887 105.0 53.0 -64.5 -38.5 -27.9 -136.1 -35.3 621 192 B H H X S+ 0 0 25 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.921 106.0 52.1 -59.8 -46.1 -25.1 -135.5 -37.9 622 193 B V H X S+ 0 0 0 -4,-1.3 4,-2.5 1,-0.2 5,-0.2 0.942 112.3 46.1 -58.0 -46.2 -26.9 -137.5 -40.5 623 194 B F H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.947 114.3 46.8 -57.9 -50.0 -30.0 -135.4 -39.9 624 195 B A H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -80,-0.2 0.830 113.6 47.8 -66.2 -34.0 -28.1 -132.1 -39.9 625 196 B K H X S+ 0 0 7 -4,-2.7 4,-2.9 2,-0.2 5,-0.3 0.931 110.5 50.4 -75.5 -43.8 -26.2 -132.9 -43.1 626 197 B S H X S+ 0 0 0 -4,-2.5 4,-2.4 -5,-0.3 -2,-0.2 0.953 113.7 49.0 -49.2 -51.1 -29.4 -134.1 -44.9 627 198 B F H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.923 112.1 46.6 -54.0 -54.0 -30.8 -130.8 -43.8 628 199 B A H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.911 114.6 45.3 -60.1 -45.8 -27.9 -128.7 -45.0 629 200 B L H < S+ 0 0 4 -4,-2.9 6,-0.4 1,-0.2 -1,-0.2 0.854 112.2 53.7 -70.8 -33.5 -27.6 -130.4 -48.4 630 201 B Y H < S+ 0 0 6 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.923 114.6 39.2 -62.2 -44.7 -31.4 -130.1 -48.9 631 202 B Y H < S+ 0 0 33 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.708 96.9 81.6 -86.8 -21.1 -31.5 -126.4 -48.2 632 203 B E S >X S- 0 0 8 -4,-1.8 3,-2.6 -5,-0.2 4,-1.4 -0.787 77.1-144.3 -86.5 113.1 -28.3 -125.3 -50.0 633 204 B P T 34 S+ 0 0 88 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.739 94.9 52.8 -56.0 -28.9 -29.5 -125.1 -53.6 634 205 B H T 34 S+ 0 0 141 1,-0.2 -4,-0.1 2,-0.1 -5,-0.1 0.304 114.6 41.1 -93.3 12.6 -26.2 -126.4 -55.1 635 206 B Y T <> S+ 0 0 48 -3,-2.6 4,-1.8 -6,-0.4 3,-0.3 0.450 91.9 86.9-121.8 -17.9 -26.2 -129.5 -52.9 636 207 B K H X S+ 0 0 71 -4,-1.4 4,-2.2 1,-0.2 5,-0.2 0.879 86.5 51.8 -54.8 -43.4 -29.9 -130.4 -53.2 637 208 B E H > S+ 0 0 117 -4,-0.5 4,-1.7 1,-0.2 -1,-0.2 0.863 107.1 51.8 -69.1 -37.5 -29.5 -132.4 -56.4 638 209 B A H > S+ 0 0 36 -3,-0.3 4,-2.7 2,-0.2 5,-0.4 0.895 108.3 52.2 -63.2 -41.4 -26.7 -134.6 -55.0 639 210 B L H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 8,-0.3 0.967 111.1 47.9 -56.6 -50.6 -28.8 -135.4 -51.9 640 211 B K H < S+ 0 0 110 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.814 116.5 44.3 -58.8 -34.0 -31.7 -136.4 -54.2 641 212 B S H < S+ 0 0 76 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.904 123.1 28.0 -81.3 -43.3 -29.4 -138.6 -56.4 642 213 B Y H < S+ 0 0 112 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.620 134.0 24.3-101.5 -15.0 -27.3 -140.5 -53.9 643 214 B A >X + 0 0 0 -4,-2.1 4,-1.9 -5,-0.4 3,-1.8 -0.314 67.7 163.0-145.0 56.5 -29.6 -140.7 -50.8 644 215 B P H 3> S+ 0 0 49 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.722 72.4 58.7 -56.3 -30.2 -33.1 -140.4 -52.2 645 216 B A H 3> S+ 0 0 7 2,-0.2 4,-0.8 1,-0.2 -77,-0.1 0.778 109.7 43.5 -72.2 -27.8 -34.8 -141.8 -49.0 646 217 B L H <> S+ 0 0 0 -3,-1.8 4,-2.3 -7,-0.2 5,-0.2 0.815 110.8 55.7 -84.7 -30.3 -33.3 -139.1 -46.9 647 218 B F H X S+ 0 0 11 -4,-1.9 4,-3.0 -8,-0.3 -2,-0.2 0.954 108.7 47.0 -58.2 -51.6 -34.1 -136.4 -49.5 648 219 B N H X S+ 0 0 95 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.819 109.4 55.9 -62.5 -31.5 -37.7 -137.4 -49.4 649 220 B Y H X S+ 0 0 9 -4,-0.8 4,-1.6 2,-0.2 -1,-0.2 0.952 113.6 38.5 -62.9 -49.9 -37.6 -137.3 -45.6 650 221 B M H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 -2,-0.2 0.834 111.1 60.2 -71.7 -33.3 -36.3 -133.7 -45.6 651 222 B L H X S+ 0 0 61 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.940 106.8 47.1 -57.5 -47.0 -38.6 -132.8 -48.5 652 223 B E H X>S+ 0 0 67 -4,-2.0 5,-2.5 2,-0.2 4,-1.4 0.863 112.7 48.2 -66.4 -37.1 -41.6 -133.8 -46.3 653 224 B L H <>S+ 0 0 0 -4,-1.6 5,-2.6 3,-0.2 6,-0.5 0.948 114.8 46.5 -64.9 -46.1 -40.3 -131.8 -43.4 654 225 B D H <5S+ 0 0 43 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.911 119.4 38.2 -63.4 -42.6 -39.7 -128.8 -45.5 655 226 B Q H <5S- 0 0 130 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.656 140.0 -16.1 -87.7 -15.0 -43.0 -128.8 -47.3 656 227 B M T X5S+ 0 0 114 -4,-1.4 4,-1.5 -5,-0.2 -3,-0.2 0.511 118.2 61.1-150.5 -51.2 -45.3 -129.9 -44.5 657 228 B R H > S+ 0 0 94 -6,-0.5 4,-2.3 2,-0.2 -2,-0.2 0.845 109.5 45.8 -75.6 -34.5 -45.0 -126.6 -40.3 660 231 B E H X S+ 0 0 106 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.866 112.5 51.1 -77.4 -34.4 -47.3 -128.9 -38.5 661 232 B I H X S+ 0 0 22 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.988 114.5 44.6 -59.3 -53.6 -44.8 -129.3 -35.6 662 233 B S H X S+ 0 0 2 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.896 112.7 49.6 -57.8 -46.4 -44.5 -125.5 -35.4 663 234 B D H X S+ 0 0 62 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.909 109.2 53.3 -60.9 -39.8 -48.3 -125.0 -35.6 664 235 B D H X S+ 0 0 75 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.910 107.3 51.5 -60.7 -41.6 -48.8 -127.6 -32.9 665 236 B V H X S+ 0 0 12 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.893 108.7 51.8 -61.5 -40.2 -46.3 -125.7 -30.7 666 237 B K H X S+ 0 0 73 -4,-2.1 4,-0.6 2,-0.2 -1,-0.2 0.828 109.0 49.1 -67.3 -34.1 -48.3 -122.5 -31.2 667 238 B E H >X S+ 0 0 112 -4,-1.9 3,-1.0 2,-0.2 4,-0.7 0.936 111.4 48.5 -70.6 -48.1 -51.6 -124.0 -30.3 668 239 B K H >X S+ 0 0 106 -4,-2.3 4,-1.8 1,-0.3 3,-1.4 0.915 108.1 55.9 -54.6 -44.1 -50.2 -125.5 -27.1 669 240 B N H 3< S+ 0 0 75 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.733 98.6 63.6 -60.8 -21.6 -48.7 -122.1 -26.4 670 241 B K H << S+ 0 0 152 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.766 110.7 36.0 -73.6 -24.4 -52.3 -120.7 -26.7 671 242 B N H << S+ 0 0 119 -3,-1.4 2,-0.3 -4,-0.7 -2,-0.2 0.733 127.6 6.7-100.7 -27.5 -53.4 -122.7 -23.6 672 243 B V < - 0 0 41 -4,-1.8 2,-0.6 2,-0.1 -1,-0.3 -0.992 60.2-127.4-158.7 148.7 -50.4 -122.7 -21.3 673 244 B L B +s 766 0J 34 92,-2.1 94,-2.9 -2,-0.3 2,-0.4 -0.882 34.0 168.8-101.2 120.9 -47.0 -121.2 -20.9 674 245 B D - 0 0 46 -2,-0.6 94,-0.1 92,-0.2 146,-0.1 -0.949 20.9-176.3-137.8 112.8 -44.3 -123.8 -20.3 675 246 B F > - 0 0 14 144,-0.5 3,-2.1 92,-0.4 7,-0.1 0.542 22.6-168.0 -87.2 -4.2 -40.6 -123.0 -20.5 676 247 B K T 3 - 0 0 41 1,-0.3 145,-2.5 143,-0.1 -1,-0.2 -0.278 66.5 -29.4 50.7-131.5 -39.6 -126.6 -20.0 677 248 B W T 3 S+ 0 0 55 143,-0.2 2,-0.4 145,-0.0 -1,-0.3 0.408 109.4 111.7 -95.5 5.5 -35.8 -126.6 -19.2 678 249 B Y < - 0 0 8 -3,-2.1 4,-0.5 1,-0.1 -158,-0.2 -0.663 42.0-175.9 -90.5 127.4 -35.0 -123.5 -21.3 679 250 B T > + 0 0 6 -160,-1.2 4,-2.6 -2,-0.4 5,-0.2 0.653 65.8 70.0 -99.2 -18.0 -33.9 -120.5 -19.2 680 251 B R H > S+ 0 0 30 -161,-0.8 4,-1.9 -209,-0.3 5,-0.1 0.950 107.1 36.2 -72.3 -48.5 -33.4 -117.6 -21.7 681 252 B K H > S+ 0 0 80 -210,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.858 118.1 55.2 -68.0 -37.2 -37.1 -117.0 -22.6 682 253 B A H > S+ 0 0 0 -4,-0.5 4,-3.2 2,-0.2 5,-0.2 0.955 109.0 44.5 -60.9 -52.8 -38.1 -117.9 -19.0 683 254 B E H X S+ 0 0 76 -4,-2.6 4,-2.8 1,-0.2 5,-0.3 0.922 112.7 52.0 -61.7 -46.0 -35.8 -115.3 -17.4 684 255 B S H X S+ 0 0 83 -4,-1.9 4,-2.1 -5,-0.2 5,-0.3 0.914 114.4 43.6 -54.8 -44.3 -36.8 -112.6 -19.9 685 256 B W H X S+ 0 0 34 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.929 114.5 49.4 -68.3 -44.0 -40.5 -113.3 -19.2 686 257 B G H X S+ 0 0 0 -4,-3.2 4,-1.6 2,-0.2 162,-0.3 0.946 115.1 43.2 -60.8 -49.1 -40.0 -113.5 -15.4 687 258 B V H X S+ 0 0 47 -4,-2.8 4,-0.5 -5,-0.2 -1,-0.2 0.945 119.7 41.1 -64.6 -49.5 -38.1 -110.2 -15.2 688 259 B Q H >< S+ 0 0 126 -4,-2.1 3,-0.8 -5,-0.3 4,-0.4 0.921 114.3 50.7 -67.7 -44.0 -40.3 -108.3 -17.6 689 260 B T H 3< S+ 0 0 52 -4,-2.9 4,-0.2 -5,-0.3 -1,-0.2 0.847 119.9 34.5 -64.2 -33.4 -43.6 -109.6 -16.3 690 261 B F H 3X S+ 0 0 9 -4,-1.6 4,-2.8 -5,-0.3 -1,-0.2 0.294 86.7 101.6-109.8 11.3 -42.9 -108.8 -12.7 691 262 B K H S+ 0 0 117 -4,-0.4 4,-0.8 -3,-0.2 -1,-0.2 0.921 113.6 48.4 -62.4 -40.8 -43.6 -103.2 -12.0 693 264 B W H >4 S+ 0 0 18 -4,-0.2 3,-1.2 1,-0.2 4,-0.5 0.952 111.1 49.6 -64.8 -47.6 -44.4 -105.4 -9.0 694 265 B K H >< S+ 0 0 66 -4,-2.8 3,-1.5 1,-0.3 -1,-0.2 0.908 107.6 54.6 -56.7 -42.6 -40.8 -105.6 -7.9 695 266 B E H 3< S+ 0 0 99 -4,-2.3 -442,-0.4 1,-0.3 -1,-0.3 0.686 107.3 52.1 -69.5 -16.4 -40.4 -101.8 -8.2 696 267 B N T << S+ 0 0 60 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.419 83.2 113.2 -99.0 0.5 -43.4 -101.4 -5.9 697 268 B L < - 0 0 2 -3,-1.5 -445,-0.6 -4,-0.5 2,-0.1 -0.472 65.7-126.0 -68.2 140.7 -42.1 -103.6 -3.1 698 269 B T B > -M 251 0E 13 -447,-0.2 4,-2.8 -2,-0.2 -447,-0.3 -0.408 24.8-107.8 -76.3 163.4 -41.2 -102.0 0.2 699 270 B I H > S+ 0 0 33 -449,-2.6 4,-2.5 -452,-0.2 5,-0.2 0.923 122.0 51.5 -55.2 -47.4 -37.8 -102.4 1.8 700 271 B S H > S+ 0 0 19 -452,-1.9 4,-1.7 -450,-0.2 -1,-0.2 0.884 110.7 48.0 -58.2 -42.8 -39.3 -104.6 4.4 701 272 B E H > S+ 0 0 14 -453,-0.2 4,-2.3 2,-0.2 5,-0.2 0.942 112.1 47.5 -65.7 -48.8 -41.0 -106.8 1.8 702 273 B K H X S+ 0 0 54 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.907 109.1 55.7 -60.6 -40.9 -37.9 -107.2 -0.3 703 274 B D H X S+ 0 0 107 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.899 111.1 43.0 -59.1 -42.8 -35.8 -108.0 2.7 704 275 B I H X S+ 0 0 12 -4,-1.7 4,-3.0 2,-0.2 -1,-0.2 0.836 108.3 57.2 -77.8 -31.5 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115.2 45.7 -61.6 -35.8 -39.3 -121.6 10.3 716 287 B I H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.970 116.1 42.5 -71.8 -53.1 -41.9 -119.8 8.2 717 288 B N H X S+ 0 0 9 -4,-2.4 4,-1.7 -5,-0.3 -3,-0.2 0.850 115.1 51.3 -65.5 -31.8 -43.1 -122.9 6.3 718 289 B E H X S+ 0 0 124 -4,-2.5 4,-1.1 -5,-0.2 -1,-0.2 0.938 109.4 49.6 -67.8 -47.9 -43.1 -125.0 9.5 719 290 B Y H >< S+ 0 0 60 -4,-1.9 3,-0.6 -5,-0.3 4,-0.3 0.924 112.8 48.3 -52.8 -47.4 -45.2 -122.5 11.4 720 291 B L H 3< S+ 0 0 20 -4,-2.3 5,-0.3 1,-0.2 3,-0.3 0.846 113.4 46.5 -66.5 -35.0 -47.7 -122.3 8.5 721 292 B R H >< S+ 0 0 121 -4,-1.7 3,-2.4 -5,-0.2 -1,-0.2 0.648 81.0 113.2 -78.4 -15.9 -48.0 -126.1 8.2 722 293 B K T << S+ 0 0 99 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.1 0.679 89.8 13.0 -33.8 -57.2 -48.4 -126.7 12.0 723 294 B Y T > S- 0 0 77 -3,-0.3 3,-1.8 -4,-0.3 -1,-0.3 0.145 101.7-110.1-115.3 22.5 -52.0 -128.0 12.3 724 295 B D T < S- 0 0 119 -3,-2.4 -2,-0.1 1,-0.3 -3,-0.1 0.868 81.5 -49.1 53.5 39.5 -52.7 -128.7 8.6 725 296 B G T 3 S+ 0 0 46 -5,-0.3 -1,-0.3 1,-0.3 2,-0.1 0.192 104.0 128.8 91.5 -18.0 -55.2 -125.8 8.5 726 297 B E < - 0 0 134 -3,-1.8 2,-1.0 1,-0.1 -1,-0.3 -0.453 63.1-123.3 -67.5 144.5 -57.2 -126.6 11.6 727 298 B I + 0 0 160 -2,-0.1 -1,-0.1 -3,-0.1 -3,-0.0 -0.794 43.4 163.3 -93.4 99.3 -57.6 -123.6 14.0 728 299 B I - 0 0 74 -2,-1.0 -2,-0.0 2,-0.0 2,-0.0 -0.825 24.2-152.2-125.5 89.0 -56.2 -125.0 17.3 729 300 B P - 0 0 89 0, 0.0 2,-0.7 0, 0.0 -2,-0.0 -0.336 12.3-132.3 -62.4 136.7 -55.3 -122.2 19.8 730 301 B N + 0 0 140 -2,-0.0 2,-0.5 3,-0.0 -2,-0.0 -0.854 35.6 176.2 -91.0 112.2 -52.5 -122.8 22.3 731 302 B I + 0 0 152 -2,-0.7 3,-0.1 3,-0.0 2,-0.1 -0.972 35.2 41.1-129.0 125.2 -54.0 -121.7 25.6 732 303 B G S S+ 0 0 66 1,-0.5 0, 0.0 -2,-0.5 0, 0.0 -0.033 91.7 24.4 115.3 142.2 -52.4 -122.0 29.0 733 304 B G S S- 0 0 71 -2,-0.1 -1,-0.5 1,-0.0 2,-0.3 -0.106 79.4-103.7 65.7-171.3 -48.9 -121.4 30.2 734 305 B D - 0 0 147 -3,-0.1 2,-0.2 0, 0.0 3,-0.1 -0.982 17.4-112.3-149.5 152.8 -46.5 -119.1 28.4 735 306 B L - 0 0 98 -2,-0.3 -2,-0.0 1,-0.1 2,-0.0 -0.611 46.2-101.3 -78.9 150.8 -43.5 -119.3 26.1 736 307 B D > - 0 0 89 -2,-0.2 4,-2.3 1,-0.1 3,-0.3 -0.314 41.8 -96.3 -66.1 161.8 -40.2 -118.1 27.5 737 308 B K H > S+ 0 0 189 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.807 122.9 47.4 -48.4 -42.5 -39.1 -114.6 26.4 738 309 B K H > S+ 0 0 140 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.873 111.4 48.6 -72.4 -40.2 -36.8 -115.9 23.6 739 310 B S H > S+ 0 0 51 -3,-0.3 4,-1.5 1,-0.2 -2,-0.2 0.881 111.8 51.2 -68.9 -34.3 -39.3 -118.3 22.1 740 311 B K H X S+ 0 0 97 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.892 107.7 50.8 -70.6 -40.5 -42.0 -115.6 22.1 741 312 B K H X S+ 0 0 132 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.890 109.9 51.3 -62.9 -40.8 -39.8 -113.0 20.4 742 313 B A H X S+ 0 0 48 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.856 109.6 50.7 -61.8 -37.3 -39.0 -115.6 17.7 743 314 B L H X S+ 0 0 46 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.922 109.8 47.7 -71.3 -45.2 -42.7 -116.3 17.2 744 315 B E H X S+ 0 0 112 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.850 109.4 56.2 -62.7 -34.6 -43.7 -112.7 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76,-0.1 2,-0.1 -0.993 94.7 -78.9-153.3 158.3 -51.7 -116.3 -17.8 765 336 B N - 0 0 67 -2,-0.3 -92,-2.1 -94,-0.1 2,-0.3 -0.369 59.9-176.4 -56.9 128.0 -51.9 -120.1 -17.4 766 337 B L E -sT 673 840J 0 74,-2.7 74,-3.7 -94,-0.2 2,-0.5 -0.966 26.9-139.5-137.6 142.3 -48.4 -121.1 -16.5 767 338 B I E + T 0 839J 8 -94,-2.9 -92,-0.4 -2,-0.3 2,-0.3 -0.897 25.7 179.5 -99.3 129.9 -46.5 -124.4 -15.8 768 339 B V E - T 0 838J 0 70,-2.3 70,-3.0 -2,-0.5 2,-0.4 -0.871 16.3-135.4-122.7 167.2 -44.0 -124.4 -12.9 769 340 B Y E +UT 818 837J 2 49,-2.8 49,-3.6 -2,-0.3 2,-0.3 -0.930 18.7 176.9-127.0 142.8 -41.7 -127.1 -11.5 770 341 B R E - T 0 836J 36 66,-2.1 66,-3.3 -2,-0.4 2,-0.4 -0.963 18.1-146.5-148.5 126.9 -40.9 -128.3 -8.1 771 342 B R E + T 0 835J 15 -2,-0.3 2,-0.3 64,-0.2 64,-0.2 -0.810 31.3 159.0 -93.4 135.6 -38.7 -131.2 -6.8 772 343 B V E - T 0 834J 11 62,-2.0 62,-1.3 -2,-0.4 2,-0.2 -0.892 33.3-119.3-145.5 167.9 -39.9 -132.9 -3.6 773 344 B S > - 0 0 36 -2,-0.3 3,-2.3 59,-0.2 4,-0.1 -0.498 50.6 -81.9-100.6 178.1 -39.4 -136.1 -1.7 774 345 B E G > S+ 0 0 22 1,-0.3 3,-2.1 8,-0.2 7,-0.2 0.666 116.9 84.7 -55.7 -19.3 -42.1 -138.7 -0.7 775 346 B L G > + 0 0 75 1,-0.3 3,-1.9 7,-0.2 -1,-0.3 0.658 68.7 83.5 -56.8 -15.6 -42.9 -136.4 2.3 776 347 B Q G < S+ 0 0 22 -3,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.859 90.6 48.6 -53.2 -36.0 -45.1 -134.6 -0.3 777 348 B F G < S- 0 0 8 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.317 129.0 -76.0 -92.9 5.9 -47.7 -137.2 0.5 778 349 B G X - 0 0 20 -3,-1.9 3,-2.0 1,-0.1 -1,-0.3 -0.313 49.2 -69.4 118.9 163.0 -47.4 -136.9 4.3 779 350 B K G > S+ 0 0 176 1,-0.3 3,-1.3 2,-0.2 -1,-0.1 0.736 121.2 66.4 -58.8 -26.3 -45.2 -137.7 7.3 780 351 B K G 3 S+ 0 0 166 1,-0.3 3,-0.3 -3,-0.2 -1,-0.3 0.743 97.2 55.4 -68.0 -22.8 -46.1 -141.4 7.0 781 352 B Y G X S+ 0 0 29 -3,-2.0 3,-1.9 1,-0.2 -1,-0.3 0.299 70.9 115.8 -94.4 8.7 -44.3 -141.6 3.7 782 353 B E T < S+ 0 0 118 -3,-1.3 3,-0.3 1,-0.3 -7,-0.2 0.873 88.8 26.3 -49.2 -52.5 -40.9 -140.3 5.0 783 354 B D T 3 S+ 0 0 138 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 -0.319 82.3 133.1-106.5 49.2 -39.0 -143.5 4.4 784 355 B Y < - 0 0 24 -3,-1.9 -1,-0.2 -2,-0.1 -2,-0.1 0.734 53.6-147.5 -72.8 -22.8 -41.2 -144.7 1.6 785 356 B N + 0 0 83 -3,-0.3 11,-0.1 -4,-0.2 8,-0.1 0.965 30.3 167.8 49.7 61.7 -38.2 -145.5 -0.6 786 357 B L + 0 0 0 1,-0.2 7,-2.9 6,-0.1 2,-0.5 0.832 67.1 42.1 -70.7 -34.8 -40.0 -144.7 -3.9 787 358 B R E +B 792 0L 33 5,-0.2 2,-0.4 98,-0.0 5,-0.2 -0.967 65.7 178.5-120.0 126.0 -36.7 -144.8 -5.8 788 359 B Q E > S-B 791 0L 114 3,-2.4 3,-2.2 -2,-0.5 0, 0.0 -0.997 74.0 -12.4-125.4 129.2 -34.0 -147.5 -5.3 789 360 B N T 3 S- 0 0 152 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.869 129.5 -53.1 48.4 44.2 -30.8 -147.5 -7.3 790 361 B G T 3 S+ 0 0 12 1,-0.2 93,-2.6 92,-0.1 2,-0.5 0.330 115.0 118.2 81.0 -6.8 -32.2 -145.0 -9.8 791 362 B I E < -B 788 0L 93 -3,-2.2 -3,-2.4 91,-0.1 2,-0.4 -0.821 60.9-136.9-104.0 126.1 -35.3 -147.1 -10.3 792 363 B I E -B 787 0L 3 -2,-0.5 2,-0.6 -5,-0.2 -5,-0.2 -0.645 26.4-120.8 -79.6 128.7 -38.8 -145.9 -9.5 793 364 B N > - 0 0 56 -7,-2.9 4,-1.7 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