==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 10-OCT-02 1IZO . COMPND 2 MOLECULE: CYTOCHROME P450 152A1; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR D.S.LEE,A.YAMADA,H.SUGIMOTO,I.MATSUNAGA,H.OGURA,K.ICHIHARA, . 1233 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54597.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 882 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 93 7.5 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 . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.5 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 . 47 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 171 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 498 40.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.6 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 5 1 7 6 0 0 0 3 2 5 0 1 6 0 0 0 0 1 1 1 3 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 2 1 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 3 9 0 3 3 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 3 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 6 A P 0 0 78 0, 0.0 32,-2.3 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 157.1 101.0 33.9 29.6 2 7 A H B -a 33 0A 82 30,-0.2 2,-0.5 32,-0.0 32,-0.2 -0.791 360.0-162.6-138.5 95.6 98.0 34.6 27.3 3 8 A D - 0 0 12 30,-2.0 32,-0.3 -2,-0.4 5,-0.1 -0.616 13.2-175.2 -71.0 118.9 96.6 32.2 24.7 4 9 A K + 0 0 150 -2,-0.5 -1,-0.1 30,-0.1 30,-0.1 0.255 30.3 135.4-105.6 15.1 94.6 34.6 22.5 5 10 A S > - 0 0 58 1,-0.1 3,-0.5 2,-0.1 30,-0.4 -0.295 50.7-143.6 -59.3 144.6 93.0 32.0 20.2 6 11 A L T 3 S+ 0 0 177 1,-0.2 -1,-0.1 2,-0.1 3,-0.1 0.295 93.2 53.7 -96.4 11.9 89.3 32.8 19.6 7 12 A D T >> + 0 0 79 1,-0.1 4,-2.0 2,-0.1 3,-0.5 0.013 62.6 127.3-132.3 27.8 88.3 29.1 19.5 8 13 A N H <> S+ 0 0 2 -3,-0.5 4,-2.3 27,-0.3 28,-0.1 0.763 71.8 58.0 -60.7 -28.0 89.7 27.8 22.8 9 14 A S H 3> S+ 0 0 41 26,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.900 109.0 47.7 -66.3 -38.5 86.4 26.3 23.9 10 15 A L H <> S+ 0 0 92 -3,-0.5 4,-1.0 1,-0.2 -2,-0.2 0.899 111.7 48.6 -67.2 -40.5 86.5 24.3 20.7 11 16 A T H X S+ 0 0 23 -4,-2.0 4,-2.2 1,-0.2 5,-0.3 0.846 104.9 59.8 -68.2 -34.1 90.1 23.3 21.3 12 17 A L H X S+ 0 0 11 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.893 105.1 49.7 -59.5 -39.7 89.2 22.3 24.8 13 18 A L H < S+ 0 0 70 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.760 113.0 46.8 -70.8 -26.1 86.7 19.8 23.3 14 19 A K H < S+ 0 0 139 -4,-1.0 -2,-0.2 -3,-0.2 -1,-0.2 0.784 122.9 32.4 -87.6 -26.1 89.3 18.4 21.0 15 20 A E H >< S+ 0 0 52 -4,-2.2 3,-2.4 1,-0.2 -2,-0.2 0.641 81.7 169.1-104.1 -17.0 92.0 18.1 23.6 16 21 A G G >< S+ 0 0 1 -4,-2.4 3,-1.8 1,-0.3 4,-0.4 -0.112 71.2 15.4 46.7-119.8 90.0 17.2 26.7 17 22 A Y G 3 S+ 0 0 5 375,-2.1 4,-0.4 1,-0.3 -1,-0.3 0.715 132.0 51.2 -58.9 -19.9 92.0 16.1 29.6 18 23 A L G <> S+ 0 0 47 -3,-2.4 4,-2.5 374,-0.6 -1,-0.3 0.411 80.5 95.7 -99.7 2.8 95.2 17.4 27.9 19 24 A F H <> S+ 0 0 0 -3,-1.8 4,-1.2 -7,-0.2 5,-0.2 0.967 93.4 33.6 -57.5 -55.8 94.0 21.0 27.1 20 25 A I H > S+ 0 0 2 -4,-0.4 4,-3.2 1,-0.2 5,-0.3 0.929 119.4 51.4 -67.3 -44.8 95.4 22.7 30.2 21 26 A K H > S+ 0 0 24 -4,-0.4 4,-1.6 1,-0.2 5,-0.2 0.831 104.6 56.3 -61.8 -37.5 98.5 20.5 30.4 22 27 A N H X S+ 0 0 56 -4,-2.5 4,-1.3 2,-0.2 -1,-0.2 0.885 116.1 37.9 -63.8 -37.1 99.5 21.0 26.8 23 28 A R H X S+ 0 0 10 -4,-1.2 4,-3.4 -5,-0.3 5,-0.3 0.946 110.7 54.4 -80.8 -49.9 99.6 24.7 27.4 24 29 A T H <>S+ 0 0 12 -4,-3.2 5,-1.7 1,-0.3 -2,-0.2 0.856 115.7 44.8 -52.8 -32.3 101.0 24.9 30.8 25 30 A E H ><5S+ 0 0 89 -4,-1.6 3,-0.6 -5,-0.3 -1,-0.3 0.867 112.6 50.6 -77.4 -37.0 103.8 22.9 29.4 26 31 A R H 3<5S+ 0 0 133 -4,-1.3 -2,-0.2 1,-0.2 -3,-0.2 0.897 116.0 40.6 -66.5 -41.7 104.0 25.0 26.3 27 32 A Y T 3<5S- 0 0 59 -4,-3.4 -1,-0.2 2,-0.2 -2,-0.2 0.365 103.7-130.4 -87.8 3.0 104.2 28.2 28.2 28 33 A N T < 5S+ 0 0 76 -3,-0.6 2,-0.3 -5,-0.3 -3,-0.2 0.855 73.2 115.3 48.5 35.5 106.5 26.7 30.8 29 34 A S S + B 0 39A 0 3,-1.8 3,-2.9 -2,-0.7 -2,-0.1 -0.954 54.3 2.8-133.1 154.3 86.8 29.6 27.5 37 42 A L T 3 S- 0 0 60 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.799 128.8 -60.1 41.6 35.5 83.2 28.7 27.8 38 43 A G T 3 S+ 0 0 47 1,-0.2 -1,-0.3 -3,-0.1 2,-0.3 0.722 118.7 96.2 69.8 24.6 82.4 32.3 26.9 39 44 A K E < S-B 36 0A 125 -3,-2.9 -3,-1.8 269,-0.0 2,-0.7 -0.889 83.4 -98.3-138.6 167.4 84.3 33.8 29.8 40 45 A N E -B 35 0A 105 -2,-0.3 268,-2.0 -5,-0.2 2,-0.3 -0.816 54.1-172.0 -89.8 117.3 87.7 35.2 30.7 41 46 A F E -Bc 34 308A 5 -7,-3.1 -7,-2.3 -2,-0.7 2,-0.5 -0.797 30.8-157.4-116.7 154.1 89.6 32.4 32.3 42 47 A I E -Bc 33 309A 10 266,-1.9 268,-2.0 -2,-0.3 2,-0.5 -0.998 21.6-158.2-122.7 121.7 92.8 31.7 34.1 43 48 A C E +Bc 32 310A 0 -11,-2.9 -11,-1.9 -2,-0.5 2,-0.3 -0.899 16.0 175.9-105.0 132.2 93.8 28.0 33.9 44 49 A M E -Bc 31 311A 0 266,-2.5 268,-2.7 -2,-0.5 2,-0.3 -0.916 11.5-172.8-135.0 161.8 96.2 26.5 36.5 45 50 A T + 0 0 8 -15,-1.8 4,-0.4 -2,-0.3 268,-0.1 -0.917 37.5 64.0-145.9 166.5 97.7 23.2 37.4 46 51 A G S > S- 0 0 1 266,-0.5 4,-1.9 -2,-0.3 270,-0.1 0.048 81.9 -81.8 96.5 155.6 99.8 21.7 40.2 47 52 A A H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.884 125.9 51.7 -60.4 -43.7 99.4 21.1 43.9 48 53 A E H > S+ 0 0 113 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.941 111.0 48.5 -60.8 -45.1 100.3 24.6 45.0 49 54 A A H > S+ 0 0 2 -4,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.862 108.7 54.7 -63.0 -34.4 97.8 26.0 42.6 50 55 A A H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.936 102.6 56.3 -65.3 -43.6 95.2 23.5 44.0 51 56 A K H < S+ 0 0 91 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.876 111.6 43.3 -54.7 -39.6 95.8 24.8 47.5 52 57 A V H >< S+ 0 0 23 -4,-1.6 3,-2.2 1,-0.2 -1,-0.2 0.930 107.5 58.7 -71.9 -44.9 94.9 28.4 46.3 53 58 A F H 3< S+ 0 0 2 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.859 107.8 48.5 -52.0 -36.3 92.0 27.1 44.3 54 59 A Y T 3< S+ 0 0 24 -4,-2.0 2,-0.9 -5,-0.1 -1,-0.3 0.428 78.0 112.6 -85.7 0.4 90.5 25.7 47.5 55 60 A D X> - 0 0 48 -3,-2.2 4,-1.1 1,-0.2 3,-0.9 -0.655 55.7-161.1 -71.5 109.7 91.1 28.9 49.6 56 61 A T T 34 S+ 0 0 74 -2,-0.9 -1,-0.2 1,-0.2 28,-0.1 0.426 82.9 65.9 -80.1 3.9 87.4 29.7 50.0 57 62 A D T 34 S+ 0 0 96 1,-0.1 -1,-0.2 3,-0.0 -2,-0.1 0.729 112.3 34.5 -89.8 -25.1 88.1 33.4 50.9 58 63 A R T <4 S+ 0 0 73 -3,-0.9 235,-2.3 -6,-0.2 236,-0.6 0.592 118.5 52.0-102.6 -13.7 89.3 33.9 47.3 59 64 A F E < -D 292 0A 7 -4,-1.1 2,-0.3 233,-0.2 233,-0.2 -0.967 51.6-176.0-133.3 143.8 87.0 31.5 45.4 60 65 A Q E -D 291 0A 51 231,-2.0 231,-2.6 -2,-0.4 23,-0.1 -0.929 17.1-153.9-128.5 155.3 83.3 30.8 45.0 61 66 A R > + 0 0 35 -2,-0.3 3,-2.2 229,-0.2 4,-0.4 0.681 61.1 109.0-102.4 -20.7 81.5 28.1 43.0 62 67 A Q T 3 S- 0 0 98 1,-0.3 -2,-0.1 2,-0.1 20,-0.1 -0.356 97.7 -1.6 -60.2 131.9 78.2 29.9 42.4 63 68 A N T 3 S+ 0 0 98 2,-0.1 -1,-0.3 1,-0.1 227,-0.1 0.607 96.8 124.2 61.8 15.6 77.8 30.9 38.8 64 69 A A < + 0 0 8 -3,-2.2 226,-0.2 225,-0.2 -2,-0.1 0.784 67.3 40.0 -76.1 -26.5 81.3 29.5 38.0 65 70 A L S S- 0 0 53 -4,-0.4 -2,-0.1 224,-0.1 5,-0.1 -0.878 94.5 -88.6-125.9 156.4 80.2 27.1 35.3 66 71 A P >> - 0 0 44 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.225 40.4-118.2 -55.5 148.2 77.7 27.2 32.3 67 72 A K H 3> S+ 0 0 92 1,-0.3 4,-2.1 2,-0.2 3,-0.4 0.695 105.5 80.7 -62.0 -20.4 74.2 26.0 33.3 68 73 A R H 34 S+ 0 0 73 1,-0.2 4,-0.4 2,-0.2 5,-0.3 0.776 88.2 56.2 -58.5 -26.2 74.5 23.1 30.9 69 74 A V H X>>S+ 0 0 19 -3,-1.6 5,-1.8 1,-0.2 4,-0.8 0.886 107.8 46.9 -73.6 -39.8 76.5 21.3 33.6 70 75 A Q H 3<>S+ 0 0 23 -4,-0.5 5,-2.3 -3,-0.4 -2,-0.2 0.841 109.9 53.4 -68.7 -34.8 73.7 21.7 36.1 71 76 A K T 3<5S+ 0 0 101 -4,-2.1 -1,-0.2 4,-0.2 111,-0.2 0.555 124.7 23.2 -79.4 -7.0 71.1 20.5 33.6 72 77 A S T <45S+ 0 0 0 -3,-0.6 -3,-0.2 -4,-0.4 -2,-0.1 0.644 134.9 15.0-116.4 -73.1 72.9 17.3 32.8 73 78 A L T <5S+ 0 0 27 -4,-0.8 -3,-0.2 -5,-0.3 -4,-0.1 0.929 128.2 28.1 -72.8 -54.7 75.3 16.2 35.6 74 79 A F T < - 0 0 0 -5,-2.3 3,-0.8 -6,-0.3 2,-0.2 -0.015 51.1 -61.5 101.5 148.0 70.9 19.1 38.9 76 81 A V T 3 S- 0 0 60 1,-0.2 154,-0.1 -2,-0.1 -9,-0.0 -0.473 112.8 -8.4 -72.7 132.1 69.9 22.8 39.0 77 82 A N T 3 S+ 0 0 109 -2,-0.2 -1,-0.2 1,-0.1 2,-0.1 0.856 96.0 144.7 52.7 47.9 71.1 24.9 42.0 78 83 A A X - 0 0 2 -3,-0.8 3,-2.2 152,-0.1 4,-0.4 -0.342 67.0 -66.2-103.4-173.0 72.4 22.0 44.1 79 84 A I G > S+ 0 0 14 1,-0.3 3,-1.2 2,-0.2 12,-0.1 0.746 123.3 65.9 -43.2 -38.5 75.4 21.5 46.5 80 85 A Q G 3 S+ 0 0 42 1,-0.2 -1,-0.3 -6,-0.1 276,-0.0 0.826 105.9 42.2 -61.3 -28.7 78.0 21.9 43.8 81 86 A G G < S+ 0 0 30 -3,-2.2 -1,-0.2 -19,-0.1 -2,-0.2 0.372 94.3 103.3-100.3 4.6 77.0 25.6 43.2 82 87 A M < - 0 0 35 -3,-1.2 2,-0.3 -4,-0.4 -21,-0.2 -0.514 47.1-168.5 -88.9 156.1 76.6 26.6 46.9 83 88 A D >> + 0 0 47 -2,-0.2 4,-1.0 -22,-0.1 3,-0.5 -0.886 40.8 10.4-137.4 164.9 79.0 28.6 49.0 84 89 A G H >> S- 0 0 51 -2,-0.3 4,-2.3 1,-0.2 3,-0.5 -0.094 114.0 -20.8 67.6-161.5 79.5 29.6 52.6 85 90 A S H 3> S+ 0 0 75 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.813 135.5 58.0 -53.4 -34.7 77.8 28.3 55.7 86 91 A A H <> S+ 0 0 34 -3,-0.5 4,-2.3 2,-0.2 5,-0.3 0.931 107.3 46.8 -63.8 -45.1 74.9 27.0 53.6 87 92 A H H X S+ 0 0 63 -4,-2.6 4,-1.1 -5,-0.2 3,-0.9 0.994 115.1 38.0 -57.9 -63.9 75.6 22.8 56.2 90 95 A R H 3X S+ 0 0 16 -4,-2.3 4,-1.6 1,-0.3 3,-0.3 0.843 111.7 60.7 -58.4 -32.9 74.3 20.7 53.3 91 96 A K H 3X S+ 0 0 4 -4,-3.0 4,-2.5 -5,-0.3 -1,-0.3 0.868 98.7 57.3 -62.3 -35.6 77.8 19.3 52.8 92 97 A M H < S+ 0 0 8 -4,-1.6 3,-1.5 1,-0.2 -2,-0.2 0.928 112.5 53.0 -56.7 -49.6 76.3 14.2 52.5 95 100 A L H >< S+ 0 0 29 -4,-2.5 3,-1.8 1,-0.3 -1,-0.2 0.834 100.2 61.0 -57.7 -35.8 79.2 13.5 54.7 96 101 A S H 3< S+ 0 0 58 -4,-2.1 3,-0.3 1,-0.3 -1,-0.3 0.687 105.1 50.0 -66.9 -17.3 77.1 11.8 57.3 97 102 A L T << S+ 0 0 1 -3,-1.5 -1,-0.3 -4,-0.6 -2,-0.2 0.247 109.6 51.7-100.7 7.8 76.0 9.3 54.7 98 103 A M S < S+ 0 0 14 -3,-1.8 -2,-0.2 4,-0.1 265,-0.2 0.193 74.9 130.4-132.7 17.2 79.5 8.5 53.7 99 104 A T S > S- 0 0 53 -3,-0.3 4,-2.6 -4,-0.2 3,-0.4 -0.100 79.3 -87.4 -64.1 167.8 81.3 7.7 56.9 100 105 A P H > S+ 0 0 73 0, 0.0 4,-3.3 0, 0.0 5,-0.2 0.863 127.3 58.3 -47.3 -38.8 83.4 4.5 57.3 101 106 A P H > S+ 0 0 83 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.959 109.5 41.2 -57.7 -53.3 80.3 2.6 58.4 102 107 A H H > S+ 0 0 37 -3,-0.4 4,-2.9 2,-0.2 5,-0.2 0.899 114.1 55.1 -60.5 -41.5 78.4 3.3 55.2 103 108 A Q H X S+ 0 0 35 -4,-2.6 4,-2.2 1,-0.2 5,-0.2 0.975 109.9 45.1 -53.8 -56.9 81.5 2.7 53.2 104 109 A K H X S+ 0 0 149 -4,-3.3 4,-2.3 1,-0.2 -2,-0.2 0.867 112.5 52.1 -55.3 -42.2 81.9 -0.7 54.8 105 110 A R H X S+ 0 0 97 -4,-2.6 4,-2.7 -5,-0.2 -1,-0.2 0.921 109.7 47.9 -62.6 -44.8 78.3 -1.5 54.2 106 111 A L H X S+ 0 0 1 -4,-2.9 4,-1.5 2,-0.2 -2,-0.2 0.862 111.6 50.2 -66.3 -35.0 78.5 -0.6 50.5 107 112 A A H X S+ 0 0 14 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.923 110.6 51.6 -66.8 -41.7 81.6 -2.6 50.0 108 113 A E H X S+ 0 0 113 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.954 108.1 49.5 -57.7 -55.0 79.9 -5.5 51.7 109 114 A L H X S+ 0 0 6 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.820 112.2 50.4 -56.5 -31.4 76.8 -5.3 49.5 110 115 A M H X S+ 0 0 2 -4,-1.5 4,-2.8 2,-0.2 5,-0.2 0.898 105.8 53.7 -75.2 -41.6 79.1 -5.3 46.4 111 116 A T H X S+ 0 0 50 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.924 110.1 48.9 -58.9 -41.9 81.1 -8.3 47.5 112 117 A E H X S+ 0 0 123 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.914 110.6 50.3 -63.4 -44.7 77.9 -10.2 47.8 113 118 A E H X S+ 0 0 47 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.914 110.2 49.0 -62.3 -44.7 76.7 -9.1 44.4 114 119 A W H X S+ 0 0 4 -4,-2.8 4,-1.2 2,-0.2 -1,-0.2 0.889 110.7 51.6 -62.5 -38.8 79.9 -10.1 42.7 115 120 A K H < S+ 0 0 116 -4,-2.0 4,-0.5 -5,-0.2 3,-0.4 0.935 112.1 45.2 -63.5 -45.5 79.8 -13.5 44.4 116 121 A A H >X S+ 0 0 63 -4,-2.3 3,-1.5 1,-0.2 4,-0.6 0.920 107.2 59.8 -62.6 -45.1 76.3 -14.2 43.2 117 122 A A H >X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.3 3,-0.8 0.784 87.2 75.5 -55.2 -32.2 77.1 -13.0 39.7 118 123 A V H 3X S+ 0 0 0 -4,-1.2 4,-2.2 -3,-0.4 -1,-0.3 0.868 89.3 59.0 -48.2 -41.3 79.7 -15.7 39.3 119 124 A T H <4 S+ 0 0 64 -3,-1.5 4,-0.5 -4,-0.5 -1,-0.3 0.892 111.8 37.8 -58.2 -43.0 77.0 -18.2 38.8 120 125 A R H XX S+ 0 0 130 -3,-0.8 3,-0.9 -4,-0.6 4,-0.8 0.888 112.8 55.1 -77.0 -42.3 75.6 -16.4 35.8 121 126 A W H >< S+ 0 0 3 -4,-2.5 3,-1.0 1,-0.3 287,-0.3 0.881 101.9 59.0 -58.3 -41.1 78.8 -15.3 34.2 122 127 A E T 3< S+ 0 0 79 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.789 107.9 47.1 -58.9 -29.1 80.1 -18.9 34.2 123 128 A K T <4 S+ 0 0 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0 0 32 -4,-2.0 4,-1.0 -5,-0.3 -2,-0.2 0.964 117.1 35.6 -56.7 -54.2 61.1 9.3 39.9 189 194 A I H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.856 110.6 62.1 -71.4 -35.6 62.9 10.3 43.1 190 195 A E H X S+ 0 0 38 -4,-3.2 4,-2.3 -5,-0.3 -1,-0.2 0.905 101.8 52.5 -57.7 -40.9 60.8 13.3 43.9 191 196 A V H X S+ 0 0 78 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.863 108.9 50.9 -63.5 -34.5 57.7 11.1 44.2 192 197 A M H X S+ 0 0 16 -4,-1.0 4,-3.1 2,-0.2 -2,-0.2 0.940 107.5 51.9 -67.0 -46.6 59.6 8.9 46.7 193 198 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.934 112.8 46.3 -53.4 -48.3 60.6 11.9 48.8 194 199 A E H X S+ 0 0 91 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.892 112.1 49.3 -64.5 -41.1 57.0 13.0 48.9 195 200 A D H <>S+ 0 0 64 -4,-2.2 5,-2.5 1,-0.2 6,-0.9 0.916 111.0 51.8 -63.1 -42.0 55.7 9.5 49.7 196 201 A A H ><5S+ 0 0 3 -4,-3.1 3,-1.0 1,-0.2 -2,-0.2 0.902 107.7 51.5 -59.8 -44.5 58.3 9.3 52.5 197 202 A R H 3<5S+ 0 0 62 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.764 110.9 47.8 -66.7 -25.5 57.2 12.6 53.9 198 203 A A T 3<5S- 0 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4,-2.6 1,-0.2 3,-1.6 0.868 109.5 53.8 -69.3 -36.5 69.7 12.1 46.7 233 238 A I H 3X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.3 -2,-0.2 0.867 98.8 61.3 -64.8 -35.5 70.5 11.8 43.0 234 239 A N H 3< S+ 0 0 11 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.422 111.1 42.5 -71.2 4.8 73.9 13.4 43.8 235 240 A V H <> S+ 0 0 4 -3,-1.6 4,-1.2 -5,-0.1 -2,-0.2 0.711 119.7 38.8-109.0 -54.8 74.4 10.3 46.0 236 241 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 3,-0.4 0.930 112.4 53.5 -61.7 -55.9 73.0 7.6 43.7 237 242 A R H X S+ 0 0 16 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.923 109.0 48.8 -49.8 -53.2 74.3 8.7 40.3 238 243 A P H 4 S+ 0 0 48 0, 0.0 4,-0.4 0, 0.0 -1,-0.2 0.824 107.5 55.3 -60.7 -32.5 78.0 9.0 41.5 239 244 A I H >< S+ 0 0 11 -4,-1.2 3,-1.6 -3,-0.4 4,-0.3 0.953 110.2 45.9 -65.3 -43.6 77.9 5.5 43.1 240 245 A V H >< S+ 0 0 0 -4,-2.2 3,-1.8 1,-0.3 -1,-0.2 0.832 103.2 65.5 -66.6 -28.7 76.8 4.2 39.7 241 246 A A T >X S+ 0 0 9 -4,-1.9 3,-1.6 1,-0.3 4,-0.6 0.628 77.3 83.7 -69.6 -9.9 79.5 6.3 38.1 242 247 A I H X> S+ 0 0 6 -3,-1.6 4,-2.5 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126.0 58.3-120.2 -11.7 105.4 15.1 42.7 323 328 A W S < S- 0 0 2 -4,-2.1 -1,-0.2 -5,-0.0 2,-0.1 -0.936 74.9-139.9-127.4 110.2 105.0 11.8 40.7 324 329 A D S S+ 0 0 94 -2,-0.5 4,-0.2 1,-0.3 9,-0.1 -0.462 92.8 0.2 -64.8 136.9 108.1 10.1 39.4 325 330 A H S > S- 0 0 95 -2,-0.1 3,-1.5 1,-0.1 -1,-0.3 0.925 84.1-174.7 44.7 54.2 107.3 8.8 35.9 326 331 A P T 3 S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.731 72.1 62.2 -49.9 -30.5 103.8 10.3 36.2 327 332 A D T 3 S+ 0 0 89 -4,-0.1 2,-0.4 -9,-0.1 -2,-0.1 0.101 92.4 80.7 -89.0 24.4 102.7 8.8 32.8 328 333 A E S < S- 0 0 88 -3,-1.5 2,-0.9 -4,-0.2 -47,-0.0 -0.986 81.6-118.6-133.5 142.8 103.1 5.2 33.9 329 334 A F + 0 0 8 -2,-0.4 -2,-0.1 1,-0.1 -51,-0.1 -0.705 49.0 149.8 -79.9 105.0 100.9 2.9 36.0 330 335 A R > + 0 0 68 -2,-0.9 3,-2.4 -4,-0.1 4,-0.3 -0.696 23.2 179.0-140.5 84.5 102.9 2.0 39.1 331 336 A P G > S+ 0 0 0 0, 0.0 3,-0.9 0, 0.0 -55,-0.1 0.619 79.5 77.3 -62.2 -6.0 100.9 1.3 42.2 332 337 A E G > S+ 0 0 73 1,-0.2 3,-2.9 2,-0.2 -58,-0.1 0.809 75.7 75.0 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424 17 B L H X S+ 0 0 9 -4,-2.5 4,-2.2 1,-0.2 3,-0.4 0.898 103.4 52.8 -60.8 -37.2 86.9 87.9 46.1 425 18 B L H < S+ 0 0 76 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.844 108.7 47.7 -68.1 -33.2 83.3 88.8 46.2 426 19 B K H < S+ 0 0 167 -4,-0.9 -1,-0.2 1,-0.1 -2,-0.2 0.604 122.6 32.4 -84.1 -10.9 83.5 91.2 43.3 427 20 B E H >< S+ 0 0 47 -4,-1.2 3,-2.6 -3,-0.4 4,-0.3 0.616 75.3 168.7-120.8 -16.6 85.5 88.9 41.0 428 21 B G G >< S+ 0 0 1 -4,-2.2 3,-1.4 377,-0.4 4,-0.4 -0.082 74.7 16.3 43.8-118.9 84.3 85.4 41.8 429 22 B Y G 3 S+ 0 0 4 375,-2.2 4,-0.4 1,-0.3 298,-0.3 0.600 130.8 51.0 -61.5 -12.9 85.6 82.9 39.2 430 23 B L G <> S+ 0 0 54 -3,-2.6 4,-2.8 374,-0.4 5,-0.3 0.554 80.7 93.7-102.3 -9.4 88.2 85.4 37.9 431 24 B F H <> S+ 0 0 1 -3,-1.4 4,-1.1 -4,-0.3 -2,-0.1 0.922 96.0 32.3 -47.4 -57.2 89.8 86.4 41.2 432 25 B I H >> S+ 0 0 2 -4,-0.4 4,-2.8 1,-0.2 3,-0.7 0.971 118.9 51.0 -67.6 -55.3 92.6 83.8 41.0 433 26 B K H 3> S+ 0 0 22 -4,-0.4 4,-1.4 1,-0.2 5,-0.2 0.815 105.5 58.8 -53.3 -34.5 93.1 83.7 37.2 434 27 B 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99.3 72.5 40.9 462 55 B A H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.916 101.8 53.0 -70.3 -43.0 96.3 70.2 40.9 463 56 B K H < S+ 0 0 94 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.845 114.8 42.9 -60.9 -32.9 98.4 67.1 41.1 464 57 B V H >< S+ 0 0 18 -4,-1.5 3,-3.3 2,-0.2 6,-0.2 0.939 108.2 57.7 -76.0 -50.1 100.1 68.6 44.2 465 58 B F H 3< S+ 0 0 2 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.850 107.6 50.4 -46.8 -40.9 96.8 69.9 45.7 466 59 B Y T 3< S+ 0 0 26 -4,-2.2 2,-1.1 -5,-0.1 -1,-0.3 0.267 77.6 114.2 -85.8 12.0 95.6 66.3 45.6 467 60 B D X> - 0 0 46 -3,-3.3 4,-1.7 1,-0.2 3,-0.9 -0.740 52.9-163.5 -81.0 104.5 98.7 64.9 47.3 468 61 B T T 34 S+ 0 0 73 -2,-1.1 -1,-0.2 1,-0.3 28,-0.2 0.574 85.9 59.3 -69.6 -7.0 96.9 63.7 50.5 469 62 B D T 34 S+ 0 0 95 1,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.755 114.1 36.8 -87.3 -26.7 100.3 63.5 52.3 470 63 B R T <4 S+ 0 0 78 -3,-0.9 235,-1.9 -6,-0.2 236,-0.6 0.656 120.7 42.6 -97.7 -18.5 100.8 67.2 51.7 471 64 B F E < -M 704 0E 5 -4,-1.7 2,-0.3 233,-0.2 233,-0.2 -0.973 55.0-170.5-135.5 145.7 97.2 68.5 52.1 472 65 B Q E -M 703 0E 50 231,-2.6 231,-2.7 -2,-0.3 23,-0.1 -0.909 17.9-150.1-128.0 157.8 94.3 68.0 54.4 473 66 B R > + 0 0 34 -2,-0.3 3,-2.2 21,-0.2 4,-0.4 0.709 62.1 111.6 -98.7 -23.6 90.7 69.2 54.1 474 67 B Q T 3 S- 0 0 98 1,-0.3 -2,-0.1 2,-0.1 20,-0.1 -0.280 96.0 -3.4 -56.2 127.4 90.0 69.5 57.9 475 68 B N T 3 S+ 0 0 101 18,-0.1 -1,-0.3 2,-0.1 227,-0.1 0.577 94.5 131.4 64.0 13.8 89.5 73.1 59.0 476 69 B A < + 0 0 9 -3,-2.2 226,-0.3 225,-0.2 -2,-0.1 0.852 64.1 32.6 -63.6 -38.5 90.4 74.3 55.4 477 70 B L S S- 0 0 58 -4,-0.4 5,-0.1 224,-0.2 -2,-0.1 -0.805 94.0 -81.2-125.4 163.7 87.4 76.7 55.0 478 71 B P >> - 0 0 42 0, 0.0 3,-2.1 0, 0.0 4,-0.5 -0.308 42.8-119.9 -58.0 138.7 85.2 79.1 57.0 479 72 B K H >> S+ 0 0 94 1,-0.3 4,-2.3 2,-0.2 3,-0.9 0.741 104.5 81.6 -52.5 -26.6 82.4 77.2 58.9 480 73 B R H 3> S+ 0 0 82 1,-0.3 4,-0.6 2,-0.2 -1,-0.3 0.815 87.2 55.5 -51.1 -34.4 79.9 79.3 56.9 481 74 B V H <4>S+ 0 0 19 -3,-2.1 5,-1.3 1,-0.2 6,-0.5 0.880 108.3 47.1 -68.7 -36.5 80.3 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57.4 597 190 B A H X S+ 0 0 2 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.892 114.9 50.7 -64.4 -41.3 66.3 69.7 55.0 598 191 B E H X S+ 0 0 21 -4,-2.9 4,-2.9 -5,-0.3 -1,-0.2 0.927 111.4 46.6 -64.2 -46.0 68.4 68.1 57.8 599 192 B E H X S+ 0 0 114 -4,-2.4 4,-1.9 -5,-0.2 5,-0.2 0.941 113.4 50.8 -60.3 -47.6 65.4 67.6 60.1 600 193 B W H X S+ 0 0 32 -4,-2.3 4,-1.2 -5,-0.2 -2,-0.2 0.935 115.7 40.0 -55.7 -50.7 63.3 66.3 57.3 601 194 B I H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.872 109.0 60.7 -74.4 -31.1 65.9 63.7 56.2 602 195 B E H X S+ 0 0 38 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.899 102.2 51.6 -62.2 -39.7 66.9 62.7 59.8 603 196 B V H X S+ 0 0 79 -4,-1.9 4,-3.2 1,-0.2 -1,-0.2 0.909 109.1 53.0 -63.4 -37.8 63.4 61.5 60.6 604 197 B M H X S+ 0 0 16 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.913 108.2 48.7 -61.0 -44.5 63.5 59.5 57.5 605 198 B I H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.958 113.2 48.5 -59.8 -49.6 66.8 57.9 58.5 606 199 B E H X S+ 0 0 86 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.929 112.1 47.4 -57.1 -46.9 65.3 57.2 61.9 607 200 B D H <>S+ 0 0 63 -4,-3.2 5,-1.9 1,-0.2 6,-1.4 0.840 109.9 55.4 -64.6 -31.3 62.2 55.7 60.4 608 201 B A H ><5S+ 0 0 2 -4,-2.3 3,-1.5 -5,-0.2 -2,-0.2 0.949 107.6 47.7 -64.8 -48.2 64.4 53.6 58.1 609 202 B R H 3<5S+ 0 0 64 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.835 111.4 50.7 -63.5 -31.8 66.3 52.1 61.0 610 203 B A T 3<5S- 0 0 65 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.463 111.2-123.2 -83.6 -1.5 63.0 51.3 62.8 611 204 B G T < 5S+ 0 0 59 -3,-1.5 -3,-0.2 -4,-0.2 -2,-0.1 0.604 80.8 120.3 68.8 11.7 61.8 49.6 59.6 612 205 B L < + 0 0 141 -5,-1.9 2,-0.4 -6,-0.2 -4,-0.2 0.647 69.3 51.9 -81.8 -14.4 58.8 52.0 59.7 613 206 B L S S- 0 0 37 -6,-1.4 2,-0.3 -9,-0.1 -2,-0.1 -0.971 98.0-113.7-118.8 134.8 59.7 53.4 56.3 614 207 B K - 0 0 181 -2,-0.4 2,-0.3 2,-0.0 -6,-0.1 -0.525 38.1-175.6 -72.1 132.5 60.3 50.9 53.5 615 208 B T - 0 0 36 -2,-0.3 2,-0.5 -7,-0.1 -57,-0.1 -0.895 16.2-141.4-125.8 157.5 63.9 50.9 52.2 616 209 B T > - 0 0 80 -2,-0.3 3,-1.9 3,-0.0 6,-0.3 -0.973 26.5-111.7-126.5 123.4 65.5 49.0 49.4 617 210 B S T 3 S+ 0 0 97 -2,-0.5 3,-0.1 1,-0.3 5,-0.0 -0.178 103.7 25.9 -48.6 128.6 69.0 47.5 49.5 618 211 B G T 3 S+ 0 0 27 1,-0.3 2,-0.3 2,-0.1 -1,-0.3 0.458 94.7 110.7 96.4 -1.2 71.3 49.4 47.2 619 212 B T S <> S- 0 0 29 -3,-1.9 4,-2.5 1,-0.1 -1,-0.3 -0.754 77.6-108.8-106.0 157.5 69.5 52.8 47.2 620 213 B A H > S+ 0 0 0 -2,-0.3 4,-2.5 -64,-0.3 5,-0.3 0.862 114.1 48.6 -51.2 -49.3 70.8 56.0 48.8 621 214 B L H > S+ 0 0 1 -64,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.942 115.0 45.1 -59.7 -48.1 68.4 56.2 51.7 622 215 B H H > S+ 0 0 36 -65,-0.4 4,-2.0 -6,-0.3 -2,-0.2 0.932 115.4 46.6 -61.7 -47.5 68.9 52.6 52.7 623 216 B E H X S+ 0 0 51 -4,-2.5 4,-1.4 -7,-0.2 -2,-0.2 0.882 112.7 47.9 -64.5 -43.2 72.8 52.7 52.4 624 217 B M H < S+ 0 0 0 -4,-2.5 11,-0.3 -5,-0.2 -1,-0.2 0.906 114.8 47.6 -63.8 -40.9 73.2 56.0 54.3 625 218 B A H < S+ 0 0 0 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.839 121.5 33.7 -70.6 -34.4 70.9 54.7 57.1 626 219 B F H < S+ 0 0 71 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.459 84.5 127.3-104.0 -0.1 72.6 51.4 57.4 627 220 B H < - 0 0 24 -4,-1.4 8,-0.6 -5,-0.1 2,-0.4 -0.235 46.0-150.7 -55.5 141.0 76.2 52.3 56.7 628 221 B T B -Q 634 0G 72 6,-0.2 6,-0.2 1,-0.1 5,-0.1 -0.964 8.4-140.3-118.7 136.7 78.7 51.1 59.3 629 222 B Q > - 0 0 52 4,-3.4 3,-0.7 -2,-0.4 -1,-0.1 0.085 38.4 -82.4 -78.9-167.0 82.0 53.0 59.9 630 223 B E T 3 S+ 0 0 109 1,-0.3 -1,-0.0 2,-0.1 -132,-0.0 0.951 131.7 53.0 -66.4 -49.0 85.4 51.6 60.7 631 224 B D T 3 S- 0 0 125 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.523 123.2-111.2 -64.5 -2.1 84.7 51.1 64.4 632 225 B G S < S+ 0 0 45 -3,-0.7 2,-0.2 1,-0.3 -1,-0.1 0.350 77.3 125.7 89.3 -5.6 81.7 49.2 63.1 633 226 B S - 0 0 45 -5,-0.1 -4,-3.4 1,-0.1 -1,-0.3 -0.509 60.7-112.8 -89.4 155.3 79.1 51.7 64.2 634 227 B Q B -Q 628 0G 82 -6,-0.2 -6,-0.2 -2,-0.2 -1,-0.1 -0.310 40.1 -96.4 -76.4 165.0 76.3 53.5 62.2 635 228 B L - 0 0 4 -8,-0.6 -1,-0.1 -11,-0.3 2,-0.0 -0.414 47.6 -92.9 -77.1 159.5 76.5 57.2 61.6 636 229 B D > - 0 0 123 1,-0.1 4,-2.8 -2,-0.1 5,-0.3 -0.407 41.6-107.0 -67.1 155.3 74.5 59.5 63.9 637 230 B S H > S+ 0 0 23 1,-0.2 4,-1.6 2,-0.2 -32,-0.1 0.878 120.5 49.1 -50.6 -46.5 71.0 60.2 62.6 638 231 B R H > S+ 0 0 85 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.865 111.8 47.9 -62.0 -41.0 71.9 63.8 61.7 639 232 B M H > S+ 0 0 23 -3,-0.3 4,-3.3 2,-0.2 5,-0.2 0.942 109.3 51.7 -67.2 -49.3 75.1 62.7 59.9 640 233 B A H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.856 113.7 46.9 -54.6 -36.3 73.4 60.0 57.9 641 234 B A H X S+ 0 0 0 -4,-1.6 4,-2.4 -5,-0.3 -1,-0.2 0.865 110.8 50.7 -74.3 -38.2 70.9 62.7 56.9 642 235 B I H X S+ 0 0 10 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.915 112.5 47.2 -65.1 -42.2 73.7 65.2 56.1 643 236 B E H < S+ 0 0 0 -4,-3.3 3,-0.3 2,-0.2 -2,-0.2 0.933 111.5 49.3 -66.2 -45.3 75.4 62.6 53.9 644 237 B L H >X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.3 3,-2.2 0.918 109.4 53.5 -59.7 -40.6 72.2 61.6 52.1 645 238 B I H 3X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.3 -1,-0.3 0.821 98.8 62.9 -64.6 -26.4 71.6 65.3 51.6 646 239 B N H 3< S+ 0 0 12 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.461 110.0 41.3 -76.3 1.6 75.1 65.4 50.1 647 240 B V H <> S+ 0 0 3 -3,-2.2 4,-1.6 -5,-0.1 -2,-0.2 0.733 119.3 41.2-107.9 -49.2 73.6 63.0 47.5 648 241 B L H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 5,-0.2 0.934 111.7 50.6 -67.1 -54.3 70.2 64.7 46.9 649 242 B R H X S+ 0 0 17 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.921 111.1 51.1 -53.2 -47.1 71.1 68.4 46.9 650 243 B P H >> S+ 0 0 45 0, 0.0 4,-1.2 0, 0.0 3,-1.0 0.949 106.1 52.9 -56.9 -52.1 73.9 67.8 44.3 651 244 B I H 3< S+ 0 0 11 -4,-1.6 3,-0.5 1,-0.3 -2,-0.2 0.873 111.6 47.7 -51.9 -37.1 71.6 65.9 41.9 652 245 B V H >< S+ 0 0 0 -4,-1.8 3,-1.2 1,-0.2 -1,-0.3 0.748 103.0 62.4 -76.7 -21.9 69.3 68.9 42.0 653 246 B A H XX S+ 0 0 11 -4,-1.3 3,-2.0 -3,-1.0 4,-0.6 0.716 80.4 83.6 -74.7 -20.3 72.2 71.2 41.5 654 247 B I H 3X + 0 0 9 -4,-1.2 4,-2.2 -3,-0.5 3,-0.5 0.765 69.7 83.7 -52.1 -24.2 72.7 69.5 38.1 655 248 B S H <> S+ 0 0 0 -3,-1.2 4,-2.5 1,-0.2 -1,-0.3 0.832 83.7 56.8 -50.4 -36.8 70.0 72.0 36.9 656 249 B Y H <> S+ 0 0 0 -3,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.938 108.9 44.2 -61.8 -47.6 72.6 74.6 36.4 657 250 B F H X S+ 0 0 9 -4,-0.6 4,-2.0 -3,-0.5 -1,-0.2 0.841 111.4 56.6 -64.9 -30.9 74.6 72.4 34.0 658 251 B L H X S+ 0 0 7 -4,-2.2 4,-0.8 2,-0.2 -2,-0.2 0.925 109.5 44.1 -66.1 -44.0 71.2 71.5 32.4 659 252 B V H >X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 3,-0.6 0.884 112.1 52.0 -68.4 -39.8 70.5 75.2 31.8 660 253 B F H 3X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.3 -1,-0.2 0.856 103.8 58.2 -66.6 -30.8 74.1 75.8 30.5 661 254 B S H 3X S+ 0 0 5 -4,-2.0 4,-0.7 1,-0.2 -1,-0.3 0.791 108.4 47.8 -65.9 -25.5 73.7 72.9 28.1 662 255 B A H XX S+ 0 0 0 -4,-0.8 4,-1.6 -3,-0.6 3,-0.6 0.904 109.6 49.3 -78.5 -46.6 70.7 74.8 26.8 663 256 B L H >X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 3,-0.7 0.949 107.0 59.2 -55.7 -48.1 72.6 78.1 26.5 664 257 B A H 3X S+ 0 0 0 -4,-3.0 4,-0.5 1,-0.3 -1,-0.2 0.787 109.0 42.2 -51.0 -36.6 75.3 76.1 24.7 665 258 B L H << S+ 0 0 14 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.716 116.1 50.7 -85.1 -21.8 72.8 75.0 22.0 666 259 B H H << S+ 0 0 79 -4,-1.6 -2,-0.2 -3,-0.7 -3,-0.2 0.984 117.0 34.0 -75.0 -68.3 71.2 78.5 21.8 667 260 B E H < S+ 0 0 96 -4,-2.2 -3,-0.2 1,-0.2 -2,-0.1 0.609 124.6 46.0 -65.1 -14.0 74.3 80.7 21.3 668 261 B H S >< S+ 0 0 58 -4,-0.5 3,-1.1 -5,-0.4 -1,-0.2 -0.505 70.6 174.7-132.2 68.1 76.2 78.0 19.3 669 262 B P T > + 0 0 89 0, 0.0 3,-2.7 0, 0.0 4,-0.2 0.780 58.9 71.8 -34.4 -71.0 73.7 76.6 16.6 670 263 B K T 3> S+ 0 0 148 1,-0.3 4,-1.2 2,-0.1 3,-0.2 0.526 84.8 70.5 -34.1 -23.6 75.7 74.1 14.3 671 264 B Y H <> S+ 0 0 10 -3,-1.1 4,-2.2 1,-0.2 -1,-0.3 0.692 82.9 72.4 -74.8 -15.6 76.0 71.4 16.9 672 265 B K H <> S+ 0 0 50 -3,-2.7 4,-4.1 2,-0.2 -1,-0.2 0.956 103.0 39.4 -62.9 -50.6 72.2 70.6 16.8 673 266 B E H 4 S+ 0 0 127 2,-0.2 -1,-0.2 -4,-0.2 -2,-0.2 0.901 112.0 59.7 -63.2 -39.1 72.5 68.9 13.4 674 267 B W H < S+ 0 0 61 -4,-1.2 3,-0.4 1,-0.2 -1,-0.2 0.893 114.8 35.6 -54.5 -39.8 75.8 67.5 14.7 675 268 B L H < S+ 0 0 3 -4,-2.2 2,-1.9 1,-0.2 4,-0.3 0.896 103.9 69.5 -81.2 -43.4 73.7 65.9 17.4 676 269 B R S < S+ 0 0 59 -4,-4.1 2,-0.3 -5,-0.2 -1,-0.2 0.066 102.1 63.4 -65.9 32.6 70.6 65.2 15.3 677 270 B S S S- 0 0 69 -2,-1.9 2,-1.8 -3,-0.4 5,-0.2 -0.946 103.1 -26.7-163.0 136.7 72.8 62.6 13.6 678 271 B G S S+ 0 0 80 -2,-0.3 2,-0.3 3,-0.1 3,-0.1 -0.158 92.0 4.3 61.7 -38.1 74.8 59.4 14.2 679 272 B N > - 0 0 79 -2,-1.8 4,-0.6 -4,-0.3 -2,-0.2 -0.967 53.6-106.6-168.0-179.6 75.8 59.1 17.9 680 273 B S H > S+ 0 0 41 -2,-0.3 4,-3.5 2,-0.2 5,-0.4 0.800 101.6 77.9 -84.1 -36.7 76.3 59.6 21.6 681 274 B R H > S+ 0 0 158 1,-0.3 4,-2.1 2,-0.2 5,-0.3 0.892 94.2 48.7 -36.9 -59.8 79.9 60.6 21.0 682 275 B E H > S+ 0 0 35 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.910 115.2 44.3 -50.7 -48.5 78.7 64.0 19.9 683 276 B R H X S+ 0 0 46 -4,-0.6 4,-2.1 -3,-0.3 -2,-0.2 0.936 111.9 50.7 -65.7 -46.3 76.5 64.3 23.0 684 277 B E H X S+ 0 0 85 -4,-3.5 4,-1.9 1,-0.2 -1,-0.2 0.785 114.9 45.8 -62.1 -27.0 79.1 63.0 25.4 685 278 B M H X S+ 0 0 37 -4,-2.1 4,-2.0 -5,-0.4 -1,-0.2 0.826 109.9 52.1 -83.4 -34.8 81.6 65.6 23.9 686 279 B F H X S+ 0 0 0 -4,-2.3 4,-1.1 -5,-0.3 -2,-0.2 0.809 112.0 50.5 -69.1 -27.5 79.0 68.4 24.0 687 280 B V H >X S+ 0 0 1 -4,-2.1 4,-1.9 2,-0.2 3,-1.2 0.992 108.4 47.4 -69.1 -66.8 78.6 67.4 27.7 688 281 B Q H 3X S+ 0 0 41 -4,-1.9 4,-2.1 1,-0.3 5,-0.2 0.842 111.2 53.9 -43.4 -43.1 82.2 67.5 28.7 689 282 B E H 3X S+ 0 0 0 -4,-2.0 4,-3.1 1,-0.2 -1,-0.3 0.883 105.8 53.4 -64.3 -37.1 82.6 70.8 27.0 690 283 B V H +R 713 0H 49 3,-2.5 3,-0.7 -2,-0.4 -2,-0.0 -0.948 63.8 4.5-161.1 138.4 107.1 73.0 44.9 711 304 B N T 3 S- 0 0 87 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.939 130.3 -55.9 51.5 51.5 107.5 75.2 41.9 712 305 B N T 3 S+ 0 0 168 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.820 115.8 124.4 51.6 34.2 110.3 77.1 43.7 713 306 B C E < -R 710 0H 29 -3,-0.7 -3,-2.5 2,-0.0 2,-0.7 -0.981 58.5-138.5-128.8 138.5 107.8 77.7 46.5 714 307 B E E -R 709 0H 126 -2,-0.4 2,-0.8 -5,-0.2 -5,-0.2 -0.827 15.2-161.1 -98.5 111.5 107.9 76.9 50.2 715 308 B F E -R 708 0H 0 -7,-2.5 -7,-1.3 -2,-0.7 2,-0.3 -0.814 10.0-155.7 -96.0 107.8 104.7 75.6 51.6 716 309 B K > - 0 0 107 -2,-0.8 3,-1.6 -9,-0.2 -12,-0.3 -0.624 29.0 -95.1 -86.4 138.6 104.6 75.9 55.4 717 310 B K T 3 S+ 0 0 147 -2,-0.3 -12,-0.2 1,-0.3 -1,-0.1 -0.172 108.7 23.5 -50.5 133.4 102.4 73.6 57.5 718 311 B G T 3 S+ 0 0 50 -14,-3.4 -1,-0.3 1,-0.3 2,-0.2 0.505 86.7 136.3 88.3 3.5 99.0 75.1 58.4 719 312 B T < - 0 0 32 -3,-1.6 -15,-2.4 -15,-0.1 2,-0.4 -0.607 54.4-121.3 -83.6 147.0 98.9 77.6 55.4 720 313 B S E -lN 453 703E 4 -268,-2.1 -266,-2.3 -2,-0.2 2,-0.4 -0.717 30.2-171.0 -90.6 135.8 95.6 77.9 53.5 721 314 B V E -lN 454 702E 0 -19,-2.6 -19,-1.8 -2,-0.4 2,-0.5 -0.974 14.5-155.4-130.9 144.3 95.6 77.1 49.8 722 315 B L E -lN 455 701E 0 -268,-1.7 -266,-2.3 -2,-0.4 2,-0.4 -0.939 9.4-152.6-118.3 110.5 93.0 77.5 47.0 723 316 B L E -lN 456 700E 0 -23,-2.1 -23,-2.1 -2,-0.5 2,-0.7 -0.679 23.2-130.0 -79.3 131.8 93.2 75.3 43.9 724 317 B D E > + N 0 699E 2 -268,-2.3 4,-0.8 -2,-0.4 -266,-0.5 -0.756 29.9 175.4 -89.2 115.4 91.7 77.2 41.0 725 318 B L H > S+ 0 0 5 -27,-1.8 4,-1.9 -2,-0.7 32,-0.3 0.891 76.7 49.3 -85.1 -43.9 89.1 75.1 39.2 726 319 B Y H >> S+ 0 0 28 -28,-1.5 4,-1.8 2,-0.2 3,-0.8 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113.9 28.4 15.5 888 69 C A < + 0 0 7 -3,-2.1 226,-0.2 225,-0.2 -2,-0.1 0.761 66.8 35.9 -80.6 -27.0 117.3 28.1 17.0 889 70 C L S S- 0 0 52 -4,-0.3 -2,-0.1 224,-0.1 5,-0.1 -0.915 95.1 -87.8-129.0 155.1 119.0 30.9 14.9 890 71 C P >> - 0 0 43 0, 0.0 3,-1.5 0, 0.0 4,-0.5 -0.254 41.3-117.2 -56.3 146.3 118.0 34.2 13.4 891 72 C K H 3> S+ 0 0 99 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.582 104.6 83.2 -64.1 -9.8 116.5 33.8 10.0 892 73 C R H 3> S+ 0 0 79 1,-0.2 4,-0.8 2,-0.2 -1,-0.3 0.877 87.5 54.6 -62.6 -34.1 119.3 35.9 8.5 893 74 C V H <>>S+ 0 0 19 -3,-1.5 5,-1.3 1,-0.2 4,-0.6 0.893 108.3 49.0 -65.1 -39.7 121.4 32.7 8.4 894 75 C Q H <>S+ 0 0 33 -4,-0.5 5,-1.4 1,-0.2 -2,-0.2 0.908 107.4 53.7 -65.4 -43.3 118.7 31.0 6.4 895 76 C K H <5S+ 0 0 97 -4,-2.2 -1,-0.2 4,-0.2 111,-0.2 0.638 126.8 20.8 -69.9 -11.2 118.4 33.8 3.9 896 77 C S H <5S+ 0 0 0 -4,-0.8 -3,-0.2 -3,-0.5 -2,-0.1 0.627 132.9 18.7-116.8 -79.4 122.1 33.6 3.2 897 78 C L T <5S+ 0 0 26 -4,-0.6 -3,-0.2 -5,-0.2 -4,-0.1 0.974 128.8 22.5 -64.1 -64.6 123.9 30.3 4.1 898 79 C F T < - 0 0 1 -5,-1.4 3,-0.7 -6,-0.3 2,-0.3 -0.344 48.7 -55.1 121.2 154.9 118.1 28.5 2.5 900 81 C V T 3 S- 0 0 49 1,-0.2 154,-0.1 -2,-0.2 -9,-0.0 -0.481 114.9 -12.3 -73.0 127.9 114.7 29.0 4.0 901 82 C N T 3 S+ 0 0 109 -2,-0.3 -1,-0.2 1,-0.1 2,-0.1 0.932 97.0 150.5 50.1 59.7 113.3 26.0 6.1 902 83 C A X - 0 0 2 -3,-0.7 3,-2.6 152,-0.1 4,-0.5 -0.419 64.0 -68.4-108.8-174.5 115.9 23.5 4.9 903 84 C I G > S+ 0 0 15 1,-0.3 3,-1.2 2,-0.2 12,-0.1 0.776 125.3 63.0 -43.1 -38.7 117.5 20.4 6.4 904 85 C Q G 3 S+ 0 0 43 1,-0.3 -1,-0.3 -5,-0.1 276,-0.0 0.719 106.5 43.1 -67.0 -20.2 119.4 22.5 9.0 905 86 C G G < S+ 0 0 32 -3,-2.6 -1,-0.3 -19,-0.1 2,-0.2 0.378 92.5 104.4-106.0 3.7 116.1 23.6 10.7 906 87 C M < - 0 0 34 -3,-1.2 2,-0.3 -4,-0.5 -21,-0.1 -0.589 45.9-174.2 -87.0 147.0 114.3 20.3 10.6 907 88 C D >> + 0 0 42 -2,-0.2 4,-0.7 -22,-0.1 3,-0.6 -0.858 44.7 15.7-130.5 165.0 113.8 18.1 13.7 908 89 C G H >> S- 0 0 51 -2,-0.3 4,-2.0 1,-0.2 3,-0.7 -0.128 114.5 -27.5 72.6-164.7 112.3 14.6 14.1 909 90 C S H 3> S+ 0 0 79 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.623 132.8 63.3 -64.2 -16.1 111.6 11.9 11.6 910 91 C A H <> S+ 0 0 31 -3,-0.6 4,-1.9 2,-0.2 -1,-0.3 0.900 106.7 43.9 -73.0 -41.9 111.1 14.5 9.0 911 92 C H H < S+ 0 0 7 -4,-1.4 3,-2.6 1,-0.2 4,-0.3 0.972 110.9 51.8 -65.2 -55.8 121.8 13.5 1.6 919 100 C L H >< S+ 0 0 28 -4,-2.7 3,-1.6 1,-0.3 -2,-0.2 0.826 100.6 64.0 -50.6 -36.1 123.8 10.6 3.1 920 101 C S T 3< S+ 0 0 56 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.468 105.0 46.6 -70.0 -0.6 122.9 8.5 0.0 921 102 C L T < S+ 0 0 0 -3,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.341 110.1 52.3-119.5 1.3 124.9 11.0 -2.1 922 103 C M S < S+ 0 0 17 -3,-1.6 264,-0.2 -4,-0.3 265,-0.2 0.098 75.7 128.0-126.4 23.0 128.0 11.2 0.1 923 104 C T S > S- 0 0 54 -4,-0.2 4,-2.6 1,-0.1 3,-0.4 -0.081 78.9 -86.8 -71.4 175.6 129.0 7.6 0.6 924 105 C P H > S+ 0 0 78 0, 0.0 4,-1.3 0, 0.0 5,-0.2 0.825 127.5 56.5 -55.2 -34.8 132.6 6.3 -0.0 925 106 C P H > S+ 0 0 87 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.909 112.4 41.7 -64.1 -41.8 131.8 5.6 -3.8 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14.9 -9.2 936 117 C E H X S+ 0 0 120 -4,-2.0 4,-2.2 1,-0.2 -1,-0.3 0.866 109.1 46.7 -54.1 -45.2 142.0 15.1 -12.9 937 118 C E H X S+ 0 0 52 -4,-1.5 4,-1.7 -3,-0.4 -1,-0.2 0.877 110.3 54.2 -67.2 -38.1 141.3 18.9 -12.9 938 119 C W H X S+ 0 0 2 -4,-2.7 4,-1.2 2,-0.2 -2,-0.2 0.923 109.1 47.8 -61.3 -45.6 144.5 19.5 -10.9 939 120 C K H >X S+ 0 0 114 -4,-2.4 3,-0.9 -5,-0.2 4,-0.7 0.964 112.5 47.8 -60.2 -52.5 146.6 17.6 -13.5 940 121 C A H 3< S+ 0 0 65 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.779 106.1 62.3 -59.7 -26.3 145.0 19.5 -16.4 941 122 C A H >X S+ 0 0 14 -4,-1.7 4,-2.3 1,-0.2 3,-1.1 0.830 86.6 70.1 -69.4 -35.1 145.6 22.7 -14.4 942 123 C V H < S+ 0 0 5 -4,-2.3 3,-1.1 1,-0.2 287,-0.4 0.863 101.1 56.2 -57.7 -37.9 149.6 27.4 -14.3 946 127 C E H 3< S+ 0 0 80 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.890 105.9 49.3 -62.3 -41.2 153.1 27.2 -16.0 947 128 C K T 3< S+ 0 0 158 -4,-0.6 2,-0.3 -5,-0.3 -1,-0.3 0.458 102.7 84.9 -78.4 0.2 152.1 29.8 -18.6 948 129 C A < - 0 0 34 -3,-1.1 284,-0.4 -4,-0.4 283,-0.2 -0.797 66.2-152.2-105.9 144.9 150.9 32.0 -15.7 949 130 C D S S+ 0 0 147 -2,-0.3 282,-0.7 1,-0.2 2,-0.3 0.947 85.2 13.1 -76.1 -50.3 152.9 34.4 -13.6 950 131 C E E -X 1230 0J 131 280,-0.2 2,-0.3 281,-0.1 -1,-0.2 -0.852 60.7-169.5-125.4 162.1 150.7 34.2 -10.6 951 132 C V E -X 1229 0J 8 278,-1.2 278,-2.6 -2,-0.3 2,-0.8 -0.885 15.9-145.5-153.5 114.3 147.8 31.9 -9.5 952 133 C V E > -X 1228 0J 43 -2,-0.3 4,-2.3 276,-0.2 276,-0.2 -0.757 11.3-152.9 -86.2 111.6 145.5 32.5 -6.5 953 134 C L H > S+ 0 0 2 274,-2.9 4,-4.3 -2,-0.8 5,-0.3 0.918 91.3 53.1 -47.0 -59.5 144.7 29.1 -5.0 954 135 C F H > S+ 0 0 15 272,-2.5 4,-2.9 1,-0.3 -1,-0.2 0.890 111.8 45.5 -45.9 -50.8 141.3 30.1 -3.6 955 136 C E H > S+ 0 0 57 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.885 117.0 45.1 -63.6 -38.5 140.1 31.5 -6.9 956 137 C E H X S+ 0 0 57 -4,-2.3 4,-2.3 2,-0.2 5,-0.3 0.916 113.3 50.2 -71.1 -41.4 141.4 28.4 -8.7 957 138 C A H X S+ 0 0 0 -4,-4.3 4,-3.6 -5,-0.2 5,-0.3 0.952 107.6 54.5 -59.7 -51.7 140.0 26.0 -6.1 958 139 C K H X S+ 0 0 11 -4,-2.9 4,-2.5 -5,-0.3 -1,-0.2 0.894 111.5 42.9 -48.9 -50.6 136.6 27.7 -6.3 959 140 C E H X S+ 0 0 49 -4,-1.6 4,-2.7 2,-0.2 -1,-0.2 0.935 117.8 44.0 -67.8 -45.9 136.2 27.2 -10.1 960 141 C I H X S+ 0 0 2 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.984 115.3 49.3 -60.2 -55.5 137.5 23.7 -10.2 961 142 C L H X S+ 0 0 1 -4,-3.6 4,-2.6 1,-0.3 -2,-0.2 0.891 114.6 45.0 -49.5 -45.7 135.4 22.8 -7.1 962 143 C C H X S+ 0 0 0 -4,-2.5 4,-1.7 -5,-0.3 -1,-0.3 0.881 112.5 52.3 -67.8 -36.8 132.4 24.3 -8.7 963 144 C R H X S+ 0 0 52 -4,-2.7 4,-1.9 -5,-0.2 -2,-0.2 0.965 115.1 40.7 -61.5 -53.7 133.2 22.6 -12.0 964 145 C V H X S+ 0 0 5 -4,-3.2 4,-3.0 2,-0.2 5,-0.3 0.882 110.3 57.2 -62.2 -46.2 133.5 19.2 -10.4 965 146 C A H X S+ 0 0 1 -4,-2.6 4,-2.1 -5,-0.3 6,-0.2 0.916 112.3 40.7 -54.2 -49.4 130.5 19.5 -8.0 966 147 C C H X>S+ 0 0 1 -4,-1.7 5,-2.5 2,-0.2 4,-1.5 0.895 114.6 51.2 -69.2 -41.5 128.0 20.2 -10.9 967 148 C Y H ><5S+ 0 0 161 -4,-1.9 3,-0.5 -5,-0.2 -2,-0.2 0.960 113.9 45.2 -58.3 -50.9 129.5 17.7 -13.2 968 149 C W H 3<5S+ 0 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C V H X S+ 0 0 2 -4,-1.2 4,-2.7 -3,-0.3 5,-0.3 0.899 90.2 38.1 -42.4 -69.1 131.7 28.8 -13.9 979 160 C K H > S+ 0 0 94 -4,-0.5 4,-2.5 1,-0.2 5,-0.2 0.899 118.1 52.6 -50.0 -48.2 133.3 31.9 -12.2 980 161 C E H > S+ 0 0 100 -4,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.941 113.2 41.2 -54.6 -55.0 129.9 33.5 -11.8 981 162 C R H X S+ 0 0 31 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.880 113.7 53.2 -65.1 -38.7 128.3 30.5 -10.1 982 163 C A H X S+ 0 0 0 -4,-2.7 4,-2.5 -5,-0.3 -1,-0.2 0.897 109.2 49.3 -63.5 -41.4 131.3 29.8 -7.9 983 164 C D H X S+ 0 0 39 -4,-2.5 4,-2.8 -5,-0.3 5,-0.2 0.930 109.0 53.2 -63.8 -44.9 131.3 33.4 -6.7 984 165 C D H X S+ 0 0 10 -4,-2.1 4,-1.6 -5,-0.2 -2,-0.2 0.917 109.3 48.5 -58.7 -41.3 127.6 33.1 -5.9 985 166 C F H X S+ 0 0 3 -4,-2.3 4,-1.7 1,-0.2 3,-0.3 0.966 114.7 44.4 -63.0 -50.6 128.2 30.0 -3.8 986 167 C I H X S+ 0 0 10 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.802 106.0 60.6 -64.4 -31.4 131.1 31.6 -1.9 987 168 C D H < S+ 0 0 40 -4,-2.8 15,-0.3 1,-0.2 4,-0.3 0.913 105.3 49.9 -63.3 -38.7 129.2 34.9 -1.4 988 169 C M H >X S+ 0 0 0 -4,-1.6 3,-1.2 -3,-0.3 4,-0.8 0.950 112.4 47.2 -61.5 -47.5 126.6 32.9 0.5 989 170 C V H >< S+ 0 0 6 -4,-1.7 3,-0.8 1,-0.3 4,-0.3 0.910 111.1 49.3 -61.1 -45.3 129.2 31.2 2.7 990 171 C D T 3< S+ 0 0 20 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.479 107.0 61.5 -75.3 1.6 131.1 34.4 3.5 991 172 C A T X4 S+ 0 0 0 -3,-1.2 3,-1.4 -4,-0.3 -1,-0.2 0.706 76.5 84.6-100.6 -20.0 127.7 36.0 4.4 992 173 C F T << S+ 0 0 35 -4,-0.8 -2,-0.1 -3,-0.8 -1,-0.1 0.793 103.7 26.6 -55.4 -36.0 126.6 33.8 7.3 993 174 C G T 3 S+ 0 0 17 226,-0.5 226,-0.3 -4,-0.3 2,-0.3 0.112 106.3 90.5-117.5 25.7 128.5 35.6 10.0 994 175 C A < - 0 0 2 -3,-1.4 2,-0.3 224,-0.1 224,-0.0 -0.818 55.5-146.3-121.7 160.5 128.8 39.1 8.6 995 176 C V > + 0 0 91 -2,-0.3 3,-0.6 4,-0.1 4,-0.2 -0.819 63.8 9.7-117.5 157.9 126.9 42.4 8.7 996 177 C G T 3> S- 0 0 28 -2,-0.3 4,-2.9 1,-0.2 3,-0.3 -0.415 123.3 -2.6 79.1-149.6 126.6 45.0 5.9 997 178 C P H 3> S+ 0 0 107 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.856 132.3 53.2 -47.0 -46.8 127.9 44.5 2.3 998 179 C R H <> S+ 0 0 67 -3,-0.6 4,-1.4 2,-0.2 3,-0.2 0.946 113.0 44.7 -57.9 -46.6 129.3 41.0 2.9 999 180 C H H >> S+ 0 0 11 -3,-0.3 4,-2.1 1,-0.2 3,-0.8 0.970 111.4 53.4 -61.1 -50.7 126.0 40.0 4.3 1000 181 C W H 3X S+ 0 0 140 -4,-2.9 4,-1.5 1,-0.3 -1,-0.2 0.778 101.6 59.5 -54.5 -31.8 124.2 41.6 1.5 1001 182 C K H 3X S+ 0 0 125 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.3 0.908 107.9 45.8 -65.2 -39.6 126.2 39.8 -1.1 1002 183 C G H S+ 0 0 55 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.838 112.4 52.8 -50.9 -41.9 117.9 34.0 -5.1 1008 189 C R H X S+ 0 0 107 -4,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.960 113.6 42.0 -62.3 -52.2 120.1 33.8 -8.2 1009 190 C A H X S+ 0 0 2 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.953 113.7 50.8 -59.7 -53.5 121.3 30.3 -7.4 1010 191 C E H X S+ 0 0 18 -4,-2.8 4,-3.0 1,-0.2 -1,-0.2 0.876 113.2 46.9 -53.7 -41.1 117.9 28.9 -6.2 1011 192 C E H X S+ 0 0 120 -4,-1.9 4,-1.9 -5,-0.3 -1,-0.2 0.891 110.5 52.4 -67.6 -42.6 116.3 30.2 -9.4 1012 193 C W H X S+ 0 0 30 -4,-2.2 4,-0.7 -5,-0.2 -2,-0.2 0.967 117.8 36.5 -59.2 -52.9 119.0 28.8 -11.6 1013 194 C I H >X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 3,-1.1 0.905 109.8 63.0 -68.2 -42.2 118.7 25.3 -10.0 1014 195 C E H 3X S+ 0 0 38 -4,-3.0 4,-2.3 -5,-0.3 -1,-0.2 0.895 100.4 52.0 -51.2 -47.5 114.9 25.5 -9.6 1015 196 C V H 3X S+ 0 0 76 -4,-1.9 4,-1.5 2,-0.2 -1,-0.3 0.804 109.2 53.3 -60.7 -26.9 114.3 25.7 -13.4 1016 197 C M H XX S+ 0 0 19 -3,-1.1 4,-2.9 -4,-0.7 3,-0.7 0.984 105.4 51.2 -69.1 -58.6 116.6 22.6 -13.7 1017 198 C I H 3X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.3 5,-0.2 0.897 112.5 48.1 -41.9 -50.8 114.5 20.6 -11.2 1018 199 C E H 3X S+ 0 0 81 -4,-2.3 4,-1.1 1,-0.2 -1,-0.3 0.837 111.5 48.8 -61.9 -37.4 111.4 21.5 -13.2 1019 200 C D H <<>S+ 0 0 63 -4,-1.5 5,-3.0 -3,-0.7 6,-1.0 0.842 111.8 50.5 -71.5 -35.4 113.0 20.6 -16.5 1020 201 C A H ><5S+ 0 0 2 -4,-2.9 3,-3.1 4,-0.2 -2,-0.2 0.978 108.9 49.6 -65.2 -56.4 114.2 17.2 -15.0 1021 202 C R H 3<5S+ 0 0 68 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.789 111.9 50.0 -53.1 -30.1 110.7 16.4 -13.7 1022 203 C A T 3<5S- 0 0 66 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.407 114.9-121.1 -88.6 1.1 109.4 17.2 -17.2 1023 204 C G T < 5S+ 0 0 64 -3,-3.1 -3,-0.2 2,-0.2 -2,-0.1 0.680 83.1 118.6 68.4 17.3 112.0 15.0 -18.7 1024 205 C L < + 0 0 136 -5,-3.0 2,-0.4 -6,-0.2 -4,-0.2 0.462 68.9 54.5 -91.6 -4.8 113.4 17.9 -20.7 1025 206 C L S S- 0 0 30 -6,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 -0.961 93.6-120.4-131.0 113.9 116.8 17.7 -18.9 1026 207 C K - 0 0 186 -2,-0.4 2,-0.3 -3,-0.1 -6,-0.1 -0.310 38.3-178.3 -56.9 121.3 118.6 14.4 -19.0 1027 208 C T - 0 0 37 -7,-0.1 2,-0.5 -2,-0.1 -57,-0.1 -0.863 18.1-137.9-120.5 157.3 119.1 13.2 -15.4 1028 209 C T > - 0 0 78 -2,-0.3 3,-2.3 3,-0.0 6,-0.4 -0.963 23.9-112.9-124.3 123.6 120.9 10.1 -14.1 1029 210 C S T 3 S+ 0 0 98 -2,-0.5 3,-0.1 1,-0.3 4,-0.0 -0.207 103.2 27.5 -49.1 127.2 119.6 7.9 -11.3 1030 211 C G T 3 S+ 0 0 31 1,-0.3 2,-0.3 2,-0.1 -1,-0.3 0.179 93.6 113.2 103.6 -17.6 122.0 8.1 -8.3 1031 212 C T S <> S- 0 0 29 -3,-2.3 4,-2.5 1,-0.1 -1,-0.3 -0.669 78.1-111.9 -92.2 146.6 123.3 11.7 -9.0 1032 213 C A H > S+ 0 0 0 -2,-0.3 4,-2.5 1,-0.2 5,-0.3 0.821 114.8 47.9 -40.3 -48.6 122.5 14.6 -6.7 1033 214 C L H > S+ 0 0 0 -64,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.942 113.0 46.7 -63.7 -48.3 120.3 16.4 -9.3 1034 215 C H H > S+ 0 0 37 -65,-0.5 4,-1.1 -6,-0.4 -2,-0.2 0.925 115.5 46.9 -58.7 -46.4 118.2 13.4 -10.2 1035 216 C E H >X S+ 0 0 49 -4,-2.5 4,-2.7 -7,-0.2 3,-0.6 0.932 111.4 47.1 -63.5 -52.5 117.7 12.4 -6.5 1036 217 C M H 3< S+ 0 0 0 -4,-2.5 11,-0.4 -5,-0.2 -1,-0.2 0.921 113.5 52.4 -56.8 -41.0 116.8 15.9 -5.1 1037 218 C A H 3< S+ 0 0 0 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.736 121.9 27.9 -67.4 -25.6 114.4 16.2 -8.1 1038 219 C F H << S+ 0 0 67 -4,-1.1 -2,-0.2 -3,-0.6 -1,-0.2 0.549 85.0 123.0-115.6 -10.8 112.6 12.9 -7.5 1039 220 C H < - 0 0 24 -4,-2.7 8,-0.7 -5,-0.2 2,-0.4 -0.182 50.8-147.0 -49.7 140.8 113.0 12.3 -3.7 1040 221 C T B -Z 1046 0K 73 6,-0.2 6,-0.2 2,-0.0 -1,-0.1 -0.960 9.3-130.4-117.5 137.0 109.6 11.9 -2.1 1041 222 C Q > - 0 0 50 4,-3.2 3,-2.7 -2,-0.4 -131,-0.0 -0.163 39.3 -87.4 -75.7 175.9 108.9 13.1 1.4 1042 223 C E T 3 S+ 0 0 108 1,-0.3 -1,-0.1 2,-0.1 -132,-0.0 0.889 130.6 57.2 -51.6 -40.4 107.3 10.9 4.1 1043 224 C D T 3 S- 0 0 114 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.432 119.1-112.4 -74.2 3.5 103.9 12.1 2.9 1044 225 C G S < S+ 0 0 53 -3,-2.7 2,-0.2 1,-0.3 -2,-0.1 0.406 77.9 120.5 84.1 -3.7 104.7 10.8 -0.6 1045 226 C S - 0 0 46 1,-0.1 -4,-3.2 -5,-0.1 -1,-0.3 -0.590 65.9-109.8 -94.4 156.8 104.9 14.2 -2.3 1046 227 C Q B -Z 1040 0K 82 -6,-0.2 -6,-0.2 -2,-0.2 3,-0.1 -0.450 43.2 -94.4 -77.7 156.3 108.0 15.6 -4.1 1047 228 C L - 0 0 2 -8,-0.7 -1,-0.1 -11,-0.4 2,-0.1 -0.340 52.9 -90.7 -64.6 153.4 109.8 18.5 -2.5 1048 229 C D >> - 0 0 120 1,-0.1 4,-2.7 -3,-0.1 3,-1.2 -0.475 41.6-112.7 -62.9 142.9 108.6 21.9 -3.9 1049 230 C S H 3> S+ 0 0 27 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.888 119.7 52.0 -45.1 -43.2 110.8 22.6 -6.9 1050 231 C R H 3> S+ 0 0 76 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.827 111.4 45.5 -64.4 -32.9 112.2 25.5 -4.8 1051 232 C M H <> S+ 0 0 22 -3,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.845 109.9 53.5 -79.9 -33.6 113.0 23.3 -1.9 1052 233 C A H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.926 112.6 45.9 -62.5 -44.1 114.5 20.6 -4.0 1053 234 C A H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.3 -2,-0.2 0.884 109.2 55.1 -65.2 -40.5 116.7 23.3 -5.5 1054 235 C I H X S+ 0 0 8 -4,-1.7 4,-0.6 1,-0.2 -1,-0.2 0.888 112.0 43.8 -62.2 -37.4 117.5 24.6 -2.0 1055 236 C E H < S+ 0 0 0 -4,-2.3 3,-0.4 2,-0.2 -2,-0.2 0.879 109.1 54.3 -75.7 -38.5 118.6 21.2 -0.9 1056 237 C L H >X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.3 3,-1.5 0.890 108.4 52.4 -60.8 -36.2 120.7 20.5 -4.1 1057 238 C I H 3X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.3 -1,-0.3 0.755 97.2 64.9 -70.4 -23.7 122.4 23.8 -3.2 1058 239 C N H 3< S+ 0 0 13 -4,-0.6 -1,-0.3 -3,-0.4 -2,-0.2 0.455 109.8 40.9 -78.1 3.6 123.0 22.4 0.2 1059 240 C V H <> S+ 0 0 5 -3,-1.5 4,-1.5 -4,-0.1 -2,-0.2 0.744 118.4 41.6-107.9 -56.4 125.2 19.9 -1.7 1060 241 C L H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 5,-0.2 0.935 111.5 53.1 -60.2 -54.4 126.9 22.1 -4.3 1061 242 C R H X S+ 0 0 11 -4,-1.7 4,-1.9 1,-0.2 3,-0.4 0.928 108.9 48.3 -50.0 -55.3 127.7 25.2 -2.1 1062 243 C P H > S+ 0 0 51 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.895 108.2 55.6 -55.6 -40.2 129.5 23.2 0.6 1063 244 C I H >< S+ 0 0 10 -4,-1.5 3,-0.6 1,-0.2 4,-0.2 0.868 109.7 46.1 -60.4 -37.6 131.6 21.3 -2.0 1064 245 C V H >< S+ 0 0 0 -4,-1.8 3,-1.3 -3,-0.4 -1,-0.2 0.797 104.6 64.4 -73.5 -27.9 132.8 24.7 -3.4 1065 246 C A H >X S+ 0 0 9 -4,-1.9 3,-2.1 1,-0.3 4,-0.5 0.676 77.8 81.4 -69.3 -18.3 133.4 25.8 0.3 1066 247 C I H XX S+ 0 0 9 -4,-0.8 4,-2.3 -3,-0.6 3,-1.4 0.832 72.7 83.4 -56.2 -26.4 136.1 23.1 0.6 1067 248 C S H <> S+ 0 0 0 -3,-1.3 4,-1.7 1,-0.3 -1,-0.3 0.799 82.9 57.8 -46.2 -36.9 138.2 25.8 -1.1 1068 249 C Y H <> S+ 0 0 6 -3,-2.1 4,-1.2 2,-0.2 -1,-0.3 0.877 109.5 43.6 -64.4 -38.9 138.8 27.5 2.3 1069 250 C F H X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.2 3,-0.8 0.924 109.0 56.8 -62.9 -45.4 148.6 25.0 1.5 1075 256 C L H 3X S+ 0 0 0 -4,-2.3 4,-1.5 1,-0.3 -1,-0.2 0.813 106.9 53.7 -55.5 -28.8 149.0 27.7 4.2 1076 257 C A H 3X S+ 0 0 0 -4,-0.7 4,-1.3 -3,-0.3 -1,-0.3 0.766 103.1 52.0 -79.8 -29.8 150.2 24.8 6.4 1077 258 C L H << S+ 0 0 2 -4,-1.1 7,-0.4 -3,-0.8 6,-0.2 0.932 112.6 46.3 -71.0 -46.2 152.9 23.4 4.1 1078 259 C H H < S+ 0 0 85 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.1 0.917 117.3 40.7 -61.4 -49.8 154.6 26.7 3.8 1079 260 C E H < S+ 0 0 94 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.774 127.4 33.9 -74.3 -27.6 154.5 27.7 7.4 1080 261 C H S >< S+ 0 0 43 -4,-1.3 3,-2.0 -5,-0.1 4,-0.3 -0.541 74.1 164.5-125.9 62.1 155.4 24.2 8.7 1081 262 C P T >> + 0 0 73 0, 0.0 3,-2.2 0, 0.0 4,-1.0 0.759 61.9 79.1 -49.9 -34.1 157.7 23.2 5.8 1082 263 C K H 3> S+ 0 0 159 1,-0.3 4,-1.2 2,-0.2 3,-0.3 0.804 92.1 54.1 -48.8 -30.1 159.2 20.3 7.7 1083 264 C Y H <> S+ 0 0 23 -3,-2.0 4,-3.1 2,-0.2 5,-0.3 0.706 89.1 72.9 -80.5 -19.6 156.0 18.4 6.8 1084 265 C K H <4 S+ 0 0 43 -3,-2.2 -1,-0.2 -7,-0.4 -2,-0.2 0.915 108.8 37.1 -59.0 -38.4 156.4 19.0 3.1 1085 266 C E H < S+ 0 0 108 -4,-1.0 3,-0.3 -3,-0.3 -1,-0.2 0.831 110.1 62.9 -78.4 -35.1 159.2 16.4 3.4 1086 267 C W H < S+ 0 0 67 -4,-1.2 4,-0.3 1,-0.3 3,-0.3 0.931 108.7 40.4 -54.6 -49.1 157.2 14.5 6.0 1087 268 C L S >< S+ 0 0 3 -4,-3.1 2,-0.7 1,-0.2 3,-0.6 0.595 103.9 82.6 -73.9 -10.9 154.5 13.8 3.4 1088 269 C R T 3 S+ 0 0 68 -3,-0.3 -1,-0.2 -5,-0.3 -2,-0.1 -0.353 73.3 62.4 -97.0 55.1 157.5 13.3 1.1 1089 270 C S T 3 S- 0 0 98 -2,-0.7 -1,-0.2 -3,-0.3 -2,-0.1 0.173 116.6-113.2-136.2 -26.4 158.5 9.7 1.8 1090 271 C G < + 0 0 35 -3,-0.6 2,-0.2 -4,-0.3 -2,-0.1 0.793 57.8 140.9 90.4 103.1 155.0 9.0 0.4 1091 272 C N >> - 0 0 79 -4,-0.4 4,-1.1 1,-0.1 3,-0.7 -0.747 45.1-145.8-173.8 125.7 152.0 7.7 2.3 1092 273 C S H >> S+ 0 0 67 1,-0.3 4,-2.9 -2,-0.2 3,-1.4 0.915 103.0 68.2 -52.2 -45.9 148.2 8.2 2.5 1093 274 C R H 3> S+ 0 0 112 1,-0.3 4,-1.1 2,-0.2 -1,-0.3 0.868 104.1 41.5 -37.8 -53.0 148.5 7.5 6.2 1094 275 C E H <> S+ 0 0 28 -3,-0.7 4,-1.3 1,-0.2 -1,-0.3 0.691 112.8 54.6 -75.4 -20.5 150.4 10.7 6.7 1095 276 C R H +A 1125 0L 49 3,-2.4 3,-2.9 -2,-0.4 -2,-0.0 -0.984 65.1 6.8-155.5 148.5 123.7 19.2 33.3 1123 304 C N T 3 S- 0 0 79 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.900 130.4 -59.7 41.8 48.9 127.2 20.3 34.6 1124 305 C N T 3 S+ 0 0 158 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.736 115.1 121.5 53.6 27.0 125.3 21.7 37.6 1125 306 C C E < -A 1122 0L 28 -3,-2.9 -3,-2.4 2,-0.0 2,-0.6 -0.927 60.1-131.2-122.1 147.0 123.4 24.0 35.2 1126 307 C E E -A 1121 0L 115 -2,-0.4 2,-0.8 -5,-0.2 -5,-0.2 -0.841 13.3-163.2-101.7 119.4 119.7 24.4 34.6 1127 308 C F E -A 1120 0L 0 -7,-3.0 -7,-1.4 -2,-0.6 2,-0.3 -0.823 10.8-159.2-103.9 97.6 118.5 24.4 31.0 1128 309 C K > - 0 0 93 -2,-0.8 3,-2.5 -9,-0.2 -12,-0.3 -0.586 32.7 -96.8 -77.9 130.5 114.9 25.8 30.9 1129 310 C K T 3 S+ 0 0 77 -2,-0.3 -12,-0.2 1,-0.3 -1,-0.1 -0.109 111.9 31.3 -44.7 135.5 112.8 24.9 27.8 1130 311 C G T 3 S+ 0 0 48 -14,-3.4 -1,-0.3 1,-0.4 -13,-0.1 0.079 85.8 132.6 101.2 -23.6 113.0 27.6 25.2 1131 312 C T < - 0 0 27 -3,-2.5 -15,-2.6 -15,-0.1 -1,-0.4 -0.295 53.5-129.1 -63.9 144.6 116.6 28.7 26.1 1132 313 C S E -uW 8651115I 5 -268,-2.0 -266,-1.6 -17,-0.2 2,-0.4 -0.736 25.1-167.6 -95.7 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