==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOSYNTHETIC PROTEIN 30-MAR-10 2XA9 . COMPND 2 MOLECULE: TREHALOSE-SYNTHASE TRET; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR H.-N.SONG,T.-Y.JUNG,S.-M.YOON,S.-B.LEE,M.-Y.LIM,E.-J.WOO . 824 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36857.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 603 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 102 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 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 . 72 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 126 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 276 33.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 0 2 0 2 2 4 2 2 4 8 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 4 6 4 4 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 . 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 3 A M 0 0 7 0, 0.0 75,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 125.7 30.2 -4.2 132.1 2 4 A Y E -A 75 0A 144 73,-1.8 73,-1.7 118,-0.0 2,-0.3 -0.428 360.0-131.2-108.8-177.7 32.9 -1.4 132.0 3 5 A E E -A 74 0A 39 71,-0.3 71,-0.2 -2,-0.1 3,-0.2 -0.992 4.5-146.7-142.5 133.1 32.9 2.4 131.6 4 6 A V + 0 0 16 69,-1.9 2,-3.7 -2,-0.3 -1,-0.1 0.944 29.2 163.8 -62.6 -54.5 34.9 4.6 129.3 5 7 A K + 0 0 104 68,-0.3 -1,-0.2 2,-0.0 2,-0.1 -0.127 62.0 61.8 64.1 -49.8 35.4 7.6 131.5 6 8 A E S S- 0 0 166 -2,-3.7 2,-0.3 -3,-0.2 5,-0.0 -0.433 74.5-145.9 -96.2 177.2 38.1 8.9 129.2 7 9 A F > - 0 0 29 1,-0.1 3,-1.1 -2,-0.1 5,-0.0 -0.907 11.3-151.6-152.0 119.2 37.8 9.9 125.6 8 10 A S T 3 S+ 0 0 94 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.945 101.3 56.9 -52.1 -56.3 40.4 9.5 122.8 9 11 A S T 3 S- 0 0 33 1,-0.2 2,-0.5 46,-0.1 -1,-0.3 0.785 110.3-138.1 -46.6 -27.0 39.0 12.5 120.8 10 12 A G < - 0 0 26 -3,-1.1 2,-0.4 48,-0.2 -1,-0.2 -0.902 60.1 -10.6 107.5-127.6 39.8 14.3 124.1 11 13 A K S S- 0 0 149 -2,-0.5 2,-0.5 -3,-0.1 5,-0.1 -0.479 71.4-170.5-109.6 59.8 37.4 16.9 125.4 12 14 A R + 0 0 38 -2,-0.4 2,-0.4 46,-0.3 54,-0.3 -0.339 14.6 173.4 -54.5 103.5 35.1 17.2 122.4 13 15 A K > - 0 0 92 -2,-0.5 3,-3.5 1,-0.1 4,-0.3 -0.918 46.8-111.6-119.0 145.5 32.9 20.2 123.3 14 16 A L G > S+ 0 0 4 49,-0.4 3,-2.5 -2,-0.4 4,-0.5 0.816 116.6 65.9 -38.4 -43.0 30.4 22.0 121.2 15 17 A E G > S+ 0 0 94 1,-0.3 3,-1.3 2,-0.2 4,-0.4 0.800 86.4 69.6 -52.1 -33.9 32.7 25.0 121.2 16 18 A D G < S+ 0 0 72 -3,-3.5 -1,-0.3 1,-0.3 -2,-0.2 0.569 105.9 40.5 -63.9 -8.1 35.2 22.9 119.2 17 19 A Y G X> S+ 0 0 0 -3,-2.5 4,-2.1 -4,-0.3 3,-1.6 0.406 80.3 107.5-118.3 -2.4 32.9 23.1 116.2 18 20 A K H <> S+ 0 0 52 -3,-1.3 4,-2.2 -4,-0.5 8,-0.1 0.871 81.5 50.8 -43.2 -48.5 31.7 26.7 116.6 19 21 A S H 34 S+ 0 0 118 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.790 112.5 48.3 -61.6 -30.0 33.8 27.7 113.5 20 22 A I H <4 S+ 0 0 28 -3,-1.6 -2,-0.2 1,-0.1 -1,-0.2 0.873 122.6 26.0 -80.8 -41.3 32.2 24.9 111.5 21 23 A I H < S- 0 0 23 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.595 102.6-120.4-102.9 -12.8 28.5 25.3 112.2 22 24 A G X - 0 0 32 -4,-2.2 4,-1.6 -5,-0.4 -1,-0.2 -0.042 28.4 -85.4 91.0 160.3 28.1 29.0 113.1 23 25 A E H > S+ 0 0 131 2,-0.2 4,-1.1 1,-0.2 5,-0.1 0.701 120.0 64.2 -80.1 -20.2 26.8 30.6 116.3 24 26 A E H > S+ 0 0 173 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.931 110.8 39.0 -67.2 -42.4 23.1 30.5 115.4 25 27 A E H > S+ 0 0 53 -4,-0.4 4,-2.3 2,-0.2 5,-0.2 0.884 109.4 58.3 -73.4 -41.8 23.3 26.7 115.4 26 28 A V H X S+ 0 0 2 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.801 114.7 42.1 -59.4 -24.4 25.6 26.4 118.4 27 29 A S H X S+ 0 0 59 -4,-1.1 4,-3.3 2,-0.2 5,-0.3 0.944 108.4 54.3 -82.5 -58.8 22.8 28.3 120.1 28 30 A K H X S+ 0 0 80 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.799 114.4 47.4 -44.0 -31.3 19.9 26.4 118.6 29 31 A I H X S+ 0 0 2 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.960 109.8 48.4 -76.3 -55.9 21.7 23.4 120.0 30 32 A Q H < S+ 0 0 91 -4,-1.7 3,-0.2 1,-0.2 -2,-0.2 0.838 111.8 53.1 -53.4 -36.7 22.4 24.8 123.5 31 33 A E H >X S+ 0 0 128 -4,-3.3 3,-1.5 1,-0.2 4,-0.8 0.941 107.2 49.2 -65.0 -50.0 18.8 25.8 123.7 32 34 A K H 3< S+ 0 0 51 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.656 111.9 50.9 -64.9 -17.2 17.4 22.4 122.9 33 35 A A T 3< S+ 0 0 1 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.339 94.3 70.6-103.6 5.1 19.7 20.8 125.5 34 36 A E T X4 S+ 0 0 106 -3,-1.5 3,-2.5 -4,-0.2 -2,-0.2 0.860 90.1 59.8 -85.2 -39.8 18.8 23.1 128.4 35 37 A K T 3< S+ 0 0 150 -4,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.516 113.1 41.2 -65.2 -4.2 15.3 21.6 128.7 36 38 A L T > S+ 0 0 6 -3,-0.1 3,-1.6 3,-0.1 -1,-0.3 0.060 86.0 147.2-128.3 18.7 17.2 18.3 129.4 37 39 A K T < + 0 0 146 -3,-2.5 32,-0.2 1,-0.2 31,-0.1 -0.377 68.6 13.0 -63.2 130.2 19.9 19.9 131.6 38 40 A G T 3 S+ 0 0 55 30,-3.3 -1,-0.2 1,-0.2 31,-0.2 0.457 95.7 139.8 84.6 2.5 21.2 17.6 134.3 39 41 A R < - 0 0 98 -3,-1.6 31,-1.8 29,-0.2 2,-0.6 -0.140 56.3-114.4 -74.2 170.8 19.6 14.5 132.9 40 42 A S E +b 70 0A 16 29,-0.1 87,-2.0 2,-0.0 2,-0.5 -0.938 36.5 168.3-110.7 114.3 21.1 11.0 132.6 41 43 A F E +bc 71 127A 0 29,-1.0 31,-1.6 -2,-0.6 2,-0.3 -0.865 13.6 179.6-129.8 95.6 21.7 9.8 129.1 42 44 A V E -bc 72 128A 1 85,-2.2 87,-2.0 -2,-0.5 2,-0.4 -0.713 14.7-152.8-102.9 152.4 23.8 6.7 129.0 43 45 A H E -bc 73 129A 0 29,-2.1 31,-3.4 -2,-0.3 2,-0.4 -0.931 6.8-166.5-121.9 143.7 25.0 4.5 126.1 44 46 A V E +bc 74 130A 0 85,-1.7 87,-3.3 -2,-0.4 31,-0.2 -0.996 21.7 136.8-134.1 133.1 25.8 0.8 126.0 45 47 A N E -b 75 0A 9 29,-1.3 31,-2.2 -2,-0.4 87,-0.1 -0.801 56.6 -88.5-152.3-165.2 27.7 -1.2 123.4 46 48 A S S S- 0 0 10 -2,-0.2 2,-0.3 29,-0.2 29,-0.1 0.617 91.2 -0.9 -95.5 -15.5 30.3 -3.9 122.8 47 49 A T - 0 0 42 2,-0.1 -1,-0.2 1,-0.1 30,-0.0 -0.992 37.5-146.4-168.7 162.7 33.6 -2.1 122.6 48 50 A S S S+ 0 0 20 -2,-0.3 3,-0.1 -3,-0.1 -1,-0.1 0.195 95.0 44.2-118.2 12.1 35.5 1.2 122.7 49 51 A F S S+ 0 0 170 1,-0.2 2,-1.2 6,-0.0 6,-0.2 0.601 99.3 45.4-117.3 -89.8 38.1 0.2 120.2 50 52 A G S S+ 0 0 69 4,-0.1 2,-0.2 3,-0.1 -1,-0.2 -0.481 94.3 68.3 -69.6 94.6 37.4 -1.6 117.0 51 53 A G S > S- 0 0 39 -2,-1.2 4,-1.9 -3,-0.1 5,-0.1 -0.684 70.9-127.1 161.8 142.6 34.4 0.2 115.4 52 54 A G H > S+ 0 0 50 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.857 114.1 58.6 -69.5 -34.5 33.1 3.4 113.8 53 55 A V H > S+ 0 0 32 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.913 105.6 48.2 -59.5 -43.6 30.4 3.3 116.4 54 56 A A H > S+ 0 0 2 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.947 109.4 52.8 -61.7 -46.9 33.0 3.4 119.1 55 57 A E H < S+ 0 0 89 -4,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.820 107.8 53.3 -57.8 -32.1 34.7 6.3 117.3 56 58 A I H >X S+ 0 0 38 -4,-1.9 4,-2.9 1,-0.2 3,-1.0 0.897 108.1 48.0 -70.7 -42.4 31.4 8.1 117.2 57 59 A L H 3X S+ 0 0 2 -4,-1.9 4,-2.9 1,-0.2 -2,-0.2 0.883 99.0 67.4 -66.3 -39.8 30.8 7.8 121.0 58 60 A H H 3< S+ 0 0 25 -4,-2.2 -46,-0.3 1,-0.2 -1,-0.2 0.689 117.7 26.6 -54.4 -18.8 34.3 9.0 121.8 59 61 A S H <> S+ 0 0 5 -3,-1.0 4,-1.9 -4,-0.3 -2,-0.2 0.704 119.8 55.4-111.6 -38.0 33.1 12.4 120.4 60 62 A L H X S+ 0 0 1 -4,-2.9 4,-2.4 2,-0.2 -3,-0.2 0.873 106.3 50.1 -66.2 -40.3 29.4 12.2 121.0 61 63 A V H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 10,-0.3 0.964 111.5 46.4 -65.5 -53.4 29.5 11.6 124.8 62 64 A P H > S+ 0 0 6 0, 0.0 4,-3.0 0, 0.0 -1,-0.2 0.934 112.5 53.8 -53.3 -45.1 31.9 14.4 125.6 63 65 A L H < S+ 0 0 0 -4,-1.9 -49,-0.4 1,-0.2 4,-0.3 0.939 108.7 45.7 -53.7 -54.5 29.8 16.6 123.4 64 66 A L H ><>S+ 0 0 0 -4,-2.4 5,-1.8 1,-0.2 3,-1.1 0.880 112.8 54.7 -57.0 -38.2 26.6 15.8 125.3 65 67 A R H ><5S+ 0 0 92 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.990 104.8 50.5 -56.6 -65.0 28.6 16.3 128.4 66 68 A S T 3<5S+ 0 0 59 -4,-3.0 -1,-0.2 -54,-0.3 -2,-0.2 0.409 105.8 59.5 -58.1 0.9 29.7 19.8 127.5 67 69 A I T < 5S- 0 0 17 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.140 125.4 -86.6-118.5 21.4 26.1 20.9 126.7 68 70 A G T < 5S+ 0 0 37 -3,-1.8 -30,-3.3 1,-0.3 2,-0.4 0.285 91.8 115.6 99.0 -11.4 24.5 20.3 130.1 69 71 A I < - 0 0 4 -5,-1.8 2,-2.3 -32,-0.2 -1,-0.3 -0.793 65.5-133.2 -97.1 132.2 23.6 16.6 129.8 70 72 A E E + b 0 40A 94 -31,-1.8 -29,-1.0 -2,-0.4 2,-0.1 -0.461 39.3 179.2 -81.7 69.4 25.2 14.1 132.1 71 73 A A E + b 0 41A 0 -2,-2.3 2,-0.3 -10,-0.3 -29,-0.2 -0.456 3.2 179.3 -72.6 143.7 26.0 11.7 129.3 72 74 A R E - b 0 42A 72 -31,-1.6 -29,-2.1 -2,-0.1 2,-0.5 -0.986 17.0-144.4-145.2 152.2 27.8 8.5 130.3 73 75 A W E - b 0 43A 0 -2,-0.3 -69,-1.9 -31,-0.2 2,-0.4 -0.952 13.2-175.8-129.4 118.8 29.0 5.4 128.3 74 76 A F E -Ab 3 44A 7 -31,-3.4 -29,-1.3 -2,-0.5 2,-0.3 -0.868 9.3-155.3-111.9 144.3 29.1 1.8 129.5 75 77 A V E -Ab 2 45A 11 -73,-1.7 -73,-1.8 -2,-0.4 2,-0.3 -0.774 15.6-119.7-115.8 159.1 30.5 -1.2 127.6 76 78 A I - 0 0 4 -31,-2.2 2,-0.3 -2,-0.3 37,-0.1 -0.789 22.4-151.2-100.0 141.9 29.8 -4.9 127.7 77 79 A E + 0 0 90 -2,-0.3 39,-0.1 35,-0.2 -30,-0.0 -0.727 27.4 141.6-107.2 158.7 32.4 -7.5 128.6 78 80 A G - 0 0 45 -2,-0.3 2,-0.1 -32,-0.1 -2,-0.0 -0.952 43.9 -89.2 175.0 164.4 32.6 -11.1 127.4 79 81 A P >> - 0 0 67 0, 0.0 3,-2.2 0, 0.0 4,-1.1 -0.394 47.8-101.9 -83.8 164.2 34.5 -14.2 126.2 80 82 A T H >> S+ 0 0 100 1,-0.3 4,-2.8 2,-0.2 3,-0.6 0.907 119.3 64.5 -51.3 -48.6 35.3 -15.0 122.6 81 83 A E H 34 S+ 0 0 135 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.554 102.4 52.5 -55.5 -6.7 32.5 -17.6 122.4 82 84 A F H <> S+ 0 0 0 -3,-2.2 4,-2.3 2,-0.1 -1,-0.2 0.829 111.6 40.9 -96.3 -42.9 30.1 -14.6 123.0 83 85 A F H S+ 0 0 16 -5,-0.3 4,-2.5 -4,-0.3 -2,-0.2 0.930 113.5 48.3 -65.4 -47.9 28.1 -15.8 118.4 86 88 A T H X S+ 0 0 7 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.728 107.8 56.9 -66.0 -21.4 27.2 -12.1 118.1 87 89 A K H X S+ 0 0 96 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.908 107.9 46.9 -72.9 -42.1 29.2 -12.1 114.9 88 90 A T H X S+ 0 0 36 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.917 111.9 51.4 -62.3 -43.9 26.9 -14.9 113.6 89 91 A F H X S+ 0 0 5 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.947 109.6 50.2 -57.0 -50.5 24.0 -12.8 114.9 90 92 A H H X S+ 0 0 69 -4,-2.5 4,-1.1 1,-0.2 -2,-0.2 0.933 115.5 40.9 -53.6 -53.3 25.3 -9.8 113.0 91 93 A N H < S+ 0 0 78 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.833 114.2 54.3 -66.4 -33.1 25.8 -11.6 109.7 92 94 A A H >< S+ 0 0 0 -4,-2.8 68,-2.4 -5,-0.2 3,-0.5 0.873 106.1 51.1 -69.6 -37.4 22.5 -13.5 110.2 93 95 A L H 3< S+ 0 0 3 -4,-2.7 2,-0.6 1,-0.3 65,-0.3 0.768 107.6 56.4 -69.9 -26.0 20.6 -10.2 110.7 94 96 A Q T 3< S- 0 0 77 -4,-1.1 -1,-0.3 -5,-0.2 2,-0.2 -0.477 127.1 -82.3-103.8 59.1 22.1 -8.9 107.5 95 97 A G S < S+ 0 0 17 -2,-0.6 65,-0.4 -3,-0.5 -1,-0.2 -0.521 82.6 125.9 80.1-146.6 20.9 -11.7 105.2 96 98 A N > - 0 0 92 -2,-0.2 3,-1.0 1,-0.2 2,-0.7 0.982 36.0-174.4 52.4 63.2 22.9 -15.0 105.1 97 99 A E T 3 + 0 0 132 1,-0.2 -1,-0.2 -4,-0.1 -5,-0.1 -0.088 64.8 87.0 -81.7 39.6 19.8 -17.0 105.9 98 100 A S T 3 + 0 0 108 -2,-0.7 2,-0.3 -3,-0.1 -1,-0.2 0.273 64.5 98.1-118.4 7.1 22.1 -20.1 106.1 99 101 A L < - 0 0 45 -3,-1.0 2,-0.5 -11,-0.1 64,-0.2 -0.772 64.2-139.6 -99.9 142.3 23.1 -19.7 109.7 100 102 A K - 0 0 162 -2,-0.3 2,-0.8 62,-0.1 -2,-0.0 -0.879 3.5-146.4-105.7 130.7 21.4 -21.7 112.5 101 103 A L - 0 0 21 -2,-0.5 2,-0.2 4,-0.0 -2,-0.0 -0.836 26.6-173.0 -96.5 109.2 20.5 -20.2 115.9 102 104 A T > - 0 0 58 -2,-0.8 4,-1.9 1,-0.1 3,-0.4 -0.497 37.0-111.2 -99.1 169.0 20.9 -22.9 118.6 103 105 A E H > S+ 0 0 113 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.851 116.1 63.5 -66.3 -36.3 20.1 -22.9 122.3 104 106 A E H > S+ 0 0 146 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.887 107.3 46.6 -54.2 -37.0 23.7 -23.0 123.2 105 107 A M H > S+ 0 0 31 -3,-0.4 4,-3.1 2,-0.2 5,-0.2 0.950 110.7 48.8 -70.5 -52.2 23.8 -19.6 121.6 106 108 A K H X S+ 0 0 60 -4,-1.9 4,-2.7 1,-0.2 5,-0.3 0.892 111.5 51.2 -55.9 -43.3 20.7 -18.2 123.3 107 109 A E H X S+ 0 0 120 -4,-3.0 4,-3.1 2,-0.2 5,-0.2 0.961 113.7 43.5 -59.4 -52.6 22.0 -19.3 126.7 108 110 A L H X S+ 0 0 44 -4,-1.8 4,-2.6 -5,-0.3 5,-0.3 0.937 114.9 48.3 -59.7 -50.8 25.4 -17.7 126.2 109 111 A Y H X S+ 0 0 1 -4,-3.1 4,-1.2 1,-0.2 -1,-0.2 0.937 117.5 41.4 -56.7 -49.7 24.0 -14.4 124.7 110 112 A L H X S+ 0 0 34 -4,-2.7 4,-1.0 -5,-0.2 -2,-0.2 0.917 114.5 51.0 -66.4 -44.3 21.4 -14.1 127.5 111 113 A N H >X S+ 0 0 67 -4,-3.1 3,-2.2 -5,-0.3 4,-2.0 0.974 108.9 49.8 -56.5 -58.2 23.7 -15.1 130.3 112 114 A V H 3X S+ 0 0 13 -4,-2.6 4,-1.4 1,-0.3 -1,-0.2 0.826 110.2 53.4 -50.0 -32.6 26.4 -12.7 129.3 113 115 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318 359C 0 -24,-2.1 -22,-2.0 -2,-0.3 2,-0.3 -0.987 33.3 139.8-122.1 117.2 29.0 10.0 91.0 342 344 A G E -kl 319 360C 0 17,-2.3 19,-1.8 -2,-0.5 -22,-0.3 -0.974 52.2 -87.2-155.2 168.0 27.1 6.9 92.2 343 345 A R - 0 0 35 -24,-1.5 2,-1.4 -2,-0.3 -22,-0.2 -0.343 49.3-106.4 -71.8 160.1 24.3 4.5 91.7 344 346 A A S S+ 0 0 34 17,-0.5 2,-0.3 5,-0.1 -1,-0.1 -0.630 73.9 120.5 -91.1 80.7 21.0 5.4 93.4 345 347 A V >> - 0 0 44 -2,-1.4 3,-2.2 -22,-0.1 4,-0.7 -0.965 65.8 -25.0-141.6 155.8 20.9 2.9 96.2 346 348 A G H >> S- 0 0 5 -2,-0.3 3,-1.3 1,-0.3 4,-0.7 0.000 126.1 -14.0 41.7-140.7 20.8 2.9 100.0 347 349 A G H 3> S+ 0 0 0 -22,-3.7 4,-2.1 1,-0.2 -1,-0.3 0.551 127.7 76.2 -67.9 -5.0 22.1 6.1 101.6 348 350 A I H <> S+ 0 0 1 -3,-2.2 4,-1.3 -23,-0.4 -1,-0.2 0.800 94.0 47.1 -76.5 -29.1 23.7 7.1 98.3 349 351 A K H << S+ 0 0 118 -3,-1.3 5,-0.2 -4,-0.7 -1,-0.2 0.737 114.4 49.3 -82.4 -24.3 20.3 8.2 96.7 350 352 A F H < S+ 0 0 99 -4,-0.7 -2,-0.2 -5,-0.2 -1,-0.1 0.911 113.9 42.2 -78.9 -47.2 19.5 10.1 99.8 351 353 A Q H < S+ 0 0 0 -4,-2.1 2,-0.5 -25,-0.2 -2,-0.2 0.858 102.3 72.9 -71.4 -38.1 22.8 12.1 100.2 352 354 A I < - 0 0 5 -4,-1.3 2,-1.0 -5,-0.2 8,-0.0 -0.684 64.2-159.1 -84.1 127.5 23.3 12.9 96.5 353 355 A V >>> - 0 0 41 -2,-0.5 3,-2.6 6,-0.0 4,-2.2 -0.879 35.0-122.9-102.4 96.1 21.0 15.6 95.1 354 356 A D B 345S+m 358 0D 87 -2,-1.0 5,-0.3 1,-0.3 -13,-0.1 -0.098 88.2 7.6 -47.3 130.1 21.5 14.7 91.5 355 357 A G T 345S+ 0 0 43 3,-2.5 -1,-0.3 1,-0.1 4,-0.1 0.315 130.0 59.6 81.3 -8.9 22.7 17.5 89.3 356 358 A E T <45S+ 0 0 112 -3,-2.6 31,-0.2 2,-0.4 -2,-0.2 0.777 121.3 6.3-114.2 -53.7 23.3 19.7 92.4 357 359 A T T <5S- 0 0 5 -4,-2.2 -17,-0.5 1,-0.2 2,-0.2 0.681 132.7 -35.3-103.9 -27.6 25.8 18.1 94.8 358 360 A G B S- 0 0 59 -21,-0.1 4,-1.5 1,-0.1 -1,-0.1 -0.910 79.9 -82.7-158.4-174.4 25.6 2.4 84.6 364 366 A A H > S+ 0 0 6 -2,-0.3 4,-2.7 2,-0.2 5,-0.1 0.845 119.7 54.2 -70.2 -36.7 29.2 2.8 83.7 365 367 A N H > S+ 0 0 93 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.884 110.4 46.5 -67.5 -34.5 28.6 4.6 80.4 366 368 A E H > S+ 0 0 60 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.866 112.5 53.3 -71.2 -34.9 26.5 7.2 82.1 367 369 A A H X S+ 0 0 0 -4,-1.5 4,-1.9 1,-0.2 -2,-0.2 0.909 105.4 52.6 -64.7 -44.2 29.3 7.4 84.8 368 370 A V H X S+ 0 0 13 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.890 106.5 53.9 -59.5 -41.4 32.0 8.0 82.1 369 371 A E H X S+ 0 0 134 -4,-1.6 4,-2.7 1,-0.2 -1,-0.2 0.951 111.1 43.7 -58.1 -54.5 30.0 10.9 80.7 370 372 A V H X S+ 0 0 11 -4,-1.8 4,-2.8 1,-0.2 5,-0.2 0.803 110.8 54.8 -65.0 -31.2 29.7 12.8 84.0 371 373 A V H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.929 112.0 44.0 -68.4 -43.3 33.4 12.1 84.9 372 374 A L H X S+ 0 0 36 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.935 114.3 51.0 -65.0 -44.7 34.6 13.6 81.7 373 375 A Y H X S+ 0 0 99 -4,-2.7 4,-2.7 -5,-0.2 3,-0.3 0.985 114.4 42.1 -54.3 -64.2 32.1 16.5 82.1 374 376 A L H < S+ 0 0 2 -4,-2.8 7,-0.4 1,-0.3 3,-0.2 0.933 116.0 47.5 -48.1 -57.9 33.2 17.3 85.6 375 377 A L H < S+ 0 0 38 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.852 114.7 49.9 -54.4 -33.1 36.9 16.9 84.9 376 378 A K H < S+ 0 0 163 -4,-2.5 -1,-0.2 -3,-0.3 -2,-0.2 0.866 116.2 41.1 -73.5 -37.8 36.3 19.1 81.8 377 379 A H >X + 0 0 62 -4,-2.7 4,-2.2 -3,-0.2 3,-0.7 -0.636 63.2 172.3-114.6 74.5 34.4 21.8 83.8 378 380 A P H 3> S+ 0 0 71 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.719 80.3 57.4 -53.8 -23.0 36.3 22.2 87.1 379 381 A E H 3> S+ 0 0 108 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.909 106.4 46.7 -75.0 -43.2 34.1 25.2 87.9 380 382 A V H <> S+ 0 0 40 -3,-0.7 4,-2.8 1,-0.2 5,-0.2 0.918 114.6 50.3 -61.8 -40.2 30.9 23.2 87.7 381 383 A S H X S+ 0 0 21 -4,-2.2 4,-2.2 -7,-0.4 -2,-0.2 0.867 107.8 51.2 -65.0 -39.2 32.8 20.7 89.8 382 384 A K H X S+ 0 0 120 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.914 112.2 49.1 -64.8 -39.9 33.8 23.3 92.4 383 385 A E H X S+ 0 0 109 -4,-2.6 4,-2.2 2,-0.2 5,-0.2 0.952 110.3 47.1 -63.5 -52.4 30.2 24.3 92.5 384 386 A M H X S+ 0 0 9 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.888 113.9 50.6 -57.5 -39.4 28.8 20.8 93.0 385 387 A G H X S+ 0 0 0 -4,-2.2 4,-2.0 -48,-0.2 -48,-0.3 0.942 107.8 51.3 -64.3 -47.7 31.4 20.2 95.7 386 388 A A H X S+ 0 0 51 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.893 113.1 45.2 -57.0 -44.3 30.6 23.4 97.6 387 389 A K H X S+ 0 0 99 -4,-2.2 4,-1.8 -31,-0.2 -1,-0.2 0.805 110.7 53.7 -71.7 -28.9 26.9 22.6 97.7 388 390 A A H X S+ 0 0 0 -4,-1.7 4,-1.5 -5,-0.2 -2,-0.2 0.822 106.1 53.8 -74.7 -29.3 27.6 19.0 98.7 389 391 A K H X S+ 0 0 54 -4,-2.0 4,-2.7 2,-0.2 3,-0.2 0.957 108.1 49.6 -68.3 -45.8 29.7 20.2 101.6 390 392 A E H X S+ 0 0 82 -4,-1.8 4,-3.1 1,-0.2 5,-0.2 0.891 105.0 56.7 -56.8 -44.5 26.9 22.4 102.9 391 393 A R H X S+ 0 0 54 -4,-1.8 4,-0.6 1,-0.2 5,-0.3 0.902 111.8 44.3 -55.3 -41.7 24.4 19.6 102.7 392 394 A V H >X S+ 0 0 0 -4,-1.5 4,-2.6 -3,-0.2 3,-1.0 0.944 112.2 51.0 -67.5 -49.5 26.7 17.6 105.0 393 395 A R H 3< S+ 0 0 58 -4,-2.7 4,-0.2 1,-0.3 -2,-0.2 0.863 118.8 38.0 -56.4 -39.0 27.3 20.6 107.3 394 396 A K H 3< S+ 0 0 136 -4,-3.1 -1,-0.3 -5,-0.2 -2,-0.2 0.481 134.1 18.8 -94.1 -0.2 23.6 21.2 107.7 395 397 A N H << S+ 0 0 52 -3,-1.0 -3,-0.2 -4,-0.6 -2,-0.2 0.649 123.6 33.7-137.8 -32.5 22.5 17.5 107.7 396 398 A F S < S+ 0 0 2 -4,-2.6 -195,-2.2 -5,-0.3 2,-0.2 -0.039 75.9 120.2-128.3 35.1 25.1 14.9 108.6 397 399 A I B > S-g 201 0B 0 -5,-0.3 4,-1.8 -4,-0.2 3,-0.2 -0.623 71.5-116.4 -93.7 156.2 27.6 16.4 111.1 398 400 A I H > S+ 0 0 0 -197,-1.2 4,-2.3 1,-0.2 5,-0.1 0.808 118.4 53.9 -63.0 -28.7 28.1 14.8 114.5 399 401 A T H > S+ 0 0 3 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.851 110.3 45.9 -72.5 -33.4 26.7 18.0 116.1 400 402 A K H > S+ 0 0 40 -3,-0.2 4,-0.9 2,-0.2 -2,-0.2 0.758 110.2 55.9 -76.2 -26.6 23.6 17.7 113.9 401 403 A H H X S+ 0 0 7 -4,-1.8 4,-1.0 2,-0.2 3,-0.3 0.925 109.1 45.7 -69.1 -46.1 23.5 14.1 114.9 402 404 A M H >X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 3,-1.2 0.939 106.9 57.2 -62.5 -48.3 23.4 15.0 118.6 403 405 A E H 3X S+ 0 0 3 -4,-2.1 4,-2.1 1,-0.3 -1,-0.2 0.804 102.7 57.1 -53.6 -29.0 20.8 17.7 118.0 404 406 A R H 3X S+ 0 0 49 -4,-0.9 4,-1.3 -3,-0.3 -1,-0.3 0.839 103.3 53.2 -70.9 -32.5 18.7 14.8 116.6 405 407 A Y H X S+ 0 0 0 -4,-1.9 4,-3.1 1,-0.2 3,-0.7 0.986 104.9 54.6 -57.7 -58.8 17.8 16.0 121.8 407 409 A D H 3< S+ 0 0 67 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.818 111.3 47.3 -42.4 -39.3 14.7 16.3 119.6 408 410 A I H >< S+ 0 0 15 -4,-1.3 3,-0.8 2,-0.2 -1,-0.3 0.864 112.8 45.7 -74.3 -38.4 14.0 12.6 120.5 409 411 A L H X< S+ 0 0 4 -4,-2.2 3,-0.9 -3,-0.7 -2,-0.2 0.806 108.7 57.8 -74.3 -27.7 14.6 13.1 124.2 410 412 A N T 3< S+ 0 0 67 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.500 104.2 56.4 -77.6 -3.5 12.4 16.2 124.1 411 413 A S T < 0 0 63 -3,-0.8 -1,-0.3 -5,-0.3 -2,-0.1 -0.185 360.0 360.0-121.7 40.2 9.7 14.1 122.7 412 414 A L < 0 0 84 -3,-0.9 -2,-0.1 -265,-0.0 -3,-0.1 0.686 360.0 360.0-123.7 360.0 9.3 11.4 125.4 413 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 414 3 B M 0 0 2 0, 0.0 75,-0.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 92.7 63.2 49.2 132.4 415 4 B Y - 0 0 96 73,-0.3 73,-3.0 72,-0.0 2,-0.4 -0.532 360.0-119.3 -94.8 164.2 60.8 46.3 133.1 416 5 B E E -N 487 0E 36 71,-0.2 2,-0.7 -2,-0.2 71,-0.3 -0.828 18.0-127.4-105.1 142.4 61.3 42.6 132.5 417 6 B V E +N 486 0E 8 69,-3.3 69,-0.5 -2,-0.4 3,-0.0 -0.791 38.3 158.5 -89.8 114.4 59.1 40.5 130.1 418 7 B K + 0 0 153 -2,-0.7 2,-0.3 67,-0.1 -1,-0.2 0.784 58.5 65.4-102.0 -41.2 57.8 37.5 132.0 419 8 B E S S- 0 0 174 5,-0.0 2,-0.5 2,-0.0 5,-0.0 -0.629 71.4-153.6 -84.0 142.2 54.8 36.6 129.9 420 9 B F - 0 0 30 -2,-0.3 3,-0.4 1,-0.1 5,-0.0 -0.945 12.0-154.9-125.9 114.1 55.5 35.5 126.3 421 10 B S S S+ 0 0 91 -2,-0.5 2,-2.5 1,-0.3 -1,-0.1 0.876 97.0 61.0 -47.9 -48.5 52.9 35.9 123.5 422 11 B S S > S- 0 0 29 1,-0.2 3,-0.9 49,-0.2 -1,-0.3 -0.221 112.2-126.4 -76.2 49.4 54.4 33.0 121.5 423 12 B G T 3 - 0 0 40 -2,-2.5 2,-0.6 -3,-0.4 -1,-0.2 0.011 60.0 -37.2 38.2-140.4 53.5 30.9 124.5 424 13 B K T 3 - 0 0 166 -3,-0.1 -1,-0.2 51,-0.1 48,-0.1 -0.686 67.4-154.8-113.3 76.2 56.4 29.0 125.8 425 14 B R < - 0 0 43 -3,-0.9 54,-0.4 -2,-0.6 2,-0.3 -0.287 16.0-168.3 -50.9 126.7 58.3 28.0 122.6 426 15 B K > - 0 0 93 1,-0.1 3,-1.6 52,-0.1 4,-0.3 -0.903 35.3-119.6-120.3 149.3 60.2 24.9 123.5 427 16 B L G > S+ 0 0 4 -2,-0.3 3,-2.6 49,-0.3 4,-0.5 0.915 117.0 63.3 -51.2 -41.2 62.9 23.2 121.4 428 17 B E G > S+ 0 0 98 1,-0.3 3,-1.4 2,-0.2 4,-0.4 0.810 87.6 69.5 -52.5 -34.1 60.6 20.2 121.5 429 18 B D G < S+ 0 0 69 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.574 106.0 40.3 -63.8 -8.2 58.0 22.3 119.6 430 19 B Y G X> S+ 0 0 0 -3,-2.6 4,-2.1 -4,-0.3 3,-1.5 0.399 80.4 107.4-118.3 -2.0 60.3 22.1 116.6 431 20 B K H <> S+ 0 0 52 -3,-1.4 4,-2.2 -4,-0.5 8,-0.1 0.870 81.6 50.7 -43.5 -48.5 61.5 18.5 116.9 432 21 B S H 34 S+ 0 0 123 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.791 112.6 48.2 -61.7 -30.2 59.4 17.5 113.9 433 22 B I H <4 S+ 0 0 32 -3,-1.5 -2,-0.2 1,-0.1 -1,-0.2 0.866 122.8 25.7 -81.0 -40.6 60.9 20.3 111.8 434 23 B I H < S- 0 0 23 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.607 102.7-120.8-103.2 -13.8 64.6 19.9 112.5 435 24 B G X - 0 0 33 -4,-2.2 4,-1.6 -5,-0.4 -1,-0.2 -0.049 28.4 -84.9 91.6 160.9 65.0 16.2 113.3 436 25 B E H > S+ 0 0 130 2,-0.2 4,-1.1 1,-0.2 5,-0.2 0.703 120.1 64.0 -80.0 -20.7 66.4 14.6 116.5 437 26 B E H > S+ 0 0 172 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.931 110.9 39.1 -67.1 -42.3 70.0 14.7 115.5 438 27 B E H > S+ 0 0 51 -4,-0.4 4,-2.3 2,-0.2 5,-0.2 0.880 109.4 58.2 -73.8 -40.9 69.9 18.5 115.5 439 28 B V H X S+ 0 0 2 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.804 114.7 42.0 -60.3 -24.2 67.6 18.8 118.6 440 29 B S H X S+ 0 0 59 -4,-1.1 4,-3.3 2,-0.2 5,-0.3 0.945 108.5 54.4 -82.5 -58.7 70.5 16.9 120.3 441 30 B K H X S+ 0 0 77 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.800 114.3 47.3 -43.7 -31.6 73.4 18.8 118.7 442 31 B I H X S+ 0 0 1 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.961 109.9 48.4 -76.2 -55.7 71.5 21.8 120.1 443 32 B Q H < S+ 0 0 90 -4,-1.7 -2,-0.2 1,-0.2 4,-0.2 0.831 111.7 53.1 -53.8 -36.2 70.9 20.4 123.6 444 33 B E H >X S+ 0 0 129 -4,-3.3 3,-1.5 1,-0.2 4,-0.8 0.941 107.2 49.1 -65.5 -49.7 74.6 19.4 123.8 445 34 B K H 3< S+ 0 0 49 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.657 111.9 50.9 -65.2 -17.5 75.9 22.8 122.9 446 35 B A T 3< S+ 0 0 1 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.343 94.4 70.6-103.1 5.0 73.6 24.4 125.6 447 36 B E T X4 S+ 0 0 106 -3,-1.5 3,-2.5 -4,-0.2 -2,-0.2 0.865 90.2 59.8 -85.1 -40.1 74.6 22.1 128.4 448 37 B K T 3< S+ 0 0 151 -4,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.520 113.0 41.4 -64.9 -4.7 78.1 23.6 128.7 449 38 B L T > S+ 0 0 5 -3,-0.1 3,-1.6 3,-0.1 -1,-0.3 0.059 86.0 147.4-127.6 18.5 76.2 26.9 129.4 450 39 B K T < + 0 0 147 -3,-2.5 32,-0.2 1,-0.2 31,-0.1 -0.372 68.6 12.5 -63.0 129.6 73.6 25.3 131.7 451 40 B G T 3 S+ 0 0 54 30,-3.3 -1,-0.2 1,-0.2 31,-0.2 0.461 95.6 139.9 84.8 2.5 72.3 27.6 134.5 452 41 B R < - 0 0 98 -3,-1.6 31,-1.7 29,-0.2 2,-0.6 -0.140 56.2-114.3 -74.0 170.6 73.9 30.7 133.0 453 42 B S E +o 483 0E 16 29,-0.1 87,-2.0 2,-0.0 2,-0.5 -0.938 36.7 168.2-110.2 114.1 72.4 34.2 132.8 454 43 B F E +op 484 540E 0 29,-1.0 31,-1.7 -2,-0.6 2,-0.3 -0.872 13.5 179.5-129.5 96.1 71.7 35.4 129.2 455 44 B V E -op 485 541E 0 85,-2.2 87,-2.1 -2,-0.5 2,-0.4 -0.723 14.9-152.7-103.4 152.1 69.7 38.5 129.2 456 45 B H E -op 486 542E 0 29,-2.2 31,-3.4 -2,-0.3 2,-0.4 -0.925 6.8-166.5-121.0 144.3 68.4 40.7 126.3 457 46 B V E 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1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.943 109.4 52.9 -62.9 -46.3 60.3 41.7 119.5 468 57 B E H < S+ 0 0 89 -4,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.820 107.9 53.1 -58.1 -31.9 58.5 38.9 117.7 469 58 B I H >X S+ 0 0 42 -4,-1.8 4,-2.8 1,-0.2 3,-1.0 0.898 108.0 48.2 -71.3 -42.6 61.8 37.1 117.6 470 59 B L H 3X S+ 0 0 3 -4,-1.9 4,-2.9 1,-0.2 -2,-0.2 0.884 99.0 67.2 -65.8 -39.8 62.5 37.4 121.3 471 60 B H H 3< S+ 0 0 21 -4,-2.2 -46,-0.4 1,-0.2 -1,-0.2 0.687 117.7 26.7 -54.5 -18.9 59.0 36.2 122.2 472 61 B S H <> S+ 0 0 0 -3,-1.0 4,-1.8 -4,-0.3 -2,-0.2 0.703 119.8 55.3-111.7 -37.1 60.1 32.8 120.8 473 62 B L H X S+ 0 0 1 -4,-2.8 4,-2.4 2,-0.2 -3,-0.2 0.869 106.4 50.0 -67.1 -40.2 63.9 33.0 121.3 474 63 B V H X S+ 0 0 0 -4,-2.9 4,-2.5 2,-0.2 10,-0.3 0.959 111.5 46.3 -65.8 -53.0 63.8 33.6 125.1 475 64 B P H > S+ 0 0 6 0, 0.0 4,-3.1 0, 0.0 -1,-0.2 0.933 112.6 53.8 -54.0 -44.8 61.4 30.8 125.9 476 65 B L H < S+ 0 0 0 -4,-1.8 4,-0.4 1,-0.2 -49,-0.3 0.941 108.9 45.6 -53.8 -54.7 63.6 28.6 123.7 477 66 B L H ><>S+ 0 0 0 -4,-2.4 5,-1.8 1,-0.2 3,-1.1 0.882 112.8 54.5 -57.2 -38.2 66.8 29.4 125.5 478 67 B R H ><5S+ 0 0 101 -4,-2.5 3,-1.8 1,-0.2 -2,-0.2 0.991 105.0 50.6 -57.3 -64.1 64.8 28.9 128.7 479 68 B S T 3<5S+ 0 0 62 -4,-3.1 -1,-0.2 -54,-0.4 -2,-0.2 0.419 105.8 59.4 -58.4 0.8 63.7 25.4 127.8 480 69 B I T < 5S- 0 0 17 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.149 125.5 -86.4-118.2 21.3 67.3 24.3 126.9 481 70 B G T < 5S+ 0 0 37 -3,-1.8 -30,-3.3 1,-0.3 2,-0.4 0.284 91.9 115.7 99.4 -11.4 69.0 24.9 130.3 482 71 B I < - 0 0 3 -5,-1.8 2,-2.4 -32,-0.2 -1,-0.3 -0.795 65.5-133.3 -97.1 131.5 69.9 28.6 130.0 483 72 B E E + o 0 453E 92 -31,-1.7 -29,-1.0 -2,-0.4 2,-0.1 -0.451 39.3 179.2 -81.0 69.3 68.3 31.1 132.3 484 73 B A E + o 0 454E 0 -2,-2.4 2,-0.3 -10,-0.3 -29,-0.2 -0.447 3.2 179.6 -72.2 144.3 67.5 33.5 129.5 485 74 B R E - o 0 455E 71 -31,-1.7 -29,-2.2 -2,-0.1 2,-0.5 -0.987 17.0-144.7-145.5 152.1 65.7 36.7 130.5 486 75 B W E -No 417 456E 0 -69,-0.5 -69,-3.3 -2,-0.3 2,-0.4 -0.952 13.3-176.2-129.3 118.2 64.4 39.8 128.6 487 76 B F E -No 416 457E 4 -31,-3.4 -29,-1.3 -2,-0.5 2,-0.3 -0.866 9.5-155.4-111.5 144.1 64.4 43.4 129.8 488 77 B V E - o 0 458E 1 -73,-3.0 2,-0.3 -2,-0.4 -73,-0.3 -0.782 15.6-119.5-116.3 158.8 62.9 46.4 127.9 489 78 B I - 0 0 4 -31,-2.2 2,-0.3 -2,-0.3 37,-0.1 -0.784 22.4-151.1 -99.6 141.6 63.6 50.1 128.0 490 79 B E + 0 0 86 -2,-0.3 39,-0.1 35,-0.2 -30,-0.0 -0.718 27.5 141.3-106.5 158.9 61.0 52.7 129.0 491 80 B G - 0 0 44 -2,-0.3 2,-0.1 -32,-0.1 -2,-0.0 -0.948 44.0 -89.0 174.4 163.8 60.7 56.3 127.8 492 81 B P >> - 0 0 67 0, 0.0 3,-2.1 0, 0.0 4,-1.1 -0.383 47.7-102.1 -83.0 164.5 58.8 59.4 126.7 493 82 B T H >> S+ 0 0 100 1,-0.3 4,-2.8 2,-0.2 3,-0.6 0.908 119.2 64.5 -51.7 -48.5 58.0 60.2 123.0 494 83 B E H 34 S+ 0 0 134 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.547 102.5 52.4 -55.7 -6.0 60.8 62.7 122.8 495 84 B F H <> S+ 0 0 0 -3,-2.1 4,-2.3 2,-0.1 -1,-0.2 0.821 111.6 40.9 -97.2 -42.6 63.2 59.8 123.3 496 85 B F H S+ 0 0 16 -5,-0.3 4,-2.6 -4,-0.3 -2,-0.2 0.930 113.5 48.2 -65.5 -47.8 65.1 61.0 118.7 499 88 B T H X S+ 0 0 7 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.738 107.8 56.9 -66.2 -21.9 66.0 57.4 118.4 500 89 B K H X S+ 0 0 101 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.911 108.0 46.9 -72.1 -42.1 63.9 57.3 115.2 501 90 B T H X S+ 0 0 35 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.915 111.9 51.3 -62.3 -44.3 66.2 60.1 113.9 502 91 B F H X S+ 0 0 4 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.951 109.6 50.2 -56.9 -51.4 69.2 58.0 115.1 503 92 B H H X S+ 0 0 68 -4,-2.6 4,-1.1 1,-0.2 -2,-0.2 0.931 115.5 40.9 -52.7 -53.2 67.8 55.0 113.3 504 93 B N H < S+ 0 0 76 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.840 114.3 54.0 -66.2 -34.3 67.3 56.9 110.0 505 94 B A H >< S+ 0 0 0 -4,-2.8 68,-2.5 -5,-0.2 3,-0.5 0.866 106.2 51.2 -68.2 -37.5 70.6 58.7 110.4 506 95 B L H 3< S+ 0 0 3 -4,-2.7 2,-0.6 1,-0.3 65,-0.3 0.765 107.6 56.4 -70.1 -26.1 72.5 55.4 110.8 507 96 B Q T 3< S- 0 0 77 -4,-1.1 -1,-0.3 -5,-0.2 2,-0.2 -0.483 127.3 -82.2-103.7 59.3 70.9 54.2 107.6 508 97 B G S < S+ 0 0 17 -2,-0.6 65,-0.4 -3,-0.5 -1,-0.2 -0.527 82.7 125.9 80.0-146.3 72.0 57.0 105.4 509 98 B N > - 0 0 92 -2,-0.2 3,-1.0 1,-0.2 2,-0.7 0.981 35.9-174.5 52.2 63.4 70.0 60.2 105.3 510 99 B E T 3 + 0 0 130 1,-0.2 -1,-0.2 -4,-0.1 -5,-0.1 -0.087 64.8 86.8 -82.0 40.0 73.1 62.3 106.0 511 100 B S T 3 + 0 0 108 -2,-0.7 2,-0.3 -3,-0.1 -1,-0.2 0.279 64.5 98.0-118.8 7.0 70.9 65.3 106.3 512 101 B L < - 0 0 45 -3,-1.0 2,-0.5 -11,-0.1 64,-0.2 -0.765 64.2-139.5 -99.5 143.0 69.9 64.9 110.0 513 102 B K - 0 0 160 -2,-0.3 2,-0.8 62,-0.1 -2,-0.0 -0.883 3.5-146.2-106.0 131.0 71.7 66.9 112.7 514 103 B L - 0 0 20 -2,-0.5 2,-0.2 4,-0.0 -2,-0.0 -0.839 26.6-172.9 -96.5 109.2 72.6 65.4 116.1 515 104 B T > - 0 0 59 -2,-0.8 4,-1.9 1,-0.1 3,-0.4 -0.497 37.0-111.4 -99.0 168.6 72.3 68.1 118.8 516 105 B E H > S+ 0 0 111 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.854 116.1 63.5 -66.1 -36.4 73.2 68.1 122.5 517 106 B E H > S+ 0 0 143 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.885 107.3 46.7 -54.0 -36.7 69.5 68.2 123.5 518 107 B M H > S+ 0 0 31 -3,-0.4 4,-3.1 2,-0.2 5,-0.2 0.951 110.6 48.6 -70.8 -52.2 69.4 64.8 121.8 519 108 B K H X S+ 0 0 60 -4,-1.9 4,-2.6 1,-0.2 5,-0.3 0.892 111.6 51.4 -56.2 -42.9 72.6 63.4 123.4 520 109 B E H X S+ 0 0 119 -4,-3.1 4,-3.1 2,-0.2 5,-0.2 0.961 113.6 43.2 -59.3 -52.6 71.4 64.5 126.9 521 110 B L H X S+ 0 0 42 -4,-1.8 4,-2.6 -5,-0.3 5,-0.3 0.937 115.0 48.7 -59.9 -50.2 68.0 62.9 126.5 522 111 B Y H X S+ 0 0 1 -4,-3.1 4,-1.1 1,-0.2 -1,-0.2 0.937 117.3 41.3 -57.1 -49.8 69.3 59.7 125.0 523 112 B L H X S+ 0 0 35 -4,-2.6 4,-1.1 -5,-0.2 -2,-0.2 0.918 114.6 51.1 -66.2 -44.4 72.0 59.2 127.7 524 113 B N H >X S+ 0 0 62 -4,-3.1 3,-2.2 -5,-0.3 4,-2.0 0.974 108.8 49.9 -56.5 -58.0 69.7 60.3 130.5 525 114 B V H 3X S+ 0 0 13 -4,-2.6 4,-1.4 1,-0.3 -1,-0.2 0.817 110.2 53.4 -50.9 -30.7 67.0 57.9 129.5 526 115 B N H 3< S+ 0 0 0 -4,-1.1 4,-0.4 -5,-0.3 -1,-0.3 0.730 108.3 51.9 -76.0 -22.3 69.8 55.3 129.4 527 116 B R H X< S+ 0 0 92 -3,-2.2 3,-1.3 -4,-1.1 -2,-0.2 0.971 109.8 43.4 -77.0 -59.6 70.7 56.3 133.0 528 117 B E H >< S+ 0 0 111 -4,-2.0 3,-1.6 1,-0.3 4,-0.2 0.879 112.0 54.8 -54.2 -43.1 67.4 56.0 134.7 529 118 B N G >< S+ 0 0 6 -4,-1.4 3,-0.6 -5,-0.3 4,-0.5 0.716 102.1 59.3 -66.8 -20.0 66.6 52.7 133.0 530 119 B S G < S+ 0 0 9 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.312 94.3 64.7 -91.5 8.7 69.9 51.2 134.2 531 120 B K G < S+ 0 0 145 -3,-1.6 -1,-0.2 -4,-0.1 -2,-0.2 0.378 91.7 63.1-108.7 1.4 68.9 51.7 137.9 532 121 B F S < S+ 0 0 114 -3,-0.6 2,-0.4 1,-0.3 -2,-0.1 0.819 113.0 20.6 -92.9 -37.4 66.0 49.3 137.9 533 122 B I S S- 0 0 41 -4,-0.5 2,-1.5 -118,-0.1 -1,-0.3 -0.997 72.7-129.5-135.5 138.2 67.9 46.1 137.1 534 123 B D > + 0 0 70 -2,-0.4 3,-2.2 1,-0.2 4,-0.1 -0.611 28.8 174.7 -89.4 81.9 71.6 45.3 137.5 535 124 B L G > S+ 0 0 0 -2,-1.5 3,-2.2 1,-0.3 -1,-0.2 0.826 72.4 70.2 -53.3 -37.0 72.5 43.9 134.1 536 125 B S G 3 S+ 0 0 3 1,-0.3 -1,-0.3 -3,-0.2 22,-0.3 0.600 86.9 69.1 -60.1 -10.0 76.2 43.7 135.0 537 126 B S G < S+ 0 0 69 -3,-2.2 -1,-0.3 20,-0.1 2,-0.2 0.508 82.2 90.9 -88.5 -4.4 75.2 40.8 137.4 538 127 B F S < S- 0 0 13 -3,-2.2 20,-0.2 -4,-0.1 3,-0.1 -0.632 81.1-123.7 -94.1 151.8 74.4 38.4 134.6 539 128 B D S S+ 0 0 57 -2,-0.2 2,-0.3 1,-0.2 -85,-0.2 0.813 97.8 15.1 -59.8 -32.8 76.8 35.9 132.9 540 129 B Y E -p 454 0E 13 -87,-2.0 -85,-2.2 19,-0.2 2,-0.4 -0.981 66.9-164.4-147.9 133.0 76.0 37.4 129.5 541 130 B V E -pq 455 561E 0 19,-2.3 21,-3.5 -2,-0.3 2,-0.4 -0.963 4.2-173.2-122.4 134.6 74.4 40.6 128.4 542 131 B L E -pq 456 562E 0 -87,-2.1 -85,-1.6 -2,-0.4 2,-0.4 -0.992 5.9-161.6-128.9 128.0 73.0 41.3 124.9 543 132 B V E -pq 457 563E 0 19,-2.9 21,-2.8 -2,-0.4 2,-0.5 -0.923 11.4-141.0-113.1 132.9 71.7 44.7 123.8 544 133 B H E - q 0 564E 6 -87,-3.3 21,-0.2 -2,-0.4 5,-0.1 -0.817 53.7 -36.3-100.2 124.2 69.5 45.2 120.8 545 134 B D S S- 0 0 25 19,-2.9 4,-0.4 -2,-0.5 19,-0.1 0.239 89.9 -55.3 56.8 175.2 69.8 48.2 118.4 546 135 B P S > S+ 0 0 5 0, 0.0 3,-3.3 0, 0.0 4,-0.4 0.909 111.7 78.8 -49.2 -62.1 70.7 51.8 119.3 547 136 B Q T 3 S+ 0 0 37 1,-0.3 3,-0.2 2,-0.1 -2,-0.1 0.656 111.6 22.7 -24.7 -45.4 68.1 52.8 122.0 548 137 B P T > S+ 0 0 0 0, 0.0 3,-2.8 0, 0.0 4,-0.3 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801 390 B A H X S+ 0 0 0 -4,-1.7 4,-1.5 -5,-0.2 -2,-0.2 0.812 106.1 54.1 -75.5 -28.6 65.5 26.1 98.8 802 391 B K H X S+ 0 0 54 -4,-2.0 4,-2.7 2,-0.2 3,-0.3 0.958 108.1 49.5 -68.3 -45.7 63.4 24.9 101.7 803 392 B E H X S+ 0 0 84 -4,-1.8 4,-3.1 1,-0.2 5,-0.2 0.891 105.0 56.7 -57.0 -44.6 66.2 22.8 103.0 804 393 B R H X S+ 0 0 55 -4,-1.8 4,-0.6 1,-0.2 5,-0.3 0.896 111.7 44.4 -55.6 -41.0 68.8 25.6 102.8 805 394 B V H >X S+ 0 0 0 -4,-1.5 4,-2.6 -3,-0.3 3,-0.9 0.943 112.2 51.1 -67.9 -49.4 66.4 27.5 105.1 806 395 B R H 3< S+ 0 0 60 -4,-2.7 4,-0.2 1,-0.3 -2,-0.2 0.864 118.7 38.0 -56.3 -39.5 65.8 24.6 107.4 807 396 B K H 3< S+ 0 0 137 -4,-3.1 -1,-0.3 -5,-0.2 -2,-0.2 0.477 134.1 18.8 -94.1 0.1 69.6 24.0 107.8 808 397 B N H << S+ 0 0 54 -3,-0.9 -3,-0.2 -4,-0.6 -2,-0.2 0.652 123.6 33.6-137.7 -33.3 70.7 27.6 107.8 809 398 B F S < S+ 0 0 2 -4,-2.6 -195,-2.0 -5,-0.3 2,-0.2 -0.049 76.1 120.4-127.8 35.1 68.0 30.3 108.7 810 399 B I B > S-t 614 0F 0 -5,-0.3 4,-2.1 -4,-0.2 3,-0.5 -0.620 72.2-115.5 -93.5 156.2 65.6 28.8 111.2 811 400 B I H > S+ 0 0 0 -197,-1.1 4,-1.8 1,-0.2 -196,-0.1 0.800 117.2 56.5 -62.8 -26.7 65.1 30.4 114.6 812 401 B T H > S+ 0 0 4 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.844 108.9 44.4 -72.1 -34.0 66.5 27.2 116.2 813 402 B K H > S+ 0 0 39 -3,-0.5 4,-1.9 2,-0.2 -2,-0.2 0.829 109.4 58.1 -75.1 -34.5 69.7 27.5 114.1 814 403 B H H X S+ 0 0 7 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.897 109.9 44.0 -60.5 -41.3 69.7 31.2 115.0 815 404 B M H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 3,-0.5 0.924 107.5 57.6 -69.5 -46.1 69.7 30.1 118.7 816 405 B E H X S+ 0 0 2 -4,-2.2 4,-2.4 1,-0.3 -2,-0.2 0.850 104.1 55.4 -53.5 -32.9 72.4 27.4 118.0 817 406 B R H X S+ 0 0 50 -4,-1.9 4,-1.5 1,-0.2 -1,-0.3 0.900 102.9 53.7 -67.4 -40.2 74.5 30.3 116.7 818 407 B Y H X S+ 0 0 2 -4,-1.2 4,-2.0 -3,-0.5 -1,-0.2 0.858 108.6 50.9 -61.9 -34.1 74.1 32.2 120.0 819 408 B L H >X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 3,-0.5 0.989 105.9 53.3 -65.1 -57.4 75.3 29.1 121.8 820 409 B D H 3< S+ 0 0 72 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.778 111.9 48.9 -46.5 -30.8 78.4 28.8 119.6 821 410 B I H 3< S+ 0 0 19 -4,-1.5 4,-0.4 2,-0.2 -1,-0.3 0.871 110.6 46.0 -80.4 -40.2 79.1 32.4 120.5 822 411 B L H X< S+ 0 0 2 -4,-2.0 3,-1.0 -3,-0.5 -2,-0.2 0.849 113.0 49.9 -72.3 -33.3 78.7 32.2 124.3 823 412 B N T 3< S+ 0 0 60 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.666 102.2 67.8 -74.4 -15.7 80.8 29.0 124.3 824 413 B S T 3 0 0 70 -5,-0.4 -1,-0.2 -4,-0.1 -2,-0.2 0.683 360.0 360.0 -74.8 -21.1 83.2 31.2 122.2 825 414 B L < 0 0 73 -3,-1.0 -3,-0.0 -4,-0.4 0, 0.0 -0.497 360.0 360.0 -96.5 360.0 83.8 33.3 125.3