==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 18-MAR-10 3M8N . COMPND 2 MOLECULE: POSSIBLE GLUTATHIONE S-TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOPSEUDOMONAS PALUSTRIS; . AUTHOR L.DAMODHARAN,S.K.BURLEY,S.SWAMINATHAN,NEW YORK SGX RESEARCH . 802 7 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32662.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 555 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 5.2 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 . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.6 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 . 39 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 100 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 319 39.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 28 3.5 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 4 0 1 0 0 6 3 5 2 2 0 1 0 4 2 1 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 3 0 6 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 4 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 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 0 A S 0 0 114 0, 0.0 27,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -82.7 -21.9 60.6 68.4 2 1 A L + 0 0 116 25,-1.6 2,-0.3 1,-0.2 26,-0.2 0.838 360.0 12.4 -79.0 -36.6 -20.3 63.9 69.4 3 2 A Y E -a 28 0A 45 24,-0.9 26,-2.5 2,-0.0 2,-0.5 -0.941 61.0-136.0-141.6 159.1 -18.0 62.2 71.9 4 3 A K E -aB 29 58A 45 54,-1.0 54,-2.2 -2,-0.3 2,-0.5 -0.986 22.6-164.0-112.3 123.3 -16.6 59.0 73.1 5 4 A L E -aB 30 57A 0 24,-2.3 26,-3.1 -2,-0.5 2,-0.6 -0.944 12.2-153.6-109.5 123.0 -16.4 58.5 76.8 6 5 A Y E +aB 31 56A 14 50,-2.5 50,-1.5 -2,-0.5 2,-0.3 -0.821 38.2 170.0 -89.0 123.2 -14.2 55.8 78.4 7 6 A S E -a 32 0A 2 24,-2.6 26,-2.1 -2,-0.6 2,-0.5 -0.972 41.1-140.4-144.0 141.3 -16.1 55.2 81.6 8 7 A X > - 0 0 6 -2,-0.3 3,-0.9 24,-0.2 6,-0.2 -0.951 20.9-144.0-104.7 130.8 -16.3 53.0 84.6 9 8 A Q T 3 S+ 0 0 34 -2,-0.5 -1,-0.1 1,-0.3 193,-0.1 0.905 97.6 35.5 -60.4 -44.3 -19.9 52.3 85.7 10 9 A R T 3 S+ 0 0 146 -3,-0.1 2,-0.4 4,-0.1 -1,-0.3 0.379 92.0 110.0 -99.1 5.3 -19.4 52.3 89.4 11 10 A S <> - 0 0 4 -3,-0.9 4,-2.3 1,-0.1 5,-0.1 -0.676 61.2-147.8 -78.8 130.9 -16.7 54.9 89.5 12 11 A G H > S+ 0 0 0 -2,-0.4 4,-1.7 1,-0.2 -1,-0.1 0.864 97.8 51.7 -68.5 -36.8 -17.8 58.3 91.1 13 12 A N H > S+ 0 0 17 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.879 111.6 46.7 -62.7 -38.8 -15.5 60.3 88.8 14 13 A S H > S+ 0 0 0 1,-0.2 4,-2.2 -6,-0.2 3,-0.3 0.857 107.8 56.3 -71.6 -41.2 -16.9 58.7 85.7 15 14 A Y H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.859 99.2 61.3 -61.7 -37.0 -20.4 59.1 86.9 16 15 A K H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.922 107.6 44.5 -47.1 -48.7 -19.9 62.9 87.3 17 16 A V H X S+ 0 0 0 -4,-1.0 4,-2.4 -3,-0.3 -2,-0.2 0.905 112.3 50.7 -71.5 -43.6 -19.2 63.1 83.6 18 17 A R H X S+ 0 0 1 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.875 109.7 52.1 -56.3 -37.7 -22.1 60.8 82.6 19 18 A L H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.949 109.6 48.3 -66.4 -49.0 -24.4 63.0 84.8 20 19 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.920 111.3 50.8 -54.6 -47.3 -23.3 66.2 83.0 21 20 A L H <>S+ 0 0 1 -4,-2.4 5,-2.9 2,-0.2 4,-0.2 0.856 111.8 47.2 -60.7 -38.2 -23.8 64.5 79.7 22 21 A A H ><5S+ 0 0 26 -4,-2.0 3,-1.1 3,-0.2 -2,-0.2 0.932 113.3 48.5 -66.0 -45.8 -27.4 63.4 80.7 23 22 A L H 3<5S+ 0 0 33 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.842 114.1 45.3 -67.0 -33.6 -28.2 66.9 82.0 24 23 A L T 3<5S- 0 0 40 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.471 106.2-130.2 -80.1 -6.8 -26.8 68.5 78.8 25 24 A D T < 5 + 0 0 143 -3,-1.1 -3,-0.2 -4,-0.2 -2,-0.1 0.883 48.0 169.8 52.2 43.7 -28.7 66.0 76.8 26 25 A A < - 0 0 17 -5,-2.9 2,-0.3 -6,-0.2 -1,-0.2 -0.708 32.9-128.3 -93.9 130.1 -25.5 65.4 75.0 27 26 A P + 0 0 66 0, 0.0 -25,-1.6 0, 0.0 -24,-0.9 -0.557 44.0 147.8 -74.7 130.8 -25.1 62.5 72.6 28 27 A Y E -a 3 0A 38 -2,-0.3 2,-0.4 -27,-0.2 -24,-0.2 -0.975 43.2-118.5-158.6 167.1 -22.1 60.3 73.1 29 28 A R E -a 4 0A 141 -26,-2.5 -24,-2.3 -2,-0.3 2,-0.3 -0.961 26.9-142.5-120.6 128.1 -20.8 56.8 72.9 30 29 A A E -a 5 0A 40 -2,-0.4 2,-0.5 -26,-0.2 -24,-0.2 -0.697 10.8-167.8 -97.6 136.3 -19.6 54.9 76.0 31 30 A V E -a 6 0A 40 -26,-3.1 -24,-2.6 -2,-0.3 2,-0.3 -0.997 23.7-134.5-116.8 120.2 -16.7 52.6 76.2 32 31 A E E -a 7 0A 98 -2,-0.5 2,-0.4 -26,-0.2 -24,-0.2 -0.580 23.6-178.2 -79.3 132.0 -16.6 50.6 79.5 33 32 A V - 0 0 8 -26,-2.1 2,-1.0 -2,-0.3 7,-0.1 -0.961 15.7-150.0-132.6 112.3 -13.2 50.3 81.2 34 33 A D > > - 0 0 38 -2,-0.4 3,-2.2 1,-0.2 5,-1.6 -0.698 8.9-171.4 -92.8 98.6 -13.0 48.3 84.5 35 34 A I G > 5S+ 0 0 8 -2,-1.0 3,-1.7 1,-0.3 -1,-0.2 0.813 85.2 60.1 -46.9 -40.8 -10.3 49.7 86.8 36 35 A L G 3 5S+ 0 0 41 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.653 103.7 49.3 -73.4 -17.9 -10.6 46.7 89.1 37 36 A R G < 5S- 0 0 122 -3,-2.2 -1,-0.3 608,-0.1 -2,-0.2 0.111 118.2-109.4-104.7 21.6 -9.7 44.3 86.4 38 37 A G T X 5S+ 0 0 11 -3,-1.7 3,-1.9 1,-0.1 -3,-0.2 0.623 73.4 141.0 69.4 18.3 -6.6 46.4 85.3 39 38 A E T 3 < + 0 0 77 -5,-1.6 3,-0.5 1,-0.3 6,-0.2 0.638 63.3 57.1 -76.7 -19.2 -8.2 47.4 82.1 40 39 A S T 3 S+ 0 0 1 -6,-0.2 -1,-0.3 1,-0.2 9,-0.1 0.450 100.6 62.5 -81.4 1.3 -6.9 50.9 82.2 41 40 A R S < S+ 0 0 51 -3,-1.9 -1,-0.2 4,-0.1 -2,-0.2 0.331 74.0 113.5-112.5 7.9 -3.3 49.6 82.3 42 41 A T S > S- 0 0 54 -3,-0.5 4,-3.0 -4,-0.1 5,-0.3 -0.400 79.7-111.0 -75.3 151.8 -3.1 47.7 79.1 43 42 A P H > S+ 0 0 98 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.957 117.9 54.4 -39.3 -60.7 -0.8 48.9 76.3 44 43 A D H 4 S+ 0 0 121 1,-0.2 4,-0.4 2,-0.2 -4,-0.1 0.837 114.2 39.0 -49.3 -44.8 -3.9 49.8 74.2 45 44 A F H >> S+ 0 0 9 2,-0.2 4,-2.3 -6,-0.2 3,-1.6 0.885 110.0 57.9 -72.8 -42.5 -5.4 52.1 76.9 46 45 A L H 3< S+ 0 0 31 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.833 95.7 68.1 -63.2 -24.4 -2.1 53.6 78.1 47 46 A A T 3< S+ 0 0 86 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.873 107.5 35.9 -57.8 -37.6 -1.6 54.7 74.6 48 47 A K T <4 S+ 0 0 58 -3,-1.6 16,-0.2 -4,-0.4 -2,-0.2 0.833 137.4 17.9 -89.5 -40.0 -4.6 57.2 75.0 49 48 A N >< - 0 0 10 -4,-2.3 3,-1.7 -9,-0.1 -1,-0.3 -0.896 66.8-162.4-131.1 114.6 -3.9 58.1 78.6 50 49 A P T 3 S+ 0 0 79 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.666 90.2 56.9 -67.3 -21.0 -0.4 57.3 79.8 51 50 A S T 3 S- 0 0 8 745,-0.1 747,-0.6 747,-0.1 -5,-0.1 0.210 110.4-116.0 -90.2 4.8 -1.6 57.5 83.5 52 51 A G < + 0 0 0 -3,-1.7 2,-0.3 1,-0.2 -12,-0.1 0.688 54.6 169.8 70.8 20.3 -4.3 54.9 83.3 53 52 A Q - 0 0 20 -7,-0.1 -1,-0.2 747,-0.0 746,-0.2 -0.488 21.0-145.6 -79.6 128.8 -7.0 57.5 84.0 54 53 A V S S+ 0 0 11 745,-0.6 2,-0.1 -2,-0.3 -40,-0.1 -0.995 76.6 53.5-122.1 132.3 -10.8 56.8 83.6 55 54 A P S S+ 0 0 3 0, 0.0 12,-0.6 0, 0.0 2,-0.4 0.472 72.2 171.4 -77.7 158.6 -12.9 58.8 82.6 56 55 A L E -BC 6 66A 0 -50,-1.5 -50,-2.5 10,-0.2 2,-0.6 -0.993 19.8-153.2-135.8 131.4 -11.4 59.9 79.4 57 56 A L E -BC 5 65A 0 8,-2.7 8,-2.8 -2,-0.4 2,-0.7 -0.923 7.2-148.6-108.3 112.2 -13.1 62.1 76.8 58 57 A E E +BC 4 64A 24 -54,-2.2 -54,-1.0 -2,-0.6 6,-0.2 -0.696 24.5 166.3 -72.8 114.2 -12.0 61.8 73.2 59 58 A T + 0 0 43 4,-2.3 -1,-0.2 -2,-0.7 5,-0.1 0.827 66.7 14.9 -77.3 -95.8 -12.4 65.1 71.5 60 59 A A S > S- 0 0 37 1,-0.1 3,-1.6 3,-0.1 2,-0.3 -0.215 111.4 -73.4 -61.7 165.6 -10.6 65.0 68.1 61 60 A P T 3 S+ 0 0 129 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.603 125.1 7.5 -70.3 131.9 -9.6 61.5 66.9 62 61 A G T 3 S+ 0 0 59 -2,-0.3 2,-0.4 1,-0.1 -2,-0.0 0.726 104.3 113.6 62.1 26.4 -6.6 60.6 69.1 63 62 A R < - 0 0 75 -3,-1.6 -4,-2.3 2,-0.0 2,-0.4 -0.962 45.1-173.6-127.1 118.0 -7.1 63.5 71.4 64 63 A Y E -C 58 0A 52 -2,-0.4 2,-0.5 -6,-0.2 -6,-0.2 -0.888 16.2-155.6-116.7 130.1 -8.1 62.7 75.0 65 64 A L E -C 57 0A 10 -8,-2.8 -8,-2.7 -2,-0.4 2,-0.2 -0.892 18.9-168.2-103.8 131.4 -9.1 64.9 77.9 66 65 A A E +C 56 0A 0 -2,-0.5 -10,-0.2 -10,-0.2 4,-0.1 -0.644 44.9 66.7-109.7 173.3 -8.6 63.4 81.4 67 66 A E >> - 0 0 10 -12,-0.6 4,-2.5 -2,-0.2 3,-1.0 0.847 69.2-126.0 77.9 106.2 -9.7 64.4 84.8 68 67 A S H 3> S+ 0 0 3 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.793 109.4 51.0 -50.4 -34.0 -13.5 64.3 85.5 69 68 A N H 3> S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.803 110.7 47.0 -82.5 -28.3 -13.5 67.9 86.6 70 69 A A H <> S+ 0 0 0 -3,-1.0 4,-2.1 2,-0.2 -2,-0.2 0.823 111.4 52.8 -70.3 -39.6 -11.7 69.2 83.5 71 70 A I H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.942 107.8 52.3 -57.3 -46.0 -14.0 67.1 81.4 72 71 A L H X S+ 0 0 0 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.918 109.6 47.8 -60.6 -48.6 -17.0 68.8 83.2 73 72 A W H X S+ 0 0 28 -4,-1.6 4,-0.9 1,-0.2 -1,-0.2 0.895 111.2 51.3 -56.4 -46.0 -15.7 72.2 82.4 74 73 A Y H < S+ 0 0 29 -4,-2.1 3,-0.4 1,-0.2 -1,-0.2 0.865 111.0 47.0 -57.8 -44.1 -15.1 71.4 78.8 75 74 A L H < S+ 0 0 1 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.798 112.4 51.4 -72.7 -24.8 -18.5 70.0 78.3 76 75 A A H >< S+ 0 0 2 -4,-1.4 3,-1.8 -3,-0.2 6,-0.3 0.524 71.9 117.2 -96.1 -10.7 -20.2 73.0 80.0 77 76 A V T 3< S+ 0 0 36 -4,-0.9 3,-0.1 -3,-0.4 4,-0.1 -0.360 90.6 11.0 -59.7 136.5 -18.7 76.0 78.3 78 77 A G T 3 S+ 0 0 81 1,-0.2 -1,-0.3 5,-0.2 2,-0.2 0.691 110.8 106.7 71.7 15.8 -21.5 77.8 76.5 79 78 A T S X S- 0 0 41 -3,-1.8 3,-1.4 4,-0.1 -1,-0.2 -0.664 88.3 -99.5-121.4 171.4 -24.2 75.8 78.3 80 79 A S T 3 S+ 0 0 100 1,-0.2 -4,-0.1 -2,-0.2 -2,-0.1 0.693 118.7 66.2 -69.1 -17.3 -26.7 76.4 81.0 81 80 A L T 3 S+ 0 0 9 -5,-0.1 78,-1.4 77,-0.1 -1,-0.2 0.449 89.8 77.2 -77.1 -5.3 -24.4 74.7 83.4 82 81 A A S < S- 0 0 23 -3,-1.4 7,-0.1 -6,-0.3 75,-0.0 -0.928 80.5-134.9-102.0 126.8 -21.8 77.4 83.0 83 82 A P - 0 0 6 0, 0.0 -5,-0.2 0, 0.0 -4,-0.1 -0.173 13.4-124.5 -74.9-177.7 -22.4 80.8 84.8 84 83 A D S S+ 0 0 131 70,-0.1 2,-0.1 4,-0.0 -2,-0.0 0.886 76.3 68.0 -98.9 -46.3 -22.0 84.2 83.2 85 84 A T S > S- 0 0 71 1,-0.1 4,-2.1 69,-0.0 5,-0.2 -0.388 79.3-120.2 -82.8 156.5 -19.7 86.4 85.0 86 85 A R H > S+ 0 0 89 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.880 114.9 49.8 -55.6 -40.9 -16.0 85.9 85.4 87 86 A X H > S+ 0 0 13 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.893 109.2 50.0 -70.1 -39.9 -16.4 85.7 89.2 88 87 A D H > S+ 0 0 33 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.874 109.6 50.9 -66.5 -42.4 -19.2 83.2 89.1 89 88 A R H X S+ 0 0 119 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.883 109.2 51.7 -54.2 -42.7 -17.3 80.9 86.8 90 89 A A H X S+ 0 0 1 -4,-1.5 4,-2.6 1,-0.2 -2,-0.2 0.874 107.7 53.0 -70.4 -34.2 -14.2 81.1 89.2 91 90 A E H X S+ 0 0 32 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.869 105.2 53.5 -66.6 -37.7 -16.5 80.2 92.1 92 91 A A H X S+ 0 0 4 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.904 113.0 44.2 -57.7 -44.5 -17.7 77.1 90.3 93 92 A L H X S+ 0 0 3 -4,-1.7 4,-2.8 2,-0.2 5,-0.2 0.860 107.8 59.5 -68.1 -39.8 -14.0 76.2 89.8 94 93 A Q H X S+ 0 0 24 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.957 108.4 44.1 -50.1 -53.5 -13.3 77.0 93.4 95 94 A W H X S+ 0 0 15 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.834 113.3 51.2 -66.5 -34.3 -15.8 74.5 94.5 96 95 A X H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.849 109.9 49.0 -67.9 -36.1 -14.5 71.9 92.0 97 96 A F H X S+ 0 0 0 -4,-2.8 4,-1.6 2,-0.2 5,-0.2 0.900 110.7 52.7 -65.3 -37.7 -11.0 72.4 93.2 98 97 A F H X>S+ 0 0 11 -4,-2.5 4,-2.2 -5,-0.2 5,-0.6 0.910 107.0 51.1 -60.6 -45.3 -12.4 72.0 96.7 99 98 A E H X>S+ 0 0 0 -4,-2.3 5,-2.0 1,-0.2 4,-1.3 0.904 107.1 56.5 -59.0 -39.8 -14.0 68.7 95.6 100 99 A Q H <5S+ 0 0 2 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.875 119.6 25.5 -61.9 -43.8 -10.6 67.6 94.3 101 100 A H H <5S+ 0 0 56 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.717 132.6 34.7 -93.7 -20.8 -8.5 68.0 97.5 102 101 A A H <5S+ 0 0 12 -4,-2.2 5,-0.3 -5,-0.2 -3,-0.2 0.808 126.1 25.7-104.3 -36.8 -11.3 67.6 100.2 103 102 A L T >XXS+ 0 0 0 -4,-1.3 5,-2.7 -5,-0.6 4,-1.5 0.910 116.8 51.6 -92.6 -53.7 -13.9 65.0 98.8 104 103 A E T 34XS+ 0 0 7 -5,-2.0 5,-0.9 1,-0.2 699,-0.2 0.934 111.8 47.0 -48.7 -56.2 -12.1 62.8 96.4 105 104 A P T 345S+ 0 0 10 0, 0.0 698,-0.3 0, 0.0 -1,-0.2 0.623 129.5 20.3 -67.7 -12.0 -9.2 61.9 98.8 106 105 A N T <>5S+ 0 0 19 -3,-0.9 4,-2.1 -4,-0.1 -2,-0.2 0.727 134.0 29.2-122.3 -62.1 -11.5 61.2 101.7 107 106 A I H X5S+ 0 0 0 -4,-1.5 4,-2.6 -5,-0.3 -3,-0.2 0.888 124.7 50.7 -72.3 -35.3 -15.0 60.4 100.7 108 107 A G H >S+ 0 0 2 -4,-2.1 4,-2.9 1,-0.2 5,-0.5 0.955 112.8 44.8 -49.9 -53.8 -13.8 55.6 101.6 111 110 A Y H X>S+ 0 0 8 -4,-2.6 4,-1.4 3,-0.2 5,-1.3 0.894 115.4 47.0 -56.2 -45.9 -16.2 54.8 98.7 112 111 A F H X>S+ 0 0 0 -4,-2.3 5,-2.2 3,-0.2 4,-1.0 0.969 122.8 31.8 -65.9 -50.3 -13.6 53.1 96.7 113 112 A W H <5S+ 0 0 8 -4,-3.1 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-67.7 -45.2 4.2 88.9 89.0 228 22 B L H <5S+ 0 0 30 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.846 116.3 44.4 -62.2 -31.2 4.2 87.3 85.6 229 23 B L H <5S- 0 0 40 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.624 104.1-132.7 -83.0 -14.5 1.0 89.3 84.9 230 24 B D T <5 + 0 0 147 -4,-0.9 -3,-0.2 -3,-0.3 -4,-0.1 0.938 47.8 164.3 58.3 42.6 2.5 92.5 86.3 231 25 B A < - 0 0 26 -5,-2.7 -1,-0.2 -6,-0.1 2,-0.2 -0.852 34.8-132.3 -97.0 125.1 -0.8 92.9 88.1 232 26 B P + 0 0 92 0, 0.0 -25,-0.3 0, 0.0 2,-0.3 -0.495 37.5 160.2 -70.4 139.8 -0.7 95.4 91.0 233 27 B Y - 0 0 52 -2,-0.2 2,-0.5 -27,-0.1 -24,-0.2 -0.979 42.4-115.6-154.1 162.3 -2.2 94.2 94.3 234 28 B R E -e 209 0C 134 -26,-2.8 -24,-2.5 -2,-0.3 2,-0.4 -0.864 35.7-147.9 -97.6 125.3 -2.3 94.9 98.0 235 29 B A E -e 210 0C 60 -2,-0.5 2,-0.5 -26,-0.2 -24,-0.2 -0.771 11.5-164.8-103.4 140.4 -0.8 91.9 99.9 236 30 B V E -e 211 0C 35 -26,-2.7 -24,-2.8 -2,-0.4 2,-0.2 -0.960 16.0-141.3-127.4 111.2 -1.9 90.9 103.3 237 31 B E E -e 212 0C 96 -2,-0.5 2,-0.5 -26,-0.2 -24,-0.2 -0.531 15.0-160.9 -74.1 134.3 0.4 88.5 105.2 238 32 B V - 0 0 4 -26,-2.1 2,-1.2 -2,-0.2 7,-0.1 -0.970 8.5-144.9-125.0 115.2 -1.5 85.8 107.2 239 33 B D > + 0 0 64 -2,-0.5 5,-2.3 -26,-0.1 2,-0.2 -0.730 28.0 163.8 -88.9 91.2 0.3 84.0 109.9 240 34 B I B 5 +H 243 0D 38 -2,-1.2 3,-0.2 4,-0.2 -2,-0.0 -0.579 65.8 64.7 -83.5 169.4 -0.8 80.5 110.2 241 35 B L T 5S+ 0 0 155 1,-0.9 2,-0.3 -2,-0.2 -1,-0.2 0.609 121.3 42.5 66.6 16.5 1.6 78.3 112.2 242 36 B R T 5S- 0 0 161 -3,-0.2 -1,-0.9 0, 0.0 3,-0.3 -0.732 120.3 -78.5-157.9-153.7 0.2 80.9 114.5 243 37 B G B > 5S+H 240 0D 24 -2,-0.3 3,-2.1 -3,-0.2 4,-0.5 0.477 85.4 106.0-101.7 -7.2 -3.5 82.0 114.7 244 38 B E T 3 S- 0 0 53 -4,-0.5 4,-3.2 -3,-0.1 5,-0.2 -0.209 76.0-122.2 -72.1 154.8 -9.9 84.1 113.6 248 42 B P H > S+ 0 0 110 0, 0.0 4,-1.2 0, 0.0 -1,-0.1 0.856 113.9 55.3 -60.5 -35.0 -13.5 84.9 113.3 249 43 B D H 4 S+ 0 0 113 2,-0.2 4,-0.4 1,-0.2 -4,-0.0 0.868 111.4 42.6 -67.4 -40.9 -12.8 87.8 111.1 250 44 B F H >> S+ 0 0 7 2,-0.2 4,-2.4 1,-0.2 3,-1.8 0.915 112.8 53.0 -68.9 -47.0 -10.8 85.7 108.7 251 45 B L H 3< S+ 0 0 70 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.712 99.8 64.6 -58.3 -21.0 -13.5 82.9 108.9 252 46 B A T 3< S+ 0 0 78 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.766 110.8 36.3 -69.0 -26.9 -15.9 85.7 108.0 253 47 B K T <4 S+ 0 0 42 -3,-1.8 -2,-0.2 -4,-0.4 16,-0.2 0.840 137.8 13.9 -93.7 -43.5 -14.1 86.0 104.6 254 48 B N >< - 0 0 11 -4,-2.4 3,-2.4 1,-0.1 -1,-0.3 -0.868 63.0-161.5-139.4 103.0 -13.3 82.3 104.1 255 49 B P T 3 S+ 0 0 66 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.628 93.3 59.7 -45.5 -28.2 -15.2 79.7 106.3 256 50 B S T 3 S- 0 0 36 2,-0.1 -5,-0.1 -115,-0.0 -115,-0.0 0.458 105.2-132.0 -85.7 -7.3 -12.6 77.1 105.5 257 51 B G < + 0 0 9 -3,-2.4 2,-0.3 1,-0.2 -6,-0.1 0.874 52.5 150.8 54.9 44.5 -10.0 79.3 107.0 258 52 B Q - 0 0 118 -8,-0.1 -1,-0.2 -4,-0.1 -2,-0.1 -0.837 36.6-119.0-116.0 152.2 -7.6 78.9 104.0 259 53 B V S S+ 0 0 12 -2,-0.3 -40,-0.2 12,-0.1 -47,-0.1 -0.938 79.8 58.1-120.9 136.2 -5.0 81.1 102.4 260 54 B P + 0 0 5 0, 0.0 12,-0.5 0, 0.0 2,-0.4 0.433 65.5 169.0 -88.2 164.1 -4.6 82.3 99.7 261 55 B L E -FG 211 271C 2 -50,-1.8 -50,-3.4 10,-0.1 2,-0.5 -0.992 21.6-150.6-142.8 130.3 -7.6 84.3 99.4 262 56 B L E -FG 210 270C 0 8,-3.0 8,-2.9 -2,-0.4 2,-0.9 -0.896 7.8-148.0-107.0 118.9 -8.3 86.9 96.7 263 57 B E E +FG 209 269C 31 -54,-3.3 -54,-1.1 -2,-0.5 6,-0.2 -0.783 28.0 167.9 -85.1 109.9 -10.5 89.8 97.5 264 58 B T E + 0 0 9 4,-1.9 -56,-0.2 -2,-0.9 -1,-0.2 0.739 61.7 14.8 -98.9 -35.0 -12.1 90.4 94.0 265 59 B A E > S- G 0 268C 31 3,-1.6 3,-2.3 -58,-0.1 2,-0.4 -0.864 109.9 -61.8-130.5 167.7 -14.9 92.8 94.8 266 60 B P T 3 S- 0 0 119 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.383 125.8 -14.1 -51.4 112.3 -15.6 94.9 97.8 267 61 B G T 3 S+ 0 0 49 -2,-0.4 2,-0.4 1,-0.2 -4,-0.0 0.653 111.0 120.6 61.6 18.3 -16.1 92.2 100.5 268 62 B R E < -G 265 0C 86 -3,-2.3 -4,-1.9 2,-0.0 -3,-1.6 -0.962 45.6-165.1-112.1 125.8 -16.3 89.5 97.8 269 63 B Y E -G 263 0C 49 -2,-0.4 2,-0.5 -6,-0.2 -6,-0.2 -0.875 17.9-156.4-121.3 144.4 -13.6 86.7 98.1 270 64 B L E -G 262 0C 0 -8,-2.9 -8,-3.0 -2,-0.4 2,-0.2 -0.960 16.9-173.3-116.6 129.4 -12.2 83.9 96.0 271 65 B A E +G 261 0C 6 -2,-0.5 -10,-0.1 -10,-0.2 4,-0.1 -0.602 45.0 67.3-111.2 175.0 -10.5 80.9 97.5 272 66 B E S > S- 0 0 32 -12,-0.5 4,-2.6 -2,-0.2 3,-0.5 0.762 70.3-126.4 77.5 113.0 -8.5 77.9 96.1 273 67 B S H > S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.862 108.0 51.6 -59.5 -32.7 -5.2 78.9 94.5 274 68 B N H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.852 111.4 47.6 -73.1 -33.3 -6.0 77.2 91.2 275 69 B A H > S+ 0 0 0 -3,-0.5 4,-2.5 2,-0.2 -2,-0.2 0.865 110.7 50.9 -73.0 -40.0 -9.3 78.9 91.0 276 70 B I H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.885 110.0 51.6 -61.5 -40.1 -7.6 82.2 91.8 277 71 B L H X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.918 110.3 48.3 -62.6 -44.1 -5.0 81.5 89.0 278 72 B W H X S+ 0 0 19 -4,-1.9 4,-1.1 1,-0.2 3,-0.2 0.942 111.8 50.0 -61.7 -48.6 -7.8 80.8 86.6 279 73 B Y H < S+ 0 0 26 -4,-2.5 3,-0.4 1,-0.2 -1,-0.2 0.893 113.2 44.5 -53.4 -46.9 -9.6 84.0 87.6 280 74 B L H < S+ 0 0 7 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.770 113.0 52.0 -73.5 -25.7 -6.5 86.2 87.2 281 75 B A H >< S+ 0 0 1 -4,-1.8 3,-2.0 -3,-0.2 6,-0.4 0.624 75.0 122.2 -91.1 -10.5 -5.5 84.6 83.9 282 76 B V T 3< S+ 0 0 52 -4,-1.1 3,-0.1 -3,-0.4 4,-0.0 -0.277 87.9 6.0 -59.9 126.3 -8.8 85.0 82.0 283 77 B G T 3 S+ 0 0 83 1,-0.2 -1,-0.3 5,-0.2 2,-0.2 0.700 113.4 103.1 71.1 22.3 -8.1 87.0 78.9 284 78 B T S X S- 0 0 46 -3,-2.0 3,-1.6 4,-0.1 -1,-0.2 -0.742 89.4 -92.8-124.0 176.3 -4.3 87.2 79.4 285 79 B S T 3 S+ 0 0 95 1,-0.3 4,-0.1 -2,-0.2 -4,-0.1 0.636 118.9 64.9 -62.7 -18.1 -1.2 85.5 78.0 286 80 B L T 3 S+ 0 0 8 -5,-0.2 58,-2.0 -6,-0.1 -1,-0.3 0.471 92.7 69.1 -90.5 0.8 -1.4 82.9 80.7 287 81 B A S < S- 0 0 17 -3,-1.6 7,-0.1 -6,-0.4 55,-0.1 -0.973 86.1-127.8-112.2 128.9 -4.7 81.5 79.5 288 82 B P - 0 0 5 0, 0.0 -5,-0.2 0, 0.0 6,-0.1 -0.181 18.3-114.8 -71.2 172.2 -4.6 79.6 76.2 289 83 B D S S+ 0 0 134 50,-0.1 2,-0.2 -4,-0.1 -6,-0.0 0.888 80.7 57.9 -83.1 -41.4 -6.8 80.4 73.3 290 84 B T S > S- 0 0 61 1,-0.1 4,-2.5 49,-0.1 5,-0.2 -0.506 78.1-117.5-100.0 164.0 -9.1 77.5 72.5 291 85 B R H > S+ 0 0 87 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.901 116.3 49.7 -56.3 -44.0 -11.7 75.7 74.5 292 86 B X H > S+ 0 0 58 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.906 110.9 48.2 -66.0 -41.5 -9.7 72.4 74.2 293 87 B D H > S+ 0 0 35 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.885 111.4 51.4 -65.8 -40.7 -6.4 74.0 75.3 294 88 B R H X S+ 0 0 71 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.932 109.6 48.5 -59.9 -46.3 -8.0 75.7 78.2 295 89 B A H X S+ 0 0 1 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.847 107.3 57.6 -57.4 -37.2 -9.5 72.4 79.3 296 90 B E H X S+ 0 0 42 -4,-1.6 4,-1.4 2,-0.2 -1,-0.2 0.890 106.3 49.1 -65.8 -37.3 -6.0 70.8 78.9 297 91 B A H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 3,-0.3 0.947 110.4 49.9 -66.5 -45.1 -4.7 73.4 81.4 298 92 B L H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.877 104.0 61.3 -58.2 -39.5 -7.5 72.6 83.8 299 93 B Q H X S+ 0 0 17 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.919 107.6 41.7 -52.8 -48.6 -6.7 68.9 83.4 300 94 B W H X S+ 0 0 14 -4,-1.4 4,-2.0 -3,-0.3 -1,-0.2 0.804 112.9 55.2 -73.1 -29.9 -3.2 69.4 84.7 301 95 B X H X S+ 0 0 0 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.903 108.9 46.4 -65.8 -43.4 -4.4 71.8 87.5 302 96 B F H X S+ 0 0 0 -4,-2.8 4,-1.5 2,-0.2 5,-0.2 0.907 111.6 52.6 -63.5 -42.6 -6.9 69.2 88.7 303 97 B F H X S+ 0 0 3 -4,-1.9 4,-2.8 -5,-0.2 5,-0.4 0.896 107.6 51.7 -50.9 -48.5 -4.1 66.6 88.6 304 98 B E H X>S+ 0 0 0 -4,-2.0 5,-2.2 1,-0.2 4,-1.7 0.866 106.2 57.2 -60.6 -33.8 -1.9 68.9 90.7 305 99 B Q H <5S+ 0 0 2 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.839 120.4 24.4 -76.1 -33.9 -4.7 69.1 93.2 306 100 B H H <5S+ 0 0 7 -4,-1.5 -2,-0.2 -3,-0.2 -1,-0.2 0.710 129.4 42.7 -95.9 -22.5 -5.0 65.4 93.9 307 101 B A H <5S+ 0 0 2 -4,-2.8 16,-0.2 -5,-0.2 -3,-0.2 0.779 128.7 16.8 -94.2 -34.7 -1.5 64.3 92.9 308 102 B L T <5S+ 0 0 11 -4,-1.7 -3,-0.2 -5,-0.4 -4,-0.1 0.777 98.1 90.6-110.8 -41.6 0.8 66.9 94.5 309 103 B E < 0 0 31 -5,-2.2 0, 0.0 1,-0.1 0, 0.0 -0.478 360.0 360.0 -59.8 124.3 -1.2 68.9 97.0 310 104 B P 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.014 360.0 360.0 -56.1 360.0 -0.7 67.0 100.4 311 ! 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 0.0 312 126 B A > 0 0 82 0, 0.0 4,-0.9 0, 0.0 492,-0.1 0.000 360.0 360.0 360.0 -21.6 -0.7 58.8 105.3 313 127 B L H > + 0 0 74 2,-0.2 4,-2.2 3,-0.1 5,-0.2 0.850 360.0 52.8 -73.8 -40.2 2.5 60.7 104.9 314 128 B E H >> S+ 0 0 67 2,-0.2 4,-3.0 1,-0.2 3,-0.7 0.991 105.0 52.9 -56.5 -61.6 3.9 57.8 102.8 315 129 B D H 3> S+ 0 0 4 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.813 112.2 47.0 -42.0 -43.2 1.0 57.7 100.4 316 130 B W H 3X S+ 0 0 105 -4,-0.9 4,-1.8 2,-0.2 -1,-0.2 0.865 115.5 43.7 -67.9 -38.9 1.6 61.5 99.8 317 131 B L H < S+ 0 0 36 -4,-1.5 3,-1.3 1,-0.2 4,-0.4 0.894 109.3 54.5 -73.8 -40.7 4.9 64.3 79.6 331 145 B L H 3< S+ 0 0 9 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.615 89.3 77.8 -73.3 -11.1 7.8 66.7 79.5 332 146 B K T 3< S+ 0 0 123 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.2 0.834 113.2 20.9 -62.6 -30.2 9.8 64.3 77.4 333 147 B T S < S+ 0 0 118 -3,-1.3 2,-0.3 -4,-0.3 -1,-0.2 0.349 125.1 52.8-123.6 6.6 7.8 65.4 74.4 334 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150 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 0.604 360.0 360.0 -97.9 360.0 -19.0 2.8 86.9 585 !* 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 0.0 586 0 D S 0 0 22 0, 0.0 210,-0.4 0, 0.0 27,-0.1 0.000 360.0 360.0 360.0 -64.4 5.9 50.5 86.9 587 1 D L + 0 0 58 25,-0.4 2,-0.2 1,-0.2 26,-0.2 0.233 360.0 46.9-106.0 -56.6 3.9 48.0 85.6 588 2 D Y E -m 613 0G 42 24,-1.4 26,-2.5 54,-0.0 2,-0.5 -0.489 55.4-165.2 -92.7 136.2 4.5 45.6 88.6 589 3 D K E -mN 614 643G 26 54,-0.7 54,-2.2 -2,-0.2 2,-0.5 -0.962 20.8-176.0-100.1 116.7 4.5 46.0 92.5 590 4 D L E -mN 615 642G 0 24,-2.3 26,-3.1 -2,-0.5 2,-0.6 -0.946 22.9-148.7-119.0 125.7 6.2 43.0 94.1 591 5 D Y E +mN 616 641G 6 50,-2.8 50,-1.4 -2,-0.5 2,-0.3 -0.850 41.9 158.5 -87.2 125.1 6.5 42.4 97.9 592 6 D S E -m 617 0G 0 24,-2.4 26,-1.9 -2,-0.6 2,-0.5 -0.947 44.3-137.2-148.3 146.5 9.7 40.5 98.1 593 7 D X > - 0 0 14 -2,-0.3 3,-2.1 24,-0.2 7,-0.2 -0.994 27.1-132.1-106.3 131.3 12.5 39.6 100.5 594 8 D Q T 3 S+ 0 0 39 -2,-0.5 -1,-0.1 1,-0.3 193,-0.1 0.840 101.9 34.0 -47.1 -44.0 15.9 39.9 98.9 595 9 D R T 3 S+ 0 0 111 -3,-0.1 2,-0.5 191,-0.1 -1,-0.3 0.052 86.3 109.7-107.9 30.3 17.1 36.5 100.1 596 10 D S <> - 0 0 16 -3,-2.1 4,-2.2 1,-0.1 5,-0.1 -0.887 61.8-144.1 -95.7 136.5 14.0 34.4 100.0 597 11 D G H > S+ 0 0 0 -2,-0.5 4,-2.4 2,-0.2 -1,-0.1 0.883 99.0 55.3 -62.5 -41.1 14.2 31.8 97.2 598 12 D N H > S+ 0 0 27 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.877 111.6 44.6 -57.2 -40.7 10.5 32.1 96.5 599 13 D S H > S+ 0 0 0 2,-0.2 4,-2.1 40,-0.2 3,-0.3 0.893 109.9 54.9 -70.5 -39.3 10.8 35.8 96.0 600 14 D Y H X S+ 0 0 1 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.925 98.5 63.6 -61.7 -43.7 14.0 35.5 93.9 601 15 D K H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.912 107.7 42.7 -33.7 -51.7 12.2 33.1 91.6 602 16 D V H X S+ 0 0 0 -4,-0.9 4,-1.9 -3,-0.3 -2,-0.2 0.928 112.8 49.5 -76.8 -43.6 9.9 36.0 90.6 603 17 D R H X S+ 0 0 4 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.879 109.5 54.4 -58.5 -42.3 12.5 38.7 90.3 604 18 D L H X S+ 0 0 0 -4,-2.9 4,-2.4 -5,-0.2 -2,-0.2 0.937 108.1 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24.0-145.4-119.1 114.2 9.1 48.0 92.0 615 29 D A E -m 590 0G 34 -2,-0.5 2,-0.6 -26,-0.2 -24,-0.2 -0.714 6.7-161.6 -85.8 134.4 10.2 45.7 94.8 616 30 D V E -m 591 0G 3 -26,-3.1 -24,-2.4 -2,-0.4 2,-0.1 -0.961 23.5-132.3-107.7 110.1 8.8 46.4 98.3 617 31 D E E -m 592 0G 76 -2,-0.6 2,-0.4 -26,-0.2 -24,-0.2 -0.415 24.5-177.4 -69.2 133.7 11.0 44.7 100.8 618 32 D V - 0 0 7 -26,-1.9 2,-1.0 -2,-0.1 3,-0.1 -0.957 16.1-149.5-134.1 113.4 9.4 42.6 103.5 619 33 D D > > - 0 0 44 -2,-0.4 5,-1.7 1,-0.2 3,-0.9 -0.750 10.7-172.8 -93.3 98.5 11.9 41.1 106.1 620 34 D I G > 5S+ 0 0 45 -2,-1.0 3,-1.7 1,-0.3 5,-0.2 0.824 83.6 61.4 -55.7 -38.8 10.5 37.8 107.2 621 35 D L G 3 5S+ 0 0 79 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.824 102.5 50.7 -64.9 -30.9 13.1 37.5 109.9 622 36 D R G < 5S- 0 0 189 -3,-0.9 -1,-0.3 1,-0.0 -2,-0.2 0.106 121.7-107.0 -90.2 21.3 11.9 40.8 111.6 623 37 D G T X 5S+ 0 0 16 -3,-1.7 3,-1.8 1,-0.1 -3,-0.2 0.528 76.6 139.8 69.8 11.2 8.3 39.4 111.6 624 38 D E T 3 < + 0 0 71 -5,-1.7 3,-0.4 1,-0.3 -4,-0.2 0.563 63.4 59.6 -70.2 -15.1 7.3 41.8 108.8 625 39 D S T 3 S+ 0 0 6 -6,-0.2 -1,-0.3 -5,-0.2 -5,-0.1 0.267 102.7 55.3 -88.9 8.6 5.1 39.2 107.0 626 40 D R S < S+ 0 0 181 -3,-1.8 -2,-0.2 4,-0.1 -1,-0.2 0.169 73.9 117.9-132.6 14.0 3.0 38.8 110.1 627 41 D T S > S- 0 0 64 -3,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.472 75.7-117.8 -65.3 152.3 1.9 42.4 110.7 628 42 D P H > S+ 0 0 108 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.890 115.6 58.0 -66.4 -31.4 -1.9 42.8 110.4 629 43 D D H > S+ 0 0 66 1,-0.2 4,-1.1 2,-0.2 5,-0.1 0.936 111.2 41.4 -56.4 -48.5 -1.4 45.2 107.5 630 44 D F H > S+ 0 0 7 2,-0.2 4,-3.1 1,-0.2 3,-0.3 0.898 111.9 53.9 -69.1 -37.5 0.5 42.5 105.6 631 45 D L H < S+ 0 0 60 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.761 101.7 61.1 -74.4 -22.5 -2.0 39.7 106.6 632 46 D A H < S+ 0 0 31 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.874 111.4 38.9 -58.8 -43.5 -4.7 41.9 105.3 633 47 D K H < S+ 0 0 23 -4,-1.1 -2,-0.2 -3,-0.3 -1,-0.1 0.891 136.5 17.0 -76.2 -40.3 -2.9 41.6 101.9 634 48 D N >< - 0 0 14 -4,-3.1 3,-2.5 -5,-0.1 -1,-0.3 -0.821 61.5-166.3-135.6 99.4 -2.0 38.0 102.3 635 49 D P T 3 S+ 0 0 71 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.720 92.9 60.5 -51.7 -26.5 -3.9 35.9 105.0 636 50 D S T 3 S- 0 0 29 2,-0.1 -5,-0.1 -115,-0.1 -115,-0.0 0.535 104.5-132.4 -79.3 -12.4 -1.2 33.2 104.6 637 51 D G < + 0 0 12 -3,-2.5 2,-0.3 1,-0.2 -12,-0.1 0.811 56.4 130.8 69.9 35.3 1.6 35.7 105.7 638 52 D Q - 0 0 82 -8,-0.1 -1,-0.2 2,-0.1 -2,-0.1 -0.884 47.0-109.3-123.1 145.5 4.1 35.0 102.8 639 53 D V S S+ 0 0 13 -2,-0.3 -40,-0.2 -21,-0.1 14,-0.2 -0.860 79.9 59.8 -96.6 152.0 6.3 36.7 100.3 640 54 D P + 0 0 4 0, 0.0 12,-0.5 0, 0.0 2,-0.3 0.536 61.5 165.5 -87.7 170.9 6.4 37.1 97.4 641 55 D L E -NO 591 651G 2 -50,-1.4 -50,-2.8 10,-0.1 2,-0.5 -0.951 22.1-151.2-149.1 127.4 3.1 38.8 96.6 642 56 D L E -NO 590 650G 0 8,-2.4 8,-3.3 -2,-0.3 2,-0.6 -0.879 12.6-139.4-102.0 123.7 2.2 40.5 93.3 643 57 D E E +NO 589 649G 37 -54,-2.2 -54,-0.7 -2,-0.5 6,-0.3 -0.788 26.2 176.4 -85.1 127.5 -0.3 43.4 93.4 644 58 D T E - 0 0 11 4,-3.1 5,-0.2 -2,-0.6 -1,-0.2 0.743 61.4 -14.2-114.4 -28.3 -2.3 42.8 90.4 645 59 D A E > S- O 0 648G 0 3,-1.1 3,-1.9 -608,-0.0 -1,-0.4 -0.846 105.5 -50.9-166.6 171.3 -5.1 45.4 90.4 646 60 D P T 3 S- 0 0 27 0, 0.0 3,-0.1 0, 0.0 159,-0.1 -0.389 128.2 -1.8 -66.7 129.1 -6.0 47.7 93.3 647 61 D G T 3 S+ 0 0 16 1,-0.2 2,-0.4 -2,-0.2 -524,-0.1 0.754 111.0 115.1 64.8 22.1 -6.7 45.7 96.4 648 62 D R E < -O 645 0G 59 -3,-1.9 -4,-3.1 2,-0.0 -3,-1.1 -0.994 42.6-179.8-131.8 122.2 -6.0 42.6 94.4 649 63 D Y E -O 643 0G 40 -2,-0.4 2,-0.5 -6,-0.3 -6,-0.2 -0.948 19.4-150.3-128.2 138.1 -3.0 40.4 95.2 650 64 D L E -O 642 0G 7 -8,-3.3 -8,-2.4 -2,-0.4 2,-0.2 -0.959 22.0-173.5-107.3 127.7 -1.6 37.2 93.7 651 65 D A E +O 641 0G 10 -2,-0.5 4,-0.2 -10,-0.2 -10,-0.1 -0.622 43.1 69.2-110.9 179.3 0.3 34.9 96.1 652 66 D E S >> S- 0 0 20 -12,-0.5 4,-2.2 -2,-0.2 3,-1.1 0.818 71.0-125.0 74.8 105.1 2.3 31.7 95.6 653 67 D S H 3> S+ 0 0 3 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.812 110.0 53.8 -47.2 -39.4 5.6 32.2 93.8 654 68 D N H 3> S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.795 108.9 46.4 -71.6 -31.9 4.6 29.6 91.2 655 69 D A H <> S+ 0 0 0 -3,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.809 111.5 53.0 -74.0 -32.9 1.3 31.2 90.3 656 70 D I H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.897 109.1 50.0 -67.3 -38.6 3.1 34.6 90.1 657 71 D L H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.947 111.1 48.7 -63.2 -49.6 5.5 33.0 87.6 658 72 D W H X S+ 0 0 23 -4,-1.7 4,-0.9 2,-0.2 -2,-0.2 0.897 112.1 48.2 -54.4 -45.3 2.7 31.6 85.6 659 73 D Y H >< S+ 0 0 15 -4,-2.2 3,-0.7 1,-0.2 -2,-0.2 0.944 114.5 45.9 -60.6 -53.6 0.9 34.9 85.5 660 74 D L H 3< S+ 0 0 4 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.844 112.4 51.2 -51.1 -47.0 4.1 36.8 84.5 661 75 D A H >< S+ 0 0 1 -4,-2.6 3,-2.1 -5,-0.2 6,-0.4 0.592 77.1 124.6 -72.1 -15.1 5.0 34.2 81.8 662 76 D V T << S- 0 0 59 -4,-0.9 3,-0.1 -3,-0.7 -3,-0.0 -0.272 87.7 -1.1 -57.4 122.9 1.7 34.2 80.0 663 77 D G T 3 S+ 0 0 81 1,-0.3 -1,-0.3 5,-0.2 2,-0.2 0.645 112.6 106.9 78.8 17.8 2.1 34.9 76.4 664 78 D T S X S- 0 0 47 -3,-2.1 3,-1.6 4,-0.1 -1,-0.3 -0.652 88.9 -93.0-121.9 175.1 5.9 35.4 76.7 665 79 D S T 3 S+ 0 0 96 1,-0.3 -4,-0.1 -2,-0.2 -3,-0.1 0.639 118.8 68.0 -68.3 -9.4 9.0 33.4 75.7 666 80 D L T 3 S+ 0 0 7 -5,-0.2 78,-1.8 77,-0.1 -1,-0.3 0.537 88.4 76.1 -89.0 -3.0 9.0 31.7 79.1 667 81 D A S < S- 0 0 17 -3,-1.6 7,-0.1 -6,-0.4 75,-0.0 -0.898 85.0-126.3-102.4 131.6 5.8 30.0 78.4 668 82 D P - 0 0 1 0, 0.0 -5,-0.2 0, 0.0 -4,-0.1 -0.242 19.5-122.1 -72.3 170.9 5.9 27.0 76.1 669 83 D D S S+ 0 0 124 70,-0.1 2,-0.2 -4,-0.1 -2,-0.0 0.763 79.2 60.4 -96.1 -28.2 3.6 26.9 73.1 670 84 D T S > S- 0 0 65 1,-0.1 4,-2.4 69,-0.0 5,-0.2 -0.660 79.3-118.3-101.2 161.2 1.4 23.8 73.3 671 85 D R H > S+ 0 0 90 -2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.829 115.2 51.4 -57.9 -39.7 -1.1 22.8 75.9 672 86 D X H > S+ 0 0 52 2,-0.2 4,-1.6 1,-0.1 -1,-0.2 0.882 109.1 47.9 -70.2 -40.2 0.9 19.7 76.7 673 87 D D H > S+ 0 0 29 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.889 111.5 51.0 -67.0 -44.9 4.2 21.5 77.2 674 88 D R H X S+ 0 0 75 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.856 109.5 50.3 -53.2 -42.5 2.6 24.0 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