==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-JAN-09 3FUT . COMPND 2 MOLECULE: DIMETHYLADENOSINE TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR H.DEMIRCI,R.BELARDINELLI,E.SERI,S.T.GREGORY,C.GUALERZI,A.E.D . 524 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25098.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 371 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 9.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 7.6 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 . 0 0.0 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 . 37 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 160 30.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.5 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 0 0 1 5 2 2 5 7 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 4 2 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 PARALLEL BRIDGES PER LADDER . 0 2 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 5 A A 0 0 86 0, 0.0 28,-0.2 0, 0.0 26,-0.1 0.000 360.0 360.0 360.0 -46.8 104.8 39.0 37.8 2 6 A S >> - 0 0 51 26,-0.1 4,-2.1 24,-0.0 3,-0.6 -0.925 360.0 -79.5-163.6 169.6 105.2 38.0 34.1 3 7 A P H 3> S+ 0 0 57 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.757 127.6 44.1 -46.1 -37.2 104.9 34.8 32.0 4 8 A Q H 3> S+ 0 0 126 2,-0.2 4,-2.4 3,-0.2 5,-0.2 0.872 111.3 53.0 -78.8 -37.6 108.4 33.4 33.0 5 9 A S H <> S+ 0 0 46 -3,-0.6 4,-1.9 2,-0.2 -1,-0.2 0.911 114.3 43.0 -56.2 -48.6 108.0 34.3 36.8 6 10 A V H X S+ 0 0 1 -4,-2.1 4,-3.2 2,-0.2 5,-0.3 0.949 113.0 50.6 -66.2 -51.7 104.7 32.4 37.0 7 11 A R H X S+ 0 0 128 -4,-1.8 4,-2.5 -5,-0.3 -2,-0.2 0.902 112.6 48.0 -54.4 -43.7 105.9 29.5 34.9 8 12 A A H X S+ 0 0 34 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.865 112.1 48.3 -68.2 -38.1 109.0 29.1 37.1 9 13 A L H X S+ 0 0 19 -4,-1.9 4,-1.0 2,-0.2 -2,-0.2 0.938 113.6 47.1 -66.1 -47.9 107.0 29.3 40.3 10 14 A L H ><>S+ 0 0 2 -4,-3.2 5,-3.6 1,-0.2 3,-0.5 0.892 110.0 53.1 -60.5 -40.6 104.5 26.8 39.1 11 15 A E H ><5S+ 0 0 141 -4,-2.5 3,-1.8 3,-0.3 -1,-0.2 0.844 101.2 59.6 -64.1 -36.5 107.3 24.4 37.9 12 16 A R H 3<5S+ 0 0 167 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.811 112.6 40.5 -57.2 -33.2 108.9 24.6 41.4 13 17 A H T <<5S- 0 0 50 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.143 123.9-109.6-104.1 18.1 105.6 23.1 42.6 14 18 A G T < 5S+ 0 0 68 -3,-1.8 2,-0.4 1,-0.2 -3,-0.3 0.778 71.4 139.8 62.4 32.1 105.4 20.8 39.6 15 19 A L < - 0 0 33 -5,-3.6 2,-0.5 -8,-0.2 -1,-0.2 -0.876 37.0-162.4-111.7 141.7 102.5 22.6 37.9 16 20 A F - 0 0 144 -2,-0.4 2,-0.5 -6,-0.1 -9,-0.0 -0.985 9.7-165.1-121.4 124.6 102.0 23.4 34.2 17 21 A A + 0 0 12 -2,-0.5 2,-0.2 3,-0.0 -7,-0.0 -0.962 22.9 142.9-117.5 121.6 99.5 26.1 33.2 18 22 A D S > S- 0 0 47 -2,-0.5 3,-2.1 164,-0.1 4,-0.2 -0.630 73.4 -61.5-129.4-161.7 98.2 26.5 29.7 19 23 A K T 3 S+ 0 0 188 1,-0.3 3,-0.3 -2,-0.2 166,-0.1 0.666 133.2 56.8 -63.0 -14.6 94.7 27.5 28.5 20 24 A R T 3 S+ 0 0 188 1,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.435 76.5 98.7 -94.1 1.3 93.2 24.4 30.2 21 25 A F S < S- 0 0 11 -3,-2.1 -1,-0.2 2,-0.2 -2,-0.1 0.769 90.3-120.0 -65.9 -29.5 94.5 25.2 33.7 22 26 A G S S+ 0 0 58 -3,-0.3 2,-0.3 -4,-0.2 -1,-0.1 0.279 82.6 46.2 107.6 -13.4 91.2 26.6 35.0 23 27 A Q - 0 0 24 92,-0.1 2,-0.4 91,-0.1 -1,-0.2 -0.949 65.4-136.7-150.9 174.0 92.5 30.1 35.8 24 28 A N - 0 0 28 -2,-0.3 2,-0.3 -3,-0.1 -5,-0.0 -0.954 23.3-135.5-142.5 115.4 94.6 32.9 34.5 25 29 A F E -A 181 0A 7 156,-2.3 156,-2.5 -2,-0.4 2,-0.2 -0.531 21.1-114.3 -84.3 133.5 97.1 34.7 36.6 26 30 A L E +A 180 0A 23 -2,-0.3 154,-0.3 154,-0.2 -1,-0.1 -0.428 38.2 166.0 -63.0 123.7 97.4 38.5 36.7 27 31 A V + 0 0 26 152,-3.2 2,-0.7 -2,-0.2 153,-0.2 0.256 48.5 96.6-119.4 7.2 100.8 39.6 35.3 28 32 A S > - 0 0 27 151,-0.9 4,-2.4 1,-0.2 5,-0.1 -0.880 49.3-171.4-105.2 109.6 99.9 43.3 34.8 29 33 A E H > S+ 0 0 141 -2,-0.7 4,-2.4 1,-0.2 5,-0.2 0.872 88.0 58.3 -65.9 -36.2 101.0 45.5 37.7 30 34 A A H > S+ 0 0 71 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.922 110.5 42.0 -59.4 -43.2 99.1 48.5 36.2 31 35 A H H > S+ 0 0 39 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.899 109.4 58.3 -73.5 -38.6 95.9 46.5 36.3 32 36 A L H X S+ 0 0 10 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.935 106.7 49.3 -50.2 -49.9 96.7 45.1 39.8 33 37 A R H X S+ 0 0 166 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.873 108.7 52.5 -58.8 -42.0 96.9 48.7 41.1 34 38 A R H X S+ 0 0 132 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.848 107.1 52.8 -66.2 -33.8 93.6 49.7 39.5 35 39 A I H X S+ 0 0 2 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.941 108.6 48.8 -67.5 -46.6 91.9 46.8 41.1 36 40 A V H >X S+ 0 0 7 -4,-2.1 4,-1.0 1,-0.2 3,-0.6 0.932 111.0 51.7 -56.3 -44.8 93.1 47.8 44.6 37 41 A E H >< S+ 0 0 76 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.900 106.0 54.6 -59.3 -40.6 91.9 51.3 43.9 38 42 A A H 3< S+ 0 0 5 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.768 106.5 52.0 -63.5 -29.1 88.5 50.0 42.9 39 43 A A H << S+ 0 0 1 -4,-1.4 -1,-0.2 -3,-0.6 -2,-0.2 0.680 93.1 145.7 -84.4 -16.6 88.1 48.2 46.2 40 44 A R << + 0 0 99 -4,-1.0 2,-0.1 -3,-0.7 -3,-0.0 -0.290 34.9 54.8 -68.5 153.8 89.0 51.2 48.4 41 45 A P - 0 0 74 0, 0.0 2,-2.1 0, 0.0 3,-0.2 0.522 69.7-147.7 -82.7 152.6 88.2 52.4 51.1 42 46 A F + 0 0 45 1,-0.2 -2,-0.1 21,-0.2 4,-0.1 -0.481 43.0 146.6 -85.2 70.8 89.0 49.3 53.2 43 47 A T + 0 0 105 -2,-2.1 -1,-0.2 2,-0.1 65,-0.1 0.519 67.4 24.3 -88.1 -5.2 86.3 50.0 55.7 44 48 A G S S- 0 0 11 -3,-0.2 22,-0.3 22,-0.1 64,-0.1 -0.931 101.7 -74.4-146.4 167.7 85.6 46.3 56.4 45 49 A P - 0 0 31 0, 0.0 64,-3.1 0, 0.0 2,-0.4 -0.328 48.7-124.4 -65.7 150.7 87.7 43.1 56.0 46 50 A V E -bc 67 109B 0 20,-3.5 22,-2.2 62,-0.2 2,-0.5 -0.825 15.2-161.7-100.6 136.1 88.2 41.8 52.5 47 51 A F E -bc 68 110B 13 62,-2.6 64,-2.7 -2,-0.4 2,-0.7 -0.982 12.9-163.0-111.0 115.8 87.3 38.3 51.4 48 52 A E E -bc 69 111B 5 20,-2.7 22,-3.1 -2,-0.5 2,-0.5 -0.894 1.2-161.5-107.8 108.9 89.2 37.5 48.2 49 53 A V E S+bc 70 112B 10 62,-2.4 64,-2.8 -2,-0.7 22,-0.2 -0.787 75.5 16.2 -88.1 124.8 87.8 34.6 46.2 50 54 A G + 0 0 17 20,-2.6 -1,-0.2 -2,-0.5 21,-0.2 0.966 64.5 176.8 80.5 58.9 90.4 33.2 43.7 51 55 A P > - 0 0 8 0, 0.0 3,-2.7 0, 0.0 4,-0.4 0.575 15.0-171.0 -69.2 -11.9 93.7 34.7 44.9 52 56 A G T 3 S- 0 0 7 1,-0.3 28,-0.1 2,-0.2 -2,-0.1 -0.389 73.6 -11.7 61.2-116.9 95.7 32.8 42.2 53 57 A L T 3 S- 0 0 23 -2,-0.3 -1,-0.3 -27,-0.1 30,-0.0 0.386 103.6-101.5 -93.0 -0.9 99.4 33.2 43.1 54 58 A G S <> S+ 0 0 1 -3,-2.7 4,-2.7 -4,-0.1 5,-0.2 0.564 80.8 132.9 93.5 11.0 98.6 36.0 45.7 55 59 A A H > S+ 0 0 34 -4,-0.4 4,-1.6 1,-0.2 5,-0.1 0.929 82.0 36.2 -58.9 -49.9 99.5 39.0 43.5 56 60 A L H > S+ 0 0 19 -5,-0.4 4,-3.0 2,-0.2 5,-0.2 0.866 113.0 60.3 -71.5 -36.4 96.3 40.9 44.4 57 61 A T H > S+ 0 0 0 -6,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.937 108.2 44.5 -53.2 -49.0 96.4 39.5 48.0 58 62 A R H X S+ 0 0 103 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.901 113.2 49.7 -64.3 -41.6 99.8 41.1 48.5 59 63 A A H X S+ 0 0 12 -4,-1.6 4,-1.4 -5,-0.2 -1,-0.2 0.891 110.4 50.5 -67.3 -38.2 98.7 44.4 46.9 60 64 A L H <>S+ 0 0 0 -4,-3.0 5,-2.3 1,-0.2 3,-0.4 0.939 111.1 48.2 -66.0 -45.3 95.6 44.6 49.0 61 65 A L H ><5S+ 0 0 28 -4,-2.3 3,-1.7 -5,-0.2 -2,-0.2 0.906 109.1 53.7 -59.3 -42.5 97.6 44.0 52.2 62 66 A E H 3<5S+ 0 0 142 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.774 105.1 54.7 -64.8 -28.1 100.1 46.6 51.3 63 67 A A T 3<5S- 0 0 26 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.380 129.4 -97.1 -85.2 1.3 97.2 49.1 50.8 64 68 A G T < 5S+ 0 0 54 -3,-1.7 -3,-0.2 1,-0.3 -2,-0.1 0.497 74.8 143.0 99.7 6.7 96.1 48.3 54.4 65 69 A A < - 0 0 8 -5,-2.3 2,-0.5 -6,-0.2 -1,-0.3 -0.382 49.3-132.7 -72.9 155.0 93.3 45.8 53.9 66 70 A E - 0 0 137 -22,-0.3 -20,-3.5 -2,-0.1 2,-0.4 -0.955 37.0-161.5 -99.8 126.6 92.7 42.8 56.1 67 71 A V E -bd 46 89B 7 -2,-0.5 23,-2.1 21,-0.5 2,-0.5 -0.943 30.5-172.2-124.5 134.6 92.4 39.8 53.8 68 72 A T E -bd 47 90B 25 -22,-2.2 -20,-2.7 -2,-0.4 2,-0.5 -0.993 23.8-156.5-111.8 112.3 91.0 36.3 53.9 69 73 A A E -bd 48 91B 0 21,-2.9 23,-3.3 -2,-0.5 2,-0.6 -0.851 6.3-165.5 -98.1 127.3 92.0 34.6 50.6 70 74 A I E -bd 49 92B 1 -22,-3.1 -20,-2.6 -2,-0.5 2,-0.4 -0.942 6.8-175.8-121.4 111.6 89.8 31.7 49.6 71 75 A E E - d 0 93B 4 21,-2.9 23,-1.1 -2,-0.6 -22,-0.0 -0.925 18.6-167.9-118.5 130.6 91.1 29.4 46.9 72 76 A K S S+ 0 0 112 -2,-0.4 2,-1.0 21,-0.2 23,-0.1 0.793 71.0 83.0 -82.4 -33.6 89.1 26.5 45.3 73 77 A D > - 0 0 26 1,-0.2 3,-1.9 21,-0.1 4,-0.1 -0.657 59.3-167.8 -83.9 104.5 92.1 24.9 43.5 74 78 A L G > S+ 0 0 104 -2,-1.0 3,-1.6 1,-0.3 -1,-0.2 0.690 80.7 74.2 -63.0 -20.6 93.9 22.7 46.0 75 79 A R G 3 S+ 0 0 115 1,-0.3 4,-0.4 2,-0.1 -1,-0.3 0.761 89.9 59.4 -64.2 -24.7 96.8 22.4 43.6 76 80 A L G <> S+ 0 0 0 -3,-1.9 4,-3.0 1,-0.2 5,-0.3 0.473 75.9 98.6 -85.9 -1.0 97.8 26.0 44.4 77 81 A R H <> S+ 0 0 114 -3,-1.6 4,-2.5 1,-0.2 5,-0.3 0.937 85.2 43.5 -52.7 -54.8 98.2 25.3 48.2 78 82 A P H > S+ 0 0 61 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.884 115.6 50.6 -61.1 -33.8 102.0 24.9 48.1 79 83 A V H > S+ 0 0 0 -4,-0.4 4,-2.8 2,-0.2 -2,-0.2 0.952 113.8 41.8 -66.7 -52.3 102.3 28.0 45.8 80 84 A L H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.860 109.5 57.7 -65.2 -36.3 100.2 30.3 47.9 81 85 A E H < S+ 0 0 103 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.880 113.0 43.0 -64.0 -33.6 101.7 29.1 51.2 82 86 A E H >< S+ 0 0 81 -4,-1.4 3,-1.2 -5,-0.3 -2,-0.2 0.957 115.9 44.4 -71.4 -53.8 105.0 30.2 49.7 83 87 A T H 3< S+ 0 0 37 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.808 120.3 42.1 -66.5 -27.3 104.0 33.5 48.2 84 88 A L T >< S+ 0 0 10 -4,-2.6 3,-2.1 -5,-0.2 -1,-0.3 0.344 83.3 138.1 -98.8 2.5 102.0 34.5 51.3 85 89 A S T < S+ 0 0 91 -3,-1.2 -3,-0.1 1,-0.3 -4,-0.0 -0.249 75.1 7.3 -53.7 129.3 104.7 33.3 53.8 86 90 A G T 3 S+ 0 0 81 1,-0.2 -1,-0.3 3,-0.1 -4,-0.0 0.532 101.5 122.1 77.6 8.7 105.1 35.7 56.7 87 91 A L S < S- 0 0 65 -3,-2.1 2,-2.0 2,-0.1 -1,-0.2 -0.773 72.9-113.2-104.8 148.3 102.2 37.9 55.7 88 92 A P S S+ 0 0 108 0, 0.0 -21,-0.5 0, 0.0 2,-0.3 -0.557 74.0 118.4 -80.5 83.3 99.2 38.8 57.8 89 93 A V E -d 67 0B 32 -2,-2.0 2,-0.5 -5,-0.2 -21,-0.2 -0.984 60.3-131.6-142.4 148.0 96.6 37.0 55.7 90 94 A R E -d 68 0B 177 -23,-2.1 -21,-2.9 -2,-0.3 2,-0.5 -0.931 23.4-159.3-101.4 127.2 94.2 34.1 56.3 91 95 A L E -d 69 0B 40 -2,-0.5 2,-0.4 -23,-0.2 -21,-0.2 -0.921 10.5-177.4-111.5 127.1 94.4 31.5 53.6 92 96 A V E -d 70 0B 26 -23,-3.3 -21,-2.9 -2,-0.5 2,-0.7 -0.985 18.5-151.2-127.7 132.5 91.4 29.1 53.1 93 97 A F E +d 71 0B 33 -2,-0.4 2,-0.3 -23,-0.2 -21,-0.2 -0.898 50.8 112.0-103.9 105.5 91.1 26.3 50.6 94 98 A Q S S- 0 0 64 -23,-1.1 2,-0.4 -2,-0.7 -21,-0.1 -0.972 73.3 -92.7-166.9 149.5 87.4 25.9 49.8 95 99 A D >> - 0 0 63 -2,-0.3 3,-2.4 1,-0.1 4,-0.7 -0.607 38.4-133.4 -65.5 124.4 84.9 26.2 47.1 96 100 A A G >4 S+ 0 0 6 -2,-0.4 3,-0.6 1,-0.3 5,-0.2 0.784 103.9 67.3 -56.3 -26.5 83.5 29.7 47.6 97 101 A L G 34 S+ 0 0 76 1,-0.2 -1,-0.3 3,-0.1 4,-0.1 0.778 106.5 41.7 -61.5 -23.7 80.0 28.3 47.3 98 102 A L G <4 S+ 0 0 121 -3,-2.4 -1,-0.2 2,-0.1 -2,-0.2 0.503 85.2 115.4-102.6 -7.7 80.6 26.5 50.6 99 103 A Y S << S- 0 0 34 -4,-0.7 2,-2.1 -3,-0.6 3,-0.2 -0.365 80.1-108.5 -66.0 141.7 82.3 29.2 52.5 100 104 A P > + 0 0 65 0, 0.0 3,-2.2 0, 0.0 4,-0.4 -0.439 46.2 169.7 -77.4 79.9 80.3 30.4 55.5 101 105 A W G > + 0 0 0 -2,-2.1 3,-1.2 1,-0.3 -2,-0.0 0.775 69.1 68.8 -62.0 -26.6 79.2 33.8 54.2 102 106 A E G 3 S+ 0 0 90 1,-0.3 -1,-0.3 -3,-0.2 -3,-0.0 0.603 95.9 57.6 -69.9 -8.8 76.8 34.3 57.1 103 107 A E G < S+ 0 0 67 -3,-2.2 -1,-0.3 361,-0.1 363,-0.2 0.689 80.0 104.0 -90.3 -20.9 79.7 34.6 59.4 104 108 A V S < S- 0 0 4 -3,-1.2 3,-0.1 -4,-0.4 4,-0.1 -0.266 83.9 -97.5 -65.2 146.3 81.5 37.5 57.7 105 109 A P > - 0 0 57 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.356 40.8-104.5 -58.4 139.9 81.1 40.9 59.4 106 110 A Q T 3 S+ 0 0 83 1,-0.3 26,-0.2 357,-0.2 25,-0.1 -0.434 112.2 39.0 -58.2 137.4 78.4 43.1 58.0 107 111 A G T 3 S+ 0 0 28 24,-2.5 -1,-0.3 1,-0.2 25,-0.2 0.432 85.5 147.8 93.6 2.7 80.2 45.8 56.0 108 112 A S E < - 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G 0 168B 60 -26,-2.6 -26,-2.2 -2,-0.4 -60,-0.2 -0.933 23.8-135.2-116.5 100.5 77.6 48.8 45.7 195 199 A P E - G 0 167B 31 0, 0.0 -28,-0.3 0, 0.0 -29,-0.1 -0.269 7.4-153.3 -57.4 143.4 74.7 47.1 47.6 196 200 A T - 0 0 88 -30,-2.1 -29,-0.1 2,-0.1 3,-0.1 0.499 48.2-104.2 -89.7 -10.4 71.7 49.1 48.5 197 201 A G S S+ 0 0 42 -31,-0.6 2,-0.2 1,-0.4 -30,-0.1 0.300 73.8 145.2 94.3 -7.3 70.8 46.9 51.6 198 202 A A - 0 0 21 -32,-0.3 -1,-0.4 -33,-0.1 -2,-0.1 -0.504 35.4-154.5 -62.4 131.2 68.0 45.2 49.7 199 203 A L - 0 0 15 1,-0.3 -70,-0.1 -2,-0.2 171,-0.1 -0.294 39.4 -55.1 -94.5-177.4 67.7 41.5 50.8 200 204 A D - 0 0 20 -72,-0.6 -1,-0.3 -2,-0.1 170,-0.1 -0.202 35.9-159.9 -58.7 151.6 66.3 38.7 48.7 201 205 A D > - 0 0 29 1,-0.1 4,-2.0 -3,-0.1 5,-0.2 -0.824 15.1-177.5-122.6 86.7 62.8 39.0 47.3 202 206 A P H > S+ 0 0 20 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.871 76.6 51.3 -63.7 -36.5 62.3 35.3 46.7 203 207 A G H > S+ 0 0 3 1,-0.2 4,-1.8 164,-0.2 5,-0.1 0.897 108.9 53.1 -63.8 -38.9 58.8 35.5 45.1 204 208 A L H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.935 110.9 46.5 -59.1 -44.6 60.1 38.1 42.7 205 209 A F H X S+ 0 0 7 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.803 105.0 57.9 -77.6 -22.6 62.9 35.8 41.6 206 210 A R H X S+ 0 0 121 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 0.929 112.3 44.4 -64.2 -40.6 60.8 32.8 41.2 207 211 A L H X S+ 0 0 1 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.948 114.2 47.8 -65.9 -48.3 58.8 34.9 38.7 208 212 A V H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.933 111.6 50.3 -61.6 -43.6 62.0 36.3 37.0 209 213 A E H < S+ 0 0 101 -4,-2.9 4,-0.3 1,-0.2 -1,-0.2 0.928 113.0 46.5 -59.3 -45.2 63.5 32.8 36.7 210 214 A A H >< S+ 0 0 15 -4,-2.1 3,-1.4 -5,-0.2 4,-0.4 0.909 108.0 57.2 -62.2 -42.3 60.3 31.4 35.2 211 215 A A H 3< S+ 0 0 3 -4,-2.8 37,-0.4 1,-0.3 3,-0.3 0.849 114.3 36.9 -59.9 -36.2 60.1 34.4 32.8 212 216 A F T 3< S+ 0 0 47 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.261 85.0 109.4 -99.5 9.1 63.6 33.7 31.3 213 217 A G S < S+ 0 0 64 -3,-1.4 2,-0.4 -4,-0.3 -1,-0.2 0.866 87.6 24.8 -53.7 -45.1 63.2 29.9 31.5 214 218 A K S > S- 0 0 121 -4,-0.4 3,-1.2 -3,-0.3 -1,-0.2 -0.985 73.0-147.5-129.1 125.5 63.0 29.6 27.7 215 219 A R T 3 S+ 0 0 199 -2,-0.4 34,-0.2 1,-0.3 -1,-0.1 0.837 93.1 43.6 -55.9 -45.8 64.4 32.3 25.4 216 220 A R T 3 S+ 0 0 168 31,-0.1 2,-0.3 2,-0.0 -1,-0.3 -0.072 92.7 98.1-103.3 35.3 62.0 32.1 22.5 217 221 A K S < S- 0 0 71 -3,-1.2 31,-0.4 -6,-0.1 -3,-0.1 -0.891 76.8-111.9-113.9 149.1 58.7 32.0 24.4 218 222 A T > - 0 0 13 -2,-0.3 4,-2.5 29,-0.1 29,-0.2 -0.340 34.5-108.8 -65.8 160.2 56.5 34.9 25.2 219 223 A L H > S+ 0 0 0 27,-2.9 4,-2.8 1,-0.2 5,-0.3 0.907 120.9 56.3 -58.9 -40.3 56.3 36.0 28.9 220 224 A L H > S+ 0 0 19 26,-0.5 4,-2.5 24,-0.3 -1,-0.2 0.936 112.0 40.1 -54.9 -52.6 52.8 34.5 29.0 221 225 A N H > S+ 0 0 45 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.850 113.4 53.9 -68.6 -35.7 53.9 31.1 27.8 222 226 A A H X S+ 0 0 4 -4,-2.5 4,-0.7 2,-0.2 -2,-0.2 0.931 113.0 43.0 -65.9 -44.3 57.1 31.1 29.9 223 227 A L H ><>S+ 0 0 0 -4,-2.8 5,-2.2 1,-0.2 3,-1.2 0.913 109.8 57.0 -67.7 -40.7 55.1 31.8 33.1 224 228 A A H ><5S+ 0 0 32 -4,-2.5 3,-1.7 -5,-0.3 -1,-0.2 0.892 101.5 58.1 -53.4 -40.4 52.4 29.3 32.1 225 229 A A H 3<5S+ 0 0 81 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.744 106.5 48.2 -62.4 -26.2 55.2 26.7 31.9 226 230 A A T <<5S- 0 0 60 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.267 128.4 -95.7 -97.8 6.4 56.1 27.3 35.6 227 231 A G T < 5S+ 0 0 61 -3,-1.7 -3,-0.2 1,-0.3 -2,-0.1 0.585 77.4 139.1 92.8 10.0 52.4 27.1 36.7 228 232 A Y < - 0 0 56 -5,-2.2 -1,-0.3 -6,-0.1 -2,-0.1 -0.828 63.9-111.9 -79.9 115.7 51.4 30.8 36.7 229 233 A P > - 0 0 76 0, 0.0 4,-2.3 0, 0.0 3,-0.3 -0.239 16.4-137.2 -58.0 130.3 47.8 30.5 35.2 230 234 A K H > S+ 0 0 104 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.849 101.7 54.8 -54.0 -44.7 47.6 32.1 31.7 231 235 A A H > S+ 0 0 71 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.912 111.2 45.1 -58.7 -43.8 44.2 33.8 32.5 232 236 A R H > S+ 0 0 144 -3,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.894 115.6 46.7 -66.7 -42.2 45.7 35.6 35.5 233 237 A V H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.925 110.0 53.5 -65.2 -47.4 48.9 36.6 33.7 234 238 A E H X S+ 0 0 85 -4,-3.3 4,-2.5 1,-0.2 -2,-0.2 0.927 111.8 46.1 -49.3 -49.9 47.0 37.8 30.6 235 239 A E H X S+ 0 0 103 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.897 111.2 51.2 -64.3 -42.1 44.9 40.0 33.0 236 240 A A H X S+ 0 0 8 -4,-2.1 4,-0.8 2,-0.2 -1,-0.2 0.891 112.1 46.7 -62.9 -39.6 48.0 41.3 34.8 237 241 A L H <>S+ 0 0 2 -4,-2.6 5,-2.2 2,-0.2 4,-0.5 0.890 110.8 52.1 -69.4 -42.6 49.7 42.2 31.5 238 242 A R H ><5S+ 0 0 147 -4,-2.5 3,-1.4 -5,-0.2 -2,-0.2 0.926 108.1 52.1 -53.6 -48.8 46.6 44.0 30.2 239 243 A A H 3<5S+ 0 0 76 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.712 109.3 50.1 -64.9 -23.3 46.4 46.0 33.5 240 244 A L T 3<5S- 0 0 62 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.469 112.1-117.2 -93.9 -5.0 50.0 47.1 33.0 241 245 A G T < 5 + 0 0 68 -3,-1.4 -3,-0.2 -4,-0.5 -2,-0.1 0.682 65.1 147.0 74.2 20.5 49.6 48.2 29.4 242 246 A L < - 0 0 42 -5,-2.2 -1,-0.3 -6,-0.1 -2,-0.1 -0.593 58.4 -95.6 -88.2 149.4 52.1 45.6 28.2 243 247 A P > - 0 0 68 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.372 32.8-123.9 -60.2 139.7 51.8 43.9 24.8 244 248 A P T 3 S+ 0 0 103 0, 0.0 -24,-0.3 0, 0.0 -7,-0.1 0.817 112.7 40.3 -56.7 -32.5 50.0 40.5 25.2 245 249 A R T 3 S+ 0 0 170 -26,-0.1 -26,-0.1 -27,-0.1 -24,-0.0 0.073 85.4 151.1-105.5 22.2 53.0 38.7 23.6 246 250 A V < - 0 0 3 -3,-2.1 -27,-2.9 -28,-0.1 -26,-0.5 -0.174 39.9-130.9 -50.1 144.1 55.6 40.8 25.4 247 251 A R > - 0 0 55 -29,-0.2 3,-2.2 -28,-0.1 4,-0.5 -0.759 16.1-115.3-103.5 151.6 58.9 38.9 26.0 248 252 A A G > S+ 0 0 8 -31,-0.4 3,-1.8 -37,-0.4 -36,-0.1 0.866 113.5 60.9 -49.9 -42.9 60.8 38.7 29.3 249 253 A E G 3 S+ 0 0 55 1,-0.3 -97,-1.9 -34,-0.2 -1,-0.3 0.597 95.9 62.0 -65.8 -12.5 63.7 40.6 27.8 250 254 A E G < S+ 0 0 74 -3,-2.2 2,-0.4 -99,-0.2 -1,-0.3 0.658 89.3 87.1 -86.4 -15.3 61.5 43.6 27.2 251 255 A L < - 0 0 3 -3,-1.8 2,-0.1 -4,-0.5 -99,-0.1 -0.692 64.2-149.8 -92.6 132.3 60.7 44.1 30.9 252 256 A D > - 0 0 65 -2,-0.4 4,-2.3 -101,-0.1 5,-0.2 -0.366 38.3 -94.1 -84.3 173.0 62.8 46.1 33.4 253 257 A L H > S+ 0 0 12 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.900 126.0 53.8 -54.6 -43.8 63.1 45.4 37.1 254 258 A E H > S+ 0 0 96 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.924 108.4 49.4 -58.6 -44.1 60.3 47.9 37.9 255 259 A A H > S+ 0 0 8 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.892 108.9 52.2 -64.3 -41.0 58.0 46.1 35.4 256 260 A F H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.912 109.5 50.0 -60.9 -42.1 58.7 42.7 36.9 257 261 A R H X S+ 0 0 83 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.911 111.0 48.7 -60.6 -44.0 57.9 44.0 40.4 258 262 A R H X S+ 0 0 137 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.872 111.6 50.1 -63.4 -36.4 54.6 45.5 39.1 259 263 A L H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.931 109.5 50.2 -68.5 -45.2 53.7 42.2 37.4 260 264 A R H X S+ 0 0 15 -4,-2.5 4,-0.5 1,-0.2 3,-0.3 0.944 111.1 48.6 -56.8 -49.6 54.5 40.2 40.6 261 265 A E H >< S+ 0 0 126 -4,-2.4 3,-1.3 1,-0.2 -1,-0.2 0.900 108.9 55.0 -56.2 -42.3 52.3 42.5 42.6 262 266 A G H 3< S+ 0 0 49 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.845 107.4 48.8 -60.6 -37.0 49.5 42.2 40.0 263 267 A L H 3< 0 0 26 -4,-1.9 -1,-0.3 -3,-0.3 -2,-0.2 0.498 360.0 360.0 -82.1 -4.2 49.6 38.4 40.3 264 268 A E << 0 0 154 -3,-1.3 -2,-0.2 -4,-0.5 -3,-0.2 0.731 360.0 360.0-119.7 360.0 49.4 38.6 44.1 265 !* 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 0.0 266 3 B K 0 0 176 0, 0.0 3,-0.1 0, 0.0 53,-0.1 0.000 360.0 360.0 360.0 33.0 33.0 46.7 68.6 267 4 B L + 0 0 17 1,-0.1 2,-0.9 52,-0.1 52,-0.2 0.467 360.0 76.1-113.7 -15.2 35.2 43.7 69.4 268 5 B A S S+ 0 0 6 51,-0.1 25,-0.5 23,-0.1 23,-0.2 -0.584 76.0 96.3 -99.7 65.9 37.2 45.3 72.3 269 6 B S S > S- 0 0 28 -2,-0.9 4,-2.4 21,-0.2 5,-0.2 -0.969 76.8-127.8-152.0 140.3 34.5 45.1 74.9 270 7 B P H > S+ 0 0 54 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.873 112.8 51.6 -56.9 -38.7 33.9 42.4 77.6 271 8 B Q H > S+ 0 0 140 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.931 110.4 46.6 -61.5 -51.3 30.3 42.1 76.3 272 9 B S H > S+ 0 0 26 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.884 114.6 49.0 -59.1 -41.0 31.3 41.6 72.7 273 10 B V H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.947 110.7 47.0 -68.7 -53.1 34.0 39.0 73.7 274 11 B R H X S+ 0 0 146 -4,-2.8 4,-2.4 1,-0.2 5,-0.2 0.927 114.1 50.6 -55.3 -42.9 31.7 36.9 76.0 275 12 B A H X S+ 0 0 58 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.841 111.7 45.6 -65.1 -38.6 29.0 36.9 73.3 276 13 B L H X S+ 0 0 24 -4,-1.9 4,-1.2 -5,-0.2 -1,-0.2 0.913 114.0 48.4 -71.2 -43.0 31.4 35.8 70.5 277 14 B L H ><>S+ 0 0 10 -4,-2.4 5,-2.7 1,-0.2 3,-0.9 0.961 112.1 46.9 -64.1 -51.5 33.0 33.1 72.5 278 15 B E H ><5S+ 0 0 83 -4,-2.4 3,-1.7 -5,-0.3 -1,-0.2 0.882 106.6 60.1 -59.0 -38.1 29.8 31.5 73.8 279 16 B R H 3<5S+ 0 0 175 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.842 110.1 41.9 -56.8 -35.3 28.4 31.6 70.3 280 17 B H T <<5S- 0 0 54 -4,-1.2 -1,-0.3 -3,-0.9 -2,-0.2 0.171 123.3-102.1-102.2 16.9 31.2 29.3 69.1 281 18 B G T < 5S+ 0 0 52 -3,-1.7 2,-0.4 1,-0.2 -3,-0.2 0.782 75.9 139.4 71.2 30.4 31.1 27.0 72.1 282 19 B L < 0 0 21 -5,-2.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.909 360.0 360.0-111.1 134.0 34.2 28.6 73.9 283 20 B F 0 0 177 -2,-0.4 -1,-0.1 -6,-0.1 -5,-0.1 0.408 360.0 360.0-130.5 360.0 34.3 29.2 77.6 284 ! 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 0.0 285 25 B F 0 0 85 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 -24.8 41.4 28.9 78.6 286 26 B G + 0 0 63 1,-0.2 2,-0.3 93,-0.0 0, 0.0 0.535 360.0 79.3 91.7 5.9 44.9 29.9 77.5 287 27 B Q - 0 0 42 159,-0.0 2,-0.4 2,-0.0 -1,-0.2 -0.993 54.0-161.9-137.7 150.6 44.0 33.3 75.9 288 28 B N - 0 0 60 -2,-0.3 2,-0.3 -3,-0.1 28,-0.0 -0.963 19.4-148.7-129.2 115.3 43.3 36.7 77.2 289 29 B F E -H 444 0C 10 155,-2.1 155,-2.7 -2,-0.4 2,-0.2 -0.648 20.8-111.3 -93.7 134.4 41.4 39.0 74.8 290 30 B L E +H 443 0C 19 -2,-0.3 153,-0.2 153,-0.2 -21,-0.2 -0.412 38.6 168.0 -63.5 128.3 41.9 42.8 74.7 291 31 B V + 0 0 17 151,-3.1 2,-0.6 -23,-0.2 152,-0.2 0.110 45.6 97.0-132.5 17.7 38.8 44.6 75.9 292 32 B S > - 0 0 25 150,-0.6 4,-2.8 1,-0.1 5,-0.1 -0.922 49.5-168.9-110.2 105.9 40.1 48.2 76.3 293 33 B E H > S+ 0 0 101 -2,-0.6 4,-2.6 -25,-0.5 5,-0.2 0.864 90.5 56.1 -59.4 -36.0 39.3 50.3 73.3 294 34 B A H > S+ 0 0 55 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.952 110.4 43.0 -61.4 -49.6 41.7 53.0 74.7 295 35 B H H > S+ 0 0 41 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.905 112.3 55.8 -61.2 -41.4 44.6 50.5 74.8 296 36 B L H X S+ 0 0 4 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.911 106.0 49.5 -55.5 -48.3 43.6 49.2 71.4 297 37 B R H X S+ 0 0 134 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.877 108.1 54.4 -60.9 -38.7 43.8 52.7 69.9 298 38 B R H X S+ 0 0 110 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.856 106.5 51.6 -64.8 -35.8 47.2 53.2 71.4 299 39 B I H X S+ 0 0 3 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.926 111.4 46.9 -65.4 -46.5 48.5 49.9 69.8 300 40 B V H >X S+ 0 0 8 -4,-2.1 4,-1.0 1,-0.2 3,-0.5 0.947 113.3 48.7 -59.6 -47.7 47.3 51.1 66.4 301 41 B E H >< S+ 0 0 93 -4,-2.7 3,-0.6 1,-0.2 -1,-0.2 0.887 108.9 54.2 -60.8 -38.0 48.9 54.5 66.9 302 42 B A H 3< S+ 0 0 6 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.808 106.6 51.5 -66.6 -30.6 52.1 52.8 68.0 303 43 B A H << S+ 0 0 2 -4,-1.5 -1,-0.2 -3,-0.5 -2,-0.2 0.670 94.9 144.9 -82.0 -18.8 52.3 50.7 64.8 304 44 B R << + 0 0 95 -4,-1.0 2,-0.1 -3,-0.6 -3,-0.0 -0.295 31.7 57.0 -67.1 156.9 51.9 53.7 62.5 305 45 B P - 0 0 75 0, 0.0 2,-2.1 0, 0.0 3,-0.2 0.493 67.7-148.5 -82.3 152.9 52.8 54.7 59.8 306 46 B F + 0 0 42 1,-0.2 -2,-0.1 21,-0.2 4,-0.1 -0.466 42.4 146.7 -84.4 66.9 51.6 51.7 57.7 307 47 B T + 0 0 106 -2,-2.1 -1,-0.2 2,-0.1 65,-0.1 0.586 67.5 24.0 -81.0 -13.4 54.4 52.1 55.2 308 48 B G S S- 0 0 12 -3,-0.2 22,-0.3 22,-0.1 64,-0.1 -0.897 102.8 -70.9-140.2 169.6 54.5 48.3 54.5 309 49 B P - 0 0 31 0, 0.0 64,-3.0 0, 0.0 2,-0.4 -0.324 49.0-126.4 -61.5 149.1 52.2 45.4 54.9 310 50 B V E -ij 331 373D 0 20,-3.4 22,-2.1 62,-0.2 2,-0.5 -0.841 14.2-161.8-101.4 134.8 51.3 44.3 58.5 311 51 B F E -ij 332 374D 10 62,-2.7 64,-2.8 -2,-0.4 2,-0.7 -0.979 12.4-162.3-111.3 117.6 51.7 40.7 59.7 312 52 B E E -ij 333 375D 4 20,-3.0 22,-2.9 -2,-0.5 2,-0.5 -0.899 0.8-162.0-107.1 111.8 49.7 40.3 62.9 313 53 B V E S+ij 334 376D 9 62,-2.3 64,-1.7 -2,-0.7 22,-0.2 -0.795 74.9 14.9 -93.5 126.7 50.6 37.3 65.0 314 54 B G - 0 0 17 20,-2.7 -1,-0.2 -2,-0.5 21,-0.2 0.971 65.3-179.9 77.4 58.8 47.9 36.3 67.5 315 55 B P > - 0 0 7 0, 0.0 3,-2.6 0, 0.0 4,-0.4 0.606 15.3-168.0 -65.4 -13.0 44.8 38.1 66.2 316 56 B G T 3 S- 0 0 9 1,-0.3 28,-0.2 2,-0.1 -2,-0.1 -0.450 72.3 -17.6 65.7-119.3 42.6 36.7 69.0 317 57 B L T 3 S- 0 0 9 -2,-0.3 -1,-0.3 -3,-0.1 30,-0.1 0.408 104.0 -98.2 -99.2 -4.1 39.0 37.5 68.1 318 58 B G S <> S+ 0 0 0 -3,-2.6 4,-3.0 -4,-0.1 5,-0.3 0.541 80.6 132.8 102.4 11.4 40.1 40.2 65.6 319 59 B A H > S+ 0 0 13 -4,-0.4 4,-1.9 -52,-0.2 -51,-0.1 0.947 84.5 35.8 -54.9 -53.2 39.8 43.4 67.5 320 60 B L H > S+ 0 0 17 -5,-0.3 4,-2.9 2,-0.2 5,-0.2 0.867 114.2 59.1 -72.6 -35.7 43.2 44.7 66.5 321 61 B T H > S+ 0 0 0 -6,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.952 109.3 43.3 -53.7 -53.0 42.9 43.2 63.0 322 62 B R H X S+ 0 0 50 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.906 113.9 51.2 -62.5 -42.0 39.7 45.2 62.3 323 63 B A H X S+ 0 0 13 -4,-1.9 4,-1.5 -5,-0.3 -1,-0.2 0.907 110.0 49.0 -62.8 -42.6 41.2 48.4 63.8 324 64 B L H <>S+ 0 0 0 -4,-2.9 5,-2.6 1,-0.2 3,-0.2 0.922 111.2 50.0 -62.8 -43.7 44.4 48.0 61.7 325 65 B L H ><5S+ 0 0 29 -4,-2.3 3,-1.2 1,-0.2 -2,-0.2 0.884 110.7 49.8 -62.2 -38.9 42.3 47.5 58.6 326 66 B E H 3<5S+ 0 0 133 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.746 105.8 57.1 -72.0 -24.4 40.2 50.6 59.4 327 67 B A T 3<5S- 0 0 26 -4,-1.5 -1,-0.3 -3,-0.2 -21,-0.2 0.319 128.5 -96.9 -86.9 3.6 43.4 52.6 59.9 328 68 B G T < 5S+ 0 0 59 -3,-1.2 -3,-0.2 1,-0.3 -2,-0.1 0.478 75.3 142.5 97.9 5.8 44.5 51.8 56.4 329 69 B A < - 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N 0 431D 51 -26,-2.3 -26,-2.2 -2,-0.4 -60,-0.2 -0.923 20.1-140.4-122.9 98.1 62.6 49.9 65.3 458 199 B P E - N 0 430D 31 0, 0.0 -28,-0.3 0, 0.0 -29,-0.1 -0.259 8.3-154.6 -56.9 145.8 65.3 48.0 63.5 459 200 B T - 0 0 97 -30,-2.2 -29,-0.1 2,-0.1 3,-0.1 0.622 50.9-100.6 -91.2 -16.7 68.4 49.8 62.3 460 201 B G S S+ 0 0 41 -31,-0.7 2,-0.2 1,-0.4 -30,-0.1 0.355 73.4 146.1 105.5 -3.7 69.1 47.3 59.5 461 202 B A - 0 0 23 -32,-0.4 -1,-0.4 -33,-0.1 -2,-0.1 -0.540 35.1-152.9 -65.3 131.6 71.8 45.4 61.4 462 203 B L - 0 0 15 1,-0.2 -70,-0.1 -2,-0.2 -356,-0.1 -0.329 38.3 -55.7 -92.4-179.3 71.7 41.7 60.4 463 204 B D - 0 0 20 -72,-0.7 -1,-0.2 -2,-0.1 -357,-0.2 -0.163 35.7-160.1 -57.1 149.5 72.8 38.8 62.6 464 205 B D > - 0 0 24 1,-0.1 4,-2.0 -3,-0.1 3,-0.2 -0.800 14.1-177.3-124.8 84.5 76.3 38.7 64.0 465 206 B P H > S+ 0 0 21 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.880 77.7 50.1 -58.9 -40.9 76.5 35.0 64.7 466 207 B G H > S+ 0 0 7 -363,-0.2 4,-1.7 1,-0.2 5,-0.1 0.884 109.4 52.8 -63.0 -40.0 80.0 35.0 66.3 467 208 B L H > S+ 0 0 0 -3,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.922 109.8 48.5 -58.8 -44.5 79.0 37.9 68.6 468 209 B F H X S+ 0 0 7 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.742 104.1 58.7 -77.5 -20.6 76.0 35.9 69.8 469 210 B R H X S+ 0 0 126 -4,-1.7 4,-2.2 -5,-0.2 -1,-0.2 0.927 110.1 44.5 -63.3 -44.4 78.0 32.8 70.5 470 211 B L H X S+ 0 0 1 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.955 114.7 48.1 -64.9 -49.6 80.1 34.9 72.9 471 212 B V H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 5,-0.2 0.932 112.8 47.2 -56.3 -50.2 77.1 36.5 74.5 472 213 B E H X S+ 0 0 105 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.907 113.9 48.5 -60.6 -42.3 75.2 33.3 74.9 473 214 B A H < S+ 0 0 17 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.891 107.7 55.6 -61.0 -41.3 78.3 31.6 76.4 474 215 B A H < S+ 0 0 2 -4,-2.8 37,-0.4 1,-0.2 3,-0.3 0.876 116.8 35.1 -62.9 -37.4 78.8 34.6 78.7 475 216 B F H < S+ 0 0 40 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.766 81.9 114.0 -87.4 -26.4 75.3 34.3 80.2 476 217 B G S < S+ 0 0 68 -4,-2.1 2,-0.4 -5,-0.2 -1,-0.2 0.516 82.7 32.9 -18.8 -38.6 75.1 30.4 80.1 477 218 B K S > S- 0 0 113 -3,-0.3 3,-0.6 -4,-0.3 -1,-0.1 -0.986 71.8-144.6-135.1 127.1 75.0 30.2 83.9 478 219 B R T 3 S+ 0 0 221 -2,-0.4 2,-1.6 1,-0.3 -1,-0.2 0.927 96.1 42.5 -49.9 -63.0 73.5 32.7 86.4 479 220 B R T 3 S+ 0 0 184 2,-0.0 2,-0.3 0, 0.0 -1,-0.3 -0.397 95.7 106.7 -91.7 61.3 75.9 32.4 89.3 480 221 B K < - 0 0 66 -2,-1.6 31,-0.4 -3,-0.6 -3,-0.1 -0.998 64.7-125.9-145.4 132.3 79.1 32.4 87.2 481 222 B T > - 0 0 3 -2,-0.3 4,-2.9 29,-0.1 29,-0.2 -0.288 32.5-111.2 -69.3 160.3 81.9 34.9 86.5 482 223 B L H > S+ 0 0 0 27,-2.6 4,-2.8 2,-0.2 5,-0.3 0.930 119.0 52.7 -58.6 -46.7 82.8 35.8 82.8 483 224 B L H > S+ 0 0 23 26,-0.5 4,-1.5 24,-0.2 -1,-0.2 0.912 115.6 40.3 -55.4 -47.0 86.2 34.0 83.2 484 225 B N H > S+ 0 0 63 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.837 114.8 51.1 -72.1 -37.0 84.5 30.8 84.5 485 226 B A H < S+ 0 0 4 -4,-2.9 4,-0.4 2,-0.2 -2,-0.2 0.913 113.1 44.9 -66.0 -43.7 81.5 31.0 82.1 486 227 B L H ><>S+ 0 0 0 -4,-2.8 5,-0.7 -5,-0.2 3,-0.6 0.831 108.8 58.1 -72.2 -31.5 83.7 31.4 79.0 487 228 B A H ><5S+ 0 0 29 -4,-1.5 3,-1.4 -5,-0.3 -1,-0.2 0.946 105.8 48.7 -56.8 -50.4 86.0 28.6 80.3 488 229 B A T 3<5S+ 0 0 81 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.612 109.4 57.2 -64.3 -13.4 83.0 26.2 80.3 489 230 B A T < 5S- 0 0 43 -3,-0.6 2,-0.3 -4,-0.4 -1,-0.3 0.053 122.2 -96.8-111.1 21.7 82.3 27.3 76.8 490 231 B G T < 5S+ 0 0 64 -3,-1.4 -3,-0.1 1,-0.3 -4,-0.1 -0.169 86.7 124.4 92.7 -41.7 85.6 26.5 75.0 491 232 B Y < - 0 0 43 -5,-0.7 -2,-0.3 -2,-0.3 -1,-0.3 -0.387 67.0-121.5 -55.2 113.5 87.0 30.1 75.3 492 233 B P > - 0 0 61 0, 0.0 4,-1.8 0, 0.0 5,-0.1 -0.308 7.5-129.0 -69.2 145.3 90.4 29.4 77.2 493 234 B K H > S+ 0 0 120 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.860 106.2 47.3 -63.4 -45.4 91.1 31.1 80.5 494 235 B A H > S+ 0 0 70 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.833 112.4 52.7 -64.9 -33.6 94.6 32.5 79.7 495 236 B R H > S+ 0 0 94 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.864 110.2 47.1 -69.0 -38.5 93.2 33.9 76.4 496 237 B V H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.900 110.3 51.5 -72.3 -42.0 90.3 35.6 78.2 497 238 B E H X S+ 0 0 84 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.909 111.5 48.2 -58.3 -44.4 92.5 37.2 80.9 498 239 B E H X S+ 0 0 122 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.847 111.4 50.5 -64.9 -39.0 94.8 38.6 78.2 499 240 B A H X S+ 0 0 8 -4,-1.6 4,-0.9 2,-0.2 -2,-0.2 0.916 111.4 47.8 -64.7 -45.8 91.8 39.9 76.3 500 241 B L H X>S+ 0 0 4 -4,-2.6 5,-2.1 2,-0.2 4,-1.5 0.872 109.1 52.9 -65.5 -41.3 90.4 41.7 79.4 501 242 B R H ><5S+ 0 0 166 -4,-2.4 3,-0.6 1,-0.2 -1,-0.2 0.944 108.0 51.4 -56.5 -49.1 93.8 43.2 80.3 502 243 B A H 3<5S+ 0 0 86 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.744 116.6 41.4 -60.6 -24.9 94.0 44.7 76.8 503 244 B L H 3<5S- 0 0 33 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.580 108.8-124.2 -97.1 -14.3 90.5 46.1 77.4 504 245 B G T <<5 + 0 0 67 -4,-1.5 -3,-0.2 -3,-0.6 -4,-0.1 0.841 57.8 148.4 71.6 36.1 91.1 47.2 81.0 505 246 B L < - 0 0 49 -5,-2.1 -1,-0.2 1,-0.1 -2,-0.1 -0.735 56.1 -90.5 -99.6 149.9 88.1 45.2 82.4 506 247 B P > - 0 0 69 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 -0.266 34.1-123.7 -57.9 145.7 88.1 43.7 86.0 507 248 B P T 3 S+ 0 0 98 0, 0.0 -24,-0.2 0, 0.0 -7,-0.1 0.695 109.2 37.4 -70.5 -22.3 89.4 40.1 86.1 508 249 B R T 3 S+ 0 0 161 -26,-0.1 -26,-0.1 -25,-0.1 -24,-0.0 -0.034 84.4 150.8-117.2 28.9 86.2 38.6 87.7 509 250 B V < - 0 0 5 -3,-1.4 -27,-2.6 -28,-0.1 -26,-0.5 -0.183 38.5-132.6 -54.7 150.6 83.7 40.8 85.7 510 251 B R > - 0 0 76 -29,-0.2 3,-2.0 -28,-0.1 4,-0.4 -0.797 16.9-115.9-110.3 154.7 80.3 39.2 85.1 511 252 B A G > S+ 0 0 5 -31,-0.4 3,-2.0 -37,-0.4 -36,-0.1 0.881 113.9 63.7 -53.1 -40.9 78.4 39.0 81.8 512 253 B E G 3 S+ 0 0 76 1,-0.3 -97,-2.3 -38,-0.1 -1,-0.3 0.647 97.9 57.5 -62.7 -14.7 75.6 41.2 83.3 513 254 B E G < S+ 0 0 71 -3,-2.0 2,-0.5 -99,-0.2 -1,-0.3 0.613 89.7 88.5 -89.9 -14.3 78.1 44.0 83.6 514 255 B L < - 0 0 2 -3,-2.0 -99,-0.1 -4,-0.4 2,-0.1 -0.739 62.2-153.8 -92.7 128.1 79.0 44.2 79.9 515 256 B D > - 0 0 79 -2,-0.5 4,-2.4 -101,-0.1 5,-0.2 -0.314 40.4 -92.3 -82.2 177.1 77.1 46.3 77.5 516 257 B L H > S+ 0 0 23 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.898 126.9 54.6 -59.4 -41.0 76.9 45.4 73.7 517 258 B E H > S+ 0 0 95 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.900 108.3 48.8 -57.9 -44.4 79.9 47.6 73.0 518 259 B A H > S+ 0 0 15 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.907 110.4 50.7 -65.0 -40.6 82.0 45.7 75.5 519 260 B F H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.915 111.1 49.3 -61.7 -41.7 80.9 42.4 74.1 520 261 B R H X S+ 0 0 106 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.889 114.0 45.4 -62.2 -41.0 81.9 43.7 70.6 521 262 B R H X S+ 0 0 114 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.913 113.8 49.7 -70.5 -41.1 85.2 44.8 71.9 522 263 B L H X S+ 0 0 0 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.898 110.0 50.0 -60.4 -44.5 85.7 41.5 73.8 523 264 B R H X S+ 0 0 58 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.935 111.9 48.1 -61.1 -46.2 84.8 39.4 70.8 524 265 B E H < S+ 0 0 153 -4,-1.9 -1,-0.2 3,-0.3 -2,-0.2 0.821 110.4 52.8 -63.8 -36.4 87.3 41.4 68.6 525 266 B G H < S+ 0 0 37 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.870 109.9 46.3 -66.3 -41.6 90.0 41.0 71.3 526 267 B L H < 0 0 10 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.888 360.0 360.0 -67.4 -41.2 89.6 37.2 71.4 527 268 B E < 0 0 184 -4,-2.5 -3,-0.3 -5,-0.2 -2,-0.1 0.381 360.0 360.0 146.6 360.0 89.6 37.3 67.6