==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER NUCLEOTIDYLTRANSFERASE 06-JUL-01 1H7H . COMPND 2 MOLECULE: 3-DEOXY-MANNO-OCTULOSONATE CYTIDYLYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.JELAKOVIC,G.E.SCHULZ . 486 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20954.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 342 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 43 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 11.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 32 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 123 25.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 2 4 0 0 3 1 2 0 3 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 3 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 PARALLEL BRIDGES PER LADDER . 4 2 0 4 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 A S 0 0 90 0, 0.0 2,-0.4 0, 0.0 114,-0.0 0.000 360.0 360.0 360.0 99.6 39.5 100.9 68.3 2 2 A K - 0 0 75 41,-0.1 88,-2.7 42,-0.0 89,-2.0 -0.685 360.0-172.0 -87.2 133.2 36.0 102.0 69.4 3 3 A A E -a 91 0A 1 39,-0.4 41,-2.7 -2,-0.4 42,-0.6 -0.976 3.5-175.5-127.3 137.4 33.5 99.4 70.7 4 4 A V E -ab 92 45A 0 87,-2.2 89,-2.4 -2,-0.4 2,-0.5 -0.930 19.7-132.4-129.5 154.0 29.9 99.7 71.5 5 5 A I E -ab 93 46A 0 40,-2.5 42,-3.0 -2,-0.3 2,-0.4 -0.917 17.4-167.1-109.0 130.9 27.3 97.4 72.9 6 6 A V E -ab 94 47A 0 87,-3.0 89,-2.3 -2,-0.5 42,-0.2 -0.981 3.5-163.1-118.3 128.7 23.9 97.0 71.3 7 7 A I E - b 0 48A 0 40,-2.6 42,-1.5 -2,-0.4 2,-0.3 -0.910 11.1-149.5-115.3 98.8 21.0 95.3 73.1 8 8 A P E - b 0 49A 20 0, 0.0 89,-0.9 0, 0.0 2,-0.3 -0.562 19.1-178.7 -68.5 126.2 18.2 94.2 70.8 9 9 A A - 0 0 2 40,-3.3 42,-0.4 -2,-0.3 43,-0.4 -0.726 5.8-177.3-136.5 89.3 15.0 94.3 72.8 10 10 A R - 0 0 138 -2,-0.3 9,-0.2 40,-0.2 40,-0.1 -0.638 14.7-155.9 -83.7 134.7 11.8 93.3 71.0 11 11 A Y + 0 0 48 -2,-0.3 7,-1.5 7,-0.1 8,-1.0 0.966 68.8 88.3 -74.4 -57.3 8.6 93.6 73.0 12 12 A G + 0 0 50 5,-0.2 2,-0.3 6,-0.1 -2,-0.1 -0.218 51.7 154.8 -51.0 114.7 6.5 91.1 71.1 13 13 A S - 0 0 36 1,-0.2 3,-0.1 -2,-0.1 -2,-0.0 -0.990 37.8-142.1-147.2 133.9 7.0 87.6 72.6 14 14 A S S S+ 0 0 117 -2,-0.3 -1,-0.2 1,-0.2 -2,-0.0 0.986 99.5 24.6 -58.6 -71.2 4.6 84.6 72.5 15 15 A R S S+ 0 0 166 1,-0.3 -1,-0.2 210,-0.0 210,-0.0 0.333 136.9 34.4 -82.3 8.1 5.0 82.8 75.8 16 16 A L S > S- 0 0 19 -3,-0.1 3,-0.7 210,-0.1 -1,-0.3 -0.406 77.1-159.8-160.8 73.4 6.2 86.1 77.5 17 17 A P T 3 S+ 0 0 90 0, 0.0 -5,-0.2 0, 0.0 -3,-0.1 -0.371 84.5 11.2 -60.8 125.7 4.5 89.3 76.1 18 18 A G T > S+ 0 0 4 -7,-1.5 3,-0.8 -2,-0.1 4,-0.3 0.963 80.4 172.5 68.5 51.3 6.7 92.3 77.0 19 19 A K G X + 0 0 31 -8,-1.0 3,-1.5 -3,-0.7 10,-0.3 0.897 69.8 54.8 -60.6 -45.3 9.6 90.1 78.1 20 20 A P G 3 S+ 0 0 5 0, 0.0 10,-2.9 0, 0.0 11,-0.3 0.681 105.6 55.7 -66.6 -13.4 12.2 93.0 78.5 21 21 A L G < S+ 0 0 54 -3,-0.8 -2,-0.2 7,-0.2 -3,-0.1 0.482 76.7 123.2 -96.8 -3.2 9.8 94.8 80.9 22 22 A L < - 0 0 38 -3,-1.5 7,-1.9 -4,-0.3 2,-0.3 -0.330 67.2-112.2 -60.7 137.5 9.3 91.8 83.3 23 23 A D E +J 28 0B 85 5,-0.2 2,-0.4 6,-0.1 -1,-0.1 -0.535 35.3 176.2 -78.6 133.1 10.2 92.8 86.9 24 24 A I E > S-J 27 0B 0 3,-2.4 3,-1.8 -2,-0.3 8,-0.1 -0.957 76.6 -26.1-137.0 113.0 13.2 91.2 88.6 25 25 A V T 3 S- 0 0 55 -2,-0.4 -2,-0.0 1,-0.3 -1,-0.0 0.864 128.5 -45.2 46.1 46.1 14.0 92.5 92.1 26 26 A G T 3 S+ 0 0 57 1,-0.2 -1,-0.3 0, 0.0 -3,-0.1 0.393 122.7 88.1 86.6 -3.6 12.4 95.8 91.4 27 27 A K E < S-J 24 0B 66 -3,-1.8 -3,-2.4 -5,-0.1 -1,-0.2 -0.964 80.9-106.2-128.1 145.3 13.8 96.6 88.0 28 28 A P E >> -J 23 0B 32 0, 0.0 4,-1.2 0, 0.0 3,-0.9 -0.357 37.3-112.9 -66.3 149.8 12.6 95.7 84.5 29 29 A M H 3> S+ 0 0 0 -7,-1.9 4,-1.6 -10,-0.3 3,-0.4 0.876 115.5 59.2 -50.1 -43.4 14.7 92.9 82.9 30 30 A I H 3> S+ 0 0 0 -10,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.851 101.8 55.9 -57.9 -32.8 16.1 95.3 80.2 31 31 A Q H <> S+ 0 0 35 -3,-0.9 4,-3.1 -11,-0.3 -1,-0.2 0.896 102.9 53.8 -67.5 -40.9 17.5 97.5 83.0 32 32 A H H X S+ 0 0 16 -4,-1.2 4,-1.8 -3,-0.4 -1,-0.2 0.892 111.1 45.9 -60.3 -42.0 19.5 94.6 84.5 33 33 A V H X S+ 0 0 1 -4,-1.6 4,-2.6 64,-0.2 -2,-0.2 0.939 113.7 49.3 -66.4 -45.2 21.1 93.9 81.2 34 34 A Y H X S+ 0 0 18 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.916 110.1 50.2 -60.6 -46.9 21.9 97.6 80.6 35 35 A E H X S+ 0 0 61 -4,-3.1 4,-0.5 1,-0.2 -1,-0.2 0.882 113.4 45.8 -61.3 -38.6 23.4 98.1 84.0 36 36 A R H >< S+ 0 0 37 -4,-1.8 3,-1.2 -5,-0.2 -2,-0.2 0.895 108.2 56.0 -71.9 -37.9 25.7 95.0 83.5 37 37 A A H >< S+ 0 0 1 -4,-2.6 3,-1.6 1,-0.3 -2,-0.2 0.874 102.1 58.8 -59.7 -37.0 26.6 96.2 80.0 38 38 A L H 3< S+ 0 0 106 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.719 96.3 62.4 -64.6 -23.4 27.8 99.5 81.6 39 39 A Q T << S+ 0 0 113 -3,-1.2 2,-0.6 -4,-0.5 -1,-0.3 0.449 78.1 109.0 -82.3 -1.6 30.2 97.5 83.8 40 40 A V X - 0 0 8 -3,-1.6 3,-1.0 -4,-0.2 65,-0.1 -0.678 68.4-133.7 -82.2 117.7 32.1 96.3 80.7 41 41 A A T 3 S+ 0 0 66 -2,-0.6 3,-0.1 1,-0.2 -2,-0.1 -0.361 84.0 29.0 -68.7 148.0 35.5 97.9 80.4 42 42 A G T 3 S+ 0 0 46 1,-0.2 2,-0.5 -2,-0.1 -39,-0.4 0.496 87.3 123.2 82.8 3.3 36.6 99.3 77.1 43 43 A V < - 0 0 30 -3,-1.0 -1,-0.2 1,-0.1 -39,-0.2 -0.871 43.0-166.1-102.4 131.3 33.1 100.1 75.8 44 44 A A + 0 0 63 -41,-2.7 2,-0.3 -2,-0.5 -40,-0.2 0.904 69.3 6.1 -79.4 -48.7 32.3 103.6 74.7 45 45 A E E -b 4 0A 42 -42,-0.6 -40,-2.5 2,-0.0 2,-0.4 -0.979 55.1-149.8-140.4 155.1 28.5 103.4 74.5 46 46 A V E -b 5 0A 5 -2,-0.3 19,-0.5 -42,-0.2 2,-0.3 -0.993 23.1-178.1-126.0 125.9 25.6 101.1 75.3 47 47 A W E -bc 6 65A 51 -42,-3.0 -40,-2.6 -2,-0.4 2,-0.5 -0.907 22.3-142.8-125.1 156.6 22.4 101.2 73.2 48 48 A V E -bc 7 66A 0 17,-1.8 19,-2.5 -2,-0.3 2,-0.6 -0.976 15.6-155.7-119.5 119.5 19.1 99.4 73.2 49 49 A A E +bc 8 67A 0 -42,-1.5 -40,-3.3 -2,-0.5 2,-0.3 -0.877 26.7 162.1 -97.7 123.6 17.6 98.7 69.8 50 50 A T E - c 0 68A 0 17,-2.1 19,-2.9 -2,-0.6 -40,-0.2 -0.936 42.8-157.8-141.8 163.7 13.9 98.3 69.8 51 51 A D S S+ 0 0 27 -42,-0.4 20,-0.1 -2,-0.3 -41,-0.1 0.404 78.7 75.0-116.7 -3.3 10.8 98.3 67.6 52 52 A D >> - 0 0 27 -43,-0.4 4,-1.7 1,-0.1 3,-1.1 -0.951 67.3-147.1-119.5 127.9 8.2 99.1 70.4 53 53 A P H 3> S+ 0 0 71 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.708 98.4 63.5 -61.0 -25.3 7.7 102.6 72.0 54 54 A R H 3> S+ 0 0 132 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.823 107.1 43.5 -69.8 -31.6 6.8 101.0 75.4 55 55 A V H <> S+ 0 0 0 -3,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.872 112.5 52.3 -78.5 -39.2 10.3 99.6 75.5 56 56 A E H X S+ 0 0 47 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.874 112.0 47.1 -63.2 -38.4 11.9 102.8 74.3 57 57 A Q H X S+ 0 0 111 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.894 110.5 50.6 -70.1 -41.3 10.0 104.7 77.1 58 58 A A H X S+ 0 0 25 -4,-1.6 4,-0.7 2,-0.2 -2,-0.2 0.865 112.5 48.3 -63.9 -37.6 11.0 102.2 79.8 59 59 A V H ><>S+ 0 0 0 -4,-2.2 5,-2.7 2,-0.2 3,-0.8 0.915 112.5 46.0 -69.3 -46.3 14.6 102.5 78.7 60 60 A Q H ><5S+ 0 0 83 -4,-2.0 3,-2.0 1,-0.2 -2,-0.2 0.866 102.0 68.5 -65.1 -34.4 14.6 106.3 78.7 61 61 A A H 3<5S+ 0 0 87 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.779 106.0 39.1 -56.5 -32.3 12.8 106.3 82.0 62 62 A F T <<5S- 0 0 56 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.357 125.9-103.7 -99.9 8.9 16.0 104.9 83.7 63 63 A G T < 5S+ 0 0 64 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.626 71.4 144.5 83.7 16.0 18.2 107.2 81.5 64 64 A G < - 0 0 7 -5,-2.7 2,-0.5 -6,-0.1 -1,-0.2 -0.441 54.8-103.5 -85.5 161.3 19.4 104.6 79.0 65 65 A K E -c 47 0A 89 -19,-0.5 -17,-1.8 -2,-0.1 2,-0.3 -0.736 41.7-177.6 -86.8 125.0 20.1 105.2 75.3 66 66 A A E -c 48 0A 17 -2,-0.5 2,-0.4 -19,-0.2 -17,-0.2 -0.933 12.1-166.9-124.2 146.3 17.4 103.8 73.0 67 67 A I E -c 49 0A 19 -19,-2.5 -17,-2.1 -2,-0.3 2,-0.3 -0.988 19.9-131.8-135.8 122.6 17.1 103.7 69.2 68 68 A M E -c 50 0A 76 -2,-0.4 2,-0.3 -19,-0.2 -17,-0.2 -0.549 29.3-178.7 -74.2 134.9 13.9 102.8 67.3 69 69 A T - 0 0 11 -19,-2.9 10,-0.1 -2,-0.3 2,-0.1 -0.770 36.3 -74.7-126.1 170.9 14.4 100.3 64.5 70 70 A R > - 0 0 127 -2,-0.3 3,-0.6 1,-0.1 -1,-0.1 -0.372 27.2-144.8 -68.4 146.8 12.0 98.8 61.9 71 71 A N T 3 S+ 0 0 109 1,-0.2 -1,-0.1 -20,-0.1 -20,-0.1 0.601 92.5 76.4 -85.6 -13.7 9.6 96.1 63.1 72 72 A D T 3 + 0 0 108 2,-0.0 2,-0.3 -21,-0.0 -1,-0.2 0.312 67.0 124.4 -78.4 6.4 9.9 94.2 59.8 73 73 A H < - 0 0 12 -3,-0.6 3,-0.0 1,-0.1 -22,-0.0 -0.555 51.0-157.8 -71.1 128.7 13.3 92.9 61.0 74 74 A E + 0 0 144 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.709 69.2 9.6 -82.2 -17.5 13.5 89.1 60.9 75 75 A S S > S- 0 0 24 1,-0.0 4,-1.6 126,-0.0 5,-0.1 -0.945 75.7-100.7-154.4 172.4 16.3 88.8 63.4 76 76 A G H > S+ 0 0 28 -2,-0.3 4,-0.9 1,-0.2 -1,-0.0 0.658 117.8 55.9 -71.4 -18.2 18.5 90.5 66.0 77 77 A T H > S+ 0 0 11 2,-0.2 4,-1.5 1,-0.1 -1,-0.2 0.827 104.5 50.4 -83.0 -34.6 21.4 90.7 63.4 78 78 A D H > S+ 0 0 24 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.902 109.9 52.7 -67.4 -37.8 19.3 92.6 60.8 79 79 A R H X S+ 0 0 7 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.851 106.7 52.8 -64.5 -35.4 18.4 95.0 63.6 80 80 A L H X S+ 0 0 0 -4,-0.9 4,-2.2 1,-0.2 -1,-0.2 0.831 102.3 58.7 -69.8 -34.9 22.0 95.5 64.4 81 81 A V H X S+ 0 0 15 -4,-1.5 4,-0.9 1,-0.2 -1,-0.2 0.881 106.1 49.1 -62.1 -38.3 22.9 96.3 60.8 82 82 A E H X S+ 0 0 25 -4,-1.3 4,-0.8 1,-0.2 3,-0.4 0.873 111.0 48.9 -68.9 -39.2 20.4 99.3 60.9 83 83 A V H >X S+ 0 0 0 -4,-1.4 4,-3.4 1,-0.2 3,-0.6 0.867 102.2 65.5 -67.0 -36.2 21.9 100.6 64.1 84 84 A M H 3< S+ 0 0 1 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.816 96.4 54.9 -55.6 -36.6 25.4 100.3 62.6 85 85 A H H 3< S+ 0 0 132 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.848 118.6 33.3 -68.4 -34.2 24.6 103.0 60.0 86 86 A K H << S+ 0 0 147 -4,-0.8 2,-0.7 -3,-0.6 -2,-0.2 0.854 116.2 55.4 -89.5 -41.9 23.6 105.5 62.7 87 87 A V S < S- 0 0 9 -4,-3.4 2,-0.3 -5,-0.1 -1,-0.2 -0.861 79.9-144.4-100.3 115.3 26.0 104.5 65.5 88 88 A E + 0 0 137 -2,-0.7 2,-0.3 -3,-0.1 -3,-0.1 -0.593 37.1 131.9 -83.8 134.7 29.6 104.5 64.6 89 89 A A - 0 0 1 -2,-0.3 -86,-0.2 -5,-0.2 3,-0.1 -0.959 52.8-133.6-167.4 164.0 32.1 102.0 66.0 90 90 A D S S+ 0 0 74 -88,-2.7 90,-2.2 1,-0.3 2,-0.4 0.739 98.8 34.3 -95.3 -31.5 34.8 99.6 64.9 91 91 A I E -aD 3 179A 0 -89,-2.0 -87,-2.2 88,-0.2 2,-0.5 -0.989 68.9-164.1-129.6 123.2 33.5 96.7 67.0 92 92 A Y E -aD 4 178A 0 86,-2.8 86,-3.1 -2,-0.4 2,-0.5 -0.921 5.8-158.1-109.0 128.6 29.8 96.0 67.7 93 93 A I E -aD 5 177A 0 -89,-2.4 -87,-3.0 -2,-0.5 2,-0.7 -0.919 6.3-150.6-108.5 127.1 28.8 93.6 70.5 94 94 A N E -aD 6 176A 4 82,-3.1 82,-1.4 -2,-0.5 2,-0.4 -0.880 16.6-175.5-100.4 113.2 25.3 92.0 70.4 95 95 A L - 0 0 5 -89,-2.3 2,-0.3 -2,-0.7 80,-0.1 -0.885 27.7-114.5-108.9 142.9 23.9 91.2 73.8 96 96 A Q > - 0 0 64 -2,-0.4 3,-1.0 -89,-0.1 -87,-0.1 -0.535 12.5-146.6 -75.8 133.5 20.6 89.4 74.4 97 97 A G T 3 S+ 0 0 8 -89,-0.9 -64,-0.2 -2,-0.3 -1,-0.1 0.630 95.9 55.0 -74.6 -12.0 17.9 91.5 76.0 98 98 A D T 3 S+ 0 0 26 1,-0.1 126,-0.9 -65,-0.1 -1,-0.2 0.203 85.3 82.9-106.5 13.6 16.5 88.5 77.9 99 99 A E X + 0 0 46 -3,-1.0 3,-1.2 124,-0.2 -1,-0.1 -0.668 46.4 166.4-118.8 78.8 19.7 87.3 79.6 100 100 A P T 3 + 0 0 0 0, 0.0 -1,-0.1 0, 0.0 123,-0.1 0.587 68.5 66.5 -67.2 -13.9 19.9 89.4 82.8 101 101 A M T 3 + 0 0 27 121,-0.3 120,-0.3 120,-0.1 122,-0.1 0.251 69.0 141.8 -97.0 16.6 22.5 87.2 84.5 102 102 A I < - 0 0 13 -3,-1.2 3,-0.1 1,-0.1 -7,-0.0 -0.202 50.3-129.2 -56.9 138.8 25.3 88.0 82.0 103 103 A R >> - 0 0 77 1,-0.1 3,-1.2 118,-0.1 4,-1.1 -0.866 3.9-146.2 -97.1 120.1 28.8 88.4 83.5 104 104 A P H 3> S+ 0 0 12 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.824 98.8 62.0 -51.5 -33.0 30.6 91.6 82.5 105 105 A R H 3> S+ 0 0 143 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.861 98.5 54.9 -63.8 -36.4 33.9 89.6 82.6 106 106 A D H <> S+ 0 0 16 -3,-1.2 4,-1.7 1,-0.2 -1,-0.2 0.872 106.7 50.1 -65.5 -38.0 32.7 87.3 79.8 107 107 A V H X S+ 0 0 1 -4,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.871 108.3 53.9 -68.6 -34.7 32.0 90.2 77.5 108 108 A E H X S+ 0 0 47 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.858 104.7 54.0 -66.8 -34.9 35.4 91.6 78.2 109 109 A T H X S+ 0 0 59 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.919 110.1 48.0 -62.5 -44.0 37.0 88.2 77.2 110 110 A L H X S+ 0 0 0 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.908 113.0 47.1 -62.6 -45.2 35.1 88.5 73.9 111 111 A L H X S+ 0 0 5 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.851 110.2 52.1 -67.0 -39.7 36.3 92.1 73.4 112 112 A Q H X S+ 0 0 103 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.865 106.5 55.1 -65.9 -35.6 39.9 91.3 74.2 113 113 A G H X S+ 0 0 9 -4,-1.8 4,-0.6 1,-0.2 -2,-0.2 0.919 108.7 47.6 -63.0 -42.4 39.8 88.5 71.7 114 114 A M H >< S+ 0 0 0 -4,-1.6 3,-0.6 1,-0.2 6,-0.3 0.890 114.1 46.3 -65.3 -42.3 38.7 90.9 69.0 115 115 A R H 3< S+ 0 0 84 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.821 107.0 57.8 -72.0 -29.6 41.4 93.4 69.9 116 116 A D H 3< S+ 0 0 119 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.613 114.7 37.8 -76.3 -13.0 44.1 90.8 70.1 117 117 A D X< - 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0 0 22 1,-0.1 212,-0.0 6,-0.1 -2,-0.0 -0.824 39.0-132.5-174.0 133.2 40.2 41.9 57.6 260 14 B S S S+ 0 0 124 -2,-0.2 -1,-0.1 1,-0.2 -2,-0.0 0.863 109.1 26.6 -61.8 -36.7 38.0 40.8 60.5 261 15 B R S S+ 0 0 153 210,-0.2 -1,-0.2 1,-0.2 210,-0.1 0.671 133.4 30.1-100.2 -22.5 35.1 39.7 58.3 262 16 B L S > S- 0 0 18 210,-0.1 3,-1.0 208,-0.1 -1,-0.2 -0.549 75.1-156.8-140.7 74.1 36.9 38.8 55.1 263 17 B P T 3 S+ 0 0 90 0, 0.0 -5,-0.2 0, 0.0 -3,-0.1 -0.181 84.1 16.9 -51.3 136.5 40.5 37.6 55.6 264 18 B G T > S+ 0 0 5 -7,-1.4 3,-1.7 2,-0.1 4,-0.3 0.811 82.2 167.3 66.5 33.4 42.6 38.1 52.4 265 19 B K G X + 0 0 28 -3,-1.0 3,-1.9 -8,-0.9 10,-0.3 0.812 63.5 59.0 -48.1 -49.4 40.0 40.5 51.1 266 20 B P G 3 S+ 0 0 6 0, 0.0 10,-2.5 0, 0.0 11,-0.3 0.718 106.3 52.2 -59.1 -17.5 42.0 42.0 48.1 267 21 B L G < S+ 0 0 55 -3,-1.7 -2,-0.2 7,-0.2 2,-0.1 0.411 77.6 125.2 -99.0 1.4 42.3 38.6 46.6 268 22 B L < - 0 0 40 -3,-1.9 7,-2.0 -4,-0.3 2,-0.3 -0.402 66.3-114.0 -65.0 132.4 38.6 37.6 46.7 269 23 B D E -T 274 0D 80 5,-0.2 2,-0.5 -2,-0.1 -1,-0.1 -0.510 32.7-178.8 -73.4 128.6 37.4 36.6 43.3 270 24 B I E > S-T 273 0D 0 3,-2.9 3,-1.7 -2,-0.3 207,-0.0 -0.969 74.6 -33.6-129.5 109.3 34.8 38.8 41.6 271 25 B V T 3 S- 0 0 65 -2,-0.5 -1,-0.0 1,-0.3 -2,-0.0 0.824 129.0 -36.3 44.1 47.1 33.7 37.5 38.2 272 26 B G T 3 S+ 0 0 60 1,-0.2 -1,-0.3 0, 0.0 -3,-0.1 0.240 125.3 76.6 100.5 -14.6 37.1 36.0 37.3 273 27 B K E < S-T 270 0D 70 -3,-1.7 -3,-2.9 -5,-0.1 -1,-0.2 -0.964 83.1-104.5-131.5 146.8 39.5 38.5 38.8 274 28 B P E >> -T 269 0D 27 0, 0.0 3,-1.2 0, 0.0 4,-1.1 -0.368 39.8-111.5 -65.2 149.2 40.7 39.3 42.4 275 29 B M H 3> S+ 0 0 1 -7,-2.0 4,-1.6 -10,-0.3 3,-0.5 0.864 115.7 59.2 -49.7 -40.4 39.1 42.4 43.8 276 30 B I H 3> S+ 0 0 0 -10,-2.5 4,-2.4 1,-0.2 -1,-0.3 0.832 100.6 56.0 -61.6 -32.2 42.4 44.3 43.7 277 31 B Q H <> S+ 0 0 31 -3,-1.2 4,-2.5 -11,-0.3 -1,-0.2 0.867 103.5 54.2 -69.2 -35.8 42.7 43.8 40.0 278 32 B H H X S+ 0 0 15 -4,-1.1 4,-1.6 -3,-0.5 -1,-0.2 0.918 111.7 44.1 -62.9 -44.0 39.4 45.5 39.3 279 33 B V H X S+ 0 0 1 -4,-1.6 4,-2.3 64,-0.2 -2,-0.2 0.935 114.4 50.1 -65.9 -45.9 40.4 48.6 41.3 280 34 B Y H X S+ 0 0 13 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.881 109.6 50.0 -61.0 -43.0 43.8 48.7 39.6 281 35 B E H < S+ 0 0 61 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.872 112.3 47.1 -66.2 -36.9 42.4 48.4 36.1 282 36 B R H >< S+ 0 0 37 -4,-1.6 3,-1.3 1,-0.2 4,-0.2 0.877 107.5 56.7 -71.9 -35.9 39.9 51.2 36.6 283 37 B A H >< S+ 0 0 2 -4,-2.3 3,-1.4 1,-0.3 -1,-0.2 0.844 101.0 59.1 -62.5 -33.4 42.7 53.3 38.2 284 38 B L T 3< S+ 0 0 105 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.650 96.2 62.7 -69.3 -17.3 44.6 52.9 34.9 285 39 B Q T < S+ 0 0 124 -3,-1.3 2,-0.6 -4,-0.3 -1,-0.3 0.474 77.6 108.1 -86.8 -1.9 41.7 54.4 33.0 286 40 B V X - 0 0 10 -3,-1.4 3,-1.0 -4,-0.2 65,-0.1 -0.679 67.4-136.8 -81.9 115.2 42.1 57.8 34.8 287 41 B A T 3 S+ 0 0 64 -2,-0.6 3,-0.1 1,-0.2 -2,-0.1 -0.375 82.3 32.6 -70.5 146.5 43.6 60.4 32.5 288 42 B G T 3 S+ 0 0 44 1,-0.3 -39,-0.4 -2,-0.1 2,-0.4 0.432 86.5 119.7 89.8 -0.1 46.3 62.7 33.9 289 43 B V < - 0 0 32 -3,-1.0 -1,-0.3 1,-0.1 -39,-0.2 -0.830 45.4-163.8-101.9 136.8 47.9 60.2 36.2 290 44 B A S S+ 0 0 65 -41,-2.8 2,-0.3 -2,-0.4 -40,-0.2 0.822 70.5 8.0 -86.0 -35.4 51.6 59.1 35.8 291 45 B E E -l 250 0C 46 -42,-0.7 -40,-2.6 2,-0.0 2,-0.4 -0.995 53.8-151.4-149.7 153.5 51.6 56.0 37.9 292 46 B V E -l 251 0C 9 -2,-0.3 19,-0.5 -42,-0.2 2,-0.4 -0.993 21.4-177.7-128.6 122.8 49.4 53.6 39.8 293 47 B W E -l 252 0C 51 -42,-2.9 -40,-2.5 -2,-0.4 2,-0.5 -0.932 22.5-146.2-125.4 147.1 50.7 51.6 42.9 294 48 B V E -lm 253 312C 0 17,-1.7 19,-2.7 -2,-0.4 2,-0.6 -0.949 17.5-155.8-108.8 122.3 49.2 49.1 45.2 295 49 B A E +lm 254 313C 0 -42,-2.3 -40,-2.7 -2,-0.5 2,-0.3 -0.935 26.7 163.7-101.9 118.5 50.6 49.5 48.7 296 50 B T E - 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0 0 38 -5,-2.3 -1,-0.3 -6,-0.1 2,-0.2 -0.741 44.5-124.3 -86.5 125.4 43.7 72.3 56.7 457 211 B N - 0 0 54 -2,-0.5 -89,-1.0 -62,-0.0 2,-0.5 -0.467 22.0-165.6 -73.0 140.1 41.0 72.9 54.1 458 212 B I E -p 368 0C 0 -62,-0.3 -62,-2.6 -2,-0.2 2,-0.4 -0.962 6.8-154.8-128.3 109.9 39.2 70.0 52.4 459 213 B R E -pS 369 395C 28 -91,-2.4 -89,-2.5 -2,-0.5 2,-0.6 -0.731 8.9-150.7 -87.9 136.1 37.2 70.7 49.3 460 214 B T E -p 370 0C 2 -66,-3.0 2,-0.4 -2,-0.4 -89,-0.2 -0.924 5.4-158.8-112.3 116.1 34.3 68.3 48.6 461 215 B F E -p 371 0C 30 -91,-2.6 -89,-1.5 -2,-0.6 2,-0.4 -0.770 17.0-128.8 -95.8 134.1 33.2 67.7 45.0 462 216 B E E +p 372 0C 86 -2,-0.4 2,-0.2 -91,-0.2 -89,-0.2 -0.636 33.0 165.0 -87.7 131.5 29.7 66.3 44.3 463 217 B V - 0 0 17 -91,-2.6 -89,-0.4 -2,-0.4 3,-0.1 -0.742 41.7 -77.1-130.6 178.0 29.2 63.2 42.1 464 218 B A S S- 0 0 65 -2,-0.2 -1,-0.1 1,-0.2 -92,-0.0 -0.382 70.5 -66.3 -76.0 159.1 26.4 60.7 41.4 465 219 B A - 0 0 68 1,-0.1 2,-0.2 -2,-0.1 -1,-0.2 -0.139 60.9-137.3 -47.5 133.6 25.5 57.9 43.8 466 220 B T - 0 0 39 1,-0.1 -118,-0.1 -3,-0.1 -1,-0.1 -0.522 15.4 -96.2 -97.0 163.7 28.4 55.4 44.0 467 221 B G - 0 0 25 -120,-0.3 -1,-0.1 -2,-0.2 2,-0.1 -0.309 49.2 -91.4 -73.6 158.0 28.5 51.6 44.1 468 222 B P - 0 0 43 0, 0.0 -121,-0.3 0, 0.0 -1,-0.1 -0.352 35.4-127.6 -72.1 150.4 28.8 49.7 47.4 469 223 B G - 0 0 16 -124,-0.1 2,-0.7 -123,-0.1 3,-0.2 -0.372 22.2-110.9 -88.2 173.2 32.1 48.7 49.0 470 224 B V + 0 0 0 -126,-2.4 -208,-0.1 1,-0.2 -125,-0.0 -0.834 64.4 124.0-114.1 97.0 33.1 45.2 50.1 471 225 B D S S+ 0 0 85 -2,-0.7 -210,-0.2 1,-0.2 -1,-0.2 0.694 70.5 40.7-115.1 -41.2 33.4 44.8 53.9 472 226 B T S > S- 0 0 42 -3,-0.2 4,-1.9 1,-0.1 3,-0.4 -0.780 83.9-115.0-111.6 155.4 31.0 42.0 54.7 473 227 B P H > S+ 0 0 62 0, 0.0 4,-1.2 0, 0.0 5,-0.1 0.717 117.7 59.4 -61.9 -16.4 30.4 38.7 52.8 474 228 B A H > S+ 0 0 69 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.901 105.3 46.0 -76.3 -42.7 26.9 40.0 52.1 475 229 B C H > S+ 0 0 29 -3,-0.4 4,-2.5 1,-0.2 5,-0.2 0.851 108.2 58.6 -67.0 -35.4 28.2 43.1 50.3 476 230 B L H X S+ 0 0 8 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.879 105.3 48.6 -61.7 -40.1 30.6 40.8 48.4 477 231 B E H X S+ 0 0 111 -4,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.832 111.9 50.0 -69.9 -31.7 27.7 38.8 47.0 478 232 B K H X S+ 0 0 93 -4,-1.3 4,-2.6 2,-0.2 -2,-0.2 0.902 110.5 48.2 -72.7 -42.7 25.9 42.0 46.0 479 233 B V H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.890 109.4 54.0 -64.9 -39.5 28.9 43.4 44.2 480 234 B R H X S+ 0 0 69 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.923 111.2 45.7 -60.4 -44.3 29.5 40.1 42.3 481 235 B A H X S+ 0 0 58 -4,-1.6 4,-1.9 1,-0.2 3,-0.4 0.936 114.2 48.3 -63.8 -46.7 25.9 40.3 41.1 482 236 B L H X S+ 0 0 57 -4,-2.6 4,-0.7 1,-0.2 -2,-0.2 0.840 112.8 47.2 -63.1 -38.1 26.2 44.0 40.1 483 237 B M H < S+ 0 0 7 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.681 108.7 56.3 -78.5 -19.0 29.5 43.4 38.3 484 238 B A H >< S+ 0 0 48 -4,-1.2 3,-1.1 -3,-0.4 -2,-0.2 0.935 108.6 44.0 -76.1 -48.9 28.1 40.4 36.4 485 239 B Q H 3< S+ 0 0 151 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.702 97.9 75.6 -68.9 -19.8 25.1 42.2 34.9 486 240 B E T 3< 0 0 99 -4,-0.7 -1,-0.3 -5,-0.2 -2,-0.1 0.279 360.0 360.0 -75.1 12.7 27.4 45.1 34.1 487 241 B L < 0 0 166 -3,-1.1 -3,-0.0 0, 0.0 -4,-0.0 -0.987 360.0 360.0-125.1 360.0 28.6 42.8 31.3