==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 18-OCT-11 3U9B . COMPND 2 MOLECULE: CHLORAMPHENICOL ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR T.BISWAS,S.GARNEAU-TSODIKOVA,O.V.TSODIKOV . 1930 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 84257.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1257 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 90 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 339 17.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 0.5 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 . 18 0.9 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 . 166 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 145 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 457 23.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 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 1 0 6 3 5 3 0 1 0 8 6 9 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 14 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 . 4 6 13 9 2 15 1 0 9 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 . 4 5 0 0 0 0 9 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 2 A E 0 0 160 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 164.9 68.3 13.6 22.5 2 3 A K + 0 0 97 2,-0.0 2,-0.2 0, 0.0 0, 0.0 -0.476 360.0 174.5 161.0 135.5 66.2 15.1 19.6 3 4 A K + 0 0 144 -2,-0.2 2,-0.2 2,-0.0 0, 0.0 -0.426 18.0 177.4-133.9-157.9 63.2 13.9 17.7 4 5 A I - 0 0 158 -2,-0.2 2,-0.2 2,-0.0 -2,-0.0 -0.482 25.4-157.9 148.7 139.2 60.5 14.7 15.0 5 6 A T - 0 0 30 -2,-0.2 2,-0.8 80,-0.0 -2,-0.0 -0.809 33.4 -40.3-139.9-179.8 57.9 12.3 13.8 6 7 A G + 0 0 0 -2,-0.2 2,-0.5 80,-0.1 80,-0.1 -0.215 47.1 171.2 -52.0 87.8 55.4 11.2 11.1 7 8 A Y + 0 0 118 -2,-0.8 77,-0.1 77,-0.2 75,-0.1 -0.857 4.2 165.7 -82.8 129.0 53.6 14.2 9.7 8 9 A T - 0 0 64 -2,-0.5 -2,-0.1 2,-0.0 76,-0.0 -0.517 23.5-154.7-145.9 76.3 51.6 13.1 6.6 9 10 A T - 0 0 77 73,-0.2 2,-0.6 1,-0.1 73,-0.2 -0.276 8.6-156.3 -50.6 118.0 49.2 15.8 5.8 10 11 A V - 0 0 40 71,-1.3 2,-0.6 -2,-0.0 71,-0.3 -0.919 10.4-138.5-100.3 121.9 46.3 14.3 4.0 11 12 A D > - 0 0 89 -2,-0.6 3,-0.7 1,-0.1 4,-0.3 -0.739 11.2-149.5 -79.6 122.1 44.3 16.6 1.7 12 13 A I T 3 S+ 0 0 25 -2,-0.6 -1,-0.1 1,-0.2 10,-0.1 0.585 87.5 65.4 -72.7 -13.4 40.7 15.7 2.4 13 14 A S T 3 S+ 0 0 77 1,-0.2 -1,-0.2 5,-0.1 5,-0.1 0.801 104.0 42.9 -81.1 -31.7 39.5 16.6 -1.1 14 15 A Q S < S+ 0 0 161 -3,-0.7 2,-0.3 4,-0.1 -1,-0.2 0.375 95.1 109.3 -92.1 2.0 41.5 13.8 -2.9 15 16 A W S > S- 0 0 56 -4,-0.3 3,-1.1 1,-0.1 -3,-0.0 -0.597 71.0-138.5 -81.8 138.0 40.5 11.4 -0.2 16 17 A H T 3 S+ 0 0 135 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.444 106.2 47.9 -74.3 -0.7 38.0 8.6 -1.0 17 18 A R T 3> S+ 0 0 12 -5,-0.1 4,-2.2 1,-0.1 5,-0.3 -0.088 73.4 132.3-125.7 32.7 36.4 9.3 2.4 18 19 A K H <> S+ 0 0 92 -3,-1.1 4,-1.6 1,-0.2 -2,-0.1 0.884 78.3 31.1 -60.8 -49.1 36.1 13.1 2.1 19 20 A E H > S+ 0 0 56 2,-0.2 4,-3.8 1,-0.2 5,-0.3 0.818 112.6 65.1 -81.0 -31.7 32.5 13.7 3.2 20 21 A H H > S+ 0 0 14 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.940 110.5 37.5 -48.3 -54.5 32.5 10.6 5.5 21 22 A F H X S+ 0 0 23 -4,-2.2 4,-0.6 2,-0.2 -1,-0.2 0.892 115.9 55.0 -63.9 -43.2 35.1 12.4 7.7 22 23 A E H >X S+ 0 0 73 -4,-1.6 4,-1.6 -5,-0.3 3,-0.7 0.923 110.4 44.2 -58.3 -48.8 33.4 15.8 7.1 23 24 A A H 3<>S+ 0 0 26 -4,-3.8 5,-2.1 1,-0.2 6,-0.4 0.903 114.2 48.5 -64.9 -44.7 30.0 14.5 8.4 24 25 A F H 3<5S+ 0 0 33 -4,-1.9 6,-0.4 -5,-0.3 169,-0.3 0.453 108.3 56.9 -77.8 -2.3 31.5 12.7 11.4 25 26 A Q H <<5S+ 0 0 47 -3,-0.7 -1,-0.2 -4,-0.6 -2,-0.2 0.800 123.3 16.3 -88.2 -39.6 33.5 15.8 12.2 26 27 A S T ><5S+ 0 0 65 -4,-1.6 3,-1.6 -5,-0.2 -3,-0.1 0.626 131.2 1.2 -99.5-108.6 30.4 17.9 12.4 27 28 A V T 3 5S+ 0 0 135 1,-0.3 568,-0.2 -5,-0.1 -3,-0.2 0.745 130.7 42.6 -65.2 -34.6 26.7 16.9 12.8 28 29 A A T 3 + 0 0 0 142,-2.6 4,-3.4 -2,-0.6 5,-0.3 0.151 34.1 115.3-122.8 15.3 43.8 -16.7 22.7 41 42 A T H > S+ 0 0 18 141,-0.4 4,-1.5 1,-0.2 5,-0.1 0.874 85.7 34.7 -58.0 -43.4 44.2 -20.5 23.1 42 43 A A H > S+ 0 0 41 2,-0.2 4,-1.7 3,-0.1 -1,-0.2 0.840 117.2 54.7 -80.6 -35.7 47.2 -20.8 20.8 43 44 A F H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 3,-0.2 0.965 111.4 43.9 -58.6 -53.3 48.6 -17.4 21.7 44 45 A L H X S+ 0 0 13 -4,-3.4 4,-2.2 1,-0.2 3,-0.3 0.915 112.0 51.7 -61.6 -48.1 48.7 -18.2 25.4 45 46 A K H X S+ 0 0 123 -4,-1.5 4,-1.2 -5,-0.3 -1,-0.2 0.813 114.4 43.5 -60.5 -33.4 50.2 -21.7 25.0 46 47 A T H < S+ 0 0 31 -4,-1.7 4,-0.5 -3,-0.2 -1,-0.3 0.658 113.2 52.5 -84.9 -18.9 53.0 -20.3 22.8 47 48 A V H < S+ 0 0 0 -4,-1.5 -2,-0.2 -3,-0.3 5,-0.2 0.737 112.7 44.8 -83.0 -26.5 53.4 -17.5 25.2 48 49 A K H < S+ 0 0 127 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.741 103.4 62.8 -85.2 -27.1 53.7 -20.0 28.1 49 50 A K S < S+ 0 0 183 -4,-1.2 2,-0.3 -5,-0.2 -2,-0.2 0.770 107.7 52.6 -66.2 -26.5 56.1 -22.2 26.1 50 51 A N S S- 0 0 49 -4,-0.5 0, 0.0 2,-0.1 0, 0.0 -0.720 99.9-116.4 -98.1 160.9 58.4 -19.2 26.2 51 52 A K S S+ 0 0 211 -2,-0.3 -3,-0.1 2,-0.1 2,-0.1 0.432 80.6 107.4 -82.5 3.4 59.2 -17.6 29.5 52 53 A H - 0 0 62 -5,-0.2 2,-0.3 1,-0.1 -2,-0.1 -0.377 68.1-122.5 -74.3 156.5 57.5 -14.2 28.7 53 54 A K > - 0 0 131 -2,-0.1 2,-1.3 1,-0.0 4,-0.9 -0.793 29.5 -97.5-104.9 151.8 54.2 -13.2 30.3 54 55 A F T 4 S+ 0 0 24 -2,-0.3 -10,-0.0 1,-0.2 -1,-0.0 -0.490 101.6 59.9 -71.5 91.6 51.0 -12.4 28.4 55 56 A Y T > S+ 0 0 41 -2,-1.3 4,-4.1 91,-0.0 5,-0.2 -0.199 100.2 41.7-167.8 -68.2 50.9 -8.6 28.2 56 57 A P H > S+ 0 0 14 0, 0.0 4,-3.0 0, 0.0 5,-0.1 0.909 116.7 55.6 -59.4 -38.0 53.9 -7.1 26.4 57 58 A A H X S+ 0 0 0 -4,-0.9 4,-1.7 2,-0.2 -3,-0.1 0.948 113.6 38.5 -52.7 -53.7 53.4 -9.9 24.0 58 59 A F H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.905 112.2 57.0 -67.5 -43.4 49.8 -8.9 23.4 59 60 A I H X S+ 0 0 0 -4,-4.1 4,-2.9 1,-0.2 -1,-0.2 0.937 108.2 50.1 -46.1 -50.0 50.7 -5.2 23.6 60 61 A H H X S+ 0 0 0 -4,-3.0 4,-2.5 -5,-0.2 -1,-0.2 0.890 105.6 54.2 -59.2 -44.4 53.1 -5.9 20.7 61 62 A I H X S+ 0 0 0 -4,-1.7 4,-1.1 1,-0.2 -1,-0.2 0.883 114.0 42.3 -61.5 -41.3 50.4 -7.7 18.6 62 63 A L H >X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 3,-0.6 0.948 110.8 55.2 -66.0 -51.8 48.2 -4.7 18.8 63 64 A A H 3X S+ 0 0 0 -4,-2.9 4,-1.6 1,-0.3 -2,-0.2 0.858 105.4 54.9 -49.9 -40.1 51.0 -2.2 18.2 64 65 A R H 3< S+ 0 0 57 -4,-2.5 -1,-0.3 2,-0.2 -2,-0.2 0.884 110.2 44.7 -60.3 -43.5 51.8 -4.1 15.0 65 66 A L H XX S+ 0 0 0 -4,-1.1 3,-2.0 -3,-0.6 4,-1.8 0.913 111.1 52.7 -67.6 -45.2 48.3 -3.7 13.8 66 67 A M H 3< S+ 0 0 1 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.788 110.3 50.6 -61.7 -29.1 48.2 -0.0 14.8 67 68 A N T 3< S+ 0 0 33 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.036 108.3 53.3 -98.1 24.1 51.4 0.4 12.8 68 69 A A T <4 S+ 0 0 51 -3,-2.0 -2,-0.2 1,-0.3 -3,-0.1 0.669 102.9 51.9-113.0 -52.9 50.0 -1.3 9.7 69 70 A H >< - 0 0 20 -4,-1.8 3,-1.6 1,-0.1 4,-0.4 -0.789 65.2-152.6 -98.4 121.8 46.8 0.6 9.0 70 71 A P G > S+ 0 0 53 0, 0.0 3,-0.7 0, 0.0 14,-0.1 0.655 88.0 78.3 -64.3 -18.7 46.9 4.4 8.8 71 72 A E G 3 S+ 0 0 17 1,-0.3 3,-0.3 2,-0.1 -5,-0.1 0.654 97.5 45.0 -66.6 -16.1 43.3 4.7 9.9 72 73 A F G < S+ 0 0 6 -3,-1.6 -1,-0.3 -6,-0.2 -6,-0.1 0.588 104.6 63.6 -97.1 -16.8 44.5 4.1 13.5 73 74 A R S < S+ 0 0 28 -3,-0.7 11,-2.4 -4,-0.4 2,-0.4 -0.069 78.2 121.1-100.2 33.4 47.4 6.5 13.3 74 75 A M E +H 83 0B 10 -3,-0.3 2,-0.2 9,-0.2 9,-0.2 -0.807 25.8 145.1-108.0 141.5 45.4 9.7 12.7 75 76 A A E -H 82 0B 21 7,-1.4 7,-2.1 -2,-0.4 2,-0.5 -0.868 46.3 -87.6-151.7-177.9 45.3 12.9 14.8 76 77 A M E +H 81 0B 59 88,-0.3 5,-0.2 -2,-0.2 90,-0.0 -0.917 38.0 173.1-110.6 121.8 45.0 16.7 14.6 77 78 A K - 0 0 51 3,-2.7 2,-1.9 -2,-0.5 -1,-0.1 0.518 69.2 -17.7 -90.7-125.8 48.0 19.0 14.0 78 79 A D S S- 0 0 128 1,-0.2 3,-0.1 3,-0.1 -1,-0.1 -0.492 126.3 -51.3 -87.1 69.4 47.8 22.7 13.4 79 80 A G S S+ 0 0 52 -2,-1.9 2,-0.3 1,-0.3 -1,-0.2 0.738 123.1 102.7 69.4 25.3 44.1 22.7 12.4 80 81 A E S S- 0 0 72 1821,-0.1 -3,-2.7 -69,-0.0 2,-0.4 -0.929 75.0-109.8-137.5 158.2 45.0 19.9 10.0 81 82 A L E +H 76 0B 11 -71,-0.3 -71,-1.3 -2,-0.3 2,-0.3 -0.751 39.3 177.9 -89.5 133.4 44.7 16.1 9.6 82 83 A V E -H 75 0B 0 -7,-2.1 -7,-1.4 -2,-0.4 2,-0.5 -0.898 26.7-142.0-131.2 162.1 47.9 14.0 9.8 83 84 A I E -H 74 0B 32 -2,-0.3 -9,-0.2 -9,-0.2 -12,-0.1 -0.959 26.6-133.0-123.3 110.6 49.0 10.3 9.8 84 85 A W - 0 0 14 -11,-2.4 -77,-0.2 -2,-0.5 3,-0.1 -0.363 8.8-135.5 -62.7 135.7 51.9 9.5 12.1 85 86 A D S S+ 0 0 106 1,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.851 92.5 8.3 -57.9 -36.1 54.7 7.4 10.5 86 87 A S - 0 0 36 -13,-0.1 2,-0.4 -80,-0.1 -1,-0.2 -0.989 66.1-152.2-144.2 154.1 54.5 5.4 13.7 87 88 A V - 0 0 4 -2,-0.3 54,-0.3 -24,-0.2 -14,-0.0 -0.978 16.5-146.3-125.5 140.4 52.2 5.1 16.8 88 89 A H E -c 141 0A 9 52,-2.6 54,-2.0 -2,-0.4 2,-0.4 -0.838 21.3-107.0-112.9 146.5 53.5 3.9 20.2 89 90 A P E -c 142 0A 0 0, 0.0 17,-1.4 0, 0.0 2,-0.7 -0.548 21.7-164.2 -81.0 128.1 51.6 1.9 22.9 90 91 A C E +cD 143 105A 2 52,-3.1 54,-2.3 -2,-0.4 15,-0.3 -0.888 22.9 178.2-107.7 98.8 50.5 3.7 26.1 91 92 A Y E -cD 144 104A 0 13,-1.7 13,-2.7 -2,-0.7 2,-0.3 -0.613 27.3-112.2-102.9 159.1 49.7 0.9 28.5 92 93 A T E - D 0 103A 17 52,-1.4 2,-0.4 11,-0.2 11,-0.3 -0.688 21.4-162.2 -90.8 140.9 48.5 0.9 32.1 93 94 A V E - D 0 102A 17 9,-3.9 9,-2.8 -2,-0.3 2,-0.3 -0.992 16.1-139.3-120.4 132.6 50.6 -0.3 35.0 94 95 A F E - D 0 101A 54 -2,-0.4 2,-0.6 7,-0.2 7,-0.2 -0.647 1.8-145.8 -96.3 148.2 48.9 -1.1 38.3 95 96 A H E >> - D 0 100A 8 5,-2.5 4,-1.2 -2,-0.3 5,-0.5 -0.935 7.6-168.7-114.5 109.9 50.1 -0.3 41.9 96 97 A E T 45S+ 0 0 145 -2,-0.6 -1,-0.1 1,-0.2 3,-0.1 0.900 83.3 47.8 -60.2 -47.6 49.2 -3.0 44.5 97 98 A Q T 45S+ 0 0 185 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.884 123.4 28.9 -66.7 -43.9 50.1 -1.0 47.6 98 99 A T T 45S- 0 0 27 2,-0.1 -1,-0.2 135,-0.0 -2,-0.2 0.453 96.2-132.3-101.1 -3.1 48.4 2.3 46.8 99 100 A E T <5 + 0 0 77 -4,-1.2 2,-0.2 1,-0.2 -3,-0.2 0.734 68.7 115.7 55.8 27.4 45.6 0.8 44.7 100 101 A T E < -D 95 0A 6 -5,-0.5 -5,-2.5 315,-0.1 2,-0.3 -0.617 55.3-135.2-111.4 175.3 46.2 3.5 42.0 101 102 A F E -D 94 0A 34 -7,-0.2 2,-0.4 -2,-0.2 -7,-0.2 -0.980 6.4-155.4-134.6 149.6 47.4 3.1 38.4 102 103 A S E -D 93 0A 2 -9,-2.8 -9,-3.9 -2,-0.3 2,-0.5 -0.937 10.9-144.9-116.6 145.9 50.0 4.8 36.1 103 104 A S E +D 92 0A 19 29,-2.3 32,-0.4 -2,-0.4 2,-0.3 -0.947 27.4 167.7-106.8 128.8 49.9 4.9 32.3 104 105 A L E -D 91 0A 2 -13,-2.7 -13,-1.7 -2,-0.5 2,-0.4 -0.982 21.7-138.2-141.6 156.6 53.2 4.8 30.5 105 106 A W E -D 90 0A 45 -2,-0.3 2,-0.2 31,-0.3 -15,-0.2 -0.892 7.2-160.6-119.8 139.0 54.4 4.3 27.0 106 107 A S - 0 0 0 -17,-1.4 2,-0.4 -2,-0.4 13,-0.1 -0.695 34.9 -97.1-105.6 167.1 57.3 2.4 25.4 107 108 A E - 0 0 69 -2,-0.2 2,-0.4 -19,-0.1 11,-0.1 -0.723 40.7-124.3 -85.6 131.4 58.8 2.9 21.9 108 109 A Y + 0 0 18 -2,-0.4 2,-0.4 10,-0.1 3,-0.1 -0.609 31.2 175.2 -81.2 129.9 57.4 0.5 19.3 109 110 A H - 0 0 44 -2,-0.4 6,-0.2 2,-0.1 7,-0.1 -0.990 33.2-135.5-128.4 142.7 59.7 -1.7 17.3 110 111 A D S S+ 0 0 125 -2,-0.4 2,-0.3 4,-0.1 -1,-0.1 0.917 89.8 81.6 -59.5 -46.2 58.6 -4.4 14.8 111 112 A D S > S- 0 0 80 1,-0.2 4,-2.3 -3,-0.1 3,-0.3 -0.493 75.5-149.8 -63.7 119.8 61.2 -6.9 16.2 112 113 A F H > S+ 0 0 3 104,-0.4 4,-2.8 -2,-0.3 5,-0.2 0.867 95.3 53.3 -63.0 -38.3 59.5 -8.3 19.3 113 114 A R H > S+ 0 0 161 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.814 110.9 48.5 -67.7 -31.7 62.8 -8.9 21.1 114 115 A Q H > S+ 0 0 100 -3,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.917 114.2 44.8 -69.1 -47.5 63.7 -5.2 20.5 115 116 A F H X S+ 0 0 0 -4,-2.3 4,-3.2 -6,-0.2 -2,-0.2 0.920 110.7 51.5 -64.6 -49.8 60.3 -4.0 21.8 116 117 A L H X S+ 0 0 44 -4,-2.8 4,-3.6 1,-0.2 5,-0.2 0.846 107.8 55.3 -57.4 -36.1 60.1 -6.2 24.9 117 118 A H H X S+ 0 0 122 -4,-1.0 4,-2.1 -5,-0.2 -1,-0.2 0.914 110.8 43.7 -61.2 -46.1 63.6 -4.9 25.7 118 119 A I H X S+ 0 0 39 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.931 117.4 47.2 -62.0 -48.5 62.3 -1.3 25.6 119 120 A Y H X S+ 0 0 23 -4,-3.2 4,-3.0 2,-0.2 5,-0.3 0.950 113.3 46.1 -57.9 -55.1 59.1 -2.3 27.5 120 121 A S H X S+ 0 0 49 -4,-3.6 4,-3.1 1,-0.2 5,-0.2 0.881 112.3 51.2 -58.5 -43.3 61.0 -4.3 30.2 121 122 A Q H < S+ 0 0 123 -4,-2.1 4,-0.4 -5,-0.2 -1,-0.2 0.864 114.3 44.7 -61.6 -38.9 63.5 -1.5 30.7 122 123 A D H X S+ 0 0 23 -4,-1.9 4,-2.9 2,-0.2 5,-0.4 0.884 118.2 41.5 -72.3 -42.9 60.7 1.0 31.0 123 124 A V H X S+ 0 0 37 -4,-3.0 4,-1.2 2,-0.2 -2,-0.2 0.852 112.5 53.1 -77.0 -35.7 58.6 -1.1 33.4 124 125 A A H < S+ 0 0 93 -4,-3.1 -1,-0.2 -5,-0.3 -2,-0.2 0.685 120.2 38.3 -67.9 -15.8 61.5 -2.3 35.5 125 126 A C H 4 S+ 0 0 80 -4,-0.4 3,-0.4 -5,-0.2 -2,-0.2 0.897 131.0 18.8 -99.5 -60.6 62.4 1.4 35.8 126 127 A Y H >< S+ 0 0 80 -4,-2.9 3,-3.5 1,-0.2 -3,-0.2 0.517 91.0 103.0 -94.0 -9.8 59.1 3.4 36.2 127 128 A G T 3< S+ 0 0 8 -4,-1.2 -1,-0.2 -5,-0.4 -3,-0.1 0.644 90.9 41.5 -50.9 -17.0 56.8 0.6 37.3 128 129 A E T 3 S+ 0 0 153 -3,-0.4 2,-0.5 -5,-0.1 -1,-0.3 0.218 86.7 111.3-116.8 10.2 57.1 1.9 40.8 129 130 A N < - 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0 0 82 -2,-0.1 -1,-0.1 73,-0.1 76,-0.1 -0.283 34.4-140.5-155.4 61.7 33.7 13.4 54.5 226 10 B T - 0 0 78 1,-0.1 2,-0.4 73,-0.1 73,-0.2 0.091 21.7-147.8 -26.4 94.6 35.1 16.5 52.9 227 11 B V - 0 0 36 71,-1.7 2,-0.4 1,-0.0 71,-0.4 -0.622 1.3-139.7 -78.3 125.1 38.0 14.9 50.9 228 12 B D > - 0 0 84 -2,-0.4 4,-1.1 1,-0.1 7,-0.1 -0.741 2.0-150.3 -81.2 130.9 41.0 17.1 50.5 229 13 B I T 4 S+ 0 0 87 -2,-0.4 6,-0.3 1,-0.2 5,-0.2 0.861 90.8 66.4 -65.4 -36.3 42.5 16.7 47.0 230 14 B S T 4 S+ 0 0 66 1,-0.2 -1,-0.2 5,-0.1 5,-0.1 0.916 107.6 33.9 -51.7 -56.5 46.0 17.5 48.4 231 15 B Q T 4 S+ 0 0 144 3,-0.1 -1,-0.2 4,-0.1 -2,-0.2 0.763 94.4 110.1 -75.3 -27.2 46.4 14.4 50.6 232 16 B W S >< S- 0 0 61 -4,-1.1 3,-1.5 1,-0.1 -3,-0.0 -0.194 70.0-134.6 -60.6 136.5 44.5 12.0 48.3 233 17 B H T 3 S+ 0 0 132 1,-0.3 -1,-0.1 2,-0.1 4,-0.1 0.340 105.7 45.6 -71.6 7.7 46.4 9.3 46.4 234 18 B R T 3> + 0 0 10 -5,-0.2 4,-2.4 2,-0.1 5,-0.3 0.164 67.4 131.8-134.6 18.0 44.5 10.2 43.3 235 19 B K H <> S+ 0 0 92 -3,-1.5 4,-1.4 -6,-0.3 -2,-0.1 0.775 83.6 33.9 -48.2 -37.9 44.6 14.0 43.2 236 20 B E H > S+ 0 0 60 2,-0.2 4,-2.9 3,-0.2 5,-0.3 0.807 110.9 60.3 -91.4 -33.5 45.6 14.2 39.5 237 21 B H H > S+ 0 0 16 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.981 114.6 39.6 -49.0 -58.0 43.7 11.1 38.3 238 22 B F H < S+ 0 0 22 -4,-2.4 4,-0.2 2,-0.2 -2,-0.2 0.908 114.5 52.9 -55.8 -50.6 40.6 13.0 39.4 239 23 B E H >X S+ 0 0 101 -4,-1.4 3,-0.7 -5,-0.3 4,-0.5 0.887 114.9 39.8 -59.3 -45.4 41.8 16.4 38.3 240 24 B A H 3<>S+ 0 0 37 -4,-2.9 5,-2.3 1,-0.2 3,-0.3 0.791 114.6 54.0 -74.4 -31.1 42.5 15.3 34.7 241 25 B F T 3<5S+ 0 0 35 -4,-2.1 6,-0.5 -5,-0.3 -1,-0.2 0.328 104.5 57.0 -83.6 5.2 39.4 13.1 34.6 242 26 B Q T <45S+ 0 0 44 -3,-0.7 -1,-0.2 -4,-0.2 -2,-0.2 0.532 127.2 0.1-110.3 -14.1 37.3 16.1 35.6 243 27 B S T ><5S+ 0 0 76 -4,-0.5 3,-2.6 -3,-0.3 -82,-0.2 0.025 126.6 32.7-129.2-110.0 38.4 18.3 32.7 244 28 B V T 3 5S+ 0 0 126 1,-0.3 -3,-0.1 -5,-0.1 -83,-0.1 0.610 134.2 17.4 -17.1 -60.5 40.8 17.4 29.8 245 29 B A T 3 + 0 0 0 142,-2.2 4,-3.0 -2,-0.7 5,-0.3 -0.030 35.1 116.5-118.4 25.9 23.7 -16.7 40.3 258 42 B T H > S+ 0 0 25 141,-0.5 4,-0.9 1,-0.2 142,-0.1 0.828 87.1 36.4 -61.0 -28.1 23.3 -20.6 40.4 259 43 B A H > S+ 0 0 32 2,-0.2 4,-1.6 140,-0.1 -1,-0.2 0.751 118.3 49.9 -95.5 -32.2 24.0 -20.5 44.1 260 44 B F H > S+ 0 0 0 2,-0.2 4,-2.7 3,-0.1 5,-0.2 0.959 109.7 49.5 -70.2 -52.9 22.2 -17.2 44.8 261 45 B L H X S+ 0 0 13 -4,-3.0 4,-3.4 1,-0.2 5,-0.3 0.924 110.0 51.7 -56.2 -50.7 19.0 -18.2 42.9 262 46 B K H X S+ 0 0 130 -4,-0.9 4,-1.1 -5,-0.3 -1,-0.2 0.919 112.5 44.6 -48.3 -55.1 18.8 -21.5 44.8 263 47 B T H X S+ 0 0 19 -4,-1.6 4,-0.7 2,-0.2 -1,-0.2 0.890 115.6 48.2 -59.4 -42.4 19.1 -19.9 48.2 264 48 B V H ><>S+ 0 0 2 -4,-2.7 5,-0.8 1,-0.2 3,-0.6 0.889 112.5 48.0 -66.2 -42.0 16.6 -17.2 47.3 265 49 B K H 3<5S+ 0 0 149 -4,-3.4 -1,-0.2 -5,-0.2 -2,-0.2 0.621 104.3 62.8 -73.2 -13.6 14.1 -19.7 45.8 266 50 B K H 3<5S+ 0 0 171 -4,-1.1 2,-0.3 -5,-0.3 -1,-0.2 0.748 107.8 47.4 -76.6 -25.0 14.5 -21.8 49.0 267 51 B N T <<5S- 0 0 66 -4,-0.7 2,-2.9 -3,-0.6 0, 0.0 -0.770 100.8 -95.5-118.1 160.3 13.1 -18.9 51.1 268 52 B K T 5S+ 0 0 210 -2,-0.3 2,-0.4 2,-0.0 -3,-0.1 -0.314 79.9 125.7 -72.5 62.8 10.0 -16.6 50.7 269 53 B H < - 0 0 45 -2,-2.9 2,-0.1 -5,-0.8 -2,-0.1 -0.980 60.1-131.9-129.7 124.4 12.0 -13.9 48.9 270 54 B K > - 0 0 174 -2,-0.4 4,-0.8 1,-0.1 -2,-0.0 -0.490 29.1-123.9 -65.0 140.5 11.3 -12.2 45.6 271 55 B F H >> S+ 0 0 34 1,-0.2 4,-1.3 2,-0.1 3,-1.2 0.941 98.4 61.8 -52.8 -59.4 14.5 -12.2 43.6 272 56 B Y H >> S+ 0 0 39 1,-0.3 4,-2.2 2,-0.2 3,-1.3 0.826 101.4 46.4 -39.3 -68.6 14.8 -8.4 43.0 273 57 B P H 3> S+ 0 0 4 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.726 108.8 58.1 -56.0 -27.0 15.1 -7.0 46.6 274 58 B A H X S+ 0 0 0 -4,-1.6 4,-2.4 -5,-0.3 3,-1.1 0.989 107.5 50.6 -56.9 -62.3 23.6 -1.9 48.4 281 65 B R H 3< S+ 0 0 52 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.827 110.9 50.3 -42.5 -43.6 26.2 -3.7 50.6 282 66 B L H >X S+ 0 0 0 -4,-1.9 4,-0.9 1,-0.2 3,-0.6 0.775 109.5 49.3 -75.5 -29.0 28.9 -3.2 48.0 283 67 B M H << S+ 0 0 1 -4,-1.4 7,-0.5 -3,-1.1 3,-0.3 0.884 111.3 50.4 -72.1 -38.8 28.2 0.5 47.6 284 68 B N T 3< S+ 0 0 33 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.207 107.2 56.1 -87.9 15.5 28.3 0.9 51.4 285 69 B A T <4 S+ 0 0 45 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.656 102.0 55.3-108.4 -32.8 31.7 -0.9 51.6 286 70 B H >X - 0 0 19 -4,-0.9 3,-2.0 -3,-0.3 4,-0.8 -0.881 64.8-152.4-119.8 105.4 33.7 1.2 49.2 287 71 B P T 34 S+ 0 0 58 0, 0.0 -1,-0.1 0, 0.0 14,-0.1 0.712 89.6 74.7 -33.5 -35.2 34.1 5.0 49.6 288 72 B E T >4 S+ 0 0 16 1,-0.2 3,-0.6 2,-0.1 -5,-0.1 0.833 98.3 41.8 -59.3 -37.1 34.6 5.3 45.8 289 73 B F T <4 S+ 0 0 4 -3,-2.0 2,-0.6 -6,-0.2 -1,-0.2 0.946 105.0 62.3 -74.1 -48.1 31.0 4.7 44.9 290 74 B R T 3< S+ 0 0 31 -4,-0.8 11,-2.5 -7,-0.5 2,-0.3 0.174 82.3 118.9 -69.6 22.0 29.4 6.9 47.6 291 75 B M E < +P 300 0D 10 -2,-0.6 2,-0.3 -3,-0.6 9,-0.2 -0.703 30.8 154.1 -94.5 140.0 31.1 10.0 46.2 292 76 B A E -P 299 0D 19 7,-2.0 7,-2.2 -2,-0.3 2,-0.7 -0.972 46.3-102.0-151.5 164.0 29.3 13.1 44.9 293 77 B M E +P 298 0D 48 88,-0.6 5,-0.2 -2,-0.3 90,-0.1 -0.855 44.0 169.7 -92.6 117.1 29.9 16.8 44.4 294 78 B K - 0 0 62 3,-2.3 2,-2.7 -2,-0.7 -1,-0.1 0.505 67.3 -5.6 -90.7-121.9 28.2 18.7 47.1 295 79 B D S S- 0 0 122 1,-0.2 -1,-0.1 3,-0.0 3,-0.1 -0.350 128.0 -57.5 -79.0 63.6 28.8 22.5 47.6 296 80 B G S S+ 0 0 66 -2,-2.7 2,-0.3 1,-0.2 -1,-0.2 0.615 120.1 95.1 76.4 14.7 31.5 22.6 45.0 297 81 B E S S- 0 0 105 -5,-0.0 -3,-2.3 -69,-0.0 2,-0.5 -0.944 79.6-105.3-137.6 155.1 33.5 20.0 46.8 298 82 B L E +P 293 0D 10 -71,-0.4 -71,-1.7 -2,-0.3 2,-0.3 -0.683 44.2 171.9 -80.2 125.9 34.1 16.2 46.7 299 83 B V E -P 292 0D 2 -7,-2.2 -7,-2.0 -2,-0.5 2,-0.5 -0.925 29.3-140.6-129.1 161.0 32.4 14.4 49.6 300 84 B I E -P 291 0D 29 -2,-0.3 -76,-1.1 -9,-0.2 -9,-0.2 -0.976 25.8-132.8-119.7 112.6 31.8 10.7 50.5 301 85 B W - 0 0 13 -11,-2.5 -11,-0.1 -2,-0.5 -78,-0.1 -0.412 15.9-125.3 -65.3 139.0 28.3 10.1 52.0 302 86 B D S S+ 0 0 105 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.766 92.2 0.4 -56.6 -28.0 28.4 8.0 55.1 303 87 B S - 0 0 33 -13,-0.1 2,-0.4 2,-0.0 -1,-0.1 -0.978 66.2-141.0-156.4 159.6 25.9 5.6 53.4 304 88 B V - 0 0 7 -2,-0.3 54,-0.3 -24,-0.1 -20,-0.1 -0.994 14.1-146.0-130.9 133.3 24.1 5.3 50.0 305 89 B H E -k 358 0C 14 52,-2.5 54,-1.5 -2,-0.4 19,-0.1 -0.783 24.8-109.1-103.6 142.3 20.5 4.1 49.6 306 90 B P E -k 359 0C 0 0, 0.0 17,-1.5 0, 0.0 2,-0.5 -0.417 20.7-159.7 -74.0 142.3 19.3 2.0 46.5 307 91 B C E -kL 360 322C 2 52,-1.6 54,-2.1 15,-0.2 2,-0.3 -0.890 22.0-177.8-123.2 98.4 17.1 3.6 43.9 308 92 B Y E -kL 361 321C 0 13,-1.3 13,-2.6 -2,-0.5 2,-0.3 -0.660 24.8-120.0-105.8 150.1 15.3 0.8 42.0 309 93 B T E - L 0 320C 14 52,-1.5 2,-0.4 -2,-0.3 11,-0.2 -0.669 21.9-167.4 -86.8 141.3 12.9 0.8 39.1 310 94 B V E - L 0 319C 22 9,-3.1 9,-2.2 -2,-0.3 2,-0.2 -1.000 18.7-131.3-128.1 129.0 9.5 -0.8 39.5 311 95 B F E - L 0 318C 57 -2,-0.4 2,-0.7 7,-0.2 7,-0.2 -0.568 4.4-143.9 -87.9 142.9 7.4 -1.4 36.4 312 96 B H E >> - 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0 0 1 -4,-1.4 -1,-0.3 -123,-0.1 2,-0.1 -0.982 57.4-161.5-137.0 124.5 35.1 54.2 -8.0 1918 197 I D >> - 0 0 2 -2,-0.4 4,-1.3 -3,-0.1 3,-0.6 -0.408 50.2 -90.9 -81.8 171.7 31.8 52.6 -8.9 1919 198 I G H 3> S+ 0 0 20 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.824 126.2 61.3 -52.7 -33.5 30.9 49.2 -7.4 1920 199 I F H 3> S+ 0 0 30 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.876 97.8 53.1 -62.2 -46.9 32.5 47.6 -10.4 1921 200 I H H <> S+ 0 0 13 -3,-0.6 4,-1.8 1,-0.2 -1,-0.2 0.935 115.4 40.4 -56.9 -49.2 36.1 49.0 -9.9 1922 201 I V H X S+ 0 0 0 -4,-1.3 4,-0.9 1,-0.2 -1,-0.2 0.786 110.8 63.4 -70.2 -28.2 36.2 47.7 -6.3 1923 202 I G H X S+ 0 0 0 -4,-1.5 4,-1.3 -5,-0.3 3,-0.2 0.927 107.2 38.7 -60.2 -50.1 34.5 44.6 -7.6 1924 203 I R H X S+ 0 0 53 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.878 108.3 60.0 -72.4 -40.9 37.4 43.5 -9.9 1925 204 I M H X S+ 0 0 0 -4,-1.8 4,-1.1 1,-0.2 -1,-0.2 0.777 107.1 51.3 -58.8 -24.7 40.2 44.6 -7.6 1926 205 I L H X S+ 0 0 11 -4,-0.9 4,-2.2 -3,-0.2 -1,-0.2 0.889 109.8 45.8 -79.1 -43.8 38.8 42.1 -5.1 1927 206 I N H X S+ 0 0 74 -4,-1.3 4,-1.1 2,-0.2 -2,-0.2 0.930 115.8 47.3 -61.5 -45.1 38.6 39.1 -7.5 1928 207 I E H X S+ 0 0 49 -4,-2.9 4,-2.5 2,-0.2 5,-0.2 0.855 111.1 51.6 -64.8 -36.0 42.1 39.9 -8.7 1929 208 I L H X S+ 0 0 0 -4,-1.1 4,-0.9 -5,-0.3 -1,-0.2 0.835 109.3 49.9 -67.6 -36.1 43.1 40.1 -5.0 1930 209 I Q H < S+ 0 0 51 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.714 113.0 50.7 -70.5 -22.3 41.5 36.7 -4.5 1931 210 I Q H >< S+ 0 0 106 -4,-1.1 3,-1.6 2,-0.2 4,-0.5 0.902 106.7 47.4 -84.9 -45.1 43.5 35.6 -7.5 1932 211 I Y H 3< S+ 0 0 51 -4,-2.5 3,-0.3 1,-0.3 4,-0.2 0.738 104.8 63.9 -71.0 -21.2 47.1 36.8 -6.6 1933 212 I C T 3< S+ 0 0 0 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.2 0.540 105.1 46.3 -73.3 -9.8 46.5 35.2 -3.2 1934 213 I D S < S+ 0 0 78 -3,-1.6 -2,-0.2 -170,-0.1 -1,-0.2 0.448 112.9 54.8-107.0 -7.1 46.3 31.9 -5.1 1935 214 I E S S- 0 0 96 -4,-0.5 2,-0.2 1,-0.3 -3,-0.1 0.664 103.6 -74.8 -86.8-110.5 49.4 32.7 -7.2 1936 215 I W - 0 0 157 -4,-0.2 -1,-0.3 -167,-0.0 -167,-0.1 -0.555 54.7 -62.6-135.5-160.5 52.6 33.6 -5.3 1937 216 I Q 0 0 35 1,-0.2 -154,-0.1 -2,-0.2 -2,-0.0 0.937 360.0 360.0 -53.6 -53.0 54.5 36.1 -3.2 1938 217 I G 0 0 35 -156,-0.0 -104,-0.4 -155,-0.0 -103,-0.2 -0.820 360.0 360.0 129.2 360.0 54.5 38.5 -6.2