==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 12-JUL-12 2LVW . COMPND 2 MOLECULE: ACETOLACTATE SYNTHASE ISOZYME 1 SMALL SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.N.KARANTH,S.P.SARMA . 196 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10480.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 158 80.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 28.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.0 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 . 32 16.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 48 24.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 4 0 2 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 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 PARALLEL BRIDGES PER LADDER . 0 0 1 0 0 2 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 1 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 1 A G 0 0 64 0, 0.0 3,-0.2 0, 0.0 9,-0.1 0.000 360.0 360.0 360.0 96.0 7.8 1.5 -19.0 2 2 A S - 0 0 71 1,-0.1 2,-1.2 7,-0.1 4,-0.1 0.899 360.0-103.4 55.8 111.7 6.6 -2.0 -17.9 3 3 A M + 0 0 63 1,-0.2 -1,-0.1 2,-0.1 7,-0.0 -0.445 56.0 158.8 -65.6 90.3 9.6 -4.4 -17.1 4 4 A Q S S- 0 0 166 -2,-1.2 -1,-0.2 -3,-0.2 -2,-0.1 0.951 82.4 -8.4 -79.1 -57.1 9.4 -6.5 -20.3 5 5 A N S S+ 0 0 173 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.373 125.9 74.5-123.3 -3.3 13.0 -8.0 -20.3 6 6 A T - 0 0 70 -4,-0.1 3,-0.0 1,-0.1 0, 0.0 -0.621 56.2-158.8-105.2 166.3 14.5 -6.0 -17.4 7 7 A T S S+ 0 0 77 -2,-0.2 3,-0.4 3,-0.0 -4,-0.1 0.454 89.9 64.6-112.9 -12.6 14.1 -6.2 -13.6 8 8 A H + 0 0 83 1,-0.2 78,-0.0 78,-0.1 -1,-0.0 0.051 64.2 106.6-106.9 23.3 15.2 -2.5 -13.0 9 9 A D S S+ 0 0 37 50,-0.1 51,-1.0 2,-0.0 -1,-0.2 0.845 74.6 65.2 -69.3 -34.7 12.4 -0.7 -14.8 10 10 A N E S-A 59 0A 1 -3,-0.4 2,-0.3 49,-0.2 49,-0.3 -0.233 77.2-136.9 -80.7 172.6 10.9 0.3 -11.5 11 11 A V E -A 58 0A 9 47,-2.0 47,-1.6 45,-0.1 2,-1.0 -0.980 15.8-124.8-134.3 142.7 12.4 2.7 -8.8 12 12 A I E -AB 57 83A 5 71,-2.4 71,-2.0 -2,-0.3 2,-0.9 -0.791 29.5-176.7 -94.9 96.6 12.4 2.1 -5.0 13 13 A L E -AB 56 82A 8 43,-2.2 43,-2.3 -2,-1.0 2,-0.3 -0.840 6.9-171.1 -99.4 98.6 10.7 5.2 -3.4 14 14 A E E +AB 55 81A 27 67,-1.5 67,-2.6 -2,-0.9 2,-0.3 -0.670 10.6 171.8 -91.0 144.5 10.9 4.9 0.4 15 15 A L E -AB 54 80A 5 39,-1.8 39,-2.6 -2,-0.3 2,-0.9 -0.907 25.1-145.4-151.1 123.5 9.0 7.3 2.7 16 16 A T E +AB 53 79A 14 63,-1.2 62,-2.3 -2,-0.3 63,-1.8 -0.840 30.4 177.9 -88.4 102.6 8.7 6.9 6.5 17 17 A V E -AB 52 77A 1 35,-2.2 35,-2.7 -2,-0.9 2,-0.4 -0.757 25.3-131.9-101.0 152.4 5.2 8.3 7.3 18 18 A R E -A 51 0A 101 58,-1.7 2,-1.7 -2,-0.3 33,-0.3 -0.891 39.6 -95.5-103.0 145.3 3.6 8.4 10.7 19 19 A N + 0 0 32 31,-0.8 117,-0.1 -2,-0.4 32,-0.1 -0.398 58.7 156.0 -73.7 81.1 -0.0 7.1 10.9 20 20 A H > - 0 0 74 -2,-1.7 3,-1.1 1,-0.1 2,-0.4 -0.690 65.1 -66.7 -88.2 155.3 -2.3 10.2 10.6 21 21 A P T 3 S- 0 0 119 0, 0.0 110,-0.1 0, 0.0 -1,-0.1 -0.290 117.2 -8.3 -50.6 103.0 -5.9 9.6 9.2 22 22 A G T 3 S+ 0 0 8 -2,-0.4 4,-0.3 108,-0.1 109,-0.1 0.893 78.9 142.1 79.2 46.4 -5.5 8.4 5.6 23 23 A V S X> S+ 0 0 1 -3,-1.1 4,-1.1 2,-0.2 3,-0.5 0.734 71.8 61.4 -85.1 -27.1 -1.8 9.0 4.8 24 24 A M H 3> S+ 0 0 7 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.811 98.2 60.5 -62.6 -31.5 -1.6 5.8 2.7 25 25 A T H 3> S+ 0 0 35 102,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.770 96.9 61.0 -66.2 -29.0 -4.2 7.5 0.5 26 26 A H H <> S+ 0 0 58 -3,-0.5 4,-1.8 -4,-0.3 -2,-0.2 0.968 107.8 39.9 -63.5 -55.9 -1.6 10.4 -0.1 27 27 A V H X S+ 0 0 5 -4,-1.1 4,-1.9 1,-0.2 5,-0.2 0.919 117.2 49.8 -62.5 -43.6 1.0 8.1 -1.8 28 28 A C H X S+ 0 0 4 -4,-1.8 4,-1.4 1,-0.2 96,-0.3 0.826 109.8 53.0 -63.4 -34.5 -1.7 6.1 -3.7 29 29 A G H X S+ 0 0 23 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.868 107.3 50.4 -68.8 -40.3 -3.2 9.4 -4.9 30 30 A L H X S+ 0 0 20 -4,-1.8 4,-0.5 2,-0.2 -2,-0.2 0.927 114.3 41.8 -65.6 -48.6 0.1 10.8 -6.3 31 31 A F H X S+ 0 0 8 -4,-1.9 4,-1.0 2,-0.2 -1,-0.2 0.772 112.5 57.2 -73.0 -27.7 0.9 7.7 -8.4 32 32 A A H < S+ 0 0 25 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.974 113.2 37.3 -60.1 -57.0 -2.7 7.4 -9.5 33 33 A R H < S+ 0 0 199 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.483 106.0 76.6 -76.9 -5.6 -2.8 11.0 -11.0 34 34 A R H < S- 0 0 17 -4,-0.5 -1,-0.2 2,-0.2 -2,-0.2 0.998 111.3 -95.4 -70.0 -67.9 0.8 10.5 -12.3 35 35 A A S < S+ 0 0 69 -4,-1.0 2,-0.3 1,-0.4 -4,-0.1 -0.038 97.4 36.1-179.6 -56.5 0.3 8.3 -15.4 36 36 A F S S- 0 0 88 23,-0.2 -1,-0.4 1,-0.1 -2,-0.2 -0.892 80.8-114.9-122.5 148.4 0.8 4.6 -14.4 37 37 A N - 0 0 9 -2,-0.3 22,-0.4 1,-0.1 2,-0.3 -0.005 42.0 -77.8 -74.7 178.5 -0.1 2.9 -11.1 38 38 A V - 0 0 2 1,-0.2 20,-0.2 20,-0.1 -1,-0.1 -0.631 30.2-157.8 -79.1 137.2 2.2 1.3 -8.4 39 39 A E S S+ 0 0 36 18,-2.5 2,-0.3 1,-0.3 19,-0.2 0.943 76.1 1.6 -74.4 -55.5 3.7 -2.1 -9.2 40 40 A G E -C 57 0A 0 17,-1.4 17,-2.9 103,-0.1 2,-0.4 -0.996 61.7-159.9-142.8 141.0 4.4 -3.1 -5.6 41 41 A I E -CD 56 142A 6 101,-1.0 101,-2.1 -2,-0.3 2,-0.4 -0.967 4.4-174.0-123.4 136.9 3.8 -1.6 -2.1 42 42 A L E -CD 55 141A 0 13,-1.5 13,-1.6 -2,-0.4 2,-1.0 -0.810 2.6-179.7-132.8 89.4 5.6 -2.5 1.2 43 43 A C E -CD 54 140A 0 97,-2.1 97,-1.0 -2,-0.4 11,-0.2 -0.814 12.9-168.2 -89.2 94.6 4.2 -0.7 4.2 44 44 A L E -C 53 0A 7 9,-2.4 9,-2.3 -2,-1.0 2,-0.3 -0.831 21.2-127.5 -90.5 108.3 6.5 -2.1 6.9 45 45 A P E -C 52 0A 44 0, 0.0 2,-1.1 0, 0.0 7,-0.3 -0.418 13.0-136.8 -64.3 116.4 4.9 -1.1 10.4 46 46 A I E > > -C 51 0A 39 5,-1.3 3,-1.1 -2,-0.3 5,-0.8 -0.675 16.5-163.3 -74.2 100.2 7.6 0.6 12.6 47 47 A Q T 3 5S+ 0 0 202 -2,-1.1 -1,-0.2 1,-0.2 5,-0.0 0.635 77.8 72.1 -63.1 -18.6 6.9 -1.2 15.9 48 48 A D T 3 5S- 0 0 114 -3,-0.0 -1,-0.2 2,-0.0 2,-0.2 0.840 114.9 -12.0 -69.2 -35.7 8.8 1.5 17.9 49 49 A S T < 5S- 0 0 60 -3,-1.1 2,-1.6 2,-0.1 -3,-0.0 -0.722 96.0 -61.2-146.3-172.4 6.2 4.2 17.5 50 50 A D T 5S+ 0 0 89 -2,-0.2 -31,-0.8 -5,-0.1 2,-0.3 -0.607 96.3 105.2 -83.6 74.1 3.0 5.1 15.5 51 51 A K E < -AC 18 46A 48 -2,-1.6 -5,-1.3 -5,-0.8 2,-0.3 -0.928 48.8-163.4-145.7 166.4 4.9 5.0 12.1 52 52 A S E -AC 17 45A 0 -35,-2.7 -35,-2.2 -7,-0.3 2,-0.6 -0.942 16.1-140.6-155.9 136.1 5.3 2.8 9.0 53 53 A H E -AC 16 44A 20 -9,-2.3 -9,-2.4 -2,-0.3 2,-0.4 -0.906 23.2-162.3-103.0 113.5 8.0 2.9 6.3 54 54 A I E -AC 15 43A 5 -39,-2.6 -39,-1.8 -2,-0.6 2,-0.6 -0.849 9.8-158.4-103.7 129.8 6.5 2.4 2.8 55 55 A W E -AC 14 42A 8 -13,-1.6 -13,-1.5 -2,-0.4 2,-0.7 -0.953 11.0-157.3-104.3 117.9 8.6 1.3 -0.3 56 56 A L E -AC 13 41A 0 -43,-2.3 -43,-2.2 -2,-0.6 2,-0.8 -0.887 2.3-158.6 -99.3 111.3 6.8 2.2 -3.6 57 57 A L E +AC 12 40A 1 -17,-2.9 -18,-2.5 -2,-0.7 -17,-1.4 -0.843 35.9 145.7 -87.7 104.0 7.9 0.1 -6.6 58 58 A V E -A 11 0A 0 -47,-1.6 -47,-2.0 -2,-0.8 2,-0.2 -0.984 52.2-103.4-142.6 147.3 6.9 2.3 -9.5 59 59 A N E -A 10 0A 18 -22,-0.4 -49,-0.2 -2,-0.3 -23,-0.2 -0.527 46.5-101.2 -75.3 140.1 8.4 2.9 -13.0 60 60 A D + 0 0 86 -51,-1.0 2,-0.3 -2,-0.2 -1,-0.1 -0.270 46.4 178.3 -63.0 146.4 10.3 6.3 -13.4 61 61 A D > - 0 0 30 1,-0.1 4,-0.6 -60,-0.0 -1,-0.0 -0.881 43.7-107.5-144.1 167.6 8.5 9.1 -15.3 62 62 A Q T 4 S+ 0 0 172 -2,-0.3 4,-0.2 1,-0.2 3,-0.1 0.849 125.0 36.0 -67.8 -38.0 9.0 12.8 -16.3 63 63 A R T >> S+ 0 0 105 1,-0.1 4,-2.0 2,-0.1 3,-0.6 0.668 96.3 94.7 -82.8 -24.8 6.5 14.0 -13.6 64 64 A L H 3> S+ 0 0 1 1,-0.3 4,-1.6 2,-0.2 3,-0.3 0.828 87.6 37.3 -40.4 -62.2 7.6 11.3 -11.1 65 65 A E H 3X S+ 0 0 86 -4,-0.6 4,-2.0 1,-0.2 -1,-0.3 0.752 113.8 57.2 -69.8 -29.3 10.3 13.2 -9.0 66 66 A Q H <> S+ 0 0 142 -3,-0.6 4,-1.1 -4,-0.2 -1,-0.2 0.875 110.0 45.7 -63.1 -39.5 8.2 16.5 -9.2 67 67 A M H X S+ 0 0 34 -4,-2.0 4,-2.3 -3,-0.3 -2,-0.2 0.763 109.5 54.2 -77.4 -29.3 5.3 14.5 -7.6 68 68 A I H X S+ 0 0 9 -4,-1.6 4,-2.3 -5,-0.2 -2,-0.2 0.910 107.3 51.6 -63.2 -44.5 7.7 13.0 -5.0 69 69 A S H X S+ 0 0 38 -4,-2.0 4,-0.5 1,-0.2 -2,-0.2 0.809 111.7 47.9 -63.1 -32.4 8.7 16.6 -4.1 70 70 A Q H >< S+ 0 0 100 -4,-1.1 3,-1.1 2,-0.2 4,-0.3 0.951 113.7 43.6 -70.2 -53.2 5.0 17.4 -3.7 71 71 A I H >< S+ 0 0 3 -4,-2.3 3,-1.2 1,-0.3 6,-0.3 0.793 105.7 65.1 -68.2 -28.5 4.1 14.3 -1.5 72 72 A D H 3< S+ 0 0 46 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.788 91.8 63.5 -60.4 -31.6 7.4 14.9 0.6 73 73 A K T << S+ 0 0 149 -3,-1.1 2,-0.3 -4,-0.5 -1,-0.2 0.626 77.7 104.6 -75.0 -14.8 5.9 18.3 1.8 74 74 A L S X S- 0 0 56 -3,-1.2 3,-1.0 -4,-0.3 -51,-0.0 -0.553 75.3-135.6 -69.8 132.0 3.1 16.4 3.6 75 75 A E T 3 S+ 0 0 180 1,-0.3 -1,-0.1 -2,-0.3 -57,-0.1 0.523 100.7 67.9 -75.8 -10.9 3.9 16.5 7.4 76 76 A D T 3 S+ 0 0 7 -59,-0.1 -58,-1.7 1,-0.1 2,-1.0 0.870 81.3 85.4 -68.8 -41.3 3.0 12.8 7.8 77 77 A V E < +B 17 0A 14 -3,-1.0 -60,-0.3 -6,-0.3 3,-0.1 -0.526 55.2 173.5 -62.4 95.9 6.1 12.0 5.6 78 78 A V E S+ 0 0 76 -62,-2.3 2,-0.3 -2,-1.0 -1,-0.2 0.840 71.8 8.1 -71.3 -39.2 8.7 12.1 8.5 79 79 A K E -B 16 0A 131 -63,-1.8 -63,-1.2 -3,-0.1 2,-0.3 -0.971 64.1-174.4-142.7 152.2 11.4 10.9 5.9 80 80 A V E +B 15 0A 39 -2,-0.3 2,-0.3 -65,-0.3 -65,-0.2 -0.966 6.5 174.0-150.2 131.9 11.6 10.4 2.1 81 81 A Q E -B 14 0A 97 -67,-2.6 -67,-1.5 -2,-0.3 2,-0.6 -0.997 22.5-142.6-141.4 142.2 14.4 9.0 -0.1 82 82 A R E +B 13 0A 103 -2,-0.3 2,-0.5 -69,-0.2 -69,-0.2 -0.928 23.8 179.0-106.9 115.1 14.6 8.1 -3.9 83 83 A N E -B 12 0A 62 -71,-2.0 -71,-2.4 -2,-0.6 2,-1.3 -0.977 24.5-148.9-124.4 120.9 16.6 4.9 -4.7 84 84 A Q + 0 0 112 -2,-0.5 2,-0.2 -73,-0.2 -73,-0.1 -0.719 56.0 122.9 -88.3 89.5 17.1 3.6 -8.2 85 85 A S - 0 0 26 -2,-1.3 -2,-0.1 -75,-0.0 -75,-0.0 -0.785 60.1 -79.9-144.5 179.8 17.3 -0.1 -7.3 86 86 A D > - 0 0 48 -2,-0.2 3,-1.7 1,-0.1 4,-0.5 -0.491 33.7-115.6 -92.9 156.9 15.7 -3.6 -7.9 87 87 A P T 3> S+ 0 0 22 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.506 108.9 78.3 -67.3 -5.7 12.4 -5.2 -6.5 88 88 A T H 3> S+ 0 0 84 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.768 85.6 60.2 -68.8 -28.4 14.7 -7.8 -4.8 89 89 A M H <> S+ 0 0 74 -3,-1.7 4,-2.3 2,-0.2 5,-0.3 0.893 98.0 57.9 -63.0 -42.4 15.3 -5.0 -2.2 90 90 A F H > S+ 0 0 3 -4,-0.5 4,-1.2 1,-0.2 -1,-0.2 0.890 110.4 43.1 -50.3 -46.1 11.6 -5.0 -1.5 91 91 A N H X S+ 0 0 31 -4,-1.0 4,-2.2 2,-0.2 5,-0.3 0.929 111.1 55.4 -66.8 -47.8 11.9 -8.8 -0.6 92 92 A K H X S+ 0 0 131 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.885 113.3 38.5 -53.6 -50.0 15.2 -8.3 1.4 93 93 A I H X>S+ 0 0 30 -4,-2.3 4,-1.6 2,-0.2 5,-0.9 0.727 112.9 57.6 -80.1 -26.5 13.7 -5.6 3.8 94 94 A A H <5S+ 0 0 0 -4,-1.2 -2,-0.2 -5,-0.3 -1,-0.2 0.880 115.9 35.8 -64.7 -42.0 10.3 -7.5 4.1 95 95 A V H <5S+ 0 0 66 -4,-2.2 -2,-0.2 1,-0.1 -3,-0.2 0.796 122.1 44.6 -85.4 -30.7 12.1 -10.7 5.3 96 96 A F H <5S- 0 0 152 -4,-1.9 -3,-0.2 -5,-0.3 -2,-0.2 0.787 99.8-139.9 -82.6 -29.5 14.8 -8.9 7.4 97 97 A F T <5 0 0 107 -4,-1.6 -3,-0.2 -5,-0.2 -4,-0.1 0.994 360.0 360.0 62.2 80.0 12.2 -6.4 8.9 98 98 A Q < 0 0 142 -5,-0.9 -5,-0.1 -45,-0.1 -45,-0.1 0.146 360.0 360.0-154.0 360.0 14.1 -3.0 9.0 99 !* 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 0.0 100 1 B G 0 0 59 0, 0.0 2,-0.8 0, 0.0 58,-0.1 0.000 360.0 360.0 360.0 -28.3 -9.3 -4.1 18.1 101 2 B S - 0 0 77 0, 0.0 2,-1.4 0, 0.0 4,-0.3 -0.833 360.0-156.9-109.1 90.0 -7.0 -2.7 20.8 102 3 B M + 0 0 75 -2,-0.8 4,-0.1 1,-0.2 56,-0.0 -0.560 41.1 137.8 -71.3 88.8 -3.4 -2.9 19.4 103 4 B Q S S- 0 0 146 -2,-1.4 -1,-0.2 0, 0.0 3,-0.0 0.842 94.5 -51.0 -90.3 -72.8 -1.4 -3.0 22.7 104 5 B N S S+ 0 0 156 -3,-0.3 2,-0.6 0, 0.0 -2,-0.1 0.053 95.5 139.6-147.0 16.9 1.2 -5.6 21.7 105 6 B T > - 0 0 61 -4,-0.3 3,-1.2 1,-0.2 4,-0.3 -0.560 38.1-162.1 -72.5 109.6 -1.3 -8.2 20.5 106 7 B T G > S+ 0 0 87 -2,-0.6 3,-0.7 1,-0.3 -1,-0.2 0.883 90.0 44.1 -61.3 -40.9 0.2 -9.8 17.3 107 8 B H G 3 S+ 0 0 91 1,-0.2 -1,-0.3 78,-0.1 -2,-0.1 0.067 81.3 100.7 -98.4 21.9 -3.2 -11.2 16.1 108 9 B D G < S+ 0 0 21 -3,-1.2 51,-1.2 50,-0.1 -1,-0.2 0.768 77.6 70.2 -72.4 -27.0 -5.2 -8.0 16.9 109 10 B N E < S-E 158 0A 0 -3,-0.7 2,-0.3 -4,-0.3 49,-0.3 -0.344 78.4-140.7 -80.6 168.4 -4.8 -7.3 13.1 110 11 B V E -E 157 0A 9 47,-2.1 47,-1.5 45,-0.1 2,-1.0 -0.980 15.5-123.9-134.1 142.1 -6.7 -9.3 10.3 111 12 B I E -EF 156 182A 6 71,-2.4 71,-1.9 -2,-0.3 2,-0.9 -0.777 30.0-176.6 -93.9 96.6 -5.2 -10.4 6.9 112 13 B L E -EF 155 181A 6 43,-2.2 43,-2.3 -2,-1.0 2,-0.3 -0.834 6.7-171.2 -98.9 97.9 -7.6 -8.9 4.3 113 14 B E E +EF 154 180A 26 67,-1.5 67,-2.6 -2,-0.9 2,-0.3 -0.665 10.6 171.6 -90.0 144.1 -6.4 -10.0 0.9 114 15 B L E -EF 153 179A 4 39,-1.8 39,-2.5 -2,-0.3 2,-0.9 -0.905 25.2-145.4-151.1 123.2 -7.8 -8.7 -2.4 115 16 B T E +EF 152 178A 13 63,-1.2 62,-2.4 -2,-0.3 63,-1.8 -0.837 30.4 177.9 -88.3 102.4 -6.5 -9.4 -5.9 116 17 B V E -EF 151 176A 1 35,-2.1 35,-2.7 -2,-0.9 2,-0.4 -0.749 25.3-131.7-100.5 152.7 -7.1 -6.1 -7.8 117 18 B R E -E 150 0A 100 58,-1.7 2,-1.8 -2,-0.3 33,-0.3 -0.888 39.6 -95.5-102.9 145.9 -6.1 -5.4 -11.4 118 19 B N + 0 0 30 31,-0.8 -81,-0.1 -2,-0.4 32,-0.1 -0.392 58.8 156.1 -74.3 79.7 -4.3 -2.1 -12.1 119 20 B H > - 0 0 72 -2,-1.8 3,-1.1 1,-0.1 2,-0.3 -0.685 65.1 -66.9 -87.6 154.0 -7.0 0.4 -13.1 120 21 B P T 3 S- 0 0 118 0, 0.0 -88,-0.1 0, 0.0 -1,-0.1 -0.264 117.2 -8.3 -49.8 103.5 -6.0 4.2 -12.5 121 22 B G T 3 S+ 0 0 8 -2,-0.3 4,-0.3 -90,-0.1 -89,-0.1 0.895 78.7 142.2 78.6 46.9 -5.8 4.6 -8.7 122 23 B V S X> S+ 0 0 1 -3,-1.1 4,-1.1 2,-0.2 3,-0.5 0.734 71.8 61.6 -85.1 -27.1 -7.2 1.3 -7.3 123 24 B M H 3> S+ 0 0 8 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.804 98.0 60.6 -62.9 -31.0 -4.6 1.4 -4.4 124 25 B T H 3> S+ 0 0 36 -96,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.772 96.9 60.8 -66.4 -28.9 -6.4 4.7 -3.4 125 26 B H H <> S+ 0 0 61 -3,-0.5 4,-1.8 -4,-0.3 -2,-0.2 0.968 107.7 40.2 -64.1 -56.0 -9.7 2.7 -3.0 126 27 B V H X S+ 0 0 5 -4,-1.1 4,-1.8 1,-0.2 5,-0.2 0.916 117.2 49.8 -62.1 -43.5 -8.4 0.3 -0.2 127 28 B C H X S+ 0 0 4 -4,-1.7 4,-1.4 1,-0.2 -102,-0.3 0.826 109.8 53.0 -63.6 -34.6 -6.5 3.2 1.5 128 29 B G H X S+ 0 0 21 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.870 107.3 50.5 -68.8 -40.3 -9.7 5.4 1.4 129 30 B L H X S+ 0 0 21 -4,-1.8 4,-0.6 2,-0.2 -2,-0.2 0.928 114.4 41.7 -65.2 -48.9 -11.9 2.7 3.1 130 31 B F H X S+ 0 0 8 -4,-1.8 4,-1.0 2,-0.2 -1,-0.2 0.769 112.7 56.9 -73.2 -27.8 -9.5 2.1 6.1 131 32 B A H < S+ 0 0 27 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.980 113.3 37.5 -59.9 -58.2 -8.9 5.9 6.3 132 33 B R H < S+ 0 0 197 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.506 106.0 76.4 -75.0 -6.7 -12.6 6.7 6.7 133 34 B R H < S- 0 0 16 -4,-0.6 -1,-0.2 2,-0.2 -2,-0.2 0.996 111.4 -95.5 -69.3 -67.4 -13.1 3.6 8.9 134 35 B A S < S+ 0 0 70 -4,-1.0 2,-0.3 1,-0.4 -4,-0.1 -0.050 97.5 37.0 179.5 -55.7 -11.6 4.6 12.3 135 36 B F S S- 0 0 90 23,-0.2 -1,-0.4 -5,-0.1 -2,-0.2 -0.902 80.5-115.4-122.5 148.0 -7.9 3.4 12.4 136 37 B N - 0 0 10 -2,-0.3 22,-0.4 1,-0.1 2,-0.3 -0.007 42.0 -78.0 -74.4 178.0 -5.3 3.3 9.6 137 38 B V - 0 0 2 1,-0.2 20,-0.2 20,-0.1 -1,-0.1 -0.628 30.1-157.6 -79.0 137.1 -3.6 0.2 8.0 138 39 B E S S+ 0 0 36 18,-2.5 2,-0.3 1,-0.3 19,-0.2 0.943 76.2 1.2 -74.0 -55.6 -0.7 -1.3 10.1 139 40 B G E - G 0 156A 0 17,-1.3 17,-2.9 -95,-0.1 2,-0.4 -0.996 61.9-159.5-143.2 140.9 1.0 -3.0 7.1 140 41 B I E -DG 43 155A 7 -97,-1.0 -97,-2.1 -2,-0.3 2,-0.4 -0.967 4.5-173.9-123.3 136.7 0.4 -3.3 3.3 141 42 B L E -DG 42 154A 0 13,-1.5 13,-1.6 -2,-0.4 2,-1.0 -0.812 2.7-179.7-132.4 89.5 1.7 -5.9 0.9 142 43 B C E -DG 41 153A 0 -101,-2.1 -101,-1.0 -2,-0.4 11,-0.2 -0.815 12.9-168.2 -89.0 94.8 0.9 -5.2 -2.7 143 44 B L E - G 0 152A 6 9,-2.4 9,-2.4 -2,-1.0 2,-0.3 -0.832 21.2-127.7 -90.7 108.0 2.5 -8.2 -4.4 144 45 B P E - G 0 151A 41 0, 0.0 2,-1.1 0, 0.0 7,-0.3 -0.417 12.9-136.5 -64.2 116.5 2.7 -7.6 -8.3 145 46 B I E > > - G 0 150A 42 5,-1.3 3,-1.2 -2,-0.3 5,-0.8 -0.674 16.5-163.2 -74.2 99.9 1.1 -10.5 -10.1 146 47 B Q T 3 5S+ 0 0 201 -2,-1.1 -1,-0.2 1,-0.2 5,-0.0 0.623 78.0 72.2 -62.3 -18.7 3.7 -10.9 -12.9 147 48 B D T 3 5S- 0 0 116 -3,-0.0 -1,-0.2 2,-0.0 2,-0.2 0.834 114.8 -12.3 -69.3 -34.9 1.3 -13.0 -15.1 148 49 B S T < 5S- 0 0 60 -3,-1.2 2,-1.7 2,-0.1 -3,-0.0 -0.744 95.9 -60.8-147.7-173.1 -0.9 -10.1 -16.0 149 50 B D T 5S+ 0 0 87 -2,-0.2 -31,-0.8 -5,-0.1 2,-0.3 -0.592 96.5 104.7 -82.9 73.9 -1.8 -6.4 -15.2 150 51 B K E < -EG 117 145A 47 -2,-1.7 -5,-1.3 -5,-0.8 2,-0.3 -0.931 49.0-163.1-146.2 166.5 -2.8 -7.3 -11.5 151 52 B S E -EG 116 144A 0 -35,-2.7 -35,-2.1 -7,-0.3 2,-0.6 -0.944 16.0-140.7-155.9 136.1 -1.5 -7.2 -7.9 152 53 B H E -EG 115 143A 17 -9,-2.4 -9,-2.4 -2,-0.3 2,-0.4 -0.905 23.2-162.3-103.1 113.2 -2.7 -9.1 -4.8 153 54 B I E -EG 114 142A 5 -39,-2.5 -39,-1.8 -2,-0.6 2,-0.6 -0.846 9.8-158.3-103.4 130.1 -2.7 -6.8 -1.7 154 55 B W E -EG 113 141A 9 -13,-1.6 -13,-1.5 -2,-0.4 2,-0.7 -0.953 10.9-157.3-104.5 117.9 -2.8 -8.0 1.9 155 56 B L E -EG 112 140A 1 -43,-2.3 -43,-2.2 -2,-0.6 2,-0.8 -0.888 2.4-158.7 -99.4 111.1 -4.1 -5.3 4.3 156 57 B L E +EG 111 139A 1 -17,-2.9 -18,-2.5 -2,-0.7 -17,-1.3 -0.843 35.8 146.1 -87.5 103.8 -3.0 -5.8 8.0 157 58 B V E -E 110 0A 0 -47,-1.5 -47,-2.1 -2,-0.8 2,-0.2 -0.986 51.9-103.4-142.2 146.9 -5.6 -3.8 9.9 158 59 B N E -E 109 0A 14 -22,-0.4 -49,-0.2 -2,-0.3 -23,-0.2 -0.517 46.5-100.9 -74.6 139.8 -7.2 -4.3 13.3 159 60 B D + 0 0 70 -51,-1.2 2,-0.3 -2,-0.2 -1,-0.1 -0.278 46.5 178.1 -62.9 145.5 -10.9 -5.7 13.3 160 61 B D > - 0 0 32 1,-0.1 4,-0.6 -25,-0.0 -26,-0.0 -0.889 43.7-108.3-143.7 166.7 -13.7 -3.2 13.8 161 62 B Q T 4 S+ 0 0 172 -2,-0.3 4,-0.2 1,-0.2 3,-0.1 0.835 124.7 36.4 -67.7 -37.2 -17.6 -3.1 13.9 162 63 B R T >> S+ 0 0 107 1,-0.1 4,-2.0 2,-0.1 3,-0.7 0.672 96.1 94.6 -83.1 -24.7 -17.7 -1.2 10.5 163 64 B L H 3> S+ 0 0 1 1,-0.3 4,-1.5 2,-0.2 3,-0.4 0.823 87.6 37.3 -40.6 -61.7 -14.7 -3.3 9.2 164 65 B E H 3X S+ 0 0 89 -4,-0.6 4,-2.0 1,-0.2 -1,-0.3 0.752 113.8 57.1 -70.2 -29.3 -16.5 -6.1 7.3 165 66 B Q H <> S+ 0 0 138 -3,-0.7 4,-1.0 -4,-0.2 -1,-0.2 0.861 110.0 45.8 -63.9 -38.1 -19.3 -3.7 6.1 166 67 B M H X S+ 0 0 37 -4,-2.0 4,-2.3 -3,-0.4 -2,-0.2 0.763 109.5 54.0 -78.4 -29.3 -16.5 -1.6 4.4 167 68 B I H X S+ 0 0 8 -4,-1.5 4,-2.2 -5,-0.2 -2,-0.2 0.905 107.1 52.2 -63.4 -44.0 -14.9 -4.8 3.0 168 69 B S H X S+ 0 0 38 -4,-2.0 4,-0.5 1,-0.2 -2,-0.2 0.801 111.5 47.6 -62.7 -31.7 -18.3 -5.6 1.5 169 70 B Q H >< S+ 0 0 99 -4,-1.0 3,-1.1 2,-0.2 4,-0.3 0.952 113.5 43.9 -72.0 -53.2 -18.3 -2.0 -0.1 170 71 B I H >< S+ 0 0 4 -4,-2.3 3,-1.2 1,-0.3 6,-0.3 0.790 105.7 64.9 -67.9 -28.5 -14.7 -2.1 -1.5 171 72 B D H 3< S+ 0 0 47 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.794 91.8 63.6 -60.2 -32.0 -15.4 -5.7 -2.8 172 73 B K T << S+ 0 0 146 -3,-1.1 2,-0.3 -4,-0.5 -1,-0.2 0.631 78.1 104.3 -74.5 -14.8 -18.1 -4.3 -5.2 173 74 B L S X S- 0 0 55 -3,-1.2 3,-1.0 -4,-0.3 -51,-0.0 -0.550 75.4-135.7 -70.5 132.6 -15.4 -2.3 -7.1 174 75 B E T 3 S+ 0 0 180 1,-0.3 -1,-0.1 -2,-0.3 -57,-0.1 0.586 100.4 68.0 -75.0 -14.2 -14.7 -4.0 -10.4 175 76 B D T 3 S+ 0 0 7 -59,-0.1 -58,-1.7 1,-0.1 2,-1.0 0.886 81.4 85.4 -66.2 -41.4 -10.9 -3.6 -10.0 176 77 B V E < +F 116 0A 14 -3,-1.0 -60,-0.3 -6,-0.3 3,-0.1 -0.523 55.3 173.7 -62.2 96.2 -11.2 -6.1 -7.1 177 78 B V E S+ 0 0 74 -62,-2.4 2,-0.3 -2,-1.0 -1,-0.2 0.837 72.1 7.6 -71.8 -38.4 -11.0 -9.4 -9.2 178 79 B K E -F 115 0A 134 -63,-1.8 -63,-1.2 -3,-0.1 2,-0.3 -0.974 64.0-173.7-144.0 152.2 -11.0 -11.4 -5.8 179 80 B V E +F 114 0A 40 -2,-0.3 2,-0.3 -65,-0.3 -65,-0.2 -0.962 6.7 174.4-150.4 130.5 -11.4 -10.6 -2.1 180 81 B Q E -F 113 0A 99 -67,-2.6 -67,-1.5 -2,-0.3 2,-0.6 -0.998 22.3-142.7-139.9 142.0 -11.0 -12.9 1.0 181 82 B R E +F 112 0A 102 -2,-0.3 2,-0.5 -69,-0.2 -69,-0.2 -0.930 23.7 179.2-106.4 115.7 -11.1 -12.2 4.8 182 83 B N E -F 111 0A 64 -71,-1.9 -71,-2.4 -2,-0.6 2,-1.3 -0.979 24.6-149.0-124.5 121.2 -8.6 -14.2 6.9 183 84 B Q + 0 0 103 -2,-0.5 2,-0.2 -73,-0.2 -73,-0.1 -0.728 56.0 123.8 -88.4 89.8 -8.2 -13.9 10.7 184 85 B S - 0 0 25 -2,-1.3 -2,-0.1 -75,-0.0 -75,-0.0 -0.793 59.9 -80.9-144.7 178.8 -4.4 -14.7 10.8 185 86 B D > - 0 0 51 -2,-0.2 3,-1.8 1,-0.1 4,-0.5 -0.493 33.6-115.8 -92.5 156.1 -1.0 -13.3 12.0 186 87 B P T 3> S+ 0 0 26 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.506 109.0 78.3 -67.1 -5.7 1.4 -10.7 10.3 187 88 B T H 3> S+ 0 0 86 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.765 85.6 60.1 -69.4 -28.4 3.9 -13.5 9.9 188 89 B M H <> S+ 0 0 77 -3,-1.8 4,-2.3 2,-0.2 5,-0.3 0.894 97.9 58.4 -63.0 -42.5 1.8 -14.6 6.9 189 90 B F H > S+ 0 0 3 -4,-0.5 4,-1.1 1,-0.2 -1,-0.2 0.878 110.3 42.9 -49.9 -45.2 2.6 -11.2 5.4 190 91 B N H X S+ 0 0 33 -4,-1.0 4,-2.2 2,-0.2 5,-0.2 0.925 111.2 55.3 -68.3 -47.0 6.3 -12.1 5.7 191 92 B K H X S+ 0 0 128 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.883 113.2 39.0 -54.6 -49.0 5.8 -15.7 4.4 192 93 B I H X>S+ 0 0 27 -4,-2.3 4,-1.6 2,-0.2 5,-1.1 0.721 112.8 57.4 -80.3 -26.2 4.0 -14.7 1.1 193 94 B A H <5S+ 0 0 1 -4,-1.1 -2,-0.2 -5,-0.3 -1,-0.2 0.869 115.3 36.8 -65.9 -41.2 6.4 -11.7 0.6 194 95 B V H <5S+ 0 0 64 -4,-2.2 -2,-0.2 1,-0.1 -3,-0.2 0.783 123.1 42.4 -85.4 -29.7 9.5 -14.1 0.7 195 96 B F H <5S- 0 0 153 -4,-1.8 -3,-0.2 -5,-0.2 -2,-0.2 0.779 101.1-136.4 -85.1 -29.8 7.8 -17.0 -1.2 196 97 B F T <5 0 0 107 -4,-1.6 -3,-0.2 -5,-0.2 -4,-0.1 0.997 360.0 360.0 64.4 73.8 6.1 -14.7 -3.8 197 98 B Q < 0 0 137 -5,-1.1 -5,-0.1 -45,-0.1 -54,-0.1 -0.038 360.0 360.0-162.1 360.0 2.5 -16.2 -4.0