==== 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 23-JUN-09 3HZG . COMPND 2 MOLECULE: THYMIDYLATE SYNTHASE THYX; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR B.L.STAKER,P.RATHOD,J.HUNTER . 978 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37485.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 717 73.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 137 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 61 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 120 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 354 36.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 0.9 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 3 0 0 4 0 0 0 8 5 0 3 0 0 4 0 0 0 0 0 0 0 0 0 0 4 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 6 0 0 7 5 2 0 2 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 . 4 4 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 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 A 0 0 62 0, 0.0 2,-0.5 0, 0.0 113,-0.1 0.000 360.0 360.0 360.0 -45.6 43.9 -6.1 -53.4 2 3 A E - 0 0 116 111,-0.3 113,-1.9 130,-0.1 2,-0.3 -0.909 360.0-148.4 -98.7 127.5 42.8 -2.7 -52.2 3 4 A T B -a 115 0A 43 -2,-0.5 113,-0.2 111,-0.2 111,-0.1 -0.759 6.1-132.4-100.0 145.8 42.9 -2.4 -48.3 4 5 A A - 0 0 8 111,-3.3 2,-0.3 -2,-0.3 113,-0.3 -0.815 11.1-151.1-103.7 123.8 40.6 -0.3 -46.2 5 6 A P - 0 0 84 0, 0.0 2,-0.1 0, 0.0 77,-0.1 -0.726 33.2 -98.8 -88.2 141.0 41.7 2.0 -43.4 6 7 A L + 0 0 42 -2,-0.3 2,-0.4 75,-0.1 77,-0.2 -0.354 46.9 174.8 -53.3 122.7 39.4 2.8 -40.4 7 8 A R E -C 82 0B 121 75,-2.3 75,-1.9 -2,-0.1 2,-0.4 -0.994 10.2-170.2-133.9 136.5 37.6 6.1 -40.9 8 9 A V E -C 81 0B 13 -2,-0.4 2,-0.6 73,-0.2 73,-0.2 -0.942 2.6-169.5-134.2 109.7 34.9 7.4 -38.5 9 10 A Q E -C 80 0B 25 71,-2.2 71,-2.2 -2,-0.4 2,-0.6 -0.892 20.2-137.5-111.0 115.6 32.8 10.4 -39.4 10 11 A L E +C 79 0B 32 -2,-0.6 69,-0.3 69,-0.2 3,-0.1 -0.517 32.3 167.4 -62.9 110.8 30.5 12.1 -36.8 11 12 A I E + 0 0 0 67,-2.9 496,-2.4 -2,-0.6 2,-0.3 0.522 54.4 22.8-109.6 -6.2 27.4 12.7 -38.8 12 13 A A E +CD 78 506B 2 66,-1.4 66,-1.7 494,-0.2 2,-0.3 -0.982 53.1 162.5-160.3 148.7 24.9 13.6 -36.2 13 14 A K E -CD 77 505B 77 492,-2.2 492,-3.7 -2,-0.3 2,-0.3 -0.932 44.6 -70.4-156.5 175.7 24.4 15.0 -32.7 14 15 A T E - D 0 504B 12 62,-0.5 17,-0.7 -2,-0.3 2,-0.6 -0.595 30.4-156.7 -84.5 129.8 21.9 16.5 -30.4 15 16 A D E - D 0 503B 60 488,-3.5 488,-2.0 -2,-0.3 2,-0.3 -0.931 18.8-153.9 -99.7 114.3 20.6 20.1 -30.9 16 17 A F E - D 0 502B 28 -2,-0.6 2,-0.3 486,-0.2 486,-0.3 -0.713 17.9-177.1 -96.6 143.6 19.2 21.5 -27.6 17 18 A L - 0 0 83 484,-2.7 12,-0.0 -2,-0.3 -2,-0.0 -0.806 23.2-141.7-138.7 89.9 16.4 24.2 -27.2 18 19 A A - 0 0 51 -2,-0.3 482,-0.1 1,-0.1 16,-0.0 -0.175 29.2-107.0 -55.9 138.2 15.9 25.1 -23.5 19 20 A P > - 0 0 6 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 -0.560 27.8-130.0 -71.6 137.6 12.2 25.7 -22.8 20 21 A P T 3 S+ 0 0 109 0, 0.0 2,-0.7 0, 0.0 -2,-0.1 0.869 96.9 53.3 -57.9 -48.2 11.6 29.5 -22.3 21 22 A D T 3 S+ 0 0 130 2,-0.1 -3,-0.0 -3,-0.0 0, 0.0 -0.127 86.0 96.6 -86.2 37.1 9.6 29.6 -19.0 22 23 A V S < S- 0 0 21 -3,-1.0 2,-1.9 -2,-0.7 -4,-0.0 -0.967 73.4-135.1-128.2 120.3 12.1 27.5 -17.0 23 24 A P + 0 0 101 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.491 66.2 98.9 -83.5 83.5 14.6 29.6 -14.9 24 25 A W + 0 0 21 -2,-1.9 2,-0.3 2,-0.0 -2,-0.1 -0.954 38.2 174.6-158.3 142.8 17.8 27.8 -15.6 25 26 A T - 0 0 114 -2,-0.3 2,-0.3 21,-0.3 0, 0.0 -0.858 11.9-165.2-137.4 174.1 20.7 28.4 -18.0 26 27 A T - 0 0 31 -2,-0.3 2,-1.3 2,-0.2 29,-0.1 -0.970 34.9-105.6-156.2 167.0 24.0 26.5 -18.2 27 28 A D S S+ 0 0 97 -2,-0.3 2,-0.3 2,-0.0 30,-0.2 -0.457 96.3 53.1 -93.1 59.9 27.5 26.8 -19.7 28 29 A A - 0 0 38 -2,-1.3 -2,-0.2 28,-0.1 2,-0.2 -0.972 58.3-161.5-174.2 161.9 26.8 24.3 -22.5 29 30 A D > + 0 0 132 -2,-0.3 4,-1.5 -12,-0.0 5,-0.1 -0.734 54.7 36.5-139.2-159.7 24.5 23.5 -25.3 30 31 A G H > S- 0 0 13 -14,-0.2 4,-2.0 -2,-0.2 3,-0.4 -0.050 118.3 -14.3 51.8-151.1 23.6 20.4 -27.3 31 32 A G H > S+ 0 0 2 -17,-0.7 4,-2.6 1,-0.2 -1,-0.2 0.885 136.6 51.6 -43.1 -55.2 23.6 17.0 -25.7 32 33 A P H > S+ 0 0 14 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.861 111.1 49.3 -67.4 -28.2 25.4 17.9 -22.6 33 34 A A H X S+ 0 0 0 -4,-1.5 4,-2.1 -3,-0.4 -2,-0.2 0.865 110.1 52.2 -67.4 -38.4 23.0 20.7 -21.9 34 35 A L H X S+ 0 0 0 -4,-2.0 4,-3.2 1,-0.2 5,-0.2 0.939 107.8 51.6 -62.8 -46.5 20.1 18.4 -22.6 35 36 A V H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.848 109.2 48.9 -63.9 -41.1 21.4 15.9 -20.0 36 37 A E H X S+ 0 0 0 -4,-1.4 4,-2.4 -5,-0.2 -1,-0.2 0.928 112.5 48.9 -60.7 -48.4 21.8 18.5 -17.3 37 38 A F H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.983 109.4 52.4 -57.6 -52.5 18.2 19.7 -18.0 38 39 A A H X S+ 0 0 0 -4,-3.2 4,-0.8 1,-0.2 -1,-0.2 0.900 112.4 46.0 -46.0 -47.8 16.9 16.1 -17.9 39 40 A G H X S+ 0 0 0 -4,-2.0 4,-0.6 1,-0.2 3,-0.5 0.864 111.8 49.0 -70.1 -37.4 18.5 15.6 -14.5 40 41 A R H >X>S+ 0 0 7 -4,-2.4 5,-1.5 1,-0.2 3,-1.2 0.880 102.5 63.8 -67.3 -36.7 17.4 18.8 -13.0 41 42 A A H 3<5S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.756 94.4 62.2 -59.5 -27.6 13.8 18.1 -14.2 42 43 A C H 3<5S+ 0 0 8 -4,-0.8 552,-2.3 -3,-0.5 -1,-0.3 0.866 118.2 25.6 -65.1 -36.5 13.8 15.1 -11.9 43 44 A Y H <<5S- 0 0 90 -3,-1.2 -2,-0.2 -4,-0.6 -1,-0.2 0.309 99.3-128.3-108.0 3.0 14.2 17.3 -8.8 44 45 A Q T <5 + 0 0 37 -4,-0.8 2,-0.6 1,-0.2 -3,-0.2 0.891 61.4 146.0 39.3 47.4 12.7 20.5 -10.2 45 46 A S < + 0 0 43 -5,-1.5 -1,-0.2 1,-0.1 -2,-0.1 -0.884 17.5 161.6-115.6 100.0 16.0 22.2 -9.0 46 47 A W + 0 0 39 -2,-0.6 -21,-0.3 -3,-0.1 2,-0.1 0.426 46.0 91.9-100.3 1.7 17.1 24.9 -11.4 47 48 A S - 0 0 82 -23,-0.1 3,-0.1 1,-0.0 -2,-0.0 -0.444 64.6-137.3-101.7 173.9 19.4 26.8 -9.1 48 49 A K + 0 0 68 -2,-0.1 6,-0.1 1,-0.1 -2,-0.0 -0.538 39.6 146.5-135.5 62.0 23.2 26.6 -8.4 49 50 A P + 0 0 114 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.672 65.6 68.5 -71.2 -16.6 24.1 26.8 -4.7 50 51 A N > - 0 0 79 -3,-0.1 3,-0.7 1,-0.1 4,-0.5 -0.912 65.1-158.4-116.5 111.2 27.0 24.4 -5.1 51 52 A P T 3 S+ 0 0 113 0, 0.0 3,-0.3 0, 0.0 4,-0.2 0.733 93.2 65.4 -62.6 -19.5 30.1 25.6 -7.0 52 53 A K T 3 S+ 0 0 175 1,-0.2 3,-0.3 2,-0.1 10,-0.1 0.952 118.2 23.0 -62.5 -46.8 31.0 21.9 -7.6 53 54 A T S < S+ 0 0 29 -3,-0.7 -1,-0.2 5,-0.2 6,-0.1 0.128 93.2 102.0-109.3 18.0 27.9 21.4 -9.7 54 55 A A S S+ 0 0 29 -4,-0.5 2,-0.3 -3,-0.3 -1,-0.2 0.545 78.9 60.2 -80.4 -10.0 27.2 25.0 -10.9 55 56 A T S > S- 0 0 58 -3,-0.3 4,-2.7 -4,-0.2 5,-0.3 -0.870 93.1-113.9-112.5 154.6 28.7 24.2 -14.3 56 57 A N H > S+ 0 0 10 -2,-0.3 4,-3.2 1,-0.2 5,-0.3 0.901 115.8 51.8 -45.8 -51.0 27.6 21.7 -16.9 57 58 A A H > S+ 0 0 46 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.913 111.4 44.5 -59.6 -47.5 30.8 19.7 -16.4 58 59 A G H > S+ 0 0 16 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.918 115.2 48.6 -66.1 -44.6 30.6 19.4 -12.6 59 60 A Y H X S+ 0 0 21 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.938 114.7 45.1 -56.2 -50.2 26.8 18.5 -12.8 60 61 A L H X S+ 0 0 1 -4,-3.2 4,-2.0 -5,-0.3 5,-0.2 0.927 110.3 55.7 -63.1 -42.7 27.5 15.9 -15.5 61 62 A R H X S+ 0 0 147 -4,-3.1 4,-2.3 -5,-0.3 -1,-0.2 0.936 110.4 45.6 -44.9 -51.5 30.5 14.6 -13.4 62 63 A H H X S+ 0 0 89 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.878 107.3 54.4 -69.6 -48.9 28.2 14.1 -10.4 63 64 A I H X>S+ 0 0 5 -4,-2.3 5,-2.1 1,-0.2 4,-0.7 0.874 113.7 45.3 -46.5 -43.4 25.3 12.4 -12.3 64 65 A I H <5S+ 0 0 6 -4,-2.0 3,-0.4 -5,-0.2 -2,-0.2 0.917 110.0 55.0 -69.4 -43.6 28.0 10.0 -13.5 65 66 A D H <5S+ 0 0 77 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.897 113.2 39.5 -57.0 -46.6 29.5 9.7 -10.0 66 67 A V H <5S- 0 0 93 -4,-2.8 -1,-0.3 -5,-0.1 -2,-0.2 0.575 114.9-118.1 -82.6 -11.4 26.2 8.7 -8.4 67 68 A G T <5 + 0 0 30 -4,-0.7 2,-1.7 -3,-0.4 3,-0.2 0.791 57.6 153.5 82.4 29.8 25.3 6.5 -11.4 68 69 A H > < + 0 0 52 -5,-2.1 3,-0.9 1,-0.2 4,-0.3 -0.582 14.6 158.7 -81.5 71.9 22.1 8.1 -12.6 69 70 A F G > + 0 0 63 -2,-1.7 3,-1.6 1,-0.2 4,-0.4 0.769 53.4 79.0 -74.5 -23.0 22.9 6.8 -16.1 70 71 A S G > S+ 0 0 18 1,-0.3 3,-1.7 -3,-0.2 4,-0.3 0.828 86.8 59.8 -52.8 -36.1 19.3 7.1 -17.3 71 72 A V G X S+ 0 0 0 -3,-0.9 3,-1.0 1,-0.3 -1,-0.3 0.783 93.3 65.3 -69.3 -27.1 19.8 10.8 -17.9 72 73 A L G X S+ 0 0 0 -3,-1.6 116,-0.9 -4,-0.3 3,-0.8 0.631 86.7 74.7 -65.2 -13.4 22.6 10.1 -20.3 73 74 A E G < S+ 0 0 11 -3,-1.7 -1,-0.2 -4,-0.4 -2,-0.2 0.721 76.2 75.0 -77.0 -20.1 20.1 8.5 -22.8 74 75 A H G < S+ 0 0 2 -3,-1.0 2,-0.4 -4,-0.3 -1,-0.2 0.772 89.8 63.9 -67.1 -22.2 18.5 11.7 -23.9 75 76 A A < - 0 0 0 -3,-0.8 113,-2.4 -4,-0.2 2,-0.3 -0.814 66.8-167.6-113.0 139.1 21.5 12.7 -26.1 76 77 A S E - E 0 187B 18 -2,-0.4 -62,-0.5 111,-0.3 2,-0.4 -0.880 13.8-163.5-124.7 152.7 22.7 10.8 -29.2 77 78 A V E -CE 13 186B 0 109,-2.1 109,-2.0 -2,-0.3 2,-0.4 -0.999 8.6-159.5-131.4 138.1 25.6 10.6 -31.6 78 79 A S E -CE 12 185B 2 -66,-1.7 -67,-2.9 -2,-0.4 -66,-1.4 -0.966 7.9-169.2-111.9 131.3 25.7 9.0 -35.1 79 80 A F E -CE 10 184B 0 105,-2.3 105,-2.3 -2,-0.4 2,-0.6 -0.862 20.0-142.9-108.4 152.5 28.9 7.9 -36.9 80 81 A Y E -CE 9 183B 7 -71,-2.2 -71,-2.2 -2,-0.3 2,-0.6 -0.974 26.6-166.2-107.5 105.2 29.4 6.7 -40.5 81 82 A I E +CE 8 182B 2 101,-2.7 101,-2.4 -2,-0.6 2,-0.3 -0.882 13.2 170.6 -97.8 113.7 32.1 4.0 -40.1 82 83 A T E +CE 7 181B 16 -75,-1.9 -75,-2.3 -2,-0.6 99,-0.2 -0.832 58.5 44.7-109.5 161.6 33.8 2.9 -43.3 83 84 A G E S+ 0 0 1 97,-0.6 2,-0.4 -2,-0.3 -1,-0.2 0.876 78.5 125.9 74.4 42.7 36.9 0.6 -43.3 84 85 A I E - E 0 180B 2 96,-1.1 96,-2.2 -3,-0.2 -1,-0.3 -0.955 58.6-113.1-128.7 141.5 35.7 -1.9 -40.7 85 86 A S E > - E 0 179B 2 -2,-0.4 4,-2.7 94,-0.2 5,-0.2 -0.333 16.1-119.6 -77.4 159.2 35.5 -5.6 -41.4 86 87 A R H > S+ 0 0 10 92,-1.6 4,-2.1 90,-0.7 91,-0.2 0.934 115.6 50.6 -53.4 -52.3 32.5 -7.8 -41.7 87 88 A S H 4 S+ 0 0 7 89,-1.8 4,-0.4 2,-0.2 -1,-0.2 0.864 111.0 51.4 -57.8 -36.1 33.6 -10.0 -38.8 88 89 A C H >> S+ 0 0 2 88,-0.3 4,-2.5 2,-0.2 3,-2.4 0.975 109.2 47.0 -67.3 -55.4 34.1 -6.9 -36.7 89 90 A T H 3X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.3 -1,-0.2 0.832 103.6 66.0 -54.0 -31.1 30.6 -5.5 -37.5 90 91 A H H 3< S+ 0 0 10 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.679 108.3 38.8 -65.2 -19.3 29.4 -9.0 -36.6 91 92 A E H X4 S+ 0 0 24 -3,-2.4 3,-1.4 -4,-0.4 4,-0.3 0.790 111.9 57.4 -91.8 -42.8 30.5 -8.3 -33.1 92 93 A L H >< S+ 0 0 2 -4,-2.5 3,-2.1 1,-0.2 -2,-0.2 0.946 100.5 57.4 -48.3 -53.8 29.4 -4.6 -33.1 93 94 A I T 3< S+ 0 0 1 -4,-2.7 -1,-0.2 1,-0.3 -3,-0.1 0.500 85.4 77.9 -68.6 -2.9 25.8 -5.5 -33.9 94 95 A R T < S+ 0 0 63 -3,-1.4 2,-0.9 -5,-0.1 -1,-0.3 0.669 73.1 93.5 -73.6 -17.9 25.4 -7.8 -30.8 95 96 A H X - 0 0 21 -3,-2.1 3,-0.7 -4,-0.3 737,-0.1 -0.705 64.2-168.8 -76.3 109.5 25.0 -4.5 -28.9 96 97 A R T 3 S+ 0 0 64 -2,-0.9 -1,-0.1 1,-0.3 736,-0.1 0.504 71.2 68.6 -88.9 -6.4 21.3 -4.2 -28.9 97 98 A H T 3 S+ 0 0 112 93,-0.1 90,-0.5 2,-0.1 2,-0.3 -0.022 88.0 85.2-103.8 29.0 20.8 -0.6 -27.7 98 99 A F S < S- 0 0 5 -3,-0.7 2,-0.4 88,-0.1 88,-0.2 -0.844 72.3-134.2-114.5 162.0 22.3 0.8 -30.9 99 100 A S E -F 185 0B 14 86,-2.2 86,-2.1 -2,-0.3 2,-0.3 -0.940 26.8-163.8-113.5 142.9 20.6 1.5 -34.2 100 101 A Y E -F 184 0B 4 -2,-0.4 2,-0.3 84,-0.2 84,-0.2 -0.951 26.6-178.5-134.3 144.1 22.2 0.4 -37.5 101 102 A S E -F 183 0B 0 82,-1.7 82,-2.8 -2,-0.3 2,-0.4 -0.902 27.9-173.8-137.0 111.4 22.2 0.9 -41.2 102 103 A Q E -F 182 0B 15 -2,-0.3 80,-0.2 80,-0.2 -2,-0.0 -0.883 33.8-103.3-118.9 134.6 24.7 -1.3 -43.0 103 104 A L - 0 0 7 78,-2.9 2,-0.5 -2,-0.4 429,-0.2 -0.295 45.4-138.9 -38.9 115.2 26.0 -1.7 -46.6 104 105 A S >> - 0 0 21 428,-2.6 4,-1.7 1,-0.1 3,-0.9 -0.818 14.5-153.1 -93.2 131.8 24.2 -4.9 -47.8 105 106 A Q T 34 S+ 0 0 0 -2,-0.5 66,-0.1 1,-0.2 5,-0.1 0.479 95.9 67.3 -73.3 -7.7 26.1 -7.4 -49.8 106 107 A R T 34 S+ 0 0 12 1,-0.1 62,-0.3 62,-0.1 -1,-0.2 0.754 115.5 22.6 -81.1 -26.7 22.7 -8.3 -51.3 107 108 A Y T <4 S+ 0 0 79 -3,-0.9 -2,-0.2 425,-0.2 -1,-0.1 0.578 111.0 71.5-113.8 -21.0 22.4 -5.0 -53.1 108 109 A V S < S- 0 0 14 -4,-1.7 -1,-0.1 424,-0.1 426,-0.1 -0.908 82.3-116.3-107.3 127.3 25.9 -3.6 -53.5 109 110 A P - 0 0 76 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.308 21.8-169.3 -56.8 135.7 28.4 -5.1 -56.0 110 111 A E > + 0 0 11 -5,-0.1 3,-1.3 1,-0.1 33,-0.1 0.048 52.0 114.8-113.5 23.5 31.4 -6.5 -54.2 111 112 A K T 3 S+ 0 0 123 1,-0.3 32,-0.1 31,-0.1 -1,-0.1 0.896 91.9 25.8 -58.5 -44.9 33.5 -7.0 -57.4 112 113 A D T 3 S+ 0 0 113 -3,-0.1 -1,-0.3 -111,-0.0 -2,-0.1 -0.081 89.9 158.1-113.3 31.3 36.1 -4.5 -56.3 113 114 A S < - 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