==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 18-DEC-08 3FL9 . COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE (DHFR); . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS; . AUTHOR C.R.BOURNE,W.W.BARROW . 1309 17 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 65596.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 848 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 201 15.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 149 11.4 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 . 13 1.0 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 . 182 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 181 13.8 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+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 0 3 19 1 0 2 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 15 15 3 5 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 5 1 0 2 6 7 0 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 . 4 0 0 0 0 0 7 1 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 M 0 0 84 0, 0.0 2,-0.2 0, 0.0 91,-0.2 0.000 360.0 360.0 360.0 119.7 15.6 15.8 18.3 2 2 A I E -a 92 0A 64 89,-2.0 91,-2.5 1,-0.1 2,-0.8 -0.461 360.0-151.3 -60.5 123.2 17.3 17.4 21.3 3 3 A V E -a 93 0A 5 105,-0.3 107,-3.9 -2,-0.2 108,-1.6 -0.883 23.9-179.3 -98.4 103.5 19.7 15.0 22.9 4 4 A S E -ab 94 111A 0 89,-1.9 91,-3.7 -2,-0.8 2,-0.3 -0.778 20.8-141.8-106.0 148.1 19.9 15.9 26.6 5 5 A F E -ab 95 112A 0 106,-2.8 108,-2.4 -2,-0.3 2,-0.4 -0.819 8.6-164.7 -98.9 146.8 21.9 14.4 29.5 6 6 A M E + b 0 113A 7 89,-3.2 2,-0.4 -2,-0.3 108,-0.2 -0.840 25.4 153.8-131.5 99.4 20.4 14.1 32.9 7 7 A V E - b 0 114A 5 106,-1.9 108,-2.6 -2,-0.4 2,-0.5 -0.948 36.0-151.2-126.3 143.1 23.0 13.4 35.6 8 8 A A E - b 0 115A 17 -2,-0.4 108,-0.2 106,-0.2 2,-0.1 -0.971 36.2-175.7-105.4 130.3 23.3 14.0 39.3 9 9 A M E - b 0 116A 11 106,-3.4 108,-1.2 -2,-0.5 2,-0.2 -0.330 17.7-132.0-121.6-165.6 27.0 14.5 40.1 10 10 A D > - 0 0 7 106,-0.2 3,-1.0 -2,-0.1 110,-0.2 -0.777 39.2 -92.3-141.2 177.8 29.6 15.0 42.9 11 11 A E T 3 S+ 0 0 61 108,-2.2 109,-0.2 106,-0.4 107,-0.1 0.908 135.0 34.9 -62.0 -40.9 32.5 17.1 43.9 12 12 A N T 3 S- 0 0 41 107,-0.4 -1,-0.3 109,-0.1 115,-0.2 0.086 127.5-100.7 -99.3 20.9 34.6 14.4 42.3 13 13 A R < + 0 0 66 -3,-1.0 114,-1.9 1,-0.2 2,-0.3 0.790 63.8 169.1 64.7 29.1 32.0 13.8 39.6 14 14 A V B +H 126 0B 1 112,-0.2 112,-0.2 1,-0.1 -1,-0.2 -0.585 16.8 169.0 -73.2 130.5 30.7 10.7 41.3 15 15 A I - 0 0 21 110,-1.0 2,-0.3 -2,-0.3 111,-0.2 0.070 62.8 -18.8-127.1 21.6 27.5 9.4 39.9 16 16 A G - 0 0 0 109,-0.7 -1,-0.3 5,-0.1 109,-0.2 -0.920 47.4-137.3 163.5 174.8 27.3 6.0 41.7 17 17 A K S S- 0 0 84 3,-1.7 108,-0.4 106,-0.3 106,-0.1 0.049 85.3 -16.6-123.1-120.1 29.0 3.3 43.6 18 18 A D S S- 0 0 106 106,-0.1 3,-0.1 1,-0.1 105,-0.0 0.839 132.0 -49.8 -60.6 -30.3 28.5 -0.5 43.2 19 19 A N S S+ 0 0 86 1,-0.3 31,-0.1 106,-0.1 2,-0.1 0.265 118.2 71.1-173.6 -26.4 25.4 0.5 41.4 20 20 A N S S- 0 0 84 1,-0.1 -3,-1.7 30,-0.1 -1,-0.3 -0.369 85.7 -79.7-101.5 178.8 23.2 2.9 43.3 21 21 A L - 0 0 83 -5,-0.2 -1,-0.1 2,-0.1 -5,-0.1 -0.590 24.9-143.4 -79.4 140.2 23.5 6.6 44.3 22 22 A P S S+ 0 0 27 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.621 85.0 56.7 -75.3 -14.8 25.7 7.6 47.2 23 23 A W S S- 0 0 11 98,-0.0 2,-0.5 2,-0.0 -2,-0.1 -0.801 72.5-141.2-119.7 160.8 23.2 10.3 48.2 24 24 A R + 0 0 106 -2,-0.3 126,-0.0 125,-0.0 4,-0.0 -0.806 32.3 160.5-125.1 88.8 19.5 10.2 49.1 25 25 A L > + 0 0 3 -2,-0.5 4,-2.9 1,-0.1 5,-0.2 -0.760 15.3 173.8-121.7 86.6 17.8 13.3 47.6 26 26 A P H > S+ 0 0 49 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.736 87.2 50.8 -58.0 -29.5 14.0 13.1 47.2 27 27 A S H > S+ 0 0 27 2,-0.2 4,-2.5 116,-0.2 3,-0.2 0.936 110.8 46.9 -74.7 -51.2 13.8 16.7 46.2 28 28 A E H > S+ 0 0 3 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.946 112.2 51.3 -50.8 -52.3 16.5 16.3 43.5 29 29 A L H X S+ 0 0 87 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.797 108.5 52.1 -60.7 -30.3 14.8 13.2 42.3 30 30 A Q H X S+ 0 0 118 -4,-1.0 4,-2.6 -3,-0.2 -1,-0.2 0.917 108.3 49.4 -69.4 -45.0 11.5 15.2 42.1 31 31 A Y H X S+ 0 0 39 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.845 113.0 49.8 -60.7 -34.5 13.2 17.9 40.0 32 32 A V H X S+ 0 0 13 -4,-2.3 4,-2.1 -5,-0.2 5,-0.2 0.975 110.4 48.6 -65.1 -55.6 14.5 15.0 37.9 33 33 A K H < S+ 0 0 83 -4,-2.8 4,-0.4 1,-0.2 -2,-0.2 0.846 114.9 44.5 -54.5 -40.5 11.1 13.5 37.5 34 34 A K H < S+ 0 0 64 -4,-2.6 3,-0.5 2,-0.2 -1,-0.2 0.886 111.2 52.3 -72.9 -41.2 9.4 16.8 36.6 35 35 A T H < S+ 0 0 40 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.910 114.8 39.7 -64.2 -45.2 12.1 17.9 34.1 36 36 A T S >< S+ 0 0 0 -4,-2.1 3,-2.5 -5,-0.2 2,-0.4 0.493 83.8 129.2 -86.4 -1.5 12.1 14.7 32.0 37 37 A M T 3 S+ 0 0 71 -3,-0.5 21,-0.1 -4,-0.4 20,-0.1 -0.372 76.1 21.1 -63.4 112.7 8.3 14.3 32.2 38 38 A G T 3 S+ 0 0 53 19,-0.8 -1,-0.3 -2,-0.4 20,-0.1 0.210 110.2 90.3 114.5 -9.2 7.0 13.7 28.7 39 39 A H S < S- 0 0 50 -3,-2.5 -1,-0.4 1,-0.1 54,-0.2 -0.914 81.7 -98.5-122.9 145.3 10.4 12.6 27.3 40 40 A P - 0 0 0 0, 0.0 54,-1.1 0, 0.0 2,-0.6 -0.092 29.2-129.8 -55.7 155.2 12.0 9.2 26.9 41 41 A L E -cd 60 94A 0 18,-3.2 20,-0.9 52,-0.1 2,-0.8 -0.925 16.9-161.4-114.5 106.5 14.5 7.9 29.5 42 42 A I E +cd 61 95A 0 52,-2.3 54,-4.0 -2,-0.6 55,-0.7 -0.770 30.2 146.0 -91.4 109.2 17.7 6.6 27.9 43 43 A M E -cd 62 97A 1 18,-1.8 20,-1.6 -2,-0.8 55,-0.2 -0.995 43.7-112.4-146.5 149.1 19.6 4.4 30.4 44 44 A G E > -c 63 0A 5 53,-2.0 4,-2.6 -2,-0.3 5,-0.2 -0.126 35.7-104.0 -73.1 174.2 21.7 1.3 30.4 45 45 A R H > S+ 0 0 24 18,-1.1 4,-2.1 2,-0.2 5,-0.2 0.963 118.5 44.6 -67.9 -56.1 20.8 -2.0 32.0 46 46 A K H > S+ 0 0 57 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.818 115.1 53.6 -60.0 -30.8 22.8 -2.0 35.2 47 47 A N H >> S+ 0 0 34 2,-0.2 4,-2.6 50,-0.2 3,-1.1 0.981 108.5 45.3 -64.2 -59.6 21.6 1.6 35.6 48 48 A Y H 3X S+ 0 0 18 -4,-2.6 4,-2.7 1,-0.3 -2,-0.2 0.806 110.7 56.2 -54.1 -31.5 17.9 0.8 35.3 49 49 A E H 3< S+ 0 0 125 -4,-2.1 -1,-0.3 2,-0.2 -2,-0.2 0.784 106.1 50.2 -75.4 -26.6 18.5 -2.1 37.6 50 50 A A H << S+ 0 0 18 -3,-1.1 -2,-0.2 -4,-1.0 -1,-0.2 0.942 109.1 51.1 -67.3 -52.5 19.9 0.4 40.1 51 51 A I H < S- 0 0 63 -4,-2.6 -2,-0.2 1,-0.1 -3,-0.2 0.924 98.0-153.9 -48.4 -49.5 16.8 2.5 39.6 52 52 A G < + 0 0 51 -4,-2.7 -1,-0.1 -5,-0.2 -3,-0.1 -0.108 56.8 33.4 103.3 -35.7 14.8 -0.6 40.3 53 53 A R S S- 0 0 136 -5,-0.1 2,-0.4 0, 0.0 -3,-0.0 -0.989 90.7 -78.9-152.8 158.3 11.5 0.1 38.4 54 54 A P - 0 0 42 0, 0.0 20,-0.0 0, 0.0 5,-0.0 -0.438 41.7-134.5 -60.3 114.6 10.0 1.9 35.3 55 55 A L > - 0 0 34 -2,-0.4 3,-0.6 1,-0.1 -14,-0.1 -0.653 29.5-133.2 -70.2 113.4 9.7 5.6 35.9 56 56 A P T 3 S+ 0 0 64 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.123 78.5 48.4 -68.8 162.7 6.2 6.4 34.7 57 57 A G T 3 S+ 0 0 53 1,-0.1 -19,-0.8 -20,-0.1 2,-0.3 0.389 105.2 60.6 90.6 -1.6 5.2 9.3 32.5 58 58 A R S < S- 0 0 21 -3,-0.6 2,-0.6 -21,-0.1 -1,-0.1 -0.992 93.8 -88.3-155.2 154.0 7.9 8.7 29.9 59 59 A R - 0 0 64 -2,-0.3 -18,-3.2 1,-0.1 2,-1.3 -0.546 38.5-146.5 -67.3 114.3 9.1 6.1 27.4 60 60 A N E -c 41 0A 9 -2,-0.6 15,-1.7 13,-0.3 2,-0.5 -0.683 23.3-178.8 -86.7 89.9 11.5 3.9 29.4 61 61 A I E -ce 42 75A 0 -2,-1.3 -18,-1.8 -20,-0.9 2,-0.3 -0.797 5.9-163.8 -95.0 128.3 14.1 3.0 26.8 62 62 A I E -ce 43 76A 0 13,-2.5 15,-4.1 -2,-0.5 2,-0.4 -0.827 7.1-144.8-115.3 148.3 17.0 0.7 27.9 63 63 A V E +ce 44 77A 14 -20,-1.6 -18,-1.1 -2,-0.3 2,-0.3 -0.925 31.6 139.0-118.3 137.1 20.3 -0.1 26.2 64 64 A T - 0 0 33 13,-1.5 5,-0.1 -2,-0.4 -2,-0.0 -0.919 52.8-129.9-170.7 141.5 22.2 -3.4 26.2 65 65 A R S S+ 0 0 247 -2,-0.3 -1,-0.1 3,-0.1 4,-0.1 0.967 81.9 106.2 -56.0 -52.3 24.2 -5.6 23.9 66 66 A N > - 0 0 84 1,-0.2 3,-0.8 2,-0.1 -2,-0.1 0.010 55.1-166.8 -32.3 107.8 21.9 -8.5 25.0 67 67 A E T 3 S+ 0 0 75 1,-0.2 -1,-0.2 11,-0.0 11,-0.0 0.801 87.1 53.5 -70.3 -29.9 19.6 -9.1 22.0 68 68 A G T 3 S+ 0 0 55 2,-0.0 2,-0.6 0, 0.0 -1,-0.2 -0.212 78.7 124.1-102.6 41.4 17.5 -11.2 24.3 69 69 A Y < + 0 0 33 -3,-0.8 2,-0.3 -5,-0.1 -5,-0.1 -0.909 30.4 165.6-103.7 122.8 16.9 -8.7 27.0 70 70 A H + 0 0 159 -2,-0.6 2,-0.3 5,-0.0 5,-0.1 -0.958 10.9 176.0-131.8 152.5 13.3 -7.9 27.9 71 71 A V > - 0 0 36 3,-0.4 3,-1.0 -2,-0.3 -2,-0.0 -0.933 37.9 -97.3-158.0 136.4 11.7 -6.1 30.8 72 72 A E T 3 S+ 0 0 171 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.185 101.8 9.6 -66.1 140.3 8.0 -5.2 31.4 73 73 A G T 3 S+ 0 0 57 1,-0.2 -13,-0.3 -19,-0.0 2,-0.3 0.769 111.3 102.5 67.4 28.0 6.7 -1.7 30.6 74 74 A C < - 0 0 25 -3,-1.0 -3,-0.4 -15,-0.1 2,-0.3 -1.000 63.4-138.9-146.5 140.3 10.0 -0.9 28.9 75 75 A E E -e 61 0A 68 -15,-1.7 -13,-2.5 -2,-0.3 2,-0.4 -0.678 22.6-150.4 -91.1 152.1 11.5 -0.6 25.4 76 76 A V E -e 62 0A 31 -2,-0.3 2,-0.4 -15,-0.2 -13,-0.2 -0.988 11.0-171.6-130.3 135.6 15.0 -1.9 24.7 77 77 A A E -e 63 0A 0 -15,-4.1 -13,-1.5 -2,-0.4 6,-0.1 -0.965 15.6-166.4-126.8 142.1 17.6 -0.7 22.2 78 78 A H S S+ 0 0 69 -2,-0.4 2,-0.3 -15,-0.2 -15,-0.1 0.424 76.3 37.1-105.5 -1.9 20.9 -2.4 21.3 79 79 A S S > S- 0 0 27 1,-0.1 4,-1.1 0, 0.0 5,-0.1 -0.951 74.2-124.0-142.9 158.2 22.3 0.6 19.4 80 80 A V H > S+ 0 0 13 -2,-0.3 4,-3.3 2,-0.2 3,-0.5 0.892 119.8 56.9 -63.6 -40.9 22.4 4.4 19.7 81 81 A E H > S+ 0 0 142 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.789 104.5 50.8 -58.3 -30.4 21.0 4.2 16.1 82 82 A E H > S+ 0 0 65 2,-0.2 4,-2.2 3,-0.2 -1,-0.3 0.729 111.1 47.9 -85.2 -25.3 18.1 2.1 17.5 83 83 A V H X S+ 0 0 0 -4,-1.1 4,-3.7 -3,-0.5 -2,-0.2 0.927 113.2 46.1 -73.7 -52.1 17.4 4.7 20.2 84 84 A F H < S+ 0 0 50 -4,-3.3 -2,-0.2 1,-0.2 -3,-0.2 0.861 113.9 53.4 -56.3 -34.5 17.5 7.5 17.6 85 85 A E H >< S+ 0 0 91 -4,-1.3 3,-1.4 -5,-0.3 -2,-0.2 0.975 113.1 39.7 -61.4 -57.5 15.4 5.2 15.6 86 86 A L H 3< S+ 0 0 53 -4,-2.2 3,-0.5 1,-0.3 -2,-0.2 0.892 121.1 43.8 -58.9 -43.5 12.8 4.7 18.5 87 87 A C T >< S+ 0 0 0 -4,-3.7 3,-1.4 1,-0.2 -1,-0.3 0.097 78.3 119.4 -93.9 22.4 13.0 8.4 19.5 88 88 A K T < S+ 0 0 114 -3,-1.4 -1,-0.2 1,-0.3 -2,-0.1 0.815 80.1 40.4 -56.7 -35.8 12.9 9.5 15.9 89 89 A N T 3 S+ 0 0 150 -3,-0.5 -1,-0.3 -4,-0.2 2,-0.1 0.389 94.5 114.6 -95.0 1.1 9.6 11.5 16.4 90 90 A E < - 0 0 44 -3,-1.4 3,-0.1 -6,-0.2 -51,-0.1 -0.436 57.7-153.1 -74.3 144.9 10.7 12.7 19.8 91 91 A E S S- 0 0 78 1,-0.3 -89,-2.0 -90,-0.2 2,-0.3 0.688 81.9 -3.0 -87.5 -22.4 11.4 16.4 20.4 92 92 A E E -a 2 0A 16 -91,-0.2 -1,-0.3 -89,-0.0 2,-0.3 -0.936 62.1-162.6-166.3 144.7 13.9 15.7 23.1 93 93 A I E -a 3 0A 0 -91,-2.5 -89,-1.9 -2,-0.3 2,-0.4 -0.822 15.7-133.6-125.1 168.7 15.3 12.7 25.0 94 94 A F E -ad 4 41A 1 -54,-1.1 -52,-2.3 -2,-0.3 2,-0.4 -0.892 5.7-149.6-131.4 104.0 17.3 12.3 28.2 95 95 A I E +ad 5 42A 0 -91,-3.7 -89,-3.2 -2,-0.4 -52,-0.2 -0.586 29.4 173.2 -65.8 123.6 20.4 10.2 28.5 96 96 A F E + 0 0 29 -54,-4.0 2,-0.3 -2,-0.4 -53,-0.2 0.872 36.6 3.2-111.3 -50.3 20.2 9.1 32.1 97 97 A G E S+ d 0 43A 3 -55,-0.7 -53,-2.0 -90,-0.1 -1,-0.3 -0.998 76.4 66.0-159.3 151.6 22.6 6.6 33.5 98 98 A G >> - 0 0 26 -2,-0.3 4,-1.6 -55,-0.2 3,-0.9 0.415 61.1-126.9 99.4 113.9 25.7 4.4 32.9 99 99 A A H 3> S+ 0 0 22 1,-0.3 4,-1.0 2,-0.2 -1,-0.1 0.754 112.7 51.6 -61.4 -24.9 29.0 6.3 32.3 100 100 A Q H 3> S+ 0 0 137 2,-0.2 4,-0.6 1,-0.2 -1,-0.3 0.657 102.2 58.9 -88.5 -19.9 29.4 4.3 29.1 101 101 A I H <> S+ 0 0 17 -3,-0.9 4,-1.4 2,-0.2 3,-0.5 0.857 103.2 53.5 -73.8 -37.9 26.0 5.2 27.9 102 102 A Y H X S+ 0 0 3 -4,-1.6 4,-1.3 1,-0.2 3,-0.3 0.912 105.0 54.0 -59.4 -42.8 27.0 8.9 28.1 103 103 A D H < S+ 0 0 63 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.714 106.9 53.0 -67.6 -20.6 30.1 8.1 26.0 104 104 A L H < S+ 0 0 58 -4,-0.6 -1,-0.2 -3,-0.5 -2,-0.2 0.796 118.1 34.1 -81.5 -32.9 27.8 6.6 23.3 105 105 A F H >X S+ 0 0 0 -4,-1.4 4,-1.9 -3,-0.3 3,-1.5 0.406 93.6 96.1-102.8 -1.7 25.6 9.7 23.2 106 106 A L T 3< S+ 0 0 61 -4,-1.3 3,-0.4 1,-0.3 -1,-0.1 0.920 78.0 56.9 -49.0 -51.7 28.4 12.1 23.8 107 107 A P T 34 S+ 0 0 90 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.611 118.7 33.3 -61.9 -11.3 29.0 12.7 20.0 108 108 A Y T <4 S+ 0 0 111 -3,-1.5 -105,-0.3 -106,-0.0 -2,-0.2 0.576 82.9 133.9-119.5 -19.3 25.3 13.9 19.8 109 109 A V < + 0 0 7 -4,-1.9 -105,-0.2 -3,-0.4 3,-0.1 0.095 21.6 172.5 -41.9 146.3 24.6 15.5 23.1 110 110 A D + 0 0 65 -107,-3.9 49,-0.9 1,-0.4 2,-0.3 0.649 61.8 25.7-124.0 -44.6 22.8 18.9 22.9 111 111 A K E -bF 4 158A 28 -108,-1.6 -106,-2.8 47,-0.2 2,-0.6 -0.962 62.8-146.5-131.7 146.3 21.9 19.9 26.5 112 112 A L E -bF 5 157A 4 45,-3.0 45,-1.4 -2,-0.3 2,-1.1 -0.924 7.1-171.1-119.0 110.3 23.4 19.0 29.9 113 113 A Y E +bF 6 156A 23 -108,-2.4 -106,-1.9 -2,-0.6 2,-0.5 -0.697 25.7 172.6 -97.1 82.2 21.1 18.7 32.9 114 114 A I E -bF 7 155A 11 41,-2.2 41,-2.7 -2,-1.1 2,-0.4 -0.816 21.1-165.1-102.7 124.6 23.8 18.4 35.6 115 115 A T E -bF 8 154A 1 -108,-2.6 -106,-3.4 -2,-0.5 2,-0.5 -0.861 9.9-159.4 -98.0 138.2 23.2 18.4 39.3 116 116 A K E -bF 9 153A 70 37,-2.0 37,-1.6 -2,-0.4 2,-0.6 -0.949 4.9-157.8-124.4 112.5 26.3 18.9 41.5 117 117 A I E - 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