==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 11-JUL-06 2HM9 . COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS CASEI; . AUTHOR V.I.POLSHAKOV,B.BIRDSALL . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9648.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 105 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 16.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 14.8 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 13 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 17.3 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 0 0 1 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 1 1 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 PARALLEL BRIDGES PER LADDER . 1 1 0 0 0 0 1 1 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 . 1 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 T 0 0 44 0, 0.0 111,-1.5 0, 0.0 110,-1.0 0.000 360.0 360.0 360.0 142.9 -10.1 0.6 4.4 2 2 A A E -ab 95 112A 12 92,-1.9 94,-3.9 109,-0.2 2,-0.6 -0.960 360.0-136.8-130.1 146.9 -8.2 -0.7 1.4 3 3 A F E -ab 96 113A 0 109,-2.2 111,-2.8 -2,-0.3 2,-0.5 -0.908 19.9-179.0-107.9 117.8 -4.8 -2.3 1.1 4 4 A L E + b 0 114A 3 92,-1.5 2,-0.3 -2,-0.6 111,-0.2 -0.941 24.2 128.4-119.9 113.3 -2.4 -1.2 -1.7 5 5 A W E - b 0 115A 18 109,-1.3 111,-1.2 -2,-0.5 2,-0.4 -0.991 42.2-135.5-155.7 160.5 1.0 -2.9 -2.0 6 6 A A E + b 0 116A 12 -2,-0.3 2,-0.3 109,-0.2 111,-0.2 -0.970 24.8 175.2-124.5 137.3 3.2 -4.7 -4.4 7 7 A Q E - b 0 117A 32 109,-3.3 111,-1.0 -2,-0.4 6,-0.2 -0.969 24.5-122.0-140.2 155.8 5.2 -7.9 -3.8 8 8 A D E - b 0 118A 1 4,-1.6 113,-0.2 -2,-0.3 111,-0.1 -0.225 42.6 -93.2 -85.9 178.5 7.4 -10.3 -5.6 9 9 A R S S+ 0 0 166 111,-1.2 112,-0.1 109,-0.8 110,-0.1 0.892 125.1 52.4 -61.2 -41.6 6.9 -14.1 -6.0 10 10 A D S S- 0 0 137 110,-0.2 -1,-0.2 112,-0.1 111,-0.1 0.896 118.8-107.9 -63.4 -40.7 9.0 -14.9 -2.9 11 11 A G S S+ 0 0 20 1,-0.3 117,-1.4 116,-0.0 2,-0.3 0.523 70.6 135.3 122.2 12.2 7.0 -12.4 -0.7 12 12 A L E -H 127 0B 18 115,-0.2 -4,-1.6 110,-0.2 -1,-0.3 -0.706 39.0-161.8 -92.6 142.2 9.4 -9.6 -0.1 13 13 A I E - 0 0 27 113,-0.7 2,-0.3 -2,-0.3 114,-0.2 0.817 52.5 -95.7 -89.2 -35.8 8.3 -6.0 -0.4 14 14 A G E -H 126 0B 0 112,-1.8 112,-2.2 5,-0.2 2,-0.4 -0.996 49.5 -45.5 156.8-151.5 11.7 -4.4 -0.8 15 15 A K B > S-I 18 0C 91 3,-1.8 3,-1.4 -2,-0.3 108,-0.0 -0.977 111.4 -10.6-125.3 127.9 14.5 -2.8 1.1 16 16 A D T 3 S- 0 0 107 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.758 123.7 -65.4 59.8 24.1 14.0 -0.0 3.7 17 17 A G T 3 S+ 0 0 31 1,-0.3 -1,-0.3 31,-0.0 2,-0.3 0.048 111.1 117.0 89.8 -29.2 10.4 0.2 2.5 18 18 A H B < S-I 15 0C 70 -3,-1.4 -3,-1.8 1,-0.1 -1,-0.3 -0.573 76.3-110.3 -79.0 135.9 11.4 1.4 -0.9 19 19 A L - 0 0 68 -2,-0.3 -5,-0.2 -5,-0.2 -1,-0.1 -0.506 26.3-163.7 -66.7 109.5 10.5 -0.8 -3.9 20 20 A P + 0 0 46 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.781 69.4 78.9 -66.6 -26.7 13.9 -2.1 -5.2 21 21 A W S S- 0 0 4 2,-0.1 2,-1.0 -3,-0.0 101,-0.0 -0.671 76.9-140.3 -87.4 136.9 12.3 -3.1 -8.5 22 22 A H + 0 0 146 -2,-0.3 3,-0.1 1,-0.0 -1,-0.0 -0.772 36.7 155.0 -99.9 92.1 11.7 -0.5 -11.1 23 23 A L >> - 0 0 2 -2,-1.0 4,-2.8 1,-0.1 3,-0.5 -0.714 20.2-174.7-119.0 79.3 8.3 -1.3 -12.7 24 24 A P H 3> S+ 0 0 58 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.761 86.6 57.1 -42.4 -29.6 6.9 2.0 -14.1 25 25 A D H 3> S+ 0 0 67 2,-0.2 4,-1.8 1,-0.2 -2,-0.0 0.964 110.1 38.8 -69.8 -54.4 3.8 0.0 -14.9 26 26 A D H <> S+ 0 0 4 -3,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.879 116.0 54.1 -64.5 -35.4 3.1 -1.2 -11.4 27 27 A L H X S+ 0 0 60 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.912 106.0 52.6 -63.0 -42.2 4.2 2.2 -10.0 28 28 A H H X S+ 0 0 122 -4,-1.9 4,-2.7 -5,-0.3 -1,-0.2 0.888 105.8 55.3 -59.1 -41.3 1.6 3.9 -12.3 29 29 A Y H X S+ 0 0 30 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.915 107.4 48.0 -59.7 -46.3 -1.0 1.5 -10.9 30 30 A F H X S+ 0 0 46 -4,-1.8 4,-1.4 1,-0.2 -2,-0.2 0.932 113.5 47.4 -61.5 -46.5 -0.3 2.6 -7.3 31 31 A R H < S+ 0 0 139 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.895 111.6 50.4 -61.5 -43.2 -0.4 6.3 -8.3 32 32 A A H >< S+ 0 0 58 -4,-2.7 3,-1.2 1,-0.2 -1,-0.2 0.871 108.0 52.8 -63.9 -39.0 -3.6 6.0 -10.3 33 33 A Q H 3< S+ 0 0 61 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.810 105.4 55.2 -66.5 -31.9 -5.4 4.1 -7.4 34 34 A T T >< S+ 0 0 0 -4,-1.4 3,-0.8 -5,-0.2 2,-0.6 0.338 82.6 112.2 -85.6 8.4 -4.6 6.9 -5.0 35 35 A V T < S- 0 0 60 -3,-1.2 22,-0.2 1,-0.2 3,-0.1 -0.735 91.7 -2.8 -89.7 120.5 -6.1 9.6 -7.2 36 36 A G T 3 S+ 0 0 42 20,-0.8 2,-0.3 -2,-0.6 -1,-0.2 0.681 118.0 96.5 77.4 18.1 -9.3 11.1 -5.7 37 37 A K S < S- 0 0 84 -3,-0.8 21,-0.9 55,-0.1 2,-0.3 -0.964 80.0-102.3-139.0 154.7 -9.1 8.8 -2.7 38 38 A I E -cd 58 94A 2 55,-1.7 57,-2.5 -2,-0.3 2,-0.3 -0.606 39.8-174.8 -79.5 130.5 -7.8 9.0 0.9 39 39 A M E -cd 59 95A 1 19,-2.5 21,-1.7 -2,-0.3 2,-0.5 -0.960 14.1-150.0-128.1 145.8 -4.4 7.2 1.4 40 40 A V E -cd 60 96A 0 55,-3.0 57,-2.5 -2,-0.3 58,-0.8 -0.964 12.9-170.7-119.7 129.8 -2.4 6.5 4.6 41 41 A V E -cd 61 98A 5 19,-3.7 21,-2.8 -2,-0.5 58,-0.3 -0.970 18.0-128.9-123.5 133.7 1.4 6.2 4.6 42 42 A G E > -c 62 0A 2 56,-2.1 4,-2.0 -2,-0.4 21,-0.2 -0.151 33.4-102.6 -70.3 168.6 3.6 5.1 7.4 43 43 A R H > S+ 0 0 95 19,-0.9 4,-1.3 1,-0.2 5,-0.2 0.929 124.9 51.9 -61.2 -43.0 6.7 7.2 8.6 44 44 A R H > S+ 0 0 140 1,-0.2 4,-1.8 2,-0.2 3,-0.3 0.887 108.2 54.3 -59.7 -36.0 9.1 4.9 6.7 45 45 A T H > S+ 0 0 18 1,-0.2 4,-3.5 2,-0.2 -1,-0.2 0.909 97.1 62.9 -63.6 -43.9 6.9 5.4 3.7 46 46 A Y H < S+ 0 0 66 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.864 112.7 37.0 -50.0 -39.3 7.2 9.2 4.0 47 47 A E H < S+ 0 0 128 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.762 117.3 51.8 -84.6 -27.5 10.9 8.7 3.4 48 48 A S H < S+ 0 0 33 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.2 0.773 86.9 102.7 -79.4 -27.9 10.4 5.9 0.9 49 49 A F S < S- 0 0 21 -4,-3.5 3,-0.2 -5,-0.1 -31,-0.1 -0.191 71.1-137.2 -56.6 147.1 8.0 7.9 -1.2 50 50 A P S S- 0 0 110 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.899 81.3 -7.8 -74.8 -43.0 9.4 9.4 -4.5 51 51 A K S S- 0 0 161 0, 0.0 -3,-0.0 0, 0.0 -5,-0.0 -0.853 81.0-124.1-161.0 120.6 7.7 12.8 -4.2 52 52 A R + 0 0 86 -2,-0.3 2,-0.1 -3,-0.2 21,-0.1 -0.916 67.6 29.2-129.2 156.6 5.1 14.1 -1.8 53 53 A P S S- 0 0 75 0, 0.0 20,-0.1 0, 0.0 19,-0.1 0.611 71.3-137.4 -87.6 175.3 2.5 15.4 -1.5 54 54 A L > - 0 0 27 18,-0.2 3,-0.8 -2,-0.1 2,-0.3 -0.632 21.1-112.8 -90.9 148.8 0.3 14.3 -4.4 55 55 A P T 3 S+ 0 0 75 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.614 94.1 6.9 -84.3 139.1 -2.0 16.8 -6.2 56 56 A E T 3 S+ 0 0 182 -2,-0.3 -20,-0.8 1,-0.2 2,-0.3 0.776 113.3 101.5 64.0 27.8 -5.8 16.4 -6.0 57 57 A R S < S- 0 0 51 -3,-0.8 2,-0.7 -22,-0.2 -1,-0.2 -0.948 71.9-126.0-139.2 159.1 -5.3 13.7 -3.5 58 58 A T E -c 38 0A 39 -21,-0.9 -19,-2.5 -2,-0.3 2,-0.4 -0.896 30.6-177.4-110.9 104.4 -5.5 13.3 0.3 59 59 A N E -c 39 0A 9 -2,-0.7 15,-2.2 13,-0.4 2,-0.4 -0.815 5.4-166.0-103.0 141.0 -2.4 11.8 1.8 60 60 A V E -ce 40 74A 3 -21,-1.7 -19,-3.7 -2,-0.4 2,-0.7 -0.989 11.9-146.6-128.8 131.0 -1.9 11.1 5.5 61 61 A V E -ce 41 75A 4 13,-2.2 15,-1.7 -2,-0.4 2,-0.5 -0.835 18.8-168.4 -98.0 116.5 1.3 10.3 7.4 62 62 A L E +ce 42 76A 6 -21,-2.8 -19,-0.9 -2,-0.7 2,-0.3 -0.895 10.2 170.6-108.3 127.9 0.8 7.8 10.3 63 63 A T - 0 0 15 13,-1.0 -21,-0.0 -2,-0.5 -2,-0.0 -0.955 39.1-131.2-134.4 154.1 3.5 7.1 12.9 64 64 A H S S+ 0 0 121 -2,-0.3 2,-0.4 1,-0.1 -1,-0.1 0.885 96.2 53.5 -66.6 -42.5 3.7 5.2 16.2 65 65 A Q S > S- 0 0 134 1,-0.1 3,-0.9 -3,-0.1 -1,-0.1 -0.807 71.9-146.0-101.2 136.9 5.3 8.2 18.0 66 66 A E T 3 S+ 0 0 150 -2,-0.4 -1,-0.1 1,-0.2 11,-0.0 0.543 92.2 79.8 -76.2 -4.1 3.8 11.7 18.1 67 67 A D T 3 S+ 0 0 133 2,-0.0 -1,-0.2 0, 0.0 2,-0.1 0.856 79.9 82.5 -67.0 -35.3 7.4 13.1 18.1 68 68 A Y < - 0 0 54 -3,-0.9 2,-0.3 9,-0.0 -5,-0.1 -0.434 63.2-169.1 -72.8 144.4 7.5 12.5 14.3 69 69 A Q - 0 0 142 -2,-0.1 2,-0.3 -26,-0.0 5,-0.1 -0.935 3.9-157.3-134.0 153.7 6.0 15.0 11.9 70 70 A A - 0 0 19 -2,-0.3 2,-0.4 3,-0.2 5,-0.2 -0.985 8.5-140.9-136.9 146.2 5.3 14.9 8.2 71 71 A Q S S+ 0 0 164 -2,-0.3 3,-0.1 1,-0.1 -19,-0.0 -0.875 84.2 15.7-107.9 134.4 4.8 17.4 5.4 72 72 A G S S+ 0 0 42 -2,-0.4 -13,-0.4 -19,-0.1 2,-0.4 0.119 116.0 70.7 95.1 -21.3 2.3 17.0 2.6 73 73 A A S S- 0 0 12 -20,-0.1 -13,-0.3 -15,-0.1 -3,-0.2 -0.993 91.4-103.8-132.4 136.4 0.3 14.4 4.5 74 74 A V E -e 60 0A 63 -15,-2.2 -13,-2.2 -2,-0.4 2,-0.7 -0.255 36.3-133.0 -58.5 133.0 -1.9 14.7 7.6 75 75 A V E +e 61 0A 41 -15,-0.2 2,-0.4 -5,-0.2 -13,-0.2 -0.806 30.8 171.5 -96.4 115.8 -0.0 13.3 10.6 76 76 A V E +e 62 0A 18 -15,-1.7 -13,-1.0 -2,-0.7 -16,-0.0 -0.977 19.8 176.9-125.2 128.8 -2.0 11.0 12.9 77 77 A H + 0 0 57 -2,-0.4 2,-0.5 -15,-0.2 -1,-0.1 0.412 62.2 89.8-105.0 -2.3 -0.6 9.0 15.7 78 78 A D > - 0 0 108 1,-0.2 4,-1.7 -12,-0.0 5,-0.1 -0.869 59.9-158.7-101.4 123.7 -4.0 7.5 16.8 79 79 A V H > S+ 0 0 74 -2,-0.5 4,-1.5 1,-0.2 -1,-0.2 0.918 99.6 48.8 -62.7 -43.4 -5.1 4.2 15.2 80 80 A A H > S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.868 106.4 57.8 -63.7 -37.0 -8.7 5.1 16.1 81 81 A A H > S+ 0 0 37 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.874 101.7 54.7 -62.8 -37.7 -8.3 8.5 14.6 82 82 A V H X S+ 0 0 3 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.938 109.7 46.9 -62.2 -44.2 -7.3 7.1 11.2 83 83 A F H X S+ 0 0 66 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.920 112.5 49.9 -61.5 -45.4 -10.5 5.0 11.1 84 84 A A H X S+ 0 0 46 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.874 105.9 56.5 -63.2 -37.6 -12.6 8.0 12.1 85 85 A Y H X S+ 0 0 62 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.933 109.7 44.5 -60.4 -46.4 -11.0 10.2 9.5 86 86 A A H < S+ 0 0 17 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.879 111.0 55.6 -63.6 -37.7 -12.0 7.7 6.8 87 87 A K H < S+ 0 0 171 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.858 102.6 56.3 -62.8 -36.8 -15.5 7.6 8.4 88 88 A Q H < S+ 0 0 138 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.895 109.9 45.8 -63.8 -40.0 -15.7 11.3 8.1 89 89 A H >< + 0 0 84 -4,-1.4 3,-0.8 1,-0.2 -1,-0.3 -0.622 64.0 160.7-105.7 73.5 -15.2 11.2 4.3 90 90 A P T 3 S+ 0 0 87 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.810 73.9 63.8 -60.3 -30.0 -17.5 8.3 3.3 91 91 A D T 3 S+ 0 0 151 -3,-0.2 2,-0.5 1,-0.1 -2,-0.1 0.862 102.0 54.4 -64.2 -35.6 -17.4 9.6 -0.3 92 92 A Q S < S- 0 0 48 -3,-0.8 -55,-0.1 -6,-0.2 2,-0.1 -0.877 85.0-132.9-106.4 130.6 -13.6 8.9 -0.4 93 93 A E - 0 0 102 -2,-0.5 -55,-1.7 -57,-0.2 2,-0.5 -0.437 17.6-123.9 -78.5 152.5 -12.3 5.5 0.3 94 94 A L E - d 0 38A 5 -57,-0.1 -92,-1.9 -2,-0.1 2,-0.4 -0.862 26.9-173.6-102.6 127.5 -9.3 4.9 2.6 95 95 A V E -ad 2 39A 6 -57,-2.5 -55,-3.0 -2,-0.5 2,-0.9 -0.969 21.2-135.2-123.4 134.3 -6.2 3.1 1.3 96 96 A I E -ad 3 40A 0 -94,-3.9 -92,-1.5 -2,-0.4 -55,-0.2 -0.781 17.0-176.3 -93.5 106.7 -3.2 2.0 3.2 97 97 A A E - 0 0 17 -57,-2.5 2,-0.2 -2,-0.9 -56,-0.2 0.564 48.2-156.4 -73.7 -11.3 -0.0 2.8 1.2 98 98 A G E - d 0 41A 1 -58,-0.8 -56,-2.1 1,-0.2 -1,-0.3 -0.714 59.6-151.9 123.9-178.4 2.1 1.2 3.9 99 99 A G > - 0 0 22 -58,-0.3 4,-3.0 -2,-0.2 -1,-0.2 0.561 46.3-118.5 -85.8-163.3 4.3 0.4 5.6 100 100 A A H > S+ 0 0 19 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.880 117.3 53.3 -61.4 -37.9 3.9 -3.2 6.8 101 101 A Q H > S+ 0 0 115 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.929 112.9 44.5 -63.2 -40.6 3.8 -2.0 10.4 102 102 A I H > S+ 0 0 10 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.907 113.0 51.4 -66.1 -42.9 0.9 0.3 9.3 103 103 A F H X S+ 0 0 10 -4,-3.0 4,-1.1 1,-0.2 -2,-0.2 0.913 109.1 50.8 -61.0 -44.8 -0.6 -2.6 7.3 104 104 A T H X S+ 0 0 47 -4,-3.3 4,-0.6 1,-0.2 3,-0.3 0.894 106.6 54.8 -60.6 -41.9 -0.5 -4.8 10.4 105 105 A A H < S+ 0 0 44 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.870 124.3 24.0 -61.6 -39.5 -2.2 -2.2 12.6 106 106 A F H < S+ 0 0 2 -4,-1.7 3,-0.3 -3,-0.1 -1,-0.2 0.286 96.5 97.5-109.1 7.6 -5.2 -1.9 10.2 107 107 A K H >< S+ 0 0 58 -4,-1.1 3,-0.9 -3,-0.3 -3,-0.1 0.856 79.6 56.7 -63.7 -38.2 -4.9 -5.4 8.5 108 108 A D T 3< S+ 0 0 108 -4,-0.6 -1,-0.2 1,-0.3 2,-0.1 0.821 110.1 43.9 -64.2 -35.4 -7.5 -6.9 10.8 109 109 A D T 3 S+ 0 0 94 -3,-0.3 2,-0.5 -4,-0.1 -1,-0.3 -0.326 85.7 120.4-108.9 49.6 -10.2 -4.3 9.9 110 110 A V < - 0 0 1 -3,-0.9 -108,-0.1 1,-0.1 50,-0.1 -0.950 36.0-176.9-116.9 130.1 -9.7 -4.2 6.1 111 111 A D S S+ 0 0 89 -110,-1.0 49,-1.9 -2,-0.5 2,-0.4 0.757 73.3 45.4 -94.1 -28.2 -12.4 -5.1 3.6 112 112 A T E -bF 2 159A 43 -111,-1.5 -109,-2.2 47,-0.2 2,-0.5 -0.969 63.6-168.9-123.0 128.0 -10.5 -4.7 0.4 113 113 A L E -bF 3 158A 4 45,-3.6 45,-2.7 -2,-0.4 2,-0.5 -0.948 1.2-167.8-116.0 126.4 -7.0 -6.1 -0.3 114 114 A L E +bF 4 157A 14 -111,-2.8 -109,-1.3 -2,-0.5 2,-0.4 -0.950 11.4 176.1-115.2 122.8 -4.9 -5.2 -3.4 115 115 A V E -bF 5 156A 3 41,-2.5 41,-2.3 -2,-0.5 2,-0.5 -0.986 17.4-157.1-129.8 135.1 -1.8 -7.2 -4.2 116 116 A T E -bF 6 155A 0 -111,-1.2 -109,-3.3 -2,-0.4 2,-0.5 -0.931 13.9-161.3-110.8 125.2 0.7 -7.0 -7.2 117 117 A R E -bF 7 154A 102 37,-2.0 37,-1.8 -2,-0.5 2,-0.4 -0.914 3.0-155.6-112.9 134.0 2.7 -10.1 -8.0 118 118 A L E -bF 8 153A 0 -111,-1.0 -109,-0.8 -2,-0.5 35,-0.2 -0.890 14.1-146.5-108.8 132.3 5.9 -10.1 -10.1 119 119 A A S S+ 0 0 35 33,-1.7 31,-0.3 30,-0.5 -1,-0.1 0.872 86.3 66.0 -62.6 -37.0 7.0 -13.3 -11.9 120 120 A G S S- 0 0 14 30,-0.7 -111,-1.2 29,-0.5 2,-0.3 -0.138 83.7-126.2 -76.8 177.6 10.6 -12.3 -11.3 121 121 A S - 0 0 73 -113,-0.2 2,-0.3 -112,-0.1 -2,-0.1 -0.967 17.8-166.5-132.5 148.5 12.2 -12.1 -7.8 122 122 A F - 0 0 63 -2,-0.3 2,-0.4 -110,-0.1 -110,-0.2 -0.936 14.9-133.2-131.9 153.5 14.1 -9.4 -5.9 123 123 A E + 0 0 185 -2,-0.3 2,-0.3 -103,-0.0 -108,-0.1 -0.896 36.7 141.8-111.9 136.6 16.3 -9.4 -2.7 124 124 A G - 0 0 24 -2,-0.4 -109,-0.2 -110,-0.1 -110,-0.0 -0.971 56.6-111.3-161.9 169.4 15.9 -7.0 0.1 125 125 A D S S+ 0 0 144 -2,-0.3 2,-0.5 -113,-0.0 -110,-0.2 0.466 95.5 74.4 -89.3 -1.9 16.1 -6.5 3.9 126 126 A T E -H 14 0B 19 -112,-2.2 -112,-1.8 -108,-0.1 -113,-0.7 -0.953 60.1-173.6-117.8 128.4 12.3 -5.8 4.2 127 127 A K E -H 12 0B 153 -2,-0.5 -115,-0.2 -115,-0.2 2,-0.1 -0.898 30.3-104.6-119.1 147.7 9.6 -8.5 3.9 128 128 A M - 0 0 21 -117,-1.4 3,-0.1 -2,-0.3 -121,-0.0 -0.421 42.3-104.9 -70.3 141.0 5.8 -8.1 3.8 129 129 A I - 0 0 26 1,-0.1 -1,-0.1 -2,-0.1 -28,-0.0 -0.288 46.5 -88.8 -64.2 148.5 3.9 -9.1 6.9 130 130 A P - 0 0 116 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.258 45.0-160.8 -60.4 143.8 2.0 -12.4 6.9 131 131 A L - 0 0 28 -3,-0.1 2,-1.3 -24,-0.0 3,-0.2 -0.957 22.9-121.5-128.7 147.5 -1.6 -12.3 5.6 132 132 A N > + 0 0 71 -2,-0.3 4,-1.1 1,-0.2 3,-0.3 -0.687 32.1 174.0 -91.3 90.5 -4.5 -14.8 6.0 133 133 A W T 4 S+ 0 0 93 -2,-1.3 3,-0.2 1,-0.2 -1,-0.2 0.848 77.3 57.1 -62.1 -38.1 -5.3 -15.6 2.4 134 134 A D T 4 S+ 0 0 129 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.858 101.5 56.2 -64.2 -35.7 -7.9 -18.2 3.5 135 135 A D T 4 S+ 0 0 78 -3,-0.3 26,-1.0 25,-0.0 2,-0.4 0.848 108.5 54.0 -65.0 -34.2 -9.8 -15.6 5.5 136 136 A F E < S-G 160 0A 17 -4,-1.1 2,-0.5 -3,-0.2 24,-0.2 -0.841 74.9-149.2-105.8 140.8 -10.2 -13.5 2.4 137 137 A T E -G 159 0A 84 22,-1.6 22,-1.9 -2,-0.4 2,-0.1 -0.925 24.4-114.8-112.0 128.2 -11.6 -14.6 -0.9 138 138 A K E -G 158 0A 80 -2,-0.5 20,-0.3 20,-0.2 3,-0.1 -0.388 27.7-176.1 -62.4 129.6 -10.4 -13.1 -4.2 139 139 A V E - 0 0 68 18,-2.3 2,-0.3 1,-0.4 19,-0.2 0.854 63.5 -17.0 -92.3 -45.6 -13.2 -11.2 -6.0 140 140 A S E -G 157 0A 85 17,-1.3 17,-2.9 2,-0.0 -1,-0.4 -0.983 56.5-172.1-158.0 162.4 -11.3 -10.2 -9.2 141 141 A S E -G 156 0A 65 -2,-0.3 2,-0.4 15,-0.2 15,-0.3 -0.987 10.0-149.1-157.3 158.2 -7.9 -9.9 -10.8 142 142 A R E -G 155 0A 164 13,-3.5 13,-3.9 -2,-0.3 2,-0.5 -0.989 9.8-147.8-134.0 141.3 -6.1 -8.7 -13.9 143 143 A T E -G 154 0A 92 -2,-0.4 2,-0.4 11,-0.3 11,-0.2 -0.943 13.2-177.8-116.8 127.5 -2.9 -9.9 -15.6 144 144 A V E -G 153 0A 49 9,-2.0 9,-1.4 -2,-0.5 2,-0.6 -0.973 13.0-151.0-122.0 130.3 -0.5 -7.7 -17.5 145 145 A E - 0 0 163 -2,-0.4 2,-0.1 7,-0.2 7,-0.1 -0.904 10.5-163.5-109.7 122.2 2.6 -9.0 -19.3 146 146 A D - 0 0 54 -2,-0.6 6,-0.2 2,-0.4 5,-0.0 -0.276 38.6 -96.4 -88.6 177.8 5.7 -6.8 -19.7 147 147 A T S S+ 0 0 131 -2,-0.1 -1,-0.1 4,-0.1 3,-0.0 0.926 112.5 49.0 -62.2 -45.8 8.6 -7.3 -22.1 148 148 A N S > S- 0 0 96 1,-0.1 4,-1.9 -28,-0.0 -2,-0.4 -0.770 84.0-131.4 -98.2 140.9 10.7 -9.1 -19.4 149 149 A P T 4 S+ 0 0 92 0, 0.0 -30,-0.5 0, 0.0 -29,-0.5 0.873 110.5 52.0 -56.7 -38.3 9.2 -11.9 -17.3 150 150 A A T 4 S+ 0 0 26 -31,-0.3 -30,-0.7 1,-0.2 -31,-0.1 0.894 110.0 49.4 -64.2 -39.5 10.5 -10.3 -14.1 151 151 A L T 4 S+ 0 0 51 -3,-0.2 -1,-0.2 -33,-0.1 -125,-0.2 0.805 90.0 99.1 -67.8 -34.6 8.8 -7.1 -15.1 152 152 A T < + 0 0 22 -4,-1.9 -33,-1.7 -6,-0.2 -32,-0.4 -0.332 54.0 171.9 -59.8 135.9 5.5 -8.8 -15.9 153 153 A H E -FG 118 144A 2 -9,-1.4 -9,-2.0 -35,-0.2 2,-0.3 -0.954 22.5-144.9-144.7 162.4 3.0 -8.5 -13.0 154 154 A T E -FG 117 143A 11 -37,-1.8 -37,-2.0 -2,-0.3 2,-0.5 -0.945 12.2-135.0-130.3 153.2 -0.6 -9.2 -12.2 155 155 A Y E +FG 116 142A 20 -13,-3.9 -13,-3.5 -2,-0.3 2,-0.4 -0.929 23.2 179.0-112.6 125.8 -3.2 -7.4 -10.0 156 156 A E E -FG 115 141A 21 -41,-2.3 -41,-2.5 -2,-0.5 2,-0.5 -0.981 10.5-159.3-126.7 136.5 -5.4 -9.4 -7.6 157 157 A V E -FG 114 140A 36 -17,-2.9 -18,-2.3 -2,-0.4 -17,-1.3 -0.960 5.4-166.7-120.3 127.5 -8.1 -8.0 -5.3 158 158 A W E -FG 113 138A 44 -45,-2.7 -45,-3.6 -2,-0.5 2,-0.5 -0.909 5.1-156.4-113.2 138.9 -9.4 -9.8 -2.2 159 159 A Q E -FG 112 137A 89 -22,-1.9 -22,-1.6 -2,-0.4 -47,-0.2 -0.941 24.4-117.0-114.9 130.4 -12.5 -8.9 -0.2 160 160 A K E - G 0 136A 69 -49,-1.9 2,-0.4 -2,-0.5 -24,-0.2 -0.399 30.7-159.5 -65.6 135.8 -12.9 -9.9 3.5 161 161 A K 0 0 123 -26,-1.0 -1,-0.0 1,-0.1 0, 0.0 -0.946 360.0 360.0-121.1 139.7 -15.8 -12.3 4.1 162 162 A A 0 0 147 -2,-0.4 -1,-0.1 -26,-0.0 -26,-0.0 0.464 360.0 360.0-140.3 360.0 -17.6 -13.0 7.4