==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 03-MAR-11 3QYL . COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K-12; . AUTHOR E.J.COLLINS,A.L.LEE,M.J.CARROLL,R.V.MAULDIN,A.V.GROMOVA,S.F. . 159 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8667.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 14.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 15.1 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 . 2 1.3 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 . 16 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 15.7 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 0 3 0 0 0 1 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 2 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 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 M 0 0 91 0, 0.0 90,-3.0 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 132.1 21.3 -3.6 -10.5 2 2 A I E -a 91 0A 20 104,-0.4 106,-2.6 88,-0.2 107,-1.0 -0.928 360.0-177.6-108.7 129.1 18.2 -1.9 -12.0 3 3 A S E -ab 92 109A 0 88,-3.0 90,-3.0 -2,-0.5 2,-0.4 -0.944 17.0-145.4-124.7 149.5 15.1 -3.9 -12.8 4 4 A L E -ab 93 110A 0 105,-2.5 107,-2.7 -2,-0.3 2,-0.4 -0.917 12.0-167.1-109.7 141.5 11.8 -3.1 -14.4 5 5 A I E + b 0 111A 6 88,-2.4 2,-0.3 -2,-0.4 107,-0.2 -0.997 20.1 153.4-127.2 129.1 8.6 -4.8 -13.2 6 6 A A E - b 0 112A 6 105,-2.3 107,-1.8 -2,-0.4 2,-0.5 -0.990 40.2-133.0-153.5 152.6 5.3 -4.4 -15.2 7 7 A A E - b 0 113A 15 -2,-0.3 2,-0.5 105,-0.2 107,-0.2 -0.954 31.3-163.4-107.8 117.6 2.0 -6.2 -16.1 8 8 A L E - b 0 114A 6 105,-3.4 107,-3.4 -2,-0.5 6,-0.2 -0.944 9.7-169.2-113.1 126.4 1.3 -6.2 -19.8 9 9 A A > - 0 0 7 4,-3.1 3,-1.3 -2,-0.5 4,-0.3 -0.218 55.7 -42.6 -90.4-170.9 -1.9 -6.9 -21.5 10 10 A V G > S+ 0 0 42 107,-2.5 3,-1.2 1,-0.2 109,-0.3 -0.215 131.3 17.3 -60.0 143.7 -2.2 -7.5 -25.3 11 11 A D G 3 S- 0 0 131 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.710 130.8 -72.4 64.7 26.7 -0.1 -5.2 -27.6 12 12 A R G < S+ 0 0 79 -3,-1.3 113,-2.6 1,-0.2 2,-0.3 0.671 82.1 167.2 65.5 19.8 2.0 -4.2 -24.5 13 13 A V E < +H 124 0B 6 -3,-1.2 -4,-3.1 -4,-0.3 111,-0.3 -0.530 11.7 168.9 -67.4 128.0 -0.9 -2.2 -23.0 14 14 A I E + 0 0 18 109,-2.7 2,-0.3 1,-0.3 110,-0.2 0.532 55.6 5.9-117.5 -14.2 -0.2 -1.3 -19.4 15 15 A G E -H 123 0B 7 108,-1.3 107,-2.1 5,-0.1 108,-1.2 -0.994 43.3-159.2-164.0 167.1 -2.8 1.3 -18.5 16 16 A M B > S-I 19 0C 54 3,-2.1 3,-1.4 -2,-0.3 105,-0.1 -0.911 83.0 -12.9-154.3 123.5 -5.9 3.3 -19.4 17 17 A E T 3 S- 0 0 149 -2,-0.3 3,-0.1 1,-0.3 104,-0.0 0.906 128.2 -54.5 49.0 48.8 -7.1 6.6 -17.8 18 18 A N T 3 S+ 0 0 96 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.677 119.6 99.6 60.1 26.0 -4.6 6.1 -15.0 19 19 A A B < S-I 16 0C 48 -3,-1.4 -3,-2.1 2,-0.0 -1,-0.2 -0.867 72.6-129.6-131.8 165.3 -5.8 2.7 -14.0 20 20 A M - 0 0 108 -2,-0.3 2,-1.9 -5,-0.2 -5,-0.1 -0.934 31.6-149.0-114.8 92.4 -4.7 -0.9 -14.7 21 21 A P + 0 0 64 0, 0.0 2,-0.3 0, 0.0 -6,-0.1 -0.481 61.3 79.0 -78.6 80.0 -8.1 -2.3 -15.9 22 22 A W S S- 0 0 40 -2,-1.9 2,-0.6 97,-0.0 -2,-0.1 -0.909 70.0-130.7-167.0 155.8 -8.0 -6.0 -14.8 23 23 A N + 0 0 116 -2,-0.3 125,-1.0 4,-0.0 126,-0.2 -0.876 41.6 151.1-120.6 91.5 -8.5 -7.7 -11.5 24 24 A L >> + 0 0 6 -2,-0.6 4,-1.6 123,-0.2 3,-1.2 -0.710 19.1 176.6-126.7 86.0 -5.6 -10.1 -10.9 25 25 A P H 3> S+ 0 0 40 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.854 84.5 63.1 -52.6 -35.6 -4.8 -10.7 -7.2 26 26 A A H 3> S+ 0 0 22 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.859 102.9 49.0 -59.8 -34.2 -2.1 -13.2 -8.3 27 27 A D H <> S+ 0 0 21 -3,-1.2 4,-3.0 2,-0.2 -1,-0.2 0.885 108.9 52.5 -69.8 -41.4 -0.2 -10.3 -10.1 28 28 A L H X S+ 0 0 107 -4,-1.6 4,-2.5 1,-0.2 -2,-0.2 0.903 110.8 47.7 -60.8 -39.5 -0.5 -8.1 -6.9 29 29 A A H X S+ 0 0 61 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.905 113.5 47.4 -65.7 -41.0 1.1 -11.0 -4.9 30 30 A W H X S+ 0 0 8 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.920 112.9 48.9 -65.1 -45.4 3.9 -11.4 -7.5 31 31 A F H X S+ 0 0 43 -4,-3.0 4,-0.8 2,-0.2 5,-0.2 0.916 113.4 47.8 -58.1 -46.9 4.5 -7.7 -7.5 32 32 A K H >X S+ 0 0 121 -4,-2.5 4,-2.4 1,-0.2 3,-1.0 0.947 110.9 49.2 -61.5 -50.3 4.6 -7.7 -3.7 33 33 A R H 3< S+ 0 0 159 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.860 115.5 44.4 -59.6 -38.9 7.0 -10.7 -3.4 34 34 A N H 3< S+ 0 0 14 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.516 121.8 35.1 -85.3 -6.4 9.4 -9.1 -6.0 35 35 A T H X< S+ 0 0 0 -3,-1.0 3,-1.4 -4,-0.8 -2,-0.2 0.640 82.0 114.3-120.7 -22.5 9.4 -5.5 -4.6 36 36 A L T 3< S+ 0 0 66 -4,-2.4 21,-0.2 1,-0.3 20,-0.1 -0.203 88.7 12.1 -52.7 136.1 9.2 -5.8 -0.8 37 37 A D T 3 S+ 0 0 141 19,-2.6 -1,-0.3 1,-0.2 20,-0.2 0.776 110.3 99.9 64.8 27.4 12.3 -4.5 0.9 38 38 A K S < S- 0 0 42 -3,-1.4 -1,-0.2 18,-0.2 53,-0.1 -0.985 82.6-103.5-136.0 142.8 13.7 -3.0 -2.3 39 39 A P - 0 0 10 0, 0.0 53,-2.6 0, 0.0 2,-0.4 -0.475 36.0-149.6 -68.0 141.0 13.5 0.7 -3.3 40 40 A V E -cd 59 92A 0 18,-3.1 20,-2.9 51,-0.2 2,-0.5 -0.959 5.8-157.7-115.2 131.4 10.7 1.4 -5.9 41 41 A I E +cd 60 93A 0 51,-2.5 53,-2.7 -2,-0.4 54,-0.5 -0.925 20.7 166.5-109.6 133.4 11.0 4.2 -8.5 42 42 A M E -c 61 0A 1 18,-2.2 20,-2.9 -2,-0.5 54,-0.3 -0.972 34.4-112.4-142.5 156.4 7.8 5.5 -10.1 43 43 A G E > -c 62 0A 8 52,-1.9 4,-2.4 -2,-0.3 5,-0.2 -0.372 40.0-105.2 -77.9 163.4 6.6 8.4 -12.2 44 44 A R H > S+ 0 0 95 18,-0.9 4,-2.6 1,-0.2 5,-0.2 0.883 120.6 54.8 -60.2 -35.3 4.2 11.0 -10.7 45 45 A H H > S+ 0 0 69 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.929 109.1 47.0 -67.1 -36.0 1.2 9.6 -12.7 46 46 A T H > S+ 0 0 24 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.932 110.4 53.5 -67.2 -43.9 1.9 6.1 -11.3 47 47 A W H X S+ 0 0 19 -4,-2.4 4,-2.1 1,-0.2 5,-0.3 0.928 113.3 42.9 -55.0 -47.3 2.2 7.6 -7.7 48 48 A E H < S+ 0 0 112 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.873 113.5 52.9 -66.8 -37.6 -1.2 9.3 -8.3 49 49 A S H < S+ 0 0 46 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.944 112.0 43.9 -62.2 -48.8 -2.6 6.0 -9.8 50 50 A I H < S- 0 0 51 -4,-3.2 -2,-0.2 -5,-0.1 -1,-0.2 0.887 95.3-156.6 -64.7 -38.2 -1.5 3.9 -6.8 51 51 A G < + 0 0 42 -4,-2.1 -3,-0.1 -5,-0.3 -1,-0.1 0.372 59.4 35.8 81.3 -3.5 -2.8 6.7 -4.4 52 52 A R S S- 0 0 163 -5,-0.3 -2,-0.0 0, 0.0 -3,-0.0 -0.960 95.8 -71.2-167.3 163.0 -0.7 5.9 -1.3 53 53 A P - 0 0 35 0, 0.0 5,-0.1 0, 0.0 19,-0.1 -0.264 43.0-122.2 -65.0 149.4 2.8 4.8 -0.3 54 54 A L > - 0 0 26 3,-0.1 3,-0.8 -14,-0.1 -14,-0.1 -0.825 36.0-128.8 -86.9 115.9 3.7 1.2 -0.9 55 55 A P T 3 S+ 0 0 98 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 -0.267 83.5 25.7 -66.5 157.0 4.6 -0.1 2.6 56 56 A G T 3 S+ 0 0 47 1,-0.1 -19,-2.6 -20,-0.1 2,-0.3 0.604 108.4 84.2 70.3 16.3 7.9 -2.0 3.3 57 57 A R S < S- 0 0 25 -3,-0.8 2,-0.4 -21,-0.2 -1,-0.1 -0.990 85.2-110.8-145.0 143.4 9.7 -0.3 0.4 58 58 A K - 0 0 99 -2,-0.3 -18,-3.1 -3,-0.1 2,-0.6 -0.633 38.1-146.0 -75.6 124.8 11.5 3.0 -0.1 59 59 A N E -c 40 0A 11 -2,-0.4 14,-2.9 12,-0.2 2,-0.5 -0.875 18.2-176.5-101.2 120.6 9.2 5.0 -2.4 60 60 A I E -ce 41 73A 0 -20,-2.9 -18,-2.2 -2,-0.6 2,-0.5 -0.965 7.1-162.0-118.8 125.2 10.9 7.4 -4.9 61 61 A I E -ce 42 74A 0 12,-3.4 14,-2.6 -2,-0.5 2,-0.4 -0.935 9.5-142.6-112.1 132.3 8.8 9.5 -7.1 62 62 A L E +ce 43 75A 20 -20,-2.9 -18,-0.9 -2,-0.5 2,-0.3 -0.735 35.6 145.9 -90.4 134.2 10.0 11.3 -10.3 63 63 A S - 0 0 17 12,-2.5 4,-0.1 -2,-0.4 -2,-0.0 -0.912 48.8-140.4-161.6 141.4 8.6 14.8 -11.0 64 64 A S S S+ 0 0 89 -2,-0.3 12,-0.1 2,-0.1 -1,-0.0 0.581 92.9 65.9 -76.9 -9.5 10.0 17.9 -12.7 65 65 A Q S S- 0 0 125 1,-0.1 10,-0.1 10,-0.1 -2,-0.0 -0.683 102.5 -81.4-109.5 160.2 8.2 19.8 -9.9 66 66 A P - 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.245 57.6 -93.7 -59.1 154.1 8.7 19.9 -6.1 67 67 A G - 0 0 33 1,-0.1 3,-0.1 7,-0.1 7,-0.0 -0.188 23.5-160.0 -63.8 159.0 7.1 17.1 -4.1 68 68 A T S S+ 0 0 119 1,-0.2 2,-0.2 0, 0.0 -1,-0.1 -0.032 76.2 48.1-130.0 24.6 3.7 17.2 -2.5 69 69 A D > - 0 0 32 3,-0.1 3,-1.1 1,-0.0 -1,-0.2 -0.669 54.9-163.5-171.2 112.6 4.1 14.4 0.1 70 70 A D T 3 S+ 0 0 159 1,-0.2 4,-0.0 -2,-0.2 -1,-0.0 0.349 82.3 82.0 -84.1 6.3 6.9 13.8 2.6 71 71 A R T 3 S+ 0 0 163 2,-0.0 -1,-0.2 -18,-0.0 2,-0.2 0.594 101.2 41.5 -80.0 -12.8 6.0 10.2 3.3 72 72 A V S < S- 0 0 10 -3,-1.1 2,-0.5 -14,-0.1 -12,-0.2 -0.787 91.8-105.9-125.6 168.2 7.9 9.5 0.0 73 73 A T E -e 60 0A 51 -14,-2.9 -12,-3.4 -2,-0.2 2,-0.4 -0.882 30.7-151.7-101.0 131.4 11.1 10.7 -1.6 74 74 A W E +e 61 0A 42 -2,-0.5 2,-0.3 -14,-0.2 -12,-0.2 -0.871 16.2 177.2-108.6 137.1 10.9 13.1 -4.6 75 75 A V E -e 62 0A 2 -14,-2.6 -12,-2.5 -2,-0.4 -10,-0.1 -0.940 26.5-151.2-136.4 157.5 13.5 13.4 -7.4 76 76 A K S S+ 0 0 128 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.1 0.336 75.7 29.9-114.5 5.3 13.9 15.4 -10.7 77 77 A S S > S- 0 0 55 1,-0.1 4,-2.5 -14,-0.0 5,-0.1 -0.975 77.1-109.8-157.4 160.9 16.0 13.0 -12.9 78 78 A V H > S+ 0 0 20 -2,-0.3 4,-2.5 2,-0.2 5,-0.2 0.925 120.2 48.2 -58.3 -49.2 16.7 9.4 -13.6 79 79 A D H > S+ 0 0 107 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.865 111.5 49.4 -65.4 -35.0 20.3 9.7 -12.1 80 80 A E H > S+ 0 0 82 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.914 110.6 51.6 -66.7 -42.6 18.9 11.5 -9.0 81 81 A A H X S+ 0 0 0 -4,-2.5 4,-0.6 2,-0.2 -2,-0.2 0.912 112.1 45.4 -58.3 -47.3 16.3 8.7 -8.6 82 82 A I H >< S+ 0 0 38 -4,-2.5 3,-1.1 1,-0.2 4,-0.5 0.929 113.1 50.9 -63.0 -44.8 19.0 6.0 -8.8 83 83 A A H >< S+ 0 0 72 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.911 103.2 58.6 -60.5 -43.3 21.2 8.0 -6.4 84 84 A A H 3< S+ 0 0 25 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.664 96.8 63.9 -60.4 -19.5 18.3 8.4 -3.8 85 85 A C T << S- 0 0 7 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.716 95.7-155.9 -71.9 -29.0 18.1 4.5 -3.6 86 86 A G < - 0 0 44 -3,-1.8 2,-1.3 -4,-0.5 -1,-0.2 -0.144 46.6 -27.4 77.3-170.3 21.6 4.3 -2.2 87 87 A D S S+ 0 0 174 2,-0.0 -1,-0.1 -4,-0.0 -4,-0.0 -0.642 86.2 147.5 -78.9 93.9 23.9 1.3 -2.4 88 88 A V - 0 0 45 -2,-1.3 3,-0.1 1,-0.1 -50,-0.1 -0.939 56.4-122.3-126.6 155.9 21.3 -1.5 -2.6 89 89 A P S S+ 0 0 120 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.808 94.7 19.2 -65.9 -32.7 21.5 -4.9 -4.5 90 90 A E - 0 0 24 2,-0.0 2,-0.4 -88,-0.0 -88,-0.2 -0.946 58.7-159.5-148.0 128.6 18.4 -4.2 -6.7 91 91 A I E -a 2 0A 11 -90,-3.0 -88,-3.0 -2,-0.3 2,-0.6 -0.880 17.4-149.5-102.2 129.9 16.3 -1.1 -7.7 92 92 A M E -ad 3 40A 0 -53,-2.6 -51,-2.5 -2,-0.4 2,-0.6 -0.898 2.8-158.6-106.4 115.5 12.7 -1.8 -8.9 93 93 A V E -ad 4 41A 0 -90,-3.0 -88,-2.4 -2,-0.6 -51,-0.2 -0.849 11.4-177.2 -93.1 116.5 11.2 0.6 -11.5 94 94 A I - 0 0 14 -53,-2.7 2,-0.2 -2,-0.6 -52,-0.2 0.311 34.2-177.2-105.5 7.4 7.5 0.2 -11.1 95 95 A G - 0 0 0 -54,-0.5 -52,-1.9 1,-0.2 -1,-0.3 -0.600 53.4-130.4 124.5 176.4 6.1 2.5 -13.9 96 96 A G > - 0 0 17 -54,-0.3 4,-3.0 -2,-0.2 -1,-0.2 0.506 54.7 -98.9 -97.3-149.5 4.6 4.1 -15.8 97 97 A G H > S+ 0 0 4 1,-0.2 4,-2.1 2,-0.2 -2,-0.1 0.853 120.9 46.4 -50.0 -51.7 5.2 4.0 -19.6 98 98 A R H > S+ 0 0 174 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.899 114.7 46.9 -63.1 -41.7 7.3 7.1 -19.7 99 99 A V H > S+ 0 0 10 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.914 110.3 53.7 -67.1 -40.0 9.5 6.1 -16.7 100 100 A Y H X S+ 0 0 13 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.926 104.4 56.1 -59.0 -43.7 9.9 2.6 -18.2 101 101 A E H < S+ 0 0 118 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.895 110.5 44.4 -53.4 -44.1 11.2 4.1 -21.5 102 102 A Q H < S+ 0 0 101 -4,-1.4 -1,-0.2 1,-0.2 4,-0.2 0.818 118.7 40.3 -71.7 -37.5 13.9 6.0 -19.6 103 103 A F H >X S+ 0 0 0 -4,-2.0 3,-1.2 1,-0.1 4,-0.9 0.682 93.4 84.3 -87.5 -20.5 15.1 3.1 -17.3 104 104 A L G >< S+ 0 0 23 -4,-2.5 3,-1.4 1,-0.2 -2,-0.1 0.913 89.9 50.1 -49.8 -50.1 14.9 0.3 -20.0 105 105 A P G 34 S+ 0 0 94 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.756 115.2 45.4 -61.9 -20.6 18.4 1.1 -21.4 106 106 A K G <4 S+ 0 0 85 -3,-1.2 -104,-0.4 -4,-0.2 2,-0.2 0.488 94.5 103.5 -94.7 -10.0 19.8 1.0 -17.8 107 107 A A << - 0 0 0 -3,-1.4 -104,-0.2 -4,-0.9 3,-0.1 -0.548 44.1-175.5 -86.4 145.1 18.0 -2.2 -16.7 108 108 A Q S S+ 0 0 78 -106,-2.6 50,-2.6 -2,-0.2 2,-0.3 0.523 73.5 38.6-107.2 -16.8 19.5 -5.7 -16.4 109 109 A K E -bF 3 157A 41 -107,-1.0 -105,-2.5 48,-0.2 2,-0.4 -0.999 57.7-160.2-144.2 140.5 16.3 -7.5 -15.5 110 110 A L E -bF 4 156A 0 46,-2.6 46,-2.8 -2,-0.3 2,-0.7 -0.992 3.1-164.6-120.6 127.0 12.5 -7.5 -16.6 111 111 A Y E -bF 5 155A 5 -107,-2.7 -105,-2.3 -2,-0.4 2,-0.4 -0.949 26.1-179.4-107.7 102.5 9.8 -9.0 -14.3 112 112 A L E -bF 6 154A 0 42,-3.6 42,-3.8 -2,-0.7 2,-0.6 -0.916 28.5-160.0-115.9 139.1 6.9 -9.2 -16.7 113 113 A T E -bF 7 153A 1 -107,-1.8 -105,-3.4 -2,-0.4 2,-0.8 -0.974 17.0-154.9-110.0 110.6 3.3 -10.5 -16.2 114 114 A H E -bF 8 152A 54 38,-2.9 38,-2.1 -2,-0.6 2,-0.5 -0.817 15.0-161.9 -89.0 108.0 1.9 -11.3 -19.6 115 115 A I E - F 0 151A 3 -107,-3.4 2,-2.0 -2,-0.8 36,-0.2 -0.824 21.0-138.5 -98.0 129.0 -1.8 -11.0 -19.2 116 116 A D + 0 0 83 34,-2.4 2,-0.3 -2,-0.5 34,-0.3 -0.502 62.4 124.7 -81.4 70.7 -4.2 -12.5 -21.7 117 117 A A - 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