==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 02-FEB-11 3QL0 . COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR G.BHABHA,D.C.EKIERT,P.E.WRIGHT,I.A.WILSON . 161 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8634.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 107 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 16.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 14.9 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 1.2 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 . 14 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 15.5 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 0 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 M 0 0 91 0, 0.0 91,-2.8 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 128.3 -2.1 29.2 19.7 2 2 A I E -ab 92 108A 17 105,-0.5 107,-3.0 89,-0.2 108,-1.0 -0.826 360.0-178.2-101.1 132.1 -2.8 29.2 16.0 3 3 A S E -ab 93 110A 0 89,-2.8 91,-3.0 -2,-0.4 2,-0.4 -0.932 15.9-144.3-124.7 151.3 -6.0 30.6 14.6 4 4 A L E -ab 94 111A 0 106,-1.9 108,-2.7 -2,-0.3 2,-0.4 -0.930 10.6-166.4-108.4 141.3 -7.3 30.9 11.0 5 5 A I E + b 0 112A 0 89,-2.3 2,-0.3 -2,-0.4 108,-0.2 -0.996 22.8 146.9-128.5 127.9 -9.3 33.8 9.7 6 6 A A E - b 0 113A 0 106,-2.2 108,-1.9 -2,-0.4 2,-0.5 -0.985 41.9-132.5-151.6 156.3 -11.2 33.6 6.4 7 7 A A E - b 0 114A 4 -2,-0.3 2,-0.4 106,-0.2 108,-0.2 -0.985 30.1-169.8-113.4 124.6 -14.3 34.7 4.5 8 8 A L E - b 0 115A 8 106,-2.9 108,-3.2 -2,-0.5 6,-0.2 -0.951 8.5-164.6-120.5 128.5 -16.1 31.9 2.7 9 9 A A > - 0 0 7 4,-2.8 3,-1.4 -2,-0.4 4,-0.3 -0.240 56.4 -42.3 -91.0-169.7 -18.9 32.0 0.1 10 10 A V G > S+ 0 0 49 108,-2.3 3,-1.3 106,-0.3 110,-0.3 -0.216 133.8 19.7 -55.9 143.5 -21.1 29.1 -0.9 11 11 A D G 3 S- 0 0 130 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.696 130.5 -76.4 62.9 25.7 -19.1 25.9 -1.5 12 12 A R G < S+ 0 0 83 -3,-1.4 114,-2.7 1,-0.2 -1,-0.2 0.679 77.1 172.0 63.2 23.4 -16.3 27.4 0.7 13 13 A V E < +H 125 0B 7 -3,-1.3 -4,-2.8 -4,-0.3 112,-0.2 -0.449 12.8 158.2 -65.6 129.1 -15.0 29.6 -2.2 14 14 A I E + 0 0 18 110,-2.6 2,-0.3 1,-0.3 111,-0.2 0.550 56.7 27.6-123.5 -20.3 -12.4 32.1 -1.0 15 15 A G E -H 124 0B 9 109,-1.6 108,-2.4 5,-0.2 109,-1.6 -0.985 45.4-173.1-151.0 154.1 -10.5 33.1 -4.1 16 16 A M B > S-I 19 0C 33 3,-2.4 3,-1.4 -2,-0.3 106,-0.1 -0.917 80.0 -14.9-150.9 120.6 -10.7 33.6 -7.9 17 17 A E T 3 S- 0 0 155 -2,-0.3 3,-0.1 1,-0.3 105,-0.0 0.881 125.3 -57.3 52.4 45.5 -7.8 34.5 -10.2 18 18 A N T 3 S+ 0 0 72 1,-0.2 -1,-0.3 3,-0.0 2,-0.3 0.726 124.0 88.8 54.6 30.6 -5.6 35.5 -7.3 19 19 A A B < S-I 16 0C 53 -3,-1.4 -3,-2.4 32,-0.0 -1,-0.2 -0.808 91.3 -76.4-136.5 176.7 -8.2 38.0 -6.1 20 20 A M - 0 0 61 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.1 -0.505 36.7-133.8 -71.5 145.9 -11.2 38.1 -3.9 21 21 A P S S+ 0 0 21 0, 0.0 100,-0.2 0, 0.0 -1,-0.1 0.445 86.3 41.9 -85.6 2.1 -14.3 36.5 -5.6 22 22 A W S S- 0 0 16 98,-0.1 3,-0.1 -6,-0.0 -2,-0.1 -0.935 94.9 -93.0-136.5 158.6 -16.6 39.4 -4.5 23 23 A P - 0 0 89 0, 0.0 126,-0.1 0, 0.0 0, 0.0 -0.322 69.9 -62.7 -67.4 160.1 -16.3 43.2 -4.3 24 23AA P - 0 0 105 0, 0.0 125,-0.3 0, 0.0 3,-0.1 -0.081 40.7-158.4 -53.3 137.4 -15.2 44.6 -1.0 25 24 A L >> - 0 0 5 1,-0.1 4,-2.1 -3,-0.1 3,-0.7 -0.919 5.7-165.6-112.3 95.6 -17.3 44.1 2.0 26 25 A P H 3> S+ 0 0 64 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.838 85.3 56.4 -58.2 -33.9 -16.2 46.9 4.4 27 26 A A H 3> S+ 0 0 26 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.866 109.4 46.3 -62.5 -38.3 -17.9 45.3 7.4 28 27 A D H <> S+ 0 0 0 -3,-0.7 4,-2.7 2,-0.2 -1,-0.2 0.872 109.6 53.5 -72.9 -35.8 -16.0 42.1 6.9 29 28 A L H X S+ 0 0 44 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.910 107.8 51.6 -65.1 -36.0 -12.7 44.0 6.4 30 29 A A H X S+ 0 0 60 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.885 110.2 48.7 -66.3 -40.7 -13.4 45.7 9.7 31 30 A W H X S+ 0 0 11 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.928 112.0 49.9 -60.0 -46.7 -13.9 42.3 11.4 32 31 A F H X S+ 0 0 0 -4,-2.7 4,-1.4 1,-0.2 -2,-0.2 0.930 113.1 45.6 -59.4 -49.4 -10.7 41.1 9.8 33 32 A K H X S+ 0 0 96 -4,-2.7 4,-2.1 1,-0.2 3,-0.3 0.908 111.6 50.9 -61.8 -44.7 -8.8 44.1 11.0 34 33 A R H < S+ 0 0 163 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.898 114.1 44.8 -62.7 -41.9 -10.1 44.1 14.6 35 34 A N H < S+ 0 0 13 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.686 120.6 38.1 -77.0 -18.6 -9.3 40.4 15.0 36 35 A T H >< S+ 0 0 0 -4,-1.4 3,-1.5 -3,-0.3 -2,-0.2 0.647 84.4 115.1-105.8 -17.8 -5.8 40.6 13.5 37 36 A L T 3< S+ 0 0 62 -4,-2.1 21,-0.2 1,-0.3 20,-0.1 -0.230 83.9 13.4 -57.8 139.4 -4.5 43.9 14.8 38 37 A N T 3 S+ 0 0 144 19,-2.3 -1,-0.3 1,-0.2 20,-0.2 0.653 111.5 95.5 68.3 20.0 -1.5 43.7 17.1 39 38 A K S < S- 0 0 47 -3,-1.5 20,-0.6 18,-0.2 -1,-0.2 -0.926 82.4 -98.9-129.9 158.9 -0.8 40.1 16.3 40 39 A P E -c 59 0A 7 0, 0.0 53,-2.4 0, 0.0 2,-0.4 -0.571 36.3-154.5 -75.3 141.2 1.5 38.3 13.8 41 40 A V E -cd 60 93A 0 18,-2.8 20,-2.7 -2,-0.2 2,-0.5 -0.984 3.0-156.1-118.9 133.4 -0.2 37.3 10.6 42 41 A I E +cd 61 94A 0 51,-2.5 53,-2.7 -2,-0.4 54,-0.3 -0.918 21.4 167.2-108.7 129.1 1.0 34.4 8.4 43 42 A M E -c 62 0A 0 18,-2.4 20,-3.1 -2,-0.5 54,-0.3 -0.965 33.5-110.8-138.5 158.0 0.2 34.4 4.7 44 43 A G E > -c 63 0A 8 52,-2.1 4,-2.3 -2,-0.3 3,-0.3 -0.416 37.5-107.2 -79.1 160.4 1.1 32.6 1.5 45 44 A R H > S+ 0 0 85 18,-1.4 4,-2.4 1,-0.2 5,-0.1 0.859 119.0 54.0 -58.7 -38.6 3.0 34.4 -1.3 46 45 A H H > S+ 0 0 102 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.880 108.4 48.7 -67.5 -36.9 -0.1 34.5 -3.5 47 46 A T H > S+ 0 0 16 -3,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.904 108.4 54.4 -66.5 -41.2 -2.1 36.2 -0.8 48 47 A W H X S+ 0 0 14 -4,-2.3 4,-3.4 1,-0.2 3,-0.4 0.936 108.4 49.8 -52.1 -48.0 0.7 38.7 -0.3 49 48 A E H < S+ 0 0 101 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.862 108.8 52.1 -61.3 -36.7 0.5 39.4 -4.0 50 49 A S H < S+ 0 0 52 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.807 117.4 37.8 -70.1 -29.9 -3.3 39.9 -3.7 51 50 A I H < S- 0 0 25 -4,-1.8 -2,-0.2 -3,-0.4 -3,-0.2 0.928 85.0-168.9 -87.9 -52.8 -2.9 42.4 -0.9 52 51 A G < + 0 0 46 -4,-3.4 -3,-0.1 -5,-0.2 -4,-0.1 0.522 57.4 56.5 82.1 5.7 0.3 44.2 -2.2 53 52 A R S S- 0 0 180 -5,-0.2 -1,-0.0 19,-0.0 -2,-0.0 -0.961 94.1 -86.3-159.0 151.0 1.2 46.2 0.9 54 53 A P - 0 0 32 0, 0.0 5,-0.0 0, 0.0 19,-0.0 -0.354 41.3-117.4 -59.8 141.9 2.0 45.3 4.5 55 54 A L > - 0 0 6 -14,-0.1 3,-1.0 1,-0.1 -14,-0.1 -0.728 39.2-124.4 -76.2 120.3 -1.0 45.1 6.8 56 55 A P T 3 S+ 0 0 87 0, 0.0 -18,-0.1 0, 0.0 3,-0.1 -0.344 87.6 25.5 -72.3 147.3 -0.2 47.9 9.3 57 56 A G T 3 S+ 0 0 49 1,-0.2 -19,-2.3 -20,-0.1 2,-0.3 0.596 108.5 88.8 80.8 10.4 -0.1 47.2 13.1 58 57 A R S < S- 0 0 20 -3,-1.0 2,-0.7 -20,-0.2 -1,-0.2 -0.962 82.5-114.4-136.8 148.7 0.8 43.6 12.5 59 58 A K E -c 40 0A 98 -20,-0.6 -18,-2.8 -2,-0.3 2,-0.6 -0.812 38.2-148.2 -78.6 116.3 4.0 41.5 12.0 60 59 A N E -c 41 0A 10 -2,-0.7 14,-2.7 12,-0.3 2,-0.5 -0.815 17.8-176.9 -97.3 120.3 3.6 40.3 8.4 61 60 A I E -ce 42 74A 0 -20,-2.7 -18,-2.4 -2,-0.6 2,-0.5 -0.977 7.6-160.9-118.6 121.3 5.2 36.9 7.7 62 61 A I E -ce 43 75A 0 12,-3.4 14,-2.5 -2,-0.5 2,-0.7 -0.927 9.4-144.4-111.5 128.2 5.1 35.6 4.2 63 62 A L E +ce 44 76A 22 -20,-3.1 -18,-1.4 -2,-0.5 2,-0.3 -0.774 40.4 139.0 -92.8 115.0 5.5 32.0 3.3 64 63 A S - 0 0 14 12,-2.5 4,-0.1 -2,-0.7 -2,-0.1 -0.977 51.3-146.9-154.5 145.3 7.5 31.4 0.0 65 64 A S S S+ 0 0 100 -2,-0.3 12,-0.1 2,-0.1 3,-0.1 0.548 84.8 79.9 -82.2 -9.0 10.2 29.2 -1.4 66 65 A Q S S- 0 0 107 1,-0.1 3,-0.1 -3,-0.0 -2,-0.1 -0.580 97.4 -85.7-102.1 158.9 11.4 32.1 -3.5 67 66 A P - 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.319 58.0 -96.0 -62.6 148.5 13.5 35.1 -2.4 68 67 A G - 0 0 41 1,-0.1 3,-0.1 7,-0.1 7,-0.0 -0.202 23.9-159.0 -67.5 157.4 11.6 37.9 -0.9 69 68 A T S S+ 0 0 112 1,-0.2 2,-0.3 -3,-0.1 -1,-0.1 0.252 74.8 44.8-119.7 9.6 10.4 41.0 -2.9 70 69 A D > - 0 0 30 3,-0.1 3,-1.3 1,-0.0 -1,-0.2 -0.843 57.4-155.6-164.6 113.1 9.8 43.5 -0.1 71 70 A D T 3 S+ 0 0 165 -2,-0.3 4,-0.0 1,-0.2 -1,-0.0 0.506 87.2 76.9 -72.7 -5.1 12.0 44.3 2.9 72 71 A R T 3 S+ 0 0 162 2,-0.0 -12,-0.3 -18,-0.0 -1,-0.2 0.610 97.0 46.6 -80.3 -13.8 9.0 45.6 5.0 73 72 A V S < S- 0 0 13 -3,-1.3 2,-0.5 -14,-0.1 -12,-0.2 -0.759 88.7-104.4-124.4 169.9 7.8 42.1 5.8 74 73 A T E -e 61 0A 57 -14,-2.7 -12,-3.4 -2,-0.2 2,-0.5 -0.857 28.4-153.9-103.1 125.7 9.4 38.8 7.0 75 74 A W E +e 62 0A 53 -2,-0.5 2,-0.3 -14,-0.2 -12,-0.2 -0.873 15.5 178.7-103.6 130.5 10.0 36.1 4.5 76 75 A V E -e 63 0A 0 -14,-2.5 -12,-2.5 -2,-0.5 3,-0.0 -0.918 24.8-148.4-131.8 157.7 10.1 32.5 5.6 77 76 A K S S+ 0 0 132 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.1 0.300 73.4 29.7-114.9 6.7 10.6 29.2 3.7 78 77 A S S > S- 0 0 50 1,-0.1 4,-2.4 -14,-0.0 5,-0.1 -0.986 75.6-110.1-161.3 160.2 8.6 26.7 5.8 79 78 A V H > S+ 0 0 23 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.930 119.2 51.6 -58.9 -47.1 5.6 26.2 8.0 80 79 A D H > S+ 0 0 117 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.889 110.8 48.1 -59.4 -40.2 7.9 25.6 11.0 81 80 A E H > S+ 0 0 85 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.888 107.5 55.5 -67.9 -39.9 9.8 28.8 10.2 82 81 A A H X S+ 0 0 0 -4,-2.4 4,-0.6 1,-0.2 -2,-0.2 0.928 110.8 45.3 -57.3 -44.0 6.6 30.8 9.9 83 82 A I H >< S+ 0 0 48 -4,-2.2 3,-1.2 1,-0.2 4,-0.4 0.932 112.6 50.4 -67.2 -44.3 5.6 29.7 13.3 84 83 A A H >< S+ 0 0 74 -4,-2.2 3,-1.3 1,-0.3 -1,-0.2 0.848 103.0 61.0 -60.2 -34.4 9.0 30.4 14.8 85 84 A A H 3< S+ 0 0 20 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.662 94.9 62.9 -73.4 -15.9 9.1 33.9 13.3 86 85 A C T << S- 0 0 8 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.642 91.9-162.2 -80.5 -19.8 6.0 34.8 15.3 87 86 A G < - 0 0 44 -3,-1.3 2,-1.4 -4,-0.4 -1,-0.2 -0.233 48.6 -22.5 74.0-156.8 7.8 34.3 18.6 88 87 A D S S+ 0 0 177 2,-0.0 -1,-0.2 -4,-0.0 -4,-0.0 -0.587 86.5 142.0 -96.7 73.5 6.1 33.9 22.0 89 88 A V - 0 0 55 -2,-1.4 3,-0.1 1,-0.1 -50,-0.1 -0.726 57.9-122.6-107.2 159.3 2.8 35.5 21.3 90 89 A P S S+ 0 0 113 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.837 94.3 19.6 -68.6 -32.4 -0.6 34.4 22.6 91 90 A E - 0 0 25 2,-0.0 2,-0.5 -89,-0.0 -89,-0.2 -0.970 59.3-159.3-149.7 125.8 -2.2 34.0 19.2 92 91 A I E -a 2 0A 12 -91,-2.8 -89,-2.8 -2,-0.4 2,-0.6 -0.886 19.2-146.3-101.0 131.1 -0.8 33.6 15.6 93 92 A M E -ad 3 41A 0 -53,-2.4 -51,-2.5 -2,-0.5 2,-0.6 -0.905 5.1-158.9-103.7 118.5 -3.3 34.6 12.9 94 93 A V E -ad 4 42A 0 -91,-3.0 -89,-2.3 -2,-0.6 -51,-0.2 -0.892 9.6-176.3 -95.1 119.8 -3.1 32.6 9.7 95 94 A I - 0 0 0 -53,-2.7 -52,-0.1 -2,-0.6 2,-0.1 0.068 32.4-165.4-113.5 23.5 -4.7 34.7 6.9 96 95 A G - 0 0 1 -54,-0.3 -52,-2.1 1,-0.2 -1,-0.3 -0.350 45.6-144.8 99.9-177.4 -4.6 32.4 3.9 97 96 A G > - 0 0 16 -54,-0.3 4,-3.3 -50,-0.1 5,-0.2 0.321 54.4 -92.7 -95.8-145.7 -4.7 31.5 1.1 98 97 A G H > S+ 0 0 6 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.881 123.8 45.0 -52.9 -47.3 -6.0 28.1 0.2 99 98 A R H > S+ 0 0 162 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.860 116.0 48.1 -68.5 -36.7 -2.7 26.2 0.2 100 99 A V H > S+ 0 0 7 2,-0.2 4,-2.0 1,-0.2 3,-0.5 0.941 109.3 52.1 -69.9 -44.9 -1.7 27.9 3.5 101 100 A Y H X S+ 0 0 6 -4,-3.3 4,-2.5 1,-0.2 -2,-0.2 0.896 105.7 56.3 -56.2 -42.6 -5.0 27.2 5.2 102 101 A E H < S+ 0 0 101 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.863 110.9 43.9 -54.4 -43.2 -4.7 23.5 4.3 103 102 A Q H < S+ 0 0 59 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.839 120.0 39.0 -75.5 -34.3 -1.3 23.2 6.1 104 103 A F H >X S+ 0 0 0 -4,-2.0 3,-1.5 1,-0.1 4,-0.9 0.692 92.6 83.2 -93.1 -21.8 -2.3 25.1 9.2 105 104 A L G >< S+ 0 0 20 -4,-2.5 3,-1.4 1,-0.3 -1,-0.1 0.914 89.5 53.6 -50.2 -48.9 -5.9 23.9 9.8 106 105 A P G 34 S+ 0 0 97 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.746 113.2 45.3 -60.0 -20.4 -4.7 20.7 11.6 107 106 A K G <4 S+ 0 0 93 -3,-1.5 -105,-0.5 -4,-0.2 -2,-0.2 0.534 93.4 108.9 -90.7 -12.8 -2.6 23.0 13.9 108 107 A A E << -b 2 0A 0 -3,-1.4 -105,-0.2 -4,-0.9 3,-0.1 -0.385 40.3-179.8 -76.7 139.7 -5.4 25.5 14.5 109 108 A Q E S+ 0 0 110 -107,-3.0 50,-2.3 1,-0.2 2,-0.3 0.543 73.3 33.3-107.4 -15.0 -7.3 25.9 17.7 110 109 A K E -bF 3 158A 50 -108,-1.0 -106,-1.9 48,-0.2 2,-0.4 -0.991 60.4-160.2-138.6 149.9 -9.7 28.6 16.6 111 110 A L E -bF 4 157A 0 46,-2.4 46,-2.6 -2,-0.3 2,-0.6 -0.998 3.2-163.2-126.6 132.4 -11.4 29.6 13.4 112 111 A Y E -bF 5 156A 16 -108,-2.7 -106,-2.2 -2,-0.4 2,-0.4 -0.960 25.6-179.1-112.4 106.1 -12.8 33.1 12.7 113 112 A L E -bF 6 155A 0 42,-2.7 42,-2.6 -2,-0.6 2,-0.6 -0.906 25.7-162.1-115.9 136.3 -15.1 32.6 9.7 114 113 A T E -bF 7 154A 0 -108,-1.9 -106,-2.9 -2,-0.4 2,-0.7 -0.981 16.5-152.1-109.0 118.2 -17.3 35.0 7.7 115 114 A H E -bF 8 153A 62 38,-2.9 38,-1.6 -2,-0.6 2,-0.5 -0.831 11.2-156.0 -91.1 115.0 -19.9 33.1 5.8 116 115 A I E - 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