==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 22-MAY-02 1LUD . COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS CASEI; . AUTHOR V.I.POLSHAKOV,E.G.SMIRNOV,B.BIRDSALL,G.KELLY,J.FEENEY . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9809.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 16.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 12.3 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 . 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 . 19 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 16.7 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 2 0 0 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 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 0 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 . 0 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 29 0, 0.0 110,-2.1 0, 0.0 111,-1.3 0.000 360.0 360.0 360.0 110.5 -5.4 9.2 2.8 2 2 A A E -ab 95 112A 10 92,-1.9 94,-4.3 109,-0.2 2,-0.5 -0.943 360.0-129.0-132.4 156.3 -1.9 7.6 3.1 3 3 A F E -ab 96 113A 0 109,-3.6 111,-3.3 -2,-0.3 2,-0.4 -0.880 22.7-179.0-105.9 132.0 0.2 5.5 0.7 4 4 A L E + b 0 114A 3 92,-1.0 2,-0.3 -2,-0.5 111,-0.2 -0.810 24.8 129.7-133.2 96.6 1.7 2.2 2.1 5 5 A W E - b 0 115A 14 109,-2.3 111,-1.1 -2,-0.4 2,-0.4 -0.820 43.9-129.4-136.6 177.7 3.9 0.2 -0.3 6 6 A A E + b 0 116A 12 -2,-0.3 2,-0.3 109,-0.2 111,-0.2 -0.994 26.1 171.5-133.0 137.1 7.3 -1.5 -0.4 7 7 A Q E - b 0 117A 15 109,-3.1 111,-1.9 -2,-0.4 6,-0.2 -0.986 26.4-122.6-144.4 154.9 10.0 -1.1 -3.0 8 8 A D - 0 0 0 4,-0.4 113,-0.2 -2,-0.3 111,-0.1 0.001 55.1 -72.7 -82.1-166.0 13.6 -2.2 -3.5 9 9 A R S S+ 0 0 152 111,-1.5 112,-0.1 1,-0.2 110,-0.1 0.911 136.4 45.1 -59.1 -41.5 16.6 0.2 -4.2 10 10 A D S S- 0 0 112 112,-0.1 -1,-0.2 1,-0.0 111,-0.1 0.862 122.2-105.2 -72.8 -32.5 15.4 0.9 -7.8 11 11 A G + 0 0 8 1,-0.1 117,-1.1 107,-0.1 2,-0.1 0.734 61.3 158.2 111.8 39.0 11.7 1.4 -6.7 12 12 A L B +H 127 0B 0 115,-0.2 -4,-0.4 1,-0.1 115,-0.2 -0.465 16.2 178.8 -86.8 164.9 10.0 -1.9 -7.8 13 13 A I - 0 0 18 113,-1.3 2,-0.3 1,-0.2 114,-0.2 0.542 57.1 -20.3-130.9 -67.4 6.8 -3.1 -6.2 14 14 A G - 0 0 17 112,-0.8 2,-0.5 5,-0.2 112,-0.3 -0.994 48.9-152.8-151.0 142.4 5.3 -6.3 -7.6 15 15 A K S S- 0 0 59 3,-0.9 3,-0.1 -2,-0.3 108,-0.0 -0.959 76.7 -12.7-120.7 129.2 5.7 -8.2 -10.9 16 16 A D S S- 0 0 118 -2,-0.5 2,-1.9 1,-0.2 -1,-0.2 0.944 120.7 -61.7 51.7 55.2 3.0 -10.5 -12.4 17 17 A G S S+ 0 0 48 -3,-0.2 -1,-0.2 1,-0.0 2,-0.1 -0.486 122.1 78.8 78.7 -82.5 0.9 -10.6 -9.2 18 18 A H S S- 0 0 133 -2,-1.9 -3,-0.9 -4,-0.1 31,-0.1 -0.389 91.8-104.4 -65.6 136.8 3.2 -12.2 -6.7 19 19 A L - 0 0 80 -5,-0.2 -5,-0.2 1,-0.1 -1,-0.1 -0.114 21.3-128.6 -54.5 160.2 5.9 -9.9 -5.2 20 20 A P S S+ 0 0 43 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.770 91.8 45.8 -83.0 -34.1 9.5 -10.3 -6.6 21 21 A W S S- 0 0 8 2,-0.1 2,-1.1 101,-0.1 -2,-0.1 -0.924 77.9-135.2-116.2 138.6 11.1 -10.6 -3.1 22 22 A H + 0 0 154 -2,-0.4 129,-0.0 -3,-0.0 0, 0.0 -0.732 34.8 166.4 -91.5 97.4 9.9 -12.7 -0.2 23 23 A L > + 0 0 5 -2,-1.1 4,-1.4 1,-0.2 3,-0.4 -0.874 16.7 179.8-118.7 102.3 10.1 -10.4 2.8 24 24 A P H > S+ 0 0 65 0, 0.0 4,-1.6 0, 0.0 5,-0.2 0.855 85.8 57.0 -65.1 -39.2 8.3 -11.8 5.9 25 25 A D H > S+ 0 0 62 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.793 103.9 55.1 -66.6 -24.4 9.3 -8.8 8.0 26 26 A D H > S+ 0 0 15 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.925 101.0 56.3 -75.7 -43.0 7.7 -6.5 5.4 27 27 A L H X S+ 0 0 87 -4,-1.4 4,-2.7 1,-0.2 3,-0.2 0.956 106.8 50.0 -53.7 -49.6 4.2 -8.3 5.6 28 28 A H H X S+ 0 0 100 -4,-1.6 4,-2.6 1,-0.3 5,-0.4 0.909 108.8 53.4 -56.8 -38.3 4.1 -7.6 9.3 29 29 A Y H X S+ 0 0 38 -4,-1.2 4,-1.6 1,-0.2 -1,-0.3 0.895 109.0 49.4 -64.2 -37.0 5.0 -3.9 8.5 30 30 A F H X S+ 0 0 31 -4,-2.3 4,-0.8 -3,-0.2 -2,-0.2 0.958 116.7 40.1 -67.8 -48.8 2.0 -3.9 6.1 31 31 A R H >< S+ 0 0 93 -4,-2.7 3,-2.2 2,-0.2 -2,-0.2 0.994 116.8 47.5 -64.0 -61.1 -0.5 -5.3 8.6 32 32 A A H >< S+ 0 0 49 -4,-2.6 3,-1.0 1,-0.3 -1,-0.2 0.870 111.5 53.9 -48.6 -38.6 0.8 -3.4 11.6 33 33 A Q H 3< S+ 0 0 31 -4,-1.6 -1,-0.3 -5,-0.4 -2,-0.2 0.714 115.1 39.5 -72.4 -18.4 0.7 -0.2 9.5 34 34 A T T X< S+ 0 0 0 -3,-2.2 3,-1.1 -4,-0.8 2,-0.7 0.019 78.5 136.0-119.8 30.5 -2.9 -0.8 8.5 35 35 A V T < S- 0 0 59 -3,-1.0 22,-0.2 1,-0.3 3,-0.1 -0.663 87.0 -3.0 -80.7 116.7 -4.3 -2.0 11.9 36 36 A G T 3 S+ 0 0 27 -2,-0.7 2,-0.3 20,-0.5 -1,-0.3 0.666 115.8 108.0 79.4 13.6 -7.7 -0.3 12.5 37 37 A K S < S- 0 0 64 -3,-1.1 21,-0.6 55,-0.2 2,-0.5 -0.828 80.4 -96.4-121.0 162.1 -7.3 1.7 9.2 38 38 A I E -cd 58 94A 1 55,-1.3 57,-1.4 -2,-0.3 2,-0.7 -0.633 35.6-154.1 -78.4 124.2 -9.0 1.5 5.8 39 39 A M E -cd 59 95A 4 19,-1.8 21,-3.6 -2,-0.5 2,-0.7 -0.854 4.0-158.5-102.8 110.8 -6.9 -0.5 3.4 40 40 A V E +cd 60 96A 0 55,-2.9 57,-2.7 -2,-0.7 58,-0.7 -0.766 19.6 167.5 -91.5 115.6 -7.6 0.4 -0.2 41 41 A V E -cd 61 98A 0 19,-2.5 21,-1.7 -2,-0.7 58,-0.3 -0.987 31.9-124.2-129.1 128.2 -6.5 -2.4 -2.6 42 42 A G E >> -c 62 0A 8 56,-2.4 4,-2.4 -2,-0.4 3,-0.6 -0.254 35.4-100.0 -67.2 157.5 -7.5 -2.5 -6.4 43 43 A R H 3> S+ 0 0 99 19,-2.6 4,-0.9 1,-0.2 -1,-0.1 0.765 123.8 58.6 -50.0 -24.4 -9.4 -5.5 -7.7 44 44 A R H 3> S+ 0 0 200 18,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.947 111.8 36.4 -74.5 -46.8 -6.0 -6.7 -9.1 45 45 A T H X> S+ 0 0 35 -3,-0.6 4,-3.0 2,-0.2 3,-1.6 0.971 114.4 54.2 -70.5 -52.2 -4.2 -6.8 -5.7 46 46 A Y H 3< S+ 0 0 23 -4,-2.4 -1,-0.2 1,-0.3 -3,-0.2 0.852 111.7 48.1 -51.3 -31.7 -7.3 -8.0 -3.7 47 47 A E H 3< S+ 0 0 113 -4,-0.9 -1,-0.3 -5,-0.4 -2,-0.2 0.709 116.4 42.7 -82.6 -18.6 -7.5 -10.9 -6.2 48 48 A S H << S+ 0 0 70 -3,-1.6 -2,-0.2 -4,-0.7 -1,-0.2 0.680 87.8 113.6 -98.6 -20.9 -3.7 -11.6 -5.8 49 49 A F < - 0 0 41 -4,-3.0 3,-0.2 -5,-0.1 -31,-0.0 -0.080 63.3-138.4 -48.6 154.9 -3.5 -11.3 -2.0 50 50 A P S S+ 0 0 106 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.925 88.1 22.1 -83.1 -58.3 -2.7 -14.5 -0.0 51 51 A K S S- 0 0 164 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.870 87.8-143.4-119.3 102.6 -5.1 -14.3 2.9 52 52 A R S S+ 0 0 109 -2,-0.6 2,-0.1 -3,-0.2 21,-0.1 -0.948 70.1 23.3-119.4 139.1 -8.2 -12.0 2.4 53 53 A P S S- 0 0 58 0, 0.0 5,-0.1 0, 0.0 20,-0.1 0.625 87.5-121.5 -88.2 175.5 -9.6 -10.3 4.2 54 54 A L > - 0 0 34 3,-0.1 3,-0.9 -2,-0.1 2,-0.3 -0.445 31.1-102.5 -76.7 153.7 -7.1 -9.3 7.0 55 55 A P T 3 S- 0 0 81 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.550 98.3 -8.1 -75.7 131.7 -7.9 -10.1 10.7 56 56 A E T 3 S+ 0 0 172 -2,-0.3 -20,-0.5 1,-0.2 2,-0.4 0.875 113.1 114.1 48.9 38.6 -9.2 -7.2 12.8 57 57 A R S < S- 0 0 53 -3,-0.9 2,-0.6 -22,-0.2 -1,-0.2 -0.999 70.2-121.6-140.5 139.7 -8.3 -4.9 9.9 58 58 A T E -c 38 0A 22 -21,-0.6 -19,-1.8 -24,-0.4 2,-0.4 -0.668 34.2-177.3 -81.4 121.7 -10.5 -2.7 7.6 59 59 A N E -c 39 0A 6 -2,-0.6 15,-2.1 13,-0.3 2,-0.4 -0.967 7.5-170.9-122.8 133.0 -10.0 -3.7 3.9 60 60 A V E -ce 40 74A 3 -21,-3.6 -19,-2.5 -2,-0.4 2,-0.3 -0.968 10.4-148.8-123.5 135.5 -11.7 -2.1 0.9 61 61 A V E -ce 41 75A 0 13,-1.6 15,-2.1 -2,-0.4 2,-0.5 -0.757 5.5-149.6-102.1 149.8 -11.6 -3.4 -2.7 62 62 A L E +ce 42 76A 21 -21,-1.7 -19,-2.6 -2,-0.3 2,-0.3 -0.963 29.0 149.8-120.4 126.0 -11.7 -1.1 -5.8 63 63 A T - 0 0 11 13,-1.6 5,-0.0 -2,-0.5 -2,-0.0 -0.987 47.6-135.6-150.2 159.8 -13.3 -2.4 -9.0 64 64 A H S S+ 0 0 178 -2,-0.3 13,-0.1 14,-0.0 2,-0.1 0.386 79.5 94.9 -97.3 3.5 -15.1 -1.0 -12.1 65 65 A Q - 0 0 81 1,-0.1 -2,-0.1 2,-0.0 0, 0.0 -0.337 64.8-147.9 -87.1 175.0 -17.8 -3.8 -12.0 66 66 A E S S+ 0 0 176 -2,-0.1 -1,-0.1 1,-0.1 11,-0.0 0.496 91.6 57.0-119.6 -11.2 -21.2 -3.5 -10.3 67 67 A D + 0 0 140 2,-0.1 2,-0.6 0, 0.0 -1,-0.1 0.125 66.2 145.3-107.6 22.5 -21.7 -7.2 -9.2 68 68 A Y - 0 0 49 1,-0.1 2,-0.7 2,-0.0 -5,-0.0 -0.432 32.8-163.5 -61.8 109.8 -18.4 -7.4 -7.1 69 69 A Q + 0 0 157 -2,-0.6 2,-0.3 2,-0.0 -1,-0.1 -0.848 25.0 152.0-102.5 111.5 -19.5 -9.7 -4.2 70 70 A A > - 0 0 23 -2,-0.7 3,-0.6 3,-0.1 2,-0.4 -0.746 23.5-164.7-139.4 90.5 -17.2 -9.6 -1.2 71 71 A Q T 3 S+ 0 0 172 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.602 79.8 21.3 -77.4 128.3 -18.8 -10.3 2.1 72 72 A G T 3 S+ 0 0 78 -2,-0.4 2,-0.4 1,-0.2 -13,-0.3 -0.067 113.2 77.4 106.8 -34.1 -16.6 -9.3 5.1 73 73 A A S < S- 0 0 9 -3,-0.6 -1,-0.2 -15,-0.1 -13,-0.2 -0.885 86.3-111.3-112.0 141.8 -14.6 -6.8 3.0 74 74 A V E -e 60 0A 49 -15,-2.1 -13,-1.6 -2,-0.4 2,-0.3 -0.185 32.4-158.0 -61.1 160.7 -15.7 -3.3 2.0 75 75 A V E +e 61 0A 44 -15,-0.2 2,-0.3 -13,-0.0 -13,-0.2 -0.974 17.6 162.5-146.7 130.0 -16.4 -2.7 -1.7 76 76 A V E -e 62 0A 22 -15,-2.1 -13,-1.6 -2,-0.3 3,-0.1 -0.957 26.5-163.1-143.2 161.8 -16.4 0.5 -3.7 77 77 A H S S+ 0 0 71 -2,-0.3 2,-0.2 1,-0.2 -15,-0.1 -0.004 76.8 53.0-135.8 30.4 -16.2 1.6 -7.4 78 78 A D >> - 0 0 105 1,-0.1 3,-2.0 2,-0.0 4,-1.4 -0.687 67.6-141.2-168.0 108.7 -15.4 5.3 -7.1 79 79 A V H 3> S+ 0 0 35 1,-0.3 4,-2.6 -2,-0.2 5,-0.2 0.812 103.8 68.0 -42.1 -30.9 -12.5 7.0 -5.1 80 80 A A H 3> S+ 0 0 65 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.939 101.1 45.0 -58.6 -44.7 -15.1 9.7 -4.3 81 81 A A H X> S+ 0 0 52 -3,-2.0 4,-1.8 1,-0.2 3,-0.6 0.948 111.2 52.5 -65.6 -46.4 -17.1 7.2 -2.2 82 82 A V H 3X S+ 0 0 2 -4,-1.4 4,-1.6 1,-0.3 5,-0.2 0.928 105.2 55.6 -56.4 -43.7 -13.9 5.9 -0.5 83 83 A F H 3X S+ 0 0 50 -4,-2.6 4,-1.6 -5,-0.2 -1,-0.3 0.852 104.9 55.4 -59.4 -31.0 -12.9 9.5 0.5 84 84 A A H X S+ 0 0 105 -4,-1.8 4,-2.1 1,-0.2 3,-0.7 0.931 110.0 47.4 -45.1 -56.2 -16.0 6.8 4.5 86 86 A A H 3< S+ 0 0 15 -4,-1.6 6,-0.2 1,-0.3 -1,-0.2 0.932 111.2 51.4 -55.5 -44.0 -12.6 8.0 5.9 87 87 A K H 3< S+ 0 0 184 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.811 115.0 44.4 -63.4 -26.4 -14.0 11.5 6.4 88 88 A Q H << S+ 0 0 142 -4,-1.9 -1,-0.2 -3,-0.7 -2,-0.2 0.698 99.4 79.5 -91.5 -20.1 -16.9 9.9 8.3 89 89 A H < - 0 0 52 -4,-2.1 3,-0.4 3,-0.3 -1,-0.1 -0.813 56.0-169.9 -95.3 118.9 -14.8 7.4 10.4 90 90 A P S S+ 0 0 129 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.351 92.7 33.3 -82.9 2.1 -13.2 9.1 13.4 91 91 A D S S+ 0 0 131 1,-0.2 2,-0.3 -5,-0.1 -5,-0.1 0.226 115.0 57.6-141.3 11.5 -11.0 6.0 14.0 92 92 A Q - 0 0 38 -3,-0.4 -3,-0.3 -6,-0.2 -1,-0.2 -0.821 63.7-178.5-146.9 102.3 -10.4 4.7 10.4 93 93 A E - 0 0 124 -2,-0.3 -55,-1.3 -57,-0.2 2,-0.7 -0.072 41.6 -78.5 -87.8-164.8 -8.7 7.0 7.9 94 94 A L E + d 0 38A 1 -57,-0.1 -92,-1.9 -11,-0.1 2,-0.5 -0.859 49.3 176.8-101.3 116.7 -8.0 6.4 4.2 95 95 A V E -ad 2 39A 7 -57,-1.4 -55,-2.9 -2,-0.7 2,-0.3 -0.969 20.7-139.9-121.7 129.3 -4.9 4.2 3.7 96 96 A I E +ad 3 40A 0 -94,-4.3 -92,-1.0 -2,-0.5 -55,-0.1 -0.644 21.6 174.9 -87.0 144.9 -3.8 3.1 0.2 97 97 A A E - 0 0 14 -57,-2.7 2,-0.2 1,-0.4 -56,-0.2 0.387 37.4-174.5-126.5 -1.4 -2.5 -0.5 -0.3 98 98 A G E - d 0 41A 0 -58,-0.7 -56,-2.4 1,-0.1 -1,-0.4 -0.597 50.7-150.9 98.1-163.6 -2.0 -0.5 -4.1 99 99 A G > - 0 0 22 -58,-0.3 4,-1.4 -2,-0.2 3,-0.4 0.419 61.9 -90.1 -73.5-139.9 -1.4 -1.9 -6.5 100 100 A A H > S+ 0 0 22 1,-0.2 4,-1.4 2,-0.2 3,-0.2 0.902 126.2 60.9 -62.4 -39.9 0.1 0.8 -8.8 101 101 A Q H > S+ 0 0 142 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.896 106.8 45.8 -56.9 -38.7 -3.4 1.6 -10.3 102 102 A I H > S+ 0 0 9 -3,-0.4 4,-1.2 1,-0.2 -1,-0.2 0.805 106.7 58.2 -77.3 -25.6 -4.6 2.7 -6.8 103 103 A F H < S+ 0 0 5 -4,-1.4 4,-0.3 -3,-0.2 -1,-0.2 0.786 107.6 49.3 -73.3 -23.3 -1.4 4.7 -6.1 104 104 A T H >X S+ 0 0 56 -4,-1.4 3,-0.8 2,-0.2 4,-0.6 0.940 107.8 48.9 -81.0 -50.2 -2.1 6.8 -9.2 105 105 A A H 3< S+ 0 0 57 -4,-1.6 4,-0.3 1,-0.3 3,-0.2 0.849 122.5 36.9 -59.4 -31.1 -5.8 7.7 -8.6 106 106 A F T 3< S+ 0 0 0 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.490 88.4 97.3 -99.1 -4.4 -4.9 8.7 -5.1 107 107 A K T <4 S+ 0 0 99 -3,-0.8 3,-0.2 -4,-0.3 25,-0.2 0.895 86.4 48.9 -53.1 -38.4 -1.5 10.3 -5.9 108 108 A D S < S+ 0 0 138 -4,-0.6 2,-1.0 1,-0.2 -1,-0.2 0.906 111.7 50.4 -69.9 -39.0 -3.1 13.8 -6.0 109 109 A D S S+ 0 0 85 -4,-0.3 2,-0.3 -3,-0.1 -1,-0.2 -0.735 79.0 145.7-101.1 88.1 -4.9 13.3 -2.7 110 110 A V + 0 0 8 -2,-1.0 -108,-0.2 -3,-0.2 3,-0.1 -0.927 20.8 163.7-124.1 149.6 -2.1 12.1 -0.3 111 111 A D S S+ 0 0 83 -110,-2.1 49,-1.5 1,-0.4 2,-0.4 0.569 72.9 21.1-131.4 -35.6 -1.6 12.8 3.5 112 112 A T E -bF 2 159A 29 -111,-1.3 -109,-3.6 47,-0.2 2,-0.5 -0.996 62.9-157.4-140.6 134.2 0.9 10.2 4.7 113 113 A L E -bF 3 158A 0 45,-1.1 45,-2.9 -2,-0.4 2,-0.5 -0.938 7.8-176.5-115.9 129.2 3.5 8.1 2.7 114 114 A L E +bF 4 157A 8 -111,-3.3 -109,-2.3 -2,-0.5 2,-0.4 -0.902 12.7 168.1-125.8 104.1 4.9 4.8 4.0 115 115 A V E -bF 5 156A 0 41,-2.3 41,-2.7 -2,-0.5 2,-0.7 -0.937 24.6-149.7-120.0 140.0 7.6 3.2 1.7 116 116 A T E -bF 6 155A 1 -111,-1.1 -109,-3.1 -2,-0.4 2,-0.7 -0.896 11.6-161.1-107.5 112.8 9.9 0.3 2.5 117 117 A R E -bF 7 154A 85 37,-1.5 37,-1.5 -2,-0.7 -109,-0.3 -0.816 9.5-155.6 -96.5 114.4 13.3 0.5 0.7 118 118 A L E - 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