==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 09-SEP-11 3TQA . COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: COXIELLA BURNETII; . AUTHOR M.C.FRANKLIN,M.CASSIDY,B.HILLERICH,J.LOVE . 158 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9075.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 115 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 18.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 14.6 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 . 1 0.6 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 . 20 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 16.5 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 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 PARALLEL BRIDGES PER LADDER . 1 1 0 0 0 0 2 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 . 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 85 0, 0.0 2,-0.6 0, 0.0 91,-0.2 0.000 360.0 360.0 360.0 133.4 21.4 -13.4 5.3 2 2 A I E -a 92 0A 56 89,-1.5 91,-2.8 88,-0.1 2,-0.6 -0.933 360.0-151.6-106.0 114.0 18.0 -12.1 6.4 3 3 A I E -a 93 0A 18 -2,-0.6 107,-2.5 105,-0.3 108,-2.1 -0.779 19.0-173.4 -86.5 118.8 17.7 -8.3 5.9 4 4 A T E -ab 94 111A 1 89,-3.2 91,-3.9 -2,-0.6 2,-0.5 -0.939 16.1-152.4-118.7 134.8 15.2 -6.9 8.5 5 5 A L E -ab 95 112A 0 106,-2.2 108,-2.6 -2,-0.4 2,-0.5 -0.927 13.6-173.1-104.7 122.8 13.9 -3.4 8.8 6 6 A I E + b 0 113A 5 89,-2.6 2,-0.3 -2,-0.5 108,-0.2 -0.976 19.0 146.0-118.0 126.9 12.8 -2.3 12.2 7 7 A A E - b 0 114A 10 106,-1.3 108,-2.2 -2,-0.5 2,-0.5 -0.987 40.7-134.4-159.0 145.4 11.0 1.1 12.7 8 8 A A E + b 0 115A 16 -2,-0.3 2,-0.3 106,-0.2 108,-0.2 -0.923 38.3 161.1-102.6 127.7 8.4 2.8 14.8 9 9 A M E - b 0 116A 1 106,-3.5 108,-2.9 -2,-0.5 6,-0.2 -0.895 32.1-121.6-139.5 168.3 5.9 4.9 12.8 10 10 A D E > - b 0 117A 2 4,-1.1 3,-1.7 -2,-0.3 108,-0.2 -0.227 53.3 -74.8 -97.3-168.3 2.4 6.5 13.1 11 11 A K T 3 S+ 0 0 114 108,-1.7 109,-0.1 106,-0.5 107,-0.1 0.730 134.6 45.2 -65.0 -23.1 -0.7 6.0 11.0 12 12 A N T 3 S- 0 0 90 107,-0.3 -1,-0.3 2,-0.1 108,-0.1 0.106 121.0-104.9-104.7 19.8 0.8 8.1 8.1 13 13 A R < + 0 0 77 -3,-1.7 114,-3.3 1,-0.2 2,-0.2 0.697 63.7 161.8 64.1 24.0 4.3 6.4 8.4 14 14 A L E +H 126 0B 1 112,-0.2 -4,-1.1 1,-0.1 112,-0.3 -0.545 10.8 167.8 -73.1 138.0 5.9 9.4 10.1 15 15 A I E + 0 0 19 110,-2.4 2,-0.3 1,-0.3 111,-0.2 0.636 51.2 17.2-124.5 -26.0 9.2 8.5 11.9 16 16 A G E -H 125 0B 8 109,-1.5 108,-1.6 5,-0.2 109,-1.2 -0.934 41.3-163.2-150.9 169.8 11.0 11.8 12.9 17 17 A R B > S-I 20 0C 82 3,-2.3 3,-0.8 -2,-0.3 106,-0.0 -0.847 83.0 -12.9-160.4 116.7 10.9 15.5 13.5 18 18 A N T 3 S- 0 0 108 -2,-0.3 3,-0.1 1,-0.2 105,-0.0 0.897 127.9 -55.4 52.8 45.6 14.0 17.9 13.7 19 19 A N T 3 S+ 0 0 83 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.749 124.2 92.1 59.0 29.1 16.2 14.8 14.0 20 20 A E B < S-I 17 0C 116 -3,-0.8 -3,-2.3 31,-0.0 -1,-0.2 -0.852 84.4 -89.0-137.9 172.7 14.3 13.5 17.0 21 21 A L - 0 0 98 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.0 -0.692 24.3-144.5 -82.8 139.2 11.3 11.2 17.8 22 22 A P S S+ 0 0 23 0, 0.0 2,-0.3 0, 0.0 100,-0.2 0.429 80.7 25.1 -81.4 2.2 7.9 12.9 17.8 23 23 A W - 0 0 21 98,-0.1 2,-0.3 2,-0.0 -2,-0.1 -0.871 67.5-129.4-147.4 177.1 6.8 10.6 20.7 24 24 A H + 0 0 125 -2,-0.3 0, 0.0 4,-0.0 0, 0.0 -0.910 26.3 170.6-137.9 113.5 7.9 8.5 23.7 25 25 A L >> - 0 0 4 -2,-0.3 3,-1.6 1,-0.1 4,-1.3 -0.822 13.9-169.4-127.3 88.5 6.5 4.9 23.8 26 26 A P H 3> S+ 0 0 59 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.792 86.7 59.7 -47.3 -38.5 8.3 2.8 26.5 27 27 A A H 3> S+ 0 0 26 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.847 104.8 49.8 -61.2 -36.2 6.7 -0.4 25.2 28 28 A D H <> S+ 0 0 20 -3,-1.6 4,-3.0 2,-0.2 -1,-0.2 0.847 106.5 55.1 -70.2 -36.3 8.3 0.1 21.8 29 29 A L H X S+ 0 0 81 -4,-1.3 4,-2.0 2,-0.2 -2,-0.2 0.877 110.6 44.6 -66.6 -39.6 11.8 0.7 23.4 30 30 A A H X S+ 0 0 65 -4,-1.7 4,-2.2 2,-0.2 5,-0.2 0.896 114.5 49.8 -68.7 -43.2 11.7 -2.6 25.3 31 31 A H H X S+ 0 0 30 -4,-1.8 4,-1.9 -5,-0.2 -2,-0.2 0.927 112.3 48.0 -57.8 -48.8 10.4 -4.4 22.1 32 32 A F H X S+ 0 0 45 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.898 110.7 51.7 -58.8 -44.3 13.2 -2.8 20.1 33 33 A K H X S+ 0 0 109 -4,-2.0 4,-1.3 1,-0.2 -2,-0.2 0.908 111.3 45.1 -63.6 -45.6 15.8 -3.8 22.6 34 34 A S H < S+ 0 0 79 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.865 114.0 50.2 -67.0 -37.9 14.9 -7.5 22.8 35 35 A I H < S+ 0 0 42 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.825 116.7 40.0 -68.1 -33.5 14.6 -7.8 19.0 36 36 A T H >< S+ 0 0 0 -4,-1.7 3,-1.9 -5,-0.2 -2,-0.2 0.595 81.6 122.9 -96.5 -13.8 18.0 -6.2 18.4 37 37 A L T 3< S+ 0 0 74 -4,-1.3 21,-0.1 1,-0.3 20,-0.1 -0.284 84.5 5.1 -57.9 125.3 20.1 -7.8 21.2 38 38 A G T 3 S+ 0 0 67 19,-1.4 -1,-0.3 1,-0.3 20,-0.1 0.562 109.0 105.5 80.4 11.0 23.2 -9.6 19.8 39 39 A K S < S- 0 0 65 -3,-1.9 20,-0.6 18,-0.1 2,-0.3 -0.820 78.3 -98.5-117.9 158.6 22.6 -8.6 16.2 40 40 A P E -c 59 0A 3 0, 0.0 54,-2.2 0, 0.0 2,-0.5 -0.625 36.3-155.1 -73.2 132.5 24.4 -6.2 13.8 41 41 A I E -cd 60 94A 0 18,-2.2 20,-2.9 -2,-0.3 2,-0.5 -0.957 2.8-158.3-114.2 122.3 22.4 -2.9 13.6 42 42 A V E +cd 61 95A 0 52,-3.0 54,-2.5 -2,-0.5 55,-0.6 -0.883 21.5 164.3-103.2 124.8 22.9 -0.8 10.5 43 43 A M E -cd 62 97A 0 18,-2.9 20,-2.8 -2,-0.5 55,-0.3 -0.929 36.4-108.6-136.7 159.0 22.0 3.0 10.7 44 44 A G E > -c 63 0A 10 53,-1.5 4,-1.7 -2,-0.3 20,-0.2 -0.445 39.1-107.8 -78.6 162.5 22.5 6.2 8.9 45 45 A R H > S+ 0 0 85 18,-1.2 4,-2.0 1,-0.2 5,-0.1 0.865 119.6 51.2 -63.0 -39.2 24.9 8.9 10.3 46 46 A R H > S+ 0 0 165 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.880 107.2 54.1 -64.7 -39.0 22.1 11.2 11.3 47 47 A T H > S+ 0 0 33 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.858 107.1 51.5 -64.7 -35.5 20.3 8.3 13.1 48 48 A F H X S+ 0 0 19 -4,-1.7 4,-3.1 2,-0.2 3,-0.3 0.943 109.0 49.7 -63.0 -48.7 23.5 7.7 15.1 49 49 A D H < S+ 0 0 73 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.846 106.6 57.3 -58.1 -36.4 23.7 11.4 16.1 50 50 A S H < S+ 0 0 59 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.884 111.8 40.8 -61.0 -41.7 20.1 11.1 17.2 51 51 A I H < S- 0 0 66 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.899 98.1-148.9 -73.0 -44.0 20.9 8.3 19.6 52 52 A G < + 0 0 53 -4,-3.1 -3,-0.1 -5,-0.1 -4,-0.1 0.043 65.5 28.5 100.6 -24.7 24.1 10.0 20.7 53 53 A K S S- 0 0 149 -5,-0.2 20,-0.1 20,-0.0 2,-0.0 -0.972 97.2 -69.8-158.5 164.6 26.2 6.9 21.4 54 54 A P - 0 0 41 0, 0.0 20,-0.1 0, 0.0 5,-0.0 -0.355 50.7-113.0 -62.8 139.1 26.6 3.3 20.4 55 55 A L > - 0 0 25 1,-0.1 3,-0.8 -14,-0.1 5,-0.1 -0.626 42.3-116.4 -70.3 123.4 23.8 0.9 21.4 56 56 A P T 3 S+ 0 0 76 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.174 89.8 20.8 -66.2 155.4 25.3 -1.5 24.0 57 57 A H T 3 S+ 0 0 145 1,-0.2 -19,-1.4 -20,-0.1 2,-0.3 0.689 108.9 92.8 64.6 23.5 25.6 -5.2 23.4 58 58 A R S < S- 0 0 29 -3,-0.8 2,-1.2 -21,-0.1 -1,-0.2 -0.997 83.4-112.4-147.3 143.6 25.3 -4.8 19.7 59 59 A R E -c 40 0A 102 -20,-0.6 -18,-2.2 -2,-0.3 2,-0.4 -0.678 39.4-151.3 -76.6 98.5 27.6 -4.3 16.7 60 60 A N E -ce 41 74A 4 -2,-1.2 15,-2.7 13,-0.5 2,-0.5 -0.614 13.3-170.6 -76.5 125.4 26.8 -0.7 15.7 61 61 A I E -ce 42 75A 0 -20,-2.9 -18,-2.9 -2,-0.4 2,-0.5 -0.982 1.8-164.9-121.5 124.5 27.2 -0.1 12.0 62 62 A V E -ce 43 76A 0 13,-2.7 15,-2.1 -2,-0.5 2,-0.5 -0.925 8.4-149.4-115.1 129.4 27.0 3.5 10.6 63 63 A I E +ce 44 77A 18 -20,-2.8 -18,-1.2 -2,-0.5 2,-0.3 -0.852 33.3 146.9 -98.1 128.3 26.6 4.4 6.9 64 64 A T - 0 0 12 13,-1.9 -2,-0.0 -2,-0.5 -20,-0.0 -0.977 48.8-142.3-153.4 159.8 28.2 7.7 5.8 65 65 A Q S S+ 0 0 126 -2,-0.3 2,-0.6 14,-0.0 13,-0.1 0.491 72.9 107.1-101.1 -8.9 29.9 9.3 2.8 66 66 A Q > - 0 0 92 1,-0.2 3,-0.8 2,-0.1 -2,-0.0 -0.625 54.7-164.8 -73.1 114.7 32.4 11.2 5.0 67 67 A K T 3 S+ 0 0 114 -2,-0.6 -1,-0.2 1,-0.2 11,-0.0 0.776 83.4 44.1 -79.0 -29.4 35.7 9.4 4.5 68 68 A N T 3 S+ 0 0 158 2,-0.1 2,-0.5 0, 0.0 -1,-0.2 0.260 83.6 125.8 -96.4 11.0 37.7 10.8 7.4 69 69 A L < - 0 0 43 -3,-0.8 2,-0.4 2,-0.0 7,-0.0 -0.600 40.8-167.1 -79.0 120.5 34.8 10.4 9.9 70 70 A I - 0 0 130 -2,-0.5 2,-0.4 5,-0.0 5,-0.1 -0.903 8.0-177.9-107.6 134.2 35.7 8.4 13.0 71 71 A I > - 0 0 20 -2,-0.4 3,-1.5 3,-0.3 -9,-0.1 -0.920 24.3-132.6-134.7 107.5 33.1 7.1 15.4 72 72 A E T 3 S+ 0 0 151 -2,-0.4 3,-0.1 1,-0.2 -2,-0.0 -0.334 90.5 16.7 -60.2 133.1 34.3 5.2 18.5 73 73 A G T 3 S+ 0 0 61 1,-0.2 -13,-0.5 -20,-0.1 2,-0.3 0.578 111.8 90.9 80.9 12.5 32.4 1.9 19.2 74 74 A C E < S-e 60 0A 15 -3,-1.5 2,-0.5 -15,-0.1 -3,-0.3 -0.980 70.9-127.6-138.6 149.1 31.0 1.7 15.6 75 75 A D E -e 61 0A 66 -15,-2.7 -13,-2.7 -2,-0.3 2,-0.4 -0.856 27.1-145.2 -95.4 128.7 32.0 0.3 12.3 76 76 A I E +e 62 0A 38 -2,-0.5 2,-0.3 -15,-0.2 -13,-0.2 -0.807 19.3 177.5 -97.9 131.5 31.9 2.7 9.4 77 77 A F E -e 63 0A 39 -15,-2.1 -13,-1.9 -2,-0.4 3,-0.0 -0.985 27.5-142.3-129.8 146.1 30.9 1.8 5.8 78 78 A Y S S+ 0 0 101 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.1 0.414 84.2 16.1 -92.3 0.9 30.7 4.1 2.9 79 79 A S S > S- 0 0 38 1,-0.1 4,-1.5 -14,-0.0 5,-0.1 -0.966 74.4-114.9-158.4 164.9 27.6 2.5 1.3 80 80 A L H > S+ 0 0 0 -2,-0.3 4,-2.9 2,-0.2 5,-0.2 0.894 116.1 55.9 -67.5 -40.6 24.8 0.0 2.3 81 81 A D H > S+ 0 0 80 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.896 106.2 50.3 -58.3 -44.1 26.1 -2.5 -0.2 82 82 A D H > S+ 0 0 85 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.886 112.1 48.1 -61.2 -41.0 29.6 -2.5 1.4 83 83 A A H X S+ 0 0 0 -4,-1.5 4,-1.4 2,-0.2 -2,-0.2 0.958 114.2 44.5 -63.9 -52.6 28.1 -3.0 4.9 84 84 A L H < S+ 0 0 16 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.851 111.6 54.8 -60.8 -37.3 25.8 -5.9 3.7 85 85 A S H >< S+ 0 0 84 -4,-2.5 3,-0.9 -5,-0.2 -1,-0.2 0.860 108.2 48.8 -62.4 -38.1 28.8 -7.3 1.8 86 86 A A H 3< S+ 0 0 52 -4,-1.7 3,-0.3 1,-0.2 -1,-0.2 0.755 111.1 50.9 -72.2 -25.9 30.9 -7.3 5.1 87 87 A L T >< S+ 0 0 2 -4,-1.4 3,-0.6 1,-0.2 -1,-0.2 -0.045 71.9 122.2-102.6 30.1 28.0 -9.0 7.0 88 88 A T T < S+ 0 0 91 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.1 0.889 73.6 49.6 -61.5 -42.8 27.5 -11.9 4.5 89 89 A K T 3 S+ 0 0 205 -3,-0.3 -1,-0.2 -4,-0.1 -2,-0.1 0.692 88.3 103.4 -71.8 -19.9 28.1 -14.6 7.1 90 90 A E < - 0 0 71 -3,-0.6 3,-0.1 1,-0.1 -88,-0.1 -0.415 67.4-145.3 -64.0 135.9 25.7 -13.1 9.5 91 91 A P S S+ 0 0 99 0, 0.0 -89,-1.5 0, 0.0 2,-0.3 0.798 83.0 19.9 -72.6 -28.5 22.3 -14.9 9.6 92 92 A E E -a 2 0A 40 -91,-0.2 2,-0.4 2,-0.0 -89,-0.2 -0.999 60.7-166.6-144.8 139.3 20.4 -11.7 10.2 93 93 A V E -a 3 0A 0 -91,-2.8 -89,-3.2 -2,-0.3 2,-0.6 -0.996 14.3-149.5-125.7 130.8 21.0 -7.9 9.7 94 94 A I E -ad 4 41A 0 -54,-2.2 -52,-3.0 -2,-0.4 2,-0.6 -0.891 2.8-158.8-107.8 118.8 18.8 -5.3 11.2 95 95 A I E +ad 5 42A 1 -91,-3.9 -89,-2.6 -2,-0.6 -52,-0.2 -0.860 11.9 177.9 -95.2 121.8 18.3 -1.9 9.5 96 96 A I E - 0 0 19 -54,-2.5 2,-0.2 -2,-0.6 -53,-0.2 0.386 36.3-167.2-109.3 2.0 17.1 0.7 12.0 97 97 A G E - d 0 43A 1 -55,-0.6 -53,-1.5 1,-0.2 -1,-0.4 -0.671 46.2-136.1 123.0-174.9 16.9 3.8 9.7 98 98 A G > - 0 0 17 -55,-0.3 4,-3.0 -2,-0.2 5,-0.2 0.340 54.2 -94.5 -92.1-142.8 16.7 6.6 8.9 99 99 A A H > S+ 0 0 34 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.870 123.5 45.7 -58.0 -44.9 14.5 7.5 6.0 100 100 A R H > S+ 0 0 154 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.881 115.3 46.8 -67.7 -40.7 17.2 7.4 3.3 101 101 A I H > S+ 0 0 11 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.911 111.7 51.2 -68.0 -42.7 18.6 4.1 4.6 102 102 A F H X S+ 0 0 6 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.911 108.7 51.5 -58.7 -45.2 15.1 2.5 4.8 103 103 A K H < S+ 0 0 157 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.873 114.6 42.3 -61.4 -40.4 14.3 3.6 1.2 104 104 A E H < S+ 0 0 83 -4,-1.6 4,-0.2 1,-0.2 -1,-0.2 0.825 118.6 45.4 -75.0 -33.9 17.5 2.0 -0.1 105 105 A A H >X S+ 0 0 2 -4,-2.4 3,-1.8 1,-0.2 4,-0.7 0.798 93.8 80.3 -78.3 -30.5 17.1 -1.1 2.1 106 106 A L G >< S+ 0 0 22 -4,-2.7 3,-1.1 1,-0.3 -1,-0.2 0.841 89.8 50.7 -49.2 -47.8 13.4 -1.7 1.3 107 107 A P G 34 S+ 0 0 94 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.711 117.4 41.7 -66.2 -18.1 13.9 -3.4 -2.1 108 108 A K G <4 S+ 0 0 93 -3,-1.8 -105,-0.3 -4,-0.2 -2,-0.2 0.365 89.7 121.3-103.6 1.4 16.4 -5.8 -0.5 109 109 A A << - 0 0 1 -3,-1.1 -105,-0.2 -4,-0.7 3,-0.1 -0.473 35.5-180.0 -75.1 132.8 14.4 -6.3 2.7 110 110 A D S S+ 0 0 44 -107,-2.5 49,-2.8 1,-0.2 2,-0.3 0.784 71.9 20.6 -89.9 -38.4 13.3 -9.9 3.6 111 111 A K E -bF 4 158A 47 -108,-2.1 -106,-2.2 47,-0.2 2,-0.4 -0.920 58.9-158.9-136.5 152.3 11.4 -8.9 6.8 112 112 A M E -bF 5 157A 0 45,-2.6 45,-3.2 -2,-0.3 2,-0.6 -0.985 3.6-170.5-136.1 126.9 9.8 -5.9 8.5 113 113 A I E +bF 6 156A 6 -108,-2.6 -106,-1.3 -2,-0.4 2,-0.4 -0.891 26.1 179.3-112.6 96.0 9.1 -5.5 12.3 114 114 A L E -bF 7 155A 0 41,-2.9 41,-2.9 -2,-0.6 2,-0.6 -0.833 27.2-154.6-109.1 134.4 7.0 -2.3 12.4 115 115 A T E -bF 8 154A 0 -108,-2.2 -106,-3.5 -2,-0.4 2,-0.6 -0.940 19.0-166.6-100.1 113.9 5.4 -0.5 15.3 116 116 A I E -bF 9 153A 38 37,-1.6 37,-1.0 -2,-0.6 2,-0.4 -0.916 6.6-151.1-108.4 117.0 2.4 1.4 14.0 117 117 A I E -bF 10 152A 0 -108,-2.9 2,-2.0 -2,-0.6 -106,-0.5 -0.712 15.2-132.8 -90.2 131.8 0.9 4.0 16.4 118 118 A N S S+ 0 0 106 33,-3.1 2,-0.3 -2,-0.4 -108,-0.1 -0.493 77.4 80.8 -81.7 70.3 -2.8 4.8 16.1 119 119 A H S S- 0 0 77 -2,-2.0 -108,-1.7 31,-0.1 2,-0.6 -0.971 74.9-119.7-165.8 160.1 -2.3 8.6 16.1 120 120 A S - 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