==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 19-MAY-03 1PD8 . COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.CODY,J.R.LUFT,W.PANGBORN,A.GANGJEE . 186 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10209.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 122 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 14.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 12.4 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 15.6 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 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 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 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 V 0 0 85 0, 0.0 110,-0.2 0, 0.0 109,-0.2 0.000 360.0 360.0 360.0 142.2 8.4 21.8 1.3 2 2 A G + 0 0 41 108,-3.5 109,-0.1 1,-0.3 2,-0.1 0.266 360.0 0.1 -88.9-132.6 9.0 20.5 -2.2 3 3 A S - 0 0 43 1,-0.1 109,-3.2 128,-0.0 2,-0.5 -0.307 51.6-141.4 -61.1 138.3 10.7 17.4 -3.3 4 4 A L E +a 112 0A 25 126,-0.4 128,-1.3 107,-0.2 2,-0.3 -0.895 36.2 169.3-101.8 119.3 12.3 14.7 -1.1 5 5 A N E -ab 113 132A 3 107,-2.5 109,-2.8 -2,-0.5 2,-0.4 -0.976 28.4-150.2-139.8 155.0 15.6 13.5 -2.8 6 6 A C E -ab 114 133A 0 126,-2.3 128,-2.5 -2,-0.3 2,-0.3 -0.918 12.5-167.4-120.4 139.3 18.6 11.4 -2.1 7 7 A I E + b 0 134A 3 107,-1.9 2,-0.3 -2,-0.4 128,-0.2 -0.992 17.7 154.7-132.8 133.6 22.0 12.1 -3.7 8 8 A V E - b 0 135A 10 126,-1.9 128,-2.4 -2,-0.3 2,-0.5 -0.991 35.8-141.7-155.7 149.3 25.0 9.6 -3.6 9 9 A A E - b 0 136A 17 -2,-0.3 2,-0.3 126,-0.2 128,-0.2 -0.991 32.5-178.4-112.5 131.2 28.2 8.6 -5.5 10 10 A V E - b 0 137A 0 126,-2.6 128,-3.2 -2,-0.5 6,-0.2 -0.994 20.9-132.8-134.4 144.2 28.7 4.8 -5.5 11 11 A S > - 0 0 2 4,-1.6 3,-1.8 -2,-0.3 130,-0.2 -0.139 42.0 -94.4 -84.5 172.5 31.4 2.4 -6.8 12 12 A Q T 3 S+ 0 0 124 128,-2.3 129,-0.2 126,-0.4 127,-0.1 0.761 129.7 53.8 -63.2 -27.8 30.6 -0.7 -8.8 13 13 A N T 3 S- 0 0 51 127,-0.3 -1,-0.3 129,-0.1 128,-0.1 0.148 122.2-110.4 -87.7 12.5 30.8 -2.7 -5.5 14 14 A M < + 0 0 47 -3,-1.8 134,-2.1 1,-0.2 2,-0.1 0.557 63.2 159.0 71.8 10.6 28.3 -0.3 -4.1 15 15 A G E +I 147 0B 0 132,-0.2 -4,-1.6 127,-0.2 132,-0.3 -0.491 21.8 176.5 -69.8 133.5 30.8 1.3 -1.7 16 16 A I E + 0 0 27 130,-4.2 2,-0.3 1,-0.3 131,-0.2 0.539 62.5 3.8-115.6 -11.5 30.0 4.8 -0.4 17 17 A G E -I 146 0B 7 129,-1.7 128,-3.1 5,-0.2 129,-1.3 -0.996 45.5-153.4-165.4 167.7 33.0 5.3 2.0 18 18 A K B > S-J 21 0C 64 3,-2.9 3,-2.7 -2,-0.3 126,-0.1 -0.944 82.8 -20.2-147.6 115.7 36.2 4.1 3.5 19 19 A N T 3 S- 0 0 136 1,-0.3 3,-0.1 -2,-0.3 125,-0.0 0.928 128.6 -50.6 47.5 48.4 37.5 5.1 7.0 20 20 A G T 3 S+ 0 0 23 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.568 126.1 98.6 67.7 11.8 35.3 8.1 6.9 21 21 A D B < S-J 18 0C 109 -3,-2.7 -3,-2.9 39,-0.0 -1,-0.3 -0.602 84.3 -86.0-118.4 178.3 36.6 9.0 3.4 22 22 A L - 0 0 51 -5,-0.2 -5,-0.2 -2,-0.2 -6,-0.1 -0.770 33.8-133.5 -80.4 134.1 35.6 8.6 -0.3 23 23 A P S S+ 0 0 16 0, 0.0 120,-0.2 0, 0.0 -1,-0.1 0.527 87.2 55.5 -66.6 -11.7 36.8 5.3 -1.7 24 24 A W S S- 0 0 13 1,-0.1 -2,-0.2 118,-0.1 3,-0.1 -0.750 99.7 -89.6-119.0 164.8 38.2 7.1 -4.8 25 25 A P S S- 0 0 52 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.313 70.4 -75.6 -64.6 156.4 40.6 10.0 -5.4 26 26 A P - 0 0 62 0, 0.0 2,-0.5 0, 0.0 0, 0.0 -0.351 42.2-153.7 -61.9 142.0 38.7 13.3 -5.4 27 27 A L >> - 0 0 2 1,-0.1 4,-1.9 -3,-0.1 3,-1.3 -0.878 2.8-163.8-122.1 91.4 36.6 14.0 -8.5 28 28 A R H 3> S+ 0 0 129 -2,-0.5 4,-0.8 1,-0.3 -1,-0.1 0.685 88.0 46.4 -39.0 -44.6 36.2 17.8 -8.9 29 29 A N H 3> S+ 0 0 86 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.687 108.2 54.9 -77.3 -28.4 33.4 17.6 -11.4 30 30 A E H <> S+ 0 0 14 -3,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.919 111.7 45.6 -71.5 -40.8 31.4 15.0 -9.5 31 31 A F H X S+ 0 0 76 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.723 109.1 56.8 -67.3 -31.5 31.6 17.4 -6.4 32 32 A R H X S+ 0 0 183 -4,-0.8 4,-2.4 -5,-0.3 -1,-0.2 0.853 108.8 45.4 -65.5 -46.3 30.6 20.3 -8.8 33 33 A Y H X S+ 0 0 6 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.886 111.9 51.8 -62.1 -45.9 27.5 18.4 -9.7 34 34 A F H X S+ 0 0 40 -4,-1.8 4,-2.1 1,-0.2 5,-0.3 0.948 113.0 46.7 -62.9 -45.3 26.7 17.5 -6.0 35 35 A Q H X S+ 0 0 67 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.937 115.0 44.6 -60.7 -48.0 27.1 21.2 -5.2 36 36 A R H X S+ 0 0 95 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.928 113.3 50.0 -62.4 -47.5 24.9 22.4 -8.1 37 37 A M H < S+ 0 0 23 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.887 117.6 38.7 -61.9 -44.0 22.1 19.8 -7.5 38 38 A T H < S+ 0 0 0 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.778 118.5 46.3 -80.3 -29.3 21.8 20.5 -3.8 39 39 A T H < S+ 0 0 51 -4,-2.1 2,-0.4 -5,-0.3 9,-0.3 0.811 87.5 94.8 -83.8 -33.5 22.2 24.2 -3.8 40 40 A T < - 0 0 84 -4,-1.9 2,-0.5 -5,-0.2 7,-0.1 -0.532 58.8-157.2 -64.0 115.9 19.9 25.2 -6.6 41 41 A S - 0 0 36 -2,-0.4 2,-0.1 5,-0.2 4,-0.1 -0.828 14.0-153.5-102.8 129.7 16.4 26.2 -5.6 42 42 A S S S+ 0 0 86 -2,-0.5 2,-0.2 1,-0.1 -1,-0.1 -0.106 84.7 53.5 -82.9 31.7 13.6 26.0 -8.1 43 43 A V S > S- 0 0 64 3,-0.2 3,-1.0 -2,-0.1 -1,-0.1 -0.780 90.8-111.5-169.1 121.3 11.7 28.8 -6.2 44 44 A E T 3 S+ 0 0 195 1,-0.2 3,-0.1 -2,-0.2 -2,-0.1 -0.318 96.7 18.7 -65.9 135.8 13.0 32.3 -5.3 45 45 A G T 3 S+ 0 0 82 1,-0.4 2,-0.3 -2,-0.1 -1,-0.2 0.582 104.5 106.9 82.0 10.2 13.6 33.3 -1.7 46 46 A K < - 0 0 71 -3,-1.0 -1,-0.4 -5,-0.1 2,-0.3 -0.883 54.4-155.0-120.0 153.3 13.7 29.6 -0.7 47 47 A Q E -c 109 0A 90 61,-2.5 63,-2.6 -2,-0.3 2,-0.3 -0.881 20.7-113.1-123.9 155.3 16.7 27.5 0.2 48 48 A N E - 0 0 0 21,-0.5 23,-3.1 -9,-0.3 2,-0.4 -0.630 25.8-135.8 -88.8 148.1 17.3 23.7 -0.0 49 49 A L E -cd 112 71A 0 62,-2.2 64,-2.5 -2,-0.3 2,-0.5 -0.903 13.6-154.9-100.0 130.6 17.7 21.8 3.3 50 50 A V E -cd 113 72A 0 21,-3.4 23,-3.0 -2,-0.4 2,-0.4 -0.983 7.5-164.6-111.4 122.4 20.5 19.2 3.4 51 51 A I E +cd 114 73A 0 62,-2.3 64,-2.7 -2,-0.5 65,-0.4 -0.889 17.8 159.7-105.6 130.1 20.1 16.3 5.8 52 52 A M E - d 0 74A 0 21,-1.8 23,-2.3 -2,-0.4 65,-0.3 -0.990 36.1-111.2-144.3 161.2 23.1 14.1 6.8 53 53 A G E > - d 0 75A 8 63,-1.2 4,-2.3 -2,-0.3 23,-0.2 -0.148 42.7 -98.4 -82.2 178.6 24.2 11.7 9.6 54 54 A K H > S+ 0 0 68 21,-0.8 4,-2.2 2,-0.2 5,-0.1 0.896 122.4 51.5 -65.0 -43.2 27.0 12.5 12.0 55 55 A K H > S+ 0 0 120 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.905 109.7 51.4 -67.3 -38.8 29.7 10.5 10.2 56 56 A T H >> S+ 0 0 26 2,-0.2 3,-1.0 1,-0.2 4,-0.7 0.956 108.9 49.4 -64.8 -49.2 28.8 12.4 6.9 57 57 A W H >< S+ 0 0 0 -4,-2.3 3,-1.5 1,-0.3 -2,-0.2 0.947 113.0 47.4 -52.8 -49.3 29.0 15.8 8.5 58 58 A F H 3< S+ 0 0 109 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.667 102.8 66.5 -71.0 -12.0 32.4 14.9 9.9 59 59 A S H << S+ 0 0 52 -3,-1.0 -1,-0.3 -4,-1.0 -2,-0.2 0.617 83.6 83.2 -83.0 -17.0 33.6 13.5 6.6 60 60 A I S << S- 0 0 29 -3,-1.5 5,-0.1 -4,-0.7 -39,-0.0 -0.741 95.2 -99.9 -87.9 139.0 33.5 16.9 4.8 61 61 A P > - 0 0 73 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 -0.200 31.2-119.1 -53.3 146.7 36.6 19.1 5.2 62 62 A E G > S+ 0 0 142 1,-0.3 3,-2.6 2,-0.2 -2,-0.1 0.896 113.3 60.6 -55.2 -45.0 36.1 21.8 7.8 63 63 A K G 3 S+ 0 0 157 1,-0.3 -1,-0.3 0, 0.0 -3,-0.0 0.822 106.0 47.9 -57.7 -30.4 36.7 24.5 5.3 64 64 A N G < S+ 0 0 64 -3,-0.8 -1,-0.3 3,-0.1 -2,-0.2 0.258 92.8 135.5 -93.3 10.9 33.7 23.2 3.3 65 65 A R < + 0 0 49 -3,-2.6 2,-0.1 2,-0.1 21,-0.1 -0.954 59.2 27.0-113.2 127.9 31.5 23.0 6.4 66 66 A P S S- 0 0 42 0, 0.0 2,-0.3 0, 0.0 20,-0.1 0.606 97.5-115.4 -78.3 161.9 28.7 24.0 6.5 67 67 A L > - 0 0 6 -2,-0.1 3,-1.1 1,-0.1 -2,-0.1 -0.482 42.7-119.4 -62.4 119.8 27.7 23.5 2.8 68 68 A K T 3 S+ 0 0 161 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 -0.360 87.2 19.9 -69.2 143.5 27.1 27.1 1.8 69 69 A G T 3 S+ 0 0 38 1,-0.2 -21,-0.5 -2,-0.1 2,-0.3 0.367 108.4 87.7 83.3 1.4 23.7 28.3 0.5 70 70 A R S < S- 0 0 9 -3,-1.1 2,-0.6 -23,-0.1 -1,-0.2 -0.878 82.8-110.7-127.9 155.9 21.8 25.4 2.1 71 71 A I E -d 49 0A 17 -23,-3.1 -21,-3.4 -2,-0.3 2,-0.5 -0.823 37.2-148.3 -86.0 124.4 20.2 24.7 5.4 72 72 A N E +d 50 0A 0 -2,-0.6 15,-1.4 -23,-0.2 16,-1.1 -0.848 18.5 179.5 -99.8 128.7 22.4 22.0 7.1 73 73 A L E -de 51 88A 0 -23,-3.0 -21,-1.8 -2,-0.5 2,-0.4 -0.996 13.1-152.9-127.0 132.4 20.7 19.5 9.5 74 74 A V E -de 52 89A 0 14,-2.0 16,-2.3 -2,-0.4 2,-0.6 -0.800 7.4-145.5-105.8 137.9 22.6 16.7 11.2 75 75 A L E +de 53 90A 22 -23,-2.3 -21,-0.8 -2,-0.4 2,-0.3 -0.961 38.2 143.2-106.8 116.0 20.8 13.6 12.3 76 76 A S - 0 0 10 14,-2.0 -2,-0.0 -2,-0.6 13,-0.0 -0.991 41.0-162.2-153.7 150.5 22.1 12.1 15.5 77 77 A R S S+ 0 0 211 -2,-0.3 -1,-0.1 1,-0.0 14,-0.1 0.729 95.5 44.2-106.5 -22.6 20.9 10.4 18.6 78 78 A E S S+ 0 0 154 13,-0.0 2,-0.2 2,-0.0 13,-0.1 0.691 90.7 93.4 -91.1 -26.7 23.9 11.0 20.9 79 79 A L - 0 0 42 1,-0.1 -3,-0.1 12,-0.0 10,-0.0 -0.547 52.8-165.2 -72.9 137.4 24.5 14.7 20.1 80 80 A K S S+ 0 0 189 -2,-0.2 -1,-0.1 1,-0.2 9,-0.1 0.678 77.7 16.8 -92.9 -28.3 22.8 17.3 22.5 81 81 A E S S- 0 0 147 7,-0.1 -1,-0.2 3,-0.0 3,-0.1 -0.964 97.0 -82.5-140.0 160.8 23.4 20.2 20.1 82 82 A P - 0 0 42 0, 0.0 3,-0.1 0, 0.0 7,-0.1 -0.313 56.9 -98.8 -57.5 147.2 24.3 20.6 16.4 83 83 A P > - 0 0 15 0, 0.0 3,-1.5 0, 0.0 2,-0.2 -0.089 57.7 -75.4 -57.8 164.9 28.1 20.3 15.7 84 84 A Q T 3 S+ 0 0 175 1,-0.2 3,-0.1 -3,-0.1 -3,-0.0 -0.502 125.3 23.7 -64.5 138.1 29.9 23.6 15.4 85 85 A G T 3 S+ 0 0 33 1,-0.4 -1,-0.2 -2,-0.2 -13,-0.1 -0.084 100.7 110.9 98.0 -30.4 29.0 25.1 12.0 86 86 A A < - 0 0 16 -3,-1.5 -1,-0.4 1,-0.1 -13,-0.1 -0.209 54.9-154.5 -75.0 160.1 25.7 23.1 11.7 87 87 A H + 0 0 84 -15,-1.4 2,-0.3 1,-0.3 -14,-0.2 0.799 68.3 17.5-109.7 -30.3 22.2 24.7 11.9 88 88 A F E -e 73 0A 58 -16,-1.1 -14,-2.0 -7,-0.1 2,-0.3 -0.908 53.6-159.0-148.6 154.6 19.8 22.0 13.1 89 89 A L E -e 74 0A 35 -2,-0.3 2,-0.3 -16,-0.2 -14,-0.2 -0.954 13.0-176.1-132.9 134.8 20.0 18.7 14.8 90 90 A S E -e 75 0A 9 -16,-2.3 -14,-2.0 -2,-0.3 3,-0.1 -0.898 27.8-141.6-131.2 155.8 17.2 16.1 14.7 91 91 A R S S+ 0 0 153 -2,-0.3 2,-0.3 -16,-0.2 -1,-0.1 0.775 84.3 7.3 -83.9 -33.5 17.0 12.8 16.4 92 92 A S S > S- 0 0 36 -3,-0.1 4,-2.1 -17,-0.1 -1,-0.1 -0.852 73.9-104.3-143.3 175.0 15.3 11.2 13.4 93 93 A L H > S+ 0 0 4 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.839 120.9 51.7 -65.7 -39.7 14.3 11.5 9.7 94 94 A D H > S+ 0 0 82 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.803 111.9 45.0 -68.2 -33.9 10.7 12.0 10.7 95 95 A D H > S+ 0 0 68 2,-0.2 4,-2.2 3,-0.1 -2,-0.2 0.834 110.5 54.3 -78.4 -39.9 11.6 14.7 13.3 96 96 A A H X S+ 0 0 0 -4,-2.1 4,-0.6 1,-0.2 -2,-0.2 0.889 111.9 46.3 -60.0 -42.6 13.8 16.4 10.7 97 97 A L H >X S+ 0 0 21 -4,-2.0 4,-1.0 2,-0.2 3,-0.7 0.853 107.4 54.7 -67.5 -41.3 10.9 16.4 8.4 98 98 A K H >< S+ 0 0 104 -4,-1.5 3,-1.1 1,-0.2 -2,-0.2 0.933 101.9 59.5 -61.1 -43.5 8.4 17.7 10.9 99 99 A L H >< S+ 0 0 19 -4,-2.2 3,-1.1 1,-0.3 6,-0.8 0.770 99.0 58.5 -51.1 -31.5 10.7 20.8 11.6 100 100 A T H << S+ 0 0 4 -3,-0.7 -1,-0.3 -4,-0.6 9,-0.2 0.903 102.8 53.5 -61.1 -45.3 10.3 21.6 7.9 101 101 A E T << S+ 0 0 150 -3,-1.1 -1,-0.3 -4,-1.0 -2,-0.2 0.029 89.4 100.4 -80.2 13.1 6.5 21.9 8.5 102 102 A Q S <> S- 0 0 70 -3,-1.1 4,-2.1 1,-0.0 5,-0.1 -0.699 89.8-114.6-100.3 152.5 7.0 24.3 11.4 103 103 A P T 4 S+ 0 0 107 0, 0.0 4,-0.5 0, 0.0 -3,-0.1 0.658 112.2 76.2 -64.6 -11.9 6.5 28.0 10.7 104 104 A E T >4 S+ 0 0 97 1,-0.2 3,-0.5 -5,-0.1 4,-0.1 0.940 119.6 2.1 -58.9 -86.8 10.2 28.0 11.5 105 105 A L G >> S+ 0 0 2 -6,-0.8 4,-2.1 1,-0.2 3,-1.5 0.517 108.4 106.6 -76.0 -10.7 11.6 26.6 8.2 106 106 A A G 3< S+ 0 0 36 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.1 0.831 89.9 27.5 -33.4 -59.0 8.1 26.5 6.8 107 107 A N G <4 S+ 0 0 98 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.1 0.386 118.9 64.9 -88.5 -7.1 8.4 29.5 4.5 108 108 A K T <4 S+ 0 0 94 -3,-1.5 -61,-2.5 -8,-0.2 2,-0.4 0.826 83.7 76.2 -88.6 -44.6 12.2 28.9 4.2 109 109 A V E < + c 0 47A 0 -4,-2.1 -61,-0.2 -63,-0.2 3,-0.1 -0.726 36.2 169.5 -94.7 133.7 12.7 25.5 2.4 110 110 A D E S+ 0 0 10 -63,-2.6 -108,-3.5 -2,-0.4 2,-0.2 0.730 70.2 4.8 -94.3-101.5 12.3 24.4 -1.2 111 111 A M E - 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