==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 10-NOV-08 2W3A . COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.K.W.LEUNG,R.C.REYNOLDS,D.W.BORHANI . 372 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20646.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 234 62.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 57 15.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 11.8 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 . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 34 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 56 15.1 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 1 2 0 2 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 2 2 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 PARALLEL BRIDGES PER LADDER . 2 4 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 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 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 78 0, 0.0 3,-0.1 0, 0.0 96,-0.0 0.000 360.0 360.0 360.0 122.3 -9.2 11.2 4.0 2 2 A G + 0 0 74 1,-0.1 128,-0.6 127,-0.1 2,-0.3 0.427 360.0 24.7 -93.3 -1.8 -8.4 9.0 0.9 3 3 A S E -a 130 0A 40 126,-0.1 109,-0.3 2,-0.0 2,-0.3 -0.974 57.4-160.7-162.9 142.7 -6.2 11.5 -1.0 4 4 A L E -a 131 0A 3 126,-1.4 128,-1.9 -2,-0.3 2,-0.4 -0.919 8.4-152.9-120.9 156.8 -3.9 14.5 -0.4 5 5 A N E -ab 132 113A 6 107,-1.7 109,-3.2 -2,-0.3 2,-0.4 -0.988 4.2-163.0-123.9 138.6 -2.6 17.2 -2.8 6 6 A C E -ab 133 114A 2 126,-2.6 128,-3.0 -2,-0.4 2,-0.4 -0.932 6.3-167.2-108.6 148.5 0.6 19.2 -2.5 7 7 A I E +a 134 0A 4 107,-2.1 2,-0.3 -2,-0.4 128,-0.2 -0.998 18.0 149.5-138.7 130.9 1.2 22.4 -4.5 8 8 A V E -a 135 0A 10 126,-2.4 128,-2.5 -2,-0.4 2,-0.4 -0.975 36.1-140.3-153.0 154.8 4.5 24.2 -4.9 9 9 A A E -a 136 0A 16 -2,-0.3 2,-0.4 126,-0.2 128,-0.2 -0.991 30.3-176.1-119.5 135.0 6.6 26.4 -7.2 10 10 A V E -a 137 0A 0 126,-2.8 128,-2.7 -2,-0.4 6,-0.2 -0.994 20.2-130.7-140.7 134.9 10.3 25.6 -7.5 11 11 A S > - 0 0 3 4,-2.3 3,-2.0 -2,-0.4 130,-0.2 -0.198 41.2 -96.1 -76.2 171.4 13.4 27.0 -9.2 12 12 A Q T 3 S+ 0 0 143 128,-2.5 129,-0.2 126,-0.4 -1,-0.1 0.848 128.6 52.8 -59.4 -35.1 15.8 25.0 -11.3 13 13 A N T 3 S- 0 0 63 127,-0.4 -1,-0.3 129,-0.1 128,-0.1 0.159 125.1-104.6 -84.5 18.4 18.1 24.7 -8.2 14 14 A M < + 0 0 54 -3,-2.0 134,-2.6 1,-0.2 2,-0.2 0.628 68.2 156.5 66.0 19.5 15.1 23.4 -6.2 15 15 A G E +I 147 0B 0 132,-0.2 -4,-2.3 127,-0.1 132,-0.3 -0.515 20.2 166.0 -76.0 140.1 14.6 26.7 -4.3 16 16 A I E + 0 0 23 130,-2.9 2,-0.3 1,-0.3 131,-0.2 0.485 63.2 22.5-125.7 -12.5 11.2 27.6 -2.8 17 17 A G E -I 146 0B 10 129,-1.5 128,-2.6 5,-0.2 129,-1.3 -0.992 46.0-175.1-154.3 157.5 12.0 30.5 -0.5 18 18 A K B > S-J 21 0C 62 3,-2.5 3,-1.4 -2,-0.3 126,-0.1 -0.895 79.2 -14.4-152.4 122.9 14.5 33.3 0.2 19 19 A N T 3 S- 0 0 79 -2,-0.3 3,-0.1 1,-0.3 125,-0.0 0.827 127.2 -51.6 56.6 37.3 14.3 35.7 3.3 20 20 A G T 3 S+ 0 0 58 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.648 127.8 66.9 76.8 16.2 10.7 34.7 4.2 21 21 A D B < S-J 18 0C 118 -3,-1.4 -3,-2.5 1,-0.0 -1,-0.3 -0.773 96.5 -59.3-148.1-175.6 9.3 35.3 0.6 22 22 A L - 0 0 85 -2,-0.2 -5,-0.2 -5,-0.2 -6,-0.1 -0.453 37.5-131.9 -73.9 148.1 9.6 33.8 -2.9 23 23 A P S S+ 0 0 22 0, 0.0 120,-0.2 0, 0.0 -1,-0.1 0.739 90.0 51.7 -69.3 -20.7 13.1 33.7 -4.6 24 24 A W S S- 0 0 13 1,-0.1 -2,-0.1 118,-0.1 3,-0.1 -0.686 99.7 -86.0-113.6 161.8 11.6 35.2 -7.9 25 25 A P - 0 0 61 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.231 65.4 -73.0 -62.4 158.5 9.5 38.3 -8.6 26 26 A P - 0 0 58 0, 0.0 2,-0.7 0, 0.0 0, 0.0 -0.317 42.7-159.2 -58.6 127.2 5.7 38.0 -8.2 27 27 A L > - 0 0 8 1,-0.2 4,-2.3 -3,-0.1 5,-0.2 -0.924 4.4-163.3-110.4 106.7 4.1 36.0 -11.1 28 28 A R H > S+ 0 0 156 -2,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.872 84.8 42.5 -68.6 -43.0 0.5 37.0 -11.2 29 29 A N H > S+ 0 0 98 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.822 112.0 56.4 -71.6 -30.0 -1.0 34.2 -13.3 30 30 A E H > S+ 0 0 22 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.929 109.9 45.9 -62.9 -43.9 1.1 31.6 -11.5 31 31 A F H X S+ 0 0 80 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.898 108.8 55.1 -64.9 -40.9 -0.5 32.9 -8.2 32 32 A R H X S+ 0 0 89 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.865 106.6 52.2 -59.8 -34.0 -3.9 32.9 -9.8 33 33 A Y H X S+ 0 0 9 -4,-1.9 4,-2.8 2,-0.2 5,-0.3 0.945 108.7 49.4 -65.2 -49.4 -3.3 29.1 -10.6 34 34 A F H X S+ 0 0 39 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.922 113.6 47.1 -52.2 -46.9 -2.4 28.5 -7.0 35 35 A Q H X S+ 0 0 53 -4,-2.7 4,-1.9 1,-0.2 5,-0.3 0.901 113.6 47.5 -65.9 -41.4 -5.6 30.3 -5.9 36 36 A R H X S+ 0 0 111 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.938 114.9 44.8 -64.1 -48.9 -7.8 28.4 -8.5 37 37 A M H < S+ 0 0 25 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.940 119.1 40.3 -63.9 -45.2 -6.4 24.9 -7.6 38 38 A T H < S+ 0 0 0 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.809 122.7 39.6 -77.9 -27.0 -6.6 25.3 -3.8 39 39 A T H < S+ 0 0 46 -4,-1.9 9,-0.4 -5,-0.2 2,-0.2 0.822 87.1 100.1 -91.9 -34.2 -10.0 27.2 -3.7 40 40 A T < + 0 0 87 -4,-2.1 2,-0.3 -5,-0.3 7,-0.0 -0.372 36.3 157.6 -68.8 122.3 -12.2 25.4 -6.4 41 41 A S - 0 0 37 -2,-0.2 5,-0.1 5,-0.1 7,-0.0 -0.967 25.0-168.3-137.4 127.2 -14.7 22.9 -5.1 42 42 A S + 0 0 125 -2,-0.3 2,-0.7 2,-0.1 -2,-0.0 0.306 61.1 105.7 -91.9 7.8 -17.8 21.9 -7.1 43 43 A V S > S- 0 0 61 3,-0.1 3,-1.7 1,-0.0 2,-0.0 -0.811 75.1-126.8 -91.9 113.1 -19.3 20.0 -4.1 44 44 A E T 3 S+ 0 0 194 -2,-0.7 3,-0.1 1,-0.2 -2,-0.1 -0.336 89.7 18.6 -63.1 135.0 -22.1 22.1 -2.7 45 45 A G T 3 S+ 0 0 61 1,-0.3 2,-0.3 -2,-0.0 -1,-0.2 0.339 107.6 95.2 91.1 -5.7 -21.8 22.8 1.0 46 46 A K < - 0 0 91 -3,-1.7 2,-0.3 -5,-0.1 -1,-0.3 -0.811 50.7-161.6-120.4 158.9 -18.1 22.0 1.3 47 47 A Q E -c 109 0A 87 61,-2.8 63,-2.3 -2,-0.3 2,-0.2 -0.932 27.3-106.9-128.8 156.3 -14.8 23.9 1.2 48 48 A N E - 0 0 0 21,-0.5 23,-2.8 -9,-0.4 2,-0.4 -0.513 28.6-133.4 -81.2 154.8 -11.2 22.9 0.6 49 49 A L E -cd 112 71A 0 62,-2.7 64,-2.8 21,-0.2 2,-0.4 -0.907 12.3-158.8-108.9 130.3 -8.7 22.7 3.5 50 50 A V E -cd 113 72A 0 21,-2.9 23,-2.8 -2,-0.4 2,-0.4 -0.953 7.1-163.3-108.9 132.2 -5.2 24.2 3.2 51 51 A I E +cd 114 73A 0 62,-2.6 64,-2.5 -2,-0.4 65,-0.3 -0.960 19.0 157.4-115.9 132.5 -2.5 22.9 5.6 52 52 A M E - d 0 74A 0 21,-1.9 23,-2.7 -2,-0.4 65,-0.3 -0.988 38.3-104.8-150.5 157.1 0.8 24.8 6.2 53 53 A G E > - d 0 75A 12 63,-2.1 4,-2.1 -2,-0.3 23,-0.1 -0.258 42.2-102.3 -76.8 171.3 3.6 25.3 8.7 54 54 A K H > S+ 0 0 80 21,-0.6 4,-2.4 1,-0.2 5,-0.2 0.887 118.7 51.7 -69.0 -39.9 4.0 28.3 10.9 55 55 A K H > S+ 0 0 182 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.885 109.7 51.0 -63.8 -37.8 6.7 30.1 8.9 56 56 A T H 4 S+ 0 0 33 2,-0.2 4,-0.4 1,-0.2 3,-0.3 0.925 108.5 52.8 -64.0 -42.6 4.6 29.7 5.7 57 57 A W H >< S+ 0 0 0 -4,-2.1 3,-1.7 1,-0.2 -2,-0.2 0.954 110.9 45.4 -54.8 -50.9 1.6 31.2 7.6 58 58 A F H 3< S+ 0 0 32 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.697 103.1 66.7 -71.7 -15.8 3.6 34.3 8.7 59 59 A S T 3< S+ 0 0 60 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.565 84.9 89.4 -75.7 -12.3 5.0 34.6 5.1 60 60 A I S < S- 0 0 23 -3,-1.7 2,-0.1 -4,-0.4 5,-0.1 -0.684 94.3-101.4 -84.1 139.6 1.5 35.4 3.9 61 61 A P >> - 0 0 76 0, 0.0 3,-2.3 0, 0.0 4,-0.6 -0.429 27.7-124.2 -60.4 137.3 0.5 39.2 3.9 62 62 A E G >4 S+ 0 0 118 1,-0.3 3,-1.4 2,-0.2 -2,-0.0 0.862 110.7 55.4 -50.1 -43.8 -1.7 40.0 6.9 63 63 A K G 34 S+ 0 0 191 1,-0.3 -1,-0.3 0, 0.0 -3,-0.0 0.575 109.2 47.8 -69.2 -11.3 -4.5 41.4 4.6 64 64 A N G <4 S+ 0 0 66 -3,-2.3 4,-0.3 3,-0.0 -1,-0.3 0.419 90.1 135.5-105.1 -3.4 -4.6 38.1 2.7 65 65 A R << + 0 0 40 -3,-1.4 2,-0.2 -4,-0.6 21,-0.1 -0.800 57.5 34.7 -96.7 134.6 -4.7 35.9 5.9 66 66 A P S S- 0 0 36 0, 0.0 2,-0.3 0, 0.0 20,-0.1 0.675 102.7-110.8 -71.0 160.8 -6.6 33.6 6.2 67 67 A L > - 0 0 14 -2,-0.2 3,-1.2 1,-0.1 -2,-0.1 -0.474 45.5-114.4 -56.6 119.2 -6.6 32.4 2.6 68 68 A K T 3 S+ 0 0 123 -2,-0.3 -1,-0.1 -4,-0.3 3,-0.1 -0.241 90.0 15.0 -66.6 144.2 -10.2 33.3 1.5 69 69 A G T 3 S+ 0 0 48 1,-0.2 -21,-0.5 -3,-0.1 2,-0.3 0.521 111.0 89.4 75.0 7.8 -12.8 30.7 0.6 70 70 A R S < S- 0 0 6 -3,-1.2 2,-0.5 -23,-0.1 -21,-0.2 -0.954 82.4-113.9-133.7 148.8 -10.6 27.9 2.2 71 71 A I E -d 49 0A 11 -23,-2.8 -21,-2.9 -2,-0.3 2,-0.6 -0.751 36.8-146.1 -82.5 124.0 -10.4 26.4 5.7 72 72 A N E -d 50 0A 0 -2,-0.5 15,-1.8 -23,-0.2 16,-1.6 -0.864 19.3-179.3-103.5 120.3 -6.9 27.4 7.0 73 73 A L E -de 51 88A 0 -23,-2.8 -21,-1.9 -2,-0.6 2,-0.4 -0.955 9.4-158.7-120.0 126.3 -5.1 24.9 9.3 74 74 A V E -de 52 89A 0 14,-2.4 16,-2.1 -2,-0.5 2,-0.5 -0.866 10.2-140.8-104.3 138.2 -1.6 25.7 10.7 75 75 A L E +de 53 90A 23 -23,-2.7 -21,-0.6 -2,-0.4 2,-0.3 -0.826 36.3 148.0 -91.6 131.2 0.8 23.0 12.0 76 76 A S - 0 0 13 14,-1.9 16,-0.0 -2,-0.5 -2,-0.0 -0.920 38.4-160.4-159.7 141.6 2.8 23.9 15.2 77 77 A R S S+ 0 0 211 -2,-0.3 14,-0.1 1,-0.1 -1,-0.1 0.620 97.0 43.8 -87.4 -19.5 4.2 22.0 18.2 78 78 A E S S+ 0 0 167 13,-0.0 -1,-0.1 2,-0.0 13,-0.0 0.781 91.2 86.4-102.2 -34.4 4.4 25.1 20.3 79 79 A L - 0 0 57 1,-0.1 -3,-0.1 12,-0.0 10,-0.0 -0.289 51.6-163.6 -69.5 154.0 1.2 27.1 19.8 80 80 A K S S+ 0 0 103 1,-0.3 -1,-0.1 2,-0.1 9,-0.1 0.568 78.8 25.3-109.2 -19.2 -1.8 26.4 21.9 81 81 A E S S- 0 0 150 7,-0.1 -1,-0.3 1,-0.0 3,-0.1 -0.956 99.2 -83.9-139.5 158.7 -4.3 28.2 19.7 82 82 A P - 0 0 45 0, 0.0 3,-0.1 0, 0.0 7,-0.1 -0.239 55.5 -95.1 -59.9 151.7 -4.3 29.0 16.0 83 83 A P > - 0 0 3 0, 0.0 3,-2.2 0, 0.0 2,-0.1 -0.273 65.4 -68.8 -59.2 156.7 -2.4 32.1 15.0 84 84 A Q T 3 S+ 0 0 153 1,-0.3 3,-0.1 -3,-0.1 -19,-0.0 -0.288 124.7 14.8 -57.7 120.4 -4.7 35.2 14.7 85 85 A G T 3 S+ 0 0 30 1,-0.4 -1,-0.3 -3,-0.1 -13,-0.1 0.098 98.3 114.6 101.7 -21.1 -7.0 34.7 11.7 86 86 A A < - 0 0 15 -3,-2.2 -1,-0.4 1,-0.1 -13,-0.1 -0.447 57.9-145.9 -78.3 158.3 -6.4 31.0 11.2 87 87 A H S S+ 0 0 91 -15,-1.8 2,-0.3 1,-0.2 -14,-0.2 0.813 70.8 15.5 -95.8 -34.7 -9.2 28.5 11.7 88 88 A F E -e 73 0A 31 -16,-1.6 -14,-2.4 -7,-0.1 2,-0.4 -0.953 54.4-155.7-144.1 155.2 -7.5 25.4 13.1 89 89 A L E -e 74 0A 39 -2,-0.3 2,-0.3 -16,-0.2 -14,-0.2 -0.999 14.6-179.8-134.1 134.7 -4.2 24.3 14.7 90 90 A S E -e 75 0A 10 -16,-2.1 -14,-1.9 -2,-0.4 3,-0.1 -0.974 30.8-138.2-136.8 150.9 -2.8 20.7 14.7 91 91 A R S S- 0 0 75 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.1 0.622 86.1 -0.6 -80.7 -15.4 0.4 19.1 16.1 92 92 A S S > S- 0 0 39 1,-0.1 4,-1.9 -16,-0.0 -1,-0.1 -0.967 74.3-100.1-163.6 169.4 1.0 17.0 13.1 93 93 A L H > S+ 0 0 2 -2,-0.3 4,-2.3 2,-0.2 5,-0.2 0.924 120.5 52.2 -65.3 -48.8 -0.3 16.0 9.6 94 94 A D H > S+ 0 0 85 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.899 111.2 48.8 -53.6 -43.8 -1.9 12.8 10.8 95 95 A D H > S+ 0 0 78 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.870 108.7 53.8 -64.2 -40.3 -3.7 14.8 13.5 96 96 A A H X S+ 0 0 0 -4,-1.9 4,-1.1 2,-0.2 -2,-0.2 0.912 109.2 46.8 -60.2 -43.8 -4.9 17.3 11.0 97 97 A L H < S+ 0 0 11 -4,-2.3 4,-0.4 1,-0.2 3,-0.3 0.883 111.2 52.3 -70.1 -35.6 -6.5 14.7 8.7 98 98 A K H >< S+ 0 0 118 -4,-1.8 3,-1.5 -5,-0.2 4,-0.4 0.866 101.5 61.3 -65.2 -36.8 -8.1 13.1 11.7 99 99 A L H >< S+ 0 0 50 -4,-1.9 3,-1.5 1,-0.3 6,-0.5 0.847 94.5 62.6 -57.1 -35.7 -9.5 16.5 12.7 100 100 A T T 3< S+ 0 0 13 -4,-1.1 8,-0.3 -3,-0.3 9,-0.3 0.708 99.7 55.3 -64.5 -20.2 -11.4 16.6 9.4 101 101 A E T < S+ 0 0 130 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.494 89.8 96.2 -89.7 -7.1 -13.4 13.5 10.5 102 102 A Q S X> S- 0 0 99 -3,-1.5 4,-2.1 -4,-0.4 3,-0.6 -0.350 93.1 -94.4 -82.5 167.2 -14.6 15.1 13.8 103 103 A P H 3> S+ 0 0 115 0, 0.0 4,-0.6 0, 0.0 3,-0.2 0.865 117.7 54.8 -52.8 -51.0 -18.0 16.7 14.2 104 104 A E H 34 S+ 0 0 144 1,-0.2 3,-0.1 2,-0.1 -4,-0.1 0.857 125.6 22.7 -53.3 -44.6 -17.1 20.4 13.4 105 105 A L H X> S+ 0 0 8 -3,-0.6 3,-3.0 -6,-0.5 4,-1.0 0.560 94.6 105.8 -97.9 -9.9 -15.5 19.6 10.1 106 106 A A H 3< S+ 0 0 49 -4,-2.1 3,-0.3 1,-0.3 -2,-0.1 0.818 93.3 25.4 -41.7 -56.5 -17.3 16.3 9.4 107 107 A N T 3< S+ 0 0 122 -4,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.075 117.8 68.2 -95.7 26.3 -19.7 17.6 6.7 108 108 A K T <4 S+ 0 0 108 -3,-3.0 -61,-2.8 -8,-0.3 2,-0.4 0.707 71.7 80.7-123.2 -25.9 -17.4 20.5 5.6 109 109 A V E < + c 0 47A 20 -4,-1.0 -61,-0.2 -9,-0.3 3,-0.1 -0.779 34.4 167.7-103.7 130.5 -14.1 19.5 3.8 110 110 A D E + 0 0 60 -63,-2.3 2,-0.2 -2,-0.4 -62,-0.2 0.683 66.2 8.0 -94.5 -95.3 -13.7 18.6 0.2 111 111 A M E - 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