==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 04-NOV-97 1HFR . COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.CODY,N.GALITSKY,J.R.LUFT,W.PANGBORN,R.L.BLAKLEY,A.GANGJEE . 187 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10032.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 63.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 15.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 25 13.4 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 . 3 1.6 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 . 11 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 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 1 1 1 0 0 1 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 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 . 2 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 69 0, 0.0 109,-0.2 0, 0.0 110,-0.2 0.000 360.0 360.0 360.0 -67.0 8.3 21.8 2.0 2 2 A G - 0 0 45 108,-2.6 109,-0.2 107,-0.4 2,-0.1 0.456 360.0 -12.3 -85.0-142.0 9.1 20.7 -1.6 3 3 A S - 0 0 43 128,-0.0 109,-3.6 1,-0.0 2,-0.5 -0.416 50.0-141.6 -68.1 144.3 10.8 17.6 -3.0 4 4 A L E +a 112 0A 26 126,-0.5 128,-1.1 107,-0.2 2,-0.3 -0.955 33.1 164.9-114.2 123.3 12.7 14.8 -1.0 5 5 A N E -ab 113 132A 3 107,-2.0 109,-2.3 -2,-0.5 2,-0.3 -0.948 28.7-146.5-135.9 156.2 15.7 13.5 -2.8 6 6 A C E -ab 114 133A 1 126,-1.6 128,-2.1 -2,-0.3 2,-0.3 -0.837 11.5-164.4-120.7 151.2 18.9 11.5 -2.0 7 7 A I E + b 0 134A 0 107,-1.5 2,-0.3 -2,-0.3 128,-0.2 -0.957 18.5 160.4-141.4 127.3 22.2 12.1 -3.8 8 8 A V E - b 0 135A 2 126,-1.4 128,-2.4 -2,-0.3 2,-0.5 -0.952 32.1-146.1-148.9 149.5 25.1 9.5 -3.6 9 9 A A E - b 0 136A 4 -2,-0.3 2,-0.4 126,-0.2 128,-0.2 -0.994 30.9-179.3-118.0 118.8 28.2 8.6 -5.6 10 10 A V E - b 0 137A 0 126,-2.3 128,-3.0 -2,-0.5 6,-0.2 -0.974 22.0-134.4-132.1 140.9 28.8 4.8 -5.6 11 11 A S E > - b 0 138A 1 4,-1.8 3,-2.3 -2,-0.4 130,-0.2 -0.183 42.8 -92.8 -79.0 169.6 31.4 2.5 -7.0 12 12 A Q T 3 S+ 0 0 132 128,-2.6 129,-0.2 126,-0.5 127,-0.1 0.874 128.3 54.0 -57.7 -30.3 30.6 -0.7 -8.9 13 13 A N T 3 S- 0 0 54 127,-0.5 -1,-0.3 129,-0.1 131,-0.1 0.287 124.6-104.7 -89.9 18.2 30.8 -2.8 -5.7 14 14 A M < + 0 0 50 -3,-2.3 134,-1.9 1,-0.2 2,-0.3 0.674 67.8 158.1 67.8 22.2 28.3 -0.3 -4.1 15 15 A G E +I 147 0B 0 132,-0.2 -4,-1.8 1,-0.1 132,-0.3 -0.591 21.2 168.3 -79.4 134.3 30.9 1.4 -1.9 16 16 A I E + 0 0 25 130,-3.2 2,-0.3 -2,-0.3 131,-0.2 0.584 62.4 9.5-116.8 -14.0 30.4 5.0 -0.6 17 17 A G E -I 146 0B 8 129,-1.6 128,-2.4 5,-0.2 129,-1.4 -0.981 45.3-162.7-160.2 163.9 33.2 5.5 1.9 18 18 A K B > S-J 21 0C 64 3,-3.1 3,-1.8 -2,-0.3 126,-0.0 -0.853 78.5 -19.0-144.9 126.0 36.4 4.2 3.4 19 19 A N T 3 S- 0 0 138 1,-0.3 3,-0.1 -2,-0.3 125,-0.0 0.864 130.6 -43.6 42.1 50.9 38.0 5.3 6.8 20 20 A G T 3 S+ 0 0 32 1,-0.2 -1,-0.3 0, 0.0 2,-0.3 0.578 127.4 70.8 77.0 3.7 36.0 8.4 6.9 21 21 A D B < S-J 18 0C 98 -3,-1.8 -3,-3.1 39,-0.0 -1,-0.2 -0.776 90.3 -70.0-141.6-171.1 36.4 9.5 3.3 22 22 A L - 0 0 25 -2,-0.3 -5,-0.2 -5,-0.3 -6,-0.1 -0.572 39.7-128.3 -76.5 147.9 35.5 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 0.614 87.6 56.8 -75.8 -12.7 37.0 5.4 -1.7 24 24 A W S S- 0 0 16 1,-0.2 -2,-0.2 118,-0.1 3,-0.1 -0.675 97.8 -87.7-115.9 167.5 38.4 7.2 -4.8 25 25 A P - 0 0 55 0, 0.0 -1,-0.2 0, 0.0 2,-0.0 -0.247 69.8 -73.5 -63.4 161.4 40.7 10.1 -5.4 26 26 A P - 0 0 83 0, 0.0 2,-0.6 0, 0.0 0, 0.0 -0.293 41.0-154.6 -67.2 141.2 38.8 13.4 -5.5 27 27 A L >> - 0 0 2 1,-0.1 4,-1.6 -3,-0.1 3,-0.8 -0.921 3.8-164.3-122.3 93.9 36.7 14.1 -8.6 28 28 A R H 3> S+ 0 0 127 -2,-0.6 4,-1.3 1,-0.3 -1,-0.1 0.671 87.4 42.9 -54.9 -32.4 36.3 17.8 -8.9 29 29 A N H 3> S+ 0 0 52 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.614 108.6 59.1 -95.6 -9.6 33.4 17.9 -11.4 30 30 A E H <> S+ 0 0 3 -3,-0.8 4,-2.1 2,-0.2 -2,-0.2 0.858 109.8 45.4 -76.2 -30.1 31.7 15.2 -9.4 31 31 A F H X S+ 0 0 53 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.862 109.5 54.4 -77.9 -39.1 31.8 17.7 -6.5 32 32 A R H X S+ 0 0 116 -4,-1.3 4,-1.7 2,-0.2 -1,-0.2 0.783 108.4 47.9 -63.7 -40.6 30.7 20.5 -8.6 33 33 A Y H X S+ 0 0 8 -4,-0.9 4,-2.5 2,-0.2 5,-0.3 0.916 109.8 53.4 -68.2 -48.8 27.6 18.5 -9.7 34 34 A F H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 5,-0.2 0.921 113.7 43.7 -52.2 -44.7 26.9 17.6 -6.0 35 35 A Q H X S+ 0 0 80 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.856 113.2 49.0 -75.5 -36.3 27.0 21.3 -5.1 36 36 A R H X S+ 0 0 99 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.975 115.0 45.8 -69.7 -50.8 24.9 22.6 -8.1 37 37 A M H < S+ 0 0 25 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.909 119.2 39.5 -58.1 -51.4 22.2 19.9 -7.5 38 38 A T H < S+ 0 0 0 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.777 119.2 45.6 -72.2 -33.8 21.9 20.6 -3.6 39 39 A T H < S+ 0 0 44 -4,-1.7 2,-0.5 -5,-0.2 9,-0.4 0.861 88.4 92.8 -83.2 -36.8 22.3 24.3 -3.8 40 40 A T < - 0 0 86 -4,-2.4 2,-0.3 -5,-0.2 71,-0.1 -0.404 60.0-158.1 -67.0 118.5 19.9 25.3 -6.6 41 41 A S - 0 0 34 -2,-0.5 4,-0.1 5,-0.2 -2,-0.0 -0.691 14.8-144.6 -92.7 143.6 16.4 26.1 -5.4 42 42 A S S S+ 0 0 81 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.462 84.1 47.9 -82.1 -2.9 13.4 25.9 -7.7 43 43 A V S > S- 0 0 62 3,-0.0 3,-1.2 0, 0.0 -1,-0.1 -0.979 91.7-103.1-136.6 130.1 11.6 29.0 -6.2 44 44 A E T 3 S+ 0 0 187 -2,-0.3 3,-0.1 1,-0.3 -2,-0.1 -0.144 102.4 21.3 -64.7 143.1 12.9 32.5 -5.3 45 45 A G T 3 S+ 0 0 81 1,-0.3 2,-0.3 -4,-0.1 -1,-0.3 0.578 104.5 109.9 77.7 12.1 13.7 33.5 -1.8 46 46 A K < - 0 0 69 -3,-1.2 -1,-0.3 63,-0.0 2,-0.3 -0.725 49.7-157.9-115.5 162.1 14.0 29.8 -0.8 47 47 A Q E -c 109 0A 73 61,-2.1 63,-2.0 -2,-0.3 2,-0.3 -0.944 21.5-112.8-134.2 155.3 16.9 27.5 0.1 48 48 A N E - 0 0 0 21,-0.5 23,-2.1 -9,-0.4 2,-0.4 -0.683 23.6-139.4 -89.7 145.3 17.5 23.8 0.0 49 49 A L E -cd 112 71A 0 62,-2.1 64,-2.9 -2,-0.3 2,-0.5 -0.852 13.1-157.6 -96.2 135.6 17.9 21.8 3.3 50 50 A V E -cd 113 72A 0 21,-3.1 23,-2.6 -2,-0.4 2,-0.4 -0.990 4.9-162.3-121.5 124.7 20.7 19.1 3.4 51 51 A I E +cd 114 73A 0 62,-2.0 64,-2.4 -2,-0.5 65,-0.3 -0.892 18.4 162.2-104.9 124.6 20.3 16.3 6.0 52 52 A M E - d 0 74A 0 21,-2.1 23,-2.5 -2,-0.4 65,-0.3 -0.982 35.8-110.2-139.8 166.6 23.3 14.2 6.9 53 53 A G E >> - d 0 75A 12 63,-1.8 4,-2.2 -2,-0.3 3,-0.5 -0.240 45.1 -95.4 -91.8 168.2 24.5 11.8 9.7 54 54 A K H 3> S+ 0 0 63 21,-1.1 4,-1.6 1,-0.2 5,-0.1 0.834 122.4 47.8 -53.0 -47.0 27.2 12.7 12.1 55 55 A K H 3> S+ 0 0 130 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.737 108.0 56.7 -73.1 -19.7 30.1 11.0 10.1 56 56 A T H X4 S+ 0 0 19 -3,-0.5 3,-0.8 2,-0.2 4,-0.5 0.965 107.3 49.1 -68.9 -49.7 29.0 12.5 6.9 57 57 A W H >< S+ 0 0 0 -4,-2.2 3,-1.5 1,-0.3 -2,-0.2 0.933 112.1 46.2 -51.6 -53.4 29.3 15.9 8.4 58 58 A F H 3< S+ 0 0 107 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.750 101.8 67.6 -67.5 -17.9 32.8 15.2 9.8 59 59 A S T << S+ 0 0 24 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.568 83.9 89.0 -75.9 -11.5 33.9 13.7 6.5 60 60 A I S < S- 0 0 2 -3,-1.5 5,-0.1 -4,-0.5 -39,-0.0 -0.811 97.2 -99.7 -92.1 134.1 33.6 17.3 4.9 61 61 A P > - 0 0 67 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.214 31.9-121.3 -51.4 139.4 36.7 19.3 5.0 62 62 A E G > S+ 0 0 140 1,-0.3 3,-1.3 2,-0.2 -2,-0.0 0.778 109.3 62.3 -55.6 -27.1 36.3 21.8 8.0 63 63 A K G 3 S+ 0 0 172 1,-0.3 -1,-0.3 0, 0.0 -3,-0.0 0.716 103.1 46.6 -79.7 -15.6 36.8 24.7 5.6 64 64 A N G < S+ 0 0 40 -3,-1.7 -1,-0.3 3,-0.1 4,-0.2 0.081 91.2 140.8-105.1 21.8 33.7 23.9 3.5 65 65 A R < + 0 0 48 -3,-1.3 2,-0.1 2,-0.1 21,-0.1 -0.963 58.3 33.9-115.0 129.5 31.6 23.4 6.6 66 66 A P S S- 0 0 43 0, 0.0 2,-0.1 0, 0.0 20,-0.1 0.575 103.1-115.4 -67.2 158.3 28.7 24.3 6.8 67 67 A L > - 0 0 2 -2,-0.1 3,-1.3 1,-0.1 2,-0.2 -0.358 44.8-114.8 -62.8 124.8 27.9 23.6 3.0 68 68 A K T 3 S+ 0 0 150 1,-0.2 -1,-0.1 -4,-0.2 3,-0.1 -0.430 88.8 16.2 -79.6 136.2 27.2 27.2 1.8 69 69 A G T 3 S+ 0 0 37 1,-0.3 -21,-0.5 -2,-0.2 2,-0.3 0.493 109.3 94.9 88.4 7.8 23.9 28.4 0.6 70 70 A R S < S- 0 0 6 -3,-1.3 2,-0.5 -23,-0.1 -1,-0.3 -0.858 80.8-116.8-125.4 156.5 22.3 25.4 2.1 71 71 A I E -d 49 0A 14 -23,-2.1 -21,-3.1 -2,-0.3 2,-0.5 -0.858 37.7-147.3 -92.6 120.3 20.5 24.8 5.5 72 72 A N E -d 50 0A 0 -2,-0.5 15,-1.9 -23,-0.2 16,-1.1 -0.969 19.1-178.4-101.9 117.4 22.7 22.1 7.2 73 73 A L E -de 51 88A 0 -23,-2.6 -21,-2.1 -2,-0.5 2,-0.3 -0.986 10.9-155.6-115.4 134.3 21.1 19.6 9.4 74 74 A V E -de 52 89A 0 14,-2.7 16,-1.9 -2,-0.4 2,-0.6 -0.670 10.3-141.5-106.2 137.7 23.0 16.9 11.3 75 75 A L E +de 53 90A 19 -23,-2.5 -21,-1.1 -2,-0.3 2,-0.3 -0.909 39.9 141.4 -99.7 124.2 21.3 13.6 12.4 76 76 A S - 0 0 13 14,-3.0 16,-0.0 -2,-0.6 -2,-0.0 -0.945 40.4-171.8-163.1 145.3 22.4 12.4 15.7 77 77 A R S S+ 0 0 170 -2,-0.3 14,-0.1 1,-0.0 -1,-0.1 0.575 94.2 48.8-105.4 -10.7 21.2 10.7 19.0 78 78 A E S S+ 0 0 168 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.724 92.2 84.9 -97.2 -35.9 24.4 11.1 20.9 79 79 A L - 0 0 47 1,-0.1 -3,-0.1 -4,-0.0 -25,-0.0 -0.471 58.1-159.9 -72.4 145.5 25.1 14.8 20.3 80 80 A K S S+ 0 0 203 1,-0.2 -1,-0.1 -2,-0.1 9,-0.1 0.689 77.9 17.6 -95.5 -34.8 23.5 17.4 22.6 81 81 A E S S- 0 0 148 7,-0.1 -1,-0.2 3,-0.0 3,-0.1 -0.923 98.1 -83.0-135.8 157.6 23.9 20.4 20.3 82 82 A P - 0 0 42 0, 0.0 7,-0.1 0, 0.0 3,-0.1 -0.325 58.2-102.6 -53.9 144.1 24.6 20.7 16.5 83 83 A P > - 0 0 17 0, 0.0 3,-1.7 0, 0.0 -9,-0.1 -0.229 56.9 -68.3 -65.5 162.4 28.4 20.5 15.9 84 84 A Q T 3 S+ 0 0 177 1,-0.3 3,-0.1 -3,-0.1 -3,-0.0 -0.362 127.1 20.6 -52.0 130.0 30.3 23.8 15.3 85 85 A G T 3 S+ 0 0 33 1,-0.3 -1,-0.3 -3,-0.1 -13,-0.2 -0.209 98.7 114.9 96.1 -32.0 29.1 25.2 11.8 86 86 A A < - 0 0 16 -3,-1.7 -1,-0.3 1,-0.1 -13,-0.1 -0.272 52.2-157.5 -72.2 152.6 25.8 23.1 11.7 87 87 A H S S+ 0 0 91 -15,-1.9 2,-0.3 1,-0.3 -14,-0.2 0.870 70.4 18.7-101.9 -31.9 22.5 24.8 11.8 88 88 A F E -e 73 0A 59 -16,-1.1 -14,-2.7 -7,-0.1 2,-0.3 -0.936 53.4-162.5-141.5 154.2 20.2 22.0 13.1 89 89 A L E +e 74 0A 37 -2,-0.3 2,-0.3 -16,-0.2 -14,-0.2 -0.975 13.9 176.1-137.8 135.6 20.4 18.7 14.9 90 90 A S E -e 75 0A 10 -16,-1.9 -14,-3.0 -2,-0.3 3,-0.0 -0.946 30.8-138.1-139.9 156.2 17.6 16.1 15.0 91 91 A R S S+ 0 0 144 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.1 0.218 85.4 11.6 -94.0 -3.4 17.5 12.6 16.5 92 92 A S S > S- 0 0 27 1,-0.1 4,-1.0 -16,-0.0 -16,-0.1 -0.949 77.0-105.9-164.6 163.1 15.7 11.0 13.6 93 93 A L H > S+ 0 0 1 -2,-0.3 4,-1.8 2,-0.2 5,-0.3 0.869 117.2 54.4 -68.8 -32.9 14.7 11.6 10.0 94 94 A D H > S+ 0 0 81 1,-0.2 4,-4.6 2,-0.2 5,-0.2 0.943 107.4 50.3 -68.2 -44.4 11.0 12.1 10.9 95 95 A D H > S+ 0 0 69 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.764 109.6 53.4 -58.5 -29.5 11.9 14.8 13.4 96 96 A A H < S+ 0 0 1 -4,-1.0 -1,-0.2 2,-0.2 4,-0.2 0.915 115.9 35.8 -72.1 -40.1 14.0 16.4 10.6 97 97 A L H >X S+ 0 0 26 -4,-1.8 3,-1.3 1,-0.2 4,-0.7 0.830 110.9 62.4 -78.8 -40.8 11.0 16.5 8.2 98 98 A K H >< S+ 0 0 121 -4,-4.6 3,-0.7 -5,-0.3 -1,-0.2 0.884 101.8 54.7 -56.5 -32.7 8.7 17.3 11.1 99 99 A L G >< S+ 0 0 22 -4,-1.1 3,-1.0 1,-0.2 6,-0.7 0.613 94.0 67.7 -71.9 -20.0 10.8 20.6 11.5 100 100 A T G <4 S+ 0 0 5 -3,-1.3 -1,-0.2 1,-0.3 9,-0.2 0.789 98.2 52.2 -69.6 -31.6 10.3 21.6 7.9 101 101 A E G << S+ 0 0 142 -3,-0.7 -1,-0.3 -4,-0.7 -2,-0.1 -0.087 85.4 104.6 -92.3 14.8 6.6 22.2 8.6 102 102 A Q S <> S- 0 0 82 -3,-1.0 4,-2.7 1,-0.1 3,-0.4 -0.887 86.4-119.8 -98.0 133.2 7.4 24.4 11.6 103 103 A P H > S+ 0 0 100 0, 0.0 4,-0.7 0, 0.0 -1,-0.1 0.817 110.2 77.0 -45.6 -30.7 6.8 28.0 10.7 104 104 A E H 4 S+ 0 0 114 1,-0.2 3,-0.3 2,-0.1 -4,-0.1 0.931 120.6 1.9 -39.1 -74.5 10.5 28.4 11.6 105 105 A L H >> S+ 0 0 8 -6,-0.7 3,-2.6 -3,-0.4 4,-1.4 0.634 105.6 98.8 -88.8 -23.4 11.5 26.8 8.2 106 106 A A H 3< S+ 0 0 32 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.1 0.732 93.1 37.3 -41.9 -39.4 8.2 26.2 6.5 107 107 A N T 3< S+ 0 0 102 -4,-0.7 -1,-0.3 -3,-0.3 -2,-0.1 0.309 117.3 56.5 -98.4 6.4 8.4 29.3 4.3 108 108 A K T <4 S+ 0 0 92 -3,-2.6 -61,-2.1 -8,-0.2 2,-0.5 0.746 87.0 69.5-103.7 -33.5 12.2 29.0 3.8 109 109 A V E < + c 0 47A 0 -4,-1.4 -107,-0.4 -63,-0.2 -61,-0.2 -0.861 41.7 178.5 -97.8 125.2 13.1 25.6 2.3 110 110 A D E + 0 0 8 -63,-2.0 -108,-2.6 -2,-0.5 2,-0.2 0.853 69.6 12.7 -81.6 -84.5 12.4 24.5 -1.3 111 111 A M E - 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