==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 09-JAN-09 3FS6 . COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.CODY,J.PACE,J.MAKIN,J.PIRAINO,S.F.QUEENER,A.ROSOWSKY . 186 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10301.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 120 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 15.1 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 . 18 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 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 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 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 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 0.000 360.0 360.0 360.0 137.9 14.8 30.8 2.1 2 2 A G - 0 0 35 108,-2.4 109,-0.1 1,-0.2 108,-0.0 0.251 360.0 -25.6 -86.7-148.9 13.0 30.6 -1.2 3 3 A S - 0 0 54 1,-0.1 109,-3.0 108,-0.1 2,-0.4 -0.125 50.5-130.6 -70.2 156.7 9.4 31.2 -2.3 4 4 A L E +a 112 0A 29 126,-0.4 128,-1.6 107,-0.2 2,-0.3 -0.921 36.2 167.9-107.6 133.6 6.3 30.9 -0.3 5 5 A N E -ab 113 132A 2 107,-2.1 109,-3.1 -2,-0.4 2,-0.4 -0.973 29.1-146.3-145.7 151.2 3.5 28.8 -1.8 6 6 A C E -ab 114 133A 1 126,-2.4 128,-3.2 -2,-0.3 2,-0.4 -0.937 15.4-165.4-114.1 149.3 0.2 27.2 -1.0 7 7 A I E + b 0 134A 4 107,-2.2 2,-0.3 -2,-0.4 128,-0.2 -0.997 19.2 152.0-136.3 132.1 -0.9 23.9 -2.6 8 8 A V E - b 0 135A 11 126,-2.4 128,-2.5 -2,-0.4 2,-0.4 -0.979 37.0-140.5-150.9 154.3 -4.5 22.6 -2.6 9 9 A A E - b 0 136A 14 -2,-0.3 2,-0.4 126,-0.2 128,-0.2 -0.992 33.5-177.9-115.1 132.6 -7.0 20.4 -4.4 10 10 A V E - b 0 137A 0 126,-3.0 128,-3.2 -2,-0.4 6,-0.2 -0.988 21.5-130.8-136.7 141.3 -10.5 21.9 -4.4 11 11 A S E > - b 0 138A 2 4,-2.2 3,-2.2 -2,-0.4 130,-0.2 -0.281 40.2 -97.1 -81.0 172.7 -13.9 20.9 -5.7 12 12 A Q T 3 S+ 0 0 136 128,-2.4 129,-0.2 126,-0.6 127,-0.1 0.836 127.6 53.3 -60.2 -33.6 -16.2 23.2 -7.6 13 13 A N T 3 S- 0 0 56 127,-0.4 -1,-0.3 129,-0.1 128,-0.1 0.128 124.9-105.0 -87.6 20.2 -18.1 24.0 -4.4 14 14 A M < + 0 0 48 -3,-2.2 134,-2.8 1,-0.2 2,-0.2 0.610 67.6 156.3 70.7 16.6 -14.7 25.0 -2.8 15 15 A G E +I 147 0B 0 132,-0.2 -4,-2.2 127,-0.1 132,-0.3 -0.517 20.0 165.9 -78.7 140.6 -14.5 21.8 -0.7 16 16 A I E + 0 0 19 130,-2.9 2,-0.3 1,-0.3 131,-0.2 0.454 64.2 13.9-125.2 -11.7 -11.1 20.6 0.5 17 17 A G E -I 146 0B 7 129,-1.5 128,-2.7 5,-0.2 129,-1.3 -0.995 45.7-166.7-160.0 158.0 -12.1 18.0 3.2 18 18 A K B > S-J 21 0C 59 3,-2.8 3,-1.7 -2,-0.3 126,-0.0 -0.894 81.9 -16.3-148.8 122.4 -14.9 15.9 4.7 19 19 A N T 3 S- 0 0 131 -2,-0.3 3,-0.1 1,-0.3 125,-0.0 0.857 128.5 -51.0 56.1 37.0 -14.6 14.1 8.0 20 20 A G T 3 S+ 0 0 31 1,-0.3 -1,-0.3 0, 0.0 2,-0.3 0.606 125.7 80.4 79.2 11.5 -10.8 14.4 8.0 21 21 A D B < S-J 18 0C 111 -3,-1.7 -3,-2.8 39,-0.0 -1,-0.3 -0.807 91.8 -75.4-134.3 176.4 -10.3 13.1 4.5 22 22 A L - 0 0 60 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.1 -0.494 36.8-128.9 -73.6 146.9 -10.5 14.3 1.0 23 23 A P S S+ 0 0 13 0, 0.0 120,-0.2 0, 0.0 -1,-0.1 0.703 89.4 55.7 -68.2 -22.0 -14.1 14.7 -0.4 24 24 A W S S- 0 0 14 1,-0.1 3,-0.1 118,-0.1 -2,-0.1 -0.725 97.8 -90.7-109.3 159.0 -13.4 12.7 -3.6 25 25 A P - 0 0 57 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.238 67.2 -67.1 -63.5 158.8 -12.0 9.2 -4.1 26 26 A P - 0 0 68 0, 0.0 2,-0.6 0, 0.0 0, 0.0 -0.216 42.9-161.0 -53.9 132.0 -8.2 8.9 -4.4 27 27 A L > - 0 0 3 1,-0.2 4,-2.3 -3,-0.1 3,-0.4 -0.904 5.5-165.3-116.4 96.6 -6.7 10.4 -7.5 28 28 A R H > S+ 0 0 165 -2,-0.6 4,-1.9 1,-0.3 -1,-0.2 0.856 84.6 44.4 -58.3 -44.1 -3.3 8.7 -7.8 29 29 A N H > S+ 0 0 78 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.812 110.0 56.5 -72.1 -28.1 -1.7 11.1 -10.3 30 30 A E H > S+ 0 0 10 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.924 108.5 47.7 -67.5 -43.0 -3.0 14.1 -8.5 31 31 A F H X S+ 0 0 95 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.890 109.0 54.3 -59.8 -41.9 -1.2 12.9 -5.3 32 32 A R H X S+ 0 0 153 -4,-1.9 4,-2.8 -5,-0.2 -2,-0.2 0.879 106.8 51.8 -59.7 -38.9 1.9 12.3 -7.4 33 33 A Y H X S+ 0 0 5 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.938 109.4 49.0 -61.2 -48.8 1.7 16.0 -8.5 34 34 A F H X S+ 0 0 50 -4,-2.2 4,-2.4 2,-0.2 5,-0.3 0.932 112.9 48.3 -55.2 -46.9 1.4 17.1 -4.9 35 35 A Q H X S+ 0 0 78 -4,-2.6 4,-1.9 1,-0.2 5,-0.3 0.938 113.8 46.1 -60.2 -49.8 4.5 15.0 -4.0 36 36 A R H X S+ 0 0 100 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.919 114.6 46.0 -61.0 -46.6 6.5 16.3 -7.0 37 37 A M H < S+ 0 0 20 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.917 117.2 41.7 -67.6 -43.5 5.7 19.9 -6.5 38 38 A T H < S+ 0 0 0 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.776 120.0 43.5 -75.5 -26.4 6.3 20.0 -2.7 39 39 A T H < S+ 0 0 45 -4,-1.9 9,-0.4 -5,-0.3 2,-0.4 0.848 87.2 94.6 -86.2 -37.5 9.4 17.8 -2.8 40 40 A T < - 0 0 87 -4,-2.2 2,-0.4 -5,-0.3 71,-0.1 -0.413 59.3-162.5 -70.7 115.8 11.3 19.3 -5.8 41 41 A S - 0 0 36 -2,-0.4 -1,-0.1 5,-0.1 5,-0.0 -0.837 18.6-152.2-102.8 136.1 13.8 21.9 -4.6 42 42 A S S S+ 0 0 97 -2,-0.4 2,-0.4 2,-0.1 -1,-0.1 0.579 78.1 69.8 -77.4 -10.2 15.4 24.4 -6.9 43 43 A V S > S- 0 0 56 3,-0.1 3,-1.4 0, 0.0 2,-0.1 -0.930 82.7-118.7-123.2 128.5 18.6 24.7 -4.8 44 44 A E T 3 S+ 0 0 182 -2,-0.4 3,-0.1 1,-0.2 -2,-0.1 -0.364 97.4 17.3 -61.7 135.1 21.4 22.1 -4.1 45 45 A G T 3 S+ 0 0 64 1,-0.3 2,-0.3 -2,-0.1 -1,-0.2 0.530 107.8 98.0 81.9 8.0 21.8 21.0 -0.5 46 46 A K < - 0 0 64 -3,-1.4 2,-0.3 -5,-0.0 -1,-0.3 -0.840 54.8-151.9-123.7 159.3 18.4 22.2 0.6 47 47 A Q E -c 109 0A 83 61,-2.6 63,-2.2 -2,-0.3 2,-0.2 -0.912 27.1-108.8-119.7 156.7 14.9 20.7 1.2 48 48 A N E - 0 0 0 21,-0.5 23,-2.6 -9,-0.4 2,-0.4 -0.495 29.3-131.3 -75.2 153.0 11.5 22.3 0.9 49 49 A L E -cd 112 71A 0 62,-2.7 64,-3.0 21,-0.2 2,-0.5 -0.927 12.9-155.4-106.0 133.3 9.5 22.9 4.1 50 50 A V E -cd 113 72A 0 21,-3.3 23,-2.9 -2,-0.4 2,-0.5 -0.939 7.9-164.3-108.0 130.4 5.9 21.9 4.4 51 51 A I E +cd 114 73A 0 62,-2.7 64,-2.7 -2,-0.5 65,-0.4 -0.956 18.5 159.4-113.5 132.4 3.8 23.8 6.9 52 52 A M E - d 0 74A 0 21,-2.0 23,-2.6 -2,-0.5 65,-0.3 -0.996 37.9-106.4-150.3 153.1 0.4 22.4 8.1 53 53 A G E > - d 0 75A 11 63,-2.2 4,-2.4 -2,-0.3 23,-0.1 -0.228 42.3-102.4 -67.7 167.5 -2.2 22.6 10.8 54 54 A K H > S+ 0 0 67 21,-1.1 4,-2.2 1,-0.2 5,-0.2 0.901 120.7 49.2 -63.3 -44.7 -2.6 19.9 13.4 55 55 A K H > S+ 0 0 122 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.911 110.4 52.5 -64.6 -39.2 -5.7 18.3 11.8 56 56 A T H >> S+ 0 0 27 2,-0.2 4,-0.7 1,-0.2 3,-0.5 0.932 107.2 52.2 -60.3 -47.2 -4.0 18.3 8.4 57 57 A W H >< S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.949 111.5 45.8 -51.0 -53.7 -1.0 16.5 9.9 58 58 A F H 3< S+ 0 0 108 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.656 103.1 65.6 -71.4 -13.2 -3.2 13.8 11.4 59 59 A S H << S+ 0 0 53 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.654 83.4 89.3 -77.4 -16.5 -5.2 13.5 8.1 60 60 A I S << S- 0 0 22 -3,-1.4 5,-0.1 -4,-0.7 -39,-0.0 -0.689 94.9-105.8 -82.3 130.3 -2.1 12.1 6.4 61 61 A P > - 0 0 74 0, 0.0 3,-2.2 0, 0.0 4,-0.3 -0.289 27.6-119.7 -52.8 140.2 -1.9 8.3 6.6 62 62 A E G > S+ 0 0 134 1,-0.3 3,-1.4 2,-0.2 -2,-0.1 0.829 113.2 61.0 -52.3 -36.5 0.8 7.4 9.2 63 63 A K G 3 S+ 0 0 184 1,-0.3 -1,-0.3 0, 0.0 -3,-0.0 0.699 107.4 45.2 -65.9 -18.3 2.7 5.5 6.4 64 64 A N G < S+ 0 0 74 -3,-2.2 -1,-0.3 3,-0.1 4,-0.2 0.318 93.0 134.2-105.3 5.0 3.1 8.8 4.5 65 65 A R < + 0 0 49 -3,-1.4 2,-0.2 -4,-0.3 21,-0.1 -0.896 60.6 29.3-108.1 132.1 4.1 10.8 7.6 66 66 A P S S- 0 0 43 0, 0.0 2,-0.4 0, 0.0 20,-0.1 0.688 102.3-112.7 -70.2 159.7 6.4 12.8 7.7 67 67 A L > - 0 0 15 -2,-0.2 3,-1.3 1,-0.1 -2,-0.1 -0.516 45.7-114.5 -59.8 117.1 6.2 13.7 4.0 68 68 A K T 3 S+ 0 0 150 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 -0.223 89.8 15.0 -65.3 144.2 9.4 12.2 2.9 69 69 A G T 3 S+ 0 0 39 1,-0.2 -21,-0.5 -3,-0.0 2,-0.3 0.567 110.9 90.4 74.3 8.7 12.3 14.4 1.6 70 70 A R S < S- 0 0 9 -3,-1.3 2,-0.4 -23,-0.1 -21,-0.2 -0.961 82.7-112.6-131.3 149.7 10.7 17.5 3.1 71 71 A I E -d 49 0A 19 -23,-2.6 -21,-3.3 -2,-0.3 2,-0.6 -0.728 36.1-146.0 -81.7 129.0 11.0 19.2 6.4 72 72 A N E -d 50 0A 0 -2,-0.4 15,-2.0 -23,-0.2 16,-1.7 -0.899 19.2-179.5-108.8 117.6 7.6 18.8 8.2 73 73 A L E -de 51 88A 0 -23,-2.9 -21,-2.0 -2,-0.6 2,-0.4 -0.961 9.6-158.1-119.2 129.9 6.4 21.6 10.5 74 74 A V E -de 52 89A 0 14,-2.6 16,-2.1 -2,-0.4 2,-0.5 -0.868 9.4-140.4-110.1 136.5 3.0 21.5 12.3 75 75 A L E +de 53 90A 22 -23,-2.6 -21,-1.1 -2,-0.4 2,-0.3 -0.866 40.1 135.8 -96.6 126.7 1.1 24.4 13.7 76 76 A S - 0 0 15 14,-2.2 16,-0.1 -2,-0.5 -2,-0.1 -0.919 40.3-165.9-165.5 142.8 -0.6 24.1 17.1 77 77 A R S S+ 0 0 188 -2,-0.3 14,-0.1 14,-0.1 -1,-0.1 0.561 96.6 53.6 -99.7 -17.1 -1.1 26.0 20.3 78 78 A E S S+ 0 0 156 2,-0.0 -2,-0.1 13,-0.0 13,-0.0 0.877 91.5 81.8 -81.7 -43.7 -2.3 22.9 22.2 79 79 A L - 0 0 53 1,-0.1 -3,-0.1 -4,-0.0 -25,-0.0 -0.353 60.0-160.3 -66.5 144.8 0.6 20.6 21.4 80 80 A K S S+ 0 0 201 1,-0.2 -1,-0.1 2,-0.1 9,-0.1 0.549 76.4 12.7-100.1 -14.8 3.7 21.0 23.6 81 81 A E S S- 0 0 140 7,-0.1 -1,-0.2 9,-0.0 3,-0.1 -0.965 98.4 -72.1-152.9 162.8 6.1 19.3 21.1 82 82 A P - 0 0 43 0, 0.0 3,-0.1 0, 0.0 7,-0.1 -0.296 59.7-103.5 -57.8 141.7 6.0 18.1 17.5 83 83 A P > - 0 0 14 0, 0.0 3,-2.4 0, 0.0 -9,-0.0 -0.239 55.1 -69.4 -58.1 157.6 3.8 15.1 16.9 84 84 A Q T 3 S+ 0 0 163 1,-0.3 3,-0.1 -3,-0.1 -19,-0.0 -0.275 126.6 14.7 -47.1 124.4 5.5 11.7 16.4 85 85 A G T 3 S+ 0 0 37 1,-0.3 -1,-0.3 -3,-0.1 -13,-0.1 0.095 101.7 113.2 92.8 -22.1 7.3 11.8 13.1 86 86 A A < - 0 0 16 -3,-2.4 -1,-0.3 1,-0.1 -13,-0.1 -0.439 54.5-152.2 -81.5 159.2 7.1 15.6 12.7 87 87 A H + 0 0 86 -15,-2.0 2,-0.3 1,-0.2 -14,-0.2 0.798 69.2 19.3-100.5 -36.8 10.2 17.8 12.8 88 88 A F E -e 73 0A 47 -16,-1.7 -14,-2.6 -7,-0.1 2,-0.4 -0.956 54.0-158.1-139.1 156.1 9.0 21.2 14.0 89 89 A L E +e 74 0A 40 -2,-0.3 2,-0.3 -16,-0.2 -14,-0.2 -0.999 13.3 178.0-133.3 132.3 6.2 22.8 15.9 90 90 A S E -e 75 0A 11 -16,-2.1 -14,-2.2 -2,-0.4 3,-0.1 -0.972 29.5-139.8-133.2 155.1 5.1 26.5 15.8 91 91 A R S S+ 0 0 136 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.1 0.334 86.0 11.7 -96.0 3.1 2.2 28.3 17.5 92 92 A S S > S- 0 0 14 1,-0.1 4,-2.1 -16,-0.1 5,-0.1 -0.950 74.5-110.6-166.8 161.1 1.4 30.6 14.5 93 93 A L H > S+ 0 0 11 -2,-0.3 4,-2.8 2,-0.2 5,-0.2 0.912 119.7 54.3 -62.4 -43.4 2.2 30.9 10.8 94 94 A D H > S+ 0 0 73 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.910 108.8 49.0 -56.5 -43.5 4.2 34.1 11.6 95 95 A D H > S+ 0 0 57 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.899 110.6 50.5 -62.7 -42.8 6.3 32.1 14.1 96 96 A A H X S+ 0 0 0 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.926 111.8 46.8 -61.1 -46.3 6.9 29.3 11.6 97 97 A L H < S+ 0 0 34 -4,-2.8 4,-0.3 1,-0.2 -2,-0.2 0.868 112.8 49.4 -66.0 -36.9 8.0 31.8 8.9 98 98 A K H >< S+ 0 0 119 -4,-2.3 3,-1.3 -5,-0.2 4,-0.4 0.855 105.4 59.4 -65.8 -36.2 10.3 33.6 11.4 99 99 A L H >< S+ 0 0 29 -4,-2.1 3,-1.4 1,-0.3 6,-0.3 0.841 94.3 62.9 -61.4 -36.3 11.7 30.2 12.4 100 100 A T T 3< S+ 0 0 2 -4,-1.3 -1,-0.3 1,-0.3 9,-0.2 0.657 100.0 56.0 -66.8 -13.8 12.9 29.5 8.9 101 101 A E T < S+ 0 0 128 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.619 86.4 102.1 -89.7 -17.2 15.2 32.6 9.4 102 102 A Q S X> S- 0 0 92 -3,-1.4 4,-2.9 -4,-0.4 3,-2.3 -0.330 89.7-107.1 -68.2 151.2 16.8 31.1 12.5 103 103 A P T 34 S+ 0 0 106 0, 0.0 4,-0.4 0, 0.0 -1,-0.1 0.731 116.7 63.5 -52.2 -28.3 20.3 29.5 12.1 104 104 A E T 34 S+ 0 0 104 1,-0.2 -4,-0.1 -5,-0.1 -5,-0.0 0.722 124.3 12.7 -68.9 -22.8 18.9 26.0 12.5 105 105 A L T X> S+ 0 0 2 -3,-2.3 4,-1.8 -6,-0.3 3,-1.8 0.576 98.8 94.6-128.0 -19.9 16.8 26.4 9.2 106 106 A A T 3< S+ 0 0 37 -4,-2.9 -2,-0.1 1,-0.3 -6,-0.1 0.771 100.3 31.8 -50.1 -36.7 18.1 29.5 7.4 107 107 A N T 34 S+ 0 0 98 -4,-0.4 -1,-0.3 -5,-0.2 -2,-0.1 0.359 117.7 56.9-103.7 2.2 20.5 27.5 5.2 108 108 A K T <4 S+ 0 0 101 -3,-1.8 -61,-2.6 -8,-0.2 2,-0.5 0.691 90.2 75.4-105.1 -25.6 18.4 24.3 5.0 109 109 A V E < + c 0 47A 0 -4,-1.8 -61,-0.2 -9,-0.2 -107,-0.2 -0.802 41.8 167.3-103.1 127.2 15.1 25.4 3.6 110 110 A D E + 0 0 8 -63,-2.2 -108,-2.4 -2,-0.5 -62,-0.2 0.643 66.8 11.3 -93.7 -99.7 14.4 26.3 -0.0 111 111 A M E - 0 0 29 -110,-0.2 -62,-2.7 -109,-0.1 2,-0.5 -0.466 66.7-142.7 -81.4 148.1 10.7 26.6 -0.9 112 112 A V E -ac 4 49A 5 -109,-3.0 -107,-2.1 -64,-0.2 2,-0.5 -0.965 13.8-165.7-111.3 132.3 8.0 26.7 1.7 113 113 A W E -ac 5 50A 3 -64,-3.0 -62,-2.7 -2,-0.5 2,-0.6 -0.973 9.9-153.8-119.8 114.9 4.7 25.0 1.0 114 114 A I E -ac 6 51A 0 -109,-3.1 -107,-2.2 -2,-0.5 -62,-0.2 -0.820 14.9-179.8 -86.7 121.3 1.6 25.6 3.0 115 115 A V - 0 0 15 -64,-2.7 2,-0.2 -2,-0.6 -63,-0.2 0.266 37.0-170.0-115.5 13.0 -0.5 22.4 2.7 116 116 A G - 0 0 1 -65,-0.4 -63,-2.2 1,-0.2 -1,-0.4 -0.527 54.0-131.3 123.7 175.4 -3.6 23.3 4.8 117 117 A G > - 0 0 17 -65,-0.3 4,-2.7 -2,-0.2 3,-0.3 0.406 57.0 -97.0 -96.7-147.5 -6.0 23.5 6.4 118 118 A S H > S+ 0 0 38 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.855 119.4 46.0 -54.2 -47.6 -8.5 26.3 5.8 119 119 A S H > S+ 0 0 93 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.869 113.9 49.8 -68.5 -35.0 -7.4 28.7 8.5 120 120 A V H > S+ 0 0 12 -3,-0.3 4,-2.4 2,-0.2 5,-0.2 0.930 111.9 47.9 -67.3 -46.5 -3.7 28.3 7.6 121 121 A Y H X S+ 0 0 11 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.933 111.6 51.4 -56.7 -46.9 -4.5 28.9 3.9 122 122 A K H X S+ 0 0 127 -4,-2.6 4,-1.2 -5,-0.2 -2,-0.2 0.926 110.7 46.8 -60.6 -46.0 -6.6 32.0 4.8 123 123 A E H >< S+ 0 0 121 -4,-2.2 3,-0.7 1,-0.2 4,-0.4 0.942 115.1 46.3 -62.0 -48.6 -3.9 33.6 6.9 124 124 A A H >< S+ 0 0 1 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.914 110.8 53.2 -58.1 -44.7 -1.2 33.0 4.2 125 125 A M H 3< S+ 0 0 6 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.701 113.5 41.9 -68.6 -20.9 -3.5 34.3 1.5 126 126 A N T << S+ 0 0 107 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.300 89.9 106.2-107.8 3.9 -4.2 37.6 3.3 127 127 A H S < S- 0 0 69 -3,-1.1 59,-0.2 -4,-0.4 -4,-0.0 -0.752 79.4-110.2 -88.1 126.2 -0.6 38.1 4.4 128 128 A P S S+ 0 0 83 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.240 74.4 58.4 -55.6 141.9 1.2 40.9 2.5 129 129 A G S S- 0 0 23 2,-0.1 57,-1.3 0, 0.0 2,-0.6 -0.802 92.1 -34.6 136.1-174.2 4.0 39.7 0.2 130 130 A H E + F 0 185A 75 -2,-0.2 -126,-0.4 55,-0.2 2,-0.3 -0.763 65.0 159.4 -85.9 122.0 4.9 37.5 -2.7 131 131 A L E - F 0 184A 3 53,-2.0 53,-2.7 -2,-0.6 2,-0.4 -0.999 25.3-157.4-146.9 138.7 2.8 34.3 -2.7 132 132 A K E -bF 5 183A 21 -128,-1.6 -126,-2.4 -2,-0.3 2,-0.5 -0.927 7.5-151.7-113.1 148.4 1.8 31.6 -5.2 133 133 A L E -bF 6 182A 0 49,-2.2 49,-2.6 -2,-0.4 2,-0.8 -0.977 0.8-160.2-117.1 122.4 -1.2 29.3 -5.0 134 134 A F E -bF 7 181A 2 -128,-3.2 -126,-2.4 -2,-0.5 2,-0.5 -0.895 23.7-177.0-101.1 106.3 -1.0 25.9 -6.8 135 135 A V E -bF 8 180A 0 45,-2.3 45,-2.0 -2,-0.8 2,-0.7 -0.931 22.3-158.1-117.9 121.7 -4.6 25.0 -7.1 136 136 A T E -bF 9 179A 0 -128,-2.5 -126,-3.0 -2,-0.5 2,-0.8 -0.900 17.2-147.8 -96.3 117.7 -6.0 21.8 -8.6 137 137 A R E -bF 10 178A 54 41,-2.8 41,-1.7 -2,-0.7 2,-0.7 -0.795 3.7-157.0 -87.7 106.2 -9.6 22.4 -9.7 138 138 A I E -bF 11 177A 2 -128,-3.2 2,-1.3 -2,-0.8 -126,-0.6 -0.802 18.9-139.6 -81.9 115.9 -11.6 19.2 -9.2 139 139 A M + 0 0 72 37,-2.5 2,-0.3 -2,-0.7 37,-0.2 -0.177 69.2 57.4 -90.6 44.7 -14.3 19.9 -11.8 140 140 A Q S S- 0 0 72 -2,-1.3 -128,-2.4 35,-0.1 -127,-0.4 -0.962 86.5 -92.8-151.9 170.6 -17.4 18.6 -9.9 141 141 A D - 0 0 99 -2,-0.3 2,-0.4 -130,-0.2 -2,-0.1 -0.679 39.0-177.2 -83.1 138.4 -19.2 19.2 -6.7 142 142 A F - 0 0 33 -2,-0.3 -127,-0.1 -118,-0.0 -131,-0.1 -0.996 35.1-105.0-136.7 136.0 -18.4 17.0 -3.7 143 143 A E + 0 0 145 -2,-0.4 2,-0.3 -120,-0.2 -2,-0.0 -0.374 53.5 172.2 -56.5 130.0 -19.9 17.0 -0.2 144 144 A S - 0 0 19 -2,-0.1 -126,-0.3 -131,-0.1 3,-0.1 -0.932 40.6-164.6-143.1 157.2 -17.5 18.7 2.1 145 145 A D S S+ 0 0 76 -128,-2.7 2,-0.3 -2,-0.3 -127,-0.2 0.317 83.5 49.9-126.2 6.0 -17.1 20.0 5.7 146 146 A T E S-I 17 0B 36 -129,-1.3 -130,-2.9 -28,-0.0 -129,-1.5 -0.986 71.8-161.5-145.1 141.1 -14.0 22.2 5.2 147 147 A F E -I 15 0B 94 -2,-0.3 -132,-0.2 -132,-0.3 -133,-0.1 -0.898 22.3-111.1-132.2 149.2 -13.5 24.8 2.4 148 148 A F - 0 0 7 -134,-2.8 3,-0.1 -2,-0.3 -30,-0.1 -0.573 45.2-109.3 -73.6 139.0 -10.8 26.7 0.6 149 149 A P - 0 0 21 0, 0.0 -1,-0.1 0, 0.0 -135,-0.0 -0.271 45.8 -79.1 -66.2 159.3 -10.8 30.5 1.3 150 150 A E - 0 0 172 1,-0.1 2,-0.7 2,-0.0 -25,-0.0 -0.316 39.0-136.9 -56.8 133.6 -11.9 32.9 -1.3 151 151 A I - 0 0 18 -3,-0.1 2,-1.0 5,-0.0 -1,-0.1 -0.889 13.4-143.0 -93.5 112.6 -9.2 33.7 -3.9 152 152 A D >> - 0 0 58 -2,-0.7 4,-2.9 1,-0.2 3,-1.4 -0.703 12.4-166.8 -78.0 101.6 -9.2 37.5 -4.5 153 153 A L T 34 S+ 0 0 112 -2,-1.0 -1,-0.2 1,-0.3 5,-0.1 0.584 81.3 71.8 -72.0 -10.0 -8.6 37.6 -8.2 154 154 A E T 34 S+ 0 0 177 1,-0.1 -1,-0.3 3,-0.1 3,-0.1 0.859 117.1 22.7 -66.4 -33.1 -7.9 41.4 -8.0 155 155 A K T <4 S+ 0 0 102 -3,-1.4 2,-0.8 1,-0.2 30,-0.3 0.806 116.5 67.6-100.6 -41.6 -4.6 40.3 -6.3 156 156 A Y < - 0 0 5 -4,-2.9 2,-0.5 28,-0.1 28,-0.2 -0.769 69.2-158.0 -91.9 111.1 -4.1 36.7 -7.4 157 157 A K E -G 183 0A 143 26,-2.7 26,-1.9 -2,-0.8 2,-0.5 -0.747 16.0-130.6 -89.0 125.3 -3.2 36.5 -11.1 158 158 A L E -G 182 0A 91 -2,-0.5 24,-0.2 24,-0.2 -1,-0.0 -0.650 29.3-128.8 -70.8 119.8 -3.9 33.2 -12.9 159 159 A L - 0 0 37 22,-3.1 22,-0.4 -2,-0.5 3,-0.1 -0.548 2.1-140.6 -77.0 137.8 -0.7 32.4 -14.8 160 160 A P S S- 0 0 120 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.599 83.4 -2.8 -75.6 -8.6 -1.1 31.6 -18.4 161 161 A E - 0 0 152 20,-0.1 5,-0.1 2,-0.0 19,-0.0 -0.935 60.1-167.4-169.3 153.9 1.6 28.8 -18.2 162 162 A Y > - 0 0 74 3,-0.4 3,-1.8 -2,-0.3 2,-0.0 -0.924 32.7-107.5-151.4 133.3 4.0 27.4 -15.6 163 163 A P T 3 S+ 0 0 108 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.303 103.8 15.7 -60.5 135.2 7.0 25.0 -16.1 164 164 A G T 3 S+ 0 0 45 1,-0.2 2,-0.5 -2,-0.0 -127,-0.0 0.478 102.7 105.9 83.6 1.5 6.3 21.5 -14.9 165 165 A V < - 0 0 17 -3,-1.8 -3,-0.4 14,-0.0 -1,-0.2 -0.969 69.8-129.4-117.6 120.7 2.6 22.0 -14.7 166 166 A L - 0 0 79 -2,-0.5 13,-0.5 1,-0.1 4,-0.1 -0.442 13.1-159.4 -66.8 138.8 0.3 20.4 -17.3 167 167 A S + 0 0 98 -2,-0.1 -1,-0.1 11,-0.1 2,-0.1 0.592 61.4 79.7 -96.6 -15.2 -2.2 22.8 -18.8 168 168 A D S S- 0 0 105 1,-0.1 11,-0.4 10,-0.1 2,-0.2 -0.366 91.5 -76.6 -94.4 174.8 -4.8 20.5 -20.2 169 169 A V - 0 0 74 9,-0.1 2,-0.3 -2,-0.1 9,-0.2 -0.490 43.9-157.9 -75.0 132.8 -7.7 18.6 -18.5 170 170 A Q E -H 177 0A 35 7,-3.4 7,-2.4 -2,-0.2 2,-0.3 -0.705 4.5-162.8-102.5 158.2 -6.8 15.5 -16.5 171 171 A E E +H 176 0A 108 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.948 14.4 165.8-149.2 128.9 -9.1 12.7 -15.6 172 172 A E E > S-H 175 0A 26 3,-2.0 3,-2.4 -2,-0.3 -2,-0.0 -0.996 74.5 -4.1-139.0 136.4 -8.9 10.0 -13.0 173 173 A K T 3 S- 0 0 111 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.837 130.2 -56.7 49.2 38.1 -11.7 7.6 -11.8 174 174 A G T 3 S+ 0 0 53 1,-0.2 2,-0.6 -3,-0.0 -1,-0.3 0.621 113.0 121.6 71.9 13.3 -14.1 9.5 -14.1 175 175 A I E < - H 0 172A 8 -3,-2.4 -3,-2.0 -35,-0.0 2,-0.3 -0.945 52.4-148.9-113.4 116.2 -13.3 12.8 -12.4 176 176 A K E + H 0 171A 95 -2,-0.6 -37,-2.5 -5,-0.2 2,-0.3 -0.593 25.9 162.5 -80.2 142.7 -11.9 15.6 -14.5 177 177 A Y E -FH 138 170A 3 -7,-2.4 -7,-3.4 -2,-0.3 2,-0.3 -0.970 19.4-156.4-152.7 165.8 -9.5 18.1 -13.0 178 178 A K E -F 137 0A 62 -41,-1.7 -41,-2.8 -2,-0.3 2,-0.4 -0.987 18.6-119.7-148.2 153.6 -7.0 20.7 -14.1 179 179 A F E -F 136 0A 19 -13,-0.5 2,-0.3 -11,-0.4 -43,-0.2 -0.767 29.2-179.7 -99.4 139.8 -3.9 22.4 -12.6 180 180 A E E -F 135 0A 26 -45,-2.0 -45,-2.3 -2,-0.4 2,-0.4 -0.967 15.2-156.0-135.4 149.3 -3.7 26.2 -12.0 181 181 A V E -F 134 0A 5 -22,-0.4 -22,-3.1 -2,-0.3 2,-0.3 -0.998 12.3-172.1-127.5 128.1 -1.0 28.5 -10.6 182 182 A Y E -FG 133 158A 10 -49,-2.6 -49,-2.2 -2,-0.4 2,-0.4 -0.883 2.6-165.7-115.0 149.6 -1.9 31.9 -9.1 183 183 A E E +FG 132 157A 57 -26,-1.9 -26,-2.7 -2,-0.3 2,-0.3 -0.995 8.6 176.3-140.4 132.6 0.6 34.6 -8.1 184 184 A K E -F 131 0A 6 -53,-2.7 -53,-2.0 -2,-0.4 2,-0.2 -0.900 7.7-174.1-122.4 158.5 0.2 37.8 -6.0 185 185 A N E F 130 0A 117 -30,-0.3 -55,-0.2 -2,-0.3 -2,-0.0 -0.730 360.0 360.0-152.4 101.9 2.8 40.3 -4.8 186 186 A D 0 0 96 -57,-1.3 -56,-0.1 -2,-0.2 -1,-0.1 0.124 360.0 360.0-140.8 360.0 1.6 43.0 -2.4