==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGAND BINDING PROTEIN 02-MAR-00 1EJE . COMPND 2 MOLECULE: FMN-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER THERMAUTOTROPHICUS . AUTHOR D.CHRISTENDAT,V.SARIDAKIS,A.BOCHKAREV,C.ARROWSMITH,A.M.EDWAR . 192 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11968.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 130 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 63 32.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 2.1 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 . 22 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 2 0 0 1 0 0 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 0 0 0 0 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 3 0 3 1 2 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 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 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 G 0 0 90 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 177.5 54.2 16.8 3.7 2 2 A S > - 0 0 73 1,-0.1 4,-2.5 4,-0.0 3,-0.2 -0.456 360.0-112.3 -73.4 151.7 54.9 20.4 2.7 3 3 A Q H > S+ 0 0 165 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.866 120.3 53.3 -51.3 -39.3 58.4 21.6 3.5 4 4 A A H > S+ 0 0 62 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.927 109.1 48.1 -62.0 -45.4 56.9 24.0 6.1 5 5 A A H >> S+ 0 0 55 -3,-0.2 3,-0.6 1,-0.2 4,-0.6 0.871 109.2 55.5 -62.5 -38.0 55.1 21.1 7.7 6 6 A H H >< S+ 0 0 108 -4,-2.5 3,-0.6 1,-0.2 -1,-0.2 0.890 106.5 47.3 -64.4 -42.1 58.3 19.0 7.7 7 7 A M H 3< S+ 0 0 135 -4,-2.0 -1,-0.2 1,-0.2 3,-0.2 0.553 113.6 48.2 -80.1 -5.2 60.4 21.6 9.6 8 8 A M H XX S+ 0 0 72 -4,-0.7 3,-2.3 -3,-0.6 4,-0.5 0.440 76.5 108.0-107.7 -4.1 57.8 22.1 12.2 9 9 A S T << S+ 0 0 90 -3,-0.6 -1,-0.1 -4,-0.6 -2,-0.1 0.617 91.9 32.9 -48.1 -15.3 57.3 18.4 12.7 10 10 A M T 34 S+ 0 0 176 -3,-0.2 -1,-0.3 -4,-0.1 -2,-0.1 0.399 96.9 84.9-122.1 -2.0 59.1 18.8 16.1 11 11 A D T <4 S+ 0 0 103 -3,-2.3 2,-0.3 2,-0.0 -2,-0.2 0.480 76.2 87.0 -81.4 -1.5 57.9 22.3 17.0 12 12 A F < - 0 0 170 -4,-0.5 2,-0.4 -3,-0.0 0, 0.0 -0.766 56.8-162.6-105.8 147.0 54.7 21.1 18.6 13 13 A E - 0 0 179 -2,-0.3 2,-0.1 0, 0.0 -2,-0.0 -0.942 27.4-110.1-125.2 146.3 54.0 19.9 22.1 14 14 A D - 0 0 162 -2,-0.4 0, 0.0 1,-0.0 0, 0.0 -0.422 37.2-160.8 -67.8 149.5 51.1 17.9 23.5 15 15 A F - 0 0 97 -2,-0.1 4,-0.1 0, 0.0 5,-0.1 -1.000 28.1 -93.4-137.1 137.2 48.9 20.0 25.7 16 16 A P > - 0 0 65 0, 0.0 3,-1.4 0, 0.0 0, 0.0 -0.213 25.2-145.1 -50.5 128.9 46.4 18.9 28.4 17 17 A V G > S+ 0 0 114 1,-0.3 3,-1.3 2,-0.2 4,-0.2 0.763 99.0 63.2 -68.5 -25.2 42.9 18.6 26.9 18 18 A E G 3 S+ 0 0 146 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.408 100.4 54.0 -80.2 4.9 41.4 19.8 30.3 19 19 A S G X S+ 0 0 20 -3,-1.4 3,-1.5 1,-0.1 4,-0.3 0.083 73.9 115.7-119.6 17.0 43.3 23.1 29.7 20 20 A A G X> + 0 0 55 -3,-1.3 3,-1.9 1,-0.3 4,-1.4 0.842 66.9 61.2 -55.8 -40.6 41.7 23.5 26.3 21 21 A H G 34 S+ 0 0 71 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.721 96.3 62.9 -63.1 -18.7 39.8 26.6 27.3 22 22 A R G <4 S+ 0 0 151 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.607 102.8 48.2 -81.6 -11.2 43.1 28.3 28.0 23 23 A I T <4 S+ 0 0 114 -3,-1.9 2,-1.7 -4,-0.3 -2,-0.2 0.741 99.0 68.5 -95.7 -30.7 44.1 27.9 24.3 24 24 A L S < S+ 0 0 133 -4,-1.4 -1,-0.2 153,-0.0 -4,-0.0 -0.517 95.9 179.3 -89.1 68.6 40.8 29.4 23.1 25 25 A T + 0 0 44 -2,-1.7 152,-0.1 -3,-0.2 2,-0.1 -0.930 28.9 31.9-145.5 167.2 41.6 32.9 24.4 26 26 A P - 0 0 65 0, 0.0 151,-0.2 0, 0.0 156,-0.1 0.561 69.9-172.8 -76.2 160.2 41.3 35.8 25.1 27 27 A R E -A 176 0A 26 149,-2.5 149,-3.7 -2,-0.1 156,-0.1 -0.947 31.6 -94.6-127.5 146.4 37.5 35.8 25.5 28 28 A P E -A 175 0A 66 0, 0.0 2,-0.6 0, 0.0 147,-0.2 -0.293 38.2-145.3 -55.0 129.3 34.9 38.6 26.0 29 29 A T + 0 0 7 145,-2.4 55,-0.9 55,-0.2 2,-0.3 -0.897 24.1 177.9-103.1 120.0 34.2 39.0 29.7 30 30 A V E -CD 46 83B 5 16,-3.1 16,-3.5 -2,-0.6 2,-0.6 -0.875 28.9-132.7-122.8 154.2 30.6 39.8 30.4 31 31 A M E -CD 45 82B 0 51,-2.4 51,-2.0 -2,-0.3 2,-0.5 -0.924 24.0-155.3-103.9 121.5 28.6 40.4 33.6 32 32 A V E -CD 44 81B 0 12,-3.5 12,-1.6 -2,-0.6 2,-0.4 -0.879 6.1-158.8-101.2 127.6 25.4 38.5 33.5 33 33 A T E +CD 43 80B 0 47,-2.3 47,-2.1 -2,-0.5 2,-0.3 -0.835 19.8 157.1-106.8 145.7 22.5 39.8 35.6 34 34 A T E -C 42 0B 0 8,-2.0 8,-3.0 -2,-0.4 2,-0.3 -0.899 26.6-136.6-151.0 173.1 19.5 37.7 36.7 35 35 A V E -C 41 0B 8 43,-0.3 6,-0.2 -2,-0.3 43,-0.2 -0.963 13.6-131.5-137.5 153.5 16.9 37.8 39.5 36 36 A D > - 0 0 25 4,-1.4 3,-1.1 -2,-0.3 36,-0.1 -0.260 46.6 -86.1 -90.4-173.2 15.5 35.1 41.7 37 37 A E T 3 S+ 0 0 148 1,-0.2 -1,-0.0 2,-0.1 35,-0.0 0.736 129.3 57.4 -69.8 -19.5 11.8 34.7 42.2 38 38 A E T 3 S- 0 0 150 2,-0.1 -1,-0.2 1,-0.0 -3,-0.0 0.580 121.2-107.3 -84.2 -11.5 11.8 37.2 45.0 39 39 A G < + 0 0 42 -3,-1.1 2,-0.2 1,-0.3 -2,-0.1 0.509 64.7 156.0 98.2 5.6 13.3 39.8 42.7 40 40 A N - 0 0 65 1,-0.1 -4,-1.4 81,-0.0 2,-0.3 -0.488 40.0-128.4 -69.3 131.8 16.8 39.7 44.2 41 41 A I E -C 35 0B 29 61,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.633 25.6-173.6 -84.4 135.9 19.4 40.9 41.7 42 42 A N E -C 34 0B 6 -8,-3.0 -8,-2.0 -2,-0.3 2,-0.4 -0.964 1.6-174.8-128.0 145.0 22.4 38.7 41.0 43 43 A A E +C 33 0B 0 -2,-0.4 -10,-0.2 -10,-0.2 62,-0.1 -0.997 9.5 160.5-143.2 136.9 25.4 39.6 38.9 44 44 A A E -C 32 0B 16 -12,-1.6 -12,-3.5 -2,-0.4 2,-0.3 -0.992 34.7-112.4-154.9 149.5 28.5 37.6 37.9 45 45 A P E -C 31 0B 34 0, 0.0 2,-0.4 0, 0.0 -14,-0.3 -0.608 29.0-175.3 -86.6 143.3 31.2 37.7 35.2 46 46 A F E +C 30 0B 14 -16,-3.5 -16,-3.1 -2,-0.3 17,-0.1 -1.000 21.1 178.7-138.9 138.3 31.5 35.0 32.5 47 47 A S + 0 0 16 -2,-0.4 2,-1.2 -18,-0.2 129,-0.1 0.459 67.6 86.7-115.3 -13.7 34.1 34.6 29.8 48 48 A F S S+ 0 0 64 14,-0.4 14,-2.5 -21,-0.1 2,-0.3 -0.836 70.1 124.0 -82.8 87.4 32.6 31.3 28.1 49 49 A T E +E 61 0B 31 -2,-1.2 12,-0.3 12,-0.2 10,-0.0 -0.987 29.5 157.6-146.8 157.5 30.3 33.2 25.8 50 50 A M E -E 60 0B 107 10,-2.6 10,-2.4 -2,-0.3 2,-0.1 -0.943 39.8-103.9-174.0 146.5 29.4 33.6 22.1 51 51 A P E +E 59 0B 105 0, 0.0 8,-0.3 0, 0.0 3,-0.1 -0.460 31.4 179.7 -68.6 157.5 26.8 34.6 19.7 52 52 A V E + 0 0 80 6,-2.8 2,-0.4 1,-0.5 7,-0.2 0.576 62.3 21.5-125.5 -55.0 25.0 31.8 18.0 53 53 A S E > -E 58 0B 44 5,-2.0 5,-2.2 1,-0.1 -1,-0.5 -0.949 52.9-161.3-121.4 141.9 22.3 33.1 15.6 54 54 A I T 5S+ 0 0 159 -2,-0.4 -1,-0.1 1,-0.3 5,-0.0 0.902 81.4 42.6 -85.8 -46.3 22.3 36.5 14.0 55 55 A D T 5S+ 0 0 142 1,-0.4 -1,-0.3 2,-0.1 0, 0.0 -0.858 120.3 31.9-148.1 108.7 18.6 36.6 13.0 56 56 A P T 5S- 0 0 90 0, 0.0 2,-0.5 0, 0.0 -1,-0.4 0.436 112.4-123.8 -61.9 146.1 16.8 35.5 15.1 57 57 A P T 5 + 0 0 56 0, 0.0 94,-2.4 0, 0.0 2,-0.4 -0.546 41.5 167.7 -70.0 113.3 19.3 36.8 17.7 58 58 A V E < -EF 53 150B 20 -5,-2.2 -6,-2.8 -2,-0.5 -5,-2.0 -0.988 8.8-176.6-132.8 123.9 20.4 34.0 19.9 59 59 A V E -EF 51 149B 15 90,-2.3 90,-2.6 -2,-0.4 2,-0.3 -0.756 5.8-158.4-115.1 163.7 23.4 34.3 22.3 60 60 A A E +EF 50 148B 3 -10,-2.4 -10,-2.6 -2,-0.3 2,-0.3 -0.973 14.1 171.4-143.1 156.6 25.0 31.7 24.5 61 61 A F E -EF 49 147B 3 86,-2.1 86,-2.5 -2,-0.3 2,-0.5 -0.966 27.0-125.6-159.8 149.6 27.2 31.5 27.6 62 62 A A E + F 0 146B 20 -14,-2.5 -14,-0.4 -2,-0.3 2,-0.3 -0.894 28.8 175.6-108.0 133.6 28.3 28.6 29.8 63 63 A S E - F 0 145B 0 82,-1.8 82,-2.6 -2,-0.5 -17,-0.0 -0.956 39.5-101.0-133.5 146.3 27.9 28.5 33.6 64 64 A A > - 0 0 13 -2,-0.3 3,-1.2 80,-0.2 6,-0.4 -0.504 37.6-126.2 -57.8 135.4 28.5 26.1 36.4 65 65 A P T 3 S+ 0 0 51 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.734 106.5 57.2 -59.8 -22.6 25.1 24.6 37.1 66 66 A D T 3 S+ 0 0 93 4,-0.1 -2,-0.0 5,-0.1 0, 0.0 0.620 81.2 110.9 -83.2 -15.1 25.4 25.5 40.8 67 67 A H S <> S- 0 0 79 -3,-1.2 4,-2.4 1,-0.1 5,-0.2 -0.156 78.3-121.7 -59.0 154.9 25.9 29.3 40.2 68 68 A H H > S+ 0 0 49 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.856 116.1 57.7 -64.1 -34.7 23.2 31.7 41.3 69 69 A T H > S+ 0 0 1 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.922 107.3 45.2 -62.6 -44.6 23.2 32.8 37.7 70 70 A A H > S+ 0 0 1 -6,-0.4 4,-2.1 1,-0.2 -2,-0.2 0.972 116.8 44.2 -62.9 -54.4 22.4 29.2 36.5 71 71 A R H X S+ 0 0 148 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.831 111.5 53.4 -61.1 -35.9 19.7 28.6 39.1 72 72 A N H X S+ 0 0 18 -4,-2.7 4,-3.1 2,-0.2 5,-0.4 0.901 109.5 48.1 -67.8 -39.8 18.1 32.0 38.6 73 73 A I H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.903 107.4 56.4 -66.4 -40.1 17.8 31.5 34.9 74 74 A E H < S+ 0 0 128 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.852 118.8 33.1 -59.1 -34.3 16.3 28.1 35.4 75 75 A S H < S+ 0 0 41 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.784 132.9 25.5 -95.9 -31.0 13.6 29.7 37.6 76 76 A T H < S- 0 0 29 -4,-3.1 -3,-0.2 -41,-0.2 -2,-0.2 0.477 88.5-141.8-111.8 -6.6 12.9 33.1 36.0 77 77 A H < + 0 0 99 -4,-2.2 58,-2.6 -5,-0.4 2,-0.3 0.733 63.5 94.4 55.3 30.4 14.1 32.3 32.5 78 78 A E E + G 0 134B 38 56,-0.3 -43,-0.3 -6,-0.2 2,-0.3 -0.972 38.8 162.9-147.0 160.9 15.8 35.6 31.8 79 79 A F E - G 0 133B 0 54,-2.0 54,-3.1 -2,-0.3 2,-0.4 -0.957 25.9-133.3-171.3 156.8 19.2 37.3 32.0 80 80 A V E -DG 33 132B 0 -47,-2.1 -47,-2.3 -2,-0.3 2,-0.5 -0.988 13.8-145.5-123.4 129.1 21.0 40.3 30.7 81 81 A I E -DG 32 131B 4 50,-2.4 50,-2.5 -2,-0.4 2,-0.5 -0.848 19.0-164.4 -92.8 126.9 24.5 40.1 29.2 82 82 A N E -DG 31 130B 0 -51,-2.0 -51,-2.4 -2,-0.5 48,-0.2 -0.958 15.6-129.9-118.3 119.7 26.5 43.3 30.1 83 83 A I E -D 30 0B 40 46,-2.1 46,-0.3 -2,-0.5 -53,-0.2 -0.346 20.3-132.9 -65.9 143.5 29.7 44.2 28.2 84 84 A T - 0 0 0 -55,-0.9 90,-3.0 90,-0.3 2,-0.2 -0.864 15.2-159.6-105.6 109.9 32.7 45.0 30.5 85 85 A P B > -I 173 0C 5 0, 0.0 3,-1.9 0, 0.0 87,-0.2 -0.587 30.0-116.4 -81.6 148.4 34.7 48.2 29.6 86 86 A A G > S+ 0 0 22 86,-2.3 3,-1.9 85,-0.8 4,-0.3 0.774 106.8 76.2 -57.9 -26.3 38.2 48.3 31.0 87 87 A D G 3 S+ 0 0 132 84,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.627 106.6 32.7 -63.2 -11.4 37.3 51.4 33.2 88 88 A I G <> S+ 0 0 12 -3,-1.9 4,-2.3 2,-0.1 3,-0.3 0.041 79.9 121.4-129.8 26.3 35.5 49.1 35.6 89 89 A I H <> S+ 0 0 33 -3,-1.9 4,-1.8 1,-0.2 -2,-0.1 0.877 77.0 50.6 -58.5 -39.7 37.6 45.9 35.3 90 90 A E H > S+ 0 0 146 -4,-0.3 4,-1.0 1,-0.2 -1,-0.2 0.838 111.3 49.9 -67.9 -30.8 38.4 45.9 39.0 91 91 A R H > S+ 0 0 118 -3,-0.3 4,-1.2 2,-0.2 -2,-0.2 0.872 108.5 49.1 -75.7 -39.0 34.7 46.2 39.8 92 92 A M H < S+ 0 0 3 -4,-2.3 3,-0.4 1,-0.2 4,-0.2 0.896 106.6 59.7 -67.5 -35.3 33.5 43.4 37.6 93 93 A W H >< S+ 0 0 119 -4,-1.8 3,-1.4 -5,-0.3 -1,-0.2 0.870 100.8 54.5 -58.4 -37.2 36.2 41.3 39.2 94 94 A V H >< S+ 0 0 31 -4,-1.0 3,-2.4 1,-0.3 -1,-0.2 0.852 93.6 68.5 -66.6 -33.9 34.6 41.9 42.6 95 95 A T T 3< S+ 0 0 1 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.564 90.7 66.5 -63.0 -3.8 31.2 40.6 41.3 96 96 A A T < S+ 0 0 60 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.614 75.1 109.5 -92.1 -13.1 32.9 37.2 41.1 97 97 A R S < S- 0 0 141 -3,-2.4 2,-2.1 -4,-0.2 8,-0.1 -0.188 88.6 -99.5 -58.7 156.5 33.3 37.0 44.9 98 98 A D + 0 0 157 3,-0.0 -1,-0.1 7,-0.0 3,-0.1 -0.450 53.2 179.5 -82.6 70.1 31.1 34.4 46.5 99 99 A I - 0 0 25 -2,-2.1 3,-0.1 -4,-0.2 6,-0.1 -0.462 37.3 -92.0 -72.1 139.4 28.4 36.7 47.7 100 100 A P > - 0 0 87 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.086 51.2 -91.1 -49.9 146.5 25.5 35.2 49.6 101 101 A A T 3 S+ 0 0 67 1,-0.2 3,-0.1 -3,-0.1 -59,-0.0 -0.248 114.1 27.5 -58.2 148.2 22.4 34.2 47.5 102 102 A G T 3 S+ 0 0 24 1,-0.3 2,-0.3 -62,-0.1 -1,-0.2 0.204 96.6 114.3 84.0 -18.8 19.8 36.9 47.3 103 103 A E < - 0 0 107 -3,-1.8 2,-0.8 -63,-0.1 -1,-0.3 -0.687 69.4-125.4 -89.5 139.8 22.5 39.6 47.7 104 104 A N >> - 0 0 14 -2,-0.3 3,-1.1 1,-0.2 4,-0.9 -0.741 16.4-166.5 -87.5 108.3 23.3 42.0 44.9 105 105 A E H 3> S+ 0 0 7 -2,-0.8 4,-1.4 1,-0.3 -1,-0.2 0.667 83.7 73.7 -68.6 -14.6 27.0 41.8 44.1 106 106 A L H 3>>S+ 0 0 0 2,-0.2 5,-2.9 1,-0.2 4,-0.7 0.886 94.8 53.3 -64.4 -35.1 26.6 45.0 42.0 107 107 A E H X45S+ 0 0 126 -3,-1.1 3,-1.3 1,-0.2 -2,-0.2 0.953 108.8 46.3 -63.0 -51.1 26.3 46.8 45.3 108 108 A A H 3<5S+ 0 0 54 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.729 111.9 53.7 -64.3 -21.8 29.5 45.4 46.7 109 109 A A H 3<5S- 0 0 2 -4,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.582 111.3-121.3 -88.5 -11.0 31.2 46.2 43.4 110 110 A G T <<5 + 0 0 44 -3,-1.3 2,-0.3 -4,-0.7 -3,-0.2 0.830 67.6 138.1 74.0 29.3 30.1 49.8 43.5 111 111 A L < - 0 0 9 -5,-2.9 2,-0.3 -6,-0.2 -1,-0.3 -0.716 44.4-137.4-105.5 159.4 28.2 49.4 40.2 112 112 A A - 0 0 38 -2,-0.3 13,-2.2 -3,-0.1 14,-0.6 -0.831 13.2-163.0-117.2 156.7 24.8 50.7 39.4 113 113 A W E -J 124 0D 91 -2,-0.3 2,-0.3 11,-0.3 11,-0.2 -0.961 3.0-167.8-137.5 152.9 21.9 49.1 37.5 114 114 A T E -J 123 0D 65 9,-2.5 9,-2.8 -2,-0.3 -2,-0.0 -0.905 39.5 -76.7-135.6 163.1 18.7 50.4 35.9 115 115 A S - 0 0 84 -2,-0.3 2,-0.2 7,-0.2 5,-0.1 -0.214 42.3-128.4 -61.5 150.3 15.6 48.6 34.6 116 116 A S - 0 0 13 3,-0.5 -1,-0.1 4,-0.3 -36,-0.0 -0.498 14.8-124.8 -91.5 166.8 15.7 46.7 31.3 117 117 A R S S+ 0 0 199 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.0 0.864 99.5 12.4 -82.5 -37.1 13.1 47.3 28.6 118 118 A R S S+ 0 0 131 35,-0.0 2,-0.2 -3,-0.0 -1,-0.1 0.628 118.9 52.7-116.1 -18.9 11.8 43.8 28.1 119 119 A V S S- 0 0 13 2,-0.2 -3,-0.5 1,-0.1 15,-0.1 -0.738 72.2-120.5-120.6 169.8 13.0 41.6 31.0 120 120 A K S S+ 0 0 165 -2,-0.2 -4,-0.3 -44,-0.2 -1,-0.1 0.955 86.4 80.5 -72.0 -55.3 13.1 41.6 34.8 121 121 A P S S- 0 0 0 0, 0.0 -5,-0.2 0, 0.0 -2,-0.2 -0.201 84.5-112.3 -54.9 148.9 16.9 41.5 35.5 122 122 A P - 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