==== 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 TRANSCRIPTION REGULATOR 22-JUN-09 3HYJ . COMPND 2 MOLECULE: PROTEIN DUF199/WHIA; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR B.K.KAISER,M.C.CLIFTON,B.W.SHEN,B.L.STODDARD . 384 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17828.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 274 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 19.0 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 . 27 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 35.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 1 0 0 0 1 2 1 0 2 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 3 3 3 2 2 1 0 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 . 0 0 2 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 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 M 0 0 95 0, 0.0 2,-0.4 0, 0.0 267,-0.2 0.000 360.0 360.0 360.0 157.5 8.0 51.8 13.1 2 2 A V E -A 267 0A 14 265,-1.9 265,-3.0 76,-0.1 2,-0.3 -0.885 360.0-135.4-115.6 134.8 8.1 48.8 15.5 3 3 A S E -A 266 0A 41 -2,-0.4 263,-0.2 263,-0.2 261,-0.0 -0.628 12.7-169.6 -90.3 144.2 11.1 47.6 17.4 4 4 A L + 0 0 3 261,-2.1 2,-0.7 -2,-0.3 50,-0.3 0.294 59.6 102.2-107.9 2.7 12.0 43.9 17.8 5 5 A L + 0 0 37 260,-0.6 2,-0.5 49,-0.1 -2,-0.1 -0.824 40.5 172.1-102.0 109.7 14.6 44.5 20.4 6 6 A R - 0 0 68 -2,-0.7 2,-0.9 2,-0.1 48,-0.1 -0.978 19.1-155.9-105.0 127.0 13.8 43.8 24.1 7 7 A R + 0 0 137 -2,-0.5 2,-0.3 4,-0.1 -2,-0.0 -0.802 44.4 131.1-100.1 83.2 16.8 44.0 26.5 8 8 A T > - 0 0 65 -2,-0.9 4,-1.9 1,-0.1 5,-0.1 -0.896 69.4-113.7-121.4 163.3 15.6 41.8 29.3 9 9 A F H > S+ 0 0 50 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 0.849 115.7 60.5 -57.5 -40.5 17.4 39.0 31.1 10 10 A S H > S+ 0 0 15 110,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.931 105.8 46.0 -58.7 -46.3 14.9 36.6 29.6 11 11 A E H > S+ 0 0 8 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.925 104.9 59.5 -64.5 -43.2 15.9 37.5 26.1 12 12 A E H X S+ 0 0 120 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.942 111.1 43.8 -51.6 -47.7 19.6 37.3 26.7 13 13 A I H X S+ 0 0 14 -4,-2.0 4,-1.1 1,-0.2 3,-0.3 0.926 113.3 50.4 -57.9 -49.7 19.0 33.7 27.7 14 14 A K H X S+ 0 0 14 -4,-2.3 4,-1.1 1,-0.2 -2,-0.2 0.820 106.0 55.9 -62.3 -33.7 16.7 33.0 24.7 15 15 A E H X S+ 0 0 64 -4,-3.3 4,-0.5 1,-0.2 3,-0.3 0.858 104.5 53.3 -65.3 -35.5 19.3 34.5 22.3 16 16 A E H < S+ 0 0 50 -4,-1.5 3,-0.4 -5,-0.3 4,-0.3 0.824 108.6 51.9 -66.7 -27.4 21.8 32.0 23.6 17 17 A L H >< S+ 0 0 0 -4,-1.1 3,-0.7 1,-0.2 -2,-0.2 0.676 88.1 77.1 -83.8 -20.6 19.2 29.2 22.9 18 18 A V H 3< S+ 0 0 8 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.1 0.853 98.4 48.2 -55.8 -31.5 18.5 30.1 19.2 19 19 A N T 3< S+ 0 0 87 -4,-0.5 -1,-0.2 -3,-0.4 -2,-0.2 0.598 72.7 121.6 -90.7 -18.1 21.8 28.5 18.3 20 20 A V S < S- 0 0 33 -3,-0.7 162,-0.0 -4,-0.3 -3,-0.0 -0.264 73.9-107.2 -48.3 122.4 21.7 25.1 20.1 21 21 A P - 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.132 31.1-115.6 -58.9 160.6 22.1 22.5 17.3 22 22 A F - 0 0 48 1,-0.2 2,-0.2 -3,-0.1 -2,-0.1 0.890 33.8-162.3 -77.1 -50.5 19.0 20.6 16.5 23 23 A G - 0 0 45 4,-0.1 -1,-0.2 5,-0.0 5,-0.0 -0.597 47.9 -8.5 99.2-163.0 19.2 16.8 17.2 24 24 A S S > S- 0 0 56 -2,-0.2 4,-2.1 1,-0.1 3,-0.2 -0.209 71.3-107.4 -64.7 159.3 17.1 14.0 16.0 25 25 A R H > S+ 0 0 118 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.904 123.5 52.4 -50.9 -40.3 13.9 14.6 14.0 26 26 A E H > S+ 0 0 108 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.841 105.1 52.4 -72.2 -34.8 12.0 13.6 17.1 27 27 A E H > S+ 0 0 51 -3,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.876 111.1 49.2 -64.3 -39.8 13.9 16.0 19.4 28 28 A V H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.893 110.5 49.7 -65.2 -43.2 13.0 18.8 17.0 29 29 A I H X S+ 0 0 12 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.891 108.1 53.9 -66.0 -36.8 9.4 17.7 16.9 30 30 A S H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.887 108.2 48.9 -64.1 -41.1 9.3 17.7 20.8 31 31 A E H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.915 108.4 54.3 -60.2 -45.0 10.6 21.2 21.0 32 32 A L H X S+ 0 0 2 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.889 105.4 52.6 -57.5 -39.6 8.0 22.3 18.5 33 33 A L H X S+ 0 0 5 -4,-1.9 4,-3.5 2,-0.2 5,-0.3 0.870 104.3 58.1 -64.4 -36.2 5.3 20.7 20.7 34 34 A G H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 5,-0.3 0.979 109.7 42.4 -49.7 -58.2 6.8 22.9 23.5 35 35 A F H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 5,-0.3 0.884 114.9 52.2 -55.6 -44.1 6.1 26.0 21.4 36 36 A I H X S+ 0 0 11 -4,-2.6 4,-3.0 3,-0.2 -1,-0.2 0.948 112.8 42.3 -62.8 -51.1 2.7 24.6 20.5 37 37 A K H < S+ 0 0 54 -4,-3.5 97,-0.6 1,-0.2 98,-0.3 0.843 120.5 41.6 -69.0 -34.1 1.6 23.9 24.1 38 38 A A H < S- 0 0 6 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.910 142.2 -3.0 -76.7 -39.7 2.9 27.2 25.5 39 39 A R H < S+ 0 0 65 -4,-2.9 11,-1.5 -5,-0.3 -3,-0.2 0.271 94.3 120.1-139.3 10.6 1.8 29.5 22.6 40 40 A G E < -E 49 0B 27 -4,-3.0 2,-0.3 -5,-0.3 9,-0.2 -0.499 35.4-166.7 -89.1 152.7 0.1 27.5 19.7 41 41 A D E -E 48 0B 85 7,-0.7 7,-2.4 -2,-0.2 2,-0.3 -0.905 9.3-154.8-140.1 112.1 -3.4 28.0 18.4 42 42 A L E E 47 0B 68 -2,-0.3 5,-0.2 5,-0.2 4,-0.1 -0.643 360.0 360.0 -84.7 138.2 -4.9 25.4 16.0 43 43 A D 0 0 150 3,-1.4 -2,-0.0 -2,-0.3 0, 0.0 -0.551 360.0 360.0-171.0 360.0 -7.7 26.3 13.6 44 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 45 47 A R 0 0 73 0, 0.0 44,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0-172.7 -3.6 23.6 8.8 46 48 A H - 0 0 68 42,-0.5 -3,-1.4 -4,-0.1 2,-0.4 0.750 360.0-164.9-129.1-176.6 -2.4 25.8 10.5 47 49 A I E -EF 42 88B 2 41,-2.5 41,-2.9 -5,-0.2 2,-0.5 -0.969 20.3-153.0-109.9 136.0 -1.1 26.6 13.9 48 50 A V E -EF 41 87B 44 -7,-2.4 -7,-0.7 -2,-0.4 2,-0.6 -0.953 9.1-158.1-104.8 124.1 -0.7 30.3 14.7 49 51 A F E -EF 40 86B 0 37,-3.7 37,-2.2 -2,-0.5 2,-0.8 -0.902 4.5-160.0-104.8 123.0 2.0 31.1 17.2 50 52 A S E - F 0 85B 47 -11,-1.5 2,-0.4 -2,-0.6 35,-0.2 -0.877 21.5-178.0-102.7 103.9 1.8 34.3 19.2 51 53 A L E - F 0 84B 0 33,-2.9 33,-3.3 -2,-0.8 66,-0.1 -0.818 31.2-172.0-110.1 139.7 5.3 35.0 20.5 52 54 A H S S+ 0 0 83 64,-0.4 2,-0.6 -2,-0.4 -1,-0.1 0.658 74.3 78.4 -93.2 -20.3 6.6 37.8 22.7 53 55 A S > - 0 0 4 62,-0.2 4,-2.3 63,-0.2 5,-0.1 -0.813 61.3-161.4-100.2 118.6 10.3 36.8 22.2 54 56 A F H > S+ 0 0 11 -2,-0.6 4,-2.4 -50,-0.3 -1,-0.2 0.883 97.1 51.5 -59.0 -43.7 12.1 37.6 19.0 55 57 A A H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.916 109.2 48.3 -60.5 -47.9 14.6 34.9 19.7 56 58 A A H > S+ 0 0 0 59,-0.3 4,-2.7 1,-0.2 -2,-0.2 0.924 110.6 54.5 -58.4 -40.5 11.9 32.3 20.2 57 59 A S H X S+ 0 0 4 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.898 107.4 47.7 -60.0 -47.0 10.4 33.5 17.0 58 60 A R H X S+ 0 0 15 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.895 111.4 52.4 -59.7 -41.5 13.7 33.0 15.1 59 61 A R H X S+ 0 0 2 -4,-2.3 4,-2.7 1,-0.2 3,-0.5 0.941 105.4 54.6 -60.2 -47.7 14.0 29.5 16.6 60 62 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.905 105.3 52.3 -52.0 -47.9 10.5 28.6 15.5 61 63 A L H X S+ 0 0 14 -4,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.818 110.6 48.5 -62.7 -31.2 11.2 29.5 11.9 62 64 A N H X S+ 0 0 31 -4,-1.4 4,-2.6 -3,-0.5 5,-0.2 0.901 107.6 54.7 -73.0 -42.8 14.3 27.2 12.0 63 65 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.962 111.1 46.0 -50.2 -53.8 12.2 24.5 13.5 64 66 A M H <>S+ 0 0 3 -4,-2.7 5,-3.0 2,-0.2 4,-0.3 0.826 110.7 52.8 -60.4 -35.5 9.8 24.8 10.5 65 67 A K H ><5S+ 0 0 76 -4,-1.5 3,-2.8 3,-0.2 -2,-0.2 0.996 109.9 47.3 -63.9 -59.0 12.7 24.9 8.0 66 68 A Y H 3<5S+ 0 0 103 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.849 116.0 45.9 -47.0 -44.5 14.3 21.7 9.4 67 69 A L T 3<5S- 0 0 2 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.422 111.0-122.9 -79.5 -0.5 10.8 20.0 9.3 68 70 A S T < 5 + 0 0 100 -3,-2.8 -3,-0.2 -4,-0.3 -2,-0.1 0.838 57.5 155.1 59.7 37.5 10.1 21.3 5.8 69 71 A K < - 0 0 51 -5,-3.0 -1,-0.2 -6,-0.1 2,-0.1 -0.847 44.4-122.0-104.8 116.9 6.9 23.1 7.0 70 72 A P - 0 0 61 0, 0.0 19,-2.8 0, 0.0 2,-0.6 -0.353 16.4-145.0 -59.0 123.8 5.7 26.1 5.1 71 73 A V E -G 88 0B 37 17,-0.2 17,-0.2 1,-0.1 3,-0.1 -0.847 11.5-167.5 -90.6 126.3 5.4 29.3 7.1 72 74 A S E - 0 0 67 15,-3.1 2,-0.3 -2,-0.6 16,-0.2 0.782 61.2 -5.5 -86.2 -33.3 2.4 31.2 5.8 73 75 A E E -G 87 0B 55 14,-1.2 14,-2.4 2,-0.0 2,-0.4 -0.974 42.7-162.7-168.8 143.0 3.0 34.6 7.5 74 76 A I E +G 86 0B 4 -2,-0.3 119,-4.1 12,-0.2 120,-0.6 -0.896 25.3 171.2-135.0 100.9 5.1 36.5 9.9 75 77 A I E -GH 85 192B 25 10,-2.1 10,-2.6 -2,-0.4 2,-0.5 -0.916 24.7-145.1-114.2 139.8 3.5 39.7 11.2 76 78 A V E -GH 84 191B 0 115,-3.2 115,-2.1 -2,-0.4 2,-0.5 -0.928 15.3-145.9-100.0 122.7 4.8 42.0 14.0 77 79 A E E -G 83 0B 62 6,-2.3 6,-0.8 -2,-0.5 2,-0.1 -0.811 19.3-129.4 -91.1 125.1 1.9 43.6 15.9 78 80 A K - 0 0 47 -2,-0.5 -76,-0.1 4,-0.2 -1,-0.0 -0.383 23.5-174.1 -75.6 148.4 2.8 47.1 17.1 79 81 A S 0 0 89 -2,-0.1 -1,-0.1 3,-0.0 -77,-0.0 0.765 360.0 360.0 -75.7 -34.4 2.4 48.3 20.8 80 82 A H 0 0 122 -79,-0.1 -77,-0.1 -77,-0.0 -2,-0.1 -0.703 360.0 360.0 -91.6 360.0 3.2 50.9 19.3 81 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 82 87 A R 0 0 50 0, 0.0 2,-0.3 0, 0.0 -4,-0.2 0.000 360.0 360.0 360.0 155.3 4.3 43.9 20.7 83 88 A Y E - G 0 77B 88 -6,-0.8 -6,-2.3 2,-0.0 2,-0.5 -0.907 360.0-120.8-154.1 176.0 4.2 40.3 19.8 84 89 A I E -FG 51 76B 1 -33,-3.3 -33,-2.9 -2,-0.3 2,-0.7 -0.987 17.2-153.4-120.2 123.8 5.1 38.3 16.6 85 90 A K E -FG 50 75B 13 -10,-2.6 -10,-2.1 -2,-0.5 2,-0.5 -0.879 12.6-175.5 -97.3 110.6 2.4 36.1 15.0 86 91 A I E -FG 49 74B 0 -37,-2.2 -37,-3.7 -2,-0.7 2,-0.5 -0.941 8.1-160.1-100.8 126.3 3.9 33.2 13.0 87 92 A T E +FG 48 73B 29 -14,-2.4 -15,-3.1 -2,-0.5 -14,-1.2 -0.946 19.2 179.6-109.3 124.7 1.4 31.1 11.1 88 93 A A E -FG 47 71B 0 -41,-2.9 -41,-2.5 -2,-0.5 -42,-0.5 -0.962 30.1-122.8-137.8 135.4 2.6 27.6 10.1 89 94 A E - 0 0 83 -19,-2.8 2,-0.3 -2,-0.4 -20,-0.1 -0.242 38.0-177.8 -60.3 159.3 1.6 24.4 8.3 90 95 A Y - 0 0 46 -44,-0.0 2,-0.4 -21,-0.0 -1,-0.0 -0.968 25.5-126.9-152.8 165.8 1.8 21.3 10.4 91 96 A S > - 0 0 37 -2,-0.3 3,-2.1 1,-0.1 4,-0.4 -0.978 27.3-122.6-120.3 142.5 1.3 17.5 10.2 92 97 A E G > S+ 0 0 148 -2,-0.4 3,-1.4 1,-0.3 4,-0.5 0.745 105.3 70.4 -55.8 -29.7 -0.9 15.8 12.7 93 98 A S G > S+ 0 0 75 1,-0.3 3,-1.0 2,-0.2 4,-0.4 0.812 91.3 64.6 -58.0 -26.5 1.9 13.4 13.9 94 99 A F G X S+ 0 0 2 -3,-2.1 3,-0.7 1,-0.2 -1,-0.3 0.842 96.2 56.0 -60.8 -33.8 3.5 16.5 15.5 95 100 A M G < S+ 0 0 51 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.2 0.638 108.5 45.9 -73.7 -15.4 0.5 16.9 17.9 96 101 A V G < S+ 0 0 98 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.2 0.247 73.8 122.1-126.5 5.1 0.7 13.4 19.4 97 102 A I < - 0 0 25 -3,-0.7 -3,-0.0 -4,-0.4 -71,-0.0 -0.439 51.2-147.9 -65.6 146.4 4.5 12.9 20.1 98 103 A E + 0 0 131 -2,-0.1 3,-0.5 1,-0.1 8,-0.1 -0.892 22.9 172.1-125.6 96.9 4.9 12.1 23.8 99 104 A P + 0 0 0 0, 0.0 3,-0.3 0, 0.0 10,-0.2 0.137 52.9 92.9 -98.0 22.6 8.2 13.5 25.1 100 105 A F S S+ 0 0 14 1,-0.2 3,-0.1 5,-0.1 -2,-0.0 0.598 82.0 48.7 -91.6 -13.9 7.8 12.9 28.8 101 106 A F S S+ 0 0 139 -3,-0.5 2,-0.4 1,-0.1 -1,-0.2 0.333 101.2 63.6-112.6 5.2 9.4 9.4 29.2 102 107 A D S >> S- 0 0 86 -3,-0.3 4,-2.8 1,-0.1 3,-0.6 -0.978 73.4-145.4-132.1 116.0 12.7 10.0 27.3 103 108 A V H 3> S+ 0 0 70 -2,-0.4 4,-3.3 1,-0.3 5,-0.2 0.858 98.0 52.5 -55.3 -40.4 15.0 12.6 28.9 104 109 A A H 3> S+ 0 0 32 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.875 113.2 43.0 -61.8 -41.3 16.3 13.9 25.5 105 110 A L H <> S+ 0 0 19 -3,-0.6 4,-2.1 2,-0.2 -2,-0.2 0.893 115.6 50.5 -72.8 -36.1 12.8 14.4 24.1 106 111 A F H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.958 108.7 50.2 -64.9 -50.7 11.7 16.0 27.4 107 112 A V H X S+ 0 0 21 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.931 111.0 50.4 -50.3 -47.0 14.7 18.3 27.5 108 113 A S H X S+ 0 0 1 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.867 111.0 49.8 -60.6 -35.8 13.8 19.3 23.9 109 114 A F H X S+ 0 0 0 -4,-2.1 4,-2.2 -10,-0.2 -1,-0.2 0.877 107.6 51.8 -71.6 -39.8 10.3 19.9 25.0 110 115 A L H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.915 105.9 56.9 -62.2 -41.2 11.2 22.1 28.0 111 116 A R H X S+ 0 0 15 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.895 108.1 46.9 -57.0 -40.2 13.4 24.1 25.6 112 117 A G H X S+ 0 0 0 -4,-1.4 4,-1.9 1,-0.2 5,-0.3 0.892 110.9 51.0 -69.7 -42.1 10.3 24.8 23.5 113 118 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 5,-0.4 0.918 113.5 45.4 -56.3 -45.0 8.1 25.7 26.5 114 119 A F H X S+ 0 0 0 -4,-2.4 4,-1.5 3,-0.2 -2,-0.2 0.889 112.6 47.4 -75.8 -42.7 10.6 28.2 27.8 115 120 A L H < S+ 0 0 0 -4,-2.0 -59,-0.3 -5,-0.2 -1,-0.2 0.957 122.8 34.9 -54.9 -53.0 11.5 30.0 24.6 116 121 A S H < S+ 0 0 4 -4,-1.9 -64,-0.4 -5,-0.2 -2,-0.2 0.798 140.8 7.2 -81.1 -34.5 7.8 30.4 23.6 117 122 A G H < S+ 0 0 7 -4,-2.7 15,-2.8 -5,-0.3 -3,-0.2 0.354 102.9 103.7-133.2 7.1 6.1 30.9 27.0 118 123 A G E < +J 131 0C 3 -4,-1.5 2,-0.3 -5,-0.4 13,-0.2 -0.577 34.7 170.0 -97.2 153.2 8.9 31.2 29.6 119 124 A S E -J 130 0C 47 11,-2.4 11,-2.5 -2,-0.2 2,-0.4 -0.979 11.1-161.2-153.6 160.6 10.5 34.1 31.5 120 125 A M E -J 129 0C 12 -2,-0.3 -110,-0.3 9,-0.2 9,-0.2 -0.998 19.8-123.2-145.4 137.1 12.8 34.6 34.3 121 126 A T - 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