==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 02-FEB-03 1NV8 . COMPND 2 MOLECULE: HEMK PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR H.L.SCHUBERT,J.D.PHILLIPS,C.P.HILL . 542 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26727.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 365 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 8.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 6.3 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 1 0.2 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 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 167 30.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.0 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 2 2 0 1 0 5 0 1 0 4 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 4 4 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 0 0 4 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 12 A R 0 0 205 0, 0.0 46,-0.8 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 -44.5 22.2 -12.9 -43.3 2 13 A K >> - 0 0 91 1,-0.1 4,-1.2 43,-0.1 3,-0.5 -0.713 360.0-143.4 -79.9 126.6 22.5 -9.8 -41.1 3 14 A I H 3> S+ 0 0 9 -2,-0.5 4,-2.1 1,-0.2 -1,-0.1 0.715 88.7 56.7 -67.9 -33.3 22.9 -11.2 -37.5 4 15 A W H 3> S+ 0 0 80 40,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.773 105.6 49.7 -73.5 -32.4 21.0 -8.6 -35.5 5 16 A S H <> S+ 0 0 62 -3,-0.5 4,-2.5 2,-0.2 5,-0.2 0.828 110.9 52.7 -74.2 -27.8 17.7 -9.1 -37.4 6 17 A L H X S+ 0 0 15 -4,-1.2 4,-2.8 2,-0.2 5,-0.2 0.956 109.7 48.5 -63.4 -46.7 18.2 -12.8 -36.8 7 18 A I H X S+ 0 0 7 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.920 113.4 46.9 -61.2 -43.1 18.6 -12.0 -33.1 8 19 A R H X S+ 0 0 163 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.925 114.6 44.7 -65.7 -48.9 15.5 -9.9 -33.0 9 20 A D H X S+ 0 0 96 -4,-2.5 4,-0.8 1,-0.2 -1,-0.2 0.858 114.9 49.8 -65.9 -36.9 13.3 -12.4 -34.9 10 21 A C H >X S+ 0 0 1 -4,-2.8 3,-1.0 -5,-0.2 4,-0.6 0.933 101.6 61.8 -66.0 -37.6 14.6 -15.3 -32.8 11 22 A S H >< S+ 0 0 15 -4,-2.1 3,-1.3 1,-0.3 4,-0.2 0.890 99.9 55.6 -59.8 -38.7 14.0 -13.5 -29.5 12 23 A G H >< S+ 0 0 42 -4,-1.3 3,-1.1 1,-0.3 -1,-0.3 0.826 99.1 60.1 -62.3 -31.7 10.3 -13.4 -30.2 13 24 A K H << S+ 0 0 119 -3,-1.0 -1,-0.3 -4,-0.8 3,-0.2 0.709 103.5 51.7 -70.9 -13.2 10.1 -17.1 -30.7 14 25 A L T XX S+ 0 0 0 -3,-1.3 3,-1.8 -4,-0.6 4,-1.6 0.331 75.3 110.9-103.8 5.2 11.3 -17.7 -27.1 15 26 A E T <4 S+ 0 0 126 -3,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.800 80.9 42.0 -44.9 -45.6 8.7 -15.4 -25.5 16 27 A G T 34 S+ 0 0 85 -3,-0.2 -1,-0.3 -4,-0.2 3,-0.1 0.309 114.1 50.8 -91.5 6.3 6.7 -18.2 -23.8 17 28 A V T <4 S+ 0 0 45 -3,-1.8 2,-0.3 1,-0.3 -2,-0.2 0.635 117.5 14.4-111.9 -24.9 9.7 -20.2 -22.6 18 29 A T < - 0 0 20 -4,-1.6 -1,-0.3 1,-0.1 3,-0.3 -0.984 53.9-135.5-151.5 155.0 11.8 -17.5 -20.9 19 30 A E S S+ 0 0 193 -2,-0.3 2,-0.3 1,-0.2 -4,-0.1 0.575 105.4 51.0 -80.3 -19.6 11.7 -13.9 -19.5 20 31 A T > + 0 0 68 1,-0.1 4,-1.9 -6,-0.1 -1,-0.2 -0.549 62.3 152.3-119.1 65.0 15.1 -13.1 -21.1 21 32 A S H > S+ 0 0 12 -3,-0.3 4,-2.5 -2,-0.3 5,-0.3 0.885 71.3 54.8 -69.5 -38.2 14.7 -14.1 -24.8 22 33 A V H > S+ 0 0 75 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.967 110.7 48.4 -59.3 -43.1 17.2 -11.7 -26.3 23 34 A L H > S+ 0 0 88 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.908 110.0 49.9 -64.4 -43.2 19.9 -13.0 -23.9 24 35 A E H X S+ 0 0 12 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.899 111.5 48.2 -66.3 -38.4 19.2 -16.6 -24.6 25 36 A V H X S+ 0 0 0 -4,-2.5 4,-3.7 2,-0.2 5,-0.3 0.945 110.6 53.0 -64.7 -44.8 19.4 -16.0 -28.4 26 37 A L H X S+ 0 0 32 -4,-2.9 4,-2.1 -5,-0.3 -2,-0.2 0.904 112.1 45.3 -53.6 -40.7 22.7 -14.0 -27.8 27 38 A L H X S+ 0 0 32 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.897 114.6 47.5 -71.8 -41.0 24.1 -17.0 -25.9 28 39 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.952 111.1 51.6 -66.9 -40.5 22.9 -19.5 -28.5 29 40 A V H X S+ 0 0 1 -4,-3.7 4,-3.0 1,-0.2 5,-0.2 0.942 112.5 45.5 -60.5 -46.4 24.3 -17.3 -31.3 30 41 A S H X>S+ 0 0 16 -4,-2.1 4,-1.4 -5,-0.3 5,-1.3 0.928 109.8 54.7 -61.9 -46.7 27.7 -17.2 -29.5 31 42 A R H <5S+ 0 0 129 -4,-2.7 3,-0.4 2,-0.2 -1,-0.2 0.954 114.2 41.0 -56.3 -46.9 27.6 -20.9 -28.8 32 43 A V H <5S+ 0 0 31 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.964 116.2 45.6 -71.5 -45.6 27.1 -21.7 -32.6 33 44 A L H <5S- 0 0 28 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.597 105.1-130.6 -71.1 -8.4 29.5 -19.1 -34.1 34 45 A G T <5 + 0 0 67 -4,-1.4 -3,-0.2 -3,-0.4 2,-0.2 0.866 67.2 123.2 66.8 39.5 32.0 -20.3 -31.4 35 46 A I < - 0 0 82 -5,-1.3 2,-0.5 -6,-0.1 -1,-0.2 -0.357 66.8 -86.5-120.9-168.2 32.7 -16.7 -30.5 36 47 A R > - 0 0 161 -2,-0.2 3,-2.1 1,-0.1 4,-0.5 -0.942 22.8-124.8-117.4 133.1 32.4 -14.9 -27.2 37 48 A K G > S+ 0 0 111 -2,-0.5 3,-0.7 1,-0.3 -1,-0.1 0.783 115.5 53.5 -26.7 -44.5 29.3 -13.3 -25.6 38 49 A E G > S+ 0 0 97 1,-0.2 3,-0.8 2,-0.1 -1,-0.3 0.814 102.0 55.2 -72.2 -32.1 31.4 -10.2 -25.4 39 50 A D G < S+ 0 0 88 -3,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.316 80.1 90.3 -92.9 10.1 32.5 -10.0 -29.1 40 51 A L G < + 0 0 7 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.1 0.478 60.5 94.9 -78.7 -4.5 29.0 -10.1 -30.5 41 52 A F < + 0 0 136 -3,-0.8 2,-0.7 2,-0.0 -1,-0.2 0.155 43.9 129.4 -87.0 28.4 29.0 -6.3 -30.4 42 53 A L - 0 0 124 -3,-0.5 -3,-0.0 3,-0.1 0, 0.0 -0.702 57.1-140.3 -75.4 114.3 30.1 -5.8 -34.0 43 54 A K S S+ 0 0 207 -2,-0.7 -1,-0.1 1,-0.2 -39,-0.1 0.504 82.4 28.5 -58.9 -16.3 27.5 -3.3 -35.3 44 55 A D S S- 0 0 106 1,-0.2 -40,-0.4 -41,-0.0 2,-0.2 0.858 107.7 -31.1-107.4 -59.3 26.9 -4.7 -38.9 45 56 A L + 0 0 97 -43,-0.1 -1,-0.2 -42,-0.1 -3,-0.1 -0.650 32.7 158.2-152.0 173.9 27.4 -8.4 -39.4 46 57 A G + 0 0 49 -45,-0.4 2,-0.4 -2,-0.2 -44,-0.1 0.498 42.4 117.4 163.2 11.3 28.8 -11.9 -39.0 47 58 A V - 0 0 16 -46,-0.8 -1,-0.1 4,-0.0 -14,-0.0 -0.867 35.2-159.6-124.5 125.1 26.7 -15.0 -40.2 48 59 A S > - 0 0 42 -2,-0.4 4,-2.9 1,-0.1 5,-0.1 -0.248 36.0-108.2 -79.0 158.7 26.9 -17.9 -42.8 49 60 A P H > S+ 0 0 104 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.851 120.7 47.1 -57.4 -41.1 24.0 -20.1 -44.2 50 61 A T H > S+ 0 0 117 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.967 114.3 49.7 -63.7 -49.6 25.0 -23.3 -42.3 51 62 A E H > S+ 0 0 60 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.913 108.3 54.2 -53.5 -41.0 25.3 -21.0 -39.2 52 63 A E H X S+ 0 0 68 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.901 109.8 43.8 -61.1 -46.0 21.9 -19.5 -39.8 53 64 A K H X S+ 0 0 129 -4,-1.7 4,-3.4 -3,-0.3 -1,-0.2 0.913 111.1 56.3 -68.0 -43.9 19.9 -22.8 -40.0 54 65 A R H X S+ 0 0 127 -4,-2.3 4,-3.3 1,-0.2 5,-0.3 0.952 107.8 47.3 -50.8 -53.5 21.8 -24.1 -37.0 55 66 A I H X S+ 0 0 2 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.894 114.0 46.9 -59.0 -44.4 20.7 -21.2 -34.8 56 67 A L H X S+ 0 0 60 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.916 110.8 52.6 -65.6 -45.0 17.1 -21.5 -36.0 57 68 A E H X S+ 0 0 89 -4,-3.4 4,-2.7 2,-0.2 -2,-0.2 0.979 114.0 42.9 -46.7 -57.6 17.2 -25.2 -35.3 58 69 A L H X S+ 0 0 14 -4,-3.3 4,-2.4 1,-0.2 -2,-0.2 0.875 113.0 53.5 -63.7 -32.4 18.5 -24.6 -31.7 59 70 A V H X S+ 0 0 0 -4,-2.7 4,-2.8 -5,-0.3 -1,-0.2 0.915 108.8 47.6 -68.3 -42.9 16.0 -21.7 -31.3 60 71 A E H X S+ 0 0 158 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.958 111.9 52.3 -61.0 -46.3 13.0 -24.0 -32.3 61 72 A K H <>S+ 0 0 93 -4,-2.7 5,-1.2 2,-0.2 3,-0.4 0.903 110.7 46.4 -45.6 -50.9 14.4 -26.6 -29.9 62 73 A R H ><5S+ 0 0 29 -4,-2.4 3,-2.7 1,-0.2 -2,-0.2 0.931 104.6 60.5 -68.3 -46.1 14.5 -24.1 -27.1 63 74 A A H 3<5S+ 0 0 40 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.823 95.3 63.9 -44.9 -36.9 11.0 -22.9 -27.9 64 75 A S T 3<5S- 0 0 77 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.686 126.8-102.3 -60.7 -17.3 9.9 -26.5 -27.1 65 76 A G T < 5 + 0 0 26 -3,-2.7 -3,-0.2 -4,-0.4 -2,-0.1 0.306 69.9 153.7 106.2 -3.4 11.1 -25.8 -23.5 66 77 A Y < - 0 0 21 -5,-1.2 -1,-0.3 1,-0.1 2,-0.1 -0.282 56.7 -88.0 -51.4 134.9 14.4 -27.8 -23.8 67 78 A P >> - 0 0 25 0, 0.0 4,-1.5 0, 0.0 3,-0.8 -0.260 25.3-142.9 -63.5 129.5 17.0 -26.5 -21.4 68 79 A L H 3> S+ 0 0 18 1,-0.2 4,-2.5 2,-0.2 3,-0.4 0.918 99.6 55.5 -50.6 -44.6 19.2 -23.8 -22.6 69 80 A H H 3>>S+ 0 0 47 1,-0.3 4,-1.8 2,-0.3 5,-0.7 0.721 100.2 59.8 -79.0 -13.8 22.3 -25.1 -20.8 70 81 A Y H <45S+ 0 0 16 -3,-0.8 -1,-0.3 2,-0.2 -2,-0.2 0.953 109.6 43.6 -67.8 -42.9 21.9 -28.4 -22.6 71 82 A I H <5S+ 0 0 15 -4,-1.5 -2,-0.3 -3,-0.4 -1,-0.2 0.893 116.4 46.9 -64.9 -44.0 22.2 -26.4 -25.8 72 83 A L H <5S- 0 0 26 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.797 98.7-139.6 -69.8 -24.5 25.1 -24.3 -24.4 73 84 A G T <5S+ 0 0 13 -4,-1.8 11,-0.9 -5,-0.2 2,-0.3 0.601 74.0 65.6 79.1 14.5 26.9 -27.5 -23.1 74 85 A E E < -A 83 0A 88 -5,-0.7 2,-0.3 9,-0.3 9,-0.2 -0.985 58.2-160.2-164.9 152.6 27.9 -25.6 -19.8 75 86 A K E -A 82 0A 45 7,-1.9 7,-2.7 -2,-0.3 2,-0.4 -0.987 23.8-127.2-147.9 134.3 26.4 -24.0 -16.7 76 87 A E E +A 81 0A 116 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.681 35.1 168.0 -81.3 127.7 28.0 -21.4 -14.4 77 88 A F E > -A 80 0A 2 3,-3.1 3,-1.6 -2,-0.4 -2,-0.1 -0.962 67.3 -8.2-148.1 129.0 28.0 -22.4 -10.7 78 89 A M T 3 S- 0 0 34 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.862 129.0 -58.3 50.5 42.8 29.9 -20.8 -7.9 79 90 A G T 3 S+ 0 0 53 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.639 118.2 112.3 63.5 14.9 31.7 -18.8 -10.5 80 91 A L E < -A 77 0A 21 -3,-1.6 -3,-3.1 43,-0.0 2,-0.9 -0.906 69.7-121.9-118.0 152.6 32.9 -22.0 -12.2 81 92 A S E -A 76 0A 20 -2,-0.3 2,-0.6 -5,-0.2 -5,-0.2 -0.801 28.1-169.4 -92.2 107.2 32.0 -23.4 -15.6 82 93 A F E -A 75 0A 0 -7,-2.7 -7,-1.9 -2,-0.9 40,-0.1 -0.854 20.5-128.1 -90.9 123.8 30.5 -26.9 -15.3 83 94 A L E -A 74 0A 43 -2,-0.6 -9,-0.3 -9,-0.2 2,-0.3 -0.371 33.3-179.4 -59.1 137.9 30.0 -29.0 -18.5 84 95 A V + 0 0 2 -11,-0.9 2,-0.3 -15,-0.3 6,-0.1 -0.946 7.0 176.7-138.2 165.5 26.4 -30.4 -18.7 85 96 A E > - 0 0 75 -2,-0.3 3,-1.9 3,-0.1 -15,-0.1 -0.972 48.2 -64.1-159.7 158.2 24.7 -32.5 -21.2 86 97 A E T 3 S+ 0 0 119 -2,-0.3 117,-0.1 1,-0.3 3,-0.1 -0.228 123.0 40.1 -46.5 128.0 21.4 -34.2 -21.8 87 98 A G T 3 S+ 0 0 26 115,-0.4 2,-0.4 1,-0.2 -1,-0.3 0.299 98.1 87.9 100.3 -5.0 21.2 -36.8 -19.0 88 99 A V S < S- 0 0 1 -3,-1.9 -1,-0.2 56,-0.1 2,-0.1 -0.981 80.9-111.1-128.4 136.7 22.6 -34.6 -16.1 89 100 A F - 0 0 0 -2,-0.4 32,-0.5 114,-0.1 -4,-0.0 -0.434 34.4-124.3 -58.0 136.9 20.8 -32.4 -13.8 90 101 A V - 0 0 9 -2,-0.1 -1,-0.1 30,-0.1 -6,-0.1 -0.701 32.8-107.9 -92.6 124.6 21.8 -28.7 -14.5 91 102 A P - 0 0 1 0, 0.0 -1,-0.1 0, 0.0 -15,-0.1 -0.317 32.0-141.4 -61.4 134.9 23.1 -27.1 -11.3 92 103 A R > - 0 0 53 450,-0.2 3,-1.1 1,-0.1 4,-0.4 -0.726 15.3-125.4 -95.5 149.2 20.8 -24.5 -9.7 93 104 A P T > S+ 0 0 70 0, 0.0 3,-1.2 0, 0.0 4,-0.5 0.775 106.7 67.2 -64.8 -32.0 21.8 -21.2 -8.0 94 105 A E T >> S+ 0 0 80 1,-0.3 3,-1.0 2,-0.2 4,-0.5 0.802 93.4 60.1 -53.4 -40.7 20.0 -22.1 -4.8 95 106 A T H <> S+ 0 0 0 -3,-1.1 4,-1.9 1,-0.3 3,-0.3 0.685 86.9 75.2 -65.4 -19.4 22.6 -24.9 -4.3 96 107 A E H <> S+ 0 0 53 -3,-1.2 4,-1.8 -4,-0.4 -1,-0.3 0.855 89.2 58.2 -59.8 -38.7 25.3 -22.4 -4.2 97 108 A E H <> S+ 0 0 38 -3,-1.0 4,-2.3 -4,-0.5 -1,-0.2 0.853 101.0 55.2 -66.8 -37.3 24.2 -21.5 -0.8 98 109 A L H X S+ 0 0 0 -4,-0.5 4,-2.7 -3,-0.3 5,-0.2 0.949 108.6 50.0 -52.7 -47.3 24.8 -25.1 0.4 99 110 A V H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.902 108.8 49.6 -62.7 -36.4 28.3 -24.9 -0.8 100 111 A E H X S+ 0 0 99 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.938 112.5 48.3 -70.0 -43.6 29.0 -21.6 1.0 101 112 A L H X S+ 0 0 42 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.897 111.8 51.2 -56.6 -43.0 27.6 -23.1 4.3 102 113 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.919 109.3 48.0 -61.0 -44.0 29.7 -26.2 3.7 103 114 A L H X S+ 0 0 20 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.891 110.3 53.0 -65.8 -35.4 32.9 -24.2 3.2 104 115 A E H X S+ 0 0 103 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.919 109.0 48.4 -72.8 -38.5 32.1 -22.1 6.3 105 116 A L H X S+ 0 0 21 -4,-2.3 4,-1.7 1,-0.2 6,-0.3 0.842 110.9 52.6 -67.5 -28.5 31.7 -25.4 8.4 106 117 A I H X>S+ 0 0 16 -4,-2.0 4,-1.5 2,-0.2 5,-0.7 0.877 111.1 46.5 -68.5 -40.5 35.1 -26.6 6.9 107 118 A R H <5S+ 0 0 178 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.911 113.6 48.4 -66.9 -46.9 36.8 -23.4 7.9 108 119 A K H <5S+ 0 0 147 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.835 124.1 27.8 -64.7 -34.0 35.3 -23.5 11.4 109 120 A Y H <5S- 0 0 72 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.463 99.1-117.7-113.5 -5.8 36.2 -27.1 12.2 110 121 A G T <5 - 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