==== 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 BIOSYNTHETIC PROTEIN 11-SEP-01 1JY8 . COMPND 2 MOLECULE: 2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTH . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.STEINBACHER,J.KAISER,J.WUNGSINTAWEEKUL,S.HECHT,W.EISENREIC . 155 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7550.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 106 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 18.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 7 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 38 24.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.6 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 0 0 0 0 0 0 1 0 0 2 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 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 PARALLEL BRIDGES PER LADDER . 0 1 1 0 0 0 0 1 0 1 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 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 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 0 177 0, 0.0 2,-0.4 0, 0.0 154,-0.2 0.000 360.0 360.0 360.0 135.0 29.0 35.3 29.1 2 2 A R E -A 154 0A 110 152,-2.6 152,-2.9 2,-0.0 2,-0.3 -0.952 360.0-143.8-125.8 144.7 25.9 34.3 27.2 3 3 A I E -A 153 0A 136 -2,-0.4 2,-0.3 150,-0.2 150,-0.2 -0.794 16.8-175.2-107.7 146.2 24.9 31.0 25.6 4 4 A G E -A 152 0A 6 148,-2.4 148,-2.0 -2,-0.3 2,-0.3 -0.974 8.0-164.1-140.5 155.3 23.0 30.5 22.4 5 5 A H E -A 151 0A 104 41,-0.3 2,-0.3 -2,-0.3 146,-0.2 -0.999 6.9-177.9-141.1 138.7 21.5 27.5 20.4 6 6 A G E -A 150 0A 3 144,-2.9 144,-2.2 -2,-0.3 2,-0.3 -0.935 5.4-175.0-135.7 154.6 20.2 27.2 16.8 7 7 A F E +A 149 0A 101 -2,-0.3 2,-0.3 142,-0.2 142,-0.2 -0.978 10.3 171.6-148.1 135.8 18.7 24.4 14.7 8 8 A D E -A 148 0A 33 140,-2.3 140,-1.8 -2,-0.3 2,-0.3 -0.982 11.6-167.5-146.8 156.2 17.8 24.4 11.0 9 9 A V E -A 147 0A 51 -2,-0.3 2,-0.3 138,-0.2 138,-0.2 -0.991 3.4-177.2-144.4 141.6 16.6 22.0 8.3 10 10 A H E -A 146 0A 35 136,-1.9 136,-2.1 -2,-0.3 2,-0.3 -0.991 22.8-128.1-141.1 138.4 16.4 22.3 4.5 11 11 A A E -A 145 0A 50 21,-0.5 21,-3.5 -2,-0.3 134,-0.3 -0.644 26.2-110.1 -88.2 148.0 15.0 19.8 2.0 12 12 A F E +D 31 0B 23 132,-1.9 19,-0.3 -2,-0.3 2,-0.3 -0.447 49.6 151.8 -72.3 149.1 16.9 18.5 -1.0 13 13 A G E + 0 0 22 17,-2.6 17,-0.3 -2,-0.1 2,-0.0 -0.833 41.7 1.7-178.4 136.6 15.6 19.6 -4.4 14 14 A G E S- 0 0 53 -2,-0.3 16,-0.8 15,-0.1 2,-0.2 -0.290 97.6 -32.5 80.0-163.4 17.0 20.2 -7.8 15 15 A E E S-D 29 0B 167 14,-0.3 14,-0.2 1,-0.1 16,-0.2 -0.561 76.7 -92.4 -92.0 157.8 20.5 19.7 -9.0 16 16 A G + 0 0 30 12,-1.1 14,-0.2 11,-0.5 2,-0.2 -0.017 68.4 100.2 -75.1-172.5 23.6 20.2 -6.8 17 17 A P - 0 0 36 0, 0.0 14,-0.4 0, 0.0 2,-0.3 0.596 50.2-151.3 -82.9-175.8 25.9 21.4 -5.5 18 18 A I E -E 25 0C 3 7,-2.5 7,-3.6 12,-0.2 2,-0.6 -0.820 9.3-134.8-115.5 155.2 24.9 22.4 -1.9 19 19 A I E +E 24 0C 37 17,-0.4 2,-0.4 -2,-0.3 20,-0.3 -0.978 29.8 171.2-112.6 115.7 26.4 25.2 0.1 20 20 A I E > S-E 23 0C 1 3,-2.4 3,-1.9 -2,-0.6 18,-0.1 -0.988 72.0 -9.1-128.5 121.3 27.2 24.2 3.7 21 21 A G T 3 S- 0 0 1 -2,-0.4 95,-0.2 1,-0.3 94,-0.2 0.861 130.9 -57.7 63.1 29.7 29.2 26.5 6.0 22 22 A G T 3 S+ 0 0 16 1,-0.2 2,-0.4 93,-0.1 -1,-0.3 0.262 112.1 122.1 84.3 -10.7 29.9 28.6 2.9 23 23 A V E < -E 20 0C 14 -3,-1.9 -3,-2.4 85,-0.1 2,-0.8 -0.692 63.5-131.1 -91.8 133.4 31.5 25.7 1.0 24 24 A R E -E 19 0C 183 -2,-0.4 -5,-0.2 -5,-0.2 -1,-0.0 -0.747 31.9-169.0 -81.0 108.7 30.1 24.6 -2.4 25 25 A I E -E 18 0C 1 -7,-3.6 -7,-2.5 -2,-0.8 2,-0.1 -0.912 21.5-120.0-106.8 124.8 29.9 20.8 -1.9 26 26 A P + 0 0 99 0, 0.0 2,-0.3 0, 0.0 3,-0.1 -0.389 47.0 151.9 -64.4 135.2 29.3 18.6 -4.9 27 27 A Y - 0 0 37 1,-0.1 -11,-0.5 -2,-0.1 -2,-0.0 -0.979 54.5-116.5-160.6 152.3 26.1 16.5 -4.6 28 28 A E S S+ 0 0 138 -2,-0.3 -12,-1.1 -13,-0.1 2,-0.2 0.942 102.4 32.5 -54.7 -52.4 23.5 14.8 -6.8 29 29 A K E S-D 15 0B 54 -14,-0.2 -14,-0.3 -3,-0.1 2,-0.2 -0.635 75.7-141.4-106.9 161.2 20.7 17.0 -5.4 30 30 A G E - 0 0 3 -16,-0.8 -17,-2.6 -17,-0.3 2,-0.4 -0.430 27.3 -96.2-107.3-172.8 20.7 20.6 -4.1 31 31 A L E -D 12 0B 25 -14,-0.4 2,-0.4 -19,-0.3 -19,-0.3 -0.925 26.3-133.6-113.9 135.4 18.9 22.2 -1.2 32 32 A L + 0 0 100 -21,-3.5 -21,-0.5 -2,-0.4 2,-0.3 -0.705 47.1 123.4 -86.2 131.1 15.6 24.1 -1.4 33 33 A A - 0 0 44 -2,-0.4 37,-0.1 2,-0.2 -23,-0.0 -0.967 67.9-106.2-174.8 164.1 15.4 27.5 0.4 34 34 A H S S+ 0 0 51 -2,-0.3 36,-2.8 35,-0.1 37,-0.3 0.923 111.7 28.5 -64.2 -48.4 14.7 31.3 0.0 35 35 A S S S- 0 0 14 34,-0.3 -2,-0.2 35,-0.2 37,-0.2 0.058 128.7 -61.0 -89.6-154.5 18.4 32.1 0.3 36 36 A D S S- 0 0 40 35,-2.1 -17,-0.4 34,-0.1 -5,-0.2 0.469 71.4-122.0 -73.0 -2.9 21.2 29.7 -0.8 37 37 A G + 0 0 0 1,-0.2 2,-1.2 34,-0.2 3,-0.1 0.642 44.4 173.5 71.9 20.2 19.8 27.3 1.9 38 38 A D > - 0 0 0 1,-0.2 4,-2.0 2,-0.1 -1,-0.2 -0.402 10.4-172.3 -64.2 94.3 23.0 27.0 3.9 39 39 A V H > S+ 0 0 0 -2,-1.2 4,-2.0 -20,-0.3 -1,-0.2 0.819 79.2 53.6 -58.2 -36.3 21.7 25.0 6.8 40 40 A A H > S+ 0 0 3 -21,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.904 110.6 43.1 -69.0 -44.6 24.9 25.3 8.8 41 41 A L H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.843 112.6 53.6 -73.2 -30.5 25.2 29.0 8.7 42 42 A H H X S+ 0 0 14 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.966 111.6 45.1 -65.8 -50.3 21.5 29.5 9.4 43 43 A A H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.941 114.2 49.8 -58.2 -45.3 21.8 27.4 12.5 44 44 A L H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.910 109.2 52.4 -59.5 -42.9 25.0 29.2 13.5 45 45 A T H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.918 108.1 50.0 -60.2 -45.2 23.3 32.5 13.0 46 46 A D H X S+ 0 0 32 -4,-2.4 4,-2.5 1,-0.2 -41,-0.3 0.838 108.4 54.2 -62.4 -35.5 20.3 31.6 15.3 47 47 A A H X S+ 0 0 0 -4,-1.8 4,-2.2 -5,-0.2 105,-0.3 0.927 112.6 42.2 -63.8 -46.8 22.8 30.5 17.9 48 48 A L H X S+ 0 0 0 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.920 117.0 46.5 -66.3 -46.6 24.6 33.8 17.9 49 49 A L H X>S+ 0 0 0 -4,-2.9 5,-3.0 1,-0.2 4,-0.5 0.899 112.5 52.4 -63.2 -40.5 21.4 35.9 17.7 50 50 A G H ><5S+ 0 0 29 -4,-2.5 3,-1.2 -5,-0.3 -2,-0.2 0.923 107.5 49.7 -61.1 -45.7 19.9 33.7 20.5 51 51 A A H 3<5S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.802 113.6 47.9 -63.3 -28.9 22.9 34.3 22.8 52 52 A A H 3<5S- 0 0 0 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.497 111.3-123.4 -88.9 -3.5 22.5 38.0 22.1 53 53 A A T <<5S+ 0 0 57 -3,-1.2 -3,-0.2 -4,-0.5 -2,-0.1 0.919 73.5 129.9 59.3 42.0 18.8 37.9 22.7 54 54 A L < - 0 0 37 -5,-3.0 2,-0.6 1,-0.3 -4,-0.2 0.313 66.8-122.3-105.9 6.6 18.2 39.3 19.3 55 55 A G - 0 0 37 -6,-0.5 2,-0.3 -5,-0.1 -1,-0.3 -0.825 46.3 -49.9 98.5-123.4 15.6 36.7 18.2 56 56 A D >> - 0 0 75 -2,-0.6 4,-1.4 -7,-0.1 3,-0.6 -0.956 48.8 -92.7-151.6 170.7 16.3 34.6 15.2 57 57 A I H 3> S+ 0 0 28 -2,-0.3 4,-2.7 1,-0.2 3,-0.1 0.826 118.7 54.3 -56.5 -40.3 17.2 34.7 11.5 58 58 A G H 34 S+ 0 0 33 1,-0.2 -1,-0.2 2,-0.2 5,-0.1 0.850 105.6 53.8 -66.6 -33.4 13.7 34.8 10.2 59 59 A K H <4 S+ 0 0 144 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.874 117.7 35.6 -67.6 -40.1 12.9 37.9 12.3 60 60 A L H < S+ 0 0 25 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.766 131.1 29.0 -83.7 -33.1 15.9 39.8 10.9 61 61 A F S < S- 0 0 14 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.1 -0.622 88.0-147.6-133.4 78.1 15.8 38.5 7.3 62 62 A P - 0 0 44 0, 0.0 3,-0.3 0, 0.0 6,-0.3 -0.076 15.8-135.1 -50.0 134.8 12.1 37.6 6.4 63 63 A D S S+ 0 0 128 1,-0.2 -5,-0.0 -5,-0.1 5,-0.0 0.734 108.2 55.4 -57.9 -29.2 11.3 34.7 3.9 64 64 A T S S+ 0 0 125 2,-0.0 -1,-0.2 3,-0.0 5,-0.1 0.878 82.3 92.9 -74.0 -42.5 8.9 37.2 2.4 65 65 A D > - 0 0 63 -3,-0.3 3,-1.8 1,-0.2 0, 0.0 -0.406 67.0-152.3 -61.2 112.5 11.3 40.0 1.6 66 66 A P G > S+ 0 0 107 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 0.560 86.5 80.0 -62.9 -11.4 12.6 39.3 -2.0 67 67 A A G 3 S+ 0 0 72 1,-0.3 -2,-0.1 3,-0.0 -3,-0.0 0.743 91.1 52.7 -69.3 -22.4 15.8 41.1 -1.1 68 68 A F G X S+ 0 0 37 -3,-1.8 3,-1.0 -6,-0.3 2,-0.6 0.194 78.2 124.7 -99.0 14.8 16.9 37.8 0.6 69 69 A K T < S- 0 0 165 -3,-1.4 -34,-0.3 1,-0.3 3,-0.1 -0.679 90.3 -2.4 -81.2 122.6 16.2 35.6 -2.4 70 70 A G T 3 S+ 0 0 55 -36,-2.8 -1,-0.3 -2,-0.6 -35,-0.2 0.495 99.6 171.2 76.4 6.4 19.3 33.6 -3.4 71 71 A A < - 0 0 14 -3,-1.0 -35,-2.1 -37,-0.3 2,-0.8 -0.035 41.9-112.1 -52.2 144.9 21.0 35.5 -0.6 72 72 A D >> - 0 0 59 1,-0.2 3,-1.8 -37,-0.2 4,-1.5 -0.736 21.2-147.9 -80.0 110.9 24.5 34.5 0.5 73 73 A S H 3> S+ 0 0 0 -2,-0.8 4,-2.0 1,-0.3 -1,-0.2 0.708 98.4 62.6 -55.5 -19.3 24.0 33.1 4.0 74 74 A R H 3> S+ 0 0 34 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.835 99.8 53.2 -73.4 -33.0 27.5 34.4 4.8 75 75 A E H <> S+ 0 0 116 -3,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.913 111.0 46.4 -65.4 -41.3 26.1 37.9 4.1 76 76 A L H X S+ 0 0 16 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.861 111.1 52.7 -67.3 -37.5 23.3 37.2 6.6 77 77 A L H X S+ 0 0 0 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.958 109.8 47.3 -63.4 -49.8 25.8 35.8 9.1 78 78 A R H X S+ 0 0 94 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.891 112.8 48.8 -59.1 -42.3 28.0 38.9 8.9 79 79 A E H X S+ 0 0 50 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.913 111.6 48.2 -64.3 -45.6 25.1 41.3 9.3 80 80 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.889 113.9 49.4 -61.5 -37.0 23.7 39.4 12.2 81 81 A W H X S+ 0 0 12 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.894 107.7 53.3 -69.2 -39.5 27.2 39.5 13.7 82 82 A R H X S+ 0 0 129 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.967 111.9 45.1 -59.2 -51.8 27.5 43.2 13.1 83 83 A R H X S+ 0 0 94 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.896 111.5 53.2 -59.9 -40.5 24.3 43.8 15.0 84 84 A I H ><>S+ 0 0 0 -4,-2.2 5,-1.6 1,-0.2 3,-0.5 0.936 108.6 49.0 -61.4 -46.1 25.3 41.5 17.7 85 85 A Q H ><5S+ 0 0 93 -4,-2.8 3,-1.5 1,-0.3 -1,-0.2 0.852 106.4 57.7 -61.9 -34.1 28.6 43.3 18.2 86 86 A A H 3<5S+ 0 0 78 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.829 98.2 58.8 -66.1 -32.6 26.7 46.6 18.3 87 87 A K T <<5S- 0 0 101 -4,-1.5 -1,-0.3 -3,-0.5 -2,-0.2 0.513 131.0-100.4 -72.7 -3.7 24.7 45.2 21.2 88 88 A G T < 5S+ 0 0 59 -3,-1.5 -3,-0.2 1,-0.3 2,-0.2 0.542 76.2 134.5 100.5 10.8 28.1 45.0 22.8 89 89 A Y < - 0 0 32 -5,-1.6 2,-0.3 65,-0.0 -1,-0.3 -0.546 34.0-162.0 -97.3 158.7 29.1 41.3 22.5 90 90 A T - 0 0 77 65,-1.7 65,-2.7 -2,-0.2 2,-0.2 -0.906 36.6 -90.2-127.4 156.3 32.4 39.6 21.4 91 91 A L E +B 154 0A 22 -2,-0.3 63,-0.2 29,-0.2 3,-0.1 -0.462 35.1 176.1 -73.8 138.7 32.8 36.0 20.3 92 92 A G E - 0 0 15 61,-2.3 2,-0.3 1,-0.3 62,-0.2 0.785 62.3 -62.9 -97.7 -70.7 33.6 33.3 22.8 93 93 A N E -B 153 0A 73 60,-1.2 60,-2.0 2,-0.0 2,-0.3 -0.946 44.2-142.4-173.3 157.9 33.5 30.3 20.6 94 94 A V E -Bc 152 127A 1 32,-2.2 34,-1.4 -2,-0.3 2,-0.4 -0.964 5.7-162.4-131.8 153.0 30.9 28.4 18.4 95 95 A D E -Bc 151 128A 44 56,-2.3 56,-2.3 -2,-0.3 2,-0.4 -0.997 8.2-165.1-138.5 130.2 30.4 24.7 17.7 96 96 A V E -Bc 150 129A 1 32,-1.8 34,-1.8 -2,-0.4 2,-0.5 -0.922 7.2-165.0-120.3 141.8 28.4 23.4 14.8 97 97 A T E -Bc 149 130A 39 52,-3.3 52,-2.8 -2,-0.4 2,-0.5 -0.957 8.4-159.2-128.9 108.7 26.9 19.9 14.2 98 98 A I E -Bc 148 131A 1 32,-3.0 34,-1.9 -2,-0.5 2,-0.8 -0.770 5.5-155.9 -87.7 129.0 25.8 19.0 10.7 99 99 A I E +Bc 147 132A 23 48,-2.4 48,-2.3 -2,-0.5 2,-0.3 -0.890 36.5 134.9-111.9 101.4 23.4 16.1 10.6 100 100 A A - 0 0 7 32,-2.2 5,-0.1 -2,-0.8 46,-0.1 -0.993 51.4-151.5-150.7 140.4 23.5 14.4 7.2 101 101 A Q S S+ 0 0 51 39,-0.6 -1,-0.1 1,-0.4 32,-0.1 0.876 82.9 43.0 -72.8 -39.6 23.7 10.9 5.7 102 102 A A S S+ 0 0 34 38,-0.2 -1,-0.4 -3,-0.1 2,-0.2 -0.955 81.1 44.5-161.4 157.4 25.5 12.4 2.7 103 103 A P S S- 0 0 18 0, 0.0 2,-0.4 0, 0.0 -76,-0.1 0.533 81.1-110.3 -76.8 178.3 27.4 14.1 1.4 104 104 A K - 0 0 153 -2,-0.2 4,-0.1 1,-0.2 -2,-0.1 -0.649 32.3-173.8 -74.5 126.3 30.6 13.6 3.5 105 105 A M >> + 0 0 5 -2,-0.4 3,-2.2 -5,-0.1 4,-0.9 0.804 61.5 86.2 -91.8 -30.9 31.3 16.9 5.3 106 106 A L G >4 S+ 0 0 122 1,-0.3 3,-0.9 2,-0.2 -1,-0.1 0.793 86.9 50.2 -41.1 -50.7 34.6 16.1 6.9 107 107 A P G 34 S+ 0 0 88 0, 0.0 -1,-0.3 0, 0.0 4,-0.3 0.719 113.6 48.4 -66.3 -17.2 36.9 17.1 4.0 108 108 A H G <> S+ 0 0 45 -3,-2.2 4,-2.0 1,-0.1 -2,-0.2 0.557 86.4 88.2 -97.8 -10.1 35.1 20.5 3.7 109 109 A I H S+ 0 0 73 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.915 111.0 44.0 -54.8 -45.7 38.6 23.2 7.3 111 111 A Q H > S+ 0 0 84 -4,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.867 111.1 54.5 -67.4 -37.5 37.4 25.6 4.6 112 112 A M H X S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.2 5,-0.3 0.958 108.7 49.4 -59.8 -47.1 34.1 26.0 6.4 113 113 A R H X S+ 0 0 56 -4,-3.1 4,-2.6 1,-0.2 5,-0.2 0.868 109.2 52.6 -60.0 -37.7 36.1 27.0 9.5 114 114 A V H X S+ 0 0 46 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.951 112.3 44.2 -62.5 -49.6 38.1 29.5 7.4 115 115 A F H X S+ 0 0 46 -4,-2.5 4,-3.0 -94,-0.2 -2,-0.2 0.942 116.4 45.3 -60.6 -51.6 35.0 31.2 6.1 116 116 A I H X S+ 0 0 2 -4,-2.9 4,-2.7 -95,-0.2 5,-0.2 0.907 111.0 52.4 -60.8 -45.2 33.2 31.3 9.5 117 117 A A H <>S+ 0 0 6 -4,-2.6 5,-2.4 -5,-0.3 4,-0.4 0.881 113.1 46.6 -60.3 -37.1 36.3 32.5 11.3 118 118 A E H ><5S+ 0 0 123 -4,-1.9 3,-1.2 -5,-0.2 -2,-0.2 0.962 112.2 48.4 -68.1 -52.2 36.6 35.3 8.7 119 119 A D H 3<5S+ 0 0 12 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.851 118.1 41.0 -56.9 -36.9 32.9 36.2 8.9 120 120 A L T 3<5S- 0 0 3 -4,-2.7 -1,-0.3 -5,-0.2 -29,-0.2 0.430 108.7-125.3 -91.2 -2.6 33.0 36.3 12.7 121 121 A G T < 5 + 0 0 70 -3,-1.2 -3,-0.2 -4,-0.4 2,-0.2 0.823 68.4 117.7 62.7 36.7 36.3 38.0 12.8 122 122 A C S - 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