==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 21-APR-06 2GQU . COMPND 2 MOLECULE: UDP-N-ACETYLENOLPYRUVYLGLUCOSAMINE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS CALDOPHILUS; . AUTHOR S.H.EOM,M.-K.KIM . 266 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13269.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 19.2 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 0.4 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 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 48 18.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 2 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 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 PARALLEL BRIDGES PER LADDER . 4 4 2 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 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 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 2 A F 0 0 219 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 47.8 3.9 25.5 9.3 2 3 A M - 0 0 25 1,-0.1 2,-0.4 29,-0.1 24,-0.1 -0.418 360.0 -98.4 -80.2 155.7 4.0 22.2 7.7 3 4 A R E +A 25 0A 159 22,-0.6 22,-2.7 -2,-0.1 2,-0.4 -0.607 42.9 176.8 -72.6 125.9 6.6 21.2 5.2 4 5 A V E +A 24 0A 60 -2,-0.4 2,-0.3 20,-0.2 20,-0.2 -0.996 11.6 152.9-129.9 126.3 5.4 21.6 1.6 5 6 A E E -A 23 0A 78 18,-1.8 18,-3.1 -2,-0.4 2,-0.4 -0.996 45.4-108.4-150.9 152.8 7.8 20.9 -1.3 6 7 A R E +A 22 0A 169 -2,-0.3 2,-0.3 16,-0.2 16,-0.2 -0.695 47.1 168.3 -79.9 130.9 7.9 19.7 -4.9 7 8 A V E -A 21 0A 16 14,-2.8 14,-2.2 -2,-0.4 2,-0.5 -0.819 40.5-110.1-131.0 171.2 9.3 16.2 -5.2 8 9 A L E > -A 20 0A 77 -2,-0.3 3,-2.1 12,-0.2 11,-0.2 -0.961 24.1-144.3-101.8 122.8 9.6 13.5 -7.8 9 10 A L G > S+ 0 0 0 10,-2.8 3,-2.1 -2,-0.5 4,-0.2 0.691 92.5 79.4 -67.2 -14.0 7.3 10.6 -6.8 10 11 A K G > S+ 0 0 88 8,-1.9 3,-0.6 1,-0.3 -1,-0.3 0.826 92.5 53.2 -55.1 -29.0 9.8 8.1 -8.2 11 12 A D G < S+ 0 0 105 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.484 110.1 47.3 -83.9 -4.6 11.6 8.8 -4.9 12 13 A Y G < S+ 0 0 61 -3,-2.1 2,-0.3 5,-0.1 -1,-0.2 0.127 98.9 74.8-127.0 14.4 8.5 8.0 -2.8 13 14 A T S < S- 0 0 13 -3,-0.6 3,-0.4 -4,-0.2 34,-0.2 -0.963 74.8-131.6-129.6 148.2 7.3 4.7 -4.4 14 15 A T S S+ 0 0 42 32,-2.0 180,-0.3 -2,-0.3 181,-0.2 0.855 110.0 56.4 -70.0 -31.1 8.8 1.2 -4.0 15 16 A L S S- 0 0 0 31,-0.6 -1,-0.2 34,-0.3 225,-0.2 0.777 105.5-133.2 -66.0 -30.1 8.7 0.8 -7.8 16 17 A G + 0 0 11 -3,-0.4 2,-0.3 1,-0.3 -6,-0.2 0.808 64.0 112.8 80.4 30.8 10.8 3.9 -8.2 17 18 A V + 0 0 2 -8,-0.2 34,-0.5 224,-0.1 -1,-0.3 -0.939 29.8 103.4-128.2 153.3 8.8 5.6 -11.0 18 19 A G - 0 0 6 -2,-0.3 -8,-1.9 32,-0.1 35,-0.2 -0.229 47.7-120.2 141.9 135.3 6.7 8.8 -10.9 19 20 A G - 0 0 5 33,-2.5 -10,-2.8 -10,-0.2 35,-0.2 0.101 55.5 -43.0 -80.4-164.9 6.7 12.5 -11.9 20 21 A P E +A 8 0A 39 0, 0.0 36,-1.4 0, 0.0 2,-0.3 -0.237 54.7 165.1 -71.9 147.7 6.4 15.7 -9.9 21 22 A A E -A 7 0A 0 -14,-2.2 -14,-2.8 34,-0.2 2,-0.7 -0.984 40.8-112.6-153.7 154.7 4.0 16.4 -7.1 22 23 A E E -Ab 6 59A 75 36,-0.6 38,-2.9 34,-0.4 2,-0.6 -0.824 38.2-153.6 -89.7 111.3 3.5 18.9 -4.3 23 24 A L E -Ab 5 60A 3 -18,-3.1 -18,-1.8 -2,-0.7 2,-0.6 -0.799 10.2-165.9 -98.4 122.1 4.1 17.0 -1.1 24 25 A W E -Ab 4 61A 28 36,-3.3 38,-2.6 -2,-0.6 2,-0.8 -0.912 7.5-156.0-106.3 115.1 2.5 18.1 2.1 25 26 A T E -Ab 3 62A 12 -22,-2.7 -22,-0.6 -2,-0.6 2,-0.5 -0.833 13.4-161.5 -95.5 110.4 3.9 16.5 5.3 26 27 A V E + b 0 63A 0 36,-2.9 38,-3.3 -2,-0.8 41,-0.2 -0.810 21.4 168.4 -98.7 128.9 1.3 16.6 8.0 27 28 A E + 0 0 102 -2,-0.5 39,-2.4 36,-0.2 2,-0.3 0.581 60.7 36.3-112.9 -17.8 2.2 16.2 11.6 28 29 A T S > S- 0 0 58 37,-0.2 4,-2.1 38,-0.1 5,-0.1 -0.900 79.6-108.6-136.9 163.8 -0.9 17.2 13.6 29 30 A R H > S+ 0 0 86 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.899 120.8 48.8 -55.8 -43.9 -4.7 17.0 13.5 30 31 A E H > S+ 0 0 128 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.855 108.6 52.8 -69.7 -34.1 -4.9 20.8 12.7 31 32 A E H > S+ 0 0 35 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.863 107.6 52.4 -67.3 -36.8 -2.3 20.5 10.0 32 33 A L H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.911 105.6 54.3 -62.7 -43.3 -4.4 17.8 8.4 33 34 A K H < S+ 0 0 86 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.891 113.0 43.9 -56.9 -40.8 -7.4 20.1 8.5 34 35 A R H >< S+ 0 0 127 -4,-1.7 3,-1.6 1,-0.2 -2,-0.2 0.912 110.0 53.0 -69.7 -45.3 -5.4 22.7 6.6 35 36 A A H >< S+ 0 0 0 -4,-2.6 3,-0.6 1,-0.3 -1,-0.2 0.795 105.3 56.2 -65.8 -29.4 -3.8 20.4 4.0 36 37 A T T 3< S+ 0 0 23 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.1 0.235 76.2 97.4 -87.5 12.5 -7.2 19.0 3.0 37 38 A E T < S+ 0 0 149 -3,-1.6 -1,-0.2 2,-0.1 -2,-0.1 0.598 90.2 36.7 -77.6 -11.8 -8.7 22.4 2.1 38 39 A A S < S- 0 0 31 -3,-0.6 20,-0.0 -4,-0.1 0, 0.0 -0.874 115.6 -60.3-130.0 165.3 -7.9 21.9 -1.6 39 40 A P + 0 0 98 0, 0.0 20,-2.2 0, 0.0 2,-0.3 -0.172 67.9 171.9 -50.2 135.1 -8.0 18.7 -3.7 40 41 A Y E -c 59 0A 62 18,-0.2 2,-0.3 -4,-0.1 20,-0.2 -0.927 30.8-153.4-142.9 160.6 -5.6 16.0 -2.3 41 42 A R E -c 60 0A 52 18,-2.5 20,-3.1 -2,-0.3 2,-0.5 -0.933 26.1-126.2-125.9 157.6 -4.4 12.4 -2.5 42 43 A V E -c 61 0A 54 -2,-0.3 2,-0.5 18,-0.2 20,-0.2 -0.910 17.2-157.6-107.0 133.5 -2.9 10.5 0.3 43 44 A L + 0 0 4 18,-3.0 20,-0.5 -2,-0.5 66,-0.0 -0.933 14.7 172.5-108.3 124.7 0.5 8.8 -0.0 44 45 A G S S- 0 0 22 -2,-0.5 -1,-0.1 18,-0.1 61,-0.1 0.307 71.6 -40.7 -93.0-127.7 1.5 5.9 2.2 45 46 A N S S- 0 0 58 61,-0.1 -31,-0.2 1,-0.0 -2,-0.0 0.396 75.3-124.6 -82.2 3.9 4.6 3.9 1.7 46 47 A G + 0 0 4 -33,-0.2 -32,-2.0 1,-0.1 -31,-0.6 0.786 69.5 133.6 59.8 32.3 4.0 4.0 -2.1 47 48 A S S S+ 0 0 25 -34,-0.2 -1,-0.1 1,-0.2 -34,-0.1 0.496 72.7 38.2 -94.0 -5.8 4.1 0.2 -2.3 48 49 A N S S+ 0 0 23 148,-0.0 215,-2.7 214,-0.0 2,-0.5 0.166 96.2 107.9-122.1 16.5 1.0 -0.2 -4.5 49 50 A L E -d 263 0B 17 -3,-0.3 2,-0.7 213,-0.2 -34,-0.3 -0.823 45.3-169.6-108.6 130.8 1.3 2.8 -6.7 50 51 A L E -d 264 0B 0 213,-3.0 215,-2.5 -2,-0.5 2,-0.5 -0.952 21.8-166.5-107.3 105.9 2.2 3.2 -10.4 51 52 A V E -d 265 0B 0 -2,-0.7 191,-0.1 -34,-0.5 213,-0.1 -0.850 17.0-127.3 -97.7 126.0 2.8 7.0 -10.7 52 53 A L > - 0 0 23 213,-3.6 -33,-2.5 -2,-0.5 3,-1.9 -0.203 24.7-104.1 -71.9 162.4 2.9 8.2 -14.3 53 54 A D T 3 S+ 0 0 68 1,-0.3 -1,-0.1 -35,-0.2 -43,-0.1 0.749 118.2 58.7 -61.9 -25.4 5.8 10.3 -15.6 54 55 A E T 3 S- 0 0 131 1,-0.2 -1,-0.3 -35,-0.2 -2,-0.0 0.545 96.1-151.0 -78.6 -8.5 3.7 13.5 -15.6 55 56 A G < - 0 0 2 -3,-1.9 -1,-0.2 210,-0.2 -34,-0.2 -0.280 27.0 -65.8 69.1-158.4 3.1 13.2 -11.8 56 57 A V - 0 0 6 -36,-1.4 -34,-0.4 -37,-0.1 4,-0.1 -0.959 22.0-146.2-133.2 148.2 -0.1 14.6 -10.2 57 58 A P S S+ 0 0 110 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.644 72.0 89.9 -84.9 -18.3 -1.5 18.1 -9.7 58 59 A E S S- 0 0 54 1,-0.1 -36,-0.6 -18,-0.0 -18,-0.2 -0.328 92.6 -88.6 -77.3 160.1 -3.3 17.6 -6.4 59 60 A R E -bc 22 40A 53 -20,-2.2 -18,-2.5 -24,-0.1 2,-0.6 -0.522 41.3-144.2 -60.7 131.9 -1.7 18.1 -3.0 60 61 A V E -bc 23 41A 0 -38,-2.9 -36,-3.3 -20,-0.2 2,-0.5 -0.934 15.8-153.7-105.1 116.5 -0.1 14.8 -2.0 61 62 A I E -bc 24 42A 0 -20,-3.1 -18,-3.0 -2,-0.6 2,-0.4 -0.785 13.2-173.5 -97.4 127.5 -0.5 14.3 1.8 62 63 A R E -b 25 0A 76 -38,-2.6 -36,-2.9 -2,-0.5 2,-0.7 -0.964 21.4-133.5-115.3 140.0 1.9 12.2 3.9 63 64 A L E +b 26 0A 7 -20,-0.5 -36,-0.2 -2,-0.4 2,-0.2 -0.843 43.1 140.1 -98.5 116.4 1.1 11.5 7.5 64 65 A A > + 0 0 13 -38,-3.3 3,-2.4 -2,-0.7 5,-0.2 -0.418 42.1 40.9-130.9-158.7 4.0 12.0 9.9 65 66 A G G > S+ 0 0 24 1,-0.3 3,-2.2 2,-0.2 4,-0.3 -0.237 128.3 8.5 53.7-123.3 4.5 13.4 13.4 66 67 A E G > S+ 0 0 77 -39,-2.4 3,-1.1 1,-0.3 -1,-0.3 0.758 126.8 64.8 -60.6 -25.6 1.6 12.3 15.7 67 68 A F G < S+ 0 0 0 -3,-2.4 12,-2.4 1,-0.2 13,-0.7 0.515 99.0 53.7 -77.6 -3.9 0.4 10.0 12.9 68 69 A Q G < S+ 0 0 107 -3,-2.2 -1,-0.2 11,-0.2 2,-0.2 0.336 87.7 99.5-106.8 -0.4 3.7 7.9 13.3 69 70 A T < + 0 0 83 -3,-1.1 8,-2.6 -4,-0.3 2,-0.3 -0.610 52.9 178.7 -85.6 149.9 3.3 7.4 17.0 70 71 A Y B -E 76 0C 79 6,-0.2 2,-0.4 -2,-0.2 6,-0.3 -0.998 30.5-167.3-153.5 152.6 1.8 4.1 18.2 71 72 A D > - 0 0 93 4,-1.4 3,-2.2 -2,-0.3 -2,-0.0 -0.949 19.6-148.5-135.9 117.6 0.9 1.9 21.2 72 73 A L T 3 S+ 0 0 23 -2,-0.4 93,-0.3 1,-0.3 95,-0.1 0.789 103.9 42.1 -54.8 -28.6 0.2 -1.8 20.4 73 74 A K T 3 S+ 0 0 129 2,-0.1 -1,-0.3 91,-0.1 2,-0.1 0.259 129.1 24.2-101.9 7.2 -2.4 -1.9 23.2 74 75 A G S < S- 0 0 14 -3,-2.2 91,-0.6 1,-0.1 2,-0.3 -0.291 113.5 -20.0-137.4-138.2 -3.8 1.5 22.3 75 76 A W E - F 0 164C 87 89,-0.1 -4,-1.4 -2,-0.1 2,-0.5 -0.649 49.9-156.4 -86.6 142.3 -4.0 3.7 19.2 76 77 A V E -EF 70 163C 0 87,-3.1 87,-2.6 -2,-0.3 -6,-0.2 -0.972 20.6-123.0-122.2 117.9 -1.7 3.2 16.3 77 78 A G E > - F 0 162C 0 -8,-2.6 3,-1.6 -2,-0.5 85,-0.3 -0.277 15.1-130.3 -62.7 141.6 -1.0 6.1 13.9 78 79 A A T 3 S+ 0 0 0 83,-2.6 30,-2.6 1,-0.3 31,-0.4 0.689 105.3 63.1 -69.9 -18.5 -1.8 5.4 10.3 79 80 A G T 3 S+ 0 0 2 -12,-2.4 -1,-0.3 82,-0.4 -11,-0.2 0.539 79.9 110.3 -80.9 -7.0 1.6 6.7 9.2 80 81 A T S < S- 0 0 5 -3,-1.6 27,-2.6 -13,-0.7 2,-0.4 -0.424 78.4-109.8 -67.8 142.4 3.3 3.9 11.1 81 82 A L B >> -I 106 0D 73 25,-0.2 4,-1.8 1,-0.1 3,-0.6 -0.575 15.1-142.9 -77.9 126.1 5.0 1.2 9.0 82 83 A L H 3> S+ 0 0 0 23,-3.0 4,-2.7 -2,-0.4 5,-0.2 0.896 99.9 60.0 -54.7 -42.7 3.2 -2.1 9.1 83 84 A P H 3> S+ 0 0 55 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.864 104.7 51.1 -56.0 -34.7 6.6 -4.1 9.0 84 85 A L H <> S+ 0 0 66 -3,-0.6 4,-2.8 2,-0.2 -2,-0.2 0.937 110.6 47.4 -63.4 -48.1 7.5 -2.3 12.3 85 86 A L H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 5,-0.2 0.872 106.6 57.8 -63.7 -38.9 4.2 -3.3 13.9 86 87 A V H X S+ 0 0 3 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.941 113.6 39.0 -54.7 -47.9 4.6 -6.9 12.8 87 88 A Q H X S+ 0 0 66 -4,-1.6 4,-2.5 -5,-0.2 -2,-0.2 0.900 114.2 53.7 -71.3 -39.5 7.9 -7.2 14.6 88 89 A E H X S+ 0 0 52 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.894 106.5 53.2 -62.6 -37.6 6.8 -5.1 17.6 89 90 A A H X>S+ 0 0 2 -4,-2.7 5,-2.9 2,-0.2 4,-0.5 0.940 108.9 48.8 -64.7 -43.9 3.8 -7.4 18.1 90 91 A A H ><5S+ 0 0 1 -4,-1.6 3,-1.4 1,-0.2 -2,-0.2 0.938 110.4 51.4 -59.5 -45.2 6.1 -10.5 18.1 91 92 A R H 3<5S+ 0 0 143 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.800 112.3 46.9 -60.6 -31.5 8.4 -8.7 20.7 92 93 A A H 3<5S- 0 0 54 -4,-1.8 -1,-0.3 -3,-0.3 -2,-0.2 0.421 115.3-114.8 -90.1 -1.7 5.3 -8.0 22.9 93 94 A G T <<5 + 0 0 13 -3,-1.4 77,-2.3 -4,-0.5 2,-0.5 0.860 68.6 143.1 67.6 37.1 4.0 -11.5 22.6 94 95 A L E < -J 169 0E 8 -5,-2.9 3,-0.3 75,-0.2 2,-0.3 -0.952 35.7-154.8-116.6 124.6 0.9 -10.3 20.8 95 96 A S E +J 168 0E 8 73,-3.5 73,-2.0 -2,-0.5 77,-0.0 -0.711 57.8 75.4-102.3 146.3 -0.6 -12.3 18.0 96 97 A G S S+ 0 0 32 -2,-0.3 -1,-0.2 71,-0.2 70,-0.1 0.186 82.6 66.2 141.9 -17.9 -2.7 -11.2 15.0 97 98 A L > + 0 0 2 -3,-0.3 3,-2.2 -11,-0.1 4,-0.2 0.406 66.6 100.6-106.8 -0.9 -0.3 -9.5 12.6 98 99 A E G > S+ 0 0 7 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.850 78.6 57.2 -57.0 -38.4 1.8 -12.6 11.6 99 100 A G G 3 S+ 0 0 8 20,-0.3 21,-0.3 1,-0.3 20,-0.3 0.493 99.6 62.0 -71.4 -3.7 -0.1 -13.0 8.3 100 101 A L G X S+ 0 0 4 -3,-2.2 3,-1.6 19,-0.1 -1,-0.3 0.356 72.7 128.4-103.3 2.9 0.9 -9.4 7.3 101 102 A L T < + 0 0 21 -3,-1.6 -3,-0.0 1,-0.2 -19,-0.0 -0.338 69.8 25.9 -57.0 136.1 4.6 -10.2 7.3 102 103 A G T 3 S+ 0 0 40 1,-0.2 -1,-0.2 3,-0.0 -3,-0.0 0.408 85.9 120.1 89.7 1.3 6.3 -9.0 4.1 103 104 A I < - 0 0 20 -3,-1.6 2,-1.9 1,-0.1 -1,-0.2 -0.868 52.7-154.6-100.6 109.8 3.8 -6.3 3.2 104 105 A P + 0 0 58 0, 0.0 2,-0.2 0, 0.0 -57,-0.2 -0.319 46.8 135.3 -85.1 57.0 5.8 -3.0 3.1 105 106 A A - 0 0 6 -2,-1.9 -23,-3.0 -59,-0.1 2,-0.3 -0.664 58.2-124.3 -98.6 155.1 2.7 -0.8 3.8 106 107 A Q B > -I 81 0D 27 -25,-0.3 4,-2.6 -2,-0.2 -25,-0.2 -0.656 40.9-108.9 -78.0 156.7 1.9 2.1 6.1 107 108 A V H > S+ 0 0 1 -27,-2.6 4,-2.2 -30,-0.3 -28,-0.2 0.917 119.9 51.8 -53.0 -45.9 -1.0 1.3 8.3 108 109 A G H > S+ 0 0 13 -30,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.893 111.1 46.7 -60.4 -42.5 -3.3 3.7 6.4 109 110 A G H > S+ 0 0 28 -31,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.871 109.6 54.1 -67.6 -39.7 -2.4 2.0 3.0 110 111 A A H <>S+ 0 0 1 -4,-2.6 5,-2.1 2,-0.2 4,-0.3 0.872 111.1 46.5 -60.7 -38.9 -2.9 -1.4 4.5 111 112 A V H ><5S+ 0 0 0 -4,-2.2 3,-1.4 -5,-0.2 -2,-0.2 0.968 112.1 49.5 -65.4 -50.4 -6.4 -0.4 5.5 112 113 A K H 3<5S+ 0 0 102 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.893 123.0 32.5 -57.4 -43.4 -7.2 1.2 2.2 113 114 A M T 3<5S- 0 0 43 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.318 101.0-129.2 -95.2 6.7 -6.1 -1.8 0.3 114 115 A N T < 5 - 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