==== 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 HYDROLASE 27-DEC-98 4EUG . COMPND 2 MOLECULE: PROTEIN (GLYCOSYLASE); . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR G.XIAO,M.TORDOVA,A.C.DROHAT,J.JAGADEESH,J.T.STIVERS,G.L.GILL . 225 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10742.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 140 62.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 2.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 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 . 13 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 28.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.2 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 2 1 0 0 0 0 1 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 5 A L 0 0 130 0, 0.0 49,-0.5 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 135.6 20.7 24.5 32.5 2 6 A T > - 0 0 53 47,-0.1 4,-2.0 46,-0.1 5,-0.2 -0.679 360.0 -98.4-114.0 168.2 17.4 22.8 31.7 3 7 A W H > S+ 0 0 11 -2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.908 123.8 52.9 -54.0 -41.0 15.9 21.8 28.4 4 8 A H H > S+ 0 0 110 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.911 104.8 55.5 -71.1 -34.2 13.8 25.0 28.4 5 9 A D H 4 S+ 0 0 94 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.942 119.2 31.7 -54.2 -48.4 16.8 27.1 28.9 6 10 A V H < S+ 0 0 23 -4,-2.0 4,-0.2 1,-0.2 -2,-0.2 0.698 126.7 41.0 -88.4 -17.0 18.6 25.7 25.9 7 11 A L H X S+ 0 0 4 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.427 84.0 96.5-105.5 -5.4 15.5 25.0 23.7 8 12 A A T < S+ 0 0 30 -4,-1.7 4,-0.2 1,-0.2 -2,-0.1 0.893 89.6 43.3 -53.9 -45.8 13.4 28.1 24.4 9 13 A E T >4 S+ 0 0 153 -4,-0.3 3,-1.7 1,-0.2 4,-0.3 0.925 111.7 52.6 -68.0 -43.8 14.6 29.9 21.3 10 14 A E G >4 S+ 0 0 31 1,-0.3 3,-1.9 -4,-0.2 6,-0.3 0.903 103.2 59.9 -55.0 -37.4 14.3 26.8 19.0 11 15 A K G 3< S+ 0 0 54 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.535 101.2 54.6 -77.7 -0.3 10.7 26.4 20.2 12 16 A Q G < S+ 0 0 134 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.346 82.3 114.8-105.1 3.5 9.9 29.9 18.8 13 17 A Q S X> S- 0 0 64 -3,-1.9 4,-2.3 -4,-0.3 3,-0.8 -0.536 74.0-124.6 -72.2 141.8 11.2 29.1 15.3 14 18 A P H 3> S+ 0 0 100 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.840 109.2 55.3 -54.0 -42.4 8.6 29.1 12.6 15 19 A Y H 3> S+ 0 0 59 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.863 111.8 45.4 -57.7 -38.7 9.4 25.6 11.4 16 20 A F H <> S+ 0 0 6 -3,-0.8 4,-1.8 -6,-0.3 3,-0.2 0.959 113.9 45.0 -75.2 -48.9 8.8 24.3 15.0 17 21 A L H X S+ 0 0 67 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.855 112.2 54.9 -62.4 -31.6 5.6 26.1 15.7 18 22 A N H X S+ 0 0 81 -4,-2.7 4,-2.1 -5,-0.3 -1,-0.2 0.842 103.3 55.3 -70.6 -28.9 4.4 25.1 12.2 19 23 A T H X S+ 0 0 1 -4,-1.4 4,-2.2 -5,-0.2 -1,-0.2 0.963 110.6 45.7 -63.3 -45.2 5.1 21.4 13.0 20 24 A L H X S+ 0 0 59 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.911 111.6 49.9 -64.6 -45.7 2.9 21.7 16.1 21 25 A Q H X S+ 0 0 122 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.876 110.4 51.8 -68.3 -29.2 0.1 23.5 14.3 22 26 A T H X S+ 0 0 42 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.902 110.2 48.4 -68.0 -40.2 0.2 20.9 11.5 23 27 A V H X S+ 0 0 7 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.951 110.3 51.2 -62.1 -46.3 -0.1 18.1 14.1 24 28 A A H X S+ 0 0 49 -4,-2.6 4,-0.6 1,-0.2 -1,-0.2 0.874 111.3 49.3 -57.9 -41.5 -3.0 19.9 15.8 25 29 A S H >< S+ 0 0 78 -4,-2.0 3,-1.5 -5,-0.2 -1,-0.2 0.950 109.4 50.5 -62.1 -51.5 -4.7 20.2 12.4 26 30 A E H ><>S+ 0 0 27 -4,-2.8 3,-1.8 1,-0.3 5,-0.8 0.864 101.0 63.1 -57.8 -34.4 -4.2 16.5 11.6 27 31 A R H 3<5S+ 0 0 56 -4,-2.3 -1,-0.3 1,-0.3 3,-0.2 0.749 111.6 37.9 -61.4 -23.7 -5.7 15.5 15.0 28 32 A Q T <<5S+ 0 0 175 -3,-1.5 -1,-0.3 -4,-0.6 -2,-0.2 0.197 96.4 86.4-109.4 14.2 -9.0 17.1 13.9 29 33 A S T < 5S- 0 0 70 -3,-1.8 -2,-0.1 2,-0.3 -1,-0.1 0.501 112.9 -88.3 -96.6 -2.5 -8.8 16.0 10.3 30 34 A G T 5S+ 0 0 77 1,-0.5 2,-0.3 -4,-0.3 -3,-0.1 0.273 101.0 92.1 110.9 -7.6 -10.3 12.5 10.6 31 35 A V S > - 0 0 45 0, 0.0 3,-1.9 0, 0.0 4,-0.7 -0.249 36.0-105.6 -55.0 157.8 -1.4 12.1 22.4 37 41 A Q G >4 S+ 0 0 145 1,-0.3 3,-0.9 2,-0.2 4,-0.3 0.854 119.1 57.0 -55.5 -40.6 -0.4 15.8 22.6 38 42 A K G 34 S+ 0 0 124 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.650 110.7 46.1 -68.9 -12.0 0.4 15.7 26.3 39 43 A D G X4 S+ 0 0 11 -3,-1.9 3,-2.0 1,-0.1 -1,-0.2 0.574 79.7 96.0-105.8 -9.7 2.9 12.9 25.7 40 44 A V T << S+ 0 0 6 -3,-0.9 3,-0.3 -4,-0.7 -1,-0.1 0.783 96.2 35.0 -54.9 -35.4 4.8 14.2 22.6 41 45 A F T >> S+ 0 0 55 -4,-0.3 3,-1.4 1,-0.2 4,-1.3 0.048 78.2 121.4-108.9 23.6 7.6 15.6 24.8 42 46 A N H <> + 0 0 5 -3,-2.0 4,-2.2 1,-0.3 5,-0.2 0.741 66.0 65.8 -62.1 -23.4 7.7 13.1 27.6 43 47 A A H 3> S+ 0 0 3 27,-0.7 4,-1.4 -3,-0.3 -1,-0.3 0.874 107.0 43.9 -64.0 -34.0 11.3 12.1 27.0 44 48 A F H <4 S+ 0 0 20 -3,-1.4 -1,-0.2 2,-0.2 -2,-0.2 0.770 111.5 53.5 -77.3 -30.7 12.1 15.6 28.1 45 49 A R H < S+ 0 0 159 -4,-1.3 3,-0.2 1,-0.2 -2,-0.2 0.863 116.5 37.5 -67.6 -41.1 9.7 15.5 31.0 46 50 A F H < S+ 0 0 38 -4,-2.2 2,-0.4 1,-0.2 68,-0.2 0.668 122.0 42.0 -88.6 -22.6 11.2 12.4 32.4 47 51 A T S < S- 0 0 1 -4,-1.4 -1,-0.2 -5,-0.2 5,-0.1 -0.839 76.3-156.2-131.0 95.8 14.8 13.1 31.7 48 52 A E >> - 0 0 68 -2,-0.4 3,-1.4 -3,-0.2 4,-0.5 -0.188 31.9-107.4 -62.4 158.8 16.0 16.6 32.3 49 53 A L G >4 S+ 0 0 2 1,-0.3 3,-1.5 2,-0.2 -47,-0.1 0.920 121.6 48.6 -54.7 -48.8 19.1 17.9 30.4 50 54 A G G 34 S+ 0 0 49 -49,-0.5 -1,-0.3 1,-0.3 -48,-0.1 0.560 110.6 54.3 -70.1 -7.8 21.3 17.7 33.5 51 55 A D G <4 S+ 0 0 92 -3,-1.4 2,-0.4 64,-0.0 -1,-0.3 0.421 75.2 121.8-107.4 0.8 20.0 14.2 34.2 52 56 A V << + 0 0 0 -3,-1.5 63,-0.2 -4,-0.5 3,-0.1 -0.524 19.5 152.9 -70.3 118.0 20.9 12.6 30.9 53 57 A K + 0 0 26 61,-3.5 103,-2.4 -2,-0.4 2,-0.4 0.717 68.4 20.7-106.7 -40.8 23.2 9.7 31.3 54 58 A V E -cd 115 156B 0 60,-2.3 62,-3.2 101,-0.2 2,-0.5 -0.993 64.8-154.6-132.5 135.9 22.4 7.5 28.3 55 59 A V E -cd 116 157B 0 101,-3.1 103,-3.2 -2,-0.4 2,-0.5 -0.981 11.4-178.2-113.9 125.3 20.8 8.5 25.0 56 60 A I E -cd 117 158B 0 60,-2.8 62,-1.4 -2,-0.5 2,-0.4 -0.990 14.3-152.4-120.4 119.3 19.0 5.9 23.0 57 61 A L E -c 118 0B 2 101,-1.1 103,-0.4 -2,-0.5 62,-0.2 -0.734 14.5-179.4 -90.3 137.3 17.5 7.0 19.7 58 62 A G E -c 119 0B 10 60,-1.9 62,-1.2 -2,-0.4 14,-0.1 -0.555 19.2-143.1-105.8-172.2 14.5 5.5 18.1 59 63 A Q S S+ 0 0 48 1,-0.4 62,-2.3 60,-0.2 61,-0.3 0.686 71.8 18.7-116.1 -78.4 13.2 6.8 14.8 60 64 A D S S- 0 0 29 60,-0.2 -1,-0.4 59,-0.1 62,-0.1 -0.741 78.2-114.4 -94.5 142.2 9.3 6.7 14.5 61 65 A P - 0 0 5 0, 0.0 69,-0.2 0, 0.0 -27,-0.1 -0.321 48.7 -88.7 -63.7 149.6 6.8 6.5 17.4 62 66 A Y - 0 0 42 12,-0.2 6,-0.4 1,-0.1 62,-0.1 -0.357 37.9-150.1 -56.5 148.4 4.8 3.3 17.4 63 67 A H + 0 0 70 4,-0.1 64,-2.7 -3,-0.1 65,-0.2 0.206 59.2 91.6-119.6 18.9 1.7 3.8 15.4 64 68 A G S >> S- 0 0 13 62,-0.2 3,-1.8 63,-0.1 4,-0.5 -0.714 87.2 -77.5-108.1 163.8 -0.9 1.6 16.9 65 69 A P T 34 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.304 111.8 3.5 -64.0 138.2 -3.4 2.3 19.6 66 70 A G T 34 S+ 0 0 29 2,-0.2 10,-0.9 1,-0.1 13,-0.1 0.328 107.8 97.8 76.0 0.1 -2.1 2.5 23.2 67 71 A Q T <4 + 0 0 51 -3,-1.8 9,-0.7 8,-0.2 -4,-0.1 0.984 66.3 56.4 -82.0 -75.6 1.5 1.9 22.1 68 72 A A < + 0 0 7 -4,-0.5 -2,-0.2 -6,-0.4 7,-0.1 -0.304 45.4 162.1 -64.1 138.0 3.4 5.2 21.9 69 73 A H S S- 0 0 3 2,-0.4 -1,-0.1 5,-0.4 3,-0.1 0.078 70.8 -79.1-143.0 29.0 3.6 7.4 24.9 70 74 A G S S+ 0 0 13 1,-0.2 -27,-0.7 4,-0.1 2,-0.4 0.534 101.1 99.1 97.0 5.8 6.5 9.7 24.1 71 75 A L S > S- 0 0 3 3,-0.2 3,-1.0 -29,-0.1 -2,-0.4 -0.989 79.0-106.5-126.3 128.0 9.5 7.5 24.9 72 76 A A T 3 S- 0 0 0 45,-2.2 2,-0.4 -2,-0.4 3,-0.1 -0.270 97.9 -4.3 -51.0 137.0 11.4 5.6 22.3 73 77 A F T 3 S+ 0 0 23 1,-0.2 -1,-0.2 33,-0.0 12,-0.2 0.121 105.4 116.8 69.4 -16.0 10.8 1.9 22.3 74 78 A S < - 0 0 0 -3,-1.0 -5,-0.4 -2,-0.4 2,-0.3 -0.462 43.8-164.6 -83.1 149.1 8.5 1.9 25.4 75 79 A V - 0 0 0 30,-2.3 -8,-0.2 -2,-0.2 -7,-0.1 -0.916 31.0 -92.5-127.2 163.5 4.8 1.0 25.5 76 80 A R > - 0 0 76 -10,-0.9 3,-1.8 -9,-0.7 29,-0.3 -0.277 56.1 -84.5 -67.8 156.8 2.1 1.6 28.1 77 81 A P T 3 S+ 0 0 58 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.343 118.2 32.3 -54.8 142.1 1.5 -1.0 30.8 78 82 A G T 3 S+ 0 0 83 1,-0.3 2,-0.3 -3,-0.1 -2,-0.1 0.146 94.0 111.2 95.4 -20.8 -0.9 -3.7 29.5 79 83 A I S < S- 0 0 51 -3,-1.8 26,-0.4 -13,-0.1 -1,-0.3 -0.641 77.6-101.3 -89.9 144.0 0.3 -3.4 25.9 80 84 A A - 0 0 82 -2,-0.3 -1,-0.1 1,-0.1 -4,-0.1 -0.330 41.3-102.5 -66.4 147.1 2.3 -6.2 24.3 81 85 A I - 0 0 29 1,-0.1 -1,-0.1 4,-0.1 5,-0.1 -0.557 42.2-126.2 -70.2 113.7 6.0 -5.7 24.1 82 86 A P > - 0 0 7 0, 0.0 4,-2.5 0, 0.0 3,-0.5 -0.210 23.2-103.8 -64.0 153.9 6.7 -4.8 20.5 83 87 A P H > S+ 0 0 77 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.831 118.5 54.7 -44.0 -45.2 9.3 -6.7 18.5 84 88 A S H > S+ 0 0 23 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.927 112.7 43.2 -60.3 -44.9 12.1 -4.0 18.8 85 89 A L H > S+ 0 0 0 -3,-0.5 4,-2.8 1,-0.2 -1,-0.2 0.848 109.1 57.2 -72.4 -32.5 11.8 -4.0 22.6 86 90 A L H X S+ 0 0 44 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.919 107.9 48.9 -58.5 -40.0 11.6 -7.8 22.8 87 91 A N H X S+ 0 0 11 -4,-2.0 4,-2.1 -5,-0.2 5,-0.2 0.902 108.8 51.9 -70.8 -36.2 15.0 -7.9 21.0 88 92 A M H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.935 110.5 49.5 -59.2 -43.1 16.4 -5.4 23.4 89 93 A Y H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 -2,-0.2 0.869 106.8 55.0 -64.0 -37.0 15.3 -7.6 26.2 90 94 A K H X S+ 0 0 77 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.933 109.7 46.1 -60.9 -44.6 16.8 -10.6 24.6 91 95 A E H X S+ 0 0 4 -4,-2.1 4,-0.7 1,-0.2 5,-0.2 0.914 113.1 51.2 -63.9 -41.1 20.2 -8.9 24.4 92 96 A L H >X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 3,-1.2 0.933 108.9 50.2 -61.6 -44.3 19.7 -7.8 28.0 93 97 A E H 3< S+ 0 0 55 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.841 111.2 50.3 -62.3 -31.9 18.9 -11.3 29.2 94 98 A N H 3< S+ 0 0 125 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.611 125.3 22.4 -81.0 -11.9 22.0 -12.5 27.4 95 99 A T H << S+ 0 0 37 -3,-1.2 -2,-0.2 -4,-0.7 -3,-0.2 0.663 98.8 77.2-128.5 -31.6 24.3 -10.0 29.0 96 100 A I S >< S- 0 0 30 -4,-2.9 3,-2.3 -5,-0.2 -1,-0.1 -0.766 81.6-115.3 -95.6 125.0 23.2 -8.4 32.3 97 101 A P T 3 S+ 0 0 122 0, 0.0 -3,-0.1 0, 0.0 -1,-0.1 -0.313 97.0 8.6 -55.1 129.2 23.6 -10.5 35.3 98 102 A G T 3 S+ 0 0 78 1,-0.3 2,-0.2 -5,-0.1 -5,-0.1 0.356 90.2 143.2 86.0 -6.0 20.3 -11.4 36.9 99 103 A F < + 0 0 18 -3,-2.3 2,-0.3 -7,-0.3 -1,-0.3 -0.491 23.7 178.8 -74.4 137.8 18.2 -10.0 34.1 100 104 A T - 0 0 88 -2,-0.2 -8,-0.0 0, 0.0 -10,-0.0 -0.922 42.5 -76.6-131.4 162.4 15.0 -11.9 33.1 101 105 A R - 0 0 119 -2,-0.3 -15,-0.0 1,-0.1 116,-0.0 -0.305 51.7-132.7 -57.5 117.0 12.3 -11.3 30.6 102 106 A P - 0 0 6 0, 0.0 -1,-0.1 0, 0.0 117,-0.1 -0.370 5.0-133.4 -66.1 156.3 10.0 -8.5 31.9 103 107 A N S S+ 0 0 147 -23,-0.0 2,-0.3 -2,-0.0 -2,-0.1 0.196 85.8 38.5 -92.8 17.4 6.3 -9.0 31.8 104 108 A H - 0 0 12 114,-0.1 -24,-0.1 -27,-0.1 -28,-0.1 -0.945 67.8-133.8-152.3 171.3 5.7 -5.5 30.3 105 109 A G + 0 0 0 -26,-0.4 -30,-2.3 -29,-0.3 2,-0.6 0.074 59.5 125.7-114.7 21.9 7.2 -3.0 27.8 106 110 A Y - 0 0 29 -32,-0.2 3,-0.3 1,-0.1 -30,-0.1 -0.765 31.6-179.6 -94.7 124.8 7.1 0.2 29.9 107 111 A L >> + 0 0 0 -2,-0.6 4,-1.8 1,-0.2 3,-1.1 0.038 42.9 117.4-114.0 23.3 10.4 2.0 30.3 108 112 A E H 3> S+ 0 0 63 1,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.867 76.5 59.1 -54.4 -38.2 9.6 5.0 32.5 109 113 A S H 34 S+ 0 0 21 110,-0.3 -1,-0.3 -3,-0.3 4,-0.2 0.756 102.7 53.0 -69.8 -22.1 12.0 3.7 35.1 110 114 A W H X4>S+ 0 0 0 -3,-1.1 5,-2.0 2,-0.2 3,-1.5 0.924 110.4 46.7 -67.9 -50.0 14.8 3.8 32.5 111 115 A A H ><5S+ 0 0 1 -4,-1.8 3,-1.9 1,-0.3 -2,-0.2 0.895 107.5 55.8 -58.7 -40.6 14.0 7.5 31.7 112 116 A R T 3<5S+ 0 0 133 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.638 104.9 55.3 -72.1 -5.7 13.8 8.4 35.4 113 117 A Q T < 5S- 0 0 57 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.336 133.6 -85.7 -99.7 2.0 17.4 6.9 35.8 114 118 A G T < 5S+ 0 0 3 -3,-1.9 -61,-3.5 1,-0.3 -60,-2.3 0.600 82.5 138.4 109.5 8.5 18.8 9.2 33.1 115 119 A V E < -c 54 0B 0 -5,-2.0 2,-0.8 -62,-0.2 -1,-0.3 -0.794 43.2-150.0 -92.6 108.8 18.1 7.2 29.9 116 120 A L E -c 55 0B 0 -62,-3.2 -60,-2.8 -2,-0.9 2,-1.1 -0.731 8.6-165.0 -80.1 109.5 16.9 9.7 27.3 117 121 A L E +c 56 0B 1 -2,-0.8 -45,-2.2 -62,-0.2 2,-0.6 -0.749 20.7 171.7-104.6 83.9 14.5 7.7 25.1 118 122 A L E -c 57 0B 1 -62,-1.4 -60,-1.9 -2,-1.1 2,-0.3 -0.855 25.0-156.7-107.5 114.8 14.3 10.0 22.1 119 123 A N E -c 58 0B 16 -2,-0.6 -60,-0.2 -62,-0.2 -59,-0.1 -0.620 20.0-136.5 -76.9 147.7 12.6 9.2 18.9 120 124 A T S S+ 0 0 0 -62,-1.2 2,-0.4 -61,-0.3 21,-0.4 0.759 98.5 43.2 -77.3 -23.6 13.9 11.4 16.0 121 125 A V S S- 0 0 0 -62,-2.3 -1,-0.2 20,-0.1 12,-0.1 -0.988 74.5-163.6-118.3 129.6 10.3 11.9 14.8 122 126 A L + 0 0 12 -2,-0.4 2,-0.3 10,-0.2 -62,-0.1 0.478 63.9 36.9-106.5 -0.5 7.9 12.6 17.6 123 127 A T - 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