==== 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 23-MAR-00 1EOM . COMPND 2 MOLECULE: ENDO-BETA-N-ACETYLGLUCOSAMINIDASE F3; . SOURCE 2 ORGANISM_SCIENTIFIC: ELIZABETHKINGIA MENINGOSEPTICA; . AUTHOR C.A.WADDLING,T.H.PLUMMER JR.,A.L.TARENTINO,P.VAN ROEY . 283 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11053.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 195 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 22 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 73 25.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.1 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 1 1 0 0 1 1 1 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 4 3 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 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 0 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 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 8 A N 0 0 162 0, 0.0 281,-0.2 0, 0.0 280,-0.1 0.000 360.0 360.0 360.0 88.8 -2.8 64.0 -0.9 2 9 A G - 0 0 13 279,-1.4 259,-0.3 248,-0.2 2,-0.1 -0.225 360.0 -80.4 -94.3-173.1 -5.2 66.5 0.3 3 10 A V E -a 261 0A 9 257,-2.8 259,-2.4 256,-0.1 2,-0.5 -0.449 31.4-145.4 -81.9 156.6 -5.0 70.0 1.7 4 11 A C E -a 262 0A 0 257,-0.2 24,-1.4 -2,-0.1 23,-1.4 -0.954 16.9-170.2-126.9 109.8 -4.0 70.6 5.3 5 12 A I E -ab 263 28A 0 257,-2.7 259,-2.5 -2,-0.5 2,-0.6 -0.896 7.6-153.6-106.9 122.9 -5.8 73.7 6.7 6 13 A A E -ab 264 29A 0 22,-3.7 24,-2.8 -2,-0.6 2,-0.4 -0.835 5.2-152.0-105.8 124.1 -4.8 74.9 10.0 7 14 A Y E - b 0 30A 2 257,-2.4 260,-2.5 -2,-0.6 261,-0.7 -0.703 10.5-168.7 -84.0 136.6 -6.9 76.8 12.4 8 15 A Y E - b 0 31A 0 22,-2.7 24,-2.4 -2,-0.4 2,-0.5 -0.934 9.0-154.7-126.4 105.8 -4.9 79.1 14.6 9 16 A I E - b 0 32A 8 -2,-0.5 3,-0.3 22,-0.2 24,-0.2 -0.718 6.3-148.6 -84.7 128.4 -7.0 80.5 17.4 10 17 A T + 0 0 0 22,-2.6 44,-2.0 -2,-0.5 43,-0.4 0.033 62.7 113.0 -86.7 26.7 -5.6 83.7 18.6 11 18 A D S S- 0 0 54 42,-0.2 -1,-0.2 41,-0.2 39,-0.1 0.182 91.3-103.2 -87.3 17.4 -6.7 83.5 22.3 12 19 A G + 0 0 21 -3,-0.3 -2,-0.1 1,-0.2 -1,-0.1 0.431 69.2 148.7 82.1 -1.7 -3.1 83.2 23.6 13 20 A R S S+ 0 0 69 1,-0.3 -1,-0.2 -4,-0.2 4,-0.1 -0.335 73.2 6.3 -66.4 152.3 -3.2 79.5 24.4 14 21 A N S > S- 0 0 64 1,-0.1 3,-2.6 2,-0.1 -1,-0.3 0.878 83.9-171.0 41.4 51.2 0.1 77.7 24.0 15 22 A P T 3 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.688 73.0 66.9 -44.2 -36.4 1.8 81.2 23.5 16 23 A T T 3 S+ 0 0 117 1,-0.2 2,-1.4 2,-0.1 -2,-0.1 0.745 86.3 78.5 -65.3 -18.3 5.2 79.9 22.5 17 24 A F S < S- 0 0 21 -3,-2.6 -1,-0.2 -4,-0.1 2,-0.1 -0.713 77.5-167.3 -93.5 91.0 3.6 78.5 19.4 18 25 A K > - 0 0 71 -2,-1.4 3,-2.1 1,-0.1 4,-0.2 -0.348 35.4-108.2 -75.7 157.8 3.3 81.7 17.4 19 26 A L G > S+ 0 0 0 1,-0.3 3,-1.7 35,-0.2 -1,-0.1 0.885 121.7 56.3 -51.5 -42.5 1.3 82.1 14.2 20 27 A K G 3 S+ 0 0 87 1,-0.3 -1,-0.3 48,-0.0 -3,-0.0 0.636 91.7 73.4 -69.8 -9.9 4.6 82.2 12.3 21 28 A D G < + 0 0 72 -3,-2.1 -1,-0.3 2,-0.0 -2,-0.2 0.501 61.4 130.3 -83.6 1.4 5.6 78.8 13.7 22 29 A I < - 0 0 1 -3,-1.7 4,-0.1 -4,-0.2 -3,-0.0 -0.340 58.9-130.5 -52.2 121.1 3.0 77.1 11.5 23 30 A P - 0 0 27 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 -0.010 24.0 -82.5 -70.7 179.0 5.2 74.3 10.1 24 31 A D S S+ 0 0 107 1,-0.2 3,-0.1 49,-0.0 47,-0.0 -0.222 107.3 49.4 -75.7 174.6 5.6 73.3 6.5 25 32 A K S S+ 0 0 105 1,-0.2 2,-0.5 2,-0.1 -1,-0.2 0.713 82.7 116.3 64.5 20.2 3.2 71.0 4.6 26 33 A V - 0 0 5 -3,-0.4 -1,-0.2 1,-0.1 -21,-0.1 -0.988 47.5-169.2-119.4 113.5 0.3 73.3 6.0 27 34 A D + 0 0 55 -23,-1.4 47,-2.4 -2,-0.5 2,-0.3 0.836 63.7 10.7 -72.4 -41.6 -1.4 74.9 3.0 28 35 A M E -bc 5 74A 8 -24,-1.4 -22,-3.7 45,-0.2 2,-0.4 -0.984 55.6-154.4-144.8 154.2 -3.5 77.4 4.8 29 36 A V E -bc 6 75A 0 45,-2.6 47,-3.0 -2,-0.3 2,-0.6 -0.986 11.7-152.2-128.1 134.5 -4.0 78.9 8.1 30 37 A I E -bc 7 76A 0 -24,-2.8 -22,-2.7 -2,-0.4 2,-0.5 -0.957 16.0-135.5-111.1 117.9 -7.3 80.4 9.2 31 38 A L E -bc 8 77A 0 45,-3.2 47,-2.1 -2,-0.6 2,-0.4 -0.626 35.6-174.8 -70.7 126.6 -7.1 83.1 11.8 32 39 A F E +b 9 0A 22 -24,-2.4 -22,-2.6 -2,-0.5 2,-1.0 -0.956 52.2 22.4-133.3 146.0 -9.8 82.2 14.3 33 40 A G S S+ 0 0 4 1,-0.4 18,-0.1 -2,-0.4 -24,-0.1 -0.599 95.5 101.5 99.9 -63.9 -11.2 83.8 17.4 34 41 A L S S- 0 0 0 -2,-1.0 -1,-0.4 17,-0.2 2,-0.3 -0.221 72.7-137.1 -50.3 134.2 -10.0 87.2 16.2 35 42 A K >> - 0 0 52 -3,-0.1 3,-1.9 1,-0.1 4,-1.2 -0.729 12.8-122.3-101.0 149.6 -13.0 89.0 14.8 36 43 A Y H 3> S+ 0 0 18 -2,-0.3 4,-2.3 42,-0.3 5,-0.1 0.793 110.8 64.9 -60.1 -27.0 -12.9 91.0 11.5 37 44 A W H 3> S+ 0 0 125 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.731 99.2 53.5 -71.2 -16.8 -14.1 94.1 13.4 38 45 A S H <4 S+ 0 0 9 -3,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.827 109.2 47.4 -81.5 -34.0 -10.8 94.0 15.3 39 46 A L H < S+ 0 0 0 -4,-1.2 3,-0.4 1,-0.1 -2,-0.2 0.867 113.8 50.7 -70.8 -33.9 -9.0 93.9 12.0 40 47 A Q H < S+ 0 0 81 -4,-2.3 2,-0.6 1,-0.3 -2,-0.2 0.971 127.6 18.3 -67.1 -55.0 -11.2 96.8 11.0 41 48 A D >< - 0 0 75 -4,-2.4 3,-1.2 1,-0.1 4,-0.4 -0.872 69.4-175.9-122.3 97.8 -10.6 99.0 14.0 42 49 A T T 3 S+ 0 0 47 -2,-0.6 5,-0.1 -3,-0.4 -1,-0.1 0.538 72.5 73.0 -70.5 -8.9 -7.4 97.8 15.7 43 50 A T T 3 S+ 0 0 116 1,-0.2 -1,-0.2 3,-0.1 -5,-0.1 0.621 84.5 65.8 -83.4 -12.4 -7.8 100.2 18.6 44 51 A K S < S+ 0 0 175 -3,-1.2 -1,-0.2 1,-0.2 -2,-0.1 0.912 98.4 45.9 -79.7 -39.6 -10.6 98.5 20.4 45 52 A L S S- 0 0 34 -4,-0.4 -1,-0.2 -7,-0.1 3,-0.1 -0.877 87.5-130.0-106.3 112.6 -9.0 95.2 21.5 46 53 A P > - 0 0 83 0, 0.0 3,-1.4 0, 0.0 6,-0.2 -0.322 30.0-106.4 -61.6 139.7 -5.7 95.7 23.1 47 54 A G T 3 S+ 0 0 25 1,-0.3 6,-0.2 -5,-0.1 9,-0.1 -0.307 105.1 31.5 -62.7 148.7 -3.0 93.4 21.6 48 55 A G T 3 S+ 0 0 38 4,-2.1 2,-0.3 7,-0.5 5,-0.3 0.488 107.5 89.1 81.0 2.9 -2.0 90.6 23.8 49 56 A T S X S- 0 0 63 -3,-1.4 3,-2.2 -4,-0.1 -1,-0.2 -0.942 89.5 -21.0-132.3 156.1 -5.4 90.4 25.4 50 57 A G G > S- 0 0 53 -2,-0.3 3,-2.0 1,-0.3 4,-0.2 -0.203 133.9 -3.5 49.9-130.4 -8.7 88.5 24.5 51 58 A M G 3 S+ 0 0 62 1,-0.3 -1,-0.3 -18,-0.1 -17,-0.2 0.315 140.5 53.9 -75.8 12.0 -8.7 87.4 20.9 52 59 A M G X S+ 0 0 0 -3,-2.2 3,-2.1 -6,-0.2 -4,-2.1 0.114 75.2 111.5-122.5 12.6 -5.4 89.2 20.4 53 60 A G T < + 0 0 22 -3,-2.0 -42,-0.2 -43,-0.4 -2,-0.1 0.768 67.1 63.7 -59.8 -24.3 -4.0 87.3 23.2 54 61 A S T 3 S+ 0 0 13 -44,-2.0 2,-0.3 -4,-0.2 -1,-0.3 0.545 101.4 56.2 -78.5 -6.0 -1.7 85.4 20.8 55 62 A F S < S- 0 0 5 -3,-2.1 -7,-0.5 -45,-0.3 3,-0.1 -0.924 70.7-136.6-129.8 154.4 0.2 88.5 19.8 56 63 A K S S- 0 0 160 -2,-0.3 2,-0.3 1,-0.2 -9,-0.1 0.776 88.8 -24.3 -74.5 -26.2 2.2 91.3 21.5 57 64 A S S > S- 0 0 41 -11,-0.1 4,-1.8 1,-0.1 -1,-0.2 -0.959 72.7 -87.5-170.6 175.3 0.5 93.9 19.3 58 65 A Y H > S+ 0 0 31 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.856 125.6 57.3 -69.2 -30.1 -1.2 94.3 16.0 59 66 A K H > S+ 0 0 158 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.917 104.8 51.1 -65.4 -40.9 2.2 94.9 14.4 60 67 A D H > S+ 0 0 21 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.945 111.5 48.0 -60.0 -46.1 3.3 91.5 15.7 61 68 A L H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.957 111.9 49.2 -57.3 -54.2 0.2 89.9 14.1 62 69 A D H X S+ 0 0 67 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.927 112.2 49.1 -54.7 -46.1 0.7 91.7 10.8 63 70 A T H X S+ 0 0 84 -4,-2.9 4,-1.7 1,-0.2 -1,-0.2 0.897 110.5 48.5 -62.7 -41.9 4.3 90.6 10.7 64 71 A Q H X S+ 0 0 2 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.887 107.2 56.4 -68.7 -37.5 3.7 86.9 11.5 65 72 A I H >X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 3,-0.8 0.971 107.9 47.7 -56.6 -51.3 0.9 86.8 8.8 66 73 A R H 3X S+ 0 0 66 -4,-2.1 4,-2.9 1,-0.3 5,-0.2 0.872 104.5 62.4 -58.5 -34.4 3.4 88.0 6.2 67 74 A S H 3< S+ 0 0 40 -4,-1.7 4,-0.4 1,-0.2 -1,-0.3 0.891 108.0 42.1 -57.5 -39.9 5.8 85.4 7.5 68 75 A L H X<>S+ 0 0 0 -4,-1.7 5,-2.3 -3,-0.8 3,-1.1 0.945 114.1 50.1 -72.5 -47.1 3.4 82.7 6.5 69 76 A Q H ><5S+ 0 0 43 -4,-2.3 3,-2.6 1,-0.3 -2,-0.2 0.891 104.6 56.9 -60.4 -40.7 2.4 84.2 3.1 70 77 A S T 3<5S+ 0 0 104 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.704 104.7 54.1 -68.2 -14.0 6.0 84.7 2.0 71 78 A R T < 5S- 0 0 97 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.401 126.9-105.8 -94.3 0.4 6.4 81.0 2.6 72 79 A G T < 5S+ 0 0 63 -3,-2.6 2,-0.5 1,-0.3 -3,-0.2 0.591 75.9 138.7 86.8 10.9 3.4 80.4 0.3 73 80 A I < - 0 0 9 -5,-2.3 -1,-0.3 -6,-0.1 2,-0.3 -0.798 51.7-130.8 -89.3 127.0 0.9 79.5 3.1 74 81 A K E -c 28 0A 69 -47,-2.4 -45,-2.6 -2,-0.5 2,-0.5 -0.582 16.5-152.3 -77.8 139.0 -2.4 81.2 2.5 75 82 A V E -c 29 0A 0 -2,-0.3 39,-2.8 -47,-0.2 40,-0.5 -0.956 14.9-174.4-117.6 119.4 -3.9 83.0 5.5 76 83 A L E -cd 30 115A 0 -47,-3.0 -45,-3.2 -2,-0.5 2,-0.4 -0.788 20.2-129.0-111.0 154.4 -7.7 83.3 5.8 77 84 A Q E -cd 31 116A 0 38,-2.5 40,-2.1 -2,-0.3 2,-0.4 -0.844 22.5-126.4-104.0 135.4 -9.8 85.2 8.2 78 85 A N E - d 0 117A 3 -47,-2.1 2,-0.5 -2,-0.4 -42,-0.3 -0.651 24.0-168.7 -79.5 136.0 -12.6 83.4 9.9 79 86 A I E - d 0 118A 0 38,-3.1 40,-2.4 -2,-0.4 2,-0.3 -0.995 10.6-146.3-125.5 124.4 -16.0 85.1 9.6 80 87 A D E - d 0 119A 27 -2,-0.5 40,-0.2 38,-0.2 2,-0.1 -0.670 16.8-119.0 -90.7 143.4 -18.9 83.9 11.8 81 88 A D - 0 0 1 38,-2.3 2,-0.3 -2,-0.3 40,-0.1 -0.440 37.3-169.8 -72.9 158.5 -22.5 83.8 10.6 82 89 A D > - 0 0 72 40,-0.1 3,-3.0 -2,-0.1 4,-0.4 -0.988 39.0-108.3-150.2 150.5 -24.6 86.0 12.8 83 90 A V G > S+ 0 0 76 40,-0.4 3,-1.8 -2,-0.3 4,-0.2 0.786 115.2 70.5 -53.6 -27.9 -28.4 86.6 13.3 84 91 A S G > S+ 0 0 25 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.742 84.1 70.9 -63.8 -18.7 -27.8 90.0 11.6 85 92 A W G < S+ 0 0 2 -3,-3.0 73,-0.3 1,-0.3 -1,-0.3 0.801 93.1 55.9 -65.4 -26.6 -27.2 88.0 8.4 86 93 A Q G < S+ 0 0 34 -3,-1.8 -1,-0.3 -4,-0.4 68,-0.2 0.445 103.0 71.0 -83.6 0.2 -31.0 87.3 8.5 87 94 A S S < S- 0 0 47 -3,-1.5 -3,-0.0 -4,-0.2 8,-0.0 -0.517 94.3-109.5-107.4 176.3 -31.8 91.0 8.5 88 95 A S S S+ 0 0 85 1,-0.2 -3,-0.1 -2,-0.2 -4,-0.1 0.448 114.1 59.7 -86.1 -0.2 -31.5 93.7 5.9 89 96 A K S > S- 0 0 109 -5,-0.3 3,-2.7 6,-0.1 -1,-0.2 -0.385 75.5-174.6-124.3 57.8 -28.6 95.1 7.9 90 97 A P G > S+ 0 0 2 0, 0.0 3,-2.3 0, 0.0 5,-0.2 -0.235 77.8 0.0 -55.2 131.4 -26.0 92.3 8.1 91 98 A G G 3 S- 0 0 28 1,-0.3 3,-0.1 3,-0.1 -6,-0.1 0.612 129.4 -69.7 64.4 9.2 -23.1 93.2 10.4 92 99 A G G < S+ 0 0 66 -3,-2.7 -1,-0.3 1,-0.3 2,-0.2 0.652 104.6 131.9 82.3 12.4 -24.9 96.5 10.9 93 100 A F S < S- 0 0 53 -3,-2.3 -1,-0.3 -4,-0.1 6,-0.1 -0.485 72.3-105.3 -91.6 170.6 -24.1 97.5 7.3 94 101 A A S S- 0 0 66 -2,-0.2 2,-0.3 -5,-0.1 -1,-0.1 0.723 91.1 -14.0 -70.3 -24.0 -26.7 98.9 5.0 95 102 A S S > S- 0 0 48 -5,-0.2 4,-2.5 -6,-0.1 5,-0.1 -0.954 74.4 -91.3-162.6 176.5 -27.2 95.8 2.9 96 103 A A H > S+ 0 0 15 -2,-0.3 4,-3.1 2,-0.2 5,-0.2 0.858 127.6 54.0 -68.3 -31.6 -25.5 92.4 2.1 97 104 A A H > S+ 0 0 36 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.929 109.5 47.2 -66.7 -42.8 -23.6 94.2 -0.7 98 105 A A H > S+ 0 0 24 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.921 112.9 48.8 -62.2 -44.4 -22.4 96.8 1.8 99 106 A Y H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.948 111.5 50.3 -59.4 -50.1 -21.5 93.9 4.2 100 107 A G H X S+ 0 0 0 -4,-3.1 4,-2.7 1,-0.2 5,-0.2 0.934 109.7 49.6 -55.7 -49.0 -19.6 92.1 1.4 101 108 A D H X S+ 0 0 76 -4,-2.8 4,-3.7 1,-0.2 -1,-0.2 0.919 110.6 51.7 -56.7 -43.3 -17.7 95.2 0.5 102 109 A A H X S+ 0 0 14 -4,-2.4 4,-3.3 2,-0.2 5,-0.3 0.938 109.6 47.2 -59.7 -50.1 -16.7 95.8 4.1 103 110 A I H X>S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.6 0.965 115.6 46.8 -58.1 -48.9 -15.4 92.2 4.5 104 111 A K H X>S+ 0 0 68 -4,-2.7 5,-2.1 -5,-0.2 4,-1.5 0.933 113.0 49.9 -57.4 -44.4 -13.5 92.7 1.3 105 112 A S H <>S+ 0 0 58 -4,-3.7 5,-2.1 -5,-0.2 -2,-0.2 0.928 119.3 35.9 -62.6 -44.0 -12.3 96.0 2.4 106 113 A I H <>S+ 0 0 10 -4,-3.3 5,-2.3 3,-0.2 -2,-0.2 0.960 125.5 35.6 -74.7 -53.2 -11.0 94.8 5.8 107 114 A V H <5S+ 0 0 0 -4,-3.0 6,-2.9 -5,-0.3 -3,-0.2 0.920 134.9 17.9 -71.8 -43.6 -9.8 91.3 4.9 108 115 A I T X - 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