==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-JAN-10 3LJQ . COMPND 2 MOLECULE: N(4)-(BETA-N-ACETYLGLUCOSAMINYL)-L-ASPARAGINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: FLAVOBACTERIUM MENINGOSEPTICUM; . AUTHOR Y.WANG,H.-C.GUO . 570 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19446.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 410 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 20.0 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 . 10 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 157 27.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.8 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 1 0 0 4 4 1 2 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 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 0 0 PARALLEL BRIDGES PER LADDER . 2 0 0 6 8 2 2 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 2 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 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 T 0 0 99 0, 0.0 2,-0.8 0, 0.0 250,-0.2 0.000 360.0 360.0 360.0 134.6 6.9 14.0 62.3 2 3 A N - 0 0 47 248,-2.9 143,-0.1 266,-0.0 3,-0.0 -0.866 360.0-161.7 -95.7 105.3 8.4 17.0 64.0 3 4 A K + 0 0 77 -2,-0.8 143,-0.1 1,-0.2 2,-0.1 -0.990 51.1 27.9-153.6 149.2 6.5 20.0 62.7 4 5 A P S S+ 0 0 20 0, 0.0 265,-0.3 0, 0.0 2,-0.3 0.614 75.9 151.1 -78.6 163.1 6.4 22.9 62.4 5 6 A I E -A 145 0A 0 140,-2.2 140,-3.2 263,-0.1 2,-0.4 -0.977 22.2-167.8-153.0 144.5 10.1 23.6 62.2 6 7 A V E -AB 144 267A 0 261,-2.0 261,-2.4 -2,-0.3 2,-0.4 -0.996 0.7-169.5-135.1 137.8 12.2 26.3 60.5 7 8 A L E +AB 143 266A 0 136,-2.8 136,-2.5 -2,-0.4 2,-0.3 -0.978 9.8 173.9-120.6 143.2 16.0 26.5 59.9 8 9 A S E -AB 142 265A 0 257,-2.1 257,-3.3 -2,-0.4 134,-0.2 -0.991 31.1 -98.3-149.6 162.2 17.9 29.5 58.7 9 10 A T E S- B 0 264A 0 132,-1.9 4,-0.3 -2,-0.3 255,-0.2 -0.438 71.6 -7.2 -87.9 144.5 21.6 30.4 58.2 10 11 A W S > S- 0 0 62 253,-2.4 3,-1.8 2,-0.2 4,-0.4 0.271 95.5 -56.0 71.5 172.4 23.8 32.4 60.5 11 12 A N T >> S+ 0 0 91 1,-0.3 3,-1.6 2,-0.2 4,-0.5 0.847 131.9 57.5 -56.1 -42.3 23.3 34.3 63.7 12 13 A F H 3> S+ 0 0 15 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.648 88.3 78.7 -68.6 -9.5 20.6 36.6 62.2 13 14 A G H <> S+ 0 0 0 -3,-1.8 4,-3.0 -4,-0.3 -1,-0.3 0.809 84.3 62.8 -62.7 -26.9 18.7 33.4 61.4 14 15 A L H <> S+ 0 0 48 -3,-1.6 4,-1.5 -4,-0.4 -1,-0.2 0.965 108.0 40.4 -62.6 -48.4 17.7 33.4 65.0 15 16 A H H X S+ 0 0 110 -4,-0.5 4,-1.3 1,-0.2 -2,-0.2 0.895 114.6 52.1 -67.2 -40.3 15.9 36.7 64.5 16 17 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 3,-0.3 0.918 105.8 56.6 -61.5 -43.0 14.5 35.6 61.1 17 18 A N H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 -1,-0.2 0.875 99.4 59.1 -54.8 -40.0 13.2 32.4 62.8 18 19 A V H X S+ 0 0 66 -4,-1.5 4,-1.2 2,-0.2 -1,-0.2 0.911 108.9 43.8 -57.2 -43.7 11.2 34.4 65.3 19 20 A E H X S+ 0 0 38 -4,-1.3 4,-0.8 -3,-0.3 3,-0.3 0.904 113.2 51.2 -69.8 -40.4 9.2 36.1 62.4 20 21 A A H >X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 3,-0.9 0.904 107.1 55.3 -59.2 -40.0 8.8 32.8 60.6 21 22 A W H 3X S+ 0 0 48 -4,-2.8 4,-3.0 1,-0.3 5,-0.3 0.794 93.4 66.9 -69.5 -27.9 7.5 31.3 63.8 22 23 A K H 3< S+ 0 0 89 -4,-1.2 -1,-0.3 -3,-0.3 4,-0.2 0.857 113.3 35.0 -58.2 -33.5 4.8 33.9 64.1 23 24 A V H X<>S+ 0 0 26 -3,-0.9 5,-2.6 -4,-0.8 3,-1.0 0.918 120.2 46.2 -80.4 -52.4 3.4 32.3 61.0 24 25 A L H ><5S+ 0 0 2 -4,-2.7 3,-1.8 1,-0.3 123,-0.3 0.885 108.7 55.1 -64.7 -38.3 4.3 28.7 61.6 25 26 A S T 3<5S+ 0 0 63 -4,-3.0 -1,-0.3 1,-0.3 -3,-0.1 0.703 106.7 52.0 -73.1 -16.8 3.0 28.6 65.2 26 27 A K T < 5S- 0 0 160 -3,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.281 125.6-101.2 -98.1 11.3 -0.4 29.8 64.1 27 28 A G T < 5S+ 0 0 38 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.657 71.7 152.2 81.9 15.3 -0.7 27.1 61.5 28 29 A G < - 0 0 23 -5,-2.6 119,-0.5 1,-0.1 120,-0.2 -0.147 50.7 -76.5 -73.1 175.8 0.3 29.3 58.5 29 30 A K > - 0 0 87 1,-0.1 4,-2.2 117,-0.1 3,-0.3 -0.457 26.9-131.5 -79.0 140.7 2.0 28.3 55.3 30 31 A A H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.870 108.8 59.9 -52.1 -40.1 5.7 27.5 55.1 31 32 A L H > S+ 0 0 3 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.918 108.1 42.4 -60.8 -43.6 5.8 29.8 52.0 32 33 A D H > S+ 0 0 56 -3,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.880 112.9 54.3 -68.9 -37.5 4.5 32.8 54.0 33 34 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.921 109.7 45.2 -64.5 -44.8 6.8 32.0 57.0 34 35 A V H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 5,-0.2 0.857 113.2 50.4 -74.9 -31.2 10.0 31.9 55.0 35 36 A E H X S+ 0 0 30 -4,-1.7 4,-1.8 -5,-0.3 -1,-0.2 0.948 113.6 45.0 -62.9 -50.0 9.1 35.1 53.1 36 37 A K H X S+ 0 0 84 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.894 112.4 55.4 -59.9 -40.9 8.4 36.9 56.3 37 38 A G H X S+ 0 0 0 -4,-2.5 4,-0.5 1,-0.2 3,-0.5 0.924 112.0 37.2 -60.1 -50.9 11.5 35.5 57.9 38 39 A V H >X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 3,-0.7 0.786 105.1 67.8 -81.9 -21.8 14.1 36.6 55.4 39 40 A R H 3X S+ 0 0 79 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.828 91.3 66.0 -61.9 -28.7 12.4 40.0 54.7 40 41 A L H 3X S+ 0 0 59 -4,-1.0 4,-0.6 -3,-0.5 -1,-0.2 0.907 106.9 39.3 -57.6 -40.6 13.4 40.9 58.3 41 42 A V H X< S+ 0 0 4 -3,-0.7 3,-0.6 -4,-0.5 6,-0.2 0.850 111.8 56.0 -82.9 -35.7 17.1 40.7 57.3 42 43 A E H 3< S+ 0 0 0 -4,-2.2 10,-2.5 1,-0.2 -1,-0.2 0.855 108.7 50.9 -54.9 -36.4 16.5 42.4 53.9 43 44 A D H 3< S+ 0 0 58 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.708 91.7 88.4 -76.2 -21.9 14.9 45.3 55.8 44 45 A D X< - 0 0 56 -3,-0.6 3,-2.0 -4,-0.6 6,-0.2 -0.677 57.8-163.9 -93.6 106.7 17.8 45.7 58.3 45 46 A P T 3 S+ 0 0 46 0, 0.0 -1,-0.1 0, 0.0 79,-0.1 0.695 87.5 63.7 -64.3 -16.3 20.5 48.1 57.0 46 47 A T T 3 S+ 0 0 92 1,-0.1 2,-0.9 2,-0.0 7,-0.1 0.573 83.7 81.9 -83.4 -7.0 23.0 46.8 59.6 47 48 A E X - 0 0 51 -3,-2.0 3,-0.9 5,-0.3 -1,-0.1 -0.875 67.0-172.5 -96.8 108.0 23.0 43.4 58.0 48 49 A R T 3 S+ 0 0 22 -2,-0.9 7,-2.1 1,-0.2 -1,-0.1 0.293 70.9 57.4 -93.6 3.6 25.4 44.2 55.2 49 50 A S T 3 S+ 0 0 25 5,-0.2 109,-2.3 1,-0.2 110,-0.6 0.287 102.8 54.4-113.8 7.9 25.1 41.0 53.1 50 51 A V S < S- 0 0 0 -3,-0.9 -1,-0.2 107,-0.3 -3,-0.2 -0.980 104.7 -52.0-146.8 125.9 21.3 41.1 52.5 51 52 A G S > S+ 0 0 0 -2,-0.4 3,-2.3 14,-0.1 -8,-0.2 -0.112 110.3 32.6 57.3-134.9 19.0 43.7 51.0 52 53 A Y T 3 S+ 0 0 80 -10,-2.5 -5,-0.3 33,-0.4 -2,-0.2 -0.345 128.7 20.9 -62.7 132.7 19.1 47.2 52.3 53 54 A G T 3 S+ 0 0 0 69,-1.8 -1,-0.3 1,-0.3 -2,-0.1 0.401 88.3 152.3 87.6 -3.8 22.6 48.1 53.5 54 55 A G < - 0 0 0 -3,-2.3 -1,-0.3 68,-0.1 -5,-0.2 -0.284 54.7-102.9 -61.2 143.3 24.2 45.4 51.3 55 56 A R - 0 0 83 -7,-2.1 8,-0.3 104,-0.2 -1,-0.1 -0.478 44.3-120.2 -65.6 134.6 27.7 46.1 50.2 56 57 A P - 0 0 0 0, 0.0 106,-3.1 0, 0.0 6,-0.2 -0.131 21.2 -99.4 -69.1 167.5 27.8 47.2 46.5 57 58 A D > - 0 0 0 4,-2.9 3,-2.2 105,-0.2 107,-0.2 -0.144 57.2 -83.0 -68.5 179.4 29.5 45.7 43.5 58 59 A R T 3 S+ 0 0 106 105,-2.8 106,-0.1 1,-0.3 -1,-0.1 0.670 131.0 59.5 -71.5 -11.3 32.8 47.4 42.5 59 60 A D T 3 S- 0 0 67 104,-0.3 -1,-0.3 2,-0.2 3,-0.1 0.305 120.7-105.4 -95.3 9.8 30.8 50.1 40.6 60 61 A G S < S+ 0 0 11 -3,-2.2 2,-0.4 1,-0.3 -2,-0.1 0.597 78.3 134.0 82.6 10.8 29.0 51.2 43.7 61 62 A R - 0 0 85 -6,-0.1 -4,-2.9 61,-0.0 2,-0.8 -0.808 51.9-140.1 -98.2 130.5 25.7 49.5 42.7 62 63 A V + 0 0 11 -2,-0.4 21,-0.5 -6,-0.2 2,-0.5 -0.800 28.5 178.7 -89.0 110.1 23.7 47.5 45.2 63 64 A T - 0 0 1 -2,-0.8 2,-0.3 95,-0.4 19,-0.2 -0.970 9.9-155.5-121.4 133.6 22.4 44.5 43.3 64 65 A L E -C 81 0A 0 17,-2.5 17,-2.4 -2,-0.5 2,-0.4 -0.772 8.9-164.3-116.6 146.6 20.4 41.8 44.9 65 66 A D E + D 0 157A 0 92,-2.1 92,-2.2 -2,-0.3 2,-0.3 -0.964 20.3 153.1-126.9 141.4 19.7 38.1 44.2 66 67 A A E -CD 78 156A 0 12,-2.6 12,-2.6 -2,-0.4 2,-0.3 -0.980 15.7-174.6-159.6 154.1 16.9 36.0 45.7 67 68 A C E -CD 77 155A 0 88,-2.1 88,-2.3 -2,-0.3 2,-0.3 -0.979 5.3-162.3-148.8 167.5 14.7 33.0 45.0 68 69 A I E -CD 76 154A 0 8,-2.4 8,-2.2 -2,-0.3 2,-0.4 -0.978 1.5-168.5-147.5 147.1 11.8 31.2 46.6 69 70 A M E -CD 75 153A 2 84,-2.1 84,-2.3 -2,-0.3 6,-0.2 -0.987 10.3-156.4-144.8 130.9 10.3 27.7 46.2 70 71 A D > - 0 0 13 4,-2.2 3,-0.7 -2,-0.4 112,-0.2 -0.161 38.7 -84.0 -99.8-165.7 7.0 26.4 47.6 71 72 A E T 3 S+ 0 0 45 1,-0.2 80,-0.1 2,-0.1 111,-0.1 0.407 118.9 51.0 -84.5 2.6 5.6 23.0 48.4 72 73 A N T 3 S- 0 0 48 2,-0.2 -1,-0.2 109,-0.1 3,-0.1 -0.091 120.0 -90.1-137.3 45.0 4.4 22.2 44.9 73 74 A Y S < S+ 0 0 11 -3,-0.7 2,-0.3 1,-0.2 -2,-0.1 0.589 79.8 141.5 64.7 18.1 7.4 22.8 42.6 74 75 A N + 0 0 39 2,-0.0 -4,-2.2 22,-0.0 2,-0.3 -0.722 27.8 180.0 -86.2 142.3 6.5 26.5 42.0 75 76 A I E -C 69 0A 3 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.969 18.7-176.3-140.2 151.9 9.6 28.7 41.9 76 77 A G E +C 68 0A 0 -8,-2.2 -8,-2.4 -2,-0.3 2,-0.3 -0.990 8.0 175.7-147.9 156.2 10.6 32.3 41.4 77 78 A S E -Ce 67 102A 3 24,-0.6 26,-1.9 -2,-0.3 2,-0.4 -0.995 12.8-169.8-155.7 140.1 13.9 34.1 41.2 78 79 A V E -Ce 66 103A 0 -12,-2.6 -12,-2.6 -2,-0.3 2,-0.4 -0.993 13.1-170.6-127.7 144.2 15.4 37.6 40.6 79 80 A A E + e 0 104A 0 24,-1.7 26,-2.1 -2,-0.4 -14,-0.2 -0.995 62.9 4.7-134.3 148.0 19.1 38.3 40.1 80 81 A C E S+ 0 0 6 -2,-0.4 2,-0.4 24,-0.2 -15,-0.2 0.902 82.4 162.5 53.0 48.7 21.1 41.5 39.9 81 82 A M E -C 64 0A 0 -17,-2.4 -17,-2.5 -3,-0.1 2,-0.3 -0.834 21.8-153.5-101.6 138.4 18.1 43.6 40.7 82 83 A E + 0 0 22 -2,-0.4 -19,-0.1 23,-0.2 3,-0.1 -0.749 60.6 12.8-110.8 154.9 18.5 47.2 41.9 83 84 A H S S+ 0 0 59 -21,-0.5 37,-2.5 -2,-0.3 2,-0.5 0.405 89.5 108.8 70.5 4.0 16.6 49.7 44.0 84 85 A I - 0 0 2 35,-0.2 -1,-0.1 -3,-0.1 35,-0.1 -0.955 52.8-159.3-115.7 121.4 14.1 47.2 45.5 85 86 A K S S+ 0 0 42 -2,-0.5 -33,-0.4 33,-0.4 -1,-0.1 0.767 82.7 47.5 -73.4 -26.7 14.5 46.4 49.2 86 87 A N >> + 0 0 12 1,-0.2 4,-1.4 -35,-0.1 3,-1.1 -0.611 56.4 163.5-119.6 71.2 12.7 43.0 49.3 87 88 A P H 3> S+ 0 0 0 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.827 73.6 65.5 -57.8 -29.4 13.9 40.9 46.4 88 89 A I H 3> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.904 103.4 48.2 -60.9 -33.8 12.4 37.7 48.0 89 90 A S H <> S+ 0 0 6 -3,-1.1 4,-1.7 2,-0.2 -1,-0.2 0.866 109.7 49.9 -79.1 -31.7 9.0 39.2 47.5 90 91 A V H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.911 109.7 52.6 -66.8 -40.9 9.6 40.2 43.9 91 92 A A H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.921 107.3 52.5 -57.1 -41.9 10.8 36.6 43.4 92 93 A R H X S+ 0 0 27 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.880 108.9 49.8 -62.4 -35.6 7.5 35.5 44.9 93 94 A A H X S+ 0 0 8 -4,-1.7 4,-2.8 2,-0.2 5,-0.3 0.882 106.3 54.6 -69.5 -39.0 5.7 37.7 42.4 94 95 A V H X S+ 0 0 0 -4,-2.5 4,-1.1 1,-0.2 6,-0.4 0.953 113.0 45.5 -55.6 -49.4 7.7 36.2 39.5 95 96 A M H < S+ 0 0 26 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.923 123.5 31.5 -55.1 -51.4 6.5 32.8 40.7 96 97 A E H < S+ 0 0 93 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.755 126.3 35.7 -87.0 -24.2 2.9 33.7 41.2 97 98 A K H < S+ 0 0 129 -4,-2.8 -3,-0.2 -5,-0.2 -1,-0.2 0.384 110.1 48.9-118.9 -2.0 2.2 36.4 38.6 98 99 A T S < S- 0 0 18 -4,-1.1 0, 0.0 -5,-0.3 0, 0.0 -0.916 72.6-123.9-137.8 164.2 4.2 35.4 35.5 99 100 A P S S+ 0 0 102 0, 0.0 2,-0.2 0, 0.0 385,-0.1 0.304 90.4 81.0 -89.7 11.1 4.8 32.3 33.4 100 101 A H - 0 0 6 -6,-0.4 -2,-0.2 1,-0.1 3,-0.1 -0.669 62.8-155.2-109.6 168.0 8.5 32.7 34.0 101 102 A V S S+ 0 0 4 357,-0.3 -24,-0.6 1,-0.3 2,-0.3 0.495 76.5 39.2-120.0 -7.6 10.7 31.6 36.9 102 103 A M E +e 77 0A 3 356,-0.3 356,-2.5 -26,-0.2 2,-0.4 -0.943 52.5 175.1-146.7 127.0 13.7 34.0 36.7 103 104 A L E -eF 78 457A 0 -26,-1.9 -24,-1.7 -2,-0.3 2,-0.3 -0.967 14.7-172.1-119.9 142.8 14.1 37.7 35.8 104 105 A V E >> -e 79 0A 1 352,-1.7 3,-0.9 -2,-0.4 4,-0.6 -0.909 40.2 -9.7-130.3 160.6 17.4 39.6 36.0 105 106 A G H >> S- 0 0 15 -26,-2.1 4,-1.6 -2,-0.3 3,-0.7 -0.188 122.1 -7.1 68.2-144.3 18.7 43.1 35.7 106 107 A D H 3> S+ 0 0 72 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.861 132.6 60.3 -57.9 -37.8 16.6 45.9 34.5 107 108 A G H <> S+ 0 0 3 -3,-0.9 4,-2.4 1,-0.2 -1,-0.2 0.845 102.1 52.1 -61.6 -34.8 13.8 43.5 33.6 108 109 A A H <>S+ 0 0 0 -4,-2.7 5,-2.1 1,-0.2 3,-1.1 0.929 110.1 47.7 -53.5 -48.9 8.9 44.8 40.5 113 114 A L H ><5S+ 0 0 70 -4,-2.6 3,-2.1 1,-0.3 -1,-0.2 0.906 106.5 57.2 -58.8 -41.2 7.6 48.3 39.8 114 115 A S H 3<5S+ 0 0 83 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.721 105.6 52.9 -65.5 -18.1 4.7 46.9 37.7 115 116 A Q T <<5S- 0 0 75 -4,-1.2 -1,-0.3 -3,-1.1 -2,-0.2 0.374 127.3 -98.7 -97.4 3.4 3.7 45.0 40.8 116 117 A G T < 5S+ 0 0 45 -3,-2.1 -3,-0.2 1,-0.3 -2,-0.1 0.522 73.5 144.5 94.1 6.1 3.7 48.1 43.0 117 118 A F < - 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