==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-JUL-98 5A3H . COMPND 2 MOLECULE: ENDOGLUCANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS AGARADHAERENS; . AUTHOR G.J.DAVIES,A.VARROT,M.DAUTER,A.M.BRZOZOWSKI,M.SCHULEIN, . 300 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11608.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 18 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 28.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.7 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 2 0 0 0 0 1 0 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 1 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 PARALLEL BRIDGES PER LADDER . 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 4 A S > 0 0 89 0, 0.0 4,-2.4 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -55.7 73.8 43.1 7.3 2 5 A V H > + 0 0 30 88,-0.3 4,-2.9 87,-0.3 5,-0.5 0.953 360.0 35.6 -54.9 -57.4 73.0 40.9 10.4 3 6 A V H > S+ 0 0 7 87,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.893 116.4 54.7 -72.5 -31.8 69.7 39.4 9.2 4 7 A E H 4 S+ 0 0 155 86,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.933 115.5 40.1 -66.2 -39.3 70.8 39.2 5.6 5 8 A E H < S+ 0 0 122 -4,-2.4 -2,-0.2 1,-0.1 -1,-0.2 0.945 129.1 26.6 -73.6 -47.6 73.9 37.2 6.7 6 9 A H H < S+ 0 0 33 -4,-2.9 13,-2.2 -5,-0.3 -3,-0.2 0.813 85.8 164.3 -91.5 -29.4 72.4 34.9 9.3 7 10 A G < + 0 0 5 -4,-1.8 2,-0.3 -5,-0.5 -1,-0.2 -0.221 51.5 31.0 57.6-128.2 68.9 34.8 8.0 8 11 A Q S S- 0 0 62 10,-0.1 2,-0.3 158,-0.0 12,-0.1 -0.411 74.3-154.0 -70.1 122.0 66.6 32.1 9.4 9 12 A L + 0 0 4 118,-0.4 2,-0.3 -2,-0.3 9,-0.2 -0.693 21.9 160.0 -93.7 154.6 67.5 31.1 12.9 10 13 A S E -A 17 0A 39 7,-2.0 7,-2.8 -2,-0.3 2,-0.5 -0.952 40.0 -98.2-159.5 175.2 66.8 27.7 14.4 11 14 A I E +A 16 0A 29 -2,-0.3 2,-0.4 179,-0.2 5,-0.2 -0.909 33.4 179.0-109.3 127.1 67.9 25.4 17.2 12 15 A S E > S-A 15 0A 56 3,-2.5 3,-1.6 -2,-0.5 -2,-0.0 -0.988 73.4 -20.6-130.5 114.3 70.3 22.6 16.5 13 16 A N T 3 S- 0 0 155 -2,-0.4 205,-0.1 1,-0.3 -1,-0.1 0.919 128.5 -49.7 52.5 45.6 71.5 20.4 19.3 14 17 A G T 3 S+ 0 0 10 1,-0.2 207,-0.4 204,-0.2 2,-0.4 0.520 117.7 108.3 75.0 9.8 70.4 22.9 21.9 15 18 A E E < S-A 12 0A 49 -3,-1.6 -3,-2.5 205,-0.1 2,-0.4 -0.918 73.0-115.3-119.3 148.0 72.2 25.8 20.3 16 19 A L E +A 11 0A 5 -2,-0.4 8,-1.9 237,-0.3 2,-0.3 -0.647 45.0 174.6 -77.2 120.6 71.0 28.9 18.4 17 20 A V E -AB 10 23A 10 -7,-2.8 -7,-2.0 -2,-0.4 6,-0.2 -0.923 26.6-122.1-126.4 161.3 72.3 28.6 14.8 18 21 A N > - 0 0 5 4,-2.7 3,-2.2 -2,-0.3 -11,-0.2 -0.187 47.6 -83.7 -89.2-175.7 71.9 30.6 11.5 19 22 A E T 3 S+ 0 0 102 -13,-2.2 -12,-0.1 1,-0.3 -10,-0.1 0.618 130.5 52.5 -71.1 -12.3 70.6 29.2 8.2 20 23 A R T 3 S- 0 0 191 -14,-0.2 -1,-0.3 2,-0.1 -13,-0.1 0.145 121.4-107.4-101.9 11.2 74.0 27.8 7.3 21 24 A G S < S+ 0 0 53 -3,-2.2 2,-0.3 1,-0.2 -2,-0.1 0.493 73.0 137.0 77.2 7.8 74.2 26.0 10.6 22 25 A E - 0 0 122 1,-0.1 -4,-2.7 -16,-0.1 -1,-0.2 -0.643 61.5-103.5 -90.7 142.2 76.8 28.2 12.4 23 26 A Q B -B 17 0A 112 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.3 -0.368 41.1-169.8 -60.2 141.2 76.4 29.2 16.0 24 27 A V - 0 0 9 -8,-1.9 2,-0.5 229,-0.1 -8,-0.2 -0.967 11.2-154.9-134.6 145.6 75.2 32.8 16.4 25 28 A Q - 0 0 37 -2,-0.3 2,-0.3 229,-0.1 229,-0.1 -0.986 7.8-154.2-125.3 124.4 75.0 34.9 19.5 26 29 A L - 0 0 0 -2,-0.5 230,-2.6 29,-0.0 2,-0.4 -0.724 12.9-179.8 -99.5 138.7 72.6 37.8 19.7 27 30 A K E +c 256 0B 8 -2,-0.3 29,-1.9 228,-0.2 30,-0.6 -0.953 24.0 117.7-137.7 125.3 73.3 40.7 22.1 28 31 A G E -cd 257 57B 0 228,-2.1 230,-2.4 -2,-0.4 2,-0.3 -0.807 51.4 -77.2-162.1-161.3 71.0 43.7 22.4 29 32 A M E -cd 258 58B 0 28,-1.0 30,-2.5 228,-0.3 2,-0.4 -0.880 24.0-142.4-118.8 150.2 68.8 45.8 24.6 30 33 A S E -cd 259 59B 0 228,-2.8 231,-2.5 -2,-0.3 230,-0.6 -0.880 22.2-124.8-102.5 144.9 65.2 45.5 25.9 31 34 A S E -c 261 0B 1 28,-2.8 231,-0.1 -2,-0.4 3,-0.1 -0.277 25.8-119.5 -68.6 168.3 62.9 48.4 26.2 32 35 A H S S- 0 0 7 229,-0.8 29,-0.5 1,-0.2 2,-0.2 -0.147 71.8 -35.7 -89.1-164.8 61.4 49.1 29.6 33 36 A G >> - 0 0 0 1,-0.2 4,-2.7 -2,-0.1 3,-1.5 -0.427 55.9-142.7 -60.1 129.0 57.5 48.9 29.7 34 37 A L H 3> S+ 0 0 10 27,-2.0 4,-0.5 1,-0.3 -1,-0.2 0.680 98.7 62.3 -65.9 -22.3 56.2 50.2 26.4 35 38 A Q H 34 S+ 0 0 46 1,-0.1 -1,-0.3 2,-0.1 -2,-0.1 0.582 118.9 26.1 -74.7 -11.6 53.2 51.8 28.2 36 39 A W H <4 S+ 0 0 115 -3,-1.5 -2,-0.2 2,-0.0 3,-0.1 0.689 134.9 24.0-116.6 -43.8 55.6 54.0 30.2 37 40 A Y H >< S+ 0 0 43 -4,-2.7 3,-1.7 1,-0.1 -5,-0.2 -0.080 72.5 129.6-126.6 36.0 58.8 54.5 28.1 38 41 A G G >< + 0 0 10 -4,-0.5 3,-1.9 1,-0.3 -1,-0.1 0.751 59.0 77.8 -63.3 -21.9 57.7 53.9 24.5 39 42 A Q G 3 S+ 0 0 85 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.756 88.0 59.9 -62.1 -23.1 59.3 57.1 23.4 40 43 A F G < S+ 0 0 2 -3,-1.7 2,-0.7 221,-0.2 -1,-0.3 0.463 90.0 80.4 -82.8 -2.1 62.7 55.3 23.4 41 44 A V < + 0 0 0 -3,-1.9 2,-0.3 -4,-0.1 -1,-0.1 -0.886 64.0 110.3-111.4 104.1 61.5 52.7 20.9 42 45 A N S > S- 0 0 22 -2,-0.7 4,-2.3 1,-0.1 5,-0.3 -0.973 78.4 -92.4-162.8 163.0 61.7 54.1 17.4 43 46 A Y H > S+ 0 0 85 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.877 120.1 50.8 -50.6 -46.3 63.7 53.6 14.2 44 47 A E H > S+ 0 0 99 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.928 112.5 43.0 -65.8 -42.9 66.2 56.3 15.0 45 48 A S H > S+ 0 0 0 232,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.877 115.8 50.0 -69.2 -39.2 67.1 55.1 18.5 46 49 A M H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.894 110.3 50.5 -67.1 -36.9 67.2 51.5 17.3 47 50 A K H X S+ 0 0 69 -4,-2.6 4,-2.6 -5,-0.3 5,-0.2 0.906 109.8 50.3 -67.7 -36.7 69.5 52.6 14.4 48 51 A W H X>S+ 0 0 75 -4,-2.3 4,-3.0 2,-0.2 5,-0.9 0.915 110.1 50.0 -66.1 -43.6 71.8 54.3 16.9 49 52 A L H X>S+ 0 0 0 -4,-2.3 6,-1.7 1,-0.2 5,-1.1 0.924 113.3 47.4 -58.8 -44.0 71.9 51.2 19.1 50 53 A R H <5S+ 0 0 62 -4,-2.4 4,-0.4 4,-0.2 -2,-0.2 0.929 121.1 34.5 -61.6 -49.6 72.8 49.1 16.0 51 54 A D H <5S+ 0 0 93 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.858 129.7 29.1 -79.2 -38.5 75.5 51.5 14.7 52 55 A D H <5S+ 0 0 28 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.1 0.804 133.2 29.7 -94.7 -36.9 77.1 52.8 17.9 53 56 A W T < S+ 0 0 29 33,-0.4 3,-1.4 4,-0.2 4,-0.1 -0.119 93.8 67.5 -95.3-161.8 49.2 44.3 33.2 66 69 A S T 3 S- 0 0 44 1,-0.3 -1,-0.1 2,-0.1 -3,-0.1 0.894 138.3 -42.6 51.4 46.4 50.4 47.4 35.1 67 70 A G T 3 S+ 0 0 37 -3,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.578 117.3 122.1 78.3 8.4 48.7 49.7 32.5 68 71 A G S X> S- 0 0 0 -3,-1.4 4,-2.7 3,-0.1 3,-0.8 0.300 78.3 -39.8 -78.9-152.1 49.9 47.5 29.6 69 72 A Y T 34 S+ 0 0 27 -6,-2.8 -5,-0.2 1,-0.2 -4,-0.2 0.748 129.8 52.9 -53.8 -40.8 48.1 45.7 26.9 70 73 A I T 34 S+ 0 0 44 -6,-2.3 -1,-0.2 1,-0.2 -5,-0.1 0.873 117.9 38.5 -69.2 -32.2 45.1 44.4 28.8 71 74 A D T <4 S+ 0 0 109 -3,-0.8 -2,-0.2 -7,-0.6 -1,-0.2 0.836 139.4 9.7 -84.0 -36.7 44.2 47.8 30.1 72 75 A D >< - 0 0 83 -4,-2.7 3,-1.2 -8,-0.2 -1,-0.3 -0.788 63.4-171.1-147.5 98.8 45.1 49.7 26.9 73 76 A P G > + 0 0 66 0, 0.0 3,-2.4 0, 0.0 4,-0.3 0.587 68.6 93.2 -72.4 -6.0 45.8 47.6 23.8 74 77 A S G > + 0 0 69 1,-0.3 3,-1.9 2,-0.2 4,-0.5 0.808 70.0 75.9 -59.3 -24.9 47.0 50.5 21.8 75 78 A V G X> S+ 0 0 13 -3,-1.2 4,-1.5 1,-0.3 3,-0.9 0.757 76.5 74.6 -60.5 -20.7 50.6 49.6 23.0 76 79 A K H <> S+ 0 0 49 -3,-2.4 4,-2.2 1,-0.3 -1,-0.3 0.846 88.4 61.6 -60.3 -31.4 50.5 46.7 20.5 77 80 A E H <> S+ 0 0 100 -3,-1.9 4,-2.1 -4,-0.3 -1,-0.3 0.841 99.2 53.4 -63.1 -33.1 51.0 49.4 17.8 78 81 A K H <> S+ 0 0 44 -3,-0.9 4,-2.5 -4,-0.5 -1,-0.2 0.865 105.4 54.5 -69.7 -37.9 54.4 50.3 19.4 79 82 A V H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.955 107.9 49.9 -56.1 -48.2 55.4 46.6 19.2 80 83 A K H X S+ 0 0 27 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.924 108.7 52.3 -58.4 -42.3 54.6 46.8 15.4 81 84 A E H X S+ 0 0 79 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.936 110.9 47.3 -60.8 -41.5 56.7 49.9 15.1 82 85 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.926 112.7 49.0 -65.7 -40.8 59.7 48.2 16.8 83 86 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.927 112.6 47.7 -63.3 -44.9 59.2 45.1 14.6 84 87 A E H X S+ 0 0 93 -4,-2.9 4,-2.9 1,-0.2 -1,-0.2 0.891 110.8 51.3 -65.7 -38.6 59.1 47.2 11.5 85 88 A A H X S+ 0 0 5 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.923 108.9 51.2 -63.0 -43.8 62.2 49.2 12.6 86 89 A A H X>S+ 0 0 0 -4,-2.3 5,-2.3 2,-0.2 4,-0.7 0.894 110.4 49.1 -62.5 -39.4 64.1 45.9 13.1 87 90 A I H ><5S+ 0 0 32 -4,-2.2 3,-0.9 1,-0.2 -2,-0.2 0.957 112.7 48.0 -65.2 -44.3 63.1 44.7 9.6 88 91 A D H 3<5S+ 0 0 113 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.834 116.0 43.3 -64.1 -33.4 64.3 48.0 8.2 89 92 A L H 3<5S- 0 0 1 -4,-2.2 -87,-0.3 -5,-0.2 -1,-0.2 0.432 109.3-123.0 -93.9 -2.4 67.6 47.9 10.1 90 93 A D T <<5 + 0 0 38 -3,-0.9 -87,-1.8 -4,-0.7 -88,-0.3 0.915 69.2 122.1 58.1 46.7 68.1 44.2 9.4 91 94 A I < - 0 0 0 -5,-2.3 -1,-0.2 -89,-0.2 -34,-0.2 -0.827 65.3 -94.7-126.2 167.7 68.4 43.1 13.0 92 95 A Y E -e 57 0B 0 -36,-2.2 -34,-1.5 -2,-0.3 2,-0.4 -0.502 34.4-158.0 -79.9 157.2 66.4 40.6 15.1 93 96 A V E -ef 58 129B 0 35,-2.8 37,-2.3 -36,-0.2 2,-0.5 -1.000 8.4-149.2-141.3 135.0 63.4 41.5 17.3 94 97 A I E -ef 59 130B 0 -36,-2.5 -34,-2.7 -2,-0.4 2,-0.8 -0.915 7.8-152.2-105.8 123.4 61.8 39.9 20.2 95 98 A I E -ef 60 131B 0 35,-2.5 37,-3.2 -2,-0.5 2,-0.6 -0.881 21.7-162.0 -93.2 106.0 58.1 40.4 20.7 96 99 A D E -ef 61 132B 0 -36,-2.0 -34,-1.9 -2,-0.8 2,-1.3 -0.853 21.5-157.2-106.7 116.0 57.6 40.0 24.5 97 100 A W E -e 62 0B 0 35,-2.7 38,-2.2 -2,-0.6 2,-1.8 -0.729 30.6-151.3 -82.0 91.2 54.2 39.3 26.1 98 101 A H E +e 63 0B 2 -36,-2.3 -34,-1.2 -2,-1.3 -33,-0.4 -0.500 23.0 174.9 -88.5 78.4 55.5 40.8 29.3 99 102 A I + 0 0 0 -2,-1.8 37,-0.9 -36,-0.2 4,-0.1 -0.429 19.8 132.5 -74.4 149.3 53.7 39.1 32.2 100 103 A L S S+ 0 0 42 35,-0.1 -1,-0.1 -2,-0.1 38,-0.1 -0.034 75.8 27.3-158.5 -81.5 54.8 40.0 35.7 101 104 A S S S+ 0 0 79 1,-0.2 2,-1.7 2,-0.1 3,-0.1 0.850 115.3 67.2 -62.8 -29.2 52.2 40.9 38.4 102 105 A D S S- 0 0 10 1,-0.2 -1,-0.2 3,-0.0 6,-0.1 -0.684 82.8-179.7 -84.3 77.4 49.8 38.7 36.3 103 106 A N + 0 0 45 -2,-1.7 35,-2.3 -4,-0.1 -1,-0.2 0.624 53.6 62.9 -75.7 -19.7 52.1 35.9 37.5 104 107 A D S > S- 0 0 35 33,-0.2 3,-1.9 -3,-0.1 4,-0.4 -0.949 74.7-143.8-106.2 126.4 50.5 33.0 35.8 105 108 A P T 3 S+ 0 0 1 0, 0.0 3,-0.4 0, 0.0 7,-0.2 0.747 96.8 69.1 -60.8 -20.6 50.5 33.1 32.0 106 109 A N T > S+ 0 0 39 1,-0.2 3,-1.3 2,-0.2 4,-0.3 0.732 78.6 78.8 -70.6 -21.2 47.1 31.4 32.0 107 110 A I T < S+ 0 0 81 -3,-1.9 3,-0.2 1,-0.3 -1,-0.2 0.942 112.5 19.3 -52.1 -52.3 45.4 34.5 33.5 108 111 A Y T 3> S+ 0 0 55 -4,-0.4 4,-2.3 -3,-0.4 -1,-0.3 -0.102 86.2 128.3-108.7 38.8 45.4 36.2 30.1 109 112 A K H <> S+ 0 0 56 -3,-1.3 4,-2.6 1,-0.2 5,-0.2 0.882 71.4 52.7 -65.3 -34.5 45.9 33.2 27.8 110 113 A E H > S+ 0 0 104 -4,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.938 112.4 45.7 -66.9 -43.8 42.9 34.0 25.5 111 114 A E H > S+ 0 0 73 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.867 111.7 53.9 -64.9 -36.6 44.2 37.5 24.9 112 115 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.927 107.1 50.1 -63.3 -42.2 47.7 36.0 24.3 113 116 A K H X S+ 0 0 46 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.937 113.1 46.1 -63.6 -42.3 46.5 33.6 21.7 114 117 A D H X S+ 0 0 109 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.909 114.6 48.2 -64.9 -43.0 44.7 36.4 19.8 115 118 A F H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.921 114.0 45.0 -60.9 -52.6 47.8 38.7 20.1 116 119 A F H X S+ 0 0 0 -4,-3.1 4,-2.3 2,-0.2 5,-0.3 0.839 109.7 55.8 -67.9 -26.0 50.2 36.1 18.9 117 120 A D H X S+ 0 0 64 -4,-2.2 4,-2.5 -5,-0.3 5,-0.2 0.967 111.5 45.1 -63.1 -47.3 47.9 35.0 16.1 118 121 A E H X S+ 0 0 49 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.936 114.7 46.3 -63.5 -46.3 47.9 38.7 14.9 119 122 A M H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.893 115.3 45.5 -66.6 -43.0 51.7 39.2 15.2 120 123 A S H X S+ 0 0 1 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.867 111.7 52.4 -72.4 -28.9 52.6 35.9 13.5 121 124 A E H < S+ 0 0 128 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.929 116.1 41.8 -68.1 -42.1 50.0 36.5 10.7 122 125 A L H < S+ 0 0 85 -4,-2.4 3,-0.2 -5,-0.2 -2,-0.2 0.938 134.4 14.6 -67.1 -46.9 51.6 40.0 10.2 123 126 A Y H >< S+ 0 0 9 -4,-2.6 3,-1.9 -5,-0.2 6,-0.3 0.299 87.3 111.7-118.8 8.4 55.3 39.1 10.5 124 127 A G T 3< S+ 0 0 10 -4,-1.6 41,-0.2 1,-0.3 42,-0.2 0.653 76.7 57.9 -63.5 -17.7 55.5 35.3 10.2 125 128 A D T 3 S+ 0 0 161 -3,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.109 90.3 85.8-105.6 31.0 57.2 35.5 6.8 126 129 A Y X - 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