==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-JUN-07 2V38 . COMPND 2 MOLECULE: ENDOGLUCANASE 5A; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS AGARADHAERENS; . AUTHOR T.M.GLOSTER,P.J.MELONCELLI,V.A.MONEY,C.A.TARLING,G.J.DAVIES, . 301 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11434.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 72.8 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 . 12 4.0 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 . 21 7.0 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 . 87 28.9 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 1 3 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 . 4 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 0 100 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -44.1 73.7 43.2 7.3 2 5 A V H > + 0 0 35 88,-0.4 4,-2.8 87,-0.3 5,-0.4 0.928 360.0 38.1 -58.6 -53.9 73.1 40.9 10.4 3 6 A V H > S+ 0 0 5 87,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.881 117.1 51.1 -71.1 -35.9 69.9 39.4 9.3 4 7 A E H 4 S+ 0 0 161 86,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.927 115.1 45.1 -64.2 -39.2 70.9 39.1 5.6 5 8 A E H < S+ 0 0 104 -4,-2.7 -2,-0.2 1,-0.1 -1,-0.2 0.923 126.8 26.4 -68.6 -50.2 74.2 37.4 6.8 6 9 A H H < S+ 0 0 46 -4,-2.8 13,-2.3 -5,-0.2 14,-0.2 0.798 87.7 172.3 -91.5 -26.2 72.7 35.0 9.3 7 10 A G < + 0 0 7 -4,-2.3 2,-0.4 -5,-0.4 -1,-0.2 -0.282 52.0 24.9 63.5-135.5 69.2 34.7 7.8 8 11 A Q S S- 0 0 64 -4,-0.1 2,-0.2 10,-0.1 120,-0.1 -0.483 74.3-148.9 -70.3 120.6 66.9 32.1 9.2 9 12 A L + 0 0 3 118,-0.4 2,-0.3 -2,-0.4 9,-0.2 -0.625 25.0 160.3 -86.8 149.9 67.7 31.2 12.8 10 13 A S E -A 17 0A 38 7,-2.0 7,-2.7 -2,-0.2 2,-0.5 -0.944 39.6-101.5-154.4 173.8 67.0 27.7 14.2 11 14 A I E +A 16 0A 27 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.918 34.3 176.7-105.9 128.1 68.0 25.4 17.1 12 15 A S E > S-A 15 0A 48 3,-2.5 3,-1.5 -2,-0.5 -2,-0.0 -0.988 72.8 -17.5-132.7 121.3 70.5 22.6 16.4 13 16 A N T 3 S- 0 0 161 -2,-0.4 205,-0.1 1,-0.3 -1,-0.1 0.889 129.2 -51.6 50.5 42.5 71.7 20.3 19.2 14 17 A G T 3 S+ 0 0 11 1,-0.2 2,-0.4 204,-0.1 207,-0.4 0.598 117.1 109.8 75.6 14.4 70.5 22.9 21.8 15 18 A E E < S-A 12 0A 48 -3,-1.5 -3,-2.5 205,-0.1 2,-0.4 -0.949 73.0-115.6-124.5 141.9 72.3 25.8 20.2 16 19 A L E +A 11 0A 5 -2,-0.4 8,-1.9 237,-0.4 2,-0.3 -0.624 46.1 176.3 -70.8 124.9 71.1 28.9 18.3 17 20 A V E -AB 10 23A 6 -7,-2.7 -7,-2.0 -2,-0.4 6,-0.2 -0.913 26.6-120.6-131.3 155.8 72.4 28.6 14.8 18 21 A N > - 0 0 2 4,-2.5 3,-2.1 -2,-0.3 -11,-0.2 -0.158 50.3 -80.8 -82.4-174.1 72.2 30.6 11.5 19 22 A E T 3 S+ 0 0 114 -13,-2.3 -12,-0.1 1,-0.3 -10,-0.1 0.591 130.9 54.2 -74.5 -9.4 70.8 29.2 8.2 20 23 A R T 3 S- 0 0 112 -14,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.236 120.7-107.1 -99.4 8.2 74.2 27.5 7.5 21 24 A G S < S+ 0 0 47 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.632 75.1 137.4 79.3 11.0 74.1 25.7 10.8 22 25 A E - 0 0 99 -16,-0.1 -4,-2.5 1,-0.1 -1,-0.3 -0.730 61.0-101.6 -92.9 143.2 76.8 27.8 12.4 23 26 A Q B -B 17 0A 118 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.3 -0.302 41.6-173.8 -61.6 139.9 76.5 29.0 16.0 24 27 A V - 0 0 9 -8,-1.9 2,-0.4 229,-0.1 -8,-0.2 -0.976 13.1-153.9-134.3 150.7 75.4 32.6 16.4 25 28 A Q - 0 0 46 -2,-0.3 2,-0.4 229,-0.1 229,-0.1 -0.994 7.7-155.0-126.7 125.5 75.1 34.9 19.4 26 29 A L - 0 0 2 -2,-0.4 230,-2.6 29,-0.0 2,-0.4 -0.788 12.1-178.6 -97.2 140.7 72.8 37.8 19.6 27 30 A K E +c 256 0B 9 -2,-0.4 29,-2.1 228,-0.2 30,-0.6 -0.986 24.2 113.9-139.7 127.6 73.5 40.7 22.0 28 31 A G E -cd 257 57B 0 228,-1.7 230,-2.2 -2,-0.4 2,-0.3 -0.857 51.7 -68.8-164.0-159.1 71.2 43.7 22.4 29 32 A M E -cd 258 58B 0 28,-1.0 30,-2.6 228,-0.3 2,-0.4 -0.870 24.3-144.2-116.4 149.3 68.9 45.9 24.4 30 33 A S E -cd 259 59B 0 228,-3.0 231,-2.4 -2,-0.3 230,-0.6 -0.869 22.5-126.0 -98.8 141.4 65.4 45.5 25.9 31 34 A S E -c 261 0B 0 28,-2.9 231,-0.1 -2,-0.4 3,-0.1 -0.286 25.2-119.5 -61.5 165.9 63.0 48.4 26.1 32 35 A H S S- 0 0 6 229,-0.7 29,-0.4 5,-0.2 2,-0.1 -0.173 71.8 -36.2 -85.6-164.6 61.6 49.1 29.5 33 36 A G >> - 0 0 0 1,-0.2 4,-2.6 -2,-0.1 3,-1.8 -0.394 55.7-142.8 -59.9 126.7 57.7 48.9 29.6 34 37 A L H 3> S+ 0 0 10 27,-1.9 4,-0.6 1,-0.3 -1,-0.2 0.710 99.6 62.1 -65.6 -18.8 56.4 50.2 26.3 35 38 A Q H 34 S+ 0 0 45 2,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.596 118.1 27.4 -78.3 -12.5 53.4 51.8 28.2 36 39 A W H <4 S+ 0 0 109 -3,-1.8 -2,-0.2 2,-0.0 -1,-0.1 0.696 135.0 21.8-115.5 -39.5 55.9 54.0 30.1 37 40 A Y H >< S+ 0 0 41 -4,-2.6 3,-1.5 1,-0.1 -5,-0.2 -0.140 72.1 131.6-131.6 35.3 59.0 54.5 28.0 38 41 A G G >< + 0 0 10 -4,-0.6 3,-2.0 1,-0.3 -1,-0.1 0.710 60.2 77.3 -62.4 -21.0 57.8 53.9 24.5 39 42 A Q G 3 S+ 0 0 87 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.765 88.0 59.3 -64.3 -21.9 59.4 57.1 23.3 40 43 A F G < S+ 0 0 2 -3,-1.5 2,-0.7 221,-0.2 -1,-0.3 0.461 89.9 81.0 -82.9 -2.0 62.8 55.4 23.4 41 44 A V < + 0 0 0 -3,-2.0 2,-0.3 -4,-0.1 -1,-0.1 -0.903 64.2 111.4-110.3 101.8 61.7 52.8 20.9 42 45 A N S > S- 0 0 22 -2,-0.7 4,-2.5 1,-0.1 5,-0.3 -0.968 78.0 -93.5-161.5 164.4 61.9 54.1 17.3 43 46 A Y H > S+ 0 0 87 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.902 120.6 50.2 -50.9 -46.4 63.8 53.6 14.1 44 47 A E H > S+ 0 0 104 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.931 113.0 43.9 -66.7 -44.3 66.3 56.4 14.9 45 48 A S H > S+ 0 0 0 232,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.907 115.4 49.3 -65.7 -39.0 67.2 55.2 18.4 46 49 A M H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.884 110.2 50.9 -68.1 -35.2 67.4 51.6 17.2 47 50 A K H X S+ 0 0 63 -4,-2.6 4,-3.0 -5,-0.3 5,-0.3 0.903 109.3 51.2 -67.7 -40.2 69.6 52.6 14.3 48 51 A W H X>S+ 0 0 75 -4,-2.3 4,-3.0 2,-0.2 5,-0.8 0.929 110.3 49.0 -61.5 -43.5 71.9 54.4 16.8 49 52 A L H X>S+ 0 0 0 -4,-2.5 6,-1.8 3,-0.2 5,-1.2 0.908 113.8 46.9 -61.1 -42.3 72.0 51.3 19.0 50 53 A R H <5S+ 0 0 63 -4,-2.2 4,-0.4 4,-0.2 -2,-0.2 0.948 121.7 34.8 -62.8 -49.4 72.9 49.2 15.9 51 54 A D H <5S+ 0 0 85 -4,-3.0 -2,-0.2 2,-0.1 -3,-0.2 0.865 130.2 28.4 -79.1 -40.5 75.6 51.6 14.6 52 55 A D H <5S+ 0 0 27 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.1 0.820 133.6 28.8 -94.7 -36.1 77.1 53.0 17.8 53 56 A W T < S+ 0 0 24 33,-0.4 3,-1.6 5,-0.1 4,-0.1 -0.104 93.5 71.4 -99.2-161.8 49.4 44.3 33.1 66 69 A S T 3 S- 0 0 47 1,-0.3 -1,-0.1 2,-0.1 -3,-0.1 0.860 136.8 -44.6 57.1 40.5 50.7 47.4 35.0 67 70 A G T 3 S+ 0 0 37 -3,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.538 117.1 120.8 79.6 6.2 49.0 49.7 32.5 68 71 A G S X> S- 0 0 0 -3,-1.6 4,-2.8 3,-0.1 3,-0.7 0.285 79.0 -38.7 -81.9-150.1 50.1 47.6 29.5 69 72 A Y T 34 S+ 0 0 29 -6,-2.7 -5,-0.2 1,-0.2 -4,-0.1 0.761 131.8 50.6 -52.1 -41.2 48.3 45.7 26.8 70 73 A I T 34 S+ 0 0 45 -6,-2.5 -1,-0.2 1,-0.2 -5,-0.1 0.923 118.8 39.7 -64.8 -39.5 45.4 44.3 28.8 71 74 A D T <4 S+ 0 0 95 -7,-0.7 -2,-0.2 -3,-0.7 -1,-0.2 0.839 139.7 7.4 -76.6 -38.7 44.6 47.8 30.2 72 75 A D >< - 0 0 83 -4,-2.8 3,-1.3 -8,-0.2 -1,-0.3 -0.801 64.2-167.2-149.6 99.1 45.3 49.7 26.9 73 76 A P G > S+ 0 0 72 0, 0.0 3,-2.2 0, 0.0 4,-0.3 0.561 70.4 92.9 -70.9 -5.9 45.9 47.6 23.8 74 77 A S G > + 0 0 72 1,-0.3 3,-2.0 2,-0.2 4,-0.4 0.768 69.0 76.2 -58.2 -24.4 47.3 50.5 21.8 75 78 A V G X> S+ 0 0 14 -3,-1.3 4,-1.6 1,-0.3 3,-0.9 0.718 76.1 76.2 -60.4 -22.6 50.7 49.5 22.9 76 79 A K H <> S+ 0 0 41 -3,-2.2 4,-2.1 1,-0.2 -1,-0.3 0.835 88.8 59.5 -52.1 -34.3 50.6 46.7 20.4 77 80 A E H <> S+ 0 0 99 -3,-2.0 4,-2.1 -4,-0.3 -1,-0.2 0.800 99.6 54.4 -71.2 -29.4 51.3 49.3 17.7 78 81 A K H <> S+ 0 0 42 -3,-0.9 4,-2.3 -4,-0.4 -1,-0.2 0.863 106.0 52.9 -70.2 -36.2 54.5 50.3 19.4 79 82 A V H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.943 108.6 50.3 -58.6 -46.1 55.6 46.6 19.2 80 83 A K H X S+ 0 0 27 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.921 108.6 52.2 -59.5 -44.6 54.7 46.8 15.4 81 84 A E H X S+ 0 0 79 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.922 110.7 47.9 -55.5 -45.0 56.9 49.9 15.1 82 85 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.917 112.3 48.4 -62.6 -44.5 59.8 48.1 16.8 83 86 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.931 112.3 48.8 -62.6 -44.9 59.4 45.1 14.6 84 87 A E H X S+ 0 0 93 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.907 110.5 51.1 -65.0 -38.4 59.3 47.2 11.4 85 88 A A H X S+ 0 0 4 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.918 109.4 51.1 -61.6 -43.0 62.3 49.2 12.5 86 89 A A H X>S+ 0 0 0 -4,-2.3 5,-2.2 2,-0.2 4,-0.8 0.911 110.3 48.8 -64.3 -40.8 64.2 45.9 13.1 87 90 A I H ><5S+ 0 0 31 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.946 113.1 47.1 -61.7 -46.3 63.3 44.7 9.6 88 91 A D H 3<5S+ 0 0 116 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.835 116.9 43.9 -63.7 -30.9 64.4 48.0 8.1 89 92 A L H 3<5S- 0 0 1 -4,-2.2 -87,-0.3 -5,-0.2 -1,-0.2 0.417 109.4-122.8 -94.9 -3.5 67.7 47.9 10.1 90 93 A D T <<5 + 0 0 35 -3,-0.8 -87,-1.9 -4,-0.8 -88,-0.4 0.893 68.7 122.8 59.1 44.9 68.3 44.2 9.4 91 94 A I < - 0 0 1 -5,-2.2 -1,-0.2 -89,-0.2 -34,-0.2 -0.855 65.0 -98.6-123.5 166.6 68.5 43.2 13.0 92 95 A Y E -e 57 0B 0 -36,-2.4 -34,-1.5 -2,-0.3 2,-0.4 -0.424 34.1-156.2 -81.2 159.9 66.5 40.6 15.0 93 96 A V E -ef 58 129B 0 35,-2.7 37,-2.3 -36,-0.2 2,-0.5 -1.000 8.3-147.8-144.0 134.7 63.6 41.5 17.2 94 97 A I E -ef 59 130B 0 -36,-2.6 -34,-2.9 -2,-0.4 2,-0.8 -0.926 7.5-152.6-105.2 122.8 62.0 39.9 20.2 95 98 A I E -ef 60 131B 0 35,-2.6 37,-3.1 -2,-0.5 2,-0.7 -0.875 22.1-162.0 -93.9 106.9 58.3 40.4 20.7 96 99 A D E -ef 61 132B 0 -36,-2.1 -34,-2.1 -2,-0.8 2,-1.2 -0.855 21.2-156.7-107.8 109.9 57.9 40.0 24.5 97 100 A W E -e 62 0B 0 35,-2.8 38,-2.3 -2,-0.7 2,-1.8 -0.750 30.0-151.7 -77.5 93.9 54.5 39.3 26.1 98 101 A H E +e 63 0B 3 -36,-2.6 -34,-1.1 -2,-1.2 -33,-0.4 -0.482 23.2 173.8 -93.1 73.3 55.8 40.8 29.3 99 102 A I + 0 0 1 -2,-1.8 37,-1.0 -36,-0.2 4,-0.1 -0.441 19.0 132.5 -69.7 149.4 53.9 39.1 32.1 100 103 A L S S+ 0 0 48 35,-0.1 -1,-0.1 -2,-0.1 38,-0.1 0.035 75.7 27.7-159.2 -79.4 55.0 40.0 35.7 101 104 A S S S+ 0 0 73 1,-0.2 2,-1.8 2,-0.1 3,-0.1 0.836 114.8 67.3 -66.6 -32.1 52.4 40.9 38.3 102 105 A D S S+ 0 0 9 1,-0.2 -1,-0.2 3,-0.0 6,-0.1 -0.680 82.7 179.7 -78.9 78.8 50.0 38.7 36.2 103 106 A N + 0 0 43 -2,-1.8 35,-2.2 -4,-0.1 -1,-0.2 0.600 53.5 62.7 -76.5 -19.9 52.3 35.9 37.4 104 107 A D S > S- 0 0 35 33,-0.2 3,-2.0 -3,-0.1 4,-0.4 -0.941 74.2-145.0-104.2 123.4 50.7 32.9 35.8 105 108 A P T 3 S+ 0 0 2 0, 0.0 3,-0.4 0, 0.0 7,-0.2 0.713 95.8 70.4 -63.1 -18.4 50.7 33.1 32.0 106 109 A N T > S+ 0 0 38 1,-0.2 3,-1.2 2,-0.2 4,-0.3 0.706 78.3 78.5 -68.4 -18.2 47.4 31.4 31.9 107 110 A I T < S+ 0 0 80 -3,-2.0 3,-0.2 1,-0.3 -1,-0.2 0.936 112.8 18.7 -59.4 -45.3 45.6 34.5 33.3 108 111 A Y T 3> S+ 0 0 54 -3,-0.4 4,-2.6 -4,-0.4 -1,-0.3 -0.056 86.1 128.0-116.4 35.5 45.6 36.2 30.0 109 112 A K H <> S+ 0 0 56 -3,-1.2 4,-2.5 1,-0.2 5,-0.2 0.846 71.7 54.1 -63.4 -35.9 46.2 33.2 27.7 110 113 A E H > S+ 0 0 105 -4,-0.3 4,-2.0 -3,-0.2 -1,-0.2 0.937 111.9 44.4 -65.1 -42.7 43.2 34.0 25.5 111 114 A E H > S+ 0 0 72 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.872 112.1 54.3 -65.9 -38.6 44.5 37.5 24.8 112 115 A A H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 5,-0.3 0.919 107.5 49.7 -59.9 -44.7 48.0 36.0 24.3 113 116 A K H X S+ 0 0 47 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.935 112.8 46.6 -61.8 -45.6 46.8 33.6 21.7 114 117 A D H X S+ 0 0 108 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.916 114.3 48.3 -62.7 -42.3 45.0 36.4 19.8 115 118 A F H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.934 113.6 45.2 -64.4 -48.3 48.0 38.7 20.0 116 119 A F H X S+ 0 0 0 -4,-3.0 4,-2.4 2,-0.2 5,-0.2 0.839 109.4 56.3 -69.7 -29.3 50.5 36.1 18.8 117 120 A D H X S+ 0 0 72 -4,-2.4 4,-2.2 -5,-0.3 -2,-0.2 0.960 111.7 44.0 -58.4 -50.6 48.1 35.1 16.1 118 121 A E H X S+ 0 0 51 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.931 115.6 46.5 -61.3 -47.0 48.1 38.7 14.8 119 122 A M H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.920 114.6 46.1 -66.7 -40.4 51.9 39.2 15.2 120 123 A S H X S+ 0 0 1 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.829 111.4 52.7 -73.5 -30.3 52.8 35.9 13.5 121 124 A E H < S+ 0 0 132 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.915 116.7 40.2 -66.0 -41.7 50.3 36.6 10.7 122 125 A L H < S+ 0 0 83 -4,-2.3 -2,-0.2 -5,-0.2 3,-0.2 0.909 133.8 17.5 -70.8 -44.6 51.8 40.0 10.1 123 126 A Y H >< S+ 0 0 11 -4,-2.7 3,-1.9 -5,-0.2 6,-0.3 0.311 87.0 108.9-116.9 4.1 55.5 39.1 10.5 124 127 A G T 3< S+ 0 0 10 -4,-1.5 41,-0.2 1,-0.3 42,-0.2 0.586 76.6 58.0 -68.1 -12.0 55.8 35.3 10.1 125 128 A D T 3 S+ 0 0 163 -3,-0.2 -1,-0.3 -4,-0.1 -2,-0.1 0.122 90.9 85.9-103.7 24.2 57.5 35.5 6.8 126 129 A Y X - 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0 0 8 -17,-1.9 4,-2.8 -2,-0.4 5,-0.2 -0.263 35.2 -95.7 -74.0 170.1 74.4 55.8 32.9 288 291 A P H > S+ 0 0 88 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.922 129.9 48.1 -54.2 -39.7 77.1 53.6 34.6 289 292 A S H > S+ 0 0 0 -22,-0.3 4,-2.8 -20,-0.3 5,-0.2 0.953 111.7 48.3 -64.5 -49.7 75.1 50.6 33.5 290 293 A G H > S+ 0 0 0 -21,-0.5 4,-2.8 1,-0.2 5,-0.2 0.887 108.7 53.7 -58.6 -41.7 74.6 51.8 29.9 291 294 A T H X S+ 0 0 66 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.929 112.4 45.2 -58.1 -46.2 78.3 52.6 29.5 292 295 A F H X S+ 0 0 23 -4,-1.7 4,-2.5 -5,-0.2 -2,-0.2 0.933 113.8 47.2 -61.4 -51.4 79.2 49.1 30.6 293 296 A V H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.922 111.2 51.8 -63.2 -43.5 76.6 47.4 28.4 294 297 A R H X S+ 0 0 58 -4,-2.8 4,-2.8 -5,-0.2 -1,-0.2 0.924 110.0 49.7 -56.3 -45.1 77.6 49.5 25.3 295 298 A E H X S+ 0 0 80 -4,-2.0 4,-2.5 -5,-0.2 5,-0.2 0.924 108.8 52.9 -62.2 -40.3 81.3 48.5 25.9 296 299 A K H X S+ 0 0 19 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.915 113.5 42.2 -60.9 -42.7 80.3 44.8 26.1 297 300 A I H X S+ 0 0 2 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.921 113.9 50.8 -74.9 -38.4 78.4 44.9 22.8 298 301 A R H < S+ 0 0 111 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.905 108.9 52.5 -62.8 -42.0 81.0 47.0 21.0 299 302 A E H < S+ 0 0 109 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.922 112.4 46.3 -56.0 -44.8 83.8 44.6 22.2 300 303 A S H < 0 0 66 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.812 360.0 360.0 -68.6 -33.1 81.8 41.8 20.8 301 304 A A < 0 0 98 -4,-1.9 -2,-0.2 -248,-0.2 -1,-0.2 0.713 360.0 360.0 -95.4 360.0 81.0 43.5 17.5