==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-JUN-05 2BVD . COMPND 2 MOLECULE: ENDOGLUCANASE H; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM THERMOCELLUM; . AUTHOR E.J.TAYLOR,A.GOYAL,C.I.P.D.GUERREIRO,J.A.M.PRATES,V.A.MONEY, . 276 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11025.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 194 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 17.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 26 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 28.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 1 0 0 0 0 0 2 1 1 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 1 1 2 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 PARALLEL BRIDGES PER LADDER . 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 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 G 0 0 90 0, 0.0 2,-0.1 0, 0.0 243,-0.0 0.000 360.0 360.0 360.0 153.1 16.5 15.0 -2.3 2 9 A L - 0 0 20 1,-0.1 2,-0.3 243,-0.1 243,-0.2 -0.331 360.0-132.5 -58.1 121.4 15.9 17.5 0.5 3 10 A K E -a 245 0A 75 241,-2.6 243,-2.8 -2,-0.1 2,-0.5 -0.588 14.5-141.2 -78.2 138.8 19.1 17.9 2.6 4 11 A I E +a 246 0A 0 -2,-0.3 25,-2.6 241,-0.2 26,-1.6 -0.905 30.6 163.3-105.7 122.9 18.5 17.7 6.3 5 12 A G E -ab 247 30A 0 241,-2.9 243,-2.1 -2,-0.5 2,-0.3 -0.800 13.9-173.3-130.7 172.5 20.5 20.1 8.5 6 13 A A E -ab 248 31A 0 24,-1.3 26,-2.7 241,-0.3 2,-0.6 -0.950 32.8-135.5-161.0 146.1 20.7 21.6 12.0 7 14 A W E -a 249 0A 19 241,-2.1 243,-2.5 -2,-0.3 26,-0.1 -0.968 36.0-150.7 -85.7 118.4 22.4 24.1 14.3 8 15 A V - 0 0 15 -2,-0.6 3,-0.1 24,-0.5 241,-0.1 0.321 37.4 -99.9 -87.2 10.1 22.6 21.6 17.1 9 16 A G S S+ 0 0 27 1,-0.2 2,-0.3 242,-0.1 243,-0.1 0.435 101.7 48.0 91.6 0.4 22.4 24.2 20.0 10 17 A T S S- 0 0 81 3,-0.0 -2,-0.4 241,-0.0 -1,-0.2 -0.947 108.3 -67.0-156.6 165.2 26.1 24.2 20.6 11 18 A Q - 0 0 44 -2,-0.3 2,-2.2 1,-0.1 5,-0.1 -0.360 64.6-104.6 -60.0 138.4 29.3 24.5 18.5 12 19 A P + 0 0 0 0, 0.0 -1,-0.1 0, 0.0 39,-0.1 -0.401 51.3 169.0 -81.0 74.8 29.4 21.3 16.4 13 20 A S > - 0 0 51 -2,-2.2 4,-2.4 1,-0.1 5,-0.2 -0.235 54.1 -96.4 -61.5 166.1 32.1 19.1 18.0 14 21 A E H > S+ 0 0 117 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.936 127.8 46.3 -50.9 -49.1 32.3 15.5 16.9 15 22 A S H > S+ 0 0 90 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.856 109.2 53.6 -68.3 -34.7 30.2 14.4 19.9 16 23 A A H > S+ 0 0 10 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.888 111.9 46.0 -65.7 -39.9 27.6 17.1 19.4 17 24 A I H X S+ 0 0 1 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.956 115.3 45.4 -64.7 -52.2 27.1 16.1 15.7 18 25 A K H X S+ 0 0 86 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.897 111.7 53.2 -59.6 -41.8 26.9 12.3 16.6 19 26 A S H X S+ 0 0 71 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.907 108.9 48.7 -62.3 -41.5 24.5 13.1 19.5 20 27 A F H X S+ 0 0 5 -4,-1.8 4,-3.0 2,-0.2 5,-0.2 0.877 108.4 54.3 -66.6 -35.9 22.2 15.0 17.2 21 28 A Q H X>S+ 0 0 30 -4,-2.1 5,-1.2 1,-0.2 4,-1.2 0.911 109.9 46.8 -64.0 -40.6 22.2 12.2 14.7 22 29 A E H <5S+ 0 0 154 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.879 112.5 52.1 -63.2 -39.3 21.2 9.8 17.4 23 30 A L H <5S+ 0 0 36 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.961 117.8 33.8 -63.4 -52.5 18.5 12.2 18.5 24 31 A Q H <5S- 0 0 1 -4,-3.0 -1,-0.2 2,-0.2 -2,-0.2 0.562 103.4-128.3 -83.1 -6.0 16.9 12.7 15.1 25 32 A G T <5S+ 0 0 61 -4,-1.2 2,-0.3 -5,-0.2 -3,-0.2 0.790 76.1 80.4 65.4 30.6 17.6 9.0 14.0 26 33 A R S - c 0 63A 49 -2,-0.3 3,-0.7 26,-0.2 0, 0.0 -0.329 33.6 -96.2-101.4-171.7 31.7 36.2 14.6 37 44 A W T 3 S+ 0 0 1 26,-0.8 43,-0.1 1,-0.2 25,-0.0 0.034 116.5 61.8-101.2 23.8 34.2 38.4 12.8 38 45 A S T 3 S+ 0 0 81 2,-0.1 2,-0.5 42,-0.0 -1,-0.2 0.020 82.9 101.6-123.5 22.9 36.9 38.2 15.4 39 46 A T < - 0 0 19 -3,-0.7 2,-0.1 3,-0.0 -4,-0.0 -0.943 62.4-147.6-110.8 123.8 37.2 34.4 14.9 40 47 A D >> - 0 0 60 -2,-0.5 3,-1.3 1,-0.1 4,-1.1 -0.434 27.3-112.6 -81.3 159.1 40.1 33.0 12.9 41 48 A F H 3> S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -1,-0.1 0.794 113.8 71.7 -63.6 -24.3 39.7 29.9 10.8 42 49 A S H 34 S+ 0 0 71 1,-0.2 -1,-0.2 2,-0.2 -3,-0.0 0.840 98.8 48.0 -60.8 -29.7 42.1 28.1 13.2 43 50 A W H <4 S+ 0 0 110 -3,-1.3 4,-0.4 1,-0.2 -1,-0.2 0.849 114.3 46.1 -74.3 -36.9 39.3 28.2 15.7 44 51 A V H >X S+ 0 0 0 -4,-1.1 4,-2.5 1,-0.2 3,-1.2 0.837 92.8 83.3 -71.4 -36.4 36.8 26.8 13.2 45 52 A R H 3X S+ 0 0 90 -4,-2.8 4,-3.4 1,-0.3 5,-0.2 0.815 87.2 49.4 -43.8 -54.0 39.2 24.1 11.9 46 53 A P H 3> S+ 0 0 78 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.848 114.8 46.5 -62.6 -31.9 38.5 21.4 14.5 47 54 A Y H <> S+ 0 0 53 -3,-1.2 4,-2.4 -4,-0.4 -2,-0.2 0.945 112.1 50.1 -67.8 -49.8 34.8 21.8 14.1 48 55 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.922 108.9 53.2 -52.5 -45.7 35.1 21.8 10.3 49 56 A D H X S+ 0 0 57 -4,-3.4 4,-2.8 1,-0.2 -1,-0.2 0.916 108.8 49.1 -58.2 -45.6 37.2 18.6 10.6 50 57 A A H X S+ 0 0 14 -4,-1.8 4,-1.3 -5,-0.2 -1,-0.2 0.909 112.4 48.9 -58.9 -42.6 34.4 16.9 12.7 51 58 A V H <>S+ 0 0 0 -4,-2.4 5,-2.3 2,-0.2 -2,-0.2 0.919 115.9 41.0 -65.5 -47.2 31.8 17.9 10.1 52 59 A Y H ><5S+ 0 0 39 -4,-2.7 3,-1.2 1,-0.2 -2,-0.2 0.847 110.2 57.3 -73.5 -34.3 33.7 16.7 7.1 53 60 A N H 3<5S+ 0 0 136 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.825 106.1 53.1 -60.8 -31.1 34.9 13.5 8.8 54 61 A N T 3<5S- 0 0 31 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.558 120.5-111.8 -76.3 -11.8 31.1 12.8 9.4 55 62 A G T < 5S+ 0 0 48 -3,-1.2 2,-0.2 1,-0.3 -3,-0.2 0.772 75.2 128.0 80.8 29.3 30.4 13.2 5.6 56 63 A S < - 0 0 5 -5,-2.3 2,-0.4 -6,-0.1 -1,-0.3 -0.695 61.0-114.8-111.2 165.6 28.4 16.5 6.1 57 64 A I E -c 30 0A 30 -28,-2.5 -26,-2.8 -2,-0.2 2,-0.5 -0.846 28.0-133.8 -95.3 135.5 28.6 20.0 4.6 58 65 A L E -cd 31 95A 0 36,-0.6 38,-2.8 -2,-0.4 2,-0.5 -0.818 17.3-168.4 -89.8 124.1 29.5 22.8 7.0 59 66 A M E -cd 32 96A 0 -28,-2.7 -26,-2.6 -2,-0.5 2,-0.5 -0.976 8.0-164.2-108.0 122.2 27.3 26.0 6.8 60 67 A I E -cd 33 97A 0 36,-2.8 38,-3.2 -2,-0.5 2,-0.7 -0.941 13.2-152.7-109.7 121.6 28.8 28.9 8.7 61 68 A T E -cd 34 98A 0 -28,-2.8 -26,-2.7 -2,-0.5 2,-0.8 -0.871 19.0-156.3 -87.4 115.2 26.8 31.9 9.5 62 69 A W E -cd 35 99A 0 36,-1.1 38,-1.5 -2,-0.7 -26,-0.2 -0.843 8.0-164.3-108.3 99.8 29.5 34.6 9.7 63 70 A E E -c 36 0A 24 -28,-3.3 2,-2.1 -2,-0.8 -26,-0.8 -0.762 12.2-154.9 -99.4 107.6 28.2 37.4 11.9 64 71 A P > + 0 0 0 0, 0.0 3,-1.2 0, 0.0 -28,-0.1 -0.345 36.8 147.9 -82.8 65.6 30.1 40.8 11.7 65 72 A W T 3 S+ 0 0 127 -2,-2.1 3,-0.1 1,-0.2 -29,-0.0 0.840 77.9 53.8 -57.3 -28.4 29.3 42.1 15.2 66 73 A E T 3 S+ 0 0 69 -3,-0.3 2,-0.3 1,-0.2 -1,-0.2 0.542 115.0 34.6 -88.6 -11.5 32.7 43.8 14.9 67 74 A Y < - 0 0 60 -3,-1.2 -1,-0.2 4,-0.0 2,-0.1 -0.988 66.6-151.6-145.4 134.4 32.1 45.5 11.5 68 75 A N > - 0 0 39 -2,-0.3 4,-2.7 -3,-0.1 5,-0.2 -0.439 43.4 -90.4 -95.9 179.2 29.1 47.1 9.9 69 76 A T H > S+ 0 0 0 40,-0.3 4,-2.8 1,-0.2 5,-0.2 0.790 126.6 51.8 -66.0 -28.7 28.4 47.4 6.2 70 77 A V H > S+ 0 0 42 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.944 111.2 47.4 -68.4 -49.8 30.2 50.8 6.0 71 78 A D H 4>S+ 0 0 54 1,-0.2 5,-2.1 2,-0.2 6,-0.4 0.943 117.3 44.2 -51.7 -51.0 33.3 49.4 7.7 72 79 A I H ><5S+ 0 0 0 -4,-2.7 3,-1.7 1,-0.2 5,-0.2 0.945 112.2 48.8 -66.3 -48.5 33.2 46.4 5.4 73 80 A K H 3<5S+ 0 0 77 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.823 110.1 54.2 -63.6 -29.2 32.5 48.2 2.1 74 81 A N T 3<5S- 0 0 102 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.502 118.4-110.6 -84.3 -3.6 35.3 50.6 2.9 75 82 A G T X 5S+ 0 0 22 -3,-1.7 3,-1.6 -4,-0.4 4,-0.3 0.506 76.7 131.9 91.9 9.2 37.9 47.9 3.4 76 83 A K T 3 > S+ 0 0 1 -6,-0.4 4,-2.6 -5,-0.2 3,-0.6 0.263 82.6 110.5-105.1 7.3 37.9 44.5 7.7 78 85 A D H <> S+ 0 0 42 -3,-1.6 4,-2.9 1,-0.3 5,-0.2 0.828 71.2 55.8 -61.5 -34.6 40.0 43.5 4.7 79 86 A A H 3> S+ 0 0 70 -4,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.917 113.6 42.4 -60.4 -41.5 42.9 42.0 6.7 80 87 A Y H <> S+ 0 0 10 -3,-0.6 4,-2.2 2,-0.2 -2,-0.2 0.909 114.9 49.1 -72.0 -44.7 40.6 39.7 8.5 81 88 A I H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.938 110.5 51.3 -58.7 -48.5 38.6 38.8 5.4 82 89 A T H X S+ 0 0 41 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.902 108.9 50.1 -57.8 -45.0 41.7 38.0 3.5 83 90 A R H X S+ 0 0 98 -4,-1.8 4,-2.6 -5,-0.2 5,-0.2 0.921 111.5 49.4 -59.5 -44.7 43.1 35.7 6.2 84 91 A M H X S+ 0 0 2 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.921 111.4 48.8 -61.4 -42.7 39.8 33.9 6.2 85 92 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.911 113.1 47.0 -64.2 -44.5 39.7 33.5 2.5 86 93 A Q H X S+ 0 0 97 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.925 114.6 46.7 -63.7 -43.3 43.3 32.2 2.4 87 94 A D H X S+ 0 0 46 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.891 113.0 48.3 -69.8 -38.5 42.7 29.8 5.2 88 95 A M H X S+ 0 0 0 -4,-2.8 4,-2.2 -5,-0.2 -1,-0.2 0.887 111.1 50.8 -68.9 -36.6 39.5 28.5 3.7 89 96 A K H < S+ 0 0 114 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.948 110.9 48.8 -62.2 -47.2 41.1 28.0 0.3 90 97 A A H < S+ 0 0 79 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.875 107.7 54.8 -59.8 -39.7 44.0 26.1 2.0 91 98 A Y H < S- 0 0 31 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.917 89.9-168.6 -61.5 -44.5 41.4 23.9 3.8 92 99 A G < + 0 0 42 -4,-2.2 -1,-0.1 1,-0.2 -3,-0.1 0.106 35.4 122.0 88.2 -20.8 39.9 23.2 0.4 93 100 A K S S- 0 0 75 -5,-0.1 2,-0.6 1,-0.1 -1,-0.2 -0.345 74.9 -88.3 -80.1 157.4 36.6 21.5 1.3 94 101 A E + 0 0 88 49,-0.1 -36,-0.6 -2,-0.1 2,-0.4 -0.550 51.6 179.1 -69.0 113.8 33.1 22.8 0.2 95 102 A I E -de 58 143A 0 47,-1.6 49,-3.0 -2,-0.6 2,-0.6 -0.957 23.3-144.1-120.0 132.1 31.9 25.3 2.8 96 103 A W E -de 59 144A 1 -38,-2.8 -36,-2.8 -2,-0.4 2,-0.5 -0.881 22.1-163.4 -95.4 121.6 28.6 27.1 2.6 97 104 A L E -de 60 145A 0 47,-3.2 49,-2.8 -2,-0.6 -36,-0.2 -0.925 14.1-173.2-116.3 126.8 29.1 30.7 4.0 98 105 A R E -d 61 0A 0 -38,-3.2 -36,-1.1 -2,-0.5 3,-0.5 -0.748 16.6-179.3-120.8 80.6 26.2 32.9 5.0 99 106 A P E +d 62 0A 2 0, 0.0 49,-0.2 0, 0.0 -36,-0.2 -0.469 59.7 4.4 -77.8 150.3 27.6 36.4 5.8 100 107 A L S S- 0 0 0 -38,-1.5 3,-0.2 -2,-0.1 -37,-0.1 0.688 89.2-177.8 65.6 29.2 25.7 39.4 7.0 101 108 A H + 0 0 0 -3,-0.5 4,-0.2 1,-0.2 9,-0.1 0.370 48.9 28.6 -74.0-172.5 22.4 37.6 7.3 102 109 A E > + 0 0 10 1,-0.2 3,-1.8 2,-0.1 6,-0.3 0.779 69.4 156.3 35.1 40.9 18.8 38.5 8.2 103 110 A A T 3 + 0 0 0 45,-0.5 9,-2.5 1,-0.3 10,-0.7 0.618 61.8 66.6 -76.6 -10.0 19.6 42.0 6.9 104 111 A N T 3 S+ 0 0 1 7,-0.2 50,-2.5 8,-0.2 -1,-0.3 0.230 94.5 77.8 -88.6 12.4 15.9 42.7 6.2 105 112 A G S < S- 0 0 0 -3,-1.8 8,-1.5 48,-0.2 9,-0.3 -0.351 80.9-131.0 -99.7-172.3 15.5 42.6 10.0 106 113 A D S S+ 0 0 70 7,-0.2 9,-0.5 -2,-0.1 49,-0.1 0.265 85.2 80.4-124.1 10.5 16.3 45.3 12.6 107 114 A W S S+ 0 0 96 -5,-0.3 -4,-0.1 7,-0.1 -5,-0.0 0.656 75.9 72.4 -98.9 -18.0 18.2 43.3 15.2 108 115 A Y S > S- 0 0 27 -6,-0.3 3,-2.1 -7,-0.1 6,-0.2 -0.802 77.9-128.9-102.4 145.7 21.7 43.0 13.7 109 116 A P T 3 S+ 0 0 23 0, 0.0 -40,-0.3 0, 0.0 -1,-0.1 0.545 111.5 49.0 -70.1 -5.3 24.2 45.9 13.5 110 117 A W T 3 S+ 0 0 0 -42,-0.2 2,-0.1 -9,-0.1 -7,-0.1 0.345 89.9 111.8-105.2 1.1 24.7 45.2 9.8 111 118 A A S X S- 0 0 0 -3,-2.1 3,-1.1 1,-0.1 8,-0.4 -0.440 72.4-130.1 -82.2 149.5 21.0 45.0 9.0 112 119 A I T 3 S+ 0 0 12 -9,-2.5 -8,-0.2 1,-0.2 7,-0.1 0.872 110.5 51.8 -63.3 -35.6 19.2 47.6 6.8 113 120 A G T 3 S+ 0 0 2 -8,-1.5 43,-0.4 -10,-0.7 -1,-0.2 0.545 78.8 128.2 -77.8 -7.5 16.5 47.9 9.5 114 121 A Y X - 0 0 79 -3,-1.1 3,-2.3 -9,-0.3 5,-0.2 -0.286 68.6-122.2 -56.7 134.6 19.0 48.5 12.3 115 122 A S T 3 S+ 0 0 97 -9,-0.5 -1,-0.1 1,-0.3 -8,-0.0 0.589 104.9 68.3 -63.7 -17.9 18.0 51.7 14.2 116 123 A S T 3 S- 0 0 67 1,-0.1 -1,-0.3 -7,-0.0 -2,-0.1 0.691 93.4-141.2 -70.8 -19.4 21.3 53.6 13.6 117 124 A R < + 0 0 115 -3,-2.3 -2,-0.1 -6,-0.2 -1,-0.1 0.463 64.3 125.1 72.7 6.8 20.3 53.8 9.9 118 125 A V + 0 0 47 -4,-0.1 2,-0.6 -9,-0.1 -6,-0.1 0.779 53.7 73.7 -67.9 -29.7 24.0 53.2 8.9 119 126 A N + 0 0 4 -8,-0.4 2,-0.2 -5,-0.2 -2,-0.1 -0.791 60.5 170.1 -95.3 122.1 23.3 50.2 6.7 120 127 A T > - 0 0 54 -2,-0.6 4,-2.8 1,-0.1 5,-0.2 -0.731 50.8-100.2-117.1 170.8 21.6 50.9 3.3 121 128 A N H > S+ 0 0 51 -2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.932 124.8 49.9 -53.1 -44.0 21.0 48.7 0.3 122 129 A E H > S+ 0 0 140 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.913 112.1 43.2 -65.9 -46.0 24.1 50.3 -1.3 123 130 A T H > S+ 0 0 17 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.895 116.0 50.7 -68.4 -36.1 26.4 49.8 1.6 124 131 A Y H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 -2,-0.2 0.948 112.3 44.5 -64.2 -49.6 25.1 46.2 2.1 125 132 A I H X S+ 0 0 38 -4,-2.8 4,-2.8 -5,-0.2 5,-0.3 0.920 114.5 49.7 -63.6 -43.2 25.6 45.2 -1.5 126 133 A A H X S+ 0 0 41 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.914 112.7 47.9 -61.6 -40.7 29.0 46.8 -1.7 127 134 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.950 113.2 46.8 -63.9 -50.5 30.0 45.0 1.5 128 135 A F H X S+ 0 0 1 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.944 114.3 47.0 -59.4 -49.7 28.8 41.6 0.3 129 136 A R H X S+ 0 0 87 -4,-2.8 4,-2.9 1,-0.2 -1,-0.2 0.862 109.3 55.5 -60.8 -36.4 30.4 42.0 -3.1 130 137 A H H X S+ 0 0 46 -4,-1.9 4,-2.2 -5,-0.3 -1,-0.2 0.923 107.2 48.8 -65.2 -42.5 33.7 43.1 -1.5 131 138 A I H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.955 113.6 46.4 -58.9 -49.9 33.8 39.9 0.7 132 139 A V H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.910 109.6 54.6 -61.9 -43.1 33.2 37.7 -2.3 133 140 A D H X S+ 0 0 76 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.914 108.7 48.6 -55.6 -46.4 35.7 39.6 -4.4 134 141 A I H X S+ 0 0 17 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.928 111.3 49.5 -62.2 -45.0 38.4 39.0 -1.8 135 142 A F H <>S+ 0 0 0 -4,-2.3 5,-2.4 1,-0.2 3,-0.4 0.933 113.0 47.1 -59.8 -44.6 37.6 35.3 -1.5 136 143 A R H ><5S+ 0 0 120 -4,-2.8 3,-1.7 1,-0.2 -1,-0.2 0.888 107.2 55.7 -64.8 -39.1 37.7 34.9 -5.3 137 144 A A H 3<5S+ 0 0 87 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.772 109.5 49.6 -62.4 -25.2 41.1 36.8 -5.5 138 145 A N T 3<5S- 0 0 47 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.227 118.7-111.5-101.1 12.8 42.4 34.2 -3.0 139 146 A G T < 5 + 0 0 36 -3,-1.7 2,-2.5 1,-0.2 3,-0.3 0.592 63.9 150.5 74.7 14.6 41.2 31.2 -5.0 140 147 A A > < + 0 0 2 -5,-2.4 3,-1.5 1,-0.2 -1,-0.2 -0.304 9.2 144.8 -81.1 59.5 38.5 30.2 -2.5 141 148 A T T 3 + 0 0 119 -2,-2.5 -1,-0.2 1,-0.3 -5,-0.1 0.612 61.5 71.7 -71.6 -13.2 36.3 28.7 -5.1 142 149 A N T 3 S+ 0 0 21 -3,-0.3 -47,-1.6 -48,-0.1 2,-0.5 0.596 78.7 90.5 -76.6 -14.6 35.3 26.0 -2.6 143 150 A V E < -e 95 0A 4 -3,-1.5 2,-0.4 -49,-0.2 -47,-0.2 -0.776 66.1-156.3 -89.5 123.1 33.3 28.6 -0.6 144 151 A K E -e 96 0A 65 -49,-3.0 -47,-3.2 -2,-0.5 2,-0.5 -0.855 15.2-129.0-101.7 135.7 29.6 28.8 -1.7 145 152 A W E -e 97 0A 5 -2,-0.4 26,-2.7 -49,-0.2 27,-2.2 -0.741 16.8-161.6 -97.8 126.1 27.8 32.0 -1.0 146 153 A V B -i 172 0B 0 -49,-2.8 2,-0.2 -2,-0.5 27,-0.2 -0.913 2.2-159.7-110.8 113.3 24.4 32.0 0.8 147 154 A F - 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