==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-MAY-11 2YIK . COMPND 2 MOLECULE: ENDOGLUCANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM THERMOCELLUM; . AUTHOR J.-Y.TSAI,M.M.KESAVULU,C.-D.HSIAO . 493 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17414.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 323 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 26 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 187 37.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 3 0 2 0 1 1 1 2 0 1 0 2 0 3 2 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 6 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 38 A Y 0 0 117 0, 0.0 2,-0.7 0, 0.0 388,-0.1 0.000 360.0 360.0 360.0 68.9 -11.0 26.4 -5.3 2 39 A N > - 0 0 32 1,-0.1 4,-1.6 478,-0.1 5,-0.1 -0.867 360.0-173.1 -98.8 104.4 -8.9 24.2 -3.0 3 40 A Y H > S+ 0 0 0 -2,-0.7 4,-2.1 2,-0.2 473,-0.2 0.733 81.9 59.2 -74.6 -23.2 -10.2 20.7 -3.2 4 41 A A H > S+ 0 0 1 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.925 111.0 41.8 -69.5 -43.9 -8.1 19.3 -0.4 5 42 A K H > S+ 0 0 48 480,-0.2 4,-3.0 2,-0.2 5,-0.2 0.850 112.0 55.8 -69.7 -34.5 -9.6 21.9 2.0 6 43 A A H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.921 108.8 47.2 -63.9 -42.7 -13.0 21.2 0.5 7 44 A L H X S+ 0 0 0 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.953 112.6 49.7 -61.8 -50.5 -12.6 17.5 1.3 8 45 A Q H >< S+ 0 0 9 -4,-2.3 3,-0.6 1,-0.2 4,-0.5 0.952 115.8 41.8 -52.8 -55.4 -11.4 18.3 4.8 9 46 A Y H >< S+ 0 0 9 -4,-3.0 3,-1.6 1,-0.2 4,-0.4 0.884 101.6 70.8 -61.3 -41.7 -14.3 20.6 5.5 10 47 A S H >< S+ 0 0 0 -4,-2.8 3,-0.9 1,-0.3 4,-0.3 0.796 95.0 52.9 -48.0 -38.2 -17.0 18.4 3.9 11 48 A M T XX S+ 0 0 1 -4,-1.1 3,-1.5 -3,-0.6 4,-0.9 0.732 88.4 78.6 -74.9 -20.9 -16.9 15.7 6.6 12 49 A F H <> S+ 0 0 3 -3,-1.6 4,-1.5 -4,-0.5 -1,-0.2 0.705 80.1 69.5 -62.1 -18.3 -17.5 18.1 9.5 13 50 A F H <> S+ 0 0 0 -3,-0.9 4,-0.7 -4,-0.4 -1,-0.3 0.881 96.9 53.6 -65.8 -34.4 -21.2 18.2 8.7 14 51 A Y H X> S+ 0 0 0 -3,-1.5 3,-0.9 -4,-0.3 4,-0.6 0.897 103.4 54.4 -67.4 -37.3 -21.3 14.7 9.9 15 52 A D H >< S+ 0 0 0 -4,-0.9 3,-0.8 1,-0.3 -1,-0.2 0.871 105.5 55.3 -62.1 -34.4 -19.7 15.6 13.2 16 53 A A H 3< S+ 0 0 0 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.690 111.5 43.5 -71.7 -19.1 -22.5 18.2 13.6 17 54 A N H << S+ 0 0 0 -3,-0.9 61,-3.0 -4,-0.7 -1,-0.2 0.340 78.2 131.7-108.5 4.8 -25.1 15.5 13.2 18 55 A M B << -A 77 0A 0 -3,-0.8 2,-0.3 -4,-0.6 59,-0.2 -0.323 39.6-162.3 -59.0 140.6 -23.7 12.8 15.4 19 56 A C + 0 0 0 57,-2.8 3,-0.4 15,-0.1 2,-0.2 -0.869 34.3 21.4-127.5 156.2 -26.4 11.4 17.7 20 57 A G B > S-B 35 0B 0 15,-1.0 15,-1.6 -2,-0.3 3,-0.7 -0.525 102.6 -32.0 98.7-159.8 -26.5 9.3 20.9 21 58 A T T 3 S+ 0 0 63 1,-0.2 -1,-0.2 13,-0.2 13,-0.1 0.458 124.9 60.9 -84.1 -3.8 -24.1 8.5 23.8 22 59 A G T 3> S+ 0 0 12 -3,-0.4 4,-1.5 1,-0.1 -1,-0.2 0.288 70.5 99.5-109.2 14.4 -21.0 8.6 21.6 23 60 A V H <> S+ 0 0 0 -3,-0.7 4,-2.9 2,-0.2 -1,-0.1 0.892 81.2 47.6 -74.4 -36.4 -20.9 12.1 20.3 24 61 A D H 4 S+ 0 0 92 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.791 117.2 48.3 -72.2 -17.7 -18.4 13.8 22.7 25 62 A E H 4 S+ 0 0 119 -4,-0.1 -1,-0.2 1,-0.1 -2,-0.2 0.769 125.5 25.8 -86.0 -26.8 -16.2 10.8 22.0 26 63 A N H < S+ 0 0 47 -4,-1.5 2,-0.3 -11,-0.1 -2,-0.2 0.711 100.8 83.8-110.8 -25.4 -16.6 10.9 18.2 27 64 A S < - 0 0 16 -4,-2.9 5,-0.1 -5,-0.2 -15,-0.0 -0.636 56.2-155.2 -86.1 139.1 -17.4 14.5 17.1 28 65 A L S S+ 0 0 28 -2,-0.3 2,-0.7 463,-0.1 -1,-0.1 0.438 70.1 97.4 -88.5 -0.9 -14.6 17.0 16.5 29 66 A L > - 0 0 10 1,-0.1 3,-1.9 -14,-0.1 -2,-0.1 -0.817 63.1-155.4 -95.3 116.3 -17.0 19.9 17.2 30 67 A S T 3 S+ 0 0 127 -2,-0.7 -1,-0.1 1,-0.3 -3,-0.0 0.743 91.7 63.3 -59.9 -25.2 -16.8 21.2 20.8 31 68 A W T 3 S+ 0 0 36 -3,-0.0 2,-0.5 2,-0.0 -1,-0.3 0.366 90.5 80.3 -84.2 7.2 -20.4 22.5 20.5 32 69 A R < + 0 0 8 -3,-1.9 2,-0.2 -9,-0.1 -5,-0.1 -0.958 55.7 165.0-115.0 129.1 -21.8 19.0 20.1 33 70 A G - 0 0 17 -2,-0.5 -13,-0.1 1,-0.1 -11,-0.1 -0.765 49.2 -52.8-129.7 178.5 -22.4 16.7 23.0 34 71 A D - 0 0 49 -2,-0.2 2,-0.3 -13,-0.1 -13,-0.2 -0.203 62.9-176.7 -53.2 141.3 -24.3 13.5 23.7 35 72 A C B +B 20 0B 1 -15,-1.6 -15,-1.0 1,-0.1 126,-0.2 -0.967 52.1 12.3-143.7 159.8 -28.0 13.8 22.7 36 73 A H > + 0 0 4 124,-0.8 3,-2.3 -2,-0.3 4,-0.3 0.852 68.0 164.3 42.0 42.4 -31.2 11.8 22.7 37 74 A V G > + 0 0 54 1,-0.3 3,-1.6 -17,-0.2 -1,-0.2 0.700 62.1 74.7 -63.0 -16.7 -29.4 9.4 25.1 38 75 A Y G > S+ 0 0 56 1,-0.3 3,-1.6 2,-0.2 -1,-0.3 0.657 77.3 77.4 -70.1 -10.8 -32.8 7.9 26.0 39 76 A D G X S+ 0 0 2 -3,-2.3 34,-2.2 1,-0.3 3,-1.0 0.805 85.6 63.0 -62.5 -30.0 -32.6 6.2 22.6 40 77 A A G < S+ 0 0 23 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.557 108.4 39.9 -73.0 -8.8 -30.2 3.9 24.3 41 78 A R G < S+ 0 0 138 -3,-1.6 -1,-0.3 -4,-0.1 31,-0.2 -0.288 77.5 166.3-134.3 46.6 -33.0 2.7 26.6 42 79 A L E < -C 71 0C 8 29,-2.2 29,-2.6 -3,-1.0 2,-0.2 -0.486 42.1-114.6 -65.6 127.1 -36.0 2.5 24.3 43 80 A P E -C 70 0C 36 0, 0.0 2,-1.4 0, 0.0 27,-0.3 -0.445 21.8-127.6 -66.9 133.8 -38.8 0.6 26.1 44 81 A L + 0 0 14 25,-2.6 2,-0.3 -2,-0.2 26,-0.0 -0.644 65.7 104.3 -85.2 88.5 -39.6 -2.7 24.3 45 82 A D S > S- 0 0 45 -2,-1.4 4,-1.3 11,-0.0 6,-0.4 -0.942 83.3 -91.4-154.0 173.4 -43.4 -2.5 23.8 46 83 A S T 4 S+ 0 0 23 -2,-0.3 7,-0.1 1,-0.2 -2,-0.1 0.376 120.2 44.6 -74.6 4.0 -46.0 -1.9 21.0 47 84 A Q T 4 S+ 0 0 128 -4,-0.1 -1,-0.2 5,-0.1 -3,-0.1 0.722 113.8 43.6-112.5 -43.2 -46.1 1.9 21.7 48 85 A N T 4 S+ 0 0 42 120,-0.1 121,-2.5 -5,-0.1 2,-0.3 0.672 129.3 27.5 -77.3 -15.8 -42.5 2.9 22.0 49 86 A T B < S-d 169 0D 0 -4,-1.3 121,-0.2 119,-0.2 119,-0.0 -0.811 82.1-124.4-130.8 173.4 -41.7 0.7 19.0 50 87 A N S S+ 0 0 37 119,-0.9 2,-0.3 -2,-0.3 -4,-0.1 0.077 72.4 114.1-110.2 23.0 -43.9 -0.3 16.1 51 88 A M S S- 0 0 7 -6,-0.4 -2,-0.2 1,-0.1 -3,-0.0 -0.684 72.4-106.7 -88.6 148.6 -43.5 -4.1 16.6 52 89 A S > - 0 0 52 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.266 21.7-113.7 -72.2 161.3 -46.7 -5.9 17.6 53 90 A D H > S+ 0 0 112 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.902 118.7 50.6 -59.8 -42.7 -47.4 -7.3 21.0 54 91 A G H > S+ 0 0 44 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.881 108.9 49.2 -64.2 -40.8 -47.2 -10.8 19.6 55 92 A F H > S+ 0 0 11 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.939 114.0 45.5 -64.9 -47.5 -44.0 -10.3 17.7 56 93 A I H X S+ 0 0 5 -4,-2.3 4,-1.0 1,-0.2 -2,-0.2 0.911 111.3 54.4 -61.0 -42.4 -42.3 -8.9 20.9 57 94 A S H < S+ 0 0 83 -4,-2.5 3,-0.4 1,-0.2 -2,-0.2 0.920 113.3 40.6 -58.7 -46.2 -43.8 -11.7 22.9 58 95 A S H < S+ 0 0 101 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.733 124.1 37.7 -75.9 -24.0 -42.3 -14.5 20.7 59 96 A N H >X S+ 0 0 40 -4,-1.7 4,-2.5 -5,-0.2 3,-1.8 0.275 75.2 116.0-114.6 13.1 -38.9 -12.7 20.1 60 97 A R H 3X S+ 0 0 113 -4,-1.0 4,-3.0 -3,-0.4 7,-0.2 0.831 72.5 58.8 -50.5 -42.4 -38.1 -11.2 23.5 61 98 A S H 34 S+ 0 0 98 1,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.716 114.8 36.8 -65.3 -19.7 -35.0 -13.3 24.2 62 99 A V H <4 S+ 0 0 34 -3,-1.8 -2,-0.2 2,-0.1 -1,-0.2 0.799 120.4 45.2 -98.2 -37.8 -33.4 -12.0 21.0 63 100 A L H < S+ 0 0 4 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.819 134.6 16.0 -73.0 -30.4 -34.7 -8.4 21.1 64 101 A D >< + 0 0 6 -4,-3.0 3,-2.2 -5,-0.3 -1,-0.2 -0.458 68.0 167.8-144.7 64.7 -33.8 -8.1 24.8 65 102 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.830 81.8 51.0 -48.9 -41.0 -31.4 -10.9 26.0 66 103 A D T 3 S- 0 0 113 4,-0.1 -5,-0.1 1,-0.1 -2,-0.0 0.568 102.0-136.6 -77.9 -8.6 -30.7 -9.2 29.3 67 104 A G < + 0 0 54 -3,-2.2 -1,-0.1 -7,-0.2 -6,-0.0 0.645 63.0 130.0 65.3 19.4 -34.4 -8.8 30.0 68 105 A D S S- 0 0 88 2,-0.2 -1,-0.1 1,-0.0 3,-0.1 0.411 76.0-118.0 -84.9 5.9 -34.3 -5.2 31.3 69 106 A G S S+ 0 0 27 -5,-0.2 -25,-2.6 1,-0.2 2,-0.3 0.642 80.9 96.8 71.4 16.0 -37.2 -4.4 29.0 70 107 A K E -C 43 0C 83 -27,-0.3 2,-0.3 -30,-0.1 -2,-0.2 -0.950 54.4-154.8-134.9 152.6 -35.2 -1.8 27.0 71 108 A V E -C 42 0C 6 -29,-2.6 -29,-2.2 -2,-0.3 2,-0.7 -0.933 19.3-124.7-126.3 155.2 -33.2 -1.8 23.7 72 109 A D + 0 0 63 -2,-0.3 -32,-0.3 -31,-0.2 -33,-0.1 -0.853 39.9 152.8-102.6 104.9 -30.4 0.4 22.5 73 110 A V + 0 0 0 -34,-2.2 -33,-0.2 -2,-0.7 2,-0.1 -0.104 37.3 127.5-118.6 33.9 -31.1 2.1 19.2 74 111 A S + 0 0 2 -35,-0.1 2,-0.2 -37,-0.1 -54,-0.1 -0.412 38.6 49.6 -86.8 164.0 -28.8 5.1 19.9 75 112 A G + 0 0 1 1,-0.1 -55,-0.1 -2,-0.1 49,-0.1 -0.574 59.7 87.0 106.2-169.8 -26.0 6.4 17.7 76 113 A G S S- 0 0 0 47,-0.6 -57,-2.8 -2,-0.2 2,-0.3 -0.320 79.0 -52.9 74.3-156.2 -25.8 7.3 14.1 77 114 A F B -A 18 0A 0 -59,-0.2 -59,-0.2 47,-0.1 2,-0.1 -0.932 39.5-113.1-130.5 146.7 -26.6 10.7 12.6 78 115 A H - 0 0 2 -61,-3.0 384,-0.2 -2,-0.3 7,-0.2 -0.388 39.2-125.1 -65.4 153.8 -29.5 13.2 12.7 79 116 A D - 0 0 3 5,-2.6 383,-2.9 382,-0.1 384,-0.4 0.969 67.2 -30.2 -75.3 -48.3 -30.9 13.3 9.2 80 117 A A S S- 0 0 3 381,-0.3 -2,-0.1 4,-0.2 381,-0.1 0.378 109.0 -37.2-137.7-108.3 -30.9 16.9 8.1 81 118 A G S S+ 0 0 1 334,-0.1 335,-2.2 335,-0.1 336,-0.2 0.331 126.7 71.5-104.8 -6.1 -31.3 20.2 10.2 82 119 A D S S- 0 0 12 333,-0.1 335,-0.1 334,-0.1 -2,-0.1 -0.124 88.9-121.1 -91.8-170.5 -33.8 18.1 12.3 83 120 A H + 0 0 3 -5,-0.1 2,-0.1 -4,-0.1 67,-0.0 0.362 68.1 114.2-123.5 2.6 -33.0 15.3 14.7 84 121 A V - 0 0 0 -6,-0.1 -5,-2.6 64,-0.1 2,-0.6 -0.407 59.3-138.3 -71.5 154.3 -34.9 12.3 13.4 85 122 A K E -E 147 0D 0 62,-2.1 62,-1.3 -7,-0.2 2,-0.5 -0.937 20.5-168.2-116.4 103.0 -32.9 9.3 12.1 86 123 A F E > -E 146 0D 2 -2,-0.6 4,-1.7 60,-0.2 60,-0.2 -0.827 15.0-143.4 -95.1 129.2 -34.5 8.1 8.8 87 124 A G H > S+ 0 0 7 58,-0.5 4,-2.4 -2,-0.5 5,-0.2 0.847 89.3 54.0 -60.8 -44.7 -33.3 4.7 7.6 88 125 A L H > S+ 0 0 8 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.964 118.1 33.7 -61.5 -54.6 -33.3 5.1 3.8 89 126 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.822 114.3 60.4 -72.9 -24.8 -31.2 8.3 3.6 90 127 A E H X S+ 0 0 1 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.957 111.2 40.6 -62.0 -47.6 -29.1 7.2 6.7 91 128 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.865 112.9 55.7 -67.8 -36.5 -28.0 4.1 4.7 92 129 A Y H X S+ 0 0 5 -4,-1.9 4,-2.6 -5,-0.2 5,-0.2 0.922 110.0 44.8 -62.4 -43.8 -27.6 6.2 1.5 93 130 A A H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.939 114.1 49.7 -65.4 -46.3 -25.2 8.6 3.2 94 131 A A H X S+ 0 0 1 -4,-2.2 4,-1.6 -5,-0.2 -2,-0.2 0.896 116.8 40.1 -59.1 -44.6 -23.2 5.8 4.9 95 132 A S H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.885 116.2 49.7 -75.8 -37.0 -22.9 3.8 1.7 96 133 A T H X S+ 0 0 1 -4,-2.6 4,-2.3 -5,-0.3 -2,-0.2 0.903 113.3 44.7 -71.2 -39.0 -22.2 6.8 -0.6 97 134 A V H X S+ 0 0 1 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.909 116.6 48.4 -68.0 -38.3 -19.5 8.3 1.7 98 135 A G H X S+ 0 0 0 -4,-1.6 4,-2.5 -5,-0.3 -2,-0.2 0.872 107.9 55.2 -64.8 -37.6 -18.1 4.8 2.0 99 136 A W H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.922 110.9 45.1 -59.9 -48.4 -18.3 4.5 -1.9 100 137 A G H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.895 112.5 49.5 -66.2 -41.3 -16.2 7.6 -2.2 101 138 A Y H < S+ 0 0 0 -4,-2.3 4,-0.5 1,-0.2 -2,-0.2 0.895 111.0 51.4 -65.0 -39.3 -13.7 6.5 0.5 102 139 A Y H < S+ 0 0 53 -4,-2.5 3,-0.4 -5,-0.2 -2,-0.2 0.918 115.8 40.6 -63.2 -44.0 -13.4 3.2 -1.3 103 140 A E H < S+ 0 0 3 -4,-2.1 3,-0.2 1,-0.2 -2,-0.2 0.910 128.5 27.5 -72.0 -45.1 -12.7 4.8 -4.7 104 141 A F S >X S+ 0 0 0 -4,-2.9 4,-1.5 -5,-0.2 3,-1.0 -0.097 70.8 133.4-114.2 37.7 -10.4 7.6 -3.6 105 142 A K H 3> S+ 0 0 39 -4,-0.5 4,-2.5 -3,-0.4 5,-0.2 0.858 71.3 63.4 -53.5 -38.1 -8.7 6.3 -0.4 106 143 A D H 3> S+ 0 0 97 -3,-0.2 4,-2.9 1,-0.2 -1,-0.3 0.889 104.2 46.5 -54.5 -42.3 -5.4 7.5 -1.8 107 144 A Q H <> S+ 0 0 23 -3,-1.0 4,-1.5 2,-0.2 6,-0.2 0.836 108.9 52.7 -71.2 -35.9 -6.6 11.1 -1.7 108 145 A F H <>S+ 0 0 0 -4,-1.5 5,-3.2 2,-0.2 6,-0.9 0.919 115.3 43.9 -64.5 -41.3 -8.0 10.9 1.8 109 146 A R H ><5S+ 0 0 137 -4,-2.5 3,-2.0 4,-0.2 -2,-0.2 0.952 109.4 54.0 -67.3 -49.9 -4.7 9.6 2.9 110 147 A A H 3<5S+ 0 0 72 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.800 115.2 42.6 -55.9 -29.5 -2.6 12.1 1.0 111 148 A T T 3<5S- 0 0 13 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.364 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