==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-JUL-08 3DX4 . COMPND 2 MOLECULE: ALPHA-MANNOSIDASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR D.A.KUNTZ,D.R.ROSE . 1016 1 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35783.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 668 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 212 20.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 7 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 88 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 194 19.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.1 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 1 0 0 3 0 1 1 1 1 1 1 1 1 0 0 1 1 0 1 0 0 0 0 0 0 1 0 RESIDUES PER ALPHA HELIX . 2 2 3 2 1 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 PARALLEL BRIDGES PER LADDER . 7 8 2 6 3 4 3 3 2 0 1 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 1 3 2 1 0 0 0 0 1 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 30 A Q 0 0 218 0, 0.0 3,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -62.3 44.8 33.9 -19.3 2 31 A a - 0 0 57 1,-0.1 2,-0.1 1000,-0.0 1000,-0.0 -0.392 360.0-106.1 -59.0 139.2 43.4 37.4 -18.6 3 32 A Q - 0 0 53 1001,-0.1 2,-0.8 1,-0.1 -1,-0.1 -0.350 31.1-115.1 -61.3 143.1 39.7 37.6 -17.7 4 33 A D > - 0 0 55 1,-0.1 4,-0.5 -3,-0.1 220,-0.2 -0.782 29.1-171.0 -82.6 113.9 37.4 38.9 -20.5 5 34 A V T 4 S+ 0 0 4 -2,-0.8 -1,-0.1 1,-0.1 877,-0.1 0.435 77.1 42.8 -90.4 3.5 36.1 42.2 -19.1 6 35 A V T 4 S+ 0 0 16 869,-0.1 871,-0.5 870,-0.1 -1,-0.1 0.789 112.1 38.7-109.4 -43.4 33.5 42.7 -21.9 7 36 A Q T 4 S+ 0 0 128 869,-0.2 2,-0.6 1,-0.1 -2,-0.1 0.497 97.5 73.2-100.9 -9.6 31.7 39.5 -22.8 8 37 A D < - 0 0 80 -4,-0.5 -1,-0.1 214,-0.2 216,-0.1 -0.899 67.7-150.2-112.9 102.2 31.1 37.7 -19.5 9 38 A V - 0 0 59 -2,-0.6 213,-0.1 1,-0.1 871,-0.1 -0.566 27.5-120.7 -70.1 116.7 28.4 39.3 -17.2 10 39 A P - 0 0 13 0, 0.0 2,-0.8 0, 0.0 214,-0.1 -0.256 13.6-132.9 -58.8 143.0 29.3 38.6 -13.6 11 40 A N + 0 0 145 213,-0.4 2,-0.3 2,-0.0 3,-0.0 -0.889 40.2 161.9 -96.9 110.5 26.9 36.6 -11.6 12 41 A V - 0 0 19 -2,-0.8 3,-0.2 1,-0.1 359,-0.1 -0.934 46.4-129.0-126.1 153.5 26.5 38.5 -8.2 13 42 A D S S+ 0 0 99 -2,-0.3 2,-0.4 1,-0.2 358,-0.2 0.864 101.3 27.5 -67.5 -35.5 23.9 38.3 -5.5 14 43 A V E +a 371 0A 5 356,-1.8 358,-2.2 -3,-0.0 2,-0.5 -0.990 63.7 179.4-130.6 120.2 23.5 42.1 -5.5 15 44 A Q E > -a 372 0A 27 -2,-0.4 4,-2.8 356,-0.2 3,-0.4 -0.991 23.8-144.9-119.7 117.8 24.2 44.2 -8.5 16 45 A M H > S+ 0 0 5 356,-2.5 4,-2.6 -2,-0.5 357,-0.1 0.787 95.4 52.1 -63.8 -30.8 23.5 47.8 -7.6 17 46 A L H > S+ 0 0 33 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.916 113.8 45.5 -66.7 -40.1 22.1 49.0 -11.0 18 47 A E H > S+ 0 0 88 -3,-0.4 4,-1.7 2,-0.2 -2,-0.2 0.925 112.6 51.0 -68.5 -42.8 19.6 46.0 -10.9 19 48 A L H X S+ 0 0 4 -4,-2.8 4,-2.7 1,-0.2 3,-0.3 0.935 108.7 51.5 -59.2 -46.9 18.8 46.8 -7.3 20 49 A Y H < S+ 0 0 19 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.888 107.2 53.4 -55.9 -39.1 18.1 50.4 -8.1 21 50 A D H < S+ 0 0 84 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.860 116.6 38.4 -65.9 -33.9 15.7 49.4 -11.0 22 51 A R H < S+ 0 0 140 -4,-1.7 -2,-0.2 -3,-0.3 -1,-0.2 0.776 95.8 94.3 -89.8 -32.8 13.7 47.2 -8.6 23 52 A M < - 0 0 8 -4,-2.7 181,-0.0 -5,-0.2 180,-0.0 -0.341 58.9-153.5 -67.3 147.9 13.7 49.4 -5.4 24 53 A S - 0 0 82 179,-0.1 -1,-0.1 2,-0.1 -4,-0.0 0.658 18.0-147.9 -93.7 -21.7 10.8 51.8 -4.7 25 54 A F + 0 0 23 1,-0.2 2,-0.2 178,-0.1 178,-0.1 0.765 29.3 173.2 62.2 27.0 12.7 54.2 -2.5 26 55 A K - 0 0 158 1,-0.1 2,-1.1 177,-0.1 -1,-0.2 -0.506 27.8-143.7 -69.6 136.4 9.7 55.1 -0.4 27 56 A D + 0 0 82 -2,-0.2 2,-0.3 2,-0.0 -1,-0.1 -0.651 35.5 164.0-103.6 76.9 10.6 57.3 2.5 28 57 A I - 0 0 98 -2,-1.1 2,-0.8 7,-0.1 -2,-0.0 -0.653 47.2-103.4-100.7 151.7 8.3 56.0 5.2 29 58 A D - 0 0 117 -2,-0.3 6,-0.2 1,-0.2 5,-0.1 -0.600 33.5-173.4 -72.0 109.5 8.5 56.6 9.0 30 59 A G - 0 0 11 4,-2.6 3,-0.4 -2,-0.8 2,-0.3 0.396 40.7-112.0 -86.6 2.5 9.9 53.3 10.3 31 60 A G S S- 0 0 24 3,-0.3 -1,-0.3 1,-0.2 5,-0.1 -0.816 82.2 -8.4 102.1-144.2 9.5 54.3 13.9 32 61 A V S S+ 0 0 60 -2,-0.3 2,-1.3 1,-0.2 -1,-0.2 0.897 137.1 58.5 -60.5 -37.5 12.4 54.9 16.3 33 62 A W S > S- 0 0 14 -3,-0.4 3,-2.0 1,-0.2 -1,-0.2 -0.775 88.0-165.1 -85.3 94.6 14.6 53.6 13.4 34 63 A K T 3 S+ 0 0 124 -2,-1.3 -4,-2.6 1,-0.3 -3,-0.3 0.792 80.6 33.5 -61.6 -31.4 13.2 56.4 11.2 35 64 A Q T 3 S+ 0 0 24 -6,-0.2 -1,-0.3 -5,-0.1 171,-0.1 0.209 123.7 41.1-109.3 16.6 14.4 54.9 8.0 36 65 A G S < S- 0 0 1 -3,-2.0 2,-0.3 212,-0.1 -8,-0.1 0.064 87.9 -92.9-124.7-126.0 14.0 51.2 8.9 37 66 A W - 0 0 71 -2,-0.1 2,-0.9 169,-0.0 -7,-0.1 -0.906 48.2 -73.6-152.4 173.7 11.5 49.2 10.8 38 67 A N - 0 0 109 -2,-0.3 2,-0.2 -6,-0.1 -7,-0.1 -0.680 55.6-138.7 -78.8 104.9 10.8 48.0 14.3 39 68 A I - 0 0 13 -2,-0.9 2,-0.3 1,-0.0 256,-0.1 -0.456 19.9-167.0 -72.4 134.4 13.5 45.2 14.6 40 69 A K - 0 0 182 -2,-0.2 2,-0.3 255,-0.1 -1,-0.0 -0.910 4.9-174.7-115.9 147.6 12.4 42.0 16.4 41 70 A Y - 0 0 64 -2,-0.3 254,-0.1 256,-0.0 3,-0.0 -0.979 31.2-114.3-138.4 155.5 14.6 39.2 17.6 42 71 A D > - 0 0 96 -2,-0.3 3,-2.6 1,-0.2 4,-0.4 -0.783 21.3-150.4 -81.9 113.7 14.1 35.8 19.2 43 72 A P G > S+ 0 0 89 0, 0.0 3,-0.7 0, 0.0 -1,-0.2 0.797 95.6 62.5 -58.8 -22.2 15.6 36.1 22.7 44 73 A L G 3 S+ 0 0 144 1,-0.2 -2,-0.0 -3,-0.0 0, 0.0 0.464 76.3 89.4 -81.1 -0.1 16.4 32.4 22.4 45 74 A K G < S+ 0 0 67 -3,-2.6 2,-0.4 2,-0.0 -1,-0.2 0.885 87.6 50.8 -63.3 -38.9 18.8 33.0 19.5 46 75 A Y S < S+ 0 0 8 -3,-0.7 2,-0.3 -4,-0.4 5,-0.2 -0.837 72.2 149.8-103.1 140.1 21.7 33.5 21.9 47 76 A N B > -F 50 0B 70 3,-1.8 3,-1.9 -2,-0.4 293,-0.0 -0.882 62.4 -67.8-153.4-179.2 22.4 31.0 24.7 48 77 A A T 3 S+ 0 0 70 1,-0.3 3,-0.2 -2,-0.3 -2,-0.0 0.812 133.4 40.7 -48.8 -35.5 25.3 29.5 26.8 49 78 A H T 3 S+ 0 0 185 1,-0.2 -1,-0.3 2,-0.0 2,-0.2 0.450 122.6 39.7 -98.9 -0.0 26.7 27.7 23.7 50 79 A H B < S+F 47 0B 58 -3,-1.9 -3,-1.8 2,-0.0 -1,-0.2 -0.680 76.2 176.1-150.3 84.2 26.1 30.6 21.2 51 80 A K - 0 0 77 -3,-0.2 2,-0.6 -5,-0.2 292,-0.2 -0.556 34.8-114.3 -91.1 154.2 26.9 34.0 22.7 52 81 A L E -g 343 0C 0 290,-2.6 292,-2.5 -2,-0.2 2,-0.6 -0.838 28.7-150.9 -83.7 118.7 26.8 37.4 21.0 53 82 A K E -gh 344 304C 90 250,-3.2 252,-3.2 -2,-0.6 2,-0.5 -0.873 13.5-163.3 -95.4 123.1 30.3 38.8 21.0 54 83 A V E -gh 345 305C 0 290,-2.6 292,-2.3 -2,-0.6 2,-0.6 -0.924 9.2-164.8-115.1 125.2 30.2 42.6 21.0 55 84 A F E -gh 346 306C 20 250,-2.9 252,-3.0 -2,-0.5 2,-0.7 -0.931 4.5-161.6-111.1 112.4 33.2 44.8 20.1 56 85 A V E -gh 347 307C 0 290,-2.8 292,-2.5 -2,-0.6 40,-0.1 -0.854 12.0-163.1 -93.0 117.3 32.9 48.4 21.2 57 86 A V E - h 0 308C 0 250,-2.4 252,-2.8 -2,-0.7 292,-0.1 -0.864 6.7-147.7-113.4 98.9 35.4 50.3 19.1 58 87 A P E + h 0 309C 0 0, 0.0 40,-1.9 0, 0.0 2,-0.3 -0.421 29.8 162.4 -66.3 140.9 36.4 53.8 20.3 59 88 A H E -ih 98 310C 2 250,-2.0 252,-0.6 38,-0.2 2,-0.3 -0.958 31.1-150.2-153.8 165.4 37.2 56.3 17.5 60 89 A S E - h 0 311C 6 38,-0.5 2,-0.7 -2,-0.3 40,-0.3 -0.915 17.8-140.1-146.4 116.5 37.5 60.0 16.8 61 90 A H E - h 0 312C 1 250,-1.9 252,-2.9 -2,-0.3 2,-0.6 -0.689 22.9-173.6 -84.0 114.7 36.8 61.4 13.4 62 91 A N - 0 0 0 -2,-0.7 42,-0.1 250,-0.2 250,-0.0 -0.889 11.0-152.1-117.6 103.6 39.4 64.1 12.7 63 92 A D - 0 0 2 -2,-0.6 2,-2.4 1,-0.1 5,-0.1 -0.597 14.8-137.5 -74.8 123.6 39.0 66.1 9.5 64 93 A P S S- 0 0 0 0, 0.0 6,-0.4 0, 0.0 377,-0.1 -0.406 88.1 -19.2 -74.0 63.9 42.2 67.5 7.9 65 94 A G S S+ 0 0 0 -2,-2.4 4,-0.2 4,-0.4 378,-0.2 0.191 81.5 127.6 103.9 135.0 40.4 70.8 7.4 66 95 A W S S+ 0 0 37 2,-2.3 384,-2.7 -3,-0.1 387,-0.2 -0.349 91.6 3.0-169.6 -84.8 36.6 71.5 7.3 67 96 A I S S+ 0 0 46 382,-0.2 2,-0.3 2,-0.1 385,-0.1 0.654 142.0 28.6 -88.8 -21.9 35.4 74.4 9.5 68 97 A Q S S- 0 0 47 -5,-0.1 -2,-2.3 384,-0.0 382,-0.1 -0.868 97.0 -97.9-125.5 166.4 39.0 75.0 10.6 69 98 A T > - 0 0 13 -2,-0.3 4,-2.9 -4,-0.2 -4,-0.4 -0.326 40.3-100.6 -75.5 167.0 42.3 74.5 8.7 70 99 A F H > S+ 0 0 13 -6,-0.4 4,-2.4 1,-0.2 -5,-0.2 0.937 125.0 45.5 -45.5 -53.4 44.4 71.4 9.2 71 100 A E H > S+ 0 0 64 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.895 111.1 51.9 -69.0 -35.5 46.8 73.4 11.5 72 101 A E H > S+ 0 0 67 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.941 113.2 44.2 -65.3 -47.1 44.0 75.1 13.4 73 102 A Y H X>S+ 0 0 11 -4,-2.9 4,-2.8 1,-0.2 5,-2.3 0.890 112.0 54.4 -62.9 -38.3 42.3 71.7 14.2 74 103 A Y H <>S+ 0 0 6 -4,-2.4 5,-2.4 -5,-0.3 6,-0.3 0.939 114.4 39.7 -60.3 -47.0 45.7 70.2 15.0 75 104 A Q H <5S+ 0 0 66 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.872 124.9 36.2 -69.8 -40.0 46.4 73.0 17.6 76 105 A H H <5S- 0 0 95 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.789 137.5 -5.5 -86.6 -28.4 42.9 73.2 19.1 77 106 A D T >X5S+ 0 0 24 -4,-2.8 4,-2.3 -5,-0.3 3,-0.7 0.683 118.1 55.2-132.0 -61.7 41.8 69.6 19.0 78 107 A T H 3> S+ 0 0 75 -3,-0.7 4,-2.8 -6,-0.3 5,-0.2 0.876 110.2 52.9 -74.3 -39.9 45.1 67.0 22.5 81 110 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.949 114.7 41.7 -59.1 -47.3 43.1 64.0 21.4 82 111 A L H X S+ 0 0 1 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.903 114.1 51.1 -69.9 -39.5 46.3 62.1 20.4 83 112 A S H X S+ 0 0 58 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.921 115.1 43.5 -61.6 -44.0 48.2 63.2 23.6 84 113 A N H X S+ 0 0 23 -4,-2.8 4,-3.0 2,-0.2 5,-0.3 0.859 110.3 55.2 -73.9 -29.1 45.3 62.1 25.7 85 114 A A H X S+ 0 0 2 -4,-2.5 4,-2.7 -5,-0.2 5,-0.4 0.933 108.1 50.3 -65.1 -41.3 44.9 58.8 23.8 86 115 A L H X S+ 0 0 4 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.961 115.3 41.8 -61.1 -47.4 48.6 58.1 24.4 87 116 A R H X S+ 0 0 125 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.947 117.9 45.0 -65.7 -48.8 48.2 58.7 28.1 88 117 A H H X S+ 0 0 6 -4,-3.0 4,-1.2 2,-0.2 7,-0.2 0.894 115.2 45.6 -68.9 -38.8 44.9 56.9 28.6 89 118 A L H < S+ 0 0 0 -4,-2.7 3,-0.4 -5,-0.3 -1,-0.2 0.925 112.0 53.4 -68.4 -41.5 45.8 53.9 26.5 90 119 A H H < S+ 0 0 85 -4,-2.3 -2,-0.2 -5,-0.4 -1,-0.2 0.948 115.7 40.0 -54.1 -47.8 49.1 53.6 28.3 91 120 A D H < S+ 0 0 91 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.628 117.0 48.8 -80.2 -14.9 47.4 53.7 31.7 92 121 A N >< - 0 0 31 -4,-1.2 3,-2.1 -3,-0.4 -1,-0.2 -0.794 66.8-170.3-129.8 84.0 44.4 51.5 30.8 93 122 A P T 3 S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.650 83.4 50.5 -57.9 -22.2 45.7 48.3 29.1 94 123 A E T 3 S+ 0 0 146 2,-0.1 253,-0.2 254,-0.0 2,-0.1 0.536 87.2 101.0 -89.7 -10.9 42.2 47.0 28.0 95 124 A M < - 0 0 2 -3,-2.1 2,-0.3 -6,-0.2 -3,-0.1 -0.485 56.1-166.5 -73.0 147.7 41.1 50.3 26.5 96 125 A K - 0 0 25 -2,-0.1 2,-0.3 -40,-0.1 33,-0.2 -0.882 11.8-178.5-133.1 164.1 41.3 50.5 22.6 97 126 A F E - j 0 129C 0 31,-2.1 33,-2.4 -2,-0.3 2,-0.3 -0.956 14.6-144.9-162.9 141.9 41.2 53.2 20.0 98 127 A I E -ij 59 130C 3 -40,-1.9 -38,-0.5 -2,-0.3 2,-0.4 -0.865 12.1-162.3-113.4 150.9 41.4 53.3 16.2 99 128 A W E + j 0 131C 1 31,-2.3 33,-2.5 -2,-0.3 35,-0.2 -0.997 15.1 170.7-137.2 132.4 43.0 56.0 14.1 100 129 A A + 0 0 7 -2,-0.4 2,-0.9 -40,-0.3 34,-0.4 0.810 55.7 74.7-105.8 -42.5 42.5 56.8 10.4 101 130 A E > - 0 0 3 1,-0.2 4,-1.7 33,-0.1 3,-0.4 -0.688 46.8-178.5 -93.9 104.1 44.1 60.1 9.3 102 131 A I H > S+ 0 0 0 33,-2.6 4,-3.3 -2,-0.9 5,-0.3 0.800 76.1 71.7 -76.4 -22.9 47.9 59.7 9.1 103 132 A S H > S+ 0 0 3 33,-2.2 4,-1.6 32,-0.3 -1,-0.2 0.949 108.2 37.4 -53.2 -46.0 48.4 63.4 8.1 104 133 A Y H > S+ 0 0 0 -3,-0.4 4,-2.6 32,-0.4 -1,-0.2 0.882 115.5 52.6 -70.0 -45.3 47.6 64.3 11.7 105 134 A F H X S+ 0 0 0 -4,-1.7 4,-3.2 1,-0.2 5,-0.2 0.925 109.4 48.7 -61.2 -43.5 49.3 61.3 13.2 106 135 A A H X S+ 0 0 3 -4,-3.3 4,-2.2 2,-0.2 -1,-0.2 0.895 111.0 51.0 -61.6 -41.2 52.6 62.0 11.5 107 136 A R H X S+ 0 0 65 -4,-1.6 4,-0.9 -5,-0.3 -2,-0.2 0.956 115.4 43.1 -60.9 -48.5 52.4 65.7 12.5 108 137 A F H >X S+ 0 0 10 -4,-2.6 3,-1.0 1,-0.2 4,-0.7 0.952 113.1 50.1 -61.6 -50.1 51.8 64.7 16.1 109 138 A Y H >< S+ 0 0 6 -4,-3.2 3,-1.1 1,-0.3 -1,-0.2 0.889 107.1 53.4 -63.1 -40.8 54.4 61.9 16.3 110 139 A H H 3< S+ 0 0 85 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.720 108.0 52.8 -71.4 -17.4 57.2 64.0 14.9 111 140 A D H << S+ 0 0 103 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.589 90.9 101.0 -89.3 -10.4 56.6 66.6 17.6 112 141 A L S << S- 0 0 25 -3,-1.1 2,-0.0 -4,-0.7 -3,-0.0 -0.474 76.6-114.9 -74.5 143.2 56.8 64.0 20.4 113 142 A G > - 0 0 49 -2,-0.2 4,-2.4 1,-0.1 3,-0.2 -0.299 36.3-102.2 -63.3 160.7 59.8 63.6 22.6 114 143 A E H > S+ 0 0 114 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.856 119.6 55.8 -60.5 -39.5 61.6 60.3 22.3 115 144 A N H > S+ 0 0 125 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.940 112.1 43.4 -60.3 -45.7 60.2 58.8 25.5 116 145 A K H > S+ 0 0 104 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.833 108.6 58.1 -69.7 -35.1 56.6 59.4 24.2 117 146 A K H X S+ 0 0 31 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.940 109.6 46.2 -53.5 -48.7 57.5 58.1 20.7 118 147 A L H X S+ 0 0 88 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.903 111.2 50.5 -63.7 -43.3 58.5 54.9 22.4 119 148 A Q H X S+ 0 0 58 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.910 112.1 49.3 -57.1 -42.9 55.3 54.8 24.5 120 149 A M H X S+ 0 0 2 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.925 108.6 50.7 -65.0 -45.3 53.3 55.3 21.3 121 150 A K H X S+ 0 0 77 -4,-2.8 4,-3.1 1,-0.2 -1,-0.2 0.891 109.1 55.1 -59.6 -34.6 55.1 52.5 19.5 122 151 A S H X S+ 0 0 48 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.903 106.3 47.3 -68.1 -44.2 54.4 50.3 22.4 123 152 A I H <>S+ 0 0 3 -4,-1.9 6,-2.1 2,-0.2 5,-1.3 0.751 116.0 46.6 -72.1 -22.5 50.6 50.8 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