==== 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 02-JAN-08 3BUB . 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) . 35954.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 664 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 213 21.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 86 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 192 18.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.7 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 1 0 0 3 1 1 0 1 1 1 1 1 1 0 0 1 1 0 1 0 0 0 0 0 0 1 0 RESIDUES PER ALPHA HELIX . 0 3 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 7 3 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 . 2 1 1 2 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 0 234 0, 0.0 2,-0.3 0, 0.0 1002,-0.1 0.000 360.0 360.0 360.0 110.4 45.4 34.2 -19.3 2 31 A a - 0 0 45 1,-0.1 2,-0.1 1000,-0.1 1000,-0.0 -0.562 360.0-112.9 -79.9 141.8 43.5 37.4 -18.8 3 32 A Q - 0 0 52 -2,-0.3 2,-0.6 1001,-0.1 -1,-0.1 -0.470 33.0-115.1 -62.8 141.0 39.9 37.4 -17.7 4 33 A D - 0 0 57 -2,-0.1 4,-0.5 1,-0.1 220,-0.2 -0.732 29.1-172.1 -79.1 116.9 37.5 38.8 -20.4 5 34 A V S S+ 0 0 4 -2,-0.6 -1,-0.1 1,-0.1 877,-0.1 0.372 76.3 43.8 -94.0 4.9 36.1 42.0 -19.0 6 35 A V S S+ 0 0 16 869,-0.1 871,-0.5 870,-0.1 -1,-0.1 0.778 109.4 40.9-112.4 -44.1 33.5 42.5 -21.8 7 36 A Q S S+ 0 0 126 869,-0.2 2,-0.6 1,-0.1 -2,-0.1 0.596 96.5 70.7 -96.8 -15.6 31.7 39.4 -22.7 8 37 A D - 0 0 74 -4,-0.5 -1,-0.1 214,-0.2 216,-0.0 -0.920 68.7-146.2-109.6 114.0 30.9 37.5 -19.5 9 38 A V - 0 0 54 -2,-0.6 213,-0.1 871,-0.1 871,-0.1 -0.690 28.4-121.1 -76.6 116.2 28.2 39.1 -17.2 10 39 A P - 0 0 14 0, 0.0 2,-0.8 0, 0.0 214,-0.1 -0.243 14.4-132.6 -60.3 141.1 29.3 38.4 -13.6 11 40 A N + 0 0 145 213,-0.4 2,-0.3 -3,-0.0 3,-0.1 -0.868 40.8 160.7 -96.3 111.1 26.9 36.4 -11.5 12 41 A V - 0 0 19 -2,-0.8 3,-0.2 1,-0.1 359,-0.1 -0.914 47.1-127.2-127.1 158.1 26.6 38.2 -8.2 13 42 A D S S+ 0 0 95 357,-0.4 2,-0.5 -2,-0.3 358,-0.2 0.888 101.2 26.9 -70.6 -39.2 24.0 38.2 -5.4 14 43 A V E -a 371 0A 3 356,-2.0 358,-2.2 -3,-0.1 2,-0.5 -0.987 63.7-180.0-127.6 120.2 23.5 42.0 -5.4 15 44 A Q E > -a 372 0A 11 -2,-0.5 4,-2.7 356,-0.2 3,-0.3 -0.988 22.7-145.7-118.4 116.7 24.2 44.1 -8.5 16 45 A M H > S+ 0 0 6 356,-2.5 4,-2.7 -2,-0.5 357,-0.1 0.799 95.2 51.4 -63.0 -31.8 23.5 47.7 -7.7 17 46 A L H > S+ 0 0 31 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.921 114.8 45.0 -66.3 -40.8 22.2 48.8 -11.0 18 47 A E H > S+ 0 0 81 -3,-0.3 4,-1.3 2,-0.2 -2,-0.2 0.886 112.4 51.6 -70.6 -36.9 19.7 45.9 -11.0 19 48 A L H >X S+ 0 0 5 -4,-2.7 4,-2.6 1,-0.2 3,-0.7 0.956 108.8 50.9 -63.2 -45.7 18.9 46.6 -7.4 20 49 A Y H 3< S+ 0 0 19 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.875 105.8 55.8 -57.1 -37.8 18.1 50.2 -8.2 21 50 A D H 3< S+ 0 0 84 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.840 116.7 35.7 -67.4 -32.6 15.9 49.1 -11.1 22 51 A R H << S+ 0 0 144 -4,-1.3 -2,-0.2 -3,-0.7 -1,-0.2 0.779 95.8 94.9 -90.7 -31.4 13.7 47.0 -8.7 23 52 A M < - 0 0 8 -4,-2.6 181,-0.0 -5,-0.1 180,-0.0 -0.291 60.7-148.8 -67.3 150.3 13.7 49.0 -5.5 24 53 A S - 0 0 72 179,-0.1 -1,-0.1 2,-0.1 -4,-0.0 0.616 14.6-149.9 -96.1 -16.6 10.9 51.5 -4.7 25 54 A F + 0 0 19 1,-0.2 2,-0.2 178,-0.1 178,-0.1 0.689 30.9 168.0 57.1 24.2 12.8 54.2 -2.6 26 55 A K - 0 0 148 1,-0.1 2,-1.2 177,-0.1 -1,-0.2 -0.470 32.9-140.4 -70.8 137.7 9.7 55.1 -0.6 27 56 A D + 0 0 85 -2,-0.2 2,-0.3 2,-0.0 -1,-0.1 -0.661 36.9 165.9 -99.5 79.0 10.6 57.3 2.4 28 57 A I - 0 0 96 -2,-1.2 2,-0.8 7,-0.1 -2,-0.0 -0.694 44.5-107.3-100.9 150.8 8.3 55.8 5.1 29 58 A D - 0 0 111 -2,-0.3 6,-0.2 1,-0.1 5,-0.1 -0.637 31.8-174.4 -74.9 108.6 8.5 56.4 8.8 30 59 A G - 0 0 13 4,-2.6 3,-0.4 -2,-0.8 2,-0.3 0.312 41.3-110.8 -89.3 7.4 9.8 53.1 10.2 31 60 A G S S- 0 0 24 3,-0.3 -1,-0.3 1,-0.2 5,-0.1 -0.790 83.2 -6.9 101.2-145.0 9.4 54.1 13.9 32 61 A V S S+ 0 0 70 -2,-0.3 2,-1.4 1,-0.2 -1,-0.2 0.890 136.2 57.9 -58.6 -37.0 12.4 54.8 16.2 33 62 A W S > S- 0 0 14 -3,-0.4 3,-1.9 1,-0.2 -1,-0.2 -0.770 88.0-164.9 -87.4 94.5 14.6 53.5 13.4 34 63 A K T 3 S+ 0 0 115 -2,-1.4 -4,-2.6 1,-0.3 -3,-0.3 0.823 80.1 34.9 -60.2 -34.4 13.1 56.2 11.2 35 64 A Q T 3 S+ 0 0 25 -6,-0.2 -1,-0.3 -5,-0.1 171,-0.1 0.237 123.8 38.3-107.6 15.7 14.4 54.8 7.9 36 65 A G S < S- 0 0 1 -3,-1.9 2,-0.3 212,-0.1 -8,-0.1 0.038 88.8 -91.0-126.8-125.7 14.0 51.1 8.8 37 66 A W - 0 0 71 -2,-0.1 2,-0.9 169,-0.0 -7,-0.1 -0.902 47.7 -73.5-151.6 173.2 11.4 49.1 10.7 38 67 A N - 0 0 109 -2,-0.3 2,-0.2 -6,-0.1 -7,-0.1 -0.688 55.5-140.3 -77.8 105.8 10.8 47.8 14.3 39 68 A I - 0 0 14 -2,-0.9 2,-0.3 1,-0.0 256,-0.1 -0.513 18.8-166.9 -74.3 134.9 13.4 45.1 14.6 40 69 A K - 0 0 179 -2,-0.2 2,-0.3 255,-0.1 -1,-0.0 -0.892 4.7-173.9-117.8 149.1 12.4 41.9 16.4 41 70 A Y - 0 0 64 -2,-0.3 254,-0.1 256,-0.0 3,-0.1 -0.968 29.7-114.1-139.3 157.8 14.6 39.2 17.7 42 71 A D > - 0 0 94 -2,-0.3 3,-2.1 1,-0.1 4,-0.3 -0.821 18.9-152.0 -88.7 116.2 14.3 35.8 19.3 43 72 A P G > S+ 0 0 88 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.832 95.4 61.8 -57.9 -27.5 15.6 35.9 22.8 44 73 A L G 3 S+ 0 0 143 1,-0.2 -2,-0.0 -3,-0.1 0, 0.0 0.508 78.5 89.1 -79.2 -2.8 16.4 32.2 22.5 45 74 A K G < S+ 0 0 67 -3,-2.1 2,-0.4 1,-0.1 -1,-0.2 0.878 88.4 46.9 -60.8 -42.7 18.8 32.8 19.6 46 75 A Y S < S+ 0 0 10 -3,-0.8 2,-0.2 -4,-0.3 5,-0.2 -0.906 73.0 150.4-106.3 135.5 21.8 33.3 22.0 47 76 A N B > -F 50 0B 67 3,-1.5 3,-1.4 -2,-0.4 293,-0.0 -0.774 62.8 -66.8-146.6-175.7 22.4 30.8 24.8 48 77 A A T 3 S+ 0 0 75 1,-0.3 3,-0.2 -2,-0.2 -2,-0.0 0.829 133.4 43.1 -52.1 -33.6 25.3 29.4 26.9 49 78 A H T 3 S+ 0 0 182 1,-0.3 2,-0.3 2,-0.0 -1,-0.3 0.599 122.4 36.7 -92.3 -8.9 26.7 27.6 23.8 50 79 A H B < S+F 47 0B 56 -3,-1.4 -3,-1.5 2,-0.0 -1,-0.3 -0.783 75.9 179.3-149.3 86.6 26.2 30.5 21.4 51 80 A K - 0 0 77 -2,-0.3 2,-0.6 -3,-0.2 292,-0.2 -0.581 33.6-113.6 -94.0 154.2 26.9 33.9 22.8 52 81 A L E -g 343 0C 0 290,-2.8 292,-2.6 -2,-0.2 2,-0.6 -0.819 29.9-151.5 -82.1 120.3 26.7 37.3 21.1 53 82 A K E -gh 344 304C 65 250,-3.1 252,-3.1 -2,-0.6 2,-0.5 -0.861 13.2-164.4 -96.3 120.7 30.3 38.7 21.0 54 83 A V E -gh 345 305C 0 290,-2.7 292,-2.3 -2,-0.6 2,-0.6 -0.927 9.5-164.7-115.4 124.5 30.2 42.5 21.1 55 84 A F E -gh 346 306C 18 250,-2.9 252,-2.9 -2,-0.5 2,-0.6 -0.932 5.1-161.1-107.5 113.1 33.2 44.7 20.2 56 85 A V E -gh 347 307C 0 290,-2.8 292,-2.6 -2,-0.6 40,-0.1 -0.860 11.7-163.0 -92.5 118.8 32.9 48.3 21.2 57 86 A V E - h 0 308C 0 250,-2.4 252,-2.8 -2,-0.6 292,-0.1 -0.866 6.6-147.9-114.6 101.0 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 -0.423 29.4 163.4 -68.8 141.7 36.3 53.8 20.4 59 88 A H E - h 0 310C 2 250,-2.0 252,-0.6 38,-0.2 2,-0.4 -0.954 31.3-148.8-154.8 165.3 37.1 56.2 17.6 60 89 A S E - h 0 311C 6 38,-0.5 2,-0.7 -2,-0.3 40,-0.3 -0.940 17.1-141.6-145.1 114.2 37.5 59.9 16.9 61 90 A H E - h 0 312C 1 250,-2.0 252,-2.9 -2,-0.4 2,-0.6 -0.708 23.0-175.0 -84.6 113.6 36.7 61.4 13.4 62 91 A N - 0 0 0 -2,-0.7 42,-0.1 250,-0.2 250,-0.1 -0.866 11.9-152.7-117.2 100.9 39.3 64.0 12.7 63 92 A D - 0 0 0 -2,-0.6 2,-2.5 1,-0.1 3,-0.1 -0.556 15.2-135.6 -72.2 123.9 38.8 66.0 9.5 64 93 A P S S- 0 0 0 0, 0.0 6,-0.4 0, 0.0 377,-0.1 -0.374 86.8 -19.1 -74.0 64.9 42.0 67.4 8.0 65 94 A G S S+ 0 0 0 -2,-2.5 4,-0.2 4,-0.3 378,-0.1 0.136 82.9 125.7 102.4 133.0 40.3 70.7 7.4 66 95 A W S S+ 0 0 31 2,-2.3 384,-2.9 -3,-0.1 387,-0.2 -0.318 90.6 6.1-169.9 -82.6 36.6 71.5 7.2 67 96 A I S S+ 0 0 46 382,-0.2 2,-0.3 -4,-0.1 385,-0.1 0.579 141.6 25.5 -88.6 -21.8 35.3 74.2 9.6 68 97 A Q S S- 0 0 48 384,-0.0 -2,-2.3 382,-0.0 382,-0.1 -0.890 97.9 -94.8-130.5 166.3 38.9 75.0 10.6 69 98 A T > - 0 0 14 -2,-0.3 4,-2.8 -4,-0.2 -4,-0.3 -0.343 39.9-102.1 -74.7 165.8 42.2 74.5 8.8 70 99 A F H > S+ 0 0 15 -6,-0.4 4,-2.3 1,-0.2 -5,-0.2 0.932 124.8 45.4 -48.7 -51.4 44.3 71.4 9.3 71 100 A E H > S+ 0 0 63 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.900 111.4 52.1 -70.4 -34.2 46.7 73.4 11.5 72 101 A E H > S+ 0 0 67 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.935 112.4 44.8 -64.2 -47.7 43.9 75.0 13.5 73 102 A Y H X>S+ 0 0 10 -4,-2.8 4,-2.3 2,-0.2 5,-2.2 0.876 111.4 54.9 -61.5 -38.2 42.2 71.7 14.3 74 103 A Y H <>S+ 0 0 6 -4,-2.3 5,-2.4 -5,-0.3 6,-0.3 0.945 114.3 39.3 -60.3 -44.9 45.6 70.2 15.1 75 104 A Q H <5S+ 0 0 68 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.861 124.3 37.9 -72.5 -36.8 46.3 73.0 17.7 76 105 A H H <5S- 0 0 98 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.663 137.5 -7.3 -90.5 -21.2 42.8 73.2 19.1 77 106 A D T >X5S+ 0 0 25 -4,-2.3 4,-2.3 -5,-0.2 3,-0.7 0.574 117.6 56.8-137.4 -62.3 41.7 69.5 19.1 78 107 A T H 3> S+ 0 0 74 -3,-0.7 4,-2.6 -6,-0.3 5,-0.3 0.896 110.5 51.4 -72.8 -40.9 45.0 67.0 22.6 81 110 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.944 114.3 43.0 -57.9 -50.7 43.2 63.9 21.5 82 111 A L H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.898 114.7 48.9 -67.8 -37.2 46.3 62.1 20.5 83 112 A S H X S+ 0 0 58 -4,-2.0 4,-1.9 -5,-0.3 -1,-0.2 0.918 115.2 44.7 -69.0 -38.9 48.2 63.1 23.6 84 113 A N H X S+ 0 0 26 -4,-2.6 4,-3.0 2,-0.2 5,-0.3 0.858 110.2 55.5 -75.9 -29.0 45.4 62.1 25.9 85 114 A A H X S+ 0 0 1 -4,-2.5 4,-2.7 -5,-0.3 5,-0.4 0.926 106.9 51.1 -63.6 -41.7 44.9 58.8 23.9 86 115 A L H X S+ 0 0 4 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.958 114.5 42.7 -60.7 -45.7 48.5 58.0 24.6 87 116 A R H X S+ 0 0 124 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.940 117.5 44.0 -66.7 -48.9 48.2 58.6 28.3 88 117 A H H X S+ 0 0 5 -4,-3.0 4,-1.1 1,-0.2 -1,-0.2 0.870 115.0 47.0 -71.6 -35.9 44.9 56.9 28.8 89 118 A L H < S+ 0 0 0 -4,-2.7 3,-0.4 -5,-0.3 -1,-0.2 0.921 111.9 51.6 -68.4 -42.6 45.7 53.8 26.7 90 119 A H H < S+ 0 0 86 -4,-2.1 -2,-0.2 -5,-0.4 -1,-0.2 0.939 115.6 42.1 -56.1 -45.2 49.0 53.5 28.4 91 120 A D H < S+ 0 0 93 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.651 116.6 48.0 -78.6 -17.3 47.3 53.6 31.8 92 121 A N >< - 0 0 31 -4,-1.1 3,-2.1 -3,-0.4 -1,-0.2 -0.795 66.2-169.9-130.6 85.3 44.3 51.3 30.9 93 122 A P T 3 S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.660 83.7 51.1 -58.9 -21.3 45.5 48.2 29.2 94 123 A E T 3 S+ 0 0 144 2,-0.1 253,-0.2 254,-0.0 2,-0.1 0.559 87.5 100.6 -89.6 -10.1 42.0 46.9 28.2 95 124 A M < - 0 0 3 -3,-2.1 2,-0.3 -6,-0.2 -3,-0.1 -0.489 55.4-166.8 -74.3 149.8 41.0 50.2 26.5 96 125 A K - 0 0 28 -2,-0.1 2,-0.3 -40,-0.1 33,-0.2 -0.847 11.1-177.7-134.0 163.5 41.3 50.4 22.7 97 126 A F E -i 129 0D 0 31,-2.0 33,-2.5 -2,-0.3 2,-0.3 -0.940 13.7-146.5-163.8 139.6 41.2 53.2 20.1 98 127 A I E -i 130 0D 3 -40,-1.9 -38,-0.5 -2,-0.3 2,-0.4 -0.867 11.3-162.5-112.1 149.5 41.4 53.2 16.3 99 128 A W E +i 131 0D 1 31,-2.3 33,-2.4 -2,-0.3 35,-0.2 -0.998 15.4 170.8-134.0 134.9 42.9 56.0 14.2 100 129 A A + 0 0 7 -2,-0.4 2,-0.9 -40,-0.3 34,-0.4 0.795 56.3 75.4-106.8 -42.5 42.5 56.7 10.5 101 130 A E > - 0 0 3 1,-0.2 4,-1.6 33,-0.1 3,-0.4 -0.687 47.1-179.0 -92.3 101.0 44.1 60.1 9.4 102 131 A I H > S+ 0 0 0 33,-2.5 4,-3.3 -2,-0.9 5,-0.3 0.805 76.1 70.7 -76.3 -24.4 47.9 59.7 9.2 103 132 A S H > S+ 0 0 3 33,-2.2 4,-1.9 32,-0.3 -1,-0.2 0.949 107.0 39.1 -50.7 -47.7 48.4 63.3 8.2 104 133 A Y H > S+ 0 0 0 -3,-0.4 4,-2.2 32,-0.3 -1,-0.2 0.875 114.5 52.8 -69.7 -40.1 47.5 64.2 11.8 105 134 A F H X S+ 0 0 0 -4,-1.6 4,-3.2 2,-0.2 5,-0.2 0.920 110.9 46.5 -65.7 -41.4 49.3 61.3 13.4 106 135 A A H X S+ 0 0 4 -4,-3.3 4,-2.0 2,-0.2 -1,-0.2 0.902 110.4 53.8 -64.1 -39.5 52.5 62.2 11.5 107 136 A R H < S+ 0 0 63 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.876 116.3 40.1 -61.4 -37.5 52.1 65.9 12.5 108 137 A F H >< S+ 0 0 10 -4,-2.2 3,-1.7 2,-0.2 4,-0.5 0.949 113.1 51.3 -76.7 -48.7 51.8 64.7 16.2 109 138 A Y H >< S+ 0 0 5 -4,-3.2 3,-1.5 1,-0.3 -2,-0.2 0.859 103.6 57.5 -61.2 -40.3 54.4 62.0 16.3 110 139 A H T 3< S+ 0 0 84 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.565 106.3 51.7 -75.7 -4.8 57.2 64.2 14.9 111 140 A D T < S+ 0 0 106 -3,-1.7 -1,-0.3 -4,-0.2 2,-0.2 0.456 90.6 103.5-101.2 -5.9 56.6 66.7 17.7 112 141 A L S < S- 0 0 27 -3,-1.5 2,-0.1 -4,-0.5 -3,-0.0 -0.536 73.8-118.4 -77.1 142.6 56.9 64.0 20.5 113 142 A G > - 0 0 49 -2,-0.2 4,-2.5 1,-0.1 3,-0.2 -0.339 35.3-102.6 -66.4 160.6 59.9 63.5 22.6 114 143 A E H > S+ 0 0 115 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.866 120.5 58.3 -58.8 -39.2 61.7 60.1 22.4 115 144 A N H > S+ 0 0 102 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.944 111.8 41.0 -53.9 -50.5 60.1 58.9 25.6 116 145 A K H > S+ 0 0 89 -3,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.854 109.8 57.8 -69.5 -37.5 56.6 59.5 24.3 117 146 A K H X S+ 0 0 41 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.887 109.0 47.7 -56.7 -42.0 57.5 58.1 20.8 118 147 A L H X S+ 0 0 97 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.920 110.9 49.6 -66.1 -45.3 58.5 54.9 22.5 119 148 A Q H X S+ 0 0 46 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.899 111.8 50.3 -57.0 -42.1 55.3 54.8 24.6 120 149 A M H X S+ 0 0 0 -4,-2.8 4,-1.4 1,-0.2 3,-0.3 0.933 108.4 50.6 -64.8 -44.3 53.3 55.3 21.4 121 150 A K H X S+ 0 0 76 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.880 108.4 54.5 -59.7 -35.7 55.1 52.5 19.6 122 151 A S H X S+ 0 0 57 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.828 106.5 49.2 -70.1 -34.5 54.3 50.2 22.6 123 152 A I H <>S+ 0 0 2 -4,-1.6 6,-2.3 -3,-0.3 5,-1.3 0.740 115.2 45.6 -77.5 -21.8 50.6 50.8 22.5 124 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