==== 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 29-APR-08 3CZN . COMPND 2 MOLECULE: ALPHA-MANNOSIDASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR N.SHAH,D.R.ROSE . 1014 1 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36217.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 661 65.2 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 . 211 20.8 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 . 86 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 193 19.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 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 4 1 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 31 A a 0 0 117 0, 0.0 2,-0.1 0, 0.0 1000,-0.0 0.000 360.0 360.0 360.0 143.4 43.4 37.2 -18.7 2 32 A Q - 0 0 63 1001,-0.1 2,-0.7 1,-0.1 220,-0.0 -0.399 360.0-116.7 -61.1 142.5 39.8 37.5 -17.7 3 33 A D - 0 0 56 1,-0.1 4,-0.5 -2,-0.1 220,-0.2 -0.791 28.8-172.8 -83.1 115.6 37.4 38.8 -20.4 4 34 A V S S+ 0 0 4 -2,-0.7 -1,-0.1 1,-0.1 877,-0.1 0.417 76.7 43.5 -92.0 1.4 36.1 42.1 -19.1 5 35 A V S S+ 0 0 15 869,-0.1 871,-0.5 870,-0.1 -1,-0.1 0.802 111.9 39.2-110.3 -44.0 33.5 42.6 -21.9 6 36 A Q S S+ 0 0 122 869,-0.2 2,-0.6 1,-0.1 -2,-0.1 0.472 97.4 73.0-102.5 -6.2 31.7 39.4 -22.8 7 37 A D - 0 0 80 -4,-0.5 -1,-0.1 214,-0.2 216,-0.0 -0.919 66.4-150.2-116.7 107.5 31.1 37.6 -19.4 8 38 A V - 0 0 57 -2,-0.6 213,-0.1 871,-0.1 871,-0.1 -0.633 28.4-121.7 -75.1 115.2 28.3 39.2 -17.2 9 39 A P - 0 0 14 0, 0.0 2,-0.9 0, 0.0 214,-0.1 -0.281 13.2-131.5 -60.1 143.2 29.3 38.4 -13.6 10 40 A N + 0 0 142 213,-0.3 2,-0.3 2,-0.0 3,-0.0 -0.839 41.2 161.6 -96.8 102.2 26.9 36.5 -11.5 11 41 A V - 0 0 19 -2,-0.9 3,-0.2 1,-0.1 359,-0.1 -0.851 46.4-129.0-120.2 155.1 26.6 38.3 -8.2 12 42 A D S S+ 0 0 102 357,-0.4 2,-0.4 -2,-0.3 358,-0.2 0.863 100.8 27.7 -70.4 -36.2 23.9 38.2 -5.4 13 43 A V E -a 370 0A 9 356,-1.8 358,-2.1 -3,-0.0 2,-0.5 -0.987 63.8-179.4-130.2 120.1 23.5 42.0 -5.4 14 44 A Q E > -a 371 0A 28 -2,-0.4 4,-2.8 356,-0.2 3,-0.3 -0.987 23.2-144.5-117.8 118.5 24.1 44.1 -8.5 15 45 A M H > S+ 0 0 6 356,-2.5 4,-2.6 -2,-0.5 357,-0.1 0.798 95.7 51.3 -61.8 -34.2 23.5 47.8 -7.6 16 46 A L H > S+ 0 0 31 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.927 114.0 45.3 -65.9 -42.2 22.1 48.9 -11.0 17 47 A E H > S+ 0 0 84 -3,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.910 112.1 52.2 -65.1 -42.9 19.6 45.9 -10.9 18 48 A L H X S+ 0 0 4 -4,-2.8 4,-2.6 1,-0.2 3,-0.3 0.939 108.4 51.0 -59.3 -46.1 18.8 46.7 -7.3 19 49 A Y H < S+ 0 0 21 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.864 106.9 54.2 -56.9 -38.4 18.1 50.3 -8.2 20 50 A D H < S+ 0 0 83 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.874 116.1 38.7 -64.7 -36.6 15.7 49.2 -11.0 21 51 A R H < S+ 0 0 138 -4,-1.7 -2,-0.2 -3,-0.3 -1,-0.2 0.776 95.2 95.0 -84.7 -34.6 13.7 47.1 -8.5 22 52 A M < - 0 0 6 -4,-2.6 181,-0.0 -5,-0.2 180,-0.0 -0.305 57.6-155.1 -66.1 146.8 13.7 49.3 -5.4 23 53 A S - 0 0 82 179,-0.1 -1,-0.1 2,-0.1 -4,-0.0 0.650 19.5-146.8 -95.0 -20.0 10.7 51.7 -4.7 24 54 A F + 0 0 24 1,-0.2 2,-0.2 178,-0.1 178,-0.1 0.786 28.9 176.1 60.3 29.5 12.7 54.1 -2.6 25 55 A K - 0 0 155 1,-0.1 2,-1.0 177,-0.1 -1,-0.2 -0.500 25.3-145.9 -70.6 134.0 9.6 54.9 -0.5 26 56 A D + 0 0 81 -2,-0.2 2,-0.2 2,-0.0 -1,-0.1 -0.610 35.3 162.1-103.0 71.1 10.5 57.2 2.4 27 57 A I - 0 0 102 -2,-1.0 2,-0.7 7,-0.1 -2,-0.0 -0.633 48.0-103.7 -96.4 150.1 8.2 56.0 5.1 28 58 A D - 0 0 120 -2,-0.2 6,-0.2 1,-0.1 5,-0.1 -0.609 33.1-172.7 -69.9 110.2 8.4 56.6 8.9 29 59 A G - 0 0 11 4,-2.4 3,-0.4 -2,-0.7 2,-0.4 0.378 39.9-112.3 -87.6 3.2 9.8 53.4 10.3 30 60 A G S S- 0 0 25 3,-0.3 -1,-0.3 1,-0.2 5,-0.1 -0.818 82.9 -6.2 101.8-142.4 9.4 54.4 13.9 31 61 A V S S+ 0 0 58 -2,-0.4 2,-1.2 1,-0.2 -1,-0.2 0.879 136.3 57.5 -60.5 -37.6 12.4 55.0 16.3 32 62 A W S > S- 0 0 14 -3,-0.4 3,-1.8 1,-0.2 -1,-0.2 -0.825 88.1-162.9 -85.9 96.6 14.6 53.8 13.4 33 63 A K T 3 S+ 0 0 123 -2,-1.2 -4,-2.4 1,-0.3 -3,-0.3 0.777 81.5 34.2 -61.7 -29.4 13.2 56.5 11.2 34 64 A Q T 3 S+ 0 0 24 -6,-0.2 -1,-0.3 -5,-0.1 171,-0.1 0.189 123.0 40.8-112.3 15.9 14.3 54.9 7.9 35 65 A G S < S- 0 0 1 -3,-1.8 2,-0.3 212,-0.1 -8,-0.1 0.043 87.6 -92.7-125.5-126.3 14.0 51.3 8.8 36 66 A W - 0 0 70 -2,-0.1 2,-1.0 169,-0.0 -7,-0.1 -0.919 47.6 -73.7-153.3 171.0 11.4 49.2 10.8 37 67 A N - 0 0 112 -2,-0.3 2,-0.2 -6,-0.1 -7,-0.1 -0.665 55.9-139.0 -76.1 103.6 10.8 48.0 14.3 38 68 A I - 0 0 13 -2,-1.0 2,-0.4 1,-0.0 256,-0.1 -0.438 19.1-165.7 -71.5 133.7 13.4 45.3 14.7 39 69 A K - 0 0 179 -2,-0.2 2,-0.3 255,-0.1 -1,-0.0 -0.924 5.2-173.8-116.0 143.6 12.3 42.1 16.4 40 70 A Y - 0 0 63 -2,-0.4 254,-0.1 256,-0.0 3,-0.0 -0.964 29.8-115.4-133.7 155.4 14.5 39.3 17.7 41 71 A D > - 0 0 94 -2,-0.3 3,-2.2 1,-0.1 4,-0.4 -0.808 20.1-149.8 -84.8 115.7 14.1 35.9 19.3 42 72 A P G > S+ 0 0 89 0, 0.0 3,-0.7 0, 0.0 -1,-0.1 0.797 96.0 60.3 -56.1 -26.3 15.4 36.1 22.9 43 73 A L G 3 S+ 0 0 148 1,-0.2 -2,-0.0 -3,-0.0 0, 0.0 0.433 77.4 90.3 -84.2 0.6 16.3 32.4 22.6 44 74 A K G < S+ 0 0 69 -3,-2.2 2,-0.4 1,-0.0 -1,-0.2 0.877 87.5 50.8 -62.2 -39.8 18.7 32.9 19.6 45 75 A Y S < S+ 0 0 7 -3,-0.7 2,-0.2 -4,-0.4 5,-0.2 -0.852 71.3 150.1-104.5 138.0 21.6 33.4 22.0 46 76 A N B > -F 49 0B 72 3,-1.7 3,-1.9 -2,-0.4 293,-0.0 -0.849 62.6 -70.6-149.9-177.4 22.4 30.9 24.8 47 77 A A T 3 S+ 0 0 72 1,-0.3 3,-0.3 -2,-0.2 -2,-0.0 0.829 134.1 42.0 -52.5 -34.6 25.3 29.5 26.8 48 78 A H T 3 S+ 0 0 178 1,-0.2 -1,-0.3 2,-0.0 2,-0.2 0.410 123.0 39.2 -95.3 -0.5 26.6 27.7 23.7 49 79 A H B < S+F 46 0B 60 -3,-1.9 -3,-1.7 2,-0.0 -1,-0.2 -0.621 76.9 176.2-150.2 85.0 25.9 30.6 21.4 50 80 A K - 0 0 87 -3,-0.3 2,-0.6 -5,-0.2 292,-0.2 -0.532 34.1-115.7 -90.6 155.2 26.8 34.0 22.8 51 81 A L E -g 342 0C 0 290,-2.7 292,-2.4 289,-0.2 2,-0.6 -0.827 28.3-151.7 -86.4 120.7 26.7 37.4 21.2 52 82 A K E -gh 343 303C 72 250,-3.2 252,-3.3 -2,-0.6 2,-0.5 -0.869 13.1-163.9 -97.5 121.0 30.2 38.8 21.0 53 83 A V E -gh 344 304C 0 290,-2.7 292,-2.2 -2,-0.6 2,-0.6 -0.916 9.6-164.9-114.8 124.2 30.2 42.6 21.1 54 84 A F E -gh 345 305C 22 250,-3.0 252,-3.0 -2,-0.5 2,-0.6 -0.930 4.7-161.7-108.9 113.3 33.2 44.8 20.2 55 85 A V E -gh 346 306C 0 290,-2.8 292,-2.5 -2,-0.6 40,-0.1 -0.845 11.8-163.6 -94.3 117.2 32.9 48.4 21.2 56 86 A V E - h 0 307C 0 250,-2.5 252,-2.8 -2,-0.6 292,-0.1 -0.866 7.0-147.6-113.5 99.6 35.4 50.3 19.1 57 87 A P E + h 0 308C 0 0, 0.0 40,-1.9 0, 0.0 2,-0.3 -0.417 29.7 162.1 -66.5 139.8 36.4 53.8 20.4 58 88 A H E -ih 97 309C 2 250,-1.9 252,-0.6 38,-0.2 2,-0.3 -0.966 31.1-150.2-153.5 165.4 37.2 56.3 17.6 59 89 A S E - h 0 310C 6 38,-0.5 2,-0.7 -2,-0.3 40,-0.3 -0.931 17.3-141.1-145.2 116.8 37.5 60.0 16.8 60 90 A H E - h 0 311C 3 250,-1.8 252,-2.8 -2,-0.3 2,-0.6 -0.700 22.2-172.2 -85.4 117.2 36.8 61.4 13.4 61 91 A N - 0 0 0 -2,-0.7 42,-0.1 250,-0.2 250,-0.0 -0.898 12.2-149.6-118.5 104.7 39.4 64.1 12.7 62 92 A D - 0 0 3 -2,-0.6 2,-2.4 1,-0.1 3,-0.1 -0.587 12.4-140.0 -74.6 120.7 39.0 66.3 9.6 63 93 A P S S- 0 0 0 0, 0.0 6,-0.3 0, 0.0 377,-0.1 -0.432 86.8 -20.6 -74.0 63.4 42.3 67.5 8.1 64 94 A G S S+ 0 0 0 -2,-2.4 4,-0.2 4,-0.4 378,-0.2 0.184 82.4 129.0 103.2 135.4 40.6 70.8 7.4 65 95 A W S S+ 0 0 36 2,-2.4 384,-2.7 -3,-0.1 387,-0.2 -0.334 90.8 1.6-171.3 -83.5 36.9 71.7 7.2 66 96 A I S S+ 0 0 55 382,-0.2 2,-0.3 2,-0.1 385,-0.1 0.722 141.9 31.2 -93.9 -20.6 35.6 74.5 9.3 67 97 A Q S S- 0 0 44 -5,-0.1 -2,-2.4 1,-0.1 382,-0.1 -0.832 98.2 -99.1-118.7 165.4 39.1 75.2 10.6 68 98 A T > - 0 0 14 -2,-0.3 4,-2.9 -4,-0.2 -4,-0.4 -0.321 38.2-101.1 -74.6 167.4 42.4 74.6 8.7 69 99 A F H > S+ 0 0 16 -6,-0.3 4,-2.4 1,-0.2 -5,-0.2 0.932 125.2 45.3 -49.0 -50.5 44.6 71.5 9.3 70 100 A E H > S+ 0 0 66 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.888 111.5 51.6 -69.4 -37.4 46.9 73.5 11.5 71 101 A E H > S+ 0 0 68 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.944 113.2 44.4 -63.3 -49.2 44.1 75.2 13.4 72 102 A Y H X>S+ 0 0 6 -4,-2.9 4,-2.8 1,-0.2 5,-2.0 0.887 111.4 55.0 -61.5 -39.3 42.4 71.8 14.2 73 103 A Y H <>S+ 0 0 8 -4,-2.4 5,-2.4 -5,-0.3 6,-0.3 0.949 114.3 39.1 -59.2 -47.0 45.8 70.3 15.0 74 104 A Q H <5S+ 0 0 67 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.860 124.8 37.3 -71.9 -35.9 46.5 73.0 17.6 75 105 A H H <5S- 0 0 98 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.779 137.1 -6.1 -89.0 -28.8 43.0 73.3 19.0 76 106 A D T >X5S+ 0 0 22 -4,-2.8 4,-2.1 -5,-0.3 3,-0.6 0.674 118.5 55.1-131.0 -62.9 41.8 69.7 19.0 77 107 A T H 3> S+ 0 0 74 -3,-0.6 4,-2.6 -6,-0.3 5,-0.2 0.882 110.1 52.7 -73.2 -40.4 45.1 67.1 22.5 80 110 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.950 114.7 42.0 -57.4 -49.4 43.2 64.0 21.4 81 111 A L H X S+ 0 0 3 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.888 113.5 51.7 -69.0 -39.4 46.4 62.2 20.5 82 112 A S H X S+ 0 0 61 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.925 114.6 43.3 -63.0 -42.7 48.2 63.3 23.6 83 113 A N H X S+ 0 0 20 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.827 110.1 56.0 -76.0 -27.5 45.4 62.1 25.8 84 114 A A H X S+ 0 0 4 -4,-2.3 4,-2.7 -5,-0.2 5,-0.4 0.934 108.8 48.3 -63.1 -45.5 45.0 58.9 23.8 85 115 A L H X S+ 0 0 5 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.951 115.7 43.7 -59.6 -48.0 48.6 58.1 24.5 86 116 A R H X S+ 0 0 128 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.947 117.7 43.7 -62.3 -50.0 48.2 58.9 28.2 87 117 A H H X S+ 0 0 7 -4,-3.0 4,-1.0 2,-0.2 7,-0.2 0.865 115.1 46.4 -71.8 -36.0 44.9 57.0 28.7 88 118 A L H < S+ 0 0 0 -4,-2.7 3,-0.4 -5,-0.2 -1,-0.2 0.916 111.6 52.9 -69.1 -42.2 45.8 53.9 26.7 89 119 A H H < S+ 0 0 88 -4,-2.1 -2,-0.2 -5,-0.4 -1,-0.2 0.940 116.1 40.2 -54.4 -46.4 49.2 53.7 28.4 90 120 A D H < S+ 0 0 93 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.590 116.9 49.2 -82.7 -13.6 47.4 53.8 31.8 91 121 A N >< - 0 0 30 -4,-1.0 3,-2.0 -3,-0.4 -1,-0.2 -0.775 66.1-170.8-131.9 85.6 44.4 51.6 31.0 92 122 A P T 3 S+ 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.675 84.1 51.5 -55.9 -24.5 45.7 48.4 29.3 93 123 A E T 3 S+ 0 0 141 2,-0.1 253,-0.2 254,-0.0 2,-0.1 0.595 87.5 101.1 -89.5 -12.5 42.2 47.1 28.3 94 124 A M < - 0 0 1 -3,-2.0 2,-0.3 -6,-0.2 -3,-0.1 -0.460 54.6-166.5 -73.6 145.7 41.2 50.4 26.6 95 125 A K - 0 0 34 -40,-0.1 2,-0.3 -2,-0.1 33,-0.2 -0.855 11.1-179.4-130.8 164.6 41.4 50.5 22.8 96 126 A F E - j 0 128C 0 31,-2.0 33,-2.4 -2,-0.3 2,-0.3 -0.950 14.6-145.9-163.0 140.1 41.2 53.2 20.1 97 127 A I E -ij 58 129C 3 -40,-1.9 -38,-0.5 -2,-0.3 2,-0.4 -0.897 11.8-162.6-112.7 151.0 41.4 53.3 16.3 98 128 A W E + j 0 130C 1 31,-2.2 33,-2.5 -2,-0.3 35,-0.2 -0.998 15.0 171.6-136.3 133.1 43.0 56.1 14.2 99 129 A A + 0 0 7 -2,-0.4 2,-1.0 -40,-0.3 34,-0.4 0.801 56.5 76.0-105.6 -41.9 42.5 56.8 10.5 100 130 A E >> - 0 0 3 1,-0.2 4,-1.7 33,-0.1 3,-0.6 -0.660 46.4-179.9 -93.6 100.9 44.2 60.1 9.4 101 131 A I H 3> S+ 0 0 0 33,-2.5 4,-3.3 -2,-1.0 5,-0.3 0.785 75.9 71.4 -73.1 -24.5 48.0 59.7 9.2 102 132 A S H 3> S+ 0 0 3 33,-2.2 4,-1.3 32,-0.3 -1,-0.2 0.937 108.1 37.5 -52.6 -45.3 48.5 63.4 8.2 103 133 A Y H <> S+ 0 0 0 -3,-0.6 4,-2.5 32,-0.3 -2,-0.2 0.893 116.2 51.3 -71.8 -44.2 47.6 64.3 11.8 104 134 A F H X S+ 0 0 0 -4,-1.7 4,-3.2 1,-0.2 5,-0.3 0.920 108.5 51.5 -64.3 -43.2 49.3 61.3 13.4 105 135 A A H X S+ 0 0 7 -4,-3.3 4,-2.3 2,-0.2 -1,-0.2 0.897 111.0 48.6 -58.7 -42.9 52.6 61.9 11.5 106 136 A R H X S+ 0 0 68 -4,-1.3 4,-1.7 -5,-0.3 -2,-0.2 0.966 114.7 45.2 -60.3 -52.0 52.6 65.5 12.7 107 137 A F H X S+ 0 0 12 -4,-2.5 4,-0.7 1,-0.2 3,-0.2 0.931 114.7 46.6 -58.4 -49.4 51.9 64.5 16.3 108 138 A Y H >< S+ 0 0 9 -4,-3.2 3,-1.2 1,-0.2 -1,-0.2 0.903 107.9 55.8 -63.9 -43.4 54.5 61.7 16.4 109 139 A H H 3< S+ 0 0 135 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.888 108.3 49.9 -55.4 -39.5 57.2 63.8 14.8 110 140 A D H 3< S+ 0 0 91 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.543 90.4 103.7 -81.0 -9.8 56.8 66.4 17.5 111 141 A L S << S- 0 0 28 -3,-1.2 2,-0.0 -4,-0.7 -3,-0.0 -0.456 75.3-114.7 -72.3 143.7 57.0 63.9 20.4 112 142 A G > - 0 0 50 -2,-0.1 4,-2.3 1,-0.1 3,-0.3 -0.326 36.8-101.4 -65.9 160.5 60.0 63.5 22.6 113 143 A E H > S+ 0 0 109 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.857 120.0 57.2 -57.7 -40.6 61.8 60.1 22.4 114 144 A N H > S+ 0 0 102 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.933 112.2 41.6 -55.5 -48.0 60.3 58.8 25.7 115 145 A K H > S+ 0 0 85 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.827 109.0 58.8 -71.7 -34.7 56.7 59.4 24.4 116 146 A K H X S+ 0 0 42 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.931 108.3 47.2 -56.2 -45.0 57.6 58.1 20.9 117 147 A L H X S+ 0 0 94 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.898 110.2 51.3 -65.8 -41.1 58.6 54.8 22.6 118 148 A Q H X S+ 0 0 42 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.899 111.3 49.5 -59.7 -41.1 55.3 54.8 24.7 119 149 A M H X S+ 0 0 4 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.931 108.3 51.3 -64.9 -46.9 53.4 55.3 21.4 120 150 A K H X S+ 0 0 95 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.878 109.1 53.7 -57.9 -35.6 55.2 52.5 19.7 121 151 A S H X S+ 0 0 41 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.886 106.5 48.5 -70.5 -40.9 54.4 50.2 22.6 122 152 A I H <>S+ 0 0 3 -4,-1.8 6,-2.3 2,-0.2 5,-1.3 0.742 115.7 46.4 -73.1 -20.8 50.6 50.8 22.6 123 153 A V H ><5S+ 0 0 13 -4,-1.5 3,-1.5 4,-0.2 -2,-0.2 0.908 112.5 48.6 -77.7 -48.1 50.6 50.2 18.8 124 154 A K H 3<5S+ 0 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