==== 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 03-JAN-08 3BUP . COMPND 2 MOLECULE: ALPHA-MANNOSIDASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR D.A.KUNTZ,D.R.ROSE . 1015 1 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35982.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 666 65.6 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 . 210 20.7 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 . 90 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 8.3 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 . 9 0.9 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 . 6 7 4 5 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 31 A a 0 0 118 0, 0.0 1000,-0.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 128.0 43.2 37.4 -18.5 2 32 A Q - 0 0 66 1001,-0.1 2,-0.7 1,-0.1 220,-0.0 -0.332 360.0-115.5 -45.6 142.1 39.6 37.6 -17.6 3 33 A D > - 0 0 56 1,-0.1 4,-0.6 2,-0.0 220,-0.2 -0.854 28.2-168.8 -86.3 117.1 37.4 38.9 -20.4 4 34 A V T 4 S+ 0 0 4 -2,-0.7 -1,-0.1 1,-0.1 877,-0.1 0.415 76.7 44.3 -91.4 3.2 36.0 42.2 -19.0 5 35 A V T 4 S+ 0 0 13 869,-0.1 871,-0.5 870,-0.1 -1,-0.1 0.829 110.7 38.8-110.2 -48.1 33.5 42.7 -21.8 6 36 A Q T 4 S+ 0 0 127 869,-0.2 2,-0.6 1,-0.1 -2,-0.1 0.547 96.9 72.4 -98.4 -13.5 31.6 39.5 -22.7 7 37 A D < - 0 0 79 -4,-0.6 -1,-0.1 214,-0.2 216,-0.1 -0.911 67.2-149.0-110.5 109.8 30.9 37.7 -19.4 8 38 A V - 0 0 56 -2,-0.6 213,-0.1 871,-0.1 871,-0.1 -0.641 27.6-121.1 -76.6 115.9 28.3 39.3 -17.1 9 39 A P - 0 0 12 0, 0.0 2,-0.8 0, 0.0 214,-0.1 -0.277 14.8-131.0 -59.1 139.9 29.3 38.5 -13.5 10 40 A N + 0 0 143 213,-0.3 2,-0.3 2,-0.0 3,-0.0 -0.866 41.1 163.9 -91.6 105.2 26.8 36.5 -11.4 11 41 A V - 0 0 20 -2,-0.8 3,-0.2 1,-0.1 359,-0.1 -0.860 45.7-129.7-120.5 157.1 26.4 38.4 -8.1 12 42 A D S S+ 0 0 101 357,-0.3 2,-0.4 -2,-0.3 358,-0.2 0.847 101.5 27.2 -70.8 -35.7 23.8 38.3 -5.3 13 43 A V E -a 370 0A 6 356,-1.7 358,-2.0 -3,-0.0 2,-0.5 -0.989 64.5-179.4-130.5 119.6 23.4 42.1 -5.3 14 44 A Q E > -a 371 0A 29 -2,-0.4 4,-3.0 356,-0.2 3,-0.3 -0.983 22.8-145.1-118.8 119.9 24.0 44.2 -8.4 15 45 A M H > S+ 0 0 6 356,-2.3 4,-2.9 -2,-0.5 5,-0.2 0.828 95.8 49.2 -64.7 -37.6 23.4 47.8 -7.6 16 46 A L H > S+ 0 0 33 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.935 115.2 46.7 -60.0 -44.7 22.0 48.9 -11.0 17 47 A E H > S+ 0 0 89 -3,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.931 113.0 49.2 -61.4 -46.7 19.6 46.0 -10.8 18 48 A L H >X S+ 0 0 5 -4,-3.0 4,-2.3 1,-0.2 3,-0.7 0.939 109.1 52.6 -59.5 -49.0 18.7 46.7 -7.2 19 49 A Y H 3< S+ 0 0 20 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.844 106.0 54.5 -52.4 -38.5 18.1 50.4 -8.1 20 50 A D H 3< S+ 0 0 84 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.825 115.4 38.1 -70.1 -32.1 15.7 49.4 -10.9 21 51 A R H << S+ 0 0 132 -4,-1.4 -2,-0.2 -3,-0.7 -1,-0.2 0.772 95.4 96.7 -89.0 -29.0 13.5 47.2 -8.5 22 52 A M < - 0 0 8 -4,-2.3 181,-0.0 -5,-0.2 180,-0.0 -0.314 58.8-152.9 -71.8 146.3 13.6 49.4 -5.3 23 53 A S - 0 0 81 179,-0.1 -1,-0.1 2,-0.1 -4,-0.0 0.722 16.0-150.1 -91.1 -24.6 10.7 51.8 -4.6 24 54 A F + 0 0 21 1,-0.2 2,-0.2 178,-0.1 178,-0.1 0.679 28.8 171.9 63.3 22.3 12.7 54.3 -2.5 25 55 A K - 0 0 152 1,-0.1 2,-1.4 177,-0.1 -1,-0.2 -0.450 30.5-142.3 -70.6 130.9 9.6 55.2 -0.4 26 56 A D + 0 0 83 -2,-0.2 2,-0.3 2,-0.0 -1,-0.1 -0.598 37.5 163.6 -93.2 75.1 10.5 57.5 2.5 27 57 A I - 0 0 100 -2,-1.4 2,-0.6 7,-0.1 -2,-0.0 -0.701 47.0-104.7 -95.1 146.4 8.1 56.1 5.2 28 58 A D - 0 0 113 -2,-0.3 6,-0.2 1,-0.2 5,-0.1 -0.572 32.3-172.2 -66.5 111.7 8.3 56.7 9.0 29 59 A G - 0 0 11 4,-2.3 3,-0.4 -2,-0.6 2,-0.3 0.384 40.0-113.4 -88.3 2.9 9.7 53.4 10.3 30 60 A G S S- 0 0 24 3,-0.3 -1,-0.3 1,-0.2 5,-0.1 -0.818 82.6 -5.6 101.7-143.4 9.3 54.4 14.0 31 61 A V S S+ 0 0 52 -2,-0.3 2,-1.3 1,-0.2 -1,-0.2 0.881 136.7 58.0 -56.9 -36.2 12.2 55.0 16.4 32 62 A W S > S- 0 0 15 -3,-0.4 3,-1.9 1,-0.2 -1,-0.2 -0.795 87.8-164.5 -90.2 93.0 14.4 53.8 13.5 33 63 A K T 3 S+ 0 0 131 -2,-1.3 -4,-2.3 1,-0.3 -3,-0.3 0.780 81.2 33.7 -57.7 -31.4 13.0 56.6 11.3 34 64 A Q T 3 S+ 0 0 26 -6,-0.2 -1,-0.3 -5,-0.1 171,-0.1 0.237 123.8 39.6-112.1 12.3 14.2 55.1 8.0 35 65 A G S < S- 0 0 1 -3,-1.9 2,-0.3 212,-0.1 -8,-0.1 0.084 88.2 -94.3-122.0-122.9 13.9 51.4 8.9 36 66 A W - 0 0 69 -2,-0.0 2,-0.9 169,-0.0 -7,-0.1 -0.925 48.8 -70.9-155.3 169.4 11.2 49.3 10.8 37 67 A N - 0 0 110 -2,-0.3 2,-0.2 -6,-0.1 -7,-0.1 -0.637 56.1-138.7 -71.4 104.0 10.7 48.0 14.4 38 68 A I - 0 0 13 -2,-0.9 2,-0.3 1,-0.0 257,-0.1 -0.459 19.5-165.4 -71.0 133.6 13.3 45.3 14.6 39 69 A K - 0 0 182 -2,-0.2 2,-0.3 255,-0.1 -1,-0.0 -0.905 5.7-174.2-116.1 147.6 12.2 42.1 16.4 40 70 A Y - 0 0 66 -2,-0.3 254,-0.1 256,-0.0 253,-0.0 -0.973 30.1-115.7-136.3 155.3 14.4 39.3 17.7 41 71 A D > - 0 0 93 -2,-0.3 3,-2.5 1,-0.1 4,-0.4 -0.816 20.1-151.0 -85.6 111.1 14.0 35.8 19.2 42 72 A P T 3 S+ 0 0 86 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.761 95.0 61.2 -56.1 -19.9 15.4 36.0 22.8 43 73 A L T 3 S+ 0 0 138 1,-0.2 -2,-0.0 -3,-0.0 0, 0.0 0.481 77.5 89.5 -86.6 -1.1 16.3 32.3 22.5 44 74 A K S < S+ 0 0 60 -3,-2.5 2,-0.3 2,-0.0 -1,-0.2 0.893 87.0 49.6 -62.0 -42.1 18.7 32.9 19.5 45 75 A Y S S+ 0 0 10 -3,-0.5 2,-0.2 -4,-0.4 5,-0.2 -0.781 71.8 151.9-102.0 142.7 21.7 33.4 21.8 46 76 A N B > -F 49 0B 62 3,-1.8 3,-1.5 -2,-0.3 -2,-0.0 -0.842 60.6 -68.9-153.3-173.2 22.5 30.9 24.7 47 77 A A T 3 S+ 0 0 72 1,-0.3 3,-0.3 -2,-0.2 -2,-0.0 0.788 133.2 41.1 -61.2 -29.1 25.3 29.5 26.7 48 78 A H T 3 S+ 0 0 186 1,-0.2 -1,-0.3 293,-0.0 2,-0.1 0.402 124.8 37.3 -99.5 2.0 26.8 27.7 23.7 49 79 A H B < S+F 46 0B 57 -3,-1.5 -3,-1.8 2,-0.0 -1,-0.2 -0.594 76.6 174.9-156.1 79.0 26.1 30.5 21.3 50 80 A K - 0 0 79 -3,-0.3 2,-0.7 -5,-0.2 292,-0.2 -0.484 36.5-112.6 -88.8 158.9 26.7 34.0 22.8 51 81 A L E -g 342 0C 0 290,-2.3 292,-2.3 289,-0.2 2,-0.6 -0.848 31.0-150.9 -84.1 114.5 26.6 37.4 21.1 52 82 A K E -gh 343 303C 93 250,-3.2 252,-3.3 -2,-0.7 2,-0.5 -0.816 13.2-161.1 -90.0 123.4 30.2 38.8 21.1 53 83 A V E -gh 344 304C 0 290,-2.8 292,-2.1 -2,-0.6 2,-0.6 -0.911 9.7-164.1-114.7 124.6 30.1 42.5 21.2 54 84 A F E -gh 345 305C 18 250,-3.0 252,-3.0 -2,-0.5 2,-0.7 -0.924 4.2-161.4-108.4 111.4 33.0 44.8 20.2 55 85 A V E -gh 346 306C 0 290,-2.8 292,-2.4 -2,-0.6 40,-0.1 -0.794 12.7-163.5 -88.4 114.6 32.8 48.4 21.4 56 86 A V E - h 0 307C 0 250,-2.6 252,-3.0 -2,-0.7 292,-0.1 -0.834 6.5-148.1-113.8 100.8 35.3 50.3 19.2 57 87 A P E + h 0 308C 0 0, 0.0 40,-1.6 0, 0.0 2,-0.3 -0.399 29.3 160.7 -64.4 140.2 36.3 53.8 20.4 58 88 A H E -ih 97 309C 2 250,-1.9 252,-0.6 38,-0.2 2,-0.4 -0.970 32.2-148.1-155.9 166.3 37.1 56.4 17.7 59 89 A S E - h 0 310C 6 38,-0.5 2,-0.8 -2,-0.3 40,-0.3 -0.959 18.8-139.7-144.2 114.9 37.4 60.1 16.9 60 90 A H E - h 0 311C 2 250,-2.3 252,-2.6 -2,-0.4 2,-0.6 -0.732 24.6-173.5 -84.4 112.5 36.6 61.5 13.5 61 91 A N - 0 0 0 -2,-0.8 42,-0.1 250,-0.2 39,-0.0 -0.919 12.4-152.2-113.8 112.5 39.2 64.1 12.7 62 92 A D - 0 0 0 -2,-0.6 2,-2.8 1,-0.1 5,-0.1 -0.726 14.9-139.3 -84.0 119.3 38.8 66.3 9.5 63 93 A P S S- 0 0 0 0, 0.0 6,-0.4 0, 0.0 377,-0.1 -0.381 88.3 -18.9 -68.9 62.2 42.2 67.5 8.1 64 94 A G S S+ 0 0 0 -2,-2.8 4,-0.2 4,-0.4 378,-0.1 0.171 82.1 127.2 103.8 134.2 40.4 70.8 7.5 65 95 A W S S+ 0 0 32 2,-2.6 384,-3.0 -3,-0.1 387,-0.2 -0.285 91.0 4.3-167.9 -81.0 36.7 71.7 7.3 66 96 A I S S+ 0 0 50 382,-0.2 2,-0.3 2,-0.1 385,-0.1 0.788 142.3 28.8 -83.6 -35.8 35.4 74.5 9.6 67 97 A Q S S- 0 0 49 -5,-0.1 -2,-2.6 1,-0.1 382,-0.1 -0.788 98.1 -99.2-117.4 164.4 39.0 75.2 10.7 68 98 A T > - 0 0 13 -2,-0.3 4,-2.9 -4,-0.2 -4,-0.4 -0.282 40.5 -98.3 -73.7 168.1 42.2 74.6 8.7 69 99 A F H > S+ 0 0 14 -6,-0.4 4,-2.6 1,-0.2 -5,-0.2 0.939 126.4 43.9 -47.1 -55.3 44.4 71.5 9.2 70 100 A E H > S+ 0 0 62 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.868 112.1 52.9 -65.2 -36.7 46.8 73.4 11.5 71 101 A E H > S+ 0 0 66 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.957 113.2 42.8 -62.8 -51.1 43.9 75.1 13.4 72 102 A Y H X>S+ 0 0 11 -4,-2.9 4,-2.6 2,-0.2 5,-1.9 0.902 112.3 55.2 -60.3 -43.1 42.2 71.8 14.2 73 103 A Y H <>S+ 0 0 7 -4,-2.6 5,-2.6 -5,-0.3 6,-0.3 0.951 114.9 38.2 -55.8 -48.8 45.6 70.2 15.0 74 104 A Q H <5S+ 0 0 62 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.881 124.7 38.6 -67.5 -40.8 46.4 72.9 17.6 75 105 A H H <5S- 0 0 97 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.722 137.2 -6.9 -85.5 -24.9 42.9 73.2 19.0 76 106 A D T X5S+ 0 0 20 -4,-2.6 4,-2.3 -5,-0.2 3,-0.4 0.619 119.4 55.1-137.6 -64.6 41.7 69.6 19.0 77 107 A T H > S+ 0 0 76 -3,-0.4 4,-2.7 -6,-0.3 -2,-0.2 0.892 110.1 53.0 -72.7 -41.6 45.0 67.1 22.6 80 110 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.942 116.0 40.1 -54.8 -48.9 43.0 64.0 21.4 81 111 A L H X S+ 0 0 1 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.865 113.6 52.6 -73.7 -36.3 46.2 62.2 20.6 82 112 A S H X S+ 0 0 63 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.944 114.5 44.1 -61.1 -44.8 48.1 63.4 23.6 83 113 A N H X S+ 0 0 25 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.846 110.1 54.7 -69.3 -34.0 45.2 62.1 25.7 84 114 A A H X S+ 0 0 2 -4,-2.3 4,-2.7 -5,-0.2 5,-0.4 0.931 108.8 49.7 -61.3 -46.7 44.9 58.8 23.7 85 115 A L H X S+ 0 0 6 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.963 115.4 42.2 -55.6 -53.7 48.6 58.2 24.5 86 116 A R H X S+ 0 0 127 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.935 117.9 45.1 -59.7 -49.4 48.2 58.9 28.2 87 117 A H H X S+ 0 0 5 -4,-2.7 4,-1.7 2,-0.2 7,-0.2 0.907 115.3 43.6 -70.4 -43.4 44.9 56.9 28.6 88 118 A L H < S+ 0 0 0 -4,-2.7 -1,-0.2 -5,-0.2 6,-0.2 0.897 113.8 53.7 -67.4 -38.8 45.8 53.8 26.7 89 119 A H H < S+ 0 0 88 -4,-2.1 -2,-0.2 -5,-0.4 -1,-0.2 0.958 116.3 38.3 -53.3 -49.0 49.2 53.8 28.4 90 120 A D H < S+ 0 0 91 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.672 119.3 47.2 -79.9 -23.2 47.5 53.9 31.8 91 121 A N >< - 0 0 29 -4,-1.7 3,-1.9 -5,-0.2 -1,-0.2 -0.838 65.2-171.2-127.5 89.8 44.6 51.6 31.0 92 122 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.652 84.3 55.4 -58.7 -22.8 45.8 48.4 29.2 93 123 A E T 3 S+ 0 0 76 2,-0.1 253,-0.2 254,-0.0 2,-0.1 0.586 85.7 101.2 -85.8 -15.3 42.2 47.2 28.4 94 124 A M < - 0 0 1 -3,-1.9 2,-0.3 -7,-0.2 -3,-0.0 -0.447 55.0-163.9 -74.5 147.8 41.2 50.5 26.6 95 125 A K + 0 0 33 -40,-0.1 2,-0.3 -2,-0.1 33,-0.2 -0.893 11.1 177.9-130.5 159.0 41.2 50.5 22.8 96 126 A F E - j 0 128C 0 31,-2.1 33,-2.7 -2,-0.3 2,-0.4 -0.969 16.0-145.7-161.7 141.8 41.2 53.2 20.1 97 127 A I E -ij 58 129C 3 -40,-1.6 -38,-0.5 -2,-0.3 2,-0.4 -0.910 11.4-161.5-115.7 145.3 41.3 53.3 16.3 98 128 A W E + j 0 130C 1 31,-2.4 33,-2.6 -2,-0.4 35,-0.2 -0.992 15.2 170.7-129.8 130.2 43.0 56.0 14.2 99 129 A A + 0 0 6 -2,-0.4 2,-0.9 -40,-0.3 34,-0.5 0.836 57.4 72.6-100.4 -44.5 42.3 56.8 10.5 100 130 A E > - 0 0 2 1,-0.2 4,-1.6 33,-0.1 3,-0.4 -0.664 46.9-179.3 -93.9 102.8 44.1 60.1 9.4 101 131 A I H > S+ 0 0 0 33,-2.5 4,-3.2 -2,-0.9 5,-0.3 0.785 76.6 71.4 -72.2 -24.5 47.8 59.7 9.2 102 132 A S H > S+ 0 0 3 33,-2.2 4,-1.6 32,-0.3 -1,-0.2 0.936 107.3 38.2 -53.1 -49.1 48.3 63.4 8.2 103 133 A Y H > S+ 0 0 0 -3,-0.4 4,-2.3 32,-0.3 -1,-0.2 0.881 115.7 52.5 -66.2 -43.1 47.4 64.3 11.8 104 134 A F H X S+ 0 0 0 -4,-1.6 4,-3.3 2,-0.2 5,-0.2 0.911 109.3 48.0 -64.4 -43.3 49.2 61.4 13.4 105 135 A A H X S+ 0 0 5 -4,-3.2 4,-2.7 2,-0.2 -1,-0.2 0.917 111.5 51.8 -60.4 -45.1 52.5 62.1 11.6 106 136 A R H X S+ 0 0 65 -4,-1.6 4,-0.8 -5,-0.3 -2,-0.2 0.892 115.8 41.8 -56.5 -44.9 52.3 65.8 12.6 107 137 A F H >X S+ 0 0 11 -4,-2.3 4,-0.9 2,-0.2 3,-0.8 0.964 115.5 47.1 -66.5 -56.6 51.7 64.7 16.2 108 138 A Y H >< S+ 0 0 11 -4,-3.3 3,-0.8 1,-0.3 -2,-0.2 0.852 105.9 58.8 -57.2 -42.4 54.4 61.9 16.3 109 139 A H H 3< S+ 0 0 138 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.834 108.0 47.4 -57.3 -36.0 57.0 64.0 14.7 110 140 A D H << S+ 0 0 91 -3,-0.8 -1,-0.2 -4,-0.8 -2,-0.2 0.624 89.9 106.9 -81.2 -18.5 56.6 66.5 17.6 111 141 A L S << S- 0 0 25 -4,-0.9 2,-0.0 -3,-0.8 -3,-0.0 -0.325 73.7-115.7 -61.1 141.0 56.8 63.9 20.4 112 142 A G > - 0 0 48 1,-0.1 4,-2.1 -2,-0.1 5,-0.2 -0.308 36.5-101.4 -68.4 164.0 59.9 63.6 22.7 113 143 A E H > S+ 0 0 114 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.850 121.0 55.1 -63.9 -36.1 61.7 60.3 22.4 114 144 A N H > S+ 0 0 104 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.939 111.5 43.9 -61.2 -47.4 60.2 58.8 25.6 115 145 A K H > S+ 0 0 98 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.824 108.1 58.7 -66.0 -36.1 56.6 59.5 24.4 116 146 A K H X S+ 0 0 46 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.910 107.8 48.2 -56.9 -43.2 57.5 58.1 20.9 117 147 A L H X S+ 0 0 93 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.878 110.1 49.8 -67.1 -40.8 58.5 54.8 22.6 118 148 A Q H X S+ 0 0 44 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.903 111.8 50.5 -60.8 -41.7 55.2 54.8 24.6 119 149 A M H X S+ 0 0 2 -4,-2.5 4,-1.5 2,-0.2 3,-0.3 0.945 109.5 48.6 -61.0 -51.2 53.3 55.4 21.4 120 150 A K H X S+ 0 0 77 -4,-2.6 4,-3.2 1,-0.2 -1,-0.2 0.873 110.3 53.9 -57.3 -38.2 55.1 52.5 19.5 121 151 A S H X S+ 0 0 55 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.860 107.6 47.2 -67.8 -37.4 54.4 50.2 22.5 122 152 A I H <>S+ 0 0 4 -4,-1.7 6,-2.3 -3,-0.3 5,-1.1 0.715 115.8 47.4 -80.2 -20.3 50.6 50.9 22.6 123 153 A V H ><5S+ 0 0 13 -4,-1.5 3,-1.3 4,-0.2 -2,-0.2 0.911 112.1 48.4 -75.7 -51.3 50.5 50.3 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