==== 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 18-SEP-08 3EJS . COMPND 2 MOLECULE: ALPHA-MANNOSIDASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR D.A.KUNTZ,K.SHEA,D.R.ROSE . 1016 1 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36818.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 655 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 49 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 209 20.6 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 . 4 0.4 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 . 79 7.8 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 . 192 18.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.0 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 1 0 1 0 1 0 0 0 0 0 0 1 0 RESIDUES PER ALPHA HELIX . 1 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 6 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 . 0 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 0 155 0, 0.0 2,-0.2 0, 0.0 1002,-0.1 0.000 360.0 360.0 360.0 -76.2 45.3 34.2 -19.0 2 31 A a - 0 0 65 1,-0.1 2,-0.1 1000,-0.1 1000,-0.0 -0.486 360.0-115.2 -70.2 136.1 43.7 37.7 -18.9 3 32 A Q - 0 0 64 -2,-0.2 2,-0.7 1001,-0.1 -1,-0.1 -0.413 27.6-116.0 -59.4 144.1 40.0 37.9 -17.9 4 33 A D > - 0 0 56 1,-0.1 4,-0.5 -2,-0.1 220,-0.2 -0.795 29.1-172.3 -85.5 115.2 37.7 39.2 -20.6 5 34 A V T 4 S+ 0 0 4 -2,-0.7 -1,-0.1 1,-0.1 877,-0.1 0.419 76.9 43.8 -91.7 -0.1 36.3 42.5 -19.2 6 35 A V T 4 S+ 0 0 17 869,-0.1 871,-0.5 870,-0.1 -1,-0.1 0.799 111.1 39.4-108.4 -43.0 33.8 43.0 -22.0 7 36 A Q T 4 S+ 0 0 126 869,-0.2 2,-0.6 1,-0.1 -2,-0.1 0.556 98.0 69.5-101.6 -11.9 31.9 39.8 -23.0 8 37 A D < - 0 0 73 -4,-0.5 -1,-0.1 214,-0.2 216,-0.1 -0.930 68.7-147.6-114.5 107.2 31.2 37.9 -19.7 9 38 A V - 0 0 57 -2,-0.6 213,-0.1 1,-0.1 871,-0.1 -0.602 28.5-118.3 -72.7 117.8 28.5 39.5 -17.4 10 39 A P - 0 0 16 0, 0.0 2,-0.8 0, 0.0 214,-0.1 -0.262 14.9-131.5 -58.8 142.0 29.5 38.8 -13.7 11 40 A N + 0 0 144 213,-0.4 2,-0.3 2,-0.0 359,-0.0 -0.875 41.8 161.0 -94.8 106.7 27.1 36.7 -11.6 12 41 A V - 0 0 21 -2,-0.8 3,-0.1 1,-0.1 359,-0.1 -0.924 46.9-129.4-125.3 155.7 26.7 38.6 -8.3 13 42 A D S S+ 0 0 104 357,-0.3 2,-0.4 -2,-0.3 358,-0.2 0.875 100.4 27.2 -70.2 -39.4 24.1 38.5 -5.5 14 43 A V E -a 371 0A 8 356,-1.9 358,-2.1 199,-0.0 2,-0.5 -0.993 63.3-179.9-125.8 121.7 23.7 42.3 -5.5 15 44 A Q E > -a 372 0A 29 -2,-0.4 4,-2.7 356,-0.2 3,-0.4 -0.987 22.9-145.3-119.4 117.2 24.3 44.5 -8.5 16 45 A M H > S+ 0 0 7 356,-2.5 4,-2.6 -2,-0.5 357,-0.1 0.799 95.0 52.1 -62.9 -32.9 23.6 48.1 -7.7 17 46 A L H > S+ 0 0 33 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.922 114.0 44.7 -64.2 -41.7 22.2 49.2 -11.0 18 47 A E H > S+ 0 0 78 -3,-0.4 4,-1.5 2,-0.2 -2,-0.2 0.912 112.1 52.4 -70.4 -40.7 19.7 46.4 -11.0 19 48 A L H X S+ 0 0 4 -4,-2.7 4,-2.4 1,-0.2 3,-0.4 0.942 108.3 51.6 -58.0 -47.2 18.9 47.1 -7.3 20 49 A Y H < S+ 0 0 20 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.877 105.8 54.8 -55.1 -41.8 18.2 50.7 -8.2 21 50 A D H < S+ 0 0 84 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.872 116.0 38.0 -60.8 -37.0 15.8 49.6 -11.0 22 51 A R H < S+ 0 0 146 -4,-1.5 -2,-0.2 -3,-0.4 -1,-0.2 0.756 95.2 95.1 -86.2 -35.3 13.7 47.5 -8.6 23 52 A M < - 0 0 8 -4,-2.4 181,-0.0 -5,-0.2 180,-0.0 -0.328 57.6-154.9 -64.4 146.2 13.7 49.7 -5.4 24 53 A S - 0 0 84 179,-0.1 -1,-0.1 2,-0.1 -4,-0.0 0.614 18.4-147.4 -95.4 -19.3 10.8 52.1 -4.7 25 54 A F + 0 0 23 1,-0.2 2,-0.2 178,-0.1 178,-0.1 0.763 29.1 174.4 60.3 28.5 12.8 54.6 -2.5 26 55 A K - 0 0 156 1,-0.1 2,-1.0 177,-0.1 -1,-0.2 -0.486 28.0-142.2 -69.7 137.6 9.7 55.4 -0.3 27 56 A D + 0 0 84 -2,-0.2 2,-0.2 2,-0.0 -1,-0.1 -0.629 36.5 165.0-100.7 75.6 10.5 57.7 2.6 28 57 A I - 0 0 105 -2,-1.0 2,-0.7 7,-0.1 -2,-0.0 -0.640 45.7-105.2-100.5 150.6 8.3 56.3 5.3 29 58 A D - 0 0 127 -2,-0.2 6,-0.2 1,-0.1 5,-0.1 -0.611 32.9-174.5 -70.7 108.7 8.4 56.9 9.1 30 59 A G - 0 0 13 4,-2.5 3,-0.4 -2,-0.7 2,-0.3 0.387 39.9-113.2 -87.0 2.5 9.9 53.7 10.5 31 60 A G S S- 0 0 25 3,-0.3 -1,-0.3 1,-0.2 5,-0.1 -0.816 82.5 -7.7 101.6-146.2 9.5 54.6 14.2 32 61 A V S S+ 0 0 61 -2,-0.3 2,-1.3 1,-0.2 -1,-0.2 0.894 136.9 58.5 -56.2 -38.8 12.5 55.3 16.5 33 62 A W S > S- 0 0 16 -3,-0.4 3,-1.6 1,-0.2 -1,-0.2 -0.786 87.2-165.4 -85.7 93.6 14.6 54.0 13.6 34 63 A K T 3 S+ 0 0 128 -2,-1.3 -4,-2.5 1,-0.3 -3,-0.3 0.803 80.9 33.6 -61.2 -31.7 13.2 56.8 11.4 35 64 A Q T 3 S+ 0 0 30 -6,-0.2 -1,-0.3 -5,-0.1 171,-0.1 0.252 124.3 39.8-109.0 14.0 14.4 55.3 8.1 36 65 A G S < S- 0 0 2 -3,-1.6 2,-0.3 212,-0.1 -8,-0.1 0.113 88.0 -92.9-124.0-126.9 14.1 51.6 9.0 37 66 A W - 0 0 72 -2,-0.0 2,-0.9 169,-0.0 -7,-0.1 -0.911 47.4 -73.7-153.6 171.7 11.5 49.5 11.0 38 67 A N - 0 0 113 -2,-0.3 2,-0.2 -6,-0.1 -7,-0.1 -0.670 55.9-138.4 -78.3 103.7 10.9 48.3 14.5 39 68 A I - 0 0 15 -2,-0.9 2,-0.3 1,-0.0 256,-0.1 -0.446 19.6-166.2 -72.9 134.5 13.5 45.5 14.8 40 69 A K - 0 0 184 -2,-0.2 2,-0.3 255,-0.1 -1,-0.0 -0.898 6.7-178.7-114.9 148.4 12.4 42.2 16.6 41 70 A Y - 0 0 62 -2,-0.3 254,-0.1 256,-0.0 3,-0.0 -0.962 32.3-113.1-141.4 159.4 14.7 39.4 17.8 42 71 A D > - 0 0 96 -2,-0.3 3,-2.4 1,-0.1 4,-0.3 -0.845 19.7-150.8 -91.7 113.9 14.2 36.0 19.5 43 72 A P G > S+ 0 0 87 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.772 95.2 63.3 -58.6 -21.8 15.7 36.3 23.0 44 73 A L G 3 S+ 0 0 139 1,-0.2 -2,-0.0 -3,-0.0 0, 0.0 0.488 76.3 89.8 -78.9 -4.5 16.5 32.6 22.8 45 74 A K G < S+ 0 0 69 -3,-2.4 2,-0.4 2,-0.0 -1,-0.2 0.873 87.3 49.5 -61.1 -40.5 19.0 33.1 19.8 46 75 A Y S < S+ 0 0 12 -3,-0.6 2,-0.2 -4,-0.3 5,-0.2 -0.837 72.7 148.8-102.1 143.0 21.9 33.6 22.2 47 76 A N B > -F 50 0B 69 3,-1.8 3,-1.5 -2,-0.4 293,-0.0 -0.868 62.8 -64.2-154.4-176.9 22.6 31.1 25.0 48 77 A A T 3 S+ 0 0 75 1,-0.3 3,-0.2 -2,-0.2 -2,-0.0 0.829 134.0 39.5 -48.0 -38.5 25.4 29.5 27.1 49 78 A H T 3 S+ 0 0 184 1,-0.2 2,-0.3 2,-0.0 -1,-0.3 0.507 122.3 41.1 -95.3 -6.4 26.9 27.8 24.0 50 79 A H B < S+F 47 0B 59 -3,-1.5 -3,-1.8 2,-0.0 -1,-0.2 -0.754 75.6 177.0-145.2 88.9 26.3 30.7 21.6 51 80 A K - 0 0 68 -2,-0.3 2,-0.6 -3,-0.2 292,-0.2 -0.615 33.4-115.3 -96.3 154.0 27.1 34.1 23.0 52 81 A L E -g 343 0C 0 290,-2.6 292,-2.4 -2,-0.2 2,-0.6 -0.812 28.1-152.3 -84.3 118.4 27.0 37.6 21.4 53 82 A K E -gh 344 304C 66 250,-3.1 252,-3.1 -2,-0.6 2,-0.5 -0.870 12.8-164.1 -95.7 122.4 30.5 39.0 21.3 54 83 A V E -gh 345 305C 0 290,-2.5 292,-2.2 -2,-0.6 2,-0.6 -0.927 9.4-164.8-116.3 125.4 30.4 42.8 21.3 55 84 A F E -gh 346 306C 23 250,-2.8 252,-2.9 -2,-0.5 2,-0.6 -0.936 5.2-161.0-109.4 111.9 33.4 45.1 20.4 56 85 A V E -gh 347 307C 0 290,-2.8 292,-2.4 -2,-0.6 40,-0.1 -0.856 12.2-161.6 -93.4 118.0 33.1 48.7 21.5 57 86 A V E - h 0 308C 0 250,-2.5 252,-2.7 -2,-0.6 292,-0.1 -0.868 5.9-147.9-112.4 99.3 35.6 50.6 19.4 58 87 A P E + h 0 309C 0 0, 0.0 40,-1.9 0, 0.0 2,-0.3 -0.424 29.6 163.9 -66.9 139.0 36.6 54.2 20.6 59 88 A H E -ih 98 310C 2 250,-2.0 252,-0.6 38,-0.2 2,-0.3 -0.962 31.1-150.5-152.0 165.6 37.4 56.7 17.8 60 89 A S E - h 0 311C 6 38,-0.5 2,-0.7 -2,-0.3 40,-0.3 -0.937 17.5-141.5-145.8 114.0 37.9 60.4 17.1 61 90 A H E - h 0 312C 2 250,-2.1 252,-2.6 -2,-0.3 2,-0.6 -0.694 22.7-173.8 -85.0 113.1 37.1 61.8 13.6 62 91 A N - 0 0 0 -2,-0.7 42,-0.2 250,-0.2 250,-0.0 -0.863 10.7-153.3-115.8 100.7 39.7 64.5 12.9 63 92 A D - 0 0 2 -2,-0.6 2,-2.4 1,-0.1 3,-0.1 -0.546 14.9-138.3 -74.3 123.8 39.3 66.6 9.7 64 93 A P S S- 0 0 0 0, 0.0 6,-0.4 0, 0.0 377,-0.1 -0.420 87.0 -18.7 -74.9 64.4 42.5 68.0 8.1 65 94 A G S S+ 0 0 0 -2,-2.4 4,-0.2 4,-0.3 378,-0.2 0.189 81.5 124.9 104.0 134.5 40.7 71.3 7.5 66 95 A W S S+ 0 0 36 2,-2.2 384,-2.7 -3,-0.1 387,-0.2 -0.334 91.6 6.0-171.1 -84.7 36.9 72.1 7.4 67 96 A I S S+ 0 0 47 382,-0.2 2,-0.3 2,-0.1 385,-0.1 0.663 141.7 26.3 -86.3 -24.0 35.7 74.9 9.7 68 97 A Q S S- 0 0 46 384,-0.0 -2,-2.2 385,-0.0 382,-0.1 -0.868 97.6 -96.6-127.2 165.6 39.3 75.7 10.8 69 98 A T > - 0 0 14 -2,-0.3 4,-2.7 -4,-0.2 -4,-0.3 -0.335 40.4-100.6 -74.1 167.6 42.6 75.1 8.9 70 99 A F H > S+ 0 0 15 -6,-0.4 4,-2.2 1,-0.2 -5,-0.2 0.923 125.1 45.4 -48.3 -51.4 44.7 72.0 9.4 71 100 A E H > S+ 0 0 66 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.898 110.7 52.3 -70.5 -37.7 47.1 74.0 11.7 72 101 A E H > S+ 0 0 70 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.937 112.9 44.6 -60.9 -48.2 44.3 75.7 13.7 73 102 A Y H X>S+ 0 0 11 -4,-2.7 4,-2.6 1,-0.2 5,-2.1 0.892 110.8 55.1 -64.5 -36.7 42.7 72.3 14.4 74 103 A Y H <>S+ 0 0 8 -4,-2.2 5,-2.3 -5,-0.3 6,-0.3 0.937 114.1 39.9 -60.1 -44.5 46.0 70.8 15.3 75 104 A Q H <5S+ 0 0 67 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.881 123.6 37.5 -72.9 -40.5 46.8 73.5 17.9 76 105 A H H <5S- 0 0 100 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.834 137.3 -6.7 -83.4 -34.3 43.3 73.8 19.4 77 106 A D T >X5S+ 0 0 24 -4,-2.6 4,-2.1 -5,-0.3 3,-0.6 0.742 117.4 56.8-127.9 -58.5 42.2 70.1 19.3 78 107 A T H 3> S+ 0 0 76 -3,-0.6 4,-2.6 -6,-0.3 5,-0.2 0.880 109.8 53.5 -74.4 -38.6 45.5 67.4 22.9 81 110 A I H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.943 114.2 42.0 -57.7 -48.5 43.5 64.4 21.7 82 111 A L H X S+ 0 0 3 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.882 113.6 51.1 -70.6 -39.5 46.8 62.6 20.8 83 112 A S H X S+ 0 0 60 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.928 114.9 43.6 -60.4 -44.7 48.6 63.7 23.9 84 113 A N H X S+ 0 0 26 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.847 110.1 55.9 -75.1 -28.7 45.8 62.5 26.1 85 114 A A H X S+ 0 0 2 -4,-2.5 4,-2.6 -5,-0.2 5,-0.4 0.931 107.6 50.1 -62.3 -45.2 45.3 59.2 24.1 86 115 A L H X S+ 0 0 6 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.951 115.3 42.5 -58.7 -47.9 49.0 58.4 24.8 87 116 A R H X S+ 0 0 126 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.954 117.8 44.4 -63.1 -50.4 48.6 59.1 28.6 88 117 A H H X S+ 0 0 7 -4,-2.8 4,-1.2 2,-0.2 -2,-0.2 0.898 115.4 45.4 -68.0 -41.7 45.3 57.3 29.0 89 118 A L H < S+ 0 0 0 -4,-2.6 3,-0.4 -5,-0.3 -1,-0.2 0.919 112.4 53.0 -66.6 -42.3 46.1 54.2 26.9 90 119 A H H < S+ 0 0 87 -4,-2.1 -2,-0.2 -5,-0.4 -1,-0.2 0.952 115.5 40.5 -53.9 -46.1 49.5 53.9 28.7 91 120 A D H < S+ 0 0 95 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.604 117.1 49.2 -82.3 -14.3 47.8 54.0 32.1 92 121 A N >< - 0 0 33 -4,-1.2 3,-2.0 -3,-0.4 -1,-0.2 -0.787 66.2-170.9-131.1 84.8 44.8 51.8 31.2 93 122 A P T 3 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.637 83.1 51.5 -59.0 -20.7 46.0 48.6 29.5 94 123 A E T 3 S+ 0 0 146 2,-0.1 253,-0.2 254,-0.0 2,-0.1 0.573 87.7 100.4 -91.6 -11.1 42.5 47.3 28.5 95 124 A M < - 0 0 4 -3,-2.0 2,-0.3 -6,-0.2 -3,-0.1 -0.460 55.4-165.7 -73.8 148.8 41.4 50.6 26.8 96 125 A K - 0 0 28 -40,-0.1 2,-0.3 -2,-0.1 33,-0.2 -0.896 11.3-177.5-132.9 164.8 41.6 50.8 23.0 97 126 A F E - j 0 129C 2 31,-2.1 33,-2.3 -2,-0.3 2,-0.3 -0.963 14.0-145.8-162.5 139.4 41.6 53.5 20.3 98 127 A I E -ij 59 130C 4 -40,-1.9 -38,-0.5 -2,-0.3 2,-0.4 -0.881 11.9-162.8-111.1 151.4 41.7 53.6 16.5 99 128 A W E + j 0 131C 2 31,-2.2 33,-2.5 -2,-0.3 35,-0.2 -0.996 15.0 170.6-136.5 132.0 43.3 56.4 14.3 100 129 A A + 0 0 9 -2,-0.4 2,-0.9 -40,-0.3 34,-0.4 0.790 56.1 74.7-105.1 -44.3 42.8 57.2 10.6 101 130 A E > - 0 0 3 1,-0.2 4,-1.6 33,-0.1 3,-0.4 -0.689 46.6-179.1 -92.3 102.8 44.5 60.5 9.5 102 131 A I H > S+ 0 0 0 33,-2.5 4,-3.0 -2,-0.9 5,-0.3 0.793 76.4 71.7 -75.5 -22.6 48.2 60.2 9.3 103 132 A S H > S+ 0 0 4 33,-2.1 4,-1.6 32,-0.3 -1,-0.2 0.950 107.7 37.8 -51.2 -49.1 48.8 63.8 8.3 104 133 A Y H > S+ 0 0 0 -3,-0.4 4,-1.9 32,-0.3 -1,-0.2 0.887 114.8 53.4 -67.6 -41.9 47.9 64.7 11.9 105 134 A F H X S+ 0 0 0 -4,-1.6 4,-3.2 1,-0.2 5,-0.2 0.918 110.8 46.3 -64.3 -43.2 49.7 61.7 13.5 106 135 A A H X S+ 0 0 4 -4,-3.0 4,-2.1 2,-0.2 -1,-0.2 0.920 110.3 54.3 -62.0 -43.3 53.0 62.6 11.7 107 136 A R H < S+ 0 0 66 -4,-1.6 4,-0.3 -5,-0.3 -1,-0.2 0.847 116.4 39.6 -59.0 -37.0 52.6 66.3 12.7 108 137 A F H >X S+ 0 0 12 -4,-1.9 3,-1.2 2,-0.2 4,-0.6 0.928 112.3 52.7 -78.4 -51.5 52.3 65.2 16.4 109 138 A Y H >< S+ 0 0 5 -4,-3.2 3,-0.8 1,-0.3 -2,-0.2 0.831 105.1 55.2 -60.8 -36.0 54.9 62.3 16.5 110 139 A H T 3< S+ 0 0 86 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.704 107.0 52.0 -70.8 -19.9 57.7 64.5 15.1 111 140 A D T <4 S+ 0 0 106 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.538 91.4 100.2 -92.7 -5.7 57.1 67.1 17.9 112 141 A L S << S- 0 0 26 -3,-0.8 2,-0.0 -4,-0.6 -3,-0.0 -0.515 75.5-115.4 -79.6 145.0 57.3 64.4 20.7 113 142 A G > - 0 0 50 -2,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.306 34.5-103.0 -66.1 161.1 60.4 63.9 22.8 114 143 A E H > S+ 0 0 118 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.861 119.2 57.1 -59.0 -38.8 62.2 60.5 22.6 115 144 A N H > S+ 0 0 106 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.952 112.7 40.8 -57.6 -49.5 60.7 59.2 25.9 116 145 A K H > S+ 0 0 97 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.809 109.3 59.1 -71.0 -32.3 57.1 59.7 24.6 117 146 A K H X S+ 0 0 34 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.924 108.5 47.2 -58.2 -45.1 58.0 58.4 21.0 118 147 A L H X S+ 0 0 96 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.908 110.8 50.4 -64.3 -43.8 59.0 55.2 22.7 119 148 A Q H X S+ 0 0 48 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.910 111.2 50.3 -56.3 -44.1 55.8 55.1 24.8 120 149 A M H X S+ 0 0 2 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.933 108.3 50.9 -63.7 -46.4 53.8 55.7 21.6 121 150 A K H X S+ 0 0 77 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.869 108.4 54.8 -59.2 -33.7 55.5 52.8 19.8 122 151 A S H X S+ 0 0 55 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.878 106.1 48.4 -69.7 -42.0 54.8 50.5 22.7 123 152 A I H <>S+ 0 0 2 -4,-1.8 6,-2.0 2,-0.2 5,-1.5 0.763 115.4 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