==== 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 VIRAL PROTEIN 26-NOV-09 3KU6 . COMPND 2 MOLECULE: HEMAGGLUTININ HA1 CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; . AUTHOR R.XU,I.A.WILSON . 494 2 6 5 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24559.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 319 64.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 96 19.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 41 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 100 20.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 0 0 1 0 3 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 3 3 3 0 0 0 0 0 0 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 . 5 5 5 2 0 4 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 4 1 1 0 1 0 0 0 0 0 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 9 A P 0 0 174 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 132.7 -11.7 -26.0 47.2 2 10 A G - 0 0 35 1,-0.2 462,-0.1 464,-0.0 464,-0.1 -0.712 360.0 -50.9-132.3-179.0 -8.4 -24.2 46.5 3 11 A D - 0 0 16 462,-0.3 460,-2.9 -2,-0.2 2,-0.3 -0.210 60.4-158.4 -52.7 144.7 -6.5 -22.0 43.9 4 12 A Q E -AB 350 462A 52 346,-2.2 346,-2.8 458,-0.2 2,-0.4 -0.951 23.9-165.4-133.3 147.1 -6.4 -23.6 40.3 5 13 A I E -AB 349 461A 0 456,-2.6 456,-3.8 -2,-0.3 2,-0.3 -0.996 19.1-164.8-128.2 138.5 -4.6 -23.5 37.1 6 14 A a E -AB 348 460A 14 342,-2.7 342,-2.2 -2,-0.4 2,-0.4 -0.932 12.5-141.6-124.5 143.8 -6.2 -25.1 34.0 7 15 A I E +A 347 0A 1 452,-3.3 2,-0.2 -2,-0.3 340,-0.2 -0.863 38.1 139.2-104.4 141.1 -4.8 -26.1 30.6 8 16 A G E -A 346 0A 0 338,-2.3 338,-2.3 -2,-0.4 2,-0.3 -0.925 36.8-108.5-164.6-175.4 -6.8 -25.5 27.4 9 17 A Y E -A 345 0A 0 326,-0.4 328,-3.1 -2,-0.2 336,-0.2 -0.909 34.9 -87.8-136.3 158.1 -7.2 -24.5 23.8 10 18 A H B +e 337 0B 16 334,-2.5 311,-0.3 -2,-0.3 2,-0.3 -0.206 36.9 176.3 -61.2 141.1 -8.5 -21.7 21.5 11 19 A A + 0 0 1 326,-1.6 2,-0.2 329,-0.3 329,-0.1 -0.961 6.8 163.1-139.6 160.3 -12.0 -21.5 20.1 12 20 A N - 0 0 31 -2,-0.3 326,-0.1 2,-0.1 324,-0.1 -0.772 51.9 -77.1-153.8-164.9 -13.7 -18.9 18.1 13 21 A N S S+ 0 0 150 -2,-0.2 16,-0.0 16,-0.1 307,-0.0 0.242 73.7 135.9 -93.1 10.3 -16.6 -18.0 15.8 14 22 A S - 0 0 17 1,-0.1 -2,-0.1 15,-0.1 16,-0.1 -0.324 31.5-179.0 -65.3 139.0 -15.2 -19.8 12.7 15 23 A T + 0 0 100 14,-0.1 -1,-0.1 12,-0.1 2,-0.1 0.131 36.9 137.1-117.3 14.2 -17.7 -21.9 10.7 16 24 A E - 0 0 105 12,-0.4 12,-2.1 13,-0.1 2,-0.3 -0.413 41.0-151.4 -62.4 131.1 -14.9 -23.0 8.2 17 25 A K E +F 27 0C 88 10,-0.2 2,-0.3 -2,-0.1 10,-0.2 -0.826 17.4 178.9-112.0 148.9 -15.2 -26.7 7.4 18 26 A V E -F 26 0C 5 8,-2.1 8,-2.7 -2,-0.3 2,-0.3 -0.951 19.0-133.0-136.5 159.2 -12.6 -29.3 6.3 19 27 A D - 0 0 36 294,-0.4 2,-0.2 -2,-0.3 5,-0.2 -0.845 18.9-177.7-110.5 153.4 -12.6 -33.0 5.6 20 28 A T - 0 0 9 3,-3.3 405,-0.2 -2,-0.3 404,-0.1 -0.751 43.2-100.5-128.0-178.7 -10.3 -35.7 6.8 21 29 A I S S+ 0 0 92 403,-0.6 404,-0.1 -2,-0.2 3,-0.1 0.891 122.6 37.0 -65.9 -40.2 -10.1 -39.5 6.0 22 30 A L S S+ 0 0 147 1,-0.2 2,-0.3 -3,-0.0 -1,-0.2 0.749 126.2 25.1 -88.3 -26.3 -11.9 -40.4 9.3 23 31 A E - 0 0 87 3,-0.0 -3,-3.3 0, 0.0 2,-0.3 -0.982 62.2-150.5-144.5 148.9 -14.4 -37.5 9.5 24 32 A R S S+ 0 0 206 -2,-0.3 -5,-0.2 -5,-0.2 -3,-0.0 -0.854 73.5 20.9-117.8 154.6 -16.2 -35.1 7.2 25 33 A N S S+ 0 0 105 -2,-0.3 2,-0.4 1,-0.2 -6,-0.2 0.891 75.1 173.7 61.3 43.1 -17.5 -31.5 7.7 26 34 A V E -F 18 0C 5 -8,-2.7 -8,-2.1 -3,-0.2 2,-0.4 -0.726 27.8-133.2 -84.5 128.9 -15.2 -30.7 10.6 27 35 A T E -F 17 0C 37 -2,-0.4 293,-2.7 -10,-0.2 2,-0.3 -0.702 27.8-172.7 -83.9 132.5 -15.3 -27.1 11.9 28 36 A V B -G 319 0D 0 -12,-2.1 -12,-0.4 -2,-0.4 291,-0.2 -0.898 33.4-126.9-125.8 153.0 -11.8 -25.6 12.5 29 37 A T S S+ 0 0 4 289,-2.9 2,-0.3 -2,-0.3 290,-0.1 0.782 96.5 11.7 -66.6 -29.1 -10.6 -22.4 14.1 30 38 A H + 0 0 76 288,-0.3 287,-2.0 -14,-0.1 286,-1.9 -0.988 68.6 170.1-152.2 144.9 -8.5 -21.5 11.0 31 39 A A E -H 315 0E 32 -2,-0.3 2,-0.5 284,-0.3 284,-0.2 -0.966 24.1-135.2-154.5 162.2 -8.2 -22.9 7.5 32 40 A K E -H 314 0E 103 282,-3.1 282,-2.8 -2,-0.3 2,-0.6 -0.964 11.1-149.9-131.1 111.5 -6.6 -22.1 4.1 33 41 A D E +H 313 0E 63 -2,-0.5 280,-0.2 280,-0.2 -2,-0.0 -0.713 16.0 179.5 -77.0 121.7 -8.5 -22.4 0.8 34 42 A I + 0 0 2 278,-2.5 258,-1.5 -2,-0.6 2,-0.5 0.259 50.5 91.0-109.7 12.8 -6.0 -23.3 -1.8 35 43 A L E -i 292 0F 1 277,-0.5 2,-0.5 256,-0.1 258,-0.2 -0.916 61.2-150.1-119.1 115.0 -8.4 -23.5 -4.8 36 44 A E E +i 293 0F 26 256,-2.9 258,-1.7 -2,-0.5 259,-0.3 -0.669 21.8 168.4 -79.8 124.9 -9.2 -20.5 -7.1 37 45 A K + 0 0 85 -2,-0.5 2,-0.3 256,-0.2 -1,-0.1 0.367 48.0 83.6-116.4 -0.6 -12.7 -20.9 -8.5 38 46 A T + 0 0 93 249,-0.1 2,-0.3 2,-0.0 249,-0.2 -0.743 42.1 169.5-114.1 156.6 -13.2 -17.4 -10.1 39 47 A H - 0 0 77 -2,-0.3 247,-0.2 247,-0.1 -2,-0.0 -0.933 42.1-112.9-153.9 164.9 -12.3 -15.7 -13.4 40 48 A N - 0 0 75 245,-2.2 244,-0.1 -2,-0.3 3,-0.1 0.421 40.4-125.4 -91.8 4.0 -13.4 -12.4 -14.9 41 49 A G S S+ 0 0 45 1,-0.2 2,-0.3 244,-0.2 243,-0.2 0.570 73.5 109.7 67.8 11.8 -15.4 -13.9 -17.8 42 50 A K - 0 0 82 243,-0.1 243,-0.6 228,-0.1 2,-0.5 -0.856 69.2-127.8-121.1 153.4 -13.3 -11.8 -20.3 43 51 A L E +k 272 0G 9 228,-0.6 230,-2.6 -2,-0.3 2,-0.2 -0.857 46.1 176.6 -92.8 131.4 -10.7 -12.4 -23.0 44 52 A b E - 0 0 0 -2,-0.5 232,-0.2 228,-0.2 2,-0.1 -0.767 36.6 -81.0-132.1 170.8 -7.8 -10.0 -22.3 45 53 A K E -k 276 0G 49 230,-2.7 232,-1.6 228,-0.3 2,-0.6 -0.489 44.1-131.9 -66.5 147.6 -4.3 -8.9 -23.2 46 53AA L E > S-kL 277 49G 14 3,-2.6 3,-1.5 1,-0.2 232,-0.2 -0.951 84.0 -21.5-109.4 108.5 -1.7 -11.2 -21.8 47 54 A N T 3 S- 0 0 80 230,-2.6 -1,-0.2 -2,-0.6 231,-0.1 0.891 128.3 -52.6 54.3 41.8 1.0 -9.1 -20.1 48 55 A G T 3 S+ 0 0 42 229,-0.2 -1,-0.3 1,-0.2 230,-0.1 0.390 116.4 113.8 79.7 -1.6 -0.1 -6.2 -22.2 49 56 A I B < -L 46 0G 56 -3,-1.5 -3,-2.6 -5,-0.0 -1,-0.2 -0.898 62.0-136.2-103.1 120.5 0.3 -8.1 -25.5 50 57 A P - 0 0 58 0, 0.0 29,-1.1 0, 0.0 30,-0.2 -0.335 16.7-113.3 -75.7 154.2 -3.1 -8.6 -27.2 51 58 A P - 0 0 11 0, 0.0 2,-0.7 0, 0.0 30,-0.2 -0.350 32.5-102.6 -71.1 166.6 -4.2 -11.8 -28.8 52 59 A L E -m 81 0H 13 28,-2.7 30,-2.9 -2,-0.1 2,-0.9 -0.862 36.0-153.1 -87.9 113.6 -4.7 -12.2 -32.6 53 60 A E E -m 82 0H 61 -2,-0.7 30,-0.1 28,-0.2 28,-0.1 -0.813 15.4-176.1 -95.5 103.5 -8.4 -12.1 -33.0 54 61 A L > - 0 0 0 28,-1.9 3,-1.9 -2,-0.9 2,-0.3 0.739 16.1-174.0 -69.1 -24.3 -9.3 -14.0 -36.2 55 62 A G T 3 S- 0 0 19 27,-0.3 29,-0.5 1,-0.3 -1,-0.2 -0.481 72.2 -9.6 66.2-119.6 -13.0 -13.1 -35.9 56 63 A D T 3 S+ 0 0 45 -2,-0.3 33,-2.9 12,-0.2 2,-0.3 0.369 118.5 98.4 -90.0 5.8 -14.9 -15.0 -38.6 57 64 A c B < -o 89 0I 0 -3,-1.9 27,-0.4 31,-0.2 33,-0.2 -0.686 62.8-141.5 -93.4 146.7 -11.7 -16.2 -40.3 58 65 A S > - 0 0 12 31,-2.2 4,-2.7 -2,-0.3 5,-0.2 -0.550 35.2-100.5 -88.7 170.2 -9.9 -19.5 -39.9 59 66 A I H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.927 128.2 48.2 -50.1 -48.7 -6.1 -19.9 -39.8 60 67 A A H > S+ 0 0 4 2,-0.2 4,-2.7 1,-0.2 5,-0.4 0.917 108.6 52.6 -60.4 -46.5 -6.3 -21.0 -43.5 61 68 A G H >>S+ 0 0 0 28,-0.2 5,-2.5 1,-0.2 4,-1.5 0.921 113.3 46.1 -56.6 -42.8 -8.5 -17.9 -44.4 62 69 A W H <5S+ 0 0 9 -4,-2.7 -2,-0.2 3,-0.2 -1,-0.2 0.972 116.6 40.6 -60.5 -56.7 -5.9 -15.7 -42.8 63 70 A L H <5S+ 0 0 1 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.851 119.7 43.5 -72.4 -34.0 -2.8 -17.2 -44.3 64 71 A L H <5S- 0 0 0 -4,-2.7 83,-2.1 -5,-0.2 84,-0.4 0.791 112.7-120.6 -74.8 -31.4 -4.2 -17.7 -47.8 65 72 A G T <5 - 0 0 2 -4,-1.5 81,-3.0 -5,-0.4 -3,-0.2 0.846 27.5-162.1 89.7 43.3 -5.8 -14.2 -47.7 66 73 A N > < - 0 0 5 -5,-2.5 3,-2.5 79,-0.2 -1,-0.1 -0.353 29.0-122.0 -49.6 129.9 -9.5 -14.9 -48.1 67 74 A P G > S+ 0 0 11 0, 0.0 3,-0.8 0, 0.0 -1,-0.2 0.655 111.3 64.8 -59.1 -15.2 -10.8 -11.4 -49.2 68 75 A E G 3 S+ 0 0 111 1,-0.2 3,-0.2 22,-0.1 -12,-0.2 0.515 98.8 56.0 -78.2 -1.4 -13.2 -11.5 -46.1 69 76 A c G X + 0 0 3 -3,-2.5 3,-2.6 -8,-0.2 -1,-0.2 0.066 64.6 127.4-117.1 20.5 -10.1 -11.5 -43.9 70 77 A D G X + 0 0 59 -3,-0.8 3,-1.7 1,-0.3 4,-0.2 0.729 63.0 69.2 -58.3 -25.8 -8.4 -8.3 -45.3 71 78 A R G 3 S+ 0 0 133 1,-0.3 3,-0.3 -3,-0.2 -1,-0.3 0.700 97.6 55.4 -62.2 -16.6 -8.1 -6.8 -41.7 72 79 A L G < S+ 0 0 12 -3,-2.6 -1,-0.3 1,-0.2 3,-0.2 0.221 71.5 107.6 -99.3 7.8 -5.5 -9.5 -41.1 73 80 A L S < S+ 0 0 63 -3,-1.7 2,-0.3 1,-0.3 -1,-0.2 0.770 95.5 16.7 -60.2 -28.8 -3.2 -8.7 -44.1 74 81 A S S S+ 0 0 110 -3,-0.3 -1,-0.3 -4,-0.2 40,-0.1 -0.925 79.8 175.7-141.5 117.7 -0.6 -7.3 -41.7 75 81AA V - 0 0 23 -2,-0.3 38,-0.4 -3,-0.2 3,-0.1 -0.977 22.1-131.0-127.1 141.4 -0.8 -8.1 -38.0 76 82 A P - 0 0 104 0, 0.0 37,-0.1 0, 0.0 38,-0.0 -0.182 52.0 -56.5 -79.2 176.7 1.6 -7.3 -35.1 77 83 A E - 0 0 63 35,-0.1 2,-0.3 1,-0.1 35,-0.2 -0.189 59.8-159.3 -53.9 142.2 3.0 -9.7 -32.5 78 84 A W - 0 0 2 33,-2.5 3,-0.1 -3,-0.1 -1,-0.1 -0.831 25.4-148.0-122.6 164.9 0.3 -11.7 -30.5 79 85 A S S S- 0 0 6 -29,-1.1 2,-0.3 1,-0.4 -1,-0.1 0.677 85.3 -11.5-104.4 -24.6 0.2 -13.5 -27.2 80 86 A Y S S- 0 0 0 -30,-0.2 -28,-2.7 183,-0.2 2,-0.5 -0.932 70.5-115.1-161.7 167.8 -2.4 -16.2 -28.3 81 87 A I E -mn 52 265H 0 183,-2.9 185,-3.4 -2,-0.3 2,-0.6 -0.960 18.2-148.8-115.1 130.6 -4.7 -16.7 -31.3 82 88 A M E +mn 53 266H 6 -30,-2.9 -28,-1.9 -2,-0.5 2,-0.4 -0.877 23.2 172.7 -97.8 123.5 -8.5 -16.6 -30.9 83 89 A E E - n 0 267H 2 183,-2.6 185,-1.9 -2,-0.6 -25,-0.1 -0.991 27.5-125.2-130.8 138.9 -10.3 -18.9 -33.4 84 90 A K - 0 0 51 -29,-0.5 185,-0.1 -2,-0.4 -28,-0.0 -0.283 26.8-112.7 -74.4 165.2 -14.0 -19.7 -33.5 85 91 A E S S+ 0 0 111 1,-0.3 -1,-0.1 182,-0.1 184,-0.0 0.910 110.5 13.2 -63.6 -41.1 -15.2 -23.3 -33.6 86 92 A N S S- 0 0 138 -28,-0.0 -1,-0.3 0, 0.0 -28,-0.1 -0.649 83.4-160.9-137.4 70.9 -16.5 -23.1 -37.1 87 93 A P - 0 0 30 0, 0.0 -30,-0.1 0, 0.0 -29,-0.1 -0.344 11.7-145.4 -62.2 136.5 -15.2 -19.9 -38.8 88 94 A R S S+ 0 0 178 1,-0.2 2,-0.9 -32,-0.1 -31,-0.2 0.808 83.6 63.8 -65.5 -34.7 -17.2 -18.9 -41.8 89 95 A D B +o 57 0I 26 -33,-2.9 -31,-2.2 1,-0.1 -28,-0.2 -0.774 68.7 104.3-108.2 93.4 -14.2 -17.5 -43.8 90 95AA G S S+ 0 0 12 -2,-0.9 2,-1.4 -33,-0.2 3,-0.2 0.237 82.5 9.2-128.5-109.9 -11.7 -20.1 -44.7 91 96 A L + 0 0 38 1,-0.2 4,-0.1 4,-0.1 -1,-0.1 -0.665 61.5 179.2 -81.4 91.6 -11.3 -21.7 -48.1 92 97 A d S S+ 0 0 11 -2,-1.4 -1,-0.2 1,-0.1 45,-0.1 0.916 82.5 51.4 -64.0 -42.3 -13.6 -19.4 -50.2 93 98 A Y S S- 0 0 5 -3,-0.2 134,-0.2 43,-0.1 -1,-0.1 -0.890 113.3-118.4 -84.2 119.3 -12.7 -21.5 -53.2 94 99 A P + 0 0 5 0, 0.0 133,-2.0 0, 0.0 2,-0.3 -0.109 62.9 94.1 -68.0 160.3 -13.5 -24.9 -51.7 95 100 A G E -p 227 0J 34 131,-0.3 2,-0.3 -4,-0.1 133,-0.2 -0.950 63.5 -65.9 163.6-139.4 -10.9 -27.6 -51.3 96 101 A S E -p 228 0J 53 131,-1.9 133,-2.9 -2,-0.3 2,-0.4 -0.913 20.1-141.4-147.1 167.1 -8.5 -29.0 -48.7 97 102 A F E > -p 229 0J 25 -2,-0.3 3,-1.0 131,-0.2 133,-0.2 -0.931 26.4-135.5-139.2 103.7 -5.3 -28.0 -46.8 98 103 A N T 3 S+ 0 0 46 131,-3.3 133,-0.2 -2,-0.4 -2,-0.0 -0.381 84.5 2.0 -62.7 139.3 -2.8 -30.8 -46.3 99 104 A D T 3> S+ 0 0 101 1,-0.1 4,-1.9 -2,-0.1 -1,-0.2 0.867 82.2 154.6 51.4 40.9 -1.2 -31.2 -42.8 100 105 A Y H <> + 0 0 35 -3,-1.0 4,-2.5 2,-0.2 5,-0.2 0.920 68.1 51.5 -66.2 -43.7 -3.4 -28.4 -41.6 101 106 A E H > S+ 0 0 50 1,-0.2 4,-2.1 2,-0.2 291,-0.3 0.882 107.8 53.3 -63.8 -36.5 -3.4 -29.5 -37.9 102 107 A E H > S+ 0 0 123 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.904 108.2 50.3 -60.1 -42.2 0.4 -29.7 -38.1 103 108 A L H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.940 109.4 50.8 -61.7 -45.4 0.5 -26.1 -39.3 104 109 A K H X S+ 0 0 11 -4,-2.5 4,-0.8 1,-0.2 -2,-0.2 0.889 108.2 53.5 -59.0 -39.5 -1.9 -25.1 -36.4 105 110 A H H >< S+ 0 0 81 -4,-2.1 3,-1.1 1,-0.2 4,-0.2 0.913 103.8 55.1 -63.2 -41.4 0.5 -26.8 -34.0 106 111 A L H >< S+ 0 0 25 -4,-2.1 3,-2.3 1,-0.2 -1,-0.2 0.911 99.3 62.9 -53.4 -43.7 3.5 -24.8 -35.4 107 112 A L H >< S+ 0 0 0 -4,-1.8 3,-1.5 1,-0.3 157,-0.4 0.771 86.2 74.4 -58.9 -23.8 1.5 -21.7 -34.6 108 113 A S T << S+ 0 0 22 -3,-1.1 155,-2.4 -4,-0.8 -1,-0.3 0.647 105.0 36.1 -60.0 -19.4 1.6 -22.6 -30.8 109 114 A S T < S+ 0 0 55 -3,-2.3 152,-2.1 -4,-0.2 2,-0.4 0.188 102.2 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