==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 29-MAR-13 4BGY . COMPND 2 MOLECULE: HEMAGGLUTININ; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA VIRUS; . AUTHOR X.XIONG,P.COOMBS,S.R MARTIN,J.LIU,H.XIAO,J.W.MCCAULEY,K.LOCH . 483 2 6 5 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24308.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 308 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 97 20.1 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 . 9 1.9 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 . 1 0.2 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 . 42 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 19.7 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 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 3 2 4 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 3 1 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 1 A D 0 0 57 0, 0.0 461,-2.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 136.6 -32.1 35.5 -7.3 2 2 A Q E -AB 349 461A 52 347,-2.0 347,-2.0 459,-0.3 2,-0.4 -0.989 360.0-149.6-151.1 155.6 -33.9 34.9 -4.0 3 3 A I E -AB 348 460A 0 457,-2.0 457,-2.7 -2,-0.3 2,-0.3 -0.987 20.8-164.3-124.1 138.6 -34.8 36.3 -0.7 4 4 A a E -AB 347 459A 7 343,-2.3 343,-2.1 -2,-0.4 2,-0.5 -0.901 15.1-138.6-123.0 150.2 -35.1 34.3 2.5 5 5 A I E +A 346 0A 1 453,-2.7 2,-0.3 -2,-0.3 341,-0.2 -0.927 39.7 146.7-104.3 133.8 -36.7 34.8 5.9 6 6 A G E -A 345 0A 0 339,-2.2 339,-2.1 -2,-0.5 2,-0.3 -0.871 33.6-119.3-151.1-174.0 -34.7 33.5 8.8 7 7 A Y E -A 344 0A 1 327,-0.3 329,-2.6 -2,-0.3 337,-0.2 -0.880 34.7 -79.6-138.0 164.1 -33.8 34.0 12.4 8 8 A H B +e 336 0B 19 335,-3.0 2,-0.3 -2,-0.3 329,-0.2 -0.235 38.7 176.8 -67.0 142.2 -30.9 34.7 14.7 9 9 A A + 0 0 2 327,-1.6 2,-0.3 330,-0.3 330,-0.1 -0.939 4.6 167.3-136.2 164.1 -28.4 32.1 16.0 10 10 A N - 0 0 31 -2,-0.3 327,-0.1 310,-0.2 325,-0.1 -0.922 49.3 -88.8-161.7-177.1 -25.3 32.4 18.1 11 11 A N S S+ 0 0 148 -2,-0.3 16,-0.0 326,-0.1 326,-0.0 0.277 72.4 135.6 -92.3 12.1 -22.7 30.5 20.1 12 12 A S - 0 0 22 1,-0.1 -2,-0.2 15,-0.1 16,-0.1 -0.316 36.8-170.2 -62.8 140.1 -24.7 30.6 23.4 13 13 A T + 0 0 120 14,-0.1 -1,-0.1 12,-0.1 14,-0.1 0.365 40.6 132.9-106.3 -0.6 -24.9 27.4 25.4 14 14 A E - 0 0 83 12,-0.3 12,-2.9 13,-0.1 2,-0.3 -0.252 39.1-160.1 -60.4 139.1 -27.5 28.7 27.9 15 15 A Q E -F 25 0C 72 10,-0.3 2,-0.3 12,-0.0 10,-0.2 -0.902 10.5-170.8-124.2 146.5 -30.4 26.3 28.5 16 16 A V E -F 24 0C 0 8,-2.3 8,-2.4 -2,-0.3 2,-0.3 -0.942 18.9-126.5-131.3 154.8 -34.0 26.8 29.8 17 17 A D + 0 0 41 295,-0.4 2,-0.2 -2,-0.3 5,-0.2 -0.789 23.4 179.3 -99.8 147.6 -36.7 24.4 30.8 18 18 A T - 0 0 10 3,-2.8 406,-0.2 -2,-0.3 405,-0.1 -0.725 44.6 -95.4-126.7-176.0 -40.2 24.3 29.5 19 19 A I S S+ 0 0 92 404,-0.5 3,-0.1 -2,-0.2 405,-0.1 0.857 121.4 31.6 -72.4 -39.4 -43.1 21.9 30.3 20 20 A M S S+ 0 0 161 1,-0.2 2,-0.4 -3,-0.0 -1,-0.2 0.607 125.9 34.4 -94.9 -16.0 -42.6 19.6 27.4 21 21 A E - 0 0 87 3,-0.0 -3,-2.8 0, 0.0 3,-0.3 -0.992 63.7-154.8-149.7 136.2 -38.9 19.8 27.0 22 22 A K S S+ 0 0 159 -2,-0.4 -5,-0.2 -5,-0.2 -3,-0.0 -0.706 72.6 19.6-108.6 156.0 -35.9 20.3 29.3 23 23 A N S S+ 0 0 103 -2,-0.3 2,-0.5 1,-0.2 -6,-0.2 0.864 73.3 175.5 56.5 42.1 -32.5 21.7 28.7 24 24 A V E -F 16 0C 3 -8,-2.4 -8,-2.3 -3,-0.3 2,-0.4 -0.684 28.0-129.9 -79.0 125.2 -33.4 23.7 25.6 25 25 A T E -F 15 0C 47 -2,-0.5 294,-2.2 -10,-0.2 2,-0.3 -0.631 30.4-173.9 -81.2 129.0 -30.5 25.8 24.3 26 26 A V B -G 318 0D 0 -12,-2.9 -12,-0.3 -2,-0.4 292,-0.2 -0.845 34.5-127.1-125.1 157.4 -31.4 29.4 23.6 27 27 A T S S+ 0 0 4 290,-2.8 2,-0.3 -2,-0.3 -13,-0.1 0.874 95.6 11.9 -69.4 -39.5 -29.7 32.4 22.1 28 28 A H + 0 0 73 289,-0.3 288,-1.9 -16,-0.1 287,-1.8 -0.988 68.2 162.6-141.0 150.7 -30.4 34.6 25.1 29 29 A A E -H 314 0E 19 -2,-0.3 2,-0.4 285,-0.3 285,-0.2 -0.938 26.1-130.9-156.8 171.8 -31.7 34.1 28.7 30 30 A Q E -H 313 0E 80 283,-2.7 283,-2.7 -2,-0.3 2,-0.3 -0.928 9.6-148.1-142.0 114.5 -31.9 35.7 32.0 31 31 A D E +H 312 0E 52 -2,-0.4 281,-0.2 281,-0.2 -2,-0.0 -0.623 17.8 175.8 -75.7 132.7 -31.0 34.2 35.4 32 32 A I + 0 0 0 279,-2.0 259,-1.6 -2,-0.3 2,-0.5 0.273 49.8 90.8-123.1 8.4 -33.3 35.6 38.1 33 33 A L E -i 291 0F 0 278,-0.6 2,-0.7 257,-0.1 259,-0.3 -0.930 66.3-141.8-112.7 125.6 -32.1 33.6 41.1 34 34 A E E +i 292 0F 25 257,-2.8 259,-1.6 -2,-0.5 260,-0.2 -0.760 23.3 173.3 -87.0 115.9 -29.3 34.7 43.4 35 35 A K + 0 0 89 -2,-0.7 2,-0.3 257,-0.2 -1,-0.1 0.494 50.9 72.8-101.3 -5.2 -27.2 31.7 44.4 36 36 A T + 0 0 95 250,-0.1 250,-0.3 2,-0.0 2,-0.3 -0.846 45.3 176.5-121.9 153.6 -24.3 33.4 46.2 37 37 A H - 0 0 74 -2,-0.3 248,-0.2 248,-0.1 246,-0.0 -0.932 39.8-116.1-141.1 160.6 -23.6 35.2 49.5 38 38 A N - 0 0 74 246,-1.9 245,-0.1 -2,-0.3 247,-0.1 0.722 44.4-125.7 -75.0 -21.7 -20.4 36.6 51.0 39 39 A G S S+ 0 0 31 245,-0.3 2,-0.3 1,-0.3 244,-0.2 0.584 71.4 103.5 92.5 13.1 -20.5 34.1 54.0 40 40 A K S S- 0 0 108 244,-0.1 244,-0.6 229,-0.1 2,-0.3 -0.947 74.0-117.6-134.0 144.1 -20.3 36.8 56.7 41 41 A L E -k 271 0G 0 229,-1.0 231,-2.2 -2,-0.3 2,-0.3 -0.657 49.3-175.6 -72.9 138.5 -22.4 38.6 59.2 42 42 A b E - 0 0 0 -2,-0.3 233,-0.3 229,-0.2 2,-0.1 -0.887 31.9 -86.6-140.0 158.4 -22.3 42.2 58.2 43 43 A D E -k 275 0G 28 231,-3.0 233,-2.2 -2,-0.3 2,-0.6 -0.397 44.3-131.6 -62.0 148.3 -23.4 45.8 59.2 44 44 A L E > S-kL 276 47G 21 3,-2.8 3,-1.0 1,-0.2 233,-0.2 -0.882 82.2 -17.8-115.0 107.0 -26.9 46.5 57.9 45 45 A D T 3 S- 0 0 114 231,-2.7 -1,-0.2 -2,-0.6 232,-0.1 0.859 129.5 -55.8 65.2 35.5 -27.2 49.9 56.1 46 46 A G T 3 S+ 0 0 47 230,-0.4 2,-0.5 1,-0.2 -1,-0.2 0.276 115.3 121.5 80.7 -9.7 -23.9 50.7 57.8 47 47 A V B < -L 44 0G 55 -3,-1.0 -3,-2.8 -5,-0.1 -1,-0.2 -0.774 64.0-123.9 -95.7 121.7 -25.5 49.9 61.3 48 48 A K - 0 0 105 -2,-0.5 29,-1.2 -5,-0.2 2,-0.2 -0.281 19.4-123.1 -67.4 140.0 -23.7 47.2 63.3 49 49 A P - 0 0 4 0, 0.0 2,-0.9 0, 0.0 30,-0.2 -0.527 26.7-112.3 -70.9 149.4 -25.6 44.2 64.5 50 50 A L E -m 79 0H 12 28,-2.5 30,-2.4 -2,-0.2 2,-0.7 -0.779 36.7-163.2 -78.5 109.9 -25.6 43.5 68.2 51 51 A I E -m 80 0H 22 -2,-0.9 30,-0.1 28,-0.2 4,-0.1 -0.865 14.9-172.9-103.2 112.2 -23.6 40.3 68.3 52 52 A L E > - 0 0 0 28,-2.1 3,-1.8 -2,-0.7 2,-0.2 0.753 16.7-174.3 -73.1 -23.8 -24.0 38.5 71.6 53 53 A R E 3 S-m 81 0H 126 27,-0.5 29,-0.7 1,-0.3 -1,-0.2 -0.477 73.5 -6.7 62.9-129.6 -21.3 35.9 70.8 54 54 A D T 3 S+ 0 0 69 -2,-0.2 33,-1.0 31,-0.1 -1,-0.3 0.727 122.3 88.1 -70.7 -22.0 -21.3 33.3 73.6 55 55 A c B < -o 87 0I 4 -3,-1.8 27,-0.4 31,-0.1 2,-0.3 -0.299 67.8-141.2 -73.4 162.6 -23.8 35.4 75.7 56 56 A S > - 0 0 2 31,-1.1 4,-3.3 25,-0.1 5,-0.3 -0.842 31.6 -99.2-123.0 161.8 -27.7 35.1 75.4 57 57 A V H > S+ 0 0 0 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.877 128.7 45.9 -48.6 -40.8 -30.5 37.6 75.5 58 58 A A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.5 0.968 111.1 50.1 -64.5 -55.5 -31.0 36.5 79.1 59 59 A G H >>S+ 0 0 0 1,-0.2 5,-3.4 28,-0.2 4,-1.0 0.917 116.5 44.4 -46.2 -49.5 -27.3 36.6 80.0 60 60 A W H <5S+ 0 0 4 -4,-3.3 -2,-0.2 3,-0.2 -1,-0.2 0.956 115.9 43.5 -61.9 -54.4 -27.2 40.1 78.5 61 61 A L H <5S+ 0 0 0 -4,-2.8 -2,-0.2 -5,-0.3 -1,-0.2 0.837 117.6 42.6 -72.8 -36.3 -30.4 41.6 80.0 62 62 A L H <5S- 0 0 0 -4,-2.8 84,-2.1 -5,-0.2 85,-0.4 0.734 116.0-117.5 -73.6 -23.2 -29.9 40.3 83.6 63 63 A G T <5 - 0 0 8 -4,-1.0 82,-3.8 -5,-0.5 -3,-0.2 0.932 29.3-155.9 82.7 53.6 -26.3 41.3 83.3 64 64 A N > < - 0 0 2 -5,-3.4 3,-2.0 80,-0.3 80,-0.1 -0.369 23.8-121.6 -51.5 137.0 -24.4 38.0 83.6 65 65 A P G > S+ 0 0 1 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.787 112.5 53.6 -59.1 -30.0 -20.9 38.8 84.9 66 66 A M G 3 S+ 0 0 111 1,-0.2 3,-0.2 2,-0.1 -11,-0.1 0.343 97.2 67.9 -87.8 7.0 -19.3 37.2 81.9 67 67 A c G X + 0 0 4 -3,-2.0 3,-1.2 -8,-0.2 -1,-0.2 -0.205 59.9 127.1-111.9 37.6 -21.5 39.3 79.5 68 68 A D G X + 0 0 51 -3,-0.6 3,-1.5 1,-0.3 -1,-0.1 0.777 59.5 71.3 -67.4 -28.7 -19.7 42.5 80.6 69 69 A E G 3 S+ 0 0 122 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.822 95.3 56.7 -49.3 -33.9 -19.0 43.3 76.9 70 70 A F G X + 0 0 7 -3,-1.2 3,-0.8 -18,-0.1 -1,-0.3 0.131 70.0 121.5-102.2 19.9 -22.7 44.0 76.6 71 71 A I T < S- 0 0 75 -3,-1.5 -10,-0.0 1,-0.2 -11,-0.0 -0.588 91.6 -1.7 -70.1 144.4 -23.3 46.7 79.2 72 72 A N T 3 S- 0 0 107 -2,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.762 88.3-170.4 39.8 42.3 -24.7 49.9 77.6 73 73 A V < - 0 0 16 -3,-0.8 38,-0.4 1,-0.1 -1,-0.1 -0.312 19.6-118.1 -58.5 139.3 -24.6 48.4 74.1 74 74 A P - 0 0 101 0, 0.0 37,-0.1 0, 0.0 -1,-0.1 -0.159 47.6 -57.3 -73.3 172.6 -25.3 51.0 71.3 75 75 A E - 0 0 82 35,-0.1 2,-0.3 1,-0.1 35,-0.2 -0.119 60.3-156.9 -42.2 138.4 -28.1 51.0 68.8 76 76 A W - 0 0 2 33,-2.8 3,-0.1 1,-0.1 -28,-0.1 -0.864 25.5-150.3-125.8 158.6 -28.3 47.8 66.7 77 77 A S S S- 0 0 10 -29,-1.2 2,-0.3 1,-0.5 -1,-0.1 0.849 86.1 -15.4 -90.6 -47.8 -29.7 46.9 63.3 78 78 A Y - 0 0 0 184,-0.2 -28,-2.5 -30,-0.1 -1,-0.5 -0.948 69.5-118.1-148.6 165.5 -30.3 43.3 64.2 79 79 A I E -mn 50 264H 0 184,-2.8 186,-2.9 -2,-0.3 2,-0.5 -0.863 17.0-154.7-110.6 145.9 -29.2 40.9 67.0 80 80 A V E +mn 51 265H 3 -30,-2.4 -28,-2.1 -2,-0.3 -27,-0.5 -0.977 16.3 173.4-125.3 122.3 -27.3 37.7 66.6 81 81 A E E -mn 53 266H 4 184,-2.4 186,-1.1 -2,-0.5 -25,-0.1 -0.975 27.5-122.0-128.9 137.5 -27.5 34.8 69.1 82 82 A K - 0 0 40 -29,-0.7 186,-0.1 -27,-0.4 -28,-0.0 -0.149 25.8-112.4 -67.7 169.7 -26.0 31.4 68.9 83 83 A A S S+ 0 0 51 1,-0.2 -1,-0.1 183,-0.1 185,-0.1 0.882 110.8 14.5 -71.4 -40.4 -28.0 28.1 69.1 84 84 A N S S- 0 0 147 4,-0.0 -1,-0.2 -28,-0.0 4,-0.1 -0.512 80.2-168.1-135.7 66.9 -26.6 27.1 72.5 85 85 A P - 0 0 23 0, 0.0 3,-0.1 0, 0.0 -30,-0.1 -0.340 14.1-147.5 -60.7 132.1 -24.8 30.1 74.0 86 86 A V S S+ 0 0 111 1,-0.2 2,-1.7 -31,-0.1 -31,-0.1 0.908 86.4 64.6 -68.9 -43.0 -22.7 29.0 77.1 87 87 A N B S+o 55 0I 34 -33,-1.0 -31,-1.1 -21,-0.1 -1,-0.2 -0.571 73.2 117.6 -86.9 77.8 -23.1 32.2 79.1 88 88 A D S S- 0 0 57 -2,-1.7 2,-1.3 -33,-0.2 3,-0.1 0.290 80.8 -7.7-104.8-129.6 -26.9 32.1 79.8 89 89 A L - 0 0 32 1,-0.2 -1,-0.2 4,-0.1 4,-0.1 -0.656 65.5-174.5 -68.8 94.8 -28.5 31.8 83.3 90 90 A d S S+ 0 0 11 -2,-1.3 -1,-0.2 1,-0.1 -2,-0.0 0.941 78.3 52.0 -62.9 -48.5 -25.2 31.2 85.2 91 91 A Y S S- 0 0 7 -3,-0.1 135,-0.2 1,-0.1 -1,-0.1 -0.822 111.0-110.9 -84.3 118.1 -27.2 30.6 88.4 92 92 A P + 0 0 6 0, 0.0 134,-1.6 0, 0.0 2,-0.3 -0.006 67.6 92.3 -57.5 153.2 -29.8 28.0 87.3 93 93 A G E -p 226 0J 21 132,-0.3 2,-0.3 -4,-0.1 134,-0.2 -0.935 65.9 -69.4 170.0-144.3 -33.4 28.8 87.0 94 94 A D E -p 227 0J 99 132,-1.6 134,-2.1 -2,-0.3 2,-0.5 -0.954 22.0-138.8-140.6 158.0 -36.1 30.0 84.5 95 95 A F E > -p 228 0J 18 -2,-0.3 3,-1.1 132,-0.2 134,-0.2 -0.968 33.2-129.6-119.7 108.7 -36.8 33.3 82.7 96 96 A N T 3 S- 0 0 57 132,-2.8 134,-0.1 -2,-0.5 5,-0.1 -0.332 83.3 -3.2 -66.5 136.7 -40.5 33.8 82.8 97 97 A D T 3> S+ 0 0 94 1,-0.1 4,-1.4 3,-0.1 -1,-0.3 0.865 83.5 159.1 48.8 44.2 -42.2 34.6 79.5 98 98 A Y H <> + 0 0 29 -3,-1.1 4,-2.9 1,-0.2 5,-0.2 0.878 67.3 48.8 -63.7 -41.2 -38.8 34.6 77.9 99 99 A E H > S+ 0 0 39 1,-0.2 4,-2.2 2,-0.2 292,-0.2 0.855 108.7 52.7 -73.2 -35.7 -40.0 34.0 74.3 100 100 A E H > S+ 0 0 122 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.823 112.3 47.7 -66.0 -30.7 -42.6 36.8 74.6 101 101 A L H X S+ 0 0 3 -4,-1.4 4,-1.5 2,-0.2 3,-0.3 0.934 109.3 50.9 -75.0 -48.4 -39.8 39.1 75.7 102 102 A K H X S+ 0 0 12 -4,-2.9 4,-0.7 1,-0.2 3,-0.2 0.885 108.9 53.8 -53.7 -40.2 -37.5 38.0 72.9 103 103 A H H >< S+ 0 0 91 -4,-2.2 3,-0.8 1,-0.2 4,-0.3 0.868 102.7 56.7 -62.0 -36.8 -40.4 38.7 70.5 104 104 A L H >< S+ 0 0 62 -4,-1.2 3,-1.5 -3,-0.3 -1,-0.2 0.856 100.3 60.0 -61.5 -35.5 -40.6 42.2 72.0 105 105 A L H >< S+ 0 0 1 -4,-1.5 3,-1.7 1,-0.3 -1,-0.2 0.691 87.1 71.4 -67.3 -25.2 -37.0 42.8 71.0 106 106 A S T << S+ 0 0 26 -3,-0.8 156,-1.3 -4,-0.7 -1,-0.3 0.685 101.1 48.3 -63.6 -17.3 -37.7 42.2 67.4 107 107 A R T < S+ 0 0 190 -3,-1.5 153,-2.5 -4,-0.3 2,-0.4 0.299 102.9 82.2 -98.4 5.6 -39.4 45.6 67.7 108 108 A I E < +Q 259 0J 7 -3,-1.7 151,-0.2 151,-0.3 155,-0.1 -0.941 39.5 170.3-123.7 134.6 -36.5 47.3 69.5 109 109 A N E S+ 0 0 15 149,-2.1 -33,-2.8 -2,-0.4 2,-0.3 0.605 71.3 25.3-110.0 -20.2 -33.2 48.8 68.2 110 110 A H E -Q 258 0J 43 148,-1.4 147,-1.3 -35,-0.2 148,-1.1 -0.951 51.8-168.1-154.7 131.4 -31.8 50.5 71.3 111 111 A F E -Q 256 0J 9 -38,-0.4 2,-0.5 -2,-0.3 145,-0.2 -0.883 9.9-156.9-106.3 146.4 -31.9 50.3 75.0 112 112 A E E -Q 255 0J 83 143,-2.5 143,-2.6 -2,-0.4 2,-0.2 -0.962 20.8-139.5-122.0 110.1 -30.6 53.0 77.4 113 113 A K E +Q 254 0J 20 -2,-0.5 2,-0.3 141,-0.2 141,-0.2 -0.504 26.3 175.7 -72.7 129.4 -29.8 51.4 80.8 114 114 A I E -Q 253 0J 40 139,-2.4 139,-3.2 -2,-0.2 2,-0.5 -0.993 31.9-115.9-136.3 151.8 -30.7 53.4 83.9 115 115 A Q E +Q 252 0J 91 -2,-0.3 137,-0.3 137,-0.3 136,-0.0 -0.685 32.0 168.2 -85.5 119.7 -30.5 52.9 87.7 116 116 A I S S+ 0 0 18 135,-1.8 136,-0.2 -2,-0.5 -1,-0.2 0.779 74.8 28.7-100.5 -36.1 -33.9 52.9 89.3 117 117 A I S S- 0 0 9 134,-1.7 -1,-0.3 47,-0.1 2,-0.1 -0.950 83.8-136.2-127.5 111.9 -33.0 51.5 92.8 118 118 A P - 0 0 37 0, 0.0 3,-0.5 0, 0.0 4,-0.3 -0.373 9.7-135.2 -65.4 141.6 -29.4 52.2 94.0 119 119 A K S > S+ 0 0 94 1,-0.2 3,-1.3 2,-0.2 8,-0.1 0.863 106.9 59.8 -63.8 -36.2 -27.5 49.3 95.6 120 120 A S T 3 S+ 0 0 106 1,-0.2 -1,-0.2 7,-0.0 7,-0.1 0.860 90.2 72.5 -56.3 -37.6 -26.5 51.8 98.3 121 121 A S T 3 + 0 0 48 -3,-0.5 2,-2.3 1,-0.2 3,-0.3 0.628 68.7 91.1 -60.9 -17.9 -30.1 52.4 99.3 122 122 A W X + 0 0 9 -3,-1.3 3,-0.7 -4,-0.3 -1,-0.2 -0.431 47.1 153.4 -80.7 71.2 -30.7 49.0 100.9 123 123 A S T 3 + 0 0 84 -2,-2.3 -1,-0.2 1,-0.2 -2,-0.1 0.851 67.7 46.7 -70.9 -36.8 -29.7 50.3 104.4 124 124 A S T 3 S+ 0 0 66 -3,-0.3 29,-0.4 2,-0.1 2,-0.3 0.434 114.0 50.4 -89.0 -1.7 -31.8 47.8 106.4 125 125 A H S < S- 0 0 12 -3,-0.7 2,-0.5 27,-0.1 27,-0.2 -0.924 89.4-105.7-131.0 158.1 -30.6 44.7 104.5 126 126 A E B +V 151 0K 51 25,-2.1 25,-2.4 -2,-0.3 -3,-0.1 -0.753 38.3 170.6 -82.6 126.2 -27.3 43.3 103.3 127 127 A A + 0 0 12 -2,-0.5 22,-0.2 23,-0.2 3,-0.1 0.432 64.5 59.2-115.8 -2.2 -26.9 44.0 99.6 128 128 A S S S+ 0 0 78 1,-0.1 -1,-0.1 20,-0.1 22,-0.1 0.337 92.1 61.8-117.9 5.8 -23.3 43.0 98.9 129 129 A L S S+ 0 0 104 20,-0.2 2,-1.8 1,-0.1 -1,-0.1 0.247 70.4 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