==== 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 12-JUN-09 3HTQ . COMPND 2 MOLECULE: HEMAGGLUTININ; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS (A/WDK/JX/12416/2005 . AUTHOR G.WANG,A.LI,Q.ZHANG,C.WU,R.ZHANG,Q.CAI,W.SONG,K.-Y.YUEN . 484 2 6 5 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23147.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 311 64.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 94 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 . 9 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 49 10.1 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 . 88 18.2 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 2 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 4 2 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 . 4 7 4 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 . 4 2 2 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 5 A D 0 0 36 0, 0.0 464,-1.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 120.3 74.5 95.2 66.6 2 6 A T E -AB 352 464A 27 350,-2.1 350,-2.3 462,-0.2 2,-0.4 -0.973 360.0-161.0-139.1 151.4 72.5 92.0 66.3 3 7 A I E -AB 351 463A 1 460,-2.4 460,-2.9 -2,-0.3 2,-0.4 -0.998 11.6-169.0-131.0 135.1 72.0 89.2 63.9 4 8 A a E -AB 350 462A 12 346,-2.2 346,-1.6 -2,-0.4 2,-0.5 -0.980 14.3-144.0-126.8 140.4 69.0 86.9 63.8 5 9 A I E +A 349 0A 2 456,-2.7 344,-0.3 -2,-0.4 2,-0.2 -0.865 38.4 148.2-101.8 133.1 68.4 83.7 61.9 6 10 A G E -A 348 0A 0 342,-3.1 342,-2.9 -2,-0.5 2,-0.3 -0.776 35.9-103.8-146.4-167.4 64.8 83.2 60.8 7 11 A Y E -A 347 0A 0 330,-0.4 332,-3.5 340,-0.3 340,-0.3 -0.946 34.4 -91.2-135.4 154.1 62.6 81.8 58.1 8 12 A H B +e 339 0B 18 338,-3.3 313,-0.3 -2,-0.3 2,-0.3 -0.008 36.6 176.5 -57.7 157.6 60.5 82.9 55.1 9 13 A A + 0 0 1 330,-1.0 2,-0.2 333,-0.5 311,-0.1 -0.961 4.6 163.7-160.4 148.5 56.8 83.9 55.2 10 14 A N - 0 0 23 -2,-0.3 330,-0.1 2,-0.1 328,-0.1 -0.814 52.2 -76.5-151.8-166.5 54.4 85.2 52.6 11 15 A N S S+ 0 0 154 -2,-0.2 16,-0.0 329,-0.1 309,-0.0 0.290 75.8 134.3 -87.2 9.7 50.7 85.9 51.7 12 16 A S - 0 0 19 1,-0.1 -2,-0.1 15,-0.1 16,-0.1 -0.238 33.0-177.6 -62.0 146.7 50.0 82.3 50.9 13 17 A T + 0 0 113 14,-0.1 -1,-0.1 12,-0.1 14,-0.1 0.245 36.9 131.5-126.4 7.8 46.8 80.7 52.2 14 18 A D - 0 0 61 12,-0.4 12,-2.4 13,-0.1 2,-0.4 -0.346 41.4-159.8 -59.3 143.3 47.4 77.2 50.8 15 19 A T E -F 25 0C 30 10,-0.3 2,-0.3 12,-0.0 10,-0.2 -0.993 11.8-172.8-133.2 138.9 46.8 74.7 53.6 16 20 A V E -F 24 0C 0 8,-2.1 8,-2.6 -2,-0.4 2,-0.4 -0.754 21.6-123.2-120.7 169.7 47.9 71.1 54.0 17 21 A D - 0 0 43 296,-0.5 2,-0.3 -2,-0.3 5,-0.2 -0.903 24.6-166.9-115.0 144.7 47.0 68.5 56.5 18 22 A T - 0 0 5 3,-3.7 409,-0.2 -2,-0.4 408,-0.2 -0.842 38.7-102.0-126.5 164.9 49.6 66.7 58.6 19 23 A V S S+ 0 0 71 407,-1.4 408,-0.1 -2,-0.3 3,-0.1 0.830 124.6 30.3 -54.9 -32.4 49.5 63.6 60.8 20 24 A L S S+ 0 0 136 406,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.742 124.7 36.0 -99.9 -27.2 49.4 65.9 63.9 21 25 A E - 0 0 95 3,-0.0 -3,-3.7 0, 0.0 2,-0.3 -0.973 62.2-141.7-135.1 147.4 47.5 68.9 62.6 22 26 A K S S+ 0 0 167 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.0 -0.801 80.5 7.0-104.5 143.9 44.8 69.9 60.2 23 27 A N S S+ 0 0 100 -2,-0.3 2,-0.7 1,-0.2 -1,-0.2 0.924 70.3 179.6 55.4 54.9 44.8 72.9 57.9 24 28 A V E -F 16 0C 7 -8,-2.6 -8,-2.1 -3,-0.3 2,-0.4 -0.785 28.1-130.8 -85.4 117.0 48.3 74.1 58.5 25 29 A T E -F 15 0C 52 -2,-0.7 295,-3.1 -10,-0.2 2,-0.3 -0.570 33.0-172.1 -70.4 126.2 48.8 77.2 56.3 26 30 A V B -G 319 0D 0 -12,-2.4 -12,-0.4 -2,-0.4 293,-0.2 -0.900 31.2-127.7-125.9 152.8 52.0 76.8 54.4 27 31 A T S S+ 0 0 4 291,-2.7 2,-0.3 -2,-0.3 -13,-0.1 0.816 93.4 13.8 -65.2 -37.1 54.1 79.1 52.1 28 32 A H S S+ 0 0 68 290,-0.2 289,-3.8 -16,-0.1 288,-2.8 -0.973 70.3 167.1-145.8 127.8 54.4 76.8 49.1 29 33 A S E -H 315 0E 18 -2,-0.3 2,-0.3 286,-0.3 286,-0.2 -0.760 20.4-143.9-131.6 177.0 52.5 73.6 48.4 30 34 A V E -H 314 0E 46 284,-2.3 284,-3.7 -2,-0.2 2,-0.5 -0.994 17.2-128.3-143.3 142.2 52.0 71.3 45.4 31 35 A N E -H 313 0E 45 -2,-0.3 282,-0.2 282,-0.2 280,-0.0 -0.825 19.5-179.7 -98.8 132.3 48.9 69.4 44.4 32 36 A L + 0 0 0 280,-2.3 260,-1.3 -2,-0.5 2,-0.5 0.352 61.6 83.2-105.3 1.6 49.1 65.6 43.8 33 37 A L E -i 292 0F 1 279,-0.3 2,-0.5 258,-0.1 260,-0.2 -0.925 65.4-147.5-115.3 131.2 45.5 65.2 42.9 34 38 A E E +i 293 0F 20 258,-2.3 260,-2.0 -2,-0.5 261,-0.3 -0.827 30.5 153.7 -95.4 124.7 43.9 65.8 39.5 35 39 A D + 0 0 67 -2,-0.5 2,-0.2 258,-0.2 -1,-0.1 0.113 48.5 85.8-135.9 21.8 40.3 67.0 39.6 36 40 A N + 0 0 102 251,-0.1 251,-0.3 248,-0.0 2,-0.2 -0.679 44.9 174.8-115.8 172.4 40.0 68.9 36.3 37 41 A H - 0 0 78 -2,-0.2 249,-0.2 249,-0.1 0, 0.0 -0.802 40.6-120.2-177.6 134.5 39.2 67.7 32.8 38 42 A N - 0 0 68 247,-1.0 246,-0.1 -2,-0.2 3,-0.1 0.366 43.9-127.7 -64.7 9.1 38.7 69.5 29.4 39 43 A G S S+ 0 0 26 246,-0.3 2,-0.3 1,-0.2 245,-0.2 0.799 73.0 114.8 47.6 32.4 35.2 68.1 29.3 40 44 A K S S- 0 0 83 230,-0.1 245,-1.0 245,-0.1 2,-0.8 -0.979 72.0-125.3-133.2 145.2 36.0 66.8 25.8 41 45 A L E -k 272 0G 1 230,-3.7 232,-1.8 -2,-0.3 234,-0.2 -0.816 47.1-174.6 -88.3 112.5 36.4 63.3 24.3 42 46 A b E - 0 0 0 -2,-0.8 234,-0.2 230,-0.2 2,-0.2 -0.361 30.8 -78.9-103.5-176.8 39.9 63.5 22.8 43 47 A K E -k 276 0G 43 232,-3.5 2,-0.7 230,-0.2 234,-0.5 -0.570 42.6-134.7 -78.7 144.8 42.2 61.5 20.7 44 48 A L E S-k 277 0G 4 3,-1.9 3,-0.4 -2,-0.2 234,-0.2 -0.885 81.9 -18.1-109.8 102.7 44.0 58.8 22.7 45 49 A N S S- 0 0 79 232,-2.0 -1,-0.2 -2,-0.7 233,-0.1 0.880 130.6 -50.1 70.6 39.4 47.7 58.7 21.9 46 50 A G S S+ 0 0 34 231,-0.2 2,-0.5 -3,-0.2 -1,-0.2 0.532 117.3 108.4 78.7 7.4 47.2 60.6 18.7 47 51 A I - 0 0 82 -3,-0.4 -3,-1.9 28,-0.1 30,-0.4 -0.941 65.0-132.6-122.5 112.6 44.3 58.4 17.4 48 52 A A - 0 0 48 -2,-0.5 29,-1.2 -5,-0.2 30,-0.2 -0.063 25.2-117.1 -55.4 159.3 40.8 59.7 17.3 49 53 A P - 0 0 17 0, 0.0 2,-0.6 0, 0.0 27,-0.2 -0.293 25.8-102.2 -90.1-178.9 38.0 57.5 18.7 50 54 A L E -l 79 0H 15 28,-2.1 30,-2.9 25,-0.1 2,-0.4 -0.933 30.7-151.7-110.2 117.0 35.0 56.1 16.8 51 55 A Q E +l 80 0H 108 -2,-0.6 30,-0.1 28,-0.2 22,-0.1 -0.707 21.1 171.8 -89.1 137.0 31.7 57.9 17.4 52 56 A L E > + 0 0 8 28,-1.5 3,-2.1 -2,-0.4 2,-0.3 0.658 15.1 171.0-112.4 -28.7 28.5 55.9 17.1 53 57 A G E 3 S+l 81 0H 26 27,-0.5 29,-0.7 1,-0.3 31,-0.3 -0.361 74.7 11.6 58.7-116.0 26.0 58.5 18.3 54 58 A K T 3 S+ 0 0 107 -2,-0.3 33,-2.2 31,-0.2 32,-1.1 0.837 125.1 72.1 -62.3 -33.1 22.5 57.3 17.7 55 59 A c B < -n 87 0I 0 -3,-2.1 27,-0.3 30,-0.2 2,-0.2 -0.493 69.5-151.3 -87.0 154.6 23.9 53.8 16.9 56 60 A N > - 0 0 25 31,-1.4 4,-2.7 -2,-0.2 5,-0.2 -0.599 39.8 -86.7-112.8 176.6 25.3 51.3 19.3 57 61 A V H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.910 126.7 47.5 -53.0 -51.0 28.0 48.7 18.7 58 62 A A H > S+ 0 0 4 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.917 113.1 50.2 -58.0 -44.4 25.6 46.0 17.5 59 63 A G H >>S+ 0 0 0 2,-0.2 5,-2.5 1,-0.2 4,-1.9 0.937 111.5 48.2 -59.4 -48.3 23.8 48.5 15.2 60 64 A W H <5S+ 0 0 3 -4,-2.7 -2,-0.2 3,-0.2 -1,-0.2 0.963 116.8 40.0 -57.6 -56.6 27.1 49.6 13.7 61 65 A L H <5S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.878 116.7 48.3 -63.2 -42.9 28.5 46.1 13.0 62 66 A L H <5S- 0 0 1 -4,-2.5 85,-1.7 -5,-0.3 86,-0.4 0.805 114.3-112.2 -69.6 -30.4 25.3 44.5 11.8 63 67 A G T <5 - 0 0 1 -4,-1.9 83,-2.3 -5,-0.3 -3,-0.2 0.848 36.6-165.8 98.8 45.0 24.4 47.3 9.4 64 68 A N > < - 0 0 6 -5,-2.5 3,-3.2 81,-0.2 -1,-0.1 -0.462 30.8-118.9 -64.4 133.3 21.4 48.9 11.0 65 69 A P T 3 S+ 0 0 2 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.429 113.4 57.9 -54.3 0.6 19.7 51.3 8.4 66 70 A E T 3 S+ 0 0 70 22,-0.1 3,-0.3 1,-0.1 -11,-0.1 0.462 95.1 62.3-109.7 -6.2 20.4 54.1 10.8 67 71 A c X + 0 0 2 -3,-3.2 3,-1.6 -8,-0.2 4,-0.1 -0.041 60.2 125.3-107.9 28.6 24.1 53.7 11.0 68 72 A D G > + 0 0 47 1,-0.3 3,-1.1 -3,-0.2 -1,-0.2 0.790 69.6 61.0 -57.7 -27.7 24.7 54.4 7.3 69 73 A L G > S+ 0 0 152 -3,-0.3 3,-0.5 1,-0.2 -1,-0.3 0.720 97.4 57.1 -73.1 -21.7 27.2 57.1 8.4 70 74 A L G X S+ 0 0 20 -3,-1.6 3,-0.8 1,-0.2 -1,-0.2 0.281 76.3 98.4 -92.3 10.0 29.5 54.6 10.2 71 75 A L G < S+ 0 0 50 -3,-1.1 -1,-0.2 1,-0.2 42,-0.2 0.506 85.8 46.2 -76.0 -3.1 29.9 52.5 7.0 72 76 A T G < S+ 0 0 123 -3,-0.5 -1,-0.2 40,-0.1 -2,-0.1 0.407 80.9 149.2-114.9 -4.3 33.3 54.2 6.4 73 77 A A < + 0 0 14 -3,-0.8 2,-0.3 -22,-0.1 40,-0.1 0.113 18.3 165.4 -32.5 136.6 34.6 53.9 10.0 74 78 A N + 0 0 88 36,-0.1 2,-0.8 38,-0.1 36,-0.1 -0.982 42.3 0.3-160.9 150.7 38.4 53.6 10.2 75 79 A S + 0 0 59 -2,-0.3 33,-0.4 34,-0.2 -25,-0.1 -0.648 66.0 160.2 78.2-106.0 41.3 53.8 12.6 76 80 A W - 0 0 4 -2,-0.8 32,-1.5 -27,-0.2 -28,-0.1 0.776 34.7-151.3 52.2 132.8 39.9 54.6 16.1 77 81 A S S S+ 0 0 7 -29,-1.2 2,-0.3 -30,-0.4 187,-0.2 0.601 80.7 0.6-101.6 -22.2 41.6 54.0 19.5 78 82 A Y S S- 0 0 0 -30,-0.2 -28,-2.1 185,-0.1 -1,-0.4 -0.950 77.7-109.7-163.1 155.5 38.5 53.6 21.6 79 83 A I E -lm 50 265H 0 185,-2.1 187,-1.9 -2,-0.3 2,-0.5 -0.764 21.5-151.1-101.0 141.6 34.7 53.5 20.9 80 84 A I E -lm 51 266H 4 -30,-2.9 -28,-1.5 -2,-0.4 -27,-0.5 -0.941 12.1-177.0-113.3 121.3 32.2 56.2 22.0 81 85 A E E -lm 53 267H 23 185,-2.3 187,-1.7 -2,-0.5 2,-0.2 -0.821 13.5-147.7-111.9 155.8 28.6 55.4 22.7 82 86 A T > - 0 0 31 -29,-0.7 3,-2.0 -2,-0.3 187,-0.1 -0.631 35.3 -99.5-116.9 173.3 26.0 58.1 23.7 83 87 A S T 3 S+ 0 0 74 1,-0.3 -29,-0.1 -2,-0.2 186,-0.0 0.356 127.2 56.0 -73.9 10.9 22.9 58.3 25.8 84 88 A N T 3 + 0 0 89 -31,-0.3 2,-2.4 -29,-0.1 3,-0.4 0.159 66.9 120.5-124.5 12.9 21.3 57.9 22.4 85 89 A S < + 0 0 23 -3,-2.0 -30,-0.2 1,-0.2 -31,-0.2 -0.451 33.3 120.1 -79.9 70.0 23.0 54.6 21.4 86 90 A E + 0 0 168 -2,-2.4 2,-1.2 -32,-1.1 -1,-0.2 0.437 40.6 95.9-111.3 -3.6 19.6 52.9 21.0 87 91 A N B +n 55 0I 43 -33,-2.2 -31,-1.4 -3,-0.4 -23,-0.2 -0.701 54.9 105.8 -94.5 90.0 19.9 51.9 17.3 88 92 A G S S+ 0 0 8 -2,-1.2 2,-2.3 -33,-0.2 -22,-0.1 0.223 73.7 14.1-127.4-113.5 21.2 48.4 17.2 89 93 A T - 0 0 42 1,-0.2 4,-0.1 4,-0.1 -1,-0.1 -0.473 61.1-177.6 -74.2 78.2 19.6 45.0 16.5 90 94 A d S S+ 0 0 7 -2,-2.3 -1,-0.2 1,-0.1 47,-0.1 0.730 71.9 63.9 -49.2 -24.7 16.4 46.5 15.0 91 95 A Y S S- 0 0 4 -3,-0.1 136,-0.3 45,-0.1 -1,-0.1 -0.893 103.3-107.7-108.0 109.0 15.2 42.9 14.6 92 96 A P + 0 0 9 0, 0.0 135,-3.1 0, 0.0 2,-0.3 0.191 65.8 97.1 -33.9 138.1 14.8 41.2 18.0 93 97 A G - 0 0 29 133,-0.3 2,-0.4 -4,-0.1 135,-0.2 -0.901 68.8 -70.0 158.8 175.6 17.2 38.5 19.1 94 98 A E - 0 0 131 -2,-0.3 135,-2.4 1,-0.0 2,-1.2 -0.809 28.9-144.2-101.0 132.5 20.3 37.7 21.1 95 99 A F B > -o 229 0J 20 -2,-0.4 3,-1.7 133,-0.2 4,-0.2 -0.712 29.3-135.4 -94.5 86.1 23.8 38.9 20.1 96 100 A I T 3 S- 0 0 23 133,-1.4 135,-0.2 -2,-1.2 5,-0.1 -0.120 80.9 -3.8 -47.5 127.8 25.9 35.9 21.1 97 101 A D T 3> S+ 0 0 106 3,-0.1 4,-2.0 133,-0.1 -1,-0.3 0.824 85.9 154.1 55.2 38.1 29.1 36.9 22.9 98 102 A Y H <> + 0 0 35 -3,-1.7 4,-3.2 2,-0.2 3,-0.3 0.954 68.3 48.8 -60.0 -56.8 28.3 40.5 22.4 99 103 A E H > S+ 0 0 49 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.919 111.5 53.4 -50.1 -44.4 30.2 41.9 25.4 100 104 A E H > S+ 0 0 108 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.897 110.6 45.5 -59.2 -41.3 33.1 39.8 24.2 101 105 A L H X S+ 0 0 2 -4,-2.0 4,-1.9 -3,-0.3 -2,-0.2 0.954 110.1 53.6 -68.5 -48.0 32.9 41.3 20.7 102 106 A R H < S+ 0 0 12 -4,-3.2 3,-0.3 1,-0.2 -2,-0.2 0.923 112.9 45.3 -50.7 -47.3 32.6 44.9 22.0 103 107 A E H >< S+ 0 0 50 -4,-2.6 3,-1.3 -5,-0.3 4,-0.3 0.907 111.1 50.5 -64.2 -45.6 35.7 44.3 24.1 104 108 A Q H 3< S+ 0 0 59 -4,-2.3 3,-0.3 1,-0.3 -1,-0.2 0.739 112.7 47.0 -67.6 -22.5 37.7 42.7 21.3 105 109 A L T 3< S+ 0 0 2 -4,-1.9 -1,-0.3 -3,-0.3 -2,-0.2 0.287 78.3 109.8-101.1 9.0 37.0 45.5 18.9 106 110 A S S < S+ 0 0 1 -3,-1.3 2,-0.4 157,-0.2 158,-0.3 0.876 87.0 25.4 -48.1 -47.5 37.8 48.2 21.4 107 111 A S S S+ 0 0 28 -3,-0.3 2,-0.4 -4,-0.3 153,-0.2 -0.970 70.6 178.2-124.6 137.7 40.9 49.2 19.5 108 112 A V - 0 0 5 -32,-1.5 151,-0.2 -33,-0.4 3,-0.1 -0.980 19.6-167.0-144.6 128.2 41.6 48.7 15.8 109 113 A S S S+ 0 0 81 149,-3.3 2,-0.4 -2,-0.4 150,-0.2 0.968 84.2 6.8 -73.4 -59.8 44.6 49.6 13.7 110 114 A S E -P 258 0J 22 148,-0.8 148,-2.3 -36,-0.1 2,-0.3 -0.954 65.8-177.6-126.3 147.0 43.0 49.0 10.2 111 115 A F E +P 257 0J 6 -2,-0.4 2,-0.4 146,-0.2 146,-0.2 -0.923 3.5 177.5-148.9 116.2 39.4 48.2 9.5 112 116 A E E -P 256 0J 91 144,-2.3 144,-3.3 -2,-0.3 2,-0.6 -0.983 18.4-147.6-127.8 127.2 38.1 47.5 6.0 113 117 A R E +P 255 0J 68 -2,-0.4 2,-0.3 142,-0.2 142,-0.2 -0.813 28.4 168.7 -93.6 123.9 34.5 46.6 5.1 114 118 A F E -P 254 0J 28 140,-2.9 140,-2.6 -2,-0.6 2,-1.0 -0.915 43.3-100.9-134.0 158.9 34.3 44.3 2.1 115 119 A E E +P 253 0J 80 -2,-0.3 138,-0.2 138,-0.2 32,-0.0 -0.692 38.2 173.3 -79.8 101.9 31.6 42.2 0.3 116 120 A I S S+ 0 0 11 -2,-1.0 -1,-0.2 136,-0.8 137,-0.2 0.880 81.1 17.0 -77.0 -38.1 32.4 38.6 1.5 117 121 A F S S- 0 0 4 135,-1.6 -1,-0.3 -3,-0.2 5,-0.1 -0.809 89.2-142.2-136.1 88.8 29.3 37.1 -0.1 118 122 A P - 0 0 48 0, 0.0 5,-0.2 0, 0.0 135,-0.1 -0.292 9.6-133.9 -58.6 131.4 27.8 39.5 -2.7 119 123 A K S > S+ 0 0 75 3,-0.1 4,-0.7 2,-0.1 3,-0.4 0.928 89.6 74.7 -46.9 -57.9 24.1 39.7 -2.9 120 124 A A T 4 S- 0 0 81 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.440 116.8 -9.8 -65.2 123.1 24.0 39.5 -6.7 121 125 A S T 4 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81.3 93.9 70.1 468 643 B K - 0 0 142 -2,-0.2 2,-0.5 -115,-0.0 -2,-0.1 -0.647 41.0-169.2 -80.1 133.8 80.7 96.1 67.1 469 644 B f - 0 0 0 -2,-0.4 -115,-0.1 -4,-0.1 -467,-0.1 -0.904 5.1-172.6-129.9 100.6 79.9 94.1 64.0 470 645 B D > - 0 0 91 -2,-0.5 4,-3.4 -117,-0.1 5,-0.3 -0.048 47.2 -79.2 -78.7-172.5 79.9 96.0 60.7 471 646 B D H > S+ 0 0 75 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.855 131.5 51.3 -62.2 -36.3 78.8 94.7 57.3 472 647 B E H > S+ 0 0 144 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.958 114.7 45.7 -64.5 -44.9 82.0 92.9 56.6 473 648 B f H > S+ 0 0 19 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.963 111.5 49.4 -59.2 -55.4 81.6 91.3 60.0 474 649 B M H X S+ 0 0 0 -4,-3.4 4,-1.4 1,-0.2 -1,-0.2 0.826 112.4 52.2 -54.4 -30.4 77.9 90.5 59.5 475 650 B E H X S+ 0 0 85 -4,-1.8 4,-2.5 -5,-0.3 3,-0.3 0.971 102.8 55.9 -69.4 -53.1 79.1 89.0 56.2 476 651 B S H <>S+ 0 0 19 -4,-2.9 5,-4.0 1,-0.3 6,-0.6 0.868 107.8 49.0 -47.0 -45.7 81.7 86.8 57.8 477 652 B V H ><5S+ 0 0 0 -4,-2.0 3,-1.1 4,-0.2 -1,-0.3 0.915 112.9 48.8 -64.6 -39.5 79.1 85.2 60.1 478 653 B K H 3<5S+ 0 0 36 -4,-1.4 2,-0.2 -3,-0.3 -2,-0.2 0.994 113.7 42.3 -63.7 -62.6 76.8 84.6 57.1 479 654 B N T 3<5S- 0 0 90 -4,-2.5 -1,-0.3 1,-0.1 -2,-0.2 0.159 120.7-112.3 -72.6 26.7 79.4 83.1 54.7 480 655 B G T < 5S+ 0 0 30 -3,-1.1 -3,-0.2 -2,-0.2 -4,-0.1 0.803 87.6 110.9 47.6 46.7 80.5 81.1 57.8 481 656 B T < + 0 0 84 -5,-4.0 -4,-0.2 -6,-0.2 -5,-0.1 0.016 36.9 157.3-134.1 28.3 84.0 82.7 58.4 482 657 B Y - 0 0 26 -6,-0.6 -9,-0.0 -5,-0.1 -8,-0.0 -0.291 38.1-116.4 -59.0 137.4 83.4 84.7 61.6 483 658 B D - 0 0 110 1,-0.2 -1,-0.1 -10,-0.0 -2,-0.0 0.022 55.7 -28.3 -74.3 176.0 86.7 85.4 63.5 484 659 B Y 0 0 182 1,-0.2 -1,-0.2 -30,-0.0 -34,-0.0 0.167 360.0 360.0 -25.7 107.2 88.2 84.6 66.9 485 660 B P 0 0 78 0, 0.0 -32,-0.9 0, 0.0 -31,-0.2 -0.130 360.0 360.0-106.1 360.0 85.3 84.0 69.3