==== 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 08-OCT-98 1HA0 . COMPND 2 MOLECULE: PROTEIN (HEMAGGLUTININ PRECURSOR); . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; . AUTHOR J.CHEN,K.HO LEE,D.A.STEINHAUER,D.J.STEVENS,J.J.SKEHEL,D.C.WI . 494 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23448.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 321 65.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 94 19.0 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 . 7 1.4 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 . 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 . 55 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 6.1 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 . 3 0.6 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 0 0 2 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 4 1 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 0 0 PARALLEL BRIDGES PER LADDER . 5 3 7 3 0 3 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 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 S 0 0 114 0, 0.0 2,-0.2 0, 0.0 489,-0.1 0.000 360.0 360.0 360.0 -50.3 79.5 48.9 -18.9 2 10 A T - 0 0 47 460,-0.2 463,-0.3 462,-0.1 2,-0.3 -0.436 360.0-146.1-122.0-163.4 78.1 51.5 -16.5 3 11 A A E -A 461 0A 3 458,-1.7 458,-1.9 -2,-0.2 2,-0.4 -0.918 15.3-124.8-158.0 172.2 75.1 52.4 -14.3 4 12 A T E -AB 460 348A 24 344,-2.7 344,-1.9 -2,-0.3 2,-0.4 -0.991 17.5-177.3-134.6 139.8 73.2 55.5 -13.3 5 13 A L E -AB 459 347A 0 454,-2.2 454,-2.4 -2,-0.4 2,-0.3 -0.889 7.8-169.6-141.4 104.8 72.3 56.8 -9.8 6 14 A a E -AB 458 346A 0 340,-3.1 340,-1.6 -2,-0.4 2,-0.4 -0.688 13.0-143.1 -94.5 148.4 70.2 59.9 -9.3 7 15 A L E + B 0 345A 0 450,-2.9 323,-2.5 -2,-0.3 2,-0.3 -0.885 33.8 164.6-106.4 140.0 69.7 61.8 -6.0 8 16 A G E - B 0 344A 0 336,-2.6 336,-1.8 -2,-0.4 2,-0.3 -0.921 34.3-135.5-152.1 178.9 66.3 63.2 -5.4 9 17 A H E - B 0 343A 18 324,-0.4 326,-2.7 -2,-0.3 334,-0.3 -0.989 35.1-106.2-137.7 144.6 63.5 64.8 -3.2 10 18 A H B -e 335 0B 18 332,-2.8 2,-0.3 -2,-0.3 326,-0.3 -0.006 28.4-168.0 -65.3 170.1 59.8 64.0 -3.1 11 19 A A - 0 0 5 324,-1.0 303,-0.1 323,-0.2 327,-0.1 -0.956 10.8-139.2-154.9 154.0 57.0 66.2 -4.5 12 20 A V - 0 0 37 -2,-0.3 3,-0.2 1,-0.1 324,-0.1 -0.808 15.9-127.6-118.2 161.0 53.2 66.1 -4.0 13 21 A P S S+ 0 0 99 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 0.978 102.0 36.4 -70.9 -54.1 50.4 66.7 -6.5 14 22 A N S S+ 0 0 155 15,-0.1 2,-0.1 2,-0.0 0, 0.0 -0.857 82.2 167.9-103.5 99.7 48.4 69.3 -4.4 15 23 A G - 0 0 29 -2,-0.8 2,-0.3 -3,-0.2 14,-0.2 -0.370 26.4-111.2-102.2-174.0 50.9 71.6 -2.6 16 24 A T E -F 28 0C 44 12,-2.3 12,-2.9 -2,-0.1 2,-0.4 -0.881 13.2-129.4-125.0 154.2 50.6 74.9 -0.7 17 25 A L E +F 27 0C 69 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.786 30.6 169.8-100.3 140.5 51.7 78.5 -1.2 18 26 A V E -F 26 0C 3 8,-1.7 8,-2.2 -2,-0.4 2,-0.2 -0.920 31.0-105.7-142.3 166.6 53.6 80.5 1.5 19 27 A K + 0 0 69 288,-0.4 5,-0.2 -2,-0.3 2,-0.2 -0.590 36.4 168.3 -94.9 156.7 55.5 83.8 1.9 20 28 A T - 0 0 14 3,-1.2 403,-0.2 -2,-0.2 402,-0.1 -0.808 53.0 -78.5-147.8-170.4 59.2 84.2 2.2 21 29 A I S S+ 0 0 107 401,-0.4 3,-0.1 -2,-0.2 402,-0.1 0.728 127.1 15.0 -71.7 -21.7 61.8 86.9 2.1 22 30 A T S S+ 0 0 119 1,-0.3 2,-0.5 400,-0.1 -1,-0.1 0.665 123.7 51.5-123.7 -31.0 61.7 87.2 -1.7 23 31 A D - 0 0 76 1,-0.1 -3,-1.2 3,-0.0 3,-0.3 -0.947 51.7-166.8-119.5 126.2 58.6 85.3 -2.9 24 32 A D S S+ 0 0 87 -2,-0.5 2,-0.6 1,-0.3 -1,-0.1 0.875 90.0 34.2 -73.6 -39.0 55.2 86.0 -1.6 25 33 A Q S S+ 0 0 87 -6,-0.1 2,-0.4 -8,-0.1 -1,-0.3 -0.866 74.5 151.7-123.3 94.0 53.7 82.9 -3.2 26 34 A I E -F 18 0C 18 -8,-2.2 -8,-1.7 -2,-0.6 2,-0.3 -0.996 40.9-122.3-124.3 128.3 56.2 80.0 -3.3 27 35 A E E +F 17 0C 35 -2,-0.4 287,-1.7 -10,-0.2 2,-0.3 -0.527 30.1 175.7 -79.7 133.2 54.9 76.4 -3.2 28 36 A V E -FG 16 313C 0 -12,-2.9 -12,-2.3 285,-0.3 285,-0.3 -0.775 43.1-110.5-124.2 165.7 56.0 73.9 -0.5 29 37 A T S S- 0 0 17 283,-2.5 2,-0.3 -2,-0.3 284,-0.1 0.475 95.4 -3.5 -79.1 0.5 54.8 70.3 0.0 30 38 A N - 0 0 86 282,-0.3 280,-2.1 281,-0.2 281,-0.4 -0.926 57.7-172.7 179.1 159.5 53.0 71.3 3.2 31 39 A A E -H 309 0D 15 278,-0.3 2,-0.4 -2,-0.3 278,-0.2 -0.975 16.4-139.1-164.3 147.2 52.2 74.1 5.7 32 40 A T E -H 308 0D 58 276,-2.6 276,-3.3 -2,-0.3 2,-0.1 -0.919 29.5-116.2-113.3 138.8 50.5 74.6 9.0 33 41 A E E -H 307 0D 44 -2,-0.4 274,-0.2 274,-0.2 3,-0.1 -0.412 23.4-172.3 -70.6 148.4 48.3 77.5 9.8 34 42 A L + 0 0 2 272,-1.8 252,-2.1 1,-0.1 2,-0.6 0.554 63.0 74.1-116.5 -15.0 49.4 79.9 12.4 35 43 A V E S-i 286 0E 1 271,-0.3 2,-0.6 250,-0.1 252,-0.3 -0.904 70.0-144.1-109.4 115.7 46.4 82.2 12.8 36 44 A Q E +i 287 0E 12 250,-2.3 252,-2.7 -2,-0.6 253,-0.4 -0.663 26.3 171.2 -74.7 115.8 43.3 80.9 14.6 37 45 A S + 0 0 72 -2,-0.6 2,-0.4 250,-0.2 -1,-0.2 0.497 49.9 61.7-108.5 -4.4 40.4 82.5 12.6 38 46 A S - 0 0 75 243,-0.1 2,-0.3 2,-0.0 251,-0.1 -0.947 54.7-162.0-132.1 146.1 37.4 80.8 14.0 39 47 A S - 0 0 36 -2,-0.4 241,-0.2 241,-0.1 240,-0.1 -0.857 27.0-127.6-116.9 156.4 35.6 80.4 17.4 40 48 A T - 0 0 115 239,-1.5 238,-0.1 -2,-0.3 240,-0.1 0.755 41.5-123.8 -73.5 -26.2 33.0 77.8 18.5 41 49 A G S S+ 0 0 31 238,-0.4 2,-0.4 1,-0.3 237,-0.1 0.354 80.8 92.0 97.2 -4.3 30.6 80.5 19.6 42 50 A K S S- 0 0 85 237,-0.2 237,-2.2 222,-0.2 2,-0.6 -0.961 71.7-130.5-128.6 141.3 30.3 79.1 23.1 43 51 A I E -k 266 0F 0 222,-2.1 224,-3.2 -2,-0.4 2,-0.4 -0.823 26.0-132.5 -92.6 114.0 32.3 80.0 26.3 44 52 A b E -k 267 0F 8 -2,-0.6 4,-0.4 229,-0.2 2,-0.2 -0.529 1.6-146.6 -71.1 121.8 33.6 76.9 28.0 45 53 A N + 0 0 74 222,-2.5 5,-0.2 -2,-0.4 -1,-0.1 0.136 65.5 109.7 -75.9 27.1 33.0 76.8 31.8 46 54 A N S S- 0 0 80 223,-0.4 225,-2.0 -2,-0.2 -2,-0.1 -0.955 79.3 -0.5-155.7 134.2 36.3 75.0 32.2 47 55 A P S S+ 0 0 50 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.949 123.6 58.5 -91.6 10.5 39.0 75.6 33.4 48 56 A H S S- 0 0 4 -4,-0.4 2,-0.9 223,-0.3 223,-0.0 -0.845 87.3-114.0-102.2 139.7 38.0 79.2 34.2 49 57 A R - 0 0 112 -2,-0.4 28,-2.9 -3,-0.1 29,-2.4 -0.581 33.8-160.1 -72.3 105.6 35.1 80.0 36.6 50 58 A I E -l 78 0G 24 -2,-0.9 2,-0.8 27,-0.2 29,-0.2 -0.809 7.4-167.8 -93.0 112.1 32.6 81.7 34.3 51 59 A L E -l 79 0G 17 27,-2.6 29,-2.5 -2,-0.7 2,-0.4 -0.885 13.6-149.7-102.1 101.8 30.0 83.8 36.2 52 60 A D E -l 80 0G 46 -2,-0.8 29,-0.2 27,-0.2 3,-0.1 -0.623 5.8-160.4 -72.9 124.0 27.3 84.7 33.7 53 61 A G > + 0 0 0 27,-2.9 3,-2.4 -2,-0.4 2,-0.4 0.749 20.5 175.3 -76.3 -27.1 25.8 88.0 34.7 54 62 A I T 3 S+ 0 0 77 26,-0.5 28,-0.4 1,-0.3 31,-0.3 -0.396 76.1 0.4 60.4-110.8 22.6 87.4 32.7 55 63 A D T 3 S+ 0 0 56 -2,-0.4 31,-2.3 30,-0.2 2,-0.3 0.349 125.2 82.8 -89.7 5.8 20.4 90.4 33.5 56 64 A c < - 0 0 2 -3,-2.4 26,-0.5 29,-0.2 2,-0.2 -0.828 61.3-151.7-117.1 150.7 23.0 91.9 35.8 57 65 A T > - 0 0 21 -2,-0.3 4,-1.4 29,-0.2 5,-0.1 -0.515 39.6-105.1-100.1 175.1 26.1 94.0 35.4 58 66 A L H > S+ 0 0 0 -2,-0.2 4,-2.5 2,-0.2 3,-0.2 0.966 120.0 52.9 -69.9 -44.8 28.9 93.7 37.9 59 67 A I H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.860 109.3 47.9 -57.3 -41.4 28.0 97.0 39.6 60 68 A D H >>S+ 0 0 0 2,-0.2 5,-2.5 1,-0.2 4,-1.7 0.850 112.5 49.2 -69.2 -34.6 24.4 96.0 40.1 61 69 A A H <5S+ 0 0 5 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.846 114.8 47.4 -70.1 -34.0 25.5 92.7 41.5 62 70 A L H <5S+ 0 0 1 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.995 114.1 43.0 -66.5 -65.9 27.8 94.7 43.8 63 71 A L H <5S- 0 0 0 -4,-2.9 79,-2.1 -5,-0.1 80,-0.4 0.758 115.3-111.9 -52.3 -36.9 25.4 97.3 45.0 64 72 A G T <5 - 0 0 1 -4,-1.7 77,-2.4 -5,-0.2 -3,-0.2 0.801 37.9-171.1 104.8 33.7 22.6 94.8 45.5 65 73 A D >>< - 0 0 1 -5,-2.5 3,-3.0 75,-0.2 4,-0.9 -0.383 35.9-115.6 -55.3 134.3 20.0 95.6 42.9 66 74 A P T 34 S+ 0 0 19 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.776 115.2 51.3 -44.8 -37.7 17.0 93.4 43.8 67 75 A H T 34 S+ 0 0 50 21,-0.4 -12,-0.2 1,-0.2 3,-0.1 0.507 112.1 49.7 -84.8 4.9 17.2 91.3 40.6 68 76 A c T X4 S+ 0 0 0 -3,-3.0 3,-3.0 -8,-0.2 -1,-0.2 0.540 71.6 100.4-116.0 -11.5 20.9 90.7 41.3 69 77 A D G >< + 0 0 55 -4,-0.9 3,-1.0 -3,-0.3 -1,-0.1 0.481 66.3 81.5 -59.7 1.7 21.2 89.5 44.9 70 78 A V G 3 S+ 0 0 108 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.653 89.0 56.9 -76.4 -14.4 21.4 85.9 43.5 71 79 A F G X S+ 0 0 11 -3,-3.0 3,-2.4 3,-0.1 -1,-0.2 0.323 76.8 140.9 -96.4 5.2 25.1 87.0 43.0 72 80 A Q T < S+ 0 0 76 -3,-1.0 39,-0.1 1,-0.3 -10,-0.1 -0.253 79.3 0.9 -53.2 130.7 25.5 87.8 46.7 73 81 A N T 3 S+ 0 0 84 37,-1.1 -1,-0.3 1,-0.2 38,-0.2 0.687 97.2 162.2 60.6 24.1 29.0 86.6 47.8 74 82 A E < - 0 0 46 -3,-2.4 36,-2.6 36,-0.2 2,-0.3 -0.293 22.8-162.7 -73.1 156.2 29.8 85.4 44.3 75 83 A T B +N 109 0H 60 34,-0.2 2,-0.3 35,-0.1 34,-0.2 -0.870 13.5 170.0-131.1 163.0 33.3 84.7 43.1 76 84 A W - 0 0 4 32,-1.7 -26,-0.2 -2,-0.3 3,-0.2 -0.989 41.6-147.1-168.9 163.3 34.5 84.3 39.5 77 85 A D S S+ 0 0 36 -28,-2.9 181,-1.7 1,-0.4 2,-0.4 0.689 102.9 11.5-103.1 -36.0 37.5 84.0 37.2 78 86 A L E -lm 50 258G 1 -29,-2.4 -27,-2.6 179,-0.2 2,-0.5 -0.973 69.0-154.0-145.6 118.9 35.6 85.8 34.5 79 87 A F E -lm 51 259G 0 179,-1.9 181,-3.4 -2,-0.4 2,-0.7 -0.845 15.4-151.2 -91.8 128.5 32.3 87.7 35.0 80 88 A V E -lm 52 260G 0 -29,-2.5 -27,-2.9 -2,-0.5 2,-0.6 -0.909 5.0-153.6-106.2 107.5 30.4 87.8 31.6 81 89 A E E - m 0 261G 16 179,-1.9 181,-1.4 -2,-0.7 2,-0.2 -0.718 13.3-140.9 -82.5 119.8 28.2 90.9 31.3 82 90 A R > - 0 0 21 -2,-0.6 3,-1.1 -26,-0.5 181,-0.2 -0.498 11.3-132.0 -80.0 148.7 25.2 90.3 29.0 83 91 A S T 3 S+ 0 0 89 179,-0.3 -1,-0.1 1,-0.3 180,-0.1 0.760 107.2 59.5 -70.6 -24.4 24.1 93.0 26.6 84 92 A K T 3 S+ 0 0 110 -30,-0.1 -1,-0.3 -28,-0.1 -29,-0.1 0.584 79.2 125.9 -77.2 -14.5 20.5 92.4 27.7 85 93 A A < + 0 0 23 -3,-1.1 2,-0.3 -31,-0.3 -29,-0.2 -0.023 36.8 178.8 -44.6 148.5 21.4 93.3 31.3 86 94 A F - 0 0 91 -31,-2.3 2,-0.4 -29,-0.1 -29,-0.2 -0.968 26.9-121.9-149.4 165.0 19.4 96.0 32.9 87 95 A S + 0 0 43 -2,-0.3 2,-0.3 -31,-0.1 -31,-0.1 -0.898 21.0 179.5-113.8 134.9 19.1 97.8 36.2 88 96 A N + 0 0 64 -2,-0.4 -21,-0.4 2,-0.1 2,-0.3 -0.745 54.0 66.7-135.5 82.7 15.8 97.7 38.1 89 97 A d S S- 0 0 2 -2,-0.3 42,-0.2 -24,-0.1 3,-0.1 -0.920 96.1 -16.9-172.7-168.4 16.4 99.7 41.3 90 98 A Y S S- 0 0 3 -2,-0.3 2,-0.4 1,-0.1 132,-0.1 -0.269 72.8-112.4 -54.6 123.5 17.1 103.2 42.5 91 99 A P + 0 0 6 0, 0.0 131,-0.8 0, 0.0 2,-0.2 -0.453 57.5 157.3 -61.0 111.8 18.4 105.3 39.5 92 100 A Y E -o 222 0I 38 -2,-0.4 2,-0.3 129,-0.2 131,-0.2 -0.702 32.8-142.4-128.2-178.8 22.0 106.0 40.3 93 101 A D E -o 223 0I 68 129,-2.2 131,-2.5 -2,-0.2 128,-0.0 -0.984 7.3-145.6-148.9 145.0 25.3 106.9 38.7 94 102 A V > - 0 0 12 -2,-0.3 3,-1.4 129,-0.2 4,-0.2 -0.920 16.1-142.4-117.7 100.1 28.8 105.8 39.4 95 103 A P T 3 S+ 0 0 46 0, 0.0 5,-0.1 0, 0.0 -2,-0.0 -0.466 96.7 13.1 -58.9 130.0 31.4 108.5 38.8 96 104 A D T 3> S+ 0 0 100 3,-0.1 4,-1.9 -2,-0.1 3,-0.4 0.915 83.5 167.6 64.8 42.1 34.4 106.6 37.3 97 105 A Y H <> + 0 0 75 -3,-1.4 4,-3.3 1,-0.2 5,-0.3 0.950 69.3 59.6 -49.2 -54.6 32.1 103.6 36.9 98 106 A A H > S+ 0 0 58 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.838 104.4 48.7 -46.1 -45.8 34.7 101.9 34.7 99 107 A S H > S+ 0 0 46 -3,-0.4 4,-3.3 2,-0.2 -1,-0.3 0.939 113.2 45.8 -65.2 -45.1 37.3 102.0 37.5 100 108 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 5,-0.4 0.968 114.3 49.6 -61.4 -47.4 34.9 100.5 40.1 101 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-10.4 466 474 A D >> - 0 0 49 -2,-0.3 4,-2.6 -117,-0.1 3,-1.1 -0.178 48.0 -84.1 -70.9 176.2 74.1 45.7 -9.8 467 475 A N H 3> S+ 0 0 61 1,-0.3 4,-2.9 2,-0.2 5,-0.1 0.856 131.5 55.1 -52.0 -40.2 71.5 46.3 -7.2 468 476 A A H 3> S+ 0 0 71 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.870 111.2 46.6 -61.8 -34.1 73.7 45.0 -4.4 469 477 A f H <> S+ 0 0 4 -3,-1.1 4,-1.5 2,-0.2 -2,-0.2 0.935 110.2 51.7 -72.0 -45.9 76.3 47.5 -5.5 470 478 A I H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.889 108.1 54.3 -58.5 -37.6 73.6 50.3 -5.7 471 479 A E H X S+ 0 0 81 -4,-2.9 4,-2.6 -5,-0.2 3,-0.4 0.959 101.8 55.7 -62.0 -50.4 72.6 49.4 -2.2 472 480 A S H <>S+ 0 0 18 -4,-1.8 5,-1.5 1,-0.3 6,-1.1 0.820 107.3 51.0 -52.3 -36.1 76.2 49.7 -0.7 473 481 A I H ><5S+ 0 0 0 -4,-1.5 3,-1.1 4,-0.2 -1,-0.3 0.908 109.7 49.8 -68.0 -43.3 76.3 53.3 -2.1 474 482 A R H 3<5S+ 0 0 45 -4,-1.8 -2,-0.2 -3,-0.4 -1,-0.2 0.913 114.6 44.5 -63.2 -40.9 73.0 54.0 -0.4 475 483 A N T 3<5S- 0 0 67 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 -0.188 111.9-112.4-101.0 44.2 74.1 52.6 2.9 476 484 A G T < 5S+ 0 0 46 -3,-1.1 -3,-0.2 -2,-0.2 -4,-0.1 0.445 91.6 104.0 45.4 10.1 77.6 54.2 3.0 477 485 A T < + 0 0 96 -5,-1.5 2,-0.6 -6,-0.2 -4,-0.2 0.286 40.0 136.4-101.8 12.9 79.5 51.0 2.7 478 486 A Y - 0 0 14 -6,-1.1 2,-0.8 -7,-0.1 -9,-0.0 -0.456 42.0-155.7 -65.6 110.9 80.5 51.5 -1.0 479 487 A D - 0 0 96 -2,-0.6 4,-0.4 1,-0.2 3,-0.3 -0.772 9.5-173.1 -88.8 108.0 84.2 50.5 -1.4 480 488 A H S >> S+ 0 0 19 -2,-0.8 4,-1.4 -34,-0.2 3,-0.9 0.768 75.3 69.4 -75.3 -27.3 85.4 52.4 -4.4 481 489 A D H >> S+ 0 0 104 1,-0.2 4,-0.6 2,-0.2 3,-0.5 0.909 91.0 65.9 -59.1 -33.8 88.8 50.9 -4.7 482 490 A V H 34 S+ 0 0 95 -3,-0.3 -1,-0.2 1,-0.3 4,-0.2 0.833 117.1 22.3 -54.5 -40.3 87.1 47.7 -5.7 483 491 A Y H <> S+ 0 0 51 -3,-0.9 4,-2.6 -4,-0.4 5,-0.3 0.374 93.2 106.5-110.3 2.6 85.8 49.2 -9.0 484 492 A R H S+ 0 0 75 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.896 116.8 45.0 -57.5 -42.9 87.2 49.4 -14.2 487 495 A A H X S+ 0 0 0 -4,-2.6 4,-3.1 2,-0.2 5,-0.2 0.920 110.2 53.7 -66.6 -44.6 85.8 52.9 -13.8 488 496 A L H X S+ 0 0 45 -4,-3.2 4,-1.4 -5,-0.3 -1,-0.2 0.835 115.1 42.4 -59.1 -33.5 89.1 54.5 -14.5 489 497 A N H < S+ 0 0 118 -4,-2.1 4,-0.5 -5,-0.2 -2,-0.2 0.962 114.8 47.0 -77.8 -54.8 89.3 52.5 -17.8 490 498 A N H < S+ 0 0 36 -4,-3.0 3,-0.4 -28,-0.3 -2,-0.2 0.857 119.9 44.1 -54.5 -37.0 85.6 53.0 -18.8 491 499 A R H < S+ 0 0 46 -4,-3.1 2,-0.7 -5,-0.2 3,-0.2 0.996 111.4 44.7 -70.6 -73.5 86.1 56.7 -18.1 492 500 A F S < S- 0 0 125 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.149 131.9 -14.6 -67.1 19.1 89.4 57.8 -19.5 493 501 A Q 0 0 152 -2,-0.7 -1,-0.2 -4,-0.5 -2,-0.1 0.078 360.0 360.0 141.1 109.2 88.9 55.9 -22.9 494 502 A I 0 0 190 -3,-0.2 -4,-0.1 -4,-0.1 -3,-0.0 -0.705 360.0 360.0 -97.3 360.0 86.6 53.3 -24.2