==== 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 01-NOV-91 1HGI . COMPND 2 MOLECULE: HEMAGGLUTININ, CHAIN HA1; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA A VIRUS; . AUTHOR N.K.SAUTER,J.E.HANSON,G.D.GLICK,J.H.BROWN,R.L.CROWTHER,S.-J. . 1509 6 18 15 3 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 57512.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 974 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 81 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 293 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 . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 21 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 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 . 142 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 300 19.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.1 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 3 0 6 0 0 3 3 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 3 RESIDUES PER ALPHA HELIX . 6 9 6 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 PARALLEL BRIDGES PER LADDER . 16 14 18 9 0 6 3 0 3 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 . 10 9 5 3 0 0 3 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 Q 0 0 167 0, 0.0 489,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-124.0 78.4 -9.1 41.8 2 2 A D - 0 0 108 1,-0.3 0, 0.0 3,-0.0 0, 0.0 0.417 360.0-101.1 -77.3-132.6 76.7 -11.6 44.2 3 3 A L S S- 0 0 137 0, 0.0 2,-1.9 0, 0.0 -1,-0.3 -0.144 89.4 -12.5-127.2-140.1 77.8 -15.2 43.6 4 4 A P S S- 0 0 101 0, 0.0 2,-1.3 0, 0.0 3,-0.1 -0.483 70.2-159.4 -65.4 86.3 75.4 -17.5 41.6 5 5 A G + 0 0 51 -2,-1.9 -3,-0.0 1,-0.2 0, 0.0 -0.559 26.0 164.7 -64.0 93.2 72.3 -15.2 41.8 6 6 A N + 0 0 134 -2,-1.3 2,-1.4 2,-0.0 -1,-0.2 0.611 23.9 119.7 -95.9 -14.2 70.0 -18.2 41.1 7 7 A D - 0 0 77 1,-0.1 2,-1.7 -3,-0.1 465,-0.5 -0.291 42.4-171.1 -69.7 95.2 66.5 -17.0 42.1 8 8 A N + 0 0 94 -2,-1.4 2,-0.3 463,-0.1 -1,-0.1 -0.422 31.8 127.4 -83.9 60.9 64.8 -17.4 38.8 9 9 A S - 0 0 43 -2,-1.7 2,-0.3 461,-0.0 489,-0.1 -0.742 41.0-147.6-110.2 175.3 61.4 -15.7 39.3 10 10 A T - 0 0 61 -2,-0.3 2,-0.3 460,-0.1 460,-0.2 -0.791 4.1-148.9-127.7 171.5 59.7 -13.0 37.2 11 11 A A E -A 469 0A 3 458,-2.5 458,-2.6 -2,-0.3 2,-0.4 -0.890 8.3-137.2-136.6 165.4 57.3 -10.1 38.0 12 12 A T E -AB 468 356A 41 344,-1.5 344,-1.7 -2,-0.3 2,-0.4 -0.999 15.9-176.4-125.7 133.3 54.5 -8.3 36.1 13 13 A L E -AB 467 355A 0 454,-2.3 454,-2.7 -2,-0.4 2,-0.4 -0.992 7.2-168.3-125.6 133.0 54.0 -4.6 36.0 14 14 A a E -AB 466 354A 24 340,-2.3 340,-2.0 -2,-0.4 2,-0.3 -0.985 9.1-150.7-128.7 132.1 51.0 -3.1 34.2 15 15 A L E + B 0 353A 5 450,-2.7 2,-0.3 -2,-0.4 338,-0.2 -0.680 31.0 146.2 -95.3 151.9 50.4 0.5 33.4 16 16 A G E - B 0 352A 1 336,-1.9 336,-2.2 -2,-0.3 2,-0.3 -0.938 34.4-123.9-165.1-172.8 46.9 1.9 33.1 17 17 A H E - B 0 351A 0 324,-0.3 326,-2.6 -2,-0.3 334,-0.3 -0.927 33.6 -90.7-143.4 162.1 44.6 4.9 33.7 18 18 A H B -e 343 0B 22 332,-2.2 305,-0.3 -2,-0.3 2,-0.3 -0.031 31.9-171.2 -70.5 179.4 41.4 5.6 35.7 19 19 A A - 0 0 5 324,-0.7 303,-0.1 327,-0.3 4,-0.1 -0.944 12.8-140.5-162.8 153.2 37.8 5.3 34.4 20 20 A V - 0 0 28 -2,-0.3 324,-0.1 2,-0.1 322,-0.1 -0.918 15.3-132.2-123.4 155.6 34.6 6.4 36.1 21 21 A P S S+ 0 0 55 0, 0.0 -1,-0.1 0, 0.0 305,-0.0 0.851 103.0 39.9 -71.6 -35.9 31.2 4.6 36.2 22 22 A N S S+ 0 0 116 15,-0.1 -2,-0.1 306,-0.1 16,-0.1 0.783 77.7 159.9 -84.4-107.6 29.4 7.8 35.2 23 23 A G - 0 0 22 14,-0.3 2,-0.3 -4,-0.1 14,-0.2 0.009 33.3-108.4 98.3 147.2 31.2 9.9 32.6 24 24 A T E -F 36 0C 46 12,-2.6 12,-3.1 10,-0.0 2,-0.4 -0.917 17.4-122.2-126.5 146.0 29.9 12.6 30.2 25 25 A L E +F 35 0C 84 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.708 34.2 177.6 -89.7 129.4 29.3 12.8 26.5 26 26 A V E -F 34 0C 4 8,-3.1 8,-1.6 -2,-0.4 2,-0.2 -0.896 27.6-113.8-126.6 158.5 31.2 15.6 24.6 27 27 A K - 0 0 63 288,-0.4 5,-0.3 -2,-0.3 2,-0.2 -0.578 34.5-179.1 -87.6 158.9 31.5 16.6 20.9 28 28 A T - 0 0 0 3,-2.8 403,-0.2 -2,-0.2 402,-0.1 -0.665 44.8 -96.3-144.3-179.2 34.8 16.3 19.0 29 29 A I S S+ 0 0 14 401,-0.4 859,-0.2 -2,-0.2 -1,-0.1 0.921 126.3 26.2 -72.4 -48.9 36.2 17.0 15.5 30 30 A T S S+ 0 0 7 400,-0.1 2,-0.3 -3,-0.1 857,-0.1 0.747 128.9 32.4 -90.4 -20.0 35.6 13.4 14.5 31 31 A D - 0 0 62 853,-0.1 -3,-2.8 1,-0.1 3,-0.2 -0.843 54.3-156.1-129.6 162.2 32.7 12.3 16.8 32 32 A D S S+ 0 0 96 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.398 90.6 36.5-121.4 -3.4 29.7 14.2 18.3 33 33 A Q + 0 0 135 2,-0.0 2,-0.4 -6,-0.0 -1,-0.3 -0.849 69.2 149.8-138.7 110.3 29.1 12.0 21.3 34 34 A I E -F 26 0C 18 -8,-1.6 -8,-3.1 -2,-0.3 2,-0.5 -0.988 42.9-122.7-133.8 139.8 32.2 10.5 22.9 35 35 A E E -F 25 0C 45 -2,-0.4 287,-2.2 -10,-0.2 2,-0.3 -0.753 30.7-178.1 -91.4 126.7 32.3 9.8 26.6 36 36 A V E -FG 24 321C 0 -12,-3.1 -12,-2.6 -2,-0.5 285,-0.3 -0.785 38.6-112.5-113.2 161.8 34.9 11.4 28.7 37 37 A T S S- 0 0 15 283,-2.8 2,-0.3 -2,-0.3 -14,-0.3 0.831 95.2 -5.7 -56.0 -37.8 35.7 11.1 32.4 38 38 A N - 0 0 85 282,-0.3 280,-2.8 -14,-0.1 281,-0.5 -0.996 60.8-177.9-162.4 151.2 34.6 14.7 33.1 39 39 A A E -H 317 0D 18 278,-0.3 2,-0.3 -2,-0.3 278,-0.2 -0.918 15.8-139.7-147.0 170.4 33.5 17.9 31.4 40 40 A T E -H 316 0D 54 276,-1.8 276,-2.6 -2,-0.3 2,-0.4 -0.991 24.9-115.6-138.2 145.2 32.5 21.5 32.3 41 41 A E E -H 315 0D 47 -2,-0.3 274,-0.2 274,-0.2 272,-0.0 -0.671 23.1-176.8 -87.2 134.6 29.7 23.6 30.9 42 42 A L + 0 0 2 272,-2.6 252,-2.1 -2,-0.4 2,-0.7 0.536 61.3 80.1-108.5 -5.9 30.5 26.7 29.0 43 43 A V E -i 294 0E 1 271,-0.3 2,-0.6 250,-0.1 252,-0.3 -0.878 67.8-148.8-104.2 115.0 27.0 28.0 28.2 44 44 A Q E +i 295 0E 11 250,-2.9 252,-2.6 -2,-0.7 253,-0.5 -0.688 25.4 169.7 -73.1 120.8 25.3 29.9 31.1 45 45 A S + 0 0 64 -2,-0.6 2,-0.4 250,-0.2 -1,-0.1 0.345 43.0 65.4-124.1 16.0 21.6 29.3 30.7 46 46 A S - 0 0 74 243,-0.1 2,-0.3 2,-0.0 251,-0.1 -0.990 56.8-150.6-141.2 143.1 19.7 30.5 33.7 47 47 A S - 0 0 37 -2,-0.4 241,-0.2 241,-0.1 240,-0.1 -0.705 25.6-127.1-102.1 162.6 19.1 33.8 35.3 48 48 A T - 0 0 85 239,-2.2 238,-0.1 -2,-0.3 240,-0.1 0.705 45.3-125.8 -74.6 -22.8 18.5 34.5 39.0 49 49 A G S S+ 0 0 34 238,-0.5 2,-0.4 236,-0.4 237,-0.2 0.417 80.4 89.9 90.7 0.1 15.3 36.3 37.8 50 50 A K S S- 0 0 77 237,-0.3 237,-2.7 222,-0.2 2,-0.8 -0.969 76.3-126.9-132.9 142.0 16.3 39.5 39.6 51 51 A I E -k 274 0F 0 222,-2.9 224,-2.4 -2,-0.4 2,-0.2 -0.787 31.3-134.7 -86.6 110.5 18.4 42.5 38.5 52 52 A b E -k 275 0F 7 -2,-0.8 4,-0.3 222,-0.2 224,-0.2 -0.513 5.0-141.4 -65.1 135.4 21.1 43.0 41.2 53 53 A N E + 0 0 57 222,-2.6 5,-0.3 -2,-0.2 -1,-0.1 0.157 64.8 103.9 -86.4 22.8 21.3 46.6 42.2 54 54 A N E S+k 278 0F 82 223,-0.7 225,-2.5 225,-0.1 3,-0.1 -0.978 71.4 10.6-156.9 141.1 25.1 46.5 42.4 55 55 A P S S+ 0 0 51 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.988 120.7 52.0 -77.4 -7.6 27.7 47.3 41.0 56 56 A H S S- 0 0 12 223,-0.4 2,-1.1 -4,-0.3 223,-0.1 -0.601 90.9-107.7 -94.4 162.0 25.9 49.4 38.5 57 57 A R - 0 0 119 -2,-0.2 28,-3.0 -3,-0.1 29,-1.9 -0.685 36.5-165.3 -86.4 97.9 23.4 52.2 39.4 58 58 A I E -l 86 0G 25 -2,-1.1 2,-0.6 -5,-0.3 29,-0.2 -0.723 3.8-162.7 -82.7 125.7 20.0 50.8 38.4 59 59 A L E -l 87 0G 13 27,-2.9 29,-2.4 -2,-0.5 2,-0.6 -0.942 13.1-144.3-104.2 118.9 17.3 53.4 38.2 60 60 A D E -l 88 0G 49 -2,-0.6 29,-0.1 27,-0.2 3,-0.1 -0.741 3.3-156.5 -86.0 125.3 13.8 51.7 38.3 61 61 A G > - 0 0 0 27,-2.2 3,-2.1 -2,-0.6 -1,-0.2 0.665 18.0-172.4 -73.7 -12.0 11.5 53.7 36.1 62 62 A I T 3 S- 0 0 96 1,-0.3 28,-0.5 26,-0.2 -1,-0.2 -0.387 74.4 -15.5 48.2-116.5 8.4 52.4 38.0 63 63 A D T 3 S+ 0 0 63 12,-0.1 31,-2.2 30,-0.1 2,-0.4 0.087 121.5 93.3-105.9 30.9 5.5 53.7 35.8 64 64 A c < - 0 0 0 -3,-2.1 26,-0.4 29,-0.2 2,-0.3 -0.942 62.9-146.7-118.2 133.7 7.6 56.2 33.9 65 65 A T > - 0 0 21 -2,-0.4 4,-2.4 29,-0.2 5,-0.2 -0.669 36.1-108.7 -83.6 159.2 9.3 55.7 30.6 66 66 A L H > S+ 0 0 0 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.932 117.8 55.8 -56.5 -43.8 12.5 57.7 30.3 67 67 A I H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.907 109.4 45.3 -61.3 -39.2 11.0 60.2 27.8 68 68 A D H >>S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 5,-1.8 0.937 112.3 52.3 -68.4 -39.1 8.1 61.1 30.2 69 69 A A H <5S+ 0 0 6 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.893 113.0 45.8 -58.4 -37.9 10.6 61.4 33.0 70 70 A L H <5S+ 0 0 1 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.968 115.0 44.3 -67.9 -55.0 12.6 63.7 30.7 71 71 A L H <5S- 0 0 2 -4,-3.0 79,-2.0 -5,-0.2 80,-0.2 0.885 115.0-114.4 -61.9 -39.2 9.7 65.9 29.6 72 72 A G T <5 - 0 0 2 -4,-3.1 77,-2.2 -5,-0.3 -3,-0.2 0.842 34.6-170.0 105.3 46.2 8.3 66.1 33.1 73 73 A D > < - 0 0 0 -5,-1.8 3,-2.5 75,-0.2 4,-0.2 -0.509 35.1-118.4 -56.4 132.1 5.0 64.3 33.1 74 74 A P G > S+ 0 0 21 0, 0.0 3,-2.4 0, 0.0 4,-0.2 0.923 114.0 53.9 -44.0 -47.4 3.5 65.3 36.6 75 75 A H G 3 S+ 0 0 44 1,-0.3 3,-0.3 21,-0.2 -12,-0.1 0.687 107.4 51.9 -69.8 -10.9 3.5 61.7 37.7 76 76 A c G X + 0 0 2 -3,-2.5 3,-2.3 1,-0.2 -1,-0.3 0.243 70.0 113.6-105.1 14.9 7.2 61.3 36.8 77 77 A D G X + 0 0 50 -3,-2.4 3,-1.6 1,-0.3 -1,-0.2 0.765 61.9 78.1 -61.7 -14.8 8.3 64.3 38.8 78 78 A V G 3 S+ 0 0 119 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.852 87.4 58.6 -55.8 -34.2 10.1 61.9 41.1 79 79 A F G X S+ 0 0 10 -3,-2.3 3,-2.0 -18,-0.1 -1,-0.3 0.375 70.5 137.0 -87.6 8.6 12.9 61.5 38.5 80 80 A Q T < S- 0 0 83 -3,-1.6 39,-0.1 1,-0.3 3,-0.1 -0.253 82.7 -3.1 -61.7 137.2 14.0 65.2 38.2 81 81 A N T 3 S+ 0 0 86 37,-1.2 -1,-0.3 1,-0.2 38,-0.3 0.636 99.9 149.6 59.0 18.9 17.8 65.5 38.1 82 82 A E < - 0 0 60 -3,-2.0 36,-2.1 36,-0.2 2,-0.3 -0.188 29.5-157.3 -80.7 170.0 18.2 61.8 38.5 83 83 A T B +N 117 0H 41 34,-0.2 2,-0.3 35,-0.1 34,-0.2 -0.962 10.4 179.0-145.0 162.3 21.0 59.6 37.1 84 84 A W - 0 0 7 32,-1.5 3,-0.2 -2,-0.3 -26,-0.2 -0.997 37.4-150.8-161.7 153.5 21.6 56.0 36.2 85 85 A D S S+ 0 0 36 -28,-3.0 181,-1.5 1,-0.4 2,-0.4 0.701 105.5 12.8 -90.5 -32.5 24.0 53.4 34.8 86 86 A L E S-lm 58 266G 0 -29,-1.9 -27,-2.9 179,-0.2 2,-0.6 -0.985 70.1-154.6-143.8 123.6 21.0 51.6 33.6 87 87 A F E -lm 59 267G 0 179,-1.8 181,-2.3 -2,-0.4 2,-0.6 -0.927 15.8-151.2 -97.1 120.7 17.5 52.9 33.4 88 88 A V E -lm 60 268G 0 -29,-2.4 -27,-2.2 -2,-0.6 2,-0.4 -0.859 7.1-157.1 -93.7 123.6 15.0 50.0 33.6 89 89 A E E - m 0 269G 17 179,-3.0 181,-2.0 -2,-0.6 2,-0.3 -0.875 12.1-141.0-100.0 134.8 11.7 50.8 31.7 90 90 A R > - 0 0 30 -28,-0.5 3,-2.1 -2,-0.4 181,-0.1 -0.694 15.7-127.3-101.3 149.4 8.7 48.7 32.9 91 91 A S T 3 S+ 0 0 77 -2,-0.3 -1,-0.1 1,-0.3 180,-0.1 0.717 108.9 58.3 -63.2 -20.1 6.0 47.3 30.7 92 92 A K T 3 S+ 0 0 160 -30,-0.2 -1,-0.3 -28,-0.1 -29,-0.1 0.422 76.0 124.8 -87.9 -4.9 3.4 49.0 32.9 93 93 A A < - 0 0 22 -3,-2.1 2,-0.3 -31,-0.2 -29,-0.2 -0.163 38.7-173.5 -62.1 152.4 4.6 52.5 32.4 94 94 A F - 0 0 85 -31,-2.2 2,-0.4 -29,-0.1 -29,-0.2 -0.997 23.8-128.4-147.7 150.9 2.1 55.0 31.2 95 95 A S + 0 0 42 -2,-0.3 -31,-0.0 -31,-0.1 0, 0.0 -0.781 23.9 174.3 -95.5 149.4 1.9 58.6 30.1 96 96 A N + 0 0 76 -2,-0.4 2,-0.2 2,-0.1 -21,-0.2 -0.279 48.5 69.2-151.9 53.0 -0.6 60.8 31.7 97 97 A d S S- 0 0 1 1,-0.2 42,-0.2 42,-0.1 3,-0.1 -0.725 96.5 -22.4-147.4-162.3 -0.3 64.4 30.5 98 98 A Y S S- 0 0 5 -2,-0.2 2,-0.3 1,-0.1 -1,-0.2 -0.202 77.6-102.7 -52.0 135.3 -0.9 66.3 27.2 99 99 A P + 0 0 6 0, 0.0 131,-1.4 0, 0.0 2,-0.3 -0.508 54.9 165.4 -64.8 129.2 -0.8 63.9 24.2 100 100 A Y E -o 230 0I 38 -2,-0.3 2,-0.3 129,-0.3 131,-0.2 -0.885 26.2-156.0-136.7 166.9 2.5 64.2 22.3 101 101 A D E -o 231 0I 28 129,-1.7 131,-2.3 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-2,-0.2 0.864 117.1 37.8 -55.3 -49.9 20.6 60.0 23.2 112 112 A V H >X S+ 0 0 2 -4,-2.6 4,-2.4 -5,-0.2 3,-1.0 0.943 111.3 62.1 -68.9 -46.2 19.3 60.6 26.7 113 113 A A H 3< S+ 0 0 0 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.818 109.6 37.8 -52.6 -37.9 19.7 57.0 27.8 114 114 A S H 3< S+ 0 0 30 -4,-2.4 151,-0.8 1,-0.2 149,-0.7 0.670 107.4 63.8 -92.5 -12.9 23.5 56.9 27.3 115 115 A S H << S- 0 0 7 -3,-1.0 -2,-0.2 -4,-0.8 -1,-0.2 0.906 89.9-159.2 -68.0 -44.9 24.0 60.4 28.6 116 116 A G < + 0 0 4 -4,-2.4 -32,-1.5 1,-0.2 2,-0.4 0.645 49.3 90.5 80.4 16.5 22.7 59.0 31.8 117 117 A T B -N 83 0H 2 -5,-0.4 -34,-0.2 -34,-0.2 -1,-0.2 -0.997 48.8-166.5-145.2 145.6 21.6 62.2 33.6 118 118 A L + 0 0 1 -36,-2.1 -37,-1.2 -2,-0.4 -36,-0.2 0.048 39.3 152.0-111.4 19.6 18.4 64.2 33.8 119 119 A E - 0 0 48 -38,-0.3 140,-1.8 -37,-0.2 2,-0.5 -0.354 26.7-164.6 -53.3 119.2 20.2 67.2 35.3 120 120 A F E -P 258 0I 13 138,-0.2 2,-0.5 -2,-0.1 138,-0.2 -0.948 14.2-165.1-120.3 133.0 18.2 70.3 34.3 121 121 A I E -P 257 0I 66 136,-2.7 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42.0 -61.6 -53.4 55.7 19.7 15.2 1450 111 F T H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.884 113.6 54.0 -65.4 -34.5 59.3 20.4 16.3 1451 112 F D H X S+ 0 0 1 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.941 109.4 49.9 -61.1 -45.2 58.8 17.9 19.2 1452 113 F S H X S+ 0 0 1 -4,-2.8 4,-3.2 2,-0.2 -2,-0.2 0.956 108.1 50.7 -55.8 -54.7 57.8 15.3 16.5 1453 114 F E H X S+ 0 0 14 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.896 109.5 52.6 -54.9 -40.7 60.8 16.0 14.3 1454 115 F M H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.957 113.8 42.2 -58.7 -47.8 63.0 15.5 17.4 1455 116 F N H X S+ 0 0 36 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.901 110.0 56.7 -69.9 -34.3 61.4 12.2 18.1 1456 117 F K H X S+ 0 0 53 -4,-3.2 4,-2.4 1,-0.2 -1,-0.2 0.931 108.2 48.2 -63.7 -42.9 61.4 11.1 14.4 1457 118 F L H X S+ 0 0 7 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.894 110.8 52.6 -63.2 -34.9 65.2 11.6 14.3 1458 119 F F H X S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.962 112.3 43.6 -65.7 -48.0 65.5 9.7 17.5 1459 120 F E H X S+ 0 0 39 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.848 110.7 55.1 -59.4 -40.8 63.5 6.7 16.1 1460 121 F K H X S+ 0 0 91 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.918 109.6 46.1 -61.8 -45.7 65.3 6.8 12.8 1461 122 F T H X S+ 0 0 2 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.908 112.0 53.7 -64.6 -39.5 68.7 6.5 14.5 1462 123 F R H >X S+ 0 0 66 -4,-2.2 4,-0.9 1,-0.2 3,-0.6 0.970 107.4 48.5 -56.9 -59.6 67.2 3.7 16.7 1463 124 F R H >< S+ 0 0 30 -4,-2.8 3,-0.7 1,-0.2 -1,-0.2 0.837 110.0 54.0 -48.7 -42.4 66.0 1.7 13.7 1464 125 F Q H 3< S+ 0 0 39 -4,-1.8 34,-0.3 1,-0.2 -1,-0.2 0.886 103.4 53.5 -63.2 -41.7 69.4 2.0 12.0 1465 126 F L H X< S+ 0 0 2 -4,-1.8 3,-2.2 -3,-0.6 -1,-0.2 0.678 82.1 175.8 -75.2 -12.0 71.5 0.7 14.9 1466 127 F R G X< - 0 0 49 -4,-0.9 3,-0.9 -3,-0.7 -1,-0.2 -0.086 66.5 -11.8 44.0-133.0 69.4 -2.5 15.1 1467 128 F E G 3 S+ 0 0 30 1,-0.2 -1,-0.3 3,-0.0 42,-0.1 0.408 122.5 81.0 -77.0 8.8 70.8 -5.0 17.7 1468 129 F N G < S+ 0 0 0 -3,-2.2 12,-2.9 11,-0.1 2,-0.3 0.490 90.7 38.8 -96.9 -0.9 74.0 -3.1 18.2 1469 130 F A E < -N 1479 0g 12 -3,-0.9 2,-0.4 10,-0.3 10,-0.2 -0.956 62.8-144.5-145.3 158.5 73.0 -0.4 20.5 1470 131 F E E -N 1478 0g 7 8,-2.1 8,-2.9 -2,-0.3 2,-0.6 -0.965 25.1-115.1-126.4 147.5 70.8 0.2 23.5 1471 132 F E E -N 1477 0g 22 -2,-0.4 6,-0.2 6,-0.2 -1015,-0.1 -0.685 14.8-162.2 -81.2 122.4 68.8 3.2 24.5 1472 133 F M - 0 0 71 4,-3.0 -1,-0.2 -2,-0.6 5,-0.1 0.535 41.2-119.8 -80.6 -4.0 70.0 4.8 27.7 1473 134 F G S S+ 0 0 22 3,-0.3 -1019,-0.1 1,-0.1 4,-0.1 0.509 98.2 81.1 85.5 0.9 66.6 6.5 28.0 1474 135 F N S S- 0 0 80 2,-0.3 -124,-0.2 -1021,-0.1 3,-0.1 -0.071 122.0 -82.2-122.4 29.8 67.8 10.1 27.8 1475 136 F G S S+ 0 0 0 1,-0.2 -450,-2.7 -126,-0.1 2,-0.5 0.574 100.4 114.0 80.3 5.0 68.2 10.3 24.0 1476 137 F m E -K 1024 0g 12 -452,-0.3 -4,-3.0 -454,-0.0 2,-0.4 -0.927 53.5-150.1-111.2 135.1 71.6 8.6 24.1 1477 138 F F E -KN10231471g 4 -454,-2.7 -454,-2.4 -2,-0.5 2,-0.8 -0.809 10.8-140.3 -96.6 141.8 72.4 5.2 22.6 1478 139 F K E -KN10221470g 50 -8,-2.9 -8,-2.1 -2,-0.4 2,-0.5 -0.929 20.2-150.2 -94.6 107.6 75.1 3.1 24.1 1479 140 F I E -KN10211469g 0 -458,-2.5 -458,-2.4 -2,-0.8 2,-0.5 -0.746 1.7-151.8 -83.5 122.1 76.7 1.5 20.9 1480 141 F Y + 0 0 15 -12,-2.9 28,-0.3 -2,-0.5 2,-0.3 -0.183 67.6 58.7 -92.3 43.1 78.1 -1.9 21.9 1481 142 F H S S- 0 0 0 -2,-0.5 2,-0.5 27,-0.1 -463,-0.1 -0.971 100.3 -76.7-156.6 163.8 81.0 -2.2 19.4 1482 143 F K - 0 0 64 -2,-0.3 2,-0.6 -465,-0.2 -462,-0.1 -0.509 51.6-177.8 -69.1 118.4 84.1 -0.2 18.6 1483 144 F r - 0 0 0 -2,-0.5 -114,-0.3 -463,-0.1 -115,-0.2 -0.905 3.5-171.2-127.0 103.6 82.9 2.8 16.7 1484 145 F D > - 0 0 45 -2,-0.6 4,-2.7 -116,-0.1 3,-0.3 -0.191 48.0 -81.1 -79.6-175.1 85.5 5.3 15.4 1485 146 F N H > S+ 0 0 63 1,-0.3 4,-2.8 2,-0.2 5,-0.1 0.843 130.7 52.3 -65.7 -27.5 84.7 8.6 13.8 1486 147 F A H > S+ 0 0 69 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.893 109.1 51.2 -73.9 -36.5 84.0 7.1 10.4 1487 148 F r H > S+ 0 0 2 -3,-0.3 4,-1.7 2,-0.2 3,-0.2 0.987 111.0 47.2 -60.2 -52.2 81.6 4.7 12.0 1488 149 F I H >X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 3,-0.5 0.919 110.3 54.3 -55.7 -42.8 79.9 7.7 13.8 1489 150 F E H 3X S+ 0 0 76 -4,-2.8 4,-3.3 1,-0.3 -1,-0.2 0.922 105.6 52.1 -61.1 -39.2 79.8 9.5 10.4 1490 151 F S H 3<>S+ 0 0 19 -4,-2.4 5,-2.3 -3,-0.2 6,-1.3 0.834 107.3 52.0 -68.2 -31.3 78.0 6.7 8.7 1491 152 F I H X<5S+ 0 0 1 -4,-1.7 3,-0.7 -3,-0.5 -1,-0.2 0.953 114.3 44.1 -66.7 -43.6 75.3 6.6 11.5 1492 153 F R H 3<5S+ 0 0 53 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.941 116.0 44.5 -67.8 -47.4 74.8 10.3 11.0 1493 154 F N T 3<5S- 0 0 85 -4,-3.3 -1,-0.2 -5,-0.2 -2,-0.2 0.391 115.0-118.1 -81.9 7.1 74.8 10.2 7.2 1494 155 F G T < 5S+ 0 0 33 -3,-0.7 -3,-0.2 -4,-0.3 -4,-0.1 0.704 85.7 107.6 77.2 22.0 72.6 7.2 7.3 1495 156 F T < + 0 0 97 -5,-2.3 -4,-0.2 -6,-0.2 -5,-0.1 0.307 38.7 139.7-111.3 9.9 74.7 4.6 5.7 1496 157 F Y - 0 0 15 -6,-1.3 2,-0.8 -7,-0.1 -9,-0.0 -0.329 41.9-149.4 -59.2 127.2 75.6 2.5 8.8 1497 158 F D >> - 0 0 84 1,-0.2 4,-0.6 -2,-0.1 3,-0.5 -0.840 8.5-168.0-102.3 107.6 75.6 -1.2 8.1 1498 159 F H H >> S+ 0 0 21 -2,-0.8 3,-1.4 -34,-0.3 4,-1.4 0.851 81.6 65.1 -62.7 -32.4 74.6 -3.0 11.3 1499 160 F D H >> S+ 0 0 88 1,-0.3 3,-0.7 2,-0.2 4,-0.5 0.894 90.7 65.1 -60.3 -39.7 75.6 -6.4 10.0 1500 161 F V H <4 S+ 0 0 48 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.2 0.800 118.9 24.0 -50.0 -35.6 79.3 -5.4 9.8 1501 162 F Y H S+ 0 0 38 -3,-0.2 4,-2.2 2,-0.2 5,-0.2 0.987 116.5 43.8 -60.9 -52.9 80.9 -7.8 17.9 1505 166 F A H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.935 113.1 48.7 -58.3 -54.6 77.9 -6.0 19.3 1506 167 F L H X S+ 0 0 7 -4,-3.3 4,-2.6 1,-0.2 5,-0.5 0.868 111.5 50.5 -61.6 -35.8 75.8 -9.0 20.4 1507 168 F N H <>S+ 0 0 64 -4,-2.1 5,-1.0 -5,-0.3 -1,-0.2 0.968 116.0 41.7 -62.2 -50.7 78.8 -10.6 22.2 1508 169 F N H <5S+ 0 0 22 -4,-2.2 -2,-0.2 -28,-0.3 -1,-0.2 0.861 118.8 46.8 -58.8 -42.6 79.5 -7.4 24.1 1509 170 F R H <5S+ 0 0 6 -4,-2.7 -2,-0.2 -29,-0.2 -1,-0.2 0.870 129.1 8.9 -79.3 -41.3 75.9 -6.7 24.8 1510 171 F F T <5S+ 0 0 23 -4,-2.6 3,-0.4 -5,-0.2 4,-0.3 0.753 113.4 61.2-103.2 -78.3 74.6 -10.0 26.0 1511 172 F Q T > 5 + 0 0 120 -5,-0.5 3,-1.3 1,-0.2 2,-0.4 0.485 65.1 115.4 -21.2 -69.4 77.2 -12.7 26.6 1512 173 F I T 3