==== 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 1HGD . 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) . 57471.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 981 65.0 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 . 305 20.2 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 . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 24 1.6 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 . 3 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 . 139 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 95 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 297 19.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.2 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 . 12 15 21 6 3 7 2 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 . 9 9 6 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 2,-0.0 0.000 360.0 360.0 360.0-123.3 78.4 -9.2 41.7 2 2 A D - 0 0 107 1,-0.3 0, 0.0 3,-0.0 0, 0.0 0.399 360.0 -99.9 -77.1-132.8 76.6 -11.6 44.2 3 3 A L S S- 0 0 136 -2,-0.0 2,-1.9 0, 0.0 -1,-0.3 -0.129 89.1 -13.2-126.7-141.9 77.8 -15.2 43.5 4 4 A P S S- 0 0 104 0, 0.0 2,-1.2 0, 0.0 0, 0.0 -0.489 71.8-157.1 -64.2 86.8 75.4 -17.6 41.5 5 5 A G + 0 0 50 -2,-1.9 -3,-0.0 1,-0.2 0, 0.0 -0.533 27.1 164.1 -63.4 94.0 72.3 -15.4 41.6 6 6 A N + 0 0 135 -2,-1.2 2,-1.1 2,-0.0 -1,-0.2 0.683 25.4 116.5 -96.3 -18.6 70.0 -18.2 41.1 7 7 A D - 0 0 84 1,-0.1 2,-1.9 465,-0.0 465,-0.5 -0.315 46.0-167.4 -68.9 99.1 66.4 -17.1 42.0 8 8 A N + 0 0 95 -2,-1.1 2,-0.3 463,-0.1 -1,-0.1 -0.456 34.6 129.5 -81.2 59.5 64.8 -17.4 38.7 9 9 A S - 0 0 37 -2,-1.9 2,-0.2 461,-0.0 489,-0.1 -0.757 38.9-152.9-112.7 175.3 61.6 -15.5 39.3 10 10 A T - 0 0 57 -2,-0.3 2,-0.3 460,-0.2 460,-0.2 -0.778 2.4-147.0-129.4 174.1 59.9 -12.7 37.3 11 11 A A E -A 469 0A 3 458,-2.1 458,-2.6 -2,-0.2 2,-0.4 -0.886 9.9-135.7-137.0 165.8 57.5 -9.8 38.1 12 12 A T E -AB 468 356A 42 344,-1.7 344,-1.7 -2,-0.3 2,-0.4 -0.994 16.7-176.3-125.4 134.7 54.8 -8.1 36.2 13 13 A L E -AB 467 355A 0 454,-2.4 454,-3.2 -2,-0.4 2,-0.4 -1.000 7.5-170.6-128.9 125.9 54.3 -4.3 36.1 14 14 A a E -AB 466 354A 22 340,-2.8 340,-2.4 -2,-0.4 2,-0.3 -0.977 11.6-148.7-122.6 136.2 51.4 -2.8 34.3 15 15 A L E + B 0 353A 4 450,-2.9 2,-0.3 -2,-0.4 338,-0.2 -0.703 30.7 152.4 -95.8 148.1 50.7 0.8 33.4 16 16 A G E - B 0 352A 1 336,-2.2 336,-2.5 -2,-0.3 2,-0.3 -0.940 32.4-126.6-158.9-177.2 47.2 2.0 33.3 17 17 A H E - B 0 351A 0 -2,-0.3 326,-2.6 324,-0.3 334,-0.3 -0.824 33.5 -93.8-133.8 168.6 44.9 5.1 33.7 18 18 A H B -e 343 0B 21 332,-2.2 305,-0.3 -2,-0.3 2,-0.3 -0.186 32.2-170.2 -78.3 178.5 41.8 5.8 35.8 19 19 A A - 0 0 4 324,-0.9 327,-0.2 327,-0.2 303,-0.1 -0.938 11.9-140.2-159.7 155.3 38.2 5.5 34.6 20 20 A V - 0 0 29 -2,-0.3 324,-0.1 1,-0.1 322,-0.1 -0.921 16.2-130.6-123.0 155.8 34.9 6.6 36.3 21 21 A P S S+ 0 0 55 0, 0.0 -1,-0.1 0, 0.0 323,-0.0 0.898 103.1 38.2 -69.5 -40.8 31.6 4.8 36.4 22 22 A N S S+ 0 0 118 15,-0.1 16,-0.1 306,-0.1 -2,-0.1 0.957 77.0 164.6 -81.0 -93.0 29.7 7.9 35.3 23 23 A G - 0 0 21 14,-0.4 2,-0.3 12,-0.1 14,-0.2 0.013 31.7-111.3 92.1 154.3 31.5 10.0 32.5 24 24 A T E -F 36 0C 46 12,-2.7 12,-3.1 14,-0.1 2,-0.3 -0.977 18.0-122.5-133.4 145.3 30.2 12.7 30.2 25 25 A L E +F 35 0C 84 -2,-0.3 2,-0.3 10,-0.3 10,-0.2 -0.708 34.2 177.9 -88.9 138.6 29.6 12.8 26.5 26 26 A V E -F 34 0C 5 8,-2.4 8,-2.2 -2,-0.3 2,-0.2 -0.929 28.5-112.2-136.1 158.2 31.4 15.6 24.6 27 27 A K - 0 0 58 288,-0.4 5,-0.3 -2,-0.3 2,-0.2 -0.590 34.9-177.0 -87.4 159.6 31.7 16.6 20.8 28 28 A T - 0 0 1 3,-2.8 403,-0.2 -2,-0.2 402,-0.1 -0.763 44.1 -96.9-146.8 173.6 35.0 16.3 19.0 29 29 A I S S+ 0 0 13 401,-0.6 859,-0.2 -2,-0.2 402,-0.1 0.874 127.1 25.6 -68.2 -40.4 36.4 17.1 15.5 30 30 A T S S+ 0 0 5 400,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.683 128.2 34.8-101.4 -11.9 35.8 13.4 14.6 31 31 A D - 0 0 66 853,-0.1 -3,-2.8 1,-0.1 3,-0.2 -0.927 54.9-155.4-134.7 154.5 32.9 12.3 16.9 32 32 A D S S+ 0 0 98 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.512 91.1 33.5-112.1 -5.5 29.9 14.1 18.3 33 33 A Q + 0 0 134 -8,-0.1 2,-0.4 -6,-0.1 -1,-0.3 -0.826 70.0 151.7-138.2 104.9 29.4 12.0 21.3 34 34 A I E -F 26 0C 20 -8,-2.2 -8,-2.4 -2,-0.3 2,-0.5 -0.990 42.6-121.1-125.4 141.4 32.5 10.6 22.9 35 35 A E E +F 25 0C 43 -2,-0.4 287,-2.2 -10,-0.2 2,-0.3 -0.718 32.6 179.8 -88.9 125.2 32.6 9.8 26.6 36 36 A V E -FG 24 321C 0 -12,-3.1 -12,-2.7 -2,-0.5 285,-0.2 -0.817 39.5-109.9-117.1 163.4 35.2 11.5 28.8 37 37 A T S S- 0 0 17 283,-2.9 -14,-0.4 -2,-0.3 2,-0.3 0.815 94.5 -11.6 -53.5 -39.4 36.0 11.4 32.5 38 38 A N - 0 0 86 282,-0.3 280,-2.4 -14,-0.1 281,-0.5 -0.986 61.3-175.0-163.4 154.1 34.8 14.9 33.2 39 39 A A E -H 317 0D 18 278,-0.3 2,-0.4 -2,-0.3 278,-0.3 -0.920 16.7-134.9-149.3 171.6 33.7 18.1 31.4 40 40 A T E -H 316 0D 50 276,-2.0 276,-3.1 -2,-0.3 2,-0.4 -0.987 23.9-116.9-136.5 143.0 32.7 21.6 32.2 41 41 A E E -H 315 0D 49 -2,-0.4 274,-0.2 274,-0.2 272,-0.0 -0.690 22.1-174.8 -84.6 131.9 29.8 23.6 30.8 42 42 A L + 0 0 1 272,-2.7 252,-2.1 -2,-0.4 2,-0.6 0.557 60.8 79.6-105.2 -5.7 30.7 26.7 28.9 43 43 A V E -i 294 0E 2 271,-0.2 2,-0.5 250,-0.1 252,-0.3 -0.887 66.6-147.9-106.5 118.0 27.1 28.1 28.3 44 44 A Q E +i 295 0E 14 250,-2.9 252,-2.9 -2,-0.6 253,-0.4 -0.694 26.0 169.0 -76.7 121.4 25.4 30.1 31.1 45 45 A S + 0 0 67 -2,-0.5 2,-0.4 250,-0.2 -1,-0.1 0.281 45.4 63.7-125.5 15.8 21.7 29.3 30.6 46 46 A S - 0 0 71 243,-0.1 2,-0.3 0, 0.0 251,-0.1 -0.999 58.1-150.4-144.7 141.6 19.8 30.5 33.6 47 47 A S - 0 0 36 -2,-0.4 241,-0.2 241,-0.1 239,-0.1 -0.691 25.3-126.9-101.0 162.6 19.2 33.9 35.2 48 48 A T - 0 0 90 239,-2.4 238,-0.1 -2,-0.3 240,-0.1 0.830 44.7-124.4 -73.1 -32.5 18.6 34.5 38.8 49 49 A G S S+ 0 0 33 238,-0.5 2,-0.4 236,-0.3 237,-0.2 0.331 80.7 87.3 101.9 -2.1 15.4 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 -0.966 75.9-127.1-133.2 141.1 16.4 39.5 39.5 51 51 A I E -k 274 0F 0 222,-2.9 224,-2.6 -2,-0.4 2,-0.3 -0.806 32.6-134.1 -85.6 111.5 18.4 42.6 38.4 52 52 A b E -k 275 0F 7 -2,-0.8 4,-0.3 222,-0.2 224,-0.2 -0.546 4.9-139.8 -67.5 132.5 21.1 43.0 41.1 53 53 A N E + 0 0 60 222,-2.9 5,-0.2 -2,-0.3 -1,-0.1 0.097 64.6 107.6 -82.4 27.2 21.3 46.6 42.2 54 54 A N E S+k 278 0F 83 223,-0.6 225,-2.5 225,-0.2 3,-0.1 -0.959 72.6 3.7-160.5 138.9 25.1 46.5 42.4 55 55 A P S S+ 0 0 51 0, 0.0 2,-0.2 0, 0.0 225,-0.1 -0.992 119.3 58.0 -80.8 -7.8 27.7 47.5 41.0 56 56 A H S S- 0 0 10 223,-0.4 2,-1.0 -4,-0.3 223,-0.0 -0.531 90.1-111.7 -86.5 158.0 25.9 49.5 38.4 57 57 A R - 0 0 113 -2,-0.2 28,-3.1 -3,-0.1 29,-2.2 -0.744 36.6-164.5 -85.9 101.8 23.5 52.3 39.3 58 58 A I E -l 86 0G 25 -2,-1.0 2,-0.6 -5,-0.2 29,-0.2 -0.757 5.1-162.3 -87.6 130.5 20.1 50.9 38.3 59 59 A L E -l 87 0G 13 27,-2.8 29,-2.7 -2,-0.4 2,-0.6 -0.967 11.8-146.0-110.2 118.0 17.3 53.5 38.1 60 60 A D E -l 88 0G 48 -2,-0.6 29,-0.1 27,-0.2 3,-0.1 -0.760 2.2-156.7 -86.4 122.6 13.8 51.8 38.1 61 61 A G > - 0 0 0 27,-2.4 3,-2.3 -2,-0.6 -1,-0.1 0.602 18.3-170.2 -73.7 -6.1 11.6 53.8 35.9 62 62 A I T 3 S- 0 0 98 1,-0.3 28,-0.5 26,-0.2 -1,-0.2 -0.343 73.0 -17.1 42.9-113.8 8.5 52.5 37.8 63 63 A D T 3 S+ 0 0 61 12,-0.2 31,-2.1 -3,-0.1 2,-0.4 0.104 121.5 92.2-108.4 30.0 5.6 53.7 35.6 64 64 A c < - 0 0 0 -3,-2.3 26,-0.4 29,-0.2 2,-0.2 -0.931 65.0-144.5-115.0 133.7 7.6 56.3 33.7 65 65 A T > - 0 0 21 -2,-0.4 4,-2.2 29,-0.2 5,-0.2 -0.570 36.0-106.4 -80.4 168.1 9.3 55.8 30.4 66 66 A L H > S+ 0 0 0 -2,-0.2 4,-2.4 2,-0.2 5,-0.1 0.942 119.0 54.5 -63.7 -43.2 12.6 57.7 30.1 67 67 A I H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.920 109.6 47.2 -60.1 -43.8 11.1 60.3 27.6 68 68 A D H >>S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-1.7 0.927 111.1 51.5 -63.7 -40.0 8.3 61.2 30.1 69 69 A A H <5S+ 0 0 4 -4,-2.2 -1,-0.2 3,-0.2 -2,-0.2 0.924 113.7 46.3 -59.1 -37.7 10.8 61.5 32.9 70 70 A L H <5S+ 0 0 1 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.980 114.0 44.8 -66.7 -55.8 12.7 63.8 30.6 71 71 A L H <5S- 0 0 2 -4,-3.0 79,-2.0 -5,-0.1 80,-0.2 0.842 114.2-115.8 -61.6 -36.5 9.8 65.9 29.5 72 72 A G T <5 - 0 0 2 -4,-2.7 77,-2.3 -5,-0.3 -3,-0.2 0.858 34.0-169.3 99.8 44.4 8.4 66.2 33.0 73 73 A D > < - 0 0 0 -5,-1.7 3,-2.5 75,-0.2 4,-0.2 -0.494 34.6-117.5 -54.0 134.3 5.1 64.4 33.0 74 74 A P G > S+ 0 0 19 0, 0.0 3,-2.3 0, 0.0 4,-0.2 0.933 114.5 53.9 -46.1 -48.9 3.6 65.3 36.4 75 75 A H G 3 S+ 0 0 45 1,-0.3 3,-0.2 21,-0.2 -12,-0.2 0.589 107.5 51.1 -69.0 -6.6 3.5 61.7 37.5 76 76 A c G X S+ 0 0 2 -3,-2.5 3,-2.1 -8,-0.2 -1,-0.3 0.151 70.3 113.8-111.3 17.8 7.3 61.3 36.7 77 77 A D G X + 0 0 48 -3,-2.3 3,-1.7 1,-0.3 -2,-0.1 0.787 61.2 78.2 -65.2 -15.3 8.4 64.4 38.7 78 78 A V G 3 S+ 0 0 125 1,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.807 88.3 58.1 -56.0 -29.8 10.2 61.9 41.0 79 79 A F G X S+ 0 0 13 -3,-2.1 3,-2.0 -18,-0.1 -1,-0.3 0.329 70.3 137.2 -90.8 9.2 13.0 61.6 38.4 80 80 A Q T < S- 0 0 88 -3,-1.7 39,-0.1 1,-0.3 3,-0.1 -0.360 82.9 -2.5 -65.2 135.9 14.1 65.2 38.1 81 81 A N T 3 S+ 0 0 86 37,-1.3 38,-0.3 1,-0.2 -1,-0.3 0.582 99.4 150.4 63.3 16.4 17.9 65.6 38.0 82 82 A E < - 0 0 59 -3,-2.0 36,-2.3 36,-0.2 2,-0.3 -0.253 29.1-158.0 -79.5 163.4 18.2 61.9 38.4 83 83 A T B +N 117 0H 41 34,-0.2 2,-0.3 35,-0.1 34,-0.2 -0.939 11.0 177.3-139.2 163.7 21.1 59.8 37.1 84 84 A W - 0 0 6 32,-1.5 -26,-0.2 -2,-0.3 3,-0.2 -0.989 37.5-149.5-161.7 156.6 21.7 56.1 36.2 85 85 A D S S+ 0 0 35 -28,-3.1 181,-1.7 1,-0.4 2,-0.4 0.695 105.0 13.2 -93.5 -37.9 24.1 53.5 34.8 86 86 A L E S-lm 58 266G 1 -29,-2.2 -27,-2.8 179,-0.2 2,-0.6 -0.989 70.8-155.4-136.5 124.2 21.1 51.6 33.5 87 87 A F E -lm 59 267G 0 179,-1.8 181,-2.6 -2,-0.4 2,-0.6 -0.924 15.7-151.2 -96.6 123.1 17.6 53.0 33.3 88 88 A V E -lm 60 268G 0 -29,-2.7 -27,-2.4 -2,-0.6 2,-0.4 -0.876 6.7-157.3 -95.8 120.7 15.1 50.1 33.5 89 89 A E E - m 0 269G 15 179,-3.0 181,-1.9 -2,-0.6 2,-0.2 -0.840 11.3-143.0 -95.2 133.8 11.8 50.8 31.6 90 90 A R > - 0 0 32 -28,-0.5 3,-1.7 -2,-0.4 181,-0.1 -0.647 17.6-125.5 -99.1 155.5 8.8 48.7 32.7 91 91 A S T 3 S+ 0 0 76 1,-0.3 -1,-0.1 -2,-0.2 180,-0.1 0.751 109.0 61.5 -68.7 -19.2 6.0 47.4 30.5 92 92 A K T 3 S+ 0 0 159 -30,-0.2 -1,-0.3 -28,-0.1 -29,-0.1 0.441 73.4 125.9 -83.5 -3.9 3.5 49.1 32.8 93 93 A A < - 0 0 23 -3,-1.7 2,-0.3 -31,-0.2 -29,-0.2 -0.280 37.8-176.3 -60.9 143.2 4.8 52.6 32.1 94 94 A F - 0 0 85 -31,-2.1 2,-0.3 -29,-0.1 -29,-0.2 -0.979 23.3-130.6-140.0 152.8 2.1 55.0 31.0 95 95 A S + 0 0 44 -2,-0.3 -31,-0.0 -31,-0.1 0, 0.0 -0.788 22.5 175.8-100.4 152.3 2.0 58.6 29.9 96 96 A N + 0 0 74 -2,-0.3 44,-0.2 2,-0.1 -21,-0.2 -0.247 47.7 70.6-154.0 53.7 -0.6 60.9 31.5 97 97 A d S S- 0 0 1 42,-0.2 42,-0.2 1,-0.2 3,-0.1 -0.674 95.2 -20.9-147.5-161.0 -0.2 64.5 30.3 98 98 A Y S S- 0 0 4 -2,-0.2 2,-0.3 1,-0.1 -1,-0.2 -0.302 78.8-103.4 -54.9 128.5 -0.8 66.5 27.0 99 99 A P + 0 0 6 0, 0.0 131,-1.5 0, 0.0 2,-0.3 -0.449 56.2 166.6 -59.7 121.6 -0.8 64.0 24.0 100 100 A Y E -o 230 0I 38 -2,-0.3 2,-0.3 129,-0.3 131,-0.2 -0.874 25.6-157.1-131.9 164.1 2.6 64.3 22.2 101 101 A D E -o 231 0I 29 129,-1.8 131,-2.5 -2,-0.3 3,-0.1 -0.950 12.9-142.1-138.1 153.1 4.6 62.4 19.6 102 102 A V > - 0 0 15 -2,-0.3 3,-1.6 129,-0.2 4,-0.2 -0.925 9.4-146.4-120.5 110.1 8.4 62.5 19.1 103 103 A P T 3 S+ 0 0 73 0, 0.0 2,-0.4 0, 0.0 3,-0.2 0.867 99.9 21.3 -43.3 -53.4 9.5 62.4 15.4 104 104 A D T >> S+ 0 0 70 128,-0.3 4,-2.1 1,-0.2 3,-0.8 -0.459 77.8 160.1-116.4 66.1 12.6 60.5 16.0 105 105 A Y H <> S+ 0 0 82 -3,-1.6 4,-3.2 -2,-0.4 5,-0.3 0.916 70.7 57.9 -45.7 -48.4 11.7 59.0 19.4 106 106 A A H 3> S+ 0 0 40 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.851 107.4 44.5 -58.5 -40.5 14.3 56.3 19.0 107 107 A S H <> S+ 0 0 1 -3,-0.8 4,-2.9 2,-0.2 -1,-0.2 0.935 114.1 49.2 -74.4 -36.1 17.2 58.7 18.7 108 108 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 5,-0.3 0.958 111.8 48.8 -66.0 -46.6 16.0 60.9 21.5 109 109 A R H X S+ 0 0 8 -4,-3.2 4,-2.4 -5,-0.2 -1,-0.2 0.905 116.4 45.0 -55.0 -39.9 15.5 57.9 23.9 110 110 A S H X S+ 0 0 10 -4,-1.7 4,-2.4 -5,-0.3 5,-0.3 0.980 111.7 50.3 -66.8 -52.4 19.0 56.7 22.9 111 111 A L H X S+ 0 0 5 -4,-2.9 4,-0.7 1,-0.2 -1,-0.2 0.811 117.2 39.1 -61.0 -39.2 20.8 60.0 23.2 112 112 A V H >X S+ 0 0 2 -4,-2.5 4,-2.2 -5,-0.2 3,-0.8 0.925 110.3 62.0 -74.7 -42.9 19.4 60.7 26.7 113 113 A A H 3< S+ 0 0 0 -4,-2.4 -2,-0.2 -5,-0.3 -3,-0.2 0.854 110.5 37.9 -53.6 -39.9 19.8 57.0 27.8 114 114 A S H 3< S+ 0 0 29 -4,-2.4 151,-0.7 1,-0.2 149,-0.5 0.674 104.9 66.0 -91.0 -11.9 23.5 57.1 27.3 115 115 A S H << S- 0 0 7 -3,-0.8 -2,-0.2 -4,-0.7 -1,-0.2 0.920 90.8-155.5 -67.1 -40.5 24.1 60.6 28.6 116 116 A G < + 0 0 5 -4,-2.2 -32,-1.5 1,-0.2 2,-0.3 0.621 52.3 88.4 81.3 11.9 22.9 59.1 31.9 117 117 A T B -N 83 0H 3 -5,-0.4 -34,-0.2 -34,-0.2 -1,-0.2 -0.999 48.3-168.4-146.6 143.9 21.6 62.3 33.5 118 118 A L + 0 0 2 -36,-2.3 -37,-1.3 -2,-0.3 -36,-0.2 -0.009 40.4 150.4-110.3 20.7 18.4 64.3 33.7 119 119 A E - 0 0 49 -38,-0.3 140,-2.0 140,-0.2 2,-0.4 -0.441 27.9-164.7 -55.8 120.4 20.2 67.3 35.3 120 120 A F E -P 258 0I 15 138,-0.2 2,-0.5 -2,-0.2 138,-0.2 -0.936 14.9-162.9-120.4 136.3 18.3 70.4 34.3 121 121 A I E -P 257 0I 67 136,-2.9 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