==== 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-OCT-07 2RFT . COMPND 2 MOLECULE: INFLUENZA B HEMAGGLUTININ (HA); . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA B VIRUS (STRAIN B/HONG KONG/ . AUTHOR Q.WANG,X.TIAN,X.CHEN,J.MA . 511 2 7 6 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24554.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 294 57.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 83 16.2 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 . 2 0.4 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-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 . 52 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 17.6 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 1 2 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 3 2 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 0 0 PARALLEL BRIDGES PER LADDER . 3 2 11 2 0 1 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 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 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 40 0, 0.0 482,-2.7 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 137.8 64.3 35.4 86.3 2 2 A R E -AB 370 482A 103 368,-1.4 368,-3.1 480,-0.2 2,-0.5 -0.867 360.0-176.4-107.6 131.1 63.3 35.1 82.7 3 3 A I E + B 0 481A 0 478,-1.3 478,-1.0 -2,-0.5 366,-0.2 -0.982 26.3 178.8-117.6 113.5 64.0 32.3 80.2 4 4 A a E - B 0 480A 12 -2,-0.5 364,-1.8 364,-0.4 2,-0.4 -0.614 31.8-116.1-112.7 168.4 62.6 33.3 76.8 5 5 A T E +E 367 0B 13 474,-1.3 2,-0.3 362,-0.3 362,-0.3 -0.869 43.0 168.5 -97.2 138.7 62.4 32.0 73.3 6 6 A G E -E 366 0B 4 360,-3.8 360,-3.3 -2,-0.4 2,-0.3 -0.963 27.8-134.4-145.5 162.3 64.2 34.1 70.7 7 7 A I E -Ef 365 356B 0 348,-0.6 350,-1.0 -2,-0.3 358,-0.3 -0.819 34.9 -97.2-114.3 163.4 65.4 34.1 67.1 8 8 A T - 0 0 11 356,-3.0 2,-0.4 -2,-0.3 350,-0.2 -0.146 17.1-143.3 -75.6 165.1 68.8 35.1 65.7 9 9 A S + 0 0 5 348,-0.4 350,-0.3 347,-0.2 2,-0.3 -0.990 41.1 142.4-122.0 134.5 70.0 38.4 64.1 10 10 A S - 0 0 48 -2,-0.4 2,-0.4 325,-0.3 325,-0.1 -0.927 55.5 -51.0-158.9 178.4 72.5 37.9 61.3 11 11 A N + 0 0 125 -2,-0.3 3,-0.1 1,-0.1 -2,-0.0 -0.536 51.3 172.8 -63.2 119.1 73.9 38.9 58.0 12 12 A S + 0 0 11 -2,-0.4 15,-0.2 1,-0.1 16,-0.1 -0.614 17.4 147.4-133.8 68.5 70.8 39.1 55.7 13 13 A P + 0 0 76 0, 0.0 2,-0.3 0, 0.0 14,-0.1 0.750 50.9 88.9 -75.4 -23.2 71.9 40.5 52.4 14 14 A H E -H 26 0C 70 12,-0.9 12,-3.0 13,-0.2 2,-0.4 -0.576 64.5-153.1 -84.9 134.8 69.4 38.5 50.4 15 15 A V E -H 25 0C 53 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.878 13.4-168.0-105.5 139.1 65.9 39.9 49.7 16 16 A V E -H 24 0C 1 8,-3.6 8,-2.2 -2,-0.4 2,-0.3 -0.873 21.6-111.5-127.4 162.0 62.9 37.6 49.1 17 17 A K + 0 0 49 -2,-0.3 2,-0.3 310,-0.2 431,-0.2 -0.725 33.7 172.8 -92.8 136.1 59.3 38.0 47.9 18 18 A T > - 0 0 8 -2,-0.3 4,-1.2 4,-0.2 427,-0.1 -0.980 28.7-146.2-149.5 129.8 56.4 37.4 50.3 19 19 A A T 4 S+ 0 0 72 -2,-0.3 -1,-0.1 425,-0.3 4,-0.1 0.887 100.1 34.3 -64.6 -43.8 52.6 38.0 49.7 20 20 A T T 4 S+ 0 0 97 1,-0.1 -1,-0.2 2,-0.1 -2,-0.0 0.866 128.3 33.1 -79.0 -40.6 51.7 39.1 53.2 21 21 A Q T 4 S- 0 0 52 1,-0.3 -2,-0.2 3,-0.0 -1,-0.1 0.349 96.0-134.4-104.8 5.7 54.9 41.0 54.2 22 22 A G < - 0 0 41 -4,-1.2 2,-0.6 2,-0.1 -1,-0.3 -0.322 67.8 -10.7 63.9-157.9 56.1 42.5 50.9 23 23 A E S S- 0 0 144 -6,-0.2 2,-0.3 -4,-0.1 -6,-0.2 -0.609 78.4-171.9 -80.4 116.9 59.8 42.2 50.1 24 24 A V E -H 16 0C 7 -8,-2.2 -8,-3.6 -2,-0.6 2,-0.3 -0.734 23.0-119.4-112.5 153.3 61.7 40.9 53.1 25 25 A N E -H 15 0C 69 -2,-0.3 309,-2.7 -10,-0.2 2,-0.3 -0.699 33.4-161.7 -88.8 146.2 65.5 40.5 54.0 26 26 A V E -HI 14 333C 0 -12,-3.0 -12,-0.9 -2,-0.3 307,-0.2 -0.985 28.3-128.5-140.9 139.1 66.7 36.9 54.8 27 27 A T S S- 0 0 32 305,-2.1 2,-0.3 -2,-0.3 -13,-0.2 0.905 91.1 -8.1 -44.7 -59.2 69.6 35.2 56.6 28 28 A G - 0 0 16 -16,-0.1 302,-2.3 -15,-0.1 2,-0.3 -0.933 62.5-158.8-140.6 163.6 70.3 32.8 53.7 29 29 A V E -J 329 0D 25 -2,-0.3 300,-0.2 300,-0.3 -14,-0.0 -0.997 16.9-139.5-144.9 146.3 68.8 31.8 50.4 30 30 A I E -J 328 0D 31 298,-3.1 298,-2.6 -2,-0.3 2,-0.1 -0.922 31.3-139.3-103.1 108.1 69.1 28.8 48.0 31 31 A P E -J 327 0D 56 0, 0.0 296,-0.2 0, 0.0 -2,-0.0 -0.443 21.0-174.6 -74.3 141.9 69.1 30.2 44.5 32 32 A L + 0 0 0 294,-2.6 274,-2.0 -2,-0.1 2,-0.2 0.326 61.4 77.7-110.2 0.8 67.0 28.3 41.9 33 33 A T + 0 0 22 293,-0.6 2,-0.3 272,-0.1 274,-0.2 -0.697 47.5 170.7-120.0 159.2 68.2 30.5 39.0 34 34 A T - 0 0 50 -2,-0.2 274,-3.4 270,-0.1 -2,-0.0 -0.960 30.4-132.6-160.6 150.8 71.2 30.8 36.7 35 35 A T - 0 0 86 -2,-0.3 274,-0.1 272,-0.2 272,-0.0 -0.878 32.5-150.0-108.1 97.0 72.2 32.7 33.6 36 36 A P - 0 0 17 0, 0.0 2,-0.3 0, 0.0 261,-0.1 -0.085 11.6-123.7 -60.1 167.4 73.9 30.1 31.4 37 37 A T - 0 0 116 260,-0.1 2,-0.4 259,-0.0 259,-0.0 -0.892 28.5 -93.2-116.0 147.2 76.6 31.2 28.9 38 38 A K + 0 0 180 -2,-0.3 2,-0.3 262,-0.0 260,-0.2 -0.425 59.4 157.8 -56.7 110.3 76.7 30.7 25.1 39 39 A S - 0 0 70 258,-2.3 260,-0.3 -2,-0.4 0, 0.0 -0.885 43.2 -77.5-129.9 169.2 78.7 27.5 24.5 40 40 A H - 0 0 91 -2,-0.3 259,-0.8 258,-0.2 2,-0.1 -0.032 48.9-100.6 -62.8 165.3 78.9 25.0 21.6 41 41 A F + 0 0 12 242,-0.4 246,-1.3 257,-0.2 2,-0.2 -0.463 42.7 175.9 -87.8 158.7 76.3 22.3 20.8 42 42 A A - 0 0 1 244,-0.2 2,-0.7 -2,-0.1 247,-0.3 -0.769 38.8 -55.1-148.2-171.2 76.7 18.7 21.8 43 43 A N E -k 289 0E 57 245,-2.1 247,-1.1 -2,-0.2 2,-0.3 -0.674 51.3-123.6 -82.2 113.7 75.0 15.2 21.8 44 44 A L E > -k 290 0E 6 -2,-0.7 3,-0.6 245,-0.2 247,-0.2 -0.420 28.1-135.8 -57.0 117.0 71.6 15.2 23.5 45 45 A K T 3 S+ 0 0 115 245,-1.3 -1,-0.1 -2,-0.3 246,-0.1 0.893 88.8 33.7 -42.4 -79.1 72.1 12.5 26.2 46 46 A G T 3 S+ 0 0 84 245,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.581 124.1 36.2 -64.4 -14.6 69.0 10.3 26.3 47 47 A T S < S- 0 0 49 -3,-0.6 2,-0.3 33,-0.0 -4,-0.0 0.053 92.2 -94.7-113.3-142.2 68.3 10.5 22.5 48 48 A Q - 0 0 96 -2,-0.1 32,-2.1 2,-0.0 33,-1.8 -0.969 33.1-132.7-150.8 135.2 70.5 10.6 19.4 49 49 A T - 0 0 15 -2,-0.3 2,-0.2 30,-0.2 33,-0.2 -0.539 17.9-176.7-101.5 152.9 71.7 13.7 17.4 50 50 A R + 0 0 20 31,-0.5 33,-0.5 -2,-0.2 3,-0.1 -0.753 26.6 141.8-127.0 177.2 71.9 14.8 13.8 51 51 A G S S+ 0 0 1 -2,-0.2 2,-0.6 31,-0.2 34,-0.3 -0.075 76.5 59.2 175.0 -42.2 73.2 17.8 11.9 52 52 A K S S- 0 0 103 1,-0.1 -1,-0.2 33,-0.0 9,-0.0 -0.950 75.6-146.0-102.4 115.5 74.7 16.1 8.9 53 53 A L S S+ 0 0 3 -2,-0.6 -1,-0.1 1,-0.2 9,-0.1 0.840 91.5 21.0 -42.9 -38.7 71.9 14.2 7.1 54 54 A b - 0 0 11 3,-0.1 -1,-0.2 1,-0.1 22,-0.1 -0.998 56.5-176.6-138.3 132.3 74.7 11.8 6.3 55 55 A P S S+ 0 0 71 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.895 88.4 45.0 -83.1 -50.8 78.1 11.2 7.9 56 56 A N S S+ 0 0 144 1,-0.2 2,-0.8 19,-0.1 17,-0.1 0.545 99.6 68.5 -81.7 -9.6 79.6 8.5 5.5 57 57 A b S S- 0 0 10 17,-0.1 -1,-0.2 15,-0.1 17,-0.2 -0.606 90.3-178.6 -95.6 70.4 78.6 10.3 2.3 58 58 A L + 0 0 127 -2,-0.8 -2,-0.1 1,-0.1 3,-0.1 0.522 41.1 38.8 -60.8-161.8 81.2 12.8 3.3 59 59 A N S S+ 0 0 148 -4,-0.1 2,-0.2 1,-0.1 -1,-0.1 0.645 92.8 95.0 14.0 76.3 82.3 16.1 1.7 60 60 A c S S- 0 0 34 12,-0.0 2,-0.3 11,-0.0 -1,-0.1 -0.850 72.9 -95.8-155.8-174.8 78.9 17.4 0.5 61 61 A T > - 0 0 16 -2,-0.2 4,-1.5 1,-0.1 30,-0.1 -0.711 30.1-119.2-103.4 170.3 76.0 19.6 1.4 62 62 A D H > S+ 0 0 4 -2,-0.3 4,-2.5 2,-0.2 5,-0.1 0.898 119.7 50.4 -68.4 -44.8 72.8 18.5 3.1 63 63 A L H > S+ 0 0 0 27,-0.5 4,-3.3 2,-0.2 5,-0.2 0.906 105.5 56.0 -57.5 -46.8 70.9 19.8 0.0 64 64 A D H >>S+ 0 0 0 26,-0.4 5,-2.1 1,-0.2 4,-0.8 0.926 110.8 44.3 -51.0 -49.9 73.3 17.9 -2.2 65 65 A V H ><5S+ 0 0 5 -4,-1.5 3,-0.7 2,-0.2 -1,-0.2 0.901 112.4 53.0 -63.5 -41.9 72.4 14.7 -0.4 66 66 A A H 3<5S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.934 108.3 50.1 -56.1 -48.7 68.7 15.7 -0.5 67 67 A L H 3<5S- 0 0 1 -4,-3.3 88,-0.6 -5,-0.1 89,-0.3 0.596 115.5-115.6 -70.8 -13.4 68.9 16.2 -4.3 68 68 A G T <<5 - 0 0 6 -4,-0.8 86,-3.4 -3,-0.7 -3,-0.2 0.847 41.1-170.9 82.7 35.7 70.5 12.7 -4.8 69 69 A R < - 0 0 20 -5,-2.1 3,-0.2 84,-0.3 -1,-0.2 -0.323 32.9-107.4 -61.2 142.2 73.9 13.9 -6.1 70 70 A P S S+ 0 0 34 0, 0.0 3,-0.2 0, 0.0 76,-0.1 0.791 112.8 25.5 -43.7 -56.7 76.1 11.0 -7.5 71 71 A K S S+ 0 0 112 1,-0.2 2,-1.7 73,-0.2 74,-0.1 0.741 108.8 76.6 -82.4 -24.6 78.8 10.8 -4.7 72 72 A c + 0 0 1 -3,-0.2 -3,-0.2 1,-0.1 -4,-0.2 -0.406 64.2 113.9 -86.1 62.2 76.6 12.2 -2.0 73 73 A M + 0 0 65 -2,-1.7 2,-0.3 -3,-0.2 -1,-0.1 -0.557 34.8 159.0-137.8 70.7 74.5 9.0 -1.5 74 74 A G - 0 0 10 -2,-0.2 2,-0.9 -17,-0.2 45,-0.2 -0.756 50.2-110.1-100.7 138.1 75.1 7.5 2.0 75 75 A T - 0 0 142 -2,-0.3 -19,-0.1 43,-0.1 43,-0.1 -0.536 46.9-152.1 -68.5 102.3 72.8 5.1 3.7 76 76 A I - 0 0 11 -2,-0.9 41,-0.4 1,-0.1 -22,-0.1 -0.728 8.9-152.9-105.6 132.2 71.6 7.5 6.5 77 77 A P - 0 0 78 0, 0.0 40,-0.8 0, 0.0 2,-0.3 0.758 23.2 -83.3 -73.0-140.0 70.4 6.5 9.9 78 78 A S + 0 0 46 38,-0.1 2,-0.3 -29,-0.1 38,-0.2 -0.828 29.5 178.5-130.8 169.0 68.0 7.9 12.5 79 79 A A - 0 0 3 36,-0.5 -30,-0.2 -2,-0.3 3,-0.1 -0.843 23.9-153.9-145.6-177.3 68.0 10.4 15.3 80 80 A K S S+ 0 0 107 -32,-2.1 198,-2.1 1,-0.3 2,-0.4 0.119 91.0 52.6-137.9 6.7 65.3 11.7 17.6 81 81 A A E S-l 278 0F 0 -33,-1.8 -31,-0.5 196,-0.2 2,-0.3 -0.990 70.6-177.1-137.7 132.9 67.2 15.0 18.1 82 82 A S E -l 279 0F 3 196,-3.2 198,-1.2 -2,-0.4 2,-0.4 -0.985 17.5-142.6-134.5 145.9 68.3 17.1 15.1 83 83 A I E -l 280 0F 2 -33,-0.5 2,-0.8 -2,-0.3 198,-0.2 -0.919 7.5-149.5-109.5 132.4 70.2 20.3 14.7 84 84 A L E +l 281 0F 6 196,-3.7 198,-1.7 -2,-0.4 3,-0.1 -0.862 29.0 161.4-100.3 102.5 69.3 22.9 12.0 85 85 A H + 0 0 44 -2,-0.8 2,-0.6 -34,-0.3 -1,-0.2 0.795 61.5 47.4 -98.9 -32.8 72.6 24.6 11.1 86 86 A E - 0 0 38 1,-0.1 -1,-0.2 197,-0.1 23,-0.1 -0.948 58.2-170.8-113.2 112.1 71.9 26.2 7.7 87 87 A V S S+ 0 0 55 -2,-0.6 -1,-0.1 1,-0.3 327,-0.1 0.817 93.5 24.8 -66.4 -32.3 68.6 28.2 7.6 88 88 A K S S- 0 0 126 -3,-0.1 -1,-0.3 326,-0.1 18,-0.1 -0.780 94.7-152.3-133.5 86.6 69.1 28.5 3.9 89 89 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 -28,-0.0 -0.136 4.7-140.9 -70.9 159.6 71.2 25.6 2.7 90 90 A V - 0 0 58 2,-0.0 -27,-0.5 9,-0.0 -26,-0.4 -0.754 8.7-123.8-117.3 158.8 73.5 25.7 -0.3 91 91 A T - 0 0 6 -2,-0.3 3,-0.1 -28,-0.1 143,-0.1 -0.702 11.6-144.4 -95.6 154.9 74.4 23.2 -3.0 92 92 A S - 0 0 69 -2,-0.3 2,-0.4 1,-0.1 142,-0.1 -0.288 58.9 -69.6-117.9 48.8 78.0 22.2 -3.7 93 93 A G S S+ 0 0 0 140,-0.6 142,-0.2 2,-0.1 4,-0.2 -0.885 73.7 123.3 119.8-136.6 78.0 21.8 -7.5 94 94 A d S S- 0 0 0 -2,-0.4 141,-0.5 48,-0.2 49,-0.2 -0.206 87.9 -8.2 57.1-160.5 76.5 19.4 -10.0 95 95 A F S S- 0 0 6 139,-0.1 2,-0.2 1,-0.1 -2,-0.1 -0.396 91.5 -97.2 -64.2 134.2 74.2 21.0 -12.6 96 96 A P - 0 0 2 0, 0.0 147,-2.1 0, 0.0 2,-0.3 -0.336 42.8-158.8 -57.1 120.9 73.5 24.7 -11.9 97 97 A I B -m 243 0G 10 136,-0.4 2,-1.1 135,-0.3 135,-0.3 -0.756 22.7-136.9 -99.9 145.2 70.2 25.2 -10.1 98 98 A M > + 0 0 15 145,-2.7 3,-1.2 -2,-0.3 147,-0.3 -0.779 35.8 177.7 -92.6 82.6 68.1 28.3 -10.0 99 99 A H G > + 0 0 12 -2,-1.1 3,-1.4 1,-0.2 6,-0.3 0.893 62.4 62.7 -57.6 -48.4 67.5 27.7 -6.3 100 100 A D G 3 S+ 0 0 141 1,-0.3 -1,-0.2 -3,-0.2 144,-0.1 0.480 86.0 73.5 -67.9 -3.5 65.4 30.8 -5.5 101 101 A R G < S+ 0 0 104 -3,-1.2 2,-0.3 144,-0.0 -1,-0.3 0.348 103.7 28.3 -93.4 6.6 62.4 30.1 -7.8 102 102 A T S X S- 0 0 22 -3,-1.4 3,-0.5 -4,-0.1 144,-0.1 -0.942 85.3-102.8-151.7 174.9 61.0 27.3 -5.6 103 103 A K G > S+ 0 0 47 -2,-0.3 3,-1.4 1,-0.2 4,-0.3 0.355 84.1 113.0 -80.2 6.7 60.8 26.0 -2.0 104 104 A I G > + 0 0 1 141,-0.5 3,-1.8 -5,-0.3 -1,-0.2 0.738 58.1 71.3 -57.9 -32.0 63.5 23.4 -2.8 105 105 A R G < S+ 0 0 42 -3,-0.5 4,-0.3 -6,-0.3 -1,-0.3 0.879 96.1 52.4 -51.8 -40.5 66.2 24.9 -0.6 106 106 A Q G <> S+ 0 0 8 -3,-1.4 4,-2.0 1,-0.2 -1,-0.3 0.535 76.8 105.1 -78.7 -6.2 64.4 23.8 2.6 107 107 A L H <> S+ 0 0 0 -3,-1.8 4,-2.5 -4,-0.3 -1,-0.2 0.830 81.9 46.4 -45.3 -45.4 64.1 20.1 1.4 108 108 A P H > S+ 0 0 0 0, 0.0 4,-3.7 0, 0.0 -1,-0.2 0.960 110.4 53.0 -61.5 -49.7 66.8 19.0 3.9 109 109 A N H > S+ 0 0 8 -4,-0.3 4,-0.6 1,-0.2 -2,-0.2 0.774 110.8 48.4 -55.7 -31.8 65.3 20.9 6.8 110 110 A L H >< S+ 0 0 11 -4,-2.0 3,-1.0 2,-0.2 4,-0.3 0.944 112.9 46.3 -69.4 -52.8 62.0 19.2 6.0 111 111 A L H >< S+ 0 0 0 -4,-2.5 3,-3.0 1,-0.3 -2,-0.2 0.935 104.0 62.6 -54.1 -52.1 63.7 15.7 5.9 112 112 A R H 3< S+ 0 0 0 -4,-3.7 -1,-0.3 1,-0.3 -2,-0.2 0.780 89.7 72.0 -40.4 -37.3 65.6 16.5 9.1 113 113 A G T << S+ 0 0 3 -3,-1.0 164,-2.5 -4,-0.6 -1,-0.3 0.705 89.0 75.3 -55.8 -26.1 62.1 16.7 10.7 114 114 A Y S < S- 0 0 30 -3,-3.0 162,-0.3 -4,-0.3 161,-0.2 -0.584 70.5-145.0 -91.5 154.9 61.7 12.9 10.5 115 115 A E S S+ 0 0 50 159,-0.6 2,-0.5 1,-0.2 -36,-0.5 0.962 90.0 40.9 -74.5 -58.3 63.3 10.2 12.6 116 116 A N E +N 274 0G 58 158,-3.7 158,-3.0 -38,-0.2 2,-0.3 -0.833 68.9 166.7 -99.6 125.6 63.6 7.6 9.8 117 117 A I E -N 273 0G 11 -40,-0.8 2,-0.3 -2,-0.5 156,-0.2 -0.954 8.7-174.9-132.5 154.3 64.7 8.7 6.2 118 118 A R E -N 272 0G 67 154,-1.0 154,-1.4 -2,-0.3 3,-0.1 -0.922 29.8-133.6-156.7 130.1 65.8 6.6 3.2 119 119 A L S S- 0 0 43 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.859 74.5 -62.4 -41.8 -55.9 67.2 7.4 -0.3 120 120 A S - 0 0 42 149,-0.1 -1,-0.2 151,-0.1 151,-0.1 -0.915 19.0-140.7 174.1 160.5 64.9 4.9 -2.1 121 121 A A S S- 0 0 65 149,-0.3 2,-0.3 -2,-0.3 150,-0.0 -0.547 93.4 -24.5-133.1 63.9 63.7 1.3 -2.6 122 122 A R S S- 0 0 200 2,-0.0 2,-0.2 148,-0.0 146,-0.0 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