==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LECTIN(AGGLUTININ) 08-JAN-93 2CWG . COMPND 2 MOLECULE: AGGLUTININ ISOLECTIN 1 (WGA1); . SOURCE 2 ORGANISM_SCIENTIFIC: TRITICUM AESTIVUM; . AUTHOR C.S.WRIGHT . 353 4 32 32 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16228.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 214 60.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 19.8 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 . 9 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 0.3 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 . 24 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 19.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.3 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 8 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 23 8 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 6 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 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 X 0 0 80 0, 0.0 2,-0.3 0, 0.0 6,-0.1 0.000 360.0 360.0 360.0 -49.4 1.9 22.2 22.2 2 2 A R - 0 0 64 4,-0.2 2,-0.2 21,-0.1 21,-0.2 -0.698 360.0-149.2-109.8 162.1 5.1 23.1 20.4 3 3 A a > + 0 0 0 19,-1.1 3,-0.6 -2,-0.3 4,-0.3 -0.648 59.7 24.8-120.1 172.7 8.4 21.4 19.8 4 4 A G B > >S-A 10 0A 2 6,-2.9 5,-2.7 1,-0.2 3,-1.7 -0.189 124.7 -18.3 72.1-157.9 11.9 22.8 19.4 5 5 A E G > 5S+ 0 0 163 1,-0.3 3,-1.0 3,-0.2 -1,-0.2 0.824 137.9 58.2 -51.5 -38.6 13.0 26.1 20.8 6 6 A Q G < 5S+ 0 0 77 -3,-0.6 -1,-0.3 1,-0.3 -2,-0.2 0.688 113.2 36.3 -70.7 -20.9 9.3 27.1 21.1 7 7 A G G X 5S- 0 0 0 -3,-1.7 3,-1.0 -4,-0.3 -1,-0.3 -0.141 124.9 -86.8-127.2 44.0 8.5 24.1 23.4 8 8 A S T < 5S- 0 0 66 -3,-1.0 -3,-0.2 1,-0.3 -2,-0.1 0.814 87.9 -53.5 53.6 43.7 11.6 23.7 25.6 9 9 A N T 3 - 0 0 0 4,-0.5 3,-0.8 -2,-0.3 179,-0.1 -0.528 34.3-104.0 -87.7 154.8 8.0 15.1 18.1 13 13 A P G > S+ 0 0 22 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.263 95.7 9.4 -69.0 155.3 6.8 11.6 18.3 14 14 A N G 3 S- 0 0 62 1,-0.3 223,-0.0 24,-0.1 -2,-0.0 0.682 127.1 -60.8 45.0 41.6 7.9 9.1 15.7 15 15 A N G < S+ 0 0 1 -3,-0.8 24,-2.5 1,-0.2 -1,-0.3 0.560 84.8 159.7 70.4 12.4 10.7 11.1 13.9 16 16 A L < - 0 0 24 -3,-2.1 -4,-0.5 22,-0.2 2,-0.3 -0.366 44.1-109.6 -67.8 146.8 8.3 13.8 12.8 17 17 A c E -C 25 0C 0 8,-1.7 8,-1.9 21,-0.2 2,-0.7 -0.575 16.7-137.7 -74.3 144.1 10.0 17.0 12.0 18 18 A a E -C 24 0C 0 19,-2.4 18,-3.0 -2,-0.3 19,-0.4 -0.902 28.1-140.6-101.0 113.8 9.7 20.0 14.2 19 19 A S > - 0 0 4 4,-2.3 3,-2.6 -2,-0.7 11,-0.1 -0.152 29.8 -96.2 -70.2 169.7 9.3 23.0 11.8 20 20 A Q T 3 S+ 0 0 75 13,-0.4 -1,-0.1 9,-0.3 14,-0.1 0.753 125.5 61.1 -58.3 -16.7 10.8 26.4 12.3 21 21 A Y T 3 S- 0 0 149 2,-0.1 -1,-0.3 9,-0.0 3,-0.1 0.475 118.4-106.6 -91.5 -5.8 7.5 27.3 13.8 22 22 A G S < S+ 0 0 0 -3,-2.6 -19,-1.1 1,-0.3 2,-0.4 0.810 78.5 124.4 86.3 29.7 7.6 24.7 16.7 23 23 A Y - 0 0 114 -21,-0.2 -4,-2.3 -4,-0.1 2,-0.3 -0.958 56.6-124.3-123.6 153.0 5.0 22.3 15.2 24 24 A b E +C 18 0C 38 -2,-0.4 2,-0.3 -6,-0.2 -6,-0.2 -0.738 52.2 104.2 -96.2 139.8 5.2 18.6 14.4 25 25 A G E -C 17 0C 0 -8,-1.9 -8,-1.7 -2,-0.3 2,-0.3 -0.945 55.1 -99.6 178.7-165.0 4.5 17.2 11.0 26 26 A M B +D 336 0D 6 310,-1.5 310,-2.1 -2,-0.3 3,-0.2 -0.896 67.4 58.9-140.9 151.6 6.0 15.7 7.8 27 27 A G S >> S- 0 0 4 -2,-0.3 4,-2.7 308,-0.3 3,-1.5 -0.365 99.8 -56.5 113.1 177.6 6.8 17.2 4.3 28 28 A G H 3> S+ 0 0 23 306,-0.3 4,-0.5 1,-0.3 -1,-0.1 0.594 128.9 63.2 -69.0 -15.3 9.0 20.1 3.2 29 29 A D H 34 S+ 0 0 109 -3,-0.2 -9,-0.3 2,-0.1 -1,-0.3 0.646 119.1 25.1 -80.5 -25.5 7.2 22.6 5.5 30 30 A Y H <4 S+ 0 0 25 -3,-1.5 -2,-0.2 -11,-0.1 6,-0.2 0.748 133.3 35.0-104.3 -44.7 8.3 20.7 8.6 31 31 A c H < S+ 0 0 0 -4,-2.7 10,-2.1 -14,-0.1 11,-0.5 0.636 104.5 76.3 -90.8 -21.5 11.5 19.0 7.4 32 32 A G S >< S- 0 0 12 -4,-0.5 3,-1.6 -5,-0.4 10,-0.2 0.338 97.8 -8.0 -70.7-150.9 12.9 21.5 5.1 33 33 A K T 3 S+ 0 0 172 1,-0.3 -13,-0.4 -5,-0.1 -1,-0.2 -0.137 131.3 17.6 -50.4 135.8 14.6 24.6 6.0 34 34 A G T 3 S+ 0 0 36 1,-0.3 -1,-0.3 -15,-0.1 -2,-0.1 0.405 79.2 159.7 76.4 10.0 14.6 25.5 9.6 35 35 A d < - 0 0 13 -3,-1.6 -1,-0.3 -4,-0.3 -16,-0.2 -0.382 21.8-166.7 -59.2 134.9 13.7 22.0 10.9 36 36 A Q - 0 0 44 -18,-3.0 2,-0.3 1,-0.3 -17,-0.1 0.804 57.7 -12.4 -97.7 -36.1 14.7 21.7 14.6 37 37 A N S S+ 0 0 6 -19,-0.4 -19,-2.4 -21,-0.1 -1,-0.3 -0.870 97.7 46.4-160.0 171.7 14.4 17.9 15.4 38 38 A G S S- 0 0 2 -2,-0.3 2,-2.4 -21,-0.2 -21,-0.2 -0.418 113.1 -8.0 82.3-154.1 13.1 14.7 14.0 39 39 A A S S+ 0 0 3 -24,-2.5 -22,-0.2 -2,-0.2 -1,-0.1 -0.176 80.5 176.7 -70.5 47.4 13.7 13.6 10.4 40 40 A d - 0 0 17 -2,-2.4 -8,-0.1 -24,-0.1 254,-0.1 -0.219 35.6-134.7 -55.4 144.4 15.2 16.9 9.2 41 41 A W S S+ 0 0 56 -10,-2.1 2,-0.9 1,-0.2 -9,-0.1 0.876 100.5 57.6 -71.7 -33.5 16.4 17.0 5.6 42 42 A T S S- 0 0 84 -11,-0.5 -1,-0.2 -10,-0.2 -2,-0.1 -0.822 92.6-137.2-100.0 101.1 19.6 18.7 6.8 43 43 A S - 0 0 30 -2,-0.9 25,-0.1 1,-0.1 -2,-0.1 -0.222 19.5-119.2 -52.3 136.0 21.2 16.4 9.4 44 44 A K - 0 0 61 1,-0.1 23,-1.9 -4,-0.1 2,-0.2 -0.282 26.1-116.7 -72.7 159.3 22.6 18.1 12.5 45 45 A R B +E 66 0E 80 21,-0.2 2,-0.3 9,-0.1 21,-0.3 -0.637 43.2 158.7 -93.4 157.2 26.3 17.9 13.3 46 46 A e + 0 0 0 19,-1.8 3,-0.5 -2,-0.2 4,-0.3 -0.901 27.6 43.2-163.2-176.8 27.5 16.1 16.4 47 47 A G S > >S- 0 0 10 6,-2.7 3,-2.1 -2,-0.3 5,-1.0 -0.067 112.8 -22.8 66.1-159.1 30.4 14.4 18.2 48 48 A S G > 5S+ 0 0 91 1,-0.3 3,-1.5 3,-0.2 -1,-0.2 0.823 133.8 61.9 -54.8 -41.2 33.9 15.8 18.1 49 49 A Q G 3 5S+ 0 0 78 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.2 0.724 114.4 35.4 -58.6 -27.7 33.3 17.7 14.9 50 50 A A G X 5S- 0 0 41 -3,-2.1 3,-0.9 -4,-0.3 -1,-0.3 -0.096 122.1-100.9-119.9 30.9 30.7 19.8 16.7 51 51 A G T < 5S- 0 0 72 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.907 81.5 -42.3 46.9 62.7 32.3 19.9 20.1 52 52 A G T 3 - 0 0 5 4,-0.4 3,-0.5 -2,-0.2 140,-0.1 -0.526 32.4-119.7 -76.1 157.7 21.9 14.2 18.3 56 56 A T G > S+ 0 0 38 1,-0.2 3,-1.7 -2,-0.2 -1,-0.1 -0.396 93.6 30.5 -85.5 170.3 18.2 14.8 19.0 57 57 A N G 3 S- 0 0 1 1,-0.3 -1,-0.2 -2,-0.1 -20,-0.0 0.720 126.8 -75.7 53.6 34.1 15.7 11.9 19.0 58 58 A N G < S+ 0 0 11 -3,-0.5 -1,-0.3 1,-0.2 2,-0.1 0.814 83.4 163.2 48.2 40.1 18.4 9.4 20.1 59 59 A Q < - 0 0 11 -3,-1.7 -4,-0.4 22,-0.1 2,-0.2 -0.475 41.4-102.2 -81.7 161.5 20.0 9.4 16.6 60 60 A g E -F 68 0F 0 8,-2.1 8,-1.6 21,-0.2 2,-0.7 -0.526 21.5-137.2 -85.2 145.2 23.4 8.0 16.1 61 61 A e E -FG 67 80F 4 19,-2.2 18,-3.5 -2,-0.2 19,-0.7 -0.893 26.5-142.9-105.1 108.7 26.4 10.3 15.6 62 62 A S > - 0 0 4 4,-2.7 3,-2.3 -2,-0.7 11,-0.1 -0.254 28.0 -98.7 -69.4 168.7 28.5 8.9 12.8 63 63 A Q T 3 S+ 0 0 92 13,-0.5 -1,-0.1 9,-0.4 14,-0.1 0.803 126.5 54.3 -57.3 -27.9 32.4 8.9 12.7 64 64 A Y T 3 S- 0 0 143 2,-0.1 -1,-0.3 -16,-0.1 14,-0.1 0.433 121.8-105.7 -92.0 0.2 32.0 12.0 10.5 65 65 A G S < S+ 0 0 0 -3,-2.3 -19,-1.8 1,-0.3 2,-0.4 0.783 75.6 126.1 81.3 36.4 29.8 13.9 13.0 66 66 A Y B -E 45 0E 37 -21,-0.3 -4,-2.7 7,-0.1 -1,-0.3 -0.953 54.9-123.6-125.1 145.8 26.4 13.7 11.4 67 67 A f E +F 61 0F 1 -23,-1.9 2,-0.3 -2,-0.4 -6,-0.2 -0.691 53.7 103.2 -88.5 133.9 23.2 12.5 12.9 68 68 A G E -F 60 0F 0 -8,-1.6 -8,-2.1 -2,-0.3 2,-0.3 -0.954 57.1 -97.7 174.9-172.8 21.1 9.6 11.4 69 69 A F B +H 293 0G 4 224,-0.9 224,-1.2 -2,-0.3 3,-0.2 -0.862 68.6 58.1-126.4 165.5 20.2 5.9 11.7 70 70 A G S >> S- 0 0 11 -2,-0.3 4,-3.0 222,-0.2 3,-1.8 -0.278 99.2 -51.5 100.3 170.9 21.5 2.9 9.8 71 71 A A H 3> S+ 0 0 34 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.758 129.5 55.5 -52.9 -37.8 25.0 1.3 9.5 72 72 A E H 34 S+ 0 0 92 -3,-0.2 -9,-0.4 2,-0.2 -1,-0.3 0.599 119.7 32.4 -72.9 -22.6 26.8 4.5 8.4 73 73 A Y H <4 S+ 0 0 9 -3,-1.8 6,-0.2 -11,-0.1 -2,-0.2 0.802 131.4 28.6 -98.7 -43.9 25.7 6.3 11.4 74 74 A g H < S+ 0 0 5 -4,-3.0 10,-2.8 -14,-0.1 11,-0.4 0.414 110.3 71.5 -96.6 -12.5 25.5 3.7 14.2 75 75 A G S >< S+ 0 0 18 -4,-1.6 3,-2.2 -5,-0.4 10,-0.2 0.252 95.5 4.0 -77.0-144.3 28.2 1.2 12.9 76 76 A A T 3 S+ 0 0 87 1,-0.3 -13,-0.5 8,-0.1 -1,-0.2 -0.031 133.3 7.8 -48.8 127.4 31.9 1.7 12.9 77 77 A G T 3 S+ 0 0 50 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.506 81.6 166.1 74.3 10.3 33.2 4.8 14.6 78 78 A h < - 0 0 24 -3,-2.2 -16,-0.3 1,-0.1 -1,-0.2 -0.295 20.8-163.7 -50.7 138.4 29.7 5.8 15.9 79 79 A Q - 0 0 70 -18,-3.5 2,-0.3 1,-0.3 -1,-0.1 0.409 58.0 -19.6-107.6 -8.9 30.4 8.5 18.4 80 80 A G B S+G 61 0F 9 -19,-0.7 -19,-2.2 -34,-0.0 -1,-0.3 -0.962 92.2 61.1 175.0 170.9 27.1 8.5 20.3 81 81 A G S S- 0 0 14 -2,-0.3 2,-2.2 -21,-0.2 -21,-0.2 -0.393 112.4 -21.2 86.4-161.8 23.4 7.6 20.4 82 82 A P S S- 0 0 16 0, 0.0 -22,-0.1 0, 0.0 -1,-0.1 -0.347 82.0-177.1 -83.9 67.3 22.6 3.9 20.1 83 83 A h - 0 0 9 -2,-2.2 -8,-0.2 1,-0.1 4,-0.2 -0.109 34.9-121.7 -56.2 158.5 25.8 2.7 18.5 84 84 A R S S+ 0 0 61 -10,-2.8 2,-0.2 -9,-0.2 -9,-0.1 0.741 92.7 79.1 -79.7 -28.4 26.2 -0.9 17.5 85 85 A A S S- 0 0 67 -11,-0.4 2,-0.4 -10,-0.2 166,-0.1 -0.540 98.1-103.8 -76.3 150.5 29.3 -1.3 19.7 86 86 A D - 0 0 79 -2,-0.2 2,-0.6 165,-0.1 -2,-0.1 -0.620 41.5-134.0 -73.8 123.9 28.7 -1.8 23.4 87 87 A I - 0 0 48 -2,-0.4 23,-2.1 23,-0.4 2,-0.1 -0.807 15.7-137.8 -89.3 121.6 29.5 1.6 24.9 88 88 A K B +I 109 0H 120 -2,-0.6 2,-0.3 21,-0.2 21,-0.2 -0.379 31.9 152.4 -82.0 149.0 31.7 1.6 28.0 89 89 A i > + 0 0 0 19,-1.9 3,-0.6 -2,-0.1 5,-0.2 -0.971 34.3 27.2-157.9 175.7 31.2 3.7 31.0 90 90 A G B > >S-J 96 0I 5 6,-2.8 5,-2.4 -2,-0.3 3,-1.3 -0.319 119.1 -13.0 64.8-139.2 31.7 4.1 34.7 91 91 A S G > 5S+ 0 0 96 1,-0.3 3,-2.0 3,-0.3 2,-0.4 0.935 132.9 63.8 -55.7 -47.3 34.5 2.4 36.5 92 92 A Q G < 5S+ 0 0 91 -3,-0.6 -1,-0.3 1,-0.3 -2,-0.2 0.244 115.8 31.6 -63.9 18.5 35.1 0.2 33.4 93 93 A A G X 5S- 0 0 36 -3,-1.3 3,-0.6 -2,-0.4 -1,-0.3 0.084 127.0 -87.0-167.5 27.7 36.0 3.4 31.6 94 94 A G T < 5S- 0 0 77 -3,-2.0 -3,-0.3 1,-0.2 -2,-0.1 0.883 87.5 -50.9 58.5 51.0 37.5 5.6 34.3 95 95 A G T 3 - 0 0 6 4,-0.4 3,-0.7 -2,-0.2 2,-0.1 -0.600 40.8-103.6 -75.8 149.9 27.0 7.7 29.3 99 99 A P G > S+ 0 0 52 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.440 94.0 16.7 -74.0 150.5 25.5 10.2 27.0 100 100 A N G 3 S- 0 0 23 1,-0.3 3,-0.1 -2,-0.1 -42,-0.0 0.783 127.5 -63.7 58.4 41.1 22.0 11.5 27.2 101 101 A N G < S+ 0 0 24 -3,-0.7 24,-2.8 1,-0.2 -1,-0.3 0.468 86.4 160.6 67.0 8.7 21.2 10.3 30.8 102 102 A L < - 0 0 18 -3,-1.5 -4,-0.4 22,-0.2 2,-0.3 -0.248 45.4-102.5 -59.7 155.9 21.6 6.7 29.7 103 103 A k E -K 111 0J 0 8,-2.0 8,-1.9 21,-0.2 2,-0.7 -0.572 20.2-141.0 -76.7 138.3 22.3 4.3 32.6 104 104 A i E -KL 110 123J 0 19,-2.2 18,-3.2 -2,-0.3 19,-0.6 -0.905 28.6-141.2 -96.6 113.9 25.8 3.0 33.3 105 105 A S > - 0 0 2 4,-3.0 3,-2.3 -2,-0.7 11,-0.1 -0.224 24.6 -99.8 -73.3 175.9 25.2 -0.7 34.3 106 106 A Q T 3 S+ 0 0 89 9,-0.3 -1,-0.1 13,-0.3 -15,-0.1 0.771 125.1 51.6 -58.6 -32.6 27.1 -2.5 37.0 107 107 A W T 3 S- 0 0 143 2,-0.1 -1,-0.3 -16,-0.1 -18,-0.1 0.330 123.6-102.9 -88.5 -1.9 29.3 -4.1 34.3 108 108 A G S < S+ 0 0 0 -3,-2.3 -19,-1.9 1,-0.3 2,-0.3 0.770 76.4 126.5 87.1 37.3 30.1 -0.8 32.7 109 109 A F B -I 88 0H 78 -21,-0.2 -4,-3.0 7,-0.0 2,-0.4 -0.925 54.8-122.5-126.8 146.3 27.9 -0.7 29.6 110 110 A j E +K 104 0J 10 -23,-2.1 -23,-0.4 -2,-0.3 2,-0.3 -0.728 52.5 112.9 -90.0 136.7 25.4 2.1 28.6 111 111 A G E -K 103 0J 0 -8,-1.9 -8,-2.0 -2,-0.4 2,-0.3 -0.904 53.9-107.7-174.3-167.4 21.8 1.4 28.1 112 112 A L B +M 250 0K 6 138,-1.6 138,-1.6 -2,-0.3 2,-0.2 -0.956 68.7 58.8-143.9 140.8 18.2 1.9 29.3 113 113 A G S >> S- 0 0 9 -2,-0.3 4,-2.4 136,-0.2 3,-1.4 -0.388 98.2 -56.7 122.1 168.8 16.0 -0.7 31.0 114 114 A S H 3> S+ 0 0 79 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.809 127.7 58.3 -45.9 -55.7 16.2 -2.8 34.2 115 115 A E H 34 S+ 0 0 80 1,-0.2 -9,-0.3 2,-0.2 -1,-0.3 0.715 121.4 28.1 -53.8 -25.4 19.5 -4.5 33.4 116 116 A F H <4 S+ 0 0 6 -3,-1.4 6,-0.2 -11,-0.1 -1,-0.2 0.687 127.8 37.3-102.4 -39.5 21.2 -1.1 33.1 117 117 A k H < S+ 0 0 10 -4,-2.4 10,-3.9 -14,-0.1 11,-0.6 0.482 107.1 70.0 -93.7 -14.3 19.2 1.2 35.4 118 118 A G S >< S+ 0 0 15 -4,-2.4 3,-1.8 -5,-0.3 -12,-0.2 -0.175 96.5 1.8 -92.0-166.8 18.5 -1.2 38.3 119 119 A G T 3 S+ 0 0 55 1,-0.3 -13,-0.3 -2,-0.1 -1,-0.2 0.300 134.2 12.6 -19.3 104.4 20.7 -2.8 40.8 120 120 A G T 3 S+ 0 0 43 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.254 80.4 161.1 102.5 -2.4 24.3 -1.6 40.5 121 121 A l < - 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