==== 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 LIGASE 06-JUL-10 3NUA . COMPND 2 MOLECULE: PHOSPHORIBOSYLAMINOIMIDAZOLE-SUCCINOCARBOXAMIDE S . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM PERFRINGENS; . AUTHOR Y.KIM,R.MULLIGAN,K.KWON,W.F.ANDERSON,A.JOACHIMIAK . 473 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21939.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 357 75.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 130 27.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.3 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 . 6 1.3 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 . 42 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 119 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 3.0 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 2 0 3 1 0 0 0 0 2 0 0 0 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 . 2 4 2 6 8 0 0 2 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 0 2 2 2 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 0 A A 0 0 156 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-120.0 52.7 -20.6 4.7 2 1 A M - 0 0 132 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.129 360.0-111.0 -56.9 137.1 50.6 -22.0 1.9 3 2 A V - 0 0 31 1,-0.1 2,-0.5 17,-0.0 -1,-0.1 -0.250 34.0-122.8 -53.6 153.1 47.4 -23.8 3.0 4 3 A N - 0 0 94 0, 0.0 17,-1.2 0, 0.0 2,-0.4 -0.922 13.4-126.3-111.8 131.0 47.6 -27.6 2.5 5 4 A Q E +A 20 0A 86 -2,-0.5 15,-0.3 15,-0.2 3,-0.1 -0.602 37.0 170.8 -73.8 128.3 45.0 -29.5 0.4 6 5 A L E - 0 0 88 13,-2.9 -1,-0.1 -2,-0.4 14,-0.1 0.059 41.8 -11.2-114.2-137.4 43.4 -32.4 2.3 7 6 A E E - 0 0 116 11,-0.1 12,-3.2 1,-0.1 2,-0.4 -0.261 68.2-106.2 -72.1 149.9 40.5 -34.7 1.5 8 7 A M E -A 18 0A 84 10,-0.2 10,-0.3 1,-0.2 3,-0.1 -0.552 30.5-173.9 -67.1 127.6 38.1 -34.2 -1.3 9 8 A L E - 0 0 74 8,-2.8 2,-0.3 -2,-0.4 9,-0.2 0.807 65.7 -5.3 -87.6 -35.6 34.7 -33.1 0.1 10 9 A Y E -A 17 0A 137 7,-1.7 7,-3.1 2,-0.0 2,-0.6 -0.957 50.4-149.2-163.3 137.0 32.7 -33.2 -3.1 11 10 A E E -A 16 0A 89 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.954 27.4-177.7-111.9 114.0 33.0 -33.9 -6.8 12 11 A G - 0 0 15 3,-3.0 -2,-0.0 -2,-0.6 0, 0.0 -0.236 46.0 -83.5 -95.0-168.7 30.6 -31.9 -8.9 13 12 A K S S+ 0 0 77 1,-0.1 3,-0.1 -2,-0.1 -1,-0.0 0.802 123.6 9.4 -65.4 -30.9 29.9 -31.9 -12.6 14 13 A A S S+ 0 0 16 1,-0.2 17,-2.5 18,-0.1 2,-0.3 0.629 126.6 33.5-124.9 -26.4 32.7 -29.3 -13.3 15 14 A K E - B 0 30A 24 15,-0.2 -3,-3.0 17,-0.1 2,-0.4 -0.920 59.6-135.7-133.1 159.0 34.8 -28.9 -10.1 16 15 A K E -AB 11 29A 52 13,-2.3 13,-3.0 -2,-0.3 2,-0.5 -0.905 17.0-145.7-106.9 145.2 36.0 -30.7 -7.1 17 16 A I E -AB 10 28A 44 -7,-3.1 -8,-2.8 -2,-0.4 -7,-1.7 -0.967 19.0-166.1-107.6 120.3 35.9 -29.1 -3.6 18 17 A Y E -AB 8 27A 37 9,-3.0 9,-2.4 -2,-0.5 -10,-0.2 -0.894 17.0-128.4-107.3 140.0 38.8 -30.1 -1.3 19 18 A A E - B 0 26A 10 -12,-3.2 -13,-2.9 -2,-0.4 2,-0.2 -0.313 27.3-158.8 -64.8 160.4 39.1 -29.6 2.4 20 19 A T E -A 5 0A 12 5,-0.7 -15,-0.2 2,-0.5 -13,-0.1 -0.780 37.4 -93.2-129.7 179.0 42.3 -27.9 3.6 21 20 A D S S+ 0 0 69 -17,-1.2 2,-0.5 -2,-0.2 -16,-0.1 0.434 109.9 78.7 -75.7 1.2 44.2 -27.7 6.9 22 21 A K S > S- 0 0 110 -18,-0.2 3,-1.8 3,-0.2 -2,-0.5 -0.958 78.3-145.8-105.6 127.3 42.1 -24.6 7.7 23 22 A E T 3 S+ 0 0 190 -2,-0.5 -1,-0.1 1,-0.3 -2,-0.0 0.684 97.4 48.4 -68.4 -16.9 38.6 -25.5 8.8 24 23 A D T 3 S+ 0 0 72 60,-0.0 61,-2.5 -5,-0.0 2,-0.3 0.222 102.4 74.5-106.4 13.9 37.1 -22.4 7.1 25 24 A M E < - C 0 84A 32 -3,-1.8 -5,-0.7 59,-0.3 2,-0.3 -0.950 51.8-175.6-126.3 147.9 38.8 -22.7 3.7 26 25 A V E -BC 19 83A 9 57,-2.9 57,-2.9 -2,-0.3 2,-0.5 -0.917 22.7-128.8-128.6 161.5 38.4 -25.0 0.7 27 26 A I E -BC 18 82A 6 -9,-2.4 -9,-3.0 -2,-0.3 2,-0.6 -0.966 17.0-151.5-108.7 127.7 40.2 -25.5 -2.6 28 27 A V E -BC 17 81A 6 53,-2.8 53,-2.0 -2,-0.5 2,-0.5 -0.905 12.3-163.4 -98.7 119.0 38.1 -25.3 -5.7 29 28 A H E -BC 16 80A 40 -13,-3.0 -13,-2.3 -2,-0.6 2,-0.6 -0.932 9.6-142.5-110.6 121.4 39.6 -27.5 -8.5 30 29 A Y E -B 15 0A 3 49,-2.8 -15,-0.2 -2,-0.5 2,-0.1 -0.728 16.5-162.2 -90.8 120.2 38.4 -26.9 -12.0 31 30 A K - 0 0 16 -17,-2.5 -18,-0.0 -2,-0.6 -1,-0.0 -0.405 29.3-121.9 -86.8 170.2 38.1 -30.0 -14.2 32 31 A D S S+ 0 0 21 16,-0.2 13,-2.6 -2,-0.1 16,-0.2 0.411 72.0 126.6 -89.1 2.9 37.9 -30.2 -18.0 33 32 A D E -E 44 0B 40 -19,-0.2 2,-0.4 11,-0.2 11,-0.2 -0.371 41.5-166.9 -62.2 131.9 34.6 -32.0 -17.7 34 33 A A E +E 43 0B 2 9,-2.9 9,-1.9 -2,-0.1 2,-0.3 -0.966 10.1 177.0-117.9 139.8 31.7 -30.4 -19.7 35 34 A T E +E 42 0B 10 -2,-0.4 2,-0.3 7,-0.2 7,-0.2 -0.987 6.8 161.4-141.3 150.7 28.1 -31.4 -19.0 36 35 A A E > +E 41 0B 11 5,-2.1 5,-2.3 -2,-0.3 4,-0.2 -0.969 49.4 42.4-156.8 168.4 24.7 -30.4 -20.2 37 36 A F T > 5S- 0 0 117 -2,-0.3 3,-1.8 1,-0.2 -1,-0.1 0.919 126.6 -46.7 58.9 54.4 21.1 -31.7 -20.4 38 37 A N T 3 5S- 0 0 119 1,-0.3 -1,-0.2 2,-0.1 93,-0.0 0.884 110.6 -54.0 58.3 39.6 20.6 -33.1 -17.0 39 38 A G T 3 5S+ 0 0 27 2,-0.2 -1,-0.3 1,-0.1 -2,-0.2 0.337 115.1 112.6 84.4 -5.0 23.8 -35.0 -17.1 40 39 A E T < 5 + 0 0 165 -3,-1.8 2,-0.5 -4,-0.2 -3,-0.2 0.793 69.3 54.3 -72.8 -30.4 23.0 -36.7 -20.4 41 40 A K E < +E 36 0B 48 -5,-2.3 -5,-2.1 2,-0.0 2,-0.3 -0.923 68.3 163.7-111.7 127.8 25.6 -34.9 -22.5 42 41 A K E +E 35 0B 137 -2,-0.5 2,-0.3 -7,-0.2 -7,-0.2 -0.985 5.7 155.9-141.5 150.9 29.3 -35.0 -21.4 43 42 A A E -E 34 0B 40 -9,-1.9 -9,-2.9 -2,-0.3 2,-0.5 -0.966 39.1-115.6-159.0 163.5 32.7 -34.4 -22.9 44 43 A Q E -E 33 0B 128 -2,-0.3 2,-0.7 -11,-0.2 -11,-0.2 -0.953 26.2-164.4-100.7 128.3 36.2 -33.5 -21.9 45 44 A I > - 0 0 21 -13,-2.6 3,-2.4 -2,-0.5 4,-0.4 -0.924 26.5-121.4-115.4 106.7 37.2 -30.1 -23.3 46 45 A E T 3 S+ 0 0 170 -2,-0.7 178,-0.0 1,-0.3 -2,-0.0 -0.232 89.5 0.7 -58.4 131.2 40.9 -29.8 -23.0 47 46 A S T 3> S+ 0 0 23 1,-0.1 4,-2.3 3,-0.0 -1,-0.3 0.313 90.9 122.5 73.7 1.7 42.0 -26.7 -20.9 48 47 A K H <> S+ 0 0 2 -3,-2.4 4,-2.7 1,-0.2 5,-0.2 0.894 73.6 51.4 -57.2 -41.0 38.4 -25.7 -20.1 49 48 A G H > S+ 0 0 0 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.880 108.4 51.2 -65.2 -37.7 39.1 -25.9 -16.4 50 49 A V H > S+ 0 0 22 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.948 112.7 45.0 -63.4 -50.0 42.2 -23.7 -16.7 51 50 A L H X S+ 0 0 4 -4,-2.3 4,-2.9 2,-0.2 5,-0.3 0.920 114.4 49.2 -62.9 -40.6 40.3 -21.0 -18.6 52 51 A N H X S+ 0 0 1 -4,-2.7 4,-2.8 -5,-0.2 5,-0.3 0.919 111.8 48.2 -67.8 -38.3 37.4 -21.2 -16.2 53 52 A N H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.927 114.7 46.6 -62.1 -43.9 39.6 -20.9 -13.1 54 53 A E H X S+ 0 0 37 -4,-2.6 4,-2.2 24,-0.2 -2,-0.2 0.913 115.7 44.3 -66.0 -44.6 41.5 -18.0 -14.7 55 54 A I H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.946 114.9 48.1 -66.7 -47.2 38.3 -16.2 -15.7 56 55 A T H X S+ 0 0 0 -4,-2.8 4,-3.0 -5,-0.3 5,-0.2 0.930 112.4 49.7 -57.8 -46.1 36.5 -16.8 -12.4 57 56 A S H X S+ 0 0 6 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.912 111.4 48.4 -61.7 -44.5 39.6 -15.6 -10.5 58 57 A L H X S+ 0 0 45 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.945 114.8 45.8 -60.4 -45.0 39.9 -12.4 -12.6 59 58 A I H X S+ 0 0 0 -4,-2.6 4,-2.6 136,-0.2 -2,-0.2 0.918 113.0 47.9 -68.8 -43.8 36.2 -11.7 -12.1 60 59 A F H X S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 -1,-0.2 0.860 109.2 53.6 -68.5 -33.2 36.1 -12.4 -8.3 61 60 A E H X S+ 0 0 135 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.939 110.9 48.0 -63.6 -41.9 39.2 -10.3 -7.7 62 61 A M H X S+ 0 0 41 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.938 112.9 47.2 -61.1 -45.3 37.4 -7.4 -9.6 63 62 A L H <>S+ 0 0 0 -4,-2.6 5,-2.5 1,-0.2 -1,-0.2 0.905 110.0 52.9 -67.2 -38.7 34.2 -8.0 -7.5 64 63 A N H ><5S+ 0 0 58 -4,-2.8 3,-1.7 1,-0.2 -1,-0.2 0.931 108.6 50.5 -57.2 -46.1 36.3 -8.1 -4.3 65 64 A K H 3<5S+ 0 0 187 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.858 106.0 56.2 -61.0 -36.4 37.9 -4.8 -5.2 66 65 A E T 3<5S- 0 0 119 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.378 124.5-103.2 -79.1 4.0 34.4 -3.3 -5.9 67 66 A G T < 5S+ 0 0 58 -3,-1.7 2,-0.4 1,-0.3 -3,-0.2 0.570 71.6 144.8 88.7 10.2 33.3 -4.2 -2.3 68 67 A I < - 0 0 17 -5,-2.5 2,-0.6 -6,-0.2 -1,-0.3 -0.667 52.6-124.4 -77.4 135.0 31.2 -7.3 -3.1 69 68 A K + 0 0 115 -2,-0.4 122,-2.5 120,-0.2 2,-0.3 -0.718 46.4 163.6 -81.1 118.6 31.6 -9.9 -0.3 70 69 A T B -f 191 0C 7 -2,-0.6 122,-0.2 120,-0.3 14,-0.1 -0.855 50.8-118.2-132.1 169.2 32.8 -13.1 -1.9 71 70 A H S S+ 0 0 9 120,-2.6 13,-2.7 -2,-0.3 2,-0.3 0.553 75.1 115.4 -77.2 -8.6 34.3 -16.4 -1.1 72 71 A F E +D 83 0A 13 119,-0.3 11,-0.2 11,-0.2 -2,-0.2 -0.501 25.5 157.8 -82.5 126.5 37.4 -15.8 -3.2 73 72 A V E - 0 0 60 9,-2.3 2,-0.3 -2,-0.3 10,-0.2 0.802 61.4 -33.4-104.3 -59.3 40.8 -15.5 -1.6 74 73 A E E -D 82 0A 92 8,-1.6 8,-3.2 0, 0.0 2,-0.3 -0.976 50.3-105.8-164.1 151.6 43.4 -16.3 -4.2 75 74 A K E -D 81 0A 75 -2,-0.3 6,-0.3 6,-0.2 3,-0.1 -0.639 30.4-174.4 -73.8 137.0 44.2 -18.3 -7.3 76 75 A L - 0 0 35 4,-2.8 2,-0.3 1,-0.3 5,-0.2 0.804 57.4 -27.3-103.8 -39.3 46.7 -21.1 -6.4 77 76 A N S S- 0 0 73 3,-1.6 -1,-0.3 -27,-0.0 3,-0.0 -0.874 87.5 -59.8-162.1-171.7 47.6 -22.7 -9.8 78 77 A D S S+ 0 0 98 -2,-0.3 -24,-0.2 1,-0.2 -25,-0.2 0.820 133.2 18.6 -55.5 -34.9 46.2 -23.2 -13.3 79 78 A R S S+ 0 0 63 -26,-0.1 -49,-2.8 -27,-0.1 2,-0.3 0.591 113.1 75.5-109.7 -14.7 43.2 -25.2 -12.0 80 79 A D E -C 29 0A 17 -51,-0.2 -4,-2.8 -53,-0.0 -3,-1.6 -0.815 45.2-178.2-115.4 144.1 42.8 -24.3 -8.3 81 80 A Q E -CD 28 75A 0 -53,-2.0 -53,-2.8 -2,-0.3 2,-0.5 -0.986 25.8-127.2-133.7 148.8 41.6 -21.5 -6.2 82 81 A L E +CD 27 74A 10 -8,-3.2 -9,-2.3 -2,-0.3 -8,-1.6 -0.823 38.2 171.2 -92.0 124.7 41.5 -20.9 -2.4 83 82 A C E -CD 26 72A 0 -57,-2.9 -57,-2.9 -2,-0.5 -11,-0.2 -0.928 39.5 -97.8-133.0 155.7 38.1 -19.9 -1.1 84 83 A K E -C 25 0A 68 -13,-2.7 2,-0.6 -2,-0.3 -59,-0.3 -0.511 46.2-114.2 -64.6 140.5 36.3 -19.4 2.1 85 84 A K - 0 0 99 -61,-2.5 2,-0.3 -2,-0.2 -1,-0.1 -0.686 45.3-179.0 -79.8 117.4 34.2 -22.5 3.0 86 85 A V - 0 0 29 -2,-0.6 2,-0.9 99,-0.1 99,-0.2 -0.827 36.3-117.4-116.7 160.7 30.6 -21.5 2.8 87 86 A E E -G 184 0C 118 97,-2.3 97,-2.6 -2,-0.3 2,-0.1 -0.858 43.3-132.3 -92.7 105.8 27.2 -23.2 3.4 88 87 A I E -G 183 0C 63 -2,-0.9 95,-0.3 95,-0.3 93,-0.0 -0.361 5.4-130.5 -65.2 131.7 25.7 -22.9 -0.0 89 88 A V - 0 0 1 93,-2.9 2,-2.6 2,-0.1 93,-0.4 -0.724 29.7-120.8 -76.6 129.1 22.1 -21.7 -0.2 90 89 A P S S+ 0 0 39 0, 0.0 35,-2.4 0, 0.0 2,-0.4 -0.209 77.4 102.3 -80.5 54.4 20.4 -24.3 -2.5 91 90 A L E -I 124 0D 2 -2,-2.6 2,-0.6 33,-0.2 91,-0.4 -0.999 63.0-142.9-133.3 133.7 19.3 -21.8 -5.2 92 91 A E E -I 123 0D 15 31,-3.1 31,-2.3 -2,-0.4 2,-0.7 -0.894 23.1-151.3 -90.1 121.4 20.7 -21.0 -8.6 93 92 A V E -IJ 122 180D 1 87,-2.8 87,-3.0 -2,-0.6 2,-0.5 -0.863 15.9-167.1-101.3 110.0 20.2 -17.2 -8.9 94 93 A I E -IJ 121 179D 25 27,-2.9 27,-2.5 -2,-0.7 2,-0.4 -0.847 10.2-165.3-107.1 130.2 19.8 -16.4 -12.6 95 94 A V E -IJ 120 178D 0 83,-2.6 83,-2.0 -2,-0.5 2,-0.5 -0.952 3.5-168.9-108.2 134.2 19.9 -12.9 -14.1 96 95 A R E +IJ 119 177D 8 23,-2.5 23,-2.6 -2,-0.4 81,-0.2 -0.960 17.4 170.6-124.9 114.7 18.7 -12.4 -17.6 97 96 A N E S+ 0 0 29 79,-2.3 18,-0.6 -2,-0.5 2,-0.3 0.755 84.1 19.8 -84.0 -28.5 19.4 -9.1 -19.3 98 97 A V E S-I 114 0D 33 78,-1.8 2,-0.4 16,-0.1 -1,-0.3 -0.964 95.5-104.0-135.5 146.4 18.2 -10.4 -22.6 99 98 A A E +I 113 0D 0 14,-2.5 13,-2.9 -2,-0.3 14,-0.6 -0.635 60.4 133.9 -77.7 126.9 15.9 -13.4 -23.1 100 99 A A >> + 0 0 0 -2,-0.4 4,-1.4 11,-0.2 3,-1.1 -0.892 47.1 13.2-153.2 179.0 17.7 -16.5 -24.3 101 100 A G H 3> S+ 0 0 11 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 -0.101 124.7 1.0 49.7-129.4 18.1 -20.2 -23.6 102 101 A S H 3> S+ 0 0 68 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.833 133.5 51.8 -70.1 -33.2 15.4 -21.7 -21.4 103 102 A M H <> S+ 0 0 3 -3,-1.1 4,-1.8 2,-0.2 6,-0.3 0.954 112.6 45.9 -65.1 -46.5 13.4 -18.5 -20.9 104 103 A A H X>S+ 0 0 2 -4,-1.4 5,-2.6 1,-0.2 4,-0.6 0.948 115.0 47.8 -62.9 -43.9 13.2 -17.9 -24.6 105 104 A K H ><5S+ 0 0 186 -4,-2.6 3,-0.8 1,-0.2 -1,-0.2 0.923 114.2 44.4 -62.3 -46.5 12.2 -21.5 -25.3 106 105 A R H 3<5S+ 0 0 72 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.752 117.9 43.1 -78.3 -21.2 9.5 -21.8 -22.7 107 106 A L H 3<5S- 0 0 9 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.349 111.4-116.4-103.5 8.7 7.9 -18.5 -23.4 108 107 A G T <<5 + 0 0 59 -3,-0.8 2,-0.3 -4,-0.6 -3,-0.2 0.844 66.0 143.6 63.4 36.1 8.1 -18.9 -27.2 109 108 A L < - 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