==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GTP-BINDING PROTEIN 08-JAN-13 3ZID . COMPND 2 MOLECULE: TUBULIN/FTSZ, GTPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOSAETA THERMOPHILA; . AUTHOR C.H.S.AYLETT,L.A.AMOS,J.LOWE . 702 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34002.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 571 81.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 83 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 5.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 63 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 292 41.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 2 2 0 3 1 1 1 2 0 0 0 3 2 0 0 0 1 1 1 0 0 1 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 2 0 2 2 2 1 3 2 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 0 0 0 0 0 2 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 . 0 0 0 0 0 0 0 0 0 2 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 M 0 0 114 0, 0.0 2,-0.5 0, 0.0 206,-0.1 0.000 360.0 360.0 360.0 -14.9 5.7 -1.3 11.6 2 2 A L - 0 0 0 195,-0.1 33,-1.2 93,-0.0 2,-0.8 -0.806 360.0-150.5-105.0 123.1 6.8 -1.8 8.0 3 3 A N E -a 35 0A 46 -2,-0.5 93,-2.4 31,-0.2 94,-2.0 -0.859 24.7-175.6 -91.4 112.9 4.9 -4.0 5.6 4 4 A V E -ab 36 97A 0 31,-3.3 33,-3.0 -2,-0.8 2,-0.5 -0.905 14.4-166.5-115.9 132.9 7.5 -5.3 3.1 5 5 A L E -ab 37 98A 0 92,-2.8 94,-3.0 -2,-0.4 2,-0.5 -0.967 4.0-168.0-114.1 129.7 6.9 -7.4 0.0 6 6 A M E -ab 38 99A 0 31,-3.3 33,-2.5 -2,-0.5 2,-0.5 -0.984 2.4-171.0-118.9 124.9 9.8 -9.1 -1.7 7 7 A L E -ab 39 100A 0 92,-2.9 94,-3.2 -2,-0.5 2,-0.7 -0.963 6.6-164.2-117.1 114.8 9.2 -10.6 -5.2 8 8 A G E -ab 40 101A 0 31,-2.4 33,-2.9 -2,-0.5 2,-0.5 -0.883 15.8-168.1-102.5 110.8 12.0 -12.7 -6.7 9 9 A V E > -a 41 0A 1 92,-3.1 4,-0.9 -2,-0.7 94,-0.5 -0.849 47.9 -3.7-111.5 126.2 11.2 -13.1 -10.4 10 10 A G H > S- 0 0 4 31,-2.5 4,-3.1 -2,-0.5 5,-0.2 -0.161 104.3 -57.5 83.0 174.6 12.9 -15.5 -12.8 11 11 A Q H > S+ 0 0 74 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.924 137.9 44.0 -58.6 -49.6 15.8 -17.7 -11.8 12 12 A C H > S+ 0 0 26 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.962 116.3 47.4 -61.0 -51.5 18.2 -14.9 -10.7 13 13 A G H X S+ 0 0 0 -4,-0.9 4,-2.3 1,-0.2 -2,-0.2 0.897 112.0 51.8 -55.4 -44.2 15.4 -13.2 -8.8 14 14 A N H X S+ 0 0 1 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.917 110.1 47.7 -56.8 -47.9 14.4 -16.5 -7.2 15 15 A R H X S+ 0 0 73 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.853 111.1 50.4 -68.7 -34.2 17.9 -17.3 -6.0 16 16 A I H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.933 110.1 50.4 -67.6 -42.3 18.4 -13.8 -4.5 17 17 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.897 108.3 53.1 -60.2 -41.0 15.1 -14.2 -2.7 18 18 A D H X S+ 0 0 16 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.902 107.4 50.9 -61.0 -42.2 16.2 -17.5 -1.3 19 19 A A H X S+ 0 0 3 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.846 108.6 53.1 -63.0 -34.9 19.5 -15.9 -0.0 20 20 A V H X S+ 0 0 2 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.937 111.7 44.2 -63.3 -47.7 17.3 -13.3 1.7 21 21 A N H X S+ 0 0 19 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.884 111.5 55.3 -63.7 -39.5 15.2 -16.0 3.3 22 22 A R H >X S+ 0 0 84 -4,-2.8 3,-0.8 1,-0.2 4,-0.7 0.973 113.7 38.4 -55.1 -56.8 18.4 -17.9 4.2 23 23 A Q H >X S+ 0 0 46 -4,-2.3 4,-1.6 1,-0.2 3,-0.5 0.787 107.9 65.2 -69.5 -29.2 20.0 -15.0 6.0 24 24 A A H 3X S+ 0 0 35 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.802 93.3 61.6 -64.2 -32.9 16.6 -13.9 7.5 25 25 A F H < S+ 0 0 196 -4,-1.2 3,-1.1 1,-0.2 -1,-0.2 0.897 105.9 51.5 -62.8 -43.5 17.4 -16.1 16.1 30 30 A L H 3< S+ 0 0 130 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.742 84.6 90.1 -65.4 -24.6 19.2 -13.0 17.3 31 31 A A T 3< 0 0 90 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.1 0.673 360.0 360.0 -55.8 -21.8 16.0 -11.2 17.9 32 32 A K < 0 0 241 -3,-1.1 -2,-0.2 -4,-0.3 -1,-0.1 0.640 360.0 360.0-112.1 360.0 15.9 -12.6 21.5 33 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 34 41 A S 0 0 67 0, 0.0 2,-0.6 0, 0.0 -31,-0.2 0.000 360.0 360.0 360.0 142.7 7.8 -5.4 10.5 35 42 A R E -a 3 0A 86 -33,-1.2 -31,-3.3 2,-0.0 2,-0.6 -0.799 360.0-169.7 -94.9 118.9 6.1 -8.0 8.3 36 43 A V E -a 4 0A 59 -2,-0.6 2,-0.3 -33,-0.2 -31,-0.2 -0.919 2.4-171.8-112.7 110.7 8.3 -9.3 5.4 37 44 A E E -a 5 0A 39 -33,-3.0 -31,-3.3 -2,-0.6 2,-0.4 -0.771 2.9-165.1-100.1 141.9 6.6 -11.4 2.7 38 45 A T E -a 6 0A 6 -2,-0.3 2,-0.4 -33,-0.2 -31,-0.2 -0.991 9.0-179.7-129.1 132.2 8.5 -13.2 0.0 39 46 A I E -a 7 0A 0 -33,-2.5 -31,-2.4 -2,-0.4 2,-0.6 -0.988 14.5-154.9-130.8 123.2 7.3 -14.7 -3.2 40 47 A A E -ac 8 59A 0 18,-3.4 20,-3.1 -2,-0.4 2,-0.4 -0.876 18.6-166.1 -91.5 120.2 9.5 -16.4 -5.7 41 48 A I E +ac 9 60A 1 -33,-2.9 -31,-2.5 -2,-0.6 2,-0.3 -0.912 17.9 150.0-114.0 133.4 7.9 -16.3 -9.1 42 49 A N E - c 0 61A 3 18,-2.1 20,-2.8 -2,-0.4 -33,-0.0 -0.991 45.5-147.4-158.0 151.9 9.0 -18.4 -12.1 43 50 A T S S+ 0 0 20 -2,-0.3 2,-0.7 18,-0.2 21,-0.4 0.507 90.6 74.9 -93.6 -9.6 7.8 -20.0 -15.3 44 51 A A >> - 0 0 35 1,-0.1 4,-1.2 19,-0.1 3,-0.7 -0.905 64.9-164.8-108.3 109.3 10.3 -22.8 -14.8 45 52 A I H 3> S+ 0 0 89 -2,-0.7 4,-2.3 1,-0.2 5,-0.2 0.808 86.1 65.1 -66.7 -28.7 9.2 -25.2 -12.1 46 53 A N H 3> S+ 0 0 96 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.887 100.5 52.4 -55.8 -41.7 12.7 -26.8 -11.8 47 54 A D H <4 S+ 0 0 29 -3,-0.7 4,-0.3 2,-0.2 -1,-0.2 0.908 110.0 46.7 -60.5 -45.3 14.0 -23.4 -10.6 48 55 A L H >< S+ 0 0 7 -4,-1.2 3,-1.0 1,-0.2 -2,-0.2 0.857 109.4 56.0 -67.1 -33.1 11.4 -23.2 -7.9 49 56 A K H 3< S+ 0 0 135 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.866 101.2 57.1 -65.0 -38.5 12.2 -26.8 -6.9 50 57 A E T 3< S+ 0 0 105 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.538 81.0 109.5 -72.8 -8.0 15.9 -26.0 -6.4 51 58 A L < - 0 0 9 -3,-1.0 -36,-0.1 -4,-0.3 8,-0.0 -0.459 45.1-177.3 -69.7 147.3 15.0 -23.3 -3.8 52 59 A K S S+ 0 0 163 -2,-0.1 -1,-0.1 3,-0.0 -4,-0.0 0.606 70.9 36.8-126.2 -17.3 16.0 -24.4 -0.3 53 60 A F S S+ 0 0 78 2,-0.1 2,-0.5 -28,-0.0 -2,-0.1 0.212 93.3 95.7-125.0 12.2 15.0 -21.7 2.2 54 61 A T S S- 0 0 5 -33,-0.0 -36,-0.1 2,-0.0 5,-0.1 -0.920 76.3-118.3-112.4 125.1 11.7 -20.6 0.7 55 62 A A > - 0 0 51 -2,-0.5 3,-2.2 1,-0.1 4,-0.1 -0.205 23.3-116.6 -59.2 148.8 8.5 -22.1 2.0 56 63 A A G > S+ 0 0 84 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.831 115.5 59.2 -57.6 -34.9 6.3 -24.0 -0.6 57 64 A K G 3 S+ 0 0 131 1,-0.3 -1,-0.3 3,-0.1 -2,-0.1 0.669 102.4 54.6 -66.9 -16.8 3.6 -21.4 -0.2 58 65 A D G < S+ 0 0 16 -3,-2.2 -18,-3.4 -19,-0.1 2,-0.7 0.251 87.4 92.1-102.8 10.5 6.0 -18.7 -1.3 59 66 A R E < -c 40 0A 72 -3,-1.6 2,-0.7 -20,-0.2 -18,-0.2 -0.912 58.9-168.8-109.7 106.0 6.9 -20.5 -4.5 60 67 A L E -c 41 0A 25 -20,-3.1 -18,-2.1 -2,-0.7 2,-0.5 -0.859 4.3-161.0-103.1 109.2 4.7 -19.4 -7.4 61 68 A H E -c 42 0A 68 -2,-0.7 -18,-0.2 -20,-0.2 -20,-0.1 -0.774 1.2-162.9 -86.8 128.1 4.8 -21.4 -10.6 62 69 A V - 0 0 0 -20,-2.8 19,-0.1 -2,-0.5 -17,-0.0 -0.921 23.7-132.0-109.2 103.8 3.4 -19.6 -13.7 63 70 A P 0 0 60 0, 0.0 -19,-0.1 0, 0.0 -20,-0.1 -0.284 360.0 360.0 -61.0 137.5 2.8 -22.3 -16.2 64 71 A N 0 0 132 -21,-0.4 13,-0.2 0, 0.0 -21,-0.1 0.099 360.0 360.0 60.3 360.0 4.2 -21.6 -19.8 65 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 66 74 A G 0 0 87 0, 0.0 -22,-0.1 0, 0.0 7,-0.1 0.000 360.0 360.0 360.0 111.2 9.0 -22.4 -22.5 67 75 A V > + 0 0 8 1,-0.1 3,-1.9 6,-0.1 6,-0.2 0.912 360.0 164.6 -82.3 -42.7 10.0 -18.7 -22.2 68 76 A G T 3 S- 0 0 61 1,-0.2 39,-0.8 5,-0.1 40,-0.4 -0.399 74.5 -34.3 59.1-132.3 13.8 -19.1 -22.4 69 77 A A T 3 S+ 0 0 32 37,-0.2 2,-0.9 38,-0.2 -1,-0.2 0.191 105.4 120.6-104.7 17.7 15.5 -15.8 -23.1 70 78 A N <> - 0 0 78 -3,-1.9 4,-2.1 1,-0.2 3,-0.1 -0.713 42.3-171.8 -87.3 102.8 12.6 -14.6 -25.3 71 79 A R H > S+ 0 0 15 -2,-0.9 4,-2.8 1,-0.2 5,-0.2 0.810 84.0 59.5 -65.8 -29.7 11.2 -11.4 -23.8 72 80 A S H > S+ 0 0 79 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.946 109.2 43.0 -63.0 -45.9 8.2 -11.4 -26.2 73 81 A K H > S+ 0 0 108 1,-0.2 4,-3.2 -6,-0.2 -2,-0.2 0.881 112.0 56.1 -66.6 -35.5 7.1 -14.8 -25.0 74 82 A G H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.940 107.5 47.4 -59.0 -49.2 7.8 -13.6 -21.5 75 83 A K H X S+ 0 0 51 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.903 113.4 47.9 -60.6 -43.3 5.5 -10.7 -21.9 76 84 A Q H X S+ 0 0 99 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.938 109.6 53.9 -61.3 -47.1 2.8 -12.9 -23.4 77 85 A G H X S+ 0 0 3 -4,-3.2 4,-1.1 1,-0.2 -2,-0.2 0.864 108.3 50.2 -53.4 -42.2 3.2 -15.3 -20.5 78 86 A F H >X S+ 0 0 1 -4,-2.2 4,-1.1 2,-0.2 3,-0.6 0.949 109.6 48.8 -63.7 -49.9 2.7 -12.5 -18.1 79 87 A W H >< S+ 0 0 139 -4,-2.2 3,-0.6 1,-0.3 4,-0.4 0.914 109.9 52.6 -57.5 -42.8 -0.5 -11.3 -19.7 80 88 A E H 3< S+ 0 0 138 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.784 124.5 27.4 -63.2 -27.3 -2.0 -14.8 -19.8 81 89 A N H S+ 0 0 135 -4,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.895 111.2 51.7 -64.9 -39.0 -4.5 -12.0 -12.6 84 92 A M H > S+ 0 0 63 -3,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.906 112.7 45.7 -64.3 -43.2 -3.2 -15.2 -11.1 85 93 A I H X S+ 0 0 0 -4,-2.3 4,-1.5 -7,-0.2 3,-0.2 0.971 115.0 45.5 -64.3 -53.9 0.1 -13.5 -10.2 86 94 A L H X S+ 0 0 2 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.839 108.7 58.2 -59.1 -34.7 -1.5 -10.3 -8.8 87 95 A E H X S+ 0 0 106 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.926 102.7 53.3 -60.1 -45.2 -4.0 -12.4 -6.9 88 96 A E H < S+ 0 0 36 -4,-1.7 4,-0.3 -3,-0.2 -1,-0.2 0.864 111.7 46.0 -59.7 -37.5 -1.2 -14.2 -5.0 89 97 A I H >< S+ 0 0 0 -4,-1.5 3,-1.9 1,-0.2 -2,-0.2 0.944 109.9 52.0 -69.6 -48.6 0.2 -10.8 -4.0 90 98 A E H >< S+ 0 0 93 -4,-2.7 3,-1.7 1,-0.3 -2,-0.2 0.782 96.4 69.6 -62.4 -26.9 -3.1 -9.3 -2.9 91 99 A K T 3< S+ 0 0 139 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.718 94.0 59.4 -60.2 -20.5 -3.8 -12.4 -0.7 92 100 A R T < S- 0 0 21 -3,-1.9 -1,-0.3 1,-0.3 2,-0.2 0.303 105.9-126.7 -99.8 8.8 -1.0 -11.1 1.6 93 101 A G < - 0 0 33 -3,-1.7 -1,-0.3 -4,-0.1 2,-0.2 -0.497 48.6 -15.8 95.3-156.2 -2.4 -7.7 2.4 94 102 A D - 0 0 118 -2,-0.2 2,-0.4 -90,-0.0 30,-0.1 -0.618 54.4-162.7 -92.9 153.0 -1.1 -4.2 2.2 95 103 A F - 0 0 7 -2,-0.2 -91,-0.2 1,-0.1 3,-0.1 -0.995 21.3-168.6-136.1 143.5 2.5 -3.2 1.7 96 104 A D S S+ 0 0 35 -93,-2.4 32,-2.6 -2,-0.4 2,-0.4 0.669 84.2 31.7 -95.0 -25.1 4.4 -0.0 2.2 97 105 A L E -bd 4 128A 0 -94,-2.0 -92,-2.8 30,-0.2 2,-0.5 -0.991 65.5-171.2-143.1 127.4 7.6 -1.2 0.5 98 106 A I E -bd 5 129A 0 30,-3.3 32,-3.5 -2,-0.4 2,-0.5 -0.975 6.1-162.7-128.1 125.0 8.0 -3.6 -2.4 99 107 A F E -bd 6 130A 0 -94,-3.0 -92,-2.9 -2,-0.5 2,-0.6 -0.930 3.3-165.4-103.0 127.3 11.2 -5.0 -3.8 100 108 A V E -bd 7 131A 0 30,-2.0 32,-3.0 -2,-0.5 2,-0.5 -0.946 12.6-167.1-112.6 108.8 11.1 -6.5 -7.3 101 109 A M E +bd 8 132A 0 -94,-3.2 -92,-3.1 -2,-0.6 2,-0.3 -0.859 24.1 127.2-108.1 126.1 14.2 -8.6 -7.8 102 110 A T E - d 0 133A 0 30,-2.3 32,-2.6 -2,-0.5 2,-0.2 -0.984 54.2-106.3-161.7 157.7 15.2 -9.9 -11.2 103 111 A S E - d 0 134A 23 -94,-0.5 32,-0.2 -2,-0.3 -90,-0.1 -0.633 24.2-141.8 -81.0 157.2 18.0 -10.1 -13.8 104 112 A V S S+ 0 0 0 30,-2.3 47,-0.3 -2,-0.2 31,-0.1 0.534 91.3 61.3 -94.6 -5.8 17.5 -7.8 -16.8 105 113 A S S S+ 0 0 7 29,-0.5 42,-0.2 42,-0.1 43,-0.2 0.625 85.3 76.8-101.3 -19.9 18.9 -10.4 -19.2 106 114 A G S S- 0 0 17 41,-0.1 -37,-0.2 1,-0.1 -35,-0.1 -0.028 80.6-115.6 -80.8-167.8 16.7 -13.5 -19.0 107 115 A G S S+ 0 0 2 -39,-0.8 4,-0.5 3,-0.1 5,-0.2 0.792 103.2 38.0 -99.4 -36.3 13.3 -14.0 -20.5 108 116 A T S >> S+ 0 0 13 -40,-0.4 4,-2.7 2,-0.1 3,-0.6 0.972 119.7 37.7 -83.6 -62.1 11.1 -14.3 -17.5 109 117 A G H 3> S+ 0 0 2 1,-0.2 4,-2.3 2,-0.2 -99,-0.1 0.943 116.3 51.7 -54.8 -50.4 12.4 -11.9 -14.9 110 118 A S H 34 S+ 0 0 0 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.720 118.7 35.7 -66.2 -23.8 13.2 -9.2 -17.3 111 119 A S H <> S+ 0 0 0 -3,-0.6 4,-1.1 -4,-0.5 -1,-0.2 0.844 118.0 47.2 -96.6 -44.1 9.8 -9.1 -19.0 112 120 A F H X S+ 0 0 0 -4,-2.7 4,-3.3 -5,-0.2 5,-0.3 0.882 104.5 63.7 -59.0 -43.2 7.5 -9.9 -16.0 113 121 A S H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.4 5,-0.2 0.909 103.0 41.4 -63.8 -49.4 9.1 -7.4 -13.7 114 122 A P H > S+ 0 0 5 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.892 118.9 49.3 -62.9 -35.2 8.4 -4.1 -15.5 115 123 A L H X S+ 0 0 31 -4,-1.1 4,-1.7 2,-0.2 -2,-0.2 0.904 112.1 47.7 -65.9 -43.1 4.9 -5.3 -16.3 116 124 A M H X S+ 0 0 0 -4,-3.3 4,-2.5 1,-0.2 -1,-0.2 0.850 109.4 52.9 -67.3 -37.2 4.3 -6.4 -12.7 117 125 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 5,-0.2 0.930 105.5 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