==== 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 TRANSFERASE 29-MAY-02 1LVW . COMPND 2 MOLECULE: GLUCOSE-1-PHOSPHATE THYMIDYLYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER THERMAUTOTROPHICUS . AUTHOR A.DONG,D.CHRISTENDAT,E.F.PAI,NORTHEAST STRUCTURAL GENOMICS C . 1170 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44580.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 819 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 100 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 9.7 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 . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 1 0.1 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 . 83 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 149 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 311 26.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 2.1 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 8 6 7 8 3 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 4 4 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 PARALLEL BRIDGES PER LADDER . 8 14 2 4 4 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 . 8 0 0 0 0 0 0 0 0 4 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 -2 A G 0 0 76 0, 0.0 102,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -4.2 -12.5 -10.0 41.7 2 -1 A A + 0 0 91 1,-0.3 2,-0.4 102,-0.1 101,-0.0 0.106 360.0 29.8-170.8 -48.8 -9.0 -11.2 41.2 3 0 A H S S- 0 0 160 101,-0.1 -1,-0.3 48,-0.0 2,-0.2 -0.969 82.9-102.9-131.9 146.4 -6.6 -9.4 43.5 4 1 A M - 0 0 27 -2,-0.4 46,-0.4 123,-0.1 47,-0.4 -0.457 40.6-149.5 -65.1 133.7 -7.1 -7.9 47.0 5 2 A K E -a 105 0A 37 99,-2.5 101,-2.2 -2,-0.2 2,-0.3 -0.429 4.5-136.5 -97.4 175.4 -7.3 -4.1 46.7 6 3 A G E -ab 106 52A 0 45,-2.3 47,-2.8 99,-0.2 2,-0.4 -0.968 10.3-163.9-135.8 151.4 -6.2 -1.5 49.3 7 4 A I E -ab 107 53A 0 99,-2.2 101,-2.4 -2,-0.3 2,-0.6 -0.999 4.9-160.3-133.2 135.0 -7.7 1.7 50.7 8 5 A V E -ab 108 54A 0 45,-2.8 47,-2.5 -2,-0.4 2,-0.9 -0.977 13.2-149.6-114.5 117.7 -5.8 4.4 52.6 9 6 A L E +ab 109 55A 18 99,-2.4 101,-3.2 -2,-0.6 102,-0.3 -0.788 30.5 158.3 -90.9 110.3 -8.2 6.6 54.6 10 7 A A + 0 0 0 45,-3.1 47,-0.4 -2,-0.9 17,-0.2 -0.271 31.0 110.6-130.6 48.7 -6.6 10.1 54.8 11 8 A G - 0 0 9 45,-0.3 16,-0.2 1,-0.2 15,-0.2 0.018 60.7 -1.9-101.6-152.1 -9.4 12.5 55.5 12 9 A G - 0 0 51 71,-0.2 2,-0.2 1,-0.1 -1,-0.2 0.055 51.1-171.9 -49.2 134.7 -10.5 14.7 58.4 13 10 A S - 0 0 59 1,-0.2 -1,-0.1 8,-0.1 -3,-0.0 -0.675 25.7-109.8-118.2 170.9 -8.9 15.0 61.8 14 11 A G - 0 0 57 -2,-0.2 3,-0.2 1,-0.1 -1,-0.2 0.075 43.5 -95.8 -79.5-155.1 -9.9 16.7 65.0 15 12 A T S > S+ 0 0 69 1,-0.2 3,-2.0 2,-0.1 6,-0.1 0.164 87.2 116.6-110.0 17.5 -8.0 19.8 66.1 16 13 A R T 3 S+ 0 0 62 1,-0.3 1144,-0.4 1143,-0.1 1145,-0.2 0.847 83.0 41.4 -56.2 -33.5 -5.7 17.8 68.5 17 14 A L T > S+ 0 0 6 -3,-0.2 3,-1.8 212,-0.1 -1,-0.3 0.362 97.2 176.1 -95.4 6.5 -2.7 18.9 66.4 18 15 A Y T < + 0 0 35 -3,-2.0 1143,-0.3 1,-0.3 1144,-0.1 -0.211 56.5 23.2 -51.8 139.6 -3.9 22.5 65.9 19 16 A P T >> S+ 0 0 0 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.978 118.4 57.9 -91.1 5.5 -2.4 24.7 64.5 20 17 A I T <4 S+ 0 0 2 -3,-1.8 4,-0.3 893,-0.4 -2,-0.2 0.703 111.6 44.7 -70.5 -16.0 -0.2 22.5 62.4 21 18 A T T 34 S+ 0 0 22 -4,-0.3 -1,-0.3 2,-0.1 5,-0.2 0.299 86.5 93.6-103.0 5.7 -3.2 20.8 60.8 22 19 A R T <4 S+ 0 0 127 -3,-1.6 -2,-0.1 -5,-0.2 -1,-0.1 0.938 111.4 7.2 -63.2 -43.0 -5.1 24.0 60.2 23 20 A A S < S+ 0 0 5 -4,-0.5 2,-0.5 1,-0.1 -1,-0.2 0.466 125.7 67.5-116.3 -3.7 -3.7 24.3 56.7 24 21 A V S S- 0 0 7 -4,-0.3 -1,-0.1 884,-0.1 5,-0.1 -0.978 83.3-121.3-123.2 121.8 -1.8 21.0 56.3 25 22 A S >> - 0 0 8 -2,-0.5 3,-2.2 1,-0.1 4,-0.5 -0.317 27.0-122.5 -54.9 135.5 -3.7 17.7 56.1 26 23 A K G >4 S+ 0 0 27 1,-0.3 3,-1.6 2,-0.2 10,-0.2 0.878 109.6 56.3 -51.1 -41.4 -2.5 15.5 58.9 27 24 A Q G 34 S+ 0 0 8 1,-0.3 10,-2.3 -16,-0.2 -1,-0.3 0.448 102.9 54.9 -78.5 3.5 -1.4 12.7 56.6 28 25 A L G <4 S+ 0 0 2 -3,-2.2 -1,-0.3 8,-0.2 -2,-0.2 0.441 81.0 114.1-106.5 -6.3 0.8 15.0 54.6 29 26 A L S << S- 0 0 2 -3,-1.6 7,-2.4 -4,-0.5 2,-0.1 -0.331 76.0-104.1 -61.8 146.4 2.8 16.1 57.7 30 27 A P E -K 35 0B 23 0, 0.0 2,-0.6 0, 0.0 207,-0.1 -0.435 22.0-161.2 -76.8 144.4 6.4 14.9 57.6 31 28 A I E > S-K 34 0B 0 3,-2.8 2,-1.8 -2,-0.1 3,-1.1 -0.893 75.1 -60.0-121.0 93.1 7.8 12.0 59.5 32 29 A Y T 3 S- 0 0 35 -2,-0.6 1081,-0.1 1,-0.2 1082,-0.1 -0.477 125.7 -5.7 67.2 -78.9 11.4 12.9 59.3 33 30 A D T 3 S+ 0 0 3 -2,-1.8 867,-0.4 1,-0.1 -1,-0.2 0.313 124.8 54.5-129.0 7.1 12.0 12.9 55.5 34 31 A K E < S-K 31 0B 0 -3,-1.1 -3,-2.8 865,-0.1 -1,-0.1 -0.984 87.8 -93.2-141.8 153.6 8.7 11.6 54.0 35 32 A P E >> -K 30 0B 3 0, 0.0 3,-1.8 0, 0.0 4,-0.5 -0.326 42.8-114.5 -62.5 145.0 5.0 12.6 54.1 36 33 A M T >4 S+ 0 0 0 -7,-2.4 3,-1.7 1,-0.3 -8,-0.2 0.873 112.0 63.6 -49.6 -44.3 3.2 10.6 56.8 37 34 A I T 3> S+ 0 0 0 -10,-2.3 4,-1.9 1,-0.3 -1,-0.3 0.714 86.5 71.1 -60.1 -21.4 1.0 8.8 54.1 38 35 A Y H <> S+ 0 0 0 -3,-1.8 4,-2.3 1,-0.2 -1,-0.3 0.865 93.2 60.3 -61.4 -32.8 4.1 7.1 52.6 39 36 A Y H S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.865 115.5 58.3 -70.4 -29.3 0.9 3.2 55.5 41 38 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.924 102.4 54.4 -60.1 -40.9 1.2 3.1 51.7 42 39 A S H X S+ 0 0 8 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.831 104.5 55.5 -61.9 -31.1 4.4 1.1 52.1 43 40 A V H X S+ 0 0 3 -4,-1.2 4,-1.4 2,-0.2 -1,-0.2 0.927 107.3 47.2 -69.2 -43.2 2.5 -1.4 54.2 44 41 A L H <>S+ 0 0 0 -4,-1.9 5,-2.3 1,-0.2 3,-0.3 0.928 114.5 48.1 -64.1 -41.3 -0.1 -2.0 51.5 45 42 A M H ><5S+ 0 0 0 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.877 108.4 52.7 -66.8 -37.7 2.7 -2.4 49.0 46 43 A L H 3<5S+ 0 0 46 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.767 105.6 56.5 -67.3 -23.4 4.7 -4.8 51.2 47 44 A A T 3<5S- 0 0 6 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.410 124.3-109.2 -83.7 -1.9 1.4 -6.8 51.4 48 45 A G T < 5 + 0 0 26 -3,-1.5 2,-0.4 1,-0.3 -3,-0.2 0.544 67.4 148.5 87.2 11.0 1.5 -7.0 47.6 49 46 A I < + 0 0 4 -5,-2.3 -1,-0.3 -6,-0.2 -44,-0.1 -0.652 15.9 167.5 -84.5 129.0 -1.4 -4.7 46.9 50 47 A R + 0 0 80 -2,-0.4 27,-2.7 -46,-0.4 2,-0.6 0.424 59.4 72.3-120.2 -3.1 -1.2 -2.6 43.7 51 48 A D E + c 0 77A 52 -47,-0.4 -45,-2.3 25,-0.2 2,-0.4 -0.935 67.9 175.2-118.3 105.2 -4.7 -1.2 43.2 52 49 A I E -bc 6 78A 0 25,-2.9 27,-2.1 -2,-0.6 2,-0.5 -0.946 24.5-153.9-124.9 131.9 -5.1 1.5 45.9 53 50 A L E -bc 7 79A 0 -47,-2.8 -45,-2.8 -2,-0.4 2,-0.6 -0.857 9.5-155.8-101.1 128.0 -7.8 4.0 46.6 54 51 A I E -bc 8 80A 0 25,-3.0 27,-2.2 -2,-0.5 2,-0.5 -0.911 10.9-167.8-102.8 123.3 -6.9 7.2 48.4 55 52 A I E +bc 9 81A 0 -47,-2.5 -45,-3.1 -2,-0.6 2,-0.3 -0.945 22.0 141.6-114.3 130.1 -9.8 8.8 50.3 56 53 A S E - c 0 82A 0 25,-1.5 27,-2.2 -2,-0.5 -45,-0.3 -0.912 50.8 -69.9-152.3 178.1 -9.5 12.4 51.6 57 54 A T > - 0 0 26 -47,-0.4 4,-2.5 -2,-0.3 27,-0.2 -0.194 46.8-107.4 -71.9 166.7 -11.5 15.5 52.1 58 55 A P T 4 S+ 0 0 52 0, 0.0 -1,-0.1 0, 0.0 26,-0.1 0.933 120.5 47.9 -60.5 -43.7 -12.6 17.7 49.2 59 56 A R T 4 S+ 0 0 99 1,-0.2 4,-0.3 2,-0.1 23,-0.0 0.919 119.9 35.6 -63.5 -45.5 -10.1 20.4 50.2 60 57 A D T >> S+ 0 0 18 1,-0.2 4,-1.8 2,-0.1 3,-1.2 0.713 91.9 85.2 -85.3 -23.1 -7.1 18.0 50.5 61 58 A L H 3X S+ 0 0 15 -4,-2.5 4,-2.4 1,-0.3 3,-0.3 0.891 88.2 55.2 -50.3 -43.3 -7.7 15.4 47.8 62 59 A P H 3> S+ 0 0 68 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.831 106.0 52.1 -59.1 -34.3 -6.0 17.5 45.2 63 60 A L H <> S+ 0 0 11 -3,-1.2 4,-1.9 -4,-0.3 -2,-0.2 0.854 108.6 50.2 -69.9 -37.9 -2.8 17.8 47.3 64 61 A Y H X S+ 0 0 0 -4,-1.8 4,-2.7 -3,-0.3 5,-0.4 0.895 110.9 49.3 -67.2 -38.6 -2.7 14.0 47.7 65 62 A R H X S+ 0 0 129 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.907 107.5 55.6 -66.2 -36.4 -3.1 13.7 43.9 66 63 A D H < S+ 0 0 77 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.916 115.0 39.5 -58.9 -40.9 -0.2 16.2 43.6 67 64 A L H < S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.1 -1,-0.2 0.929 129.7 24.9 -74.5 -44.6 2.0 14.0 45.7 68 65 A L H >< S- 0 0 0 -4,-2.7 3,-1.2 1,-0.2 5,-0.2 0.675 79.6-175.4 -99.7 -23.2 1.0 10.6 44.4 69 66 A G T 3< - 0 0 23 -4,-2.6 -1,-0.2 -5,-0.4 -2,-0.1 -0.181 65.4 -32.2 58.9-149.6 -0.3 11.0 40.9 70 67 A D T 3 S- 0 0 102 7,-0.1 8,-2.2 1,-0.1 -1,-0.2 0.496 82.5-115.3 -86.1 -0.1 -1.7 8.0 39.1 71 68 A G S X >S+ 0 0 0 -3,-1.2 3,-2.2 6,-0.3 5,-2.2 0.231 82.9 119.5 90.2 -13.2 0.7 5.6 40.9 72 69 A S G > 5 + 0 0 78 1,-0.3 3,-1.4 3,-0.2 -3,-0.1 0.796 65.7 68.1 -58.4 -26.3 2.6 4.5 37.8 73 70 A Q G 3 5S+ 0 0 40 1,-0.3 -1,-0.3 -5,-0.2 199,-0.1 0.766 110.7 35.2 -64.7 -21.7 5.8 5.8 39.2 74 71 A F G < 5S- 0 0 1 -3,-2.2 -1,-0.3 2,-0.2 -2,-0.2 0.200 118.4-108.0-112.5 11.0 5.5 3.0 41.8 75 72 A G T < 5S+ 0 0 9 -3,-1.4 -3,-0.2 1,-0.2 2,-0.2 0.816 87.2 105.4 67.9 25.7 4.0 0.4 39.5 76 73 A V S - 0 0 10 109,-0.3 3,-1.3 -3,-0.2 4,-0.3 -0.388 44.4 -75.3 123.4 160.1 -16.3 7.5 60.5 89 86 A I G > S+ 0 0 37 1,-0.3 3,-2.1 2,-0.2 4,-0.2 0.885 124.1 59.1 -60.6 -39.4 -13.8 4.9 59.4 90 87 A A G > S+ 0 0 1 108,-2.1 3,-1.7 1,-0.3 4,-0.4 0.736 87.8 76.8 -64.9 -17.7 -16.3 2.3 58.2 91 88 A D G X> S+ 0 0 5 -3,-1.3 4,-3.3 107,-0.5 3,-1.1 0.705 75.3 79.9 -64.2 -17.1 -17.6 5.0 55.7 92 89 A A H <> S+ 0 0 0 -3,-2.1 4,-1.8 -4,-0.3 -1,-0.3 0.848 90.9 50.5 -58.4 -31.9 -14.5 4.1 53.7 93 90 A F H <4 S+ 0 0 0 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.645 112.3 46.0 -82.1 -13.6 -16.4 1.0 52.4 94 91 A I H X4 S+ 0 0 64 -3,-1.1 3,-1.2 -4,-0.4 4,-0.3 0.864 116.4 43.2 -89.4 -49.9 -19.4 3.1 51.4 95 92 A V H 3< S+ 0 0 9 -4,-3.3 3,-0.3 1,-0.2 4,-0.2 0.873 123.1 42.0 -62.5 -33.6 -17.3 5.8 49.7 96 93 A G T 3X S+ 0 0 0 -4,-1.8 4,-2.6 -5,-0.4 -1,-0.2 0.271 78.6 112.2 -99.1 12.7 -15.2 3.0 48.2 97 94 A K H <> S+ 0 0 107 -3,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.902 81.5 44.2 -53.7 -48.0 -18.0 0.5 47.2 98 95 A D H 4 S+ 0 0 130 -4,-0.3 -1,-0.2 -3,-0.3 -2,-0.1 0.905 113.4 51.2 -65.8 -39.0 -17.5 0.9 43.5 99 96 A F H 4 S+ 0 0 28 -4,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.923 111.0 49.1 -61.2 -45.3 -13.7 0.8 43.7 100 97 A I H >< S+ 0 0 0 -4,-2.6 3,-2.1 1,-0.2 -2,-0.2 0.905 78.8 164.9 -63.8 -44.4 -13.9 -2.5 45.8 101 98 A G T 3< S- 0 0 33 -4,-2.1 -1,-0.2 1,-0.3 83,-0.1 -0.412 74.0 -28.5 61.7-132.5 -16.3 -4.3 43.5 102 99 A D T 3 S+ 0 0 134 -2,-0.1 -1,-0.3 2,-0.0 79,-0.2 0.237 111.2 115.9-100.1 13.8 -16.3 -8.0 44.4 103 100 A S S < S- 0 0 6 -3,-2.1 -99,-0.1 -4,-0.1 2,-0.1 -0.371 70.4-112.2 -84.6 161.3 -12.7 -8.0 45.7 104 101 A K - 0 0 78 -2,-0.1 -99,-2.5 23,-0.1 2,-0.3 -0.430 44.0-159.9 -76.4 164.9 -11.2 -8.6 49.1 105 102 A V E -aD 5 179A 0 74,-2.4 74,-2.9 -101,-0.2 2,-0.4 -0.996 21.4-148.7-156.5 143.8 -9.7 -5.4 50.5 106 103 A A E -aD 6 178A 0 -101,-2.2 -99,-2.2 -2,-0.3 2,-0.4 -0.939 16.4-160.0-112.0 136.9 -7.3 -4.0 53.1 107 104 A L E +aD 7 177A 0 70,-3.0 70,-2.8 -2,-0.4 2,-0.4 -0.948 10.4 179.2-117.0 134.8 -7.9 -0.7 54.8 108 105 A V E -aD 8 176A 0 -101,-2.4 -99,-2.4 -2,-0.4 2,-0.3 -0.992 30.5-119.2-134.6 140.9 -5.1 1.3 56.5 109 106 A L E > -a 9 0A 24 66,-2.6 3,-1.9 -2,-0.4 -99,-0.2 -0.654 22.6-129.1 -78.5 138.9 -5.5 4.6 58.2 110 107 A G T 3 S+ 0 0 0 -101,-3.2 -71,-0.2 -2,-0.3 -69,-0.1 0.566 105.4 54.2 -65.2 -12.2 -3.3 7.3 56.5 111 108 A D T 3 S+ 0 0 31 -102,-0.3 2,-0.6 -72,-0.1 -1,-0.3 0.278 81.6 109.8-103.9 11.8 -1.8 8.3 59.9 112 109 A N < - 0 0 9 -3,-1.9 2,-0.6 63,-0.2 114,-0.1 -0.771 44.0-173.7 -96.2 124.3 -0.6 4.8 61.0 113 110 A V + 0 0 0 -2,-0.6 112,-2.3 112,-0.4 2,-0.3 -0.942 7.6 175.3-120.3 113.5 3.1 4.2 61.0 114 111 A F E +L 224 0C 10 -2,-0.6 2,-0.3 110,-0.2 110,-0.2 -0.883 2.0 172.1-117.1 149.6 4.4 0.7 61.7 115 112 A Y E +L 223 0C 27 108,-2.3 108,-3.6 -2,-0.3 2,-0.2 -0.970 12.6 123.0-157.3 139.2 7.9 -0.7 61.7 116 113 A G > - 0 0 11 -2,-0.3 3,-1.2 106,-0.2 4,-0.3 -0.835 55.7 -83.4 173.2 153.9 9.7 -3.9 62.7 117 114 A H T 3 S+ 0 0 24 691,-0.6 691,-0.2 104,-0.3 -2,-0.0 -0.406 113.5 11.6 -64.0 136.5 11.9 -6.8 61.8 118 115 A R T 3> S+ 0 0 81 689,-0.5 4,-0.5 -2,-0.1 -1,-0.3 0.799 84.8 129.7 62.3 34.6 9.8 -9.6 60.2 119 116 A F H <> + 0 0 13 -3,-1.2 4,-2.2 2,-0.2 3,-0.4 0.812 61.6 65.8 -83.4 -33.8 6.7 -7.5 59.7 120 117 A S H > S+ 0 0 52 -4,-0.3 4,-2.6 1,-0.2 5,-0.2 0.879 96.5 54.6 -57.9 -39.0 6.4 -8.4 56.0 121 118 A E H > S+ 0 0 69 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.885 108.1 49.9 -65.0 -31.9 5.7 -12.0 56.8 122 119 A I H X S+ 0 0 10 -4,-0.5 4,-2.3 -3,-0.4 -1,-0.2 0.924 111.9 48.6 -69.2 -42.6 2.8 -11.0 59.0 123 120 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.898 110.0 49.5 -64.0 -44.0 1.4 -8.7 56.3 124 121 A R H X S+ 0 0 119 -4,-2.6 4,-0.8 2,-0.2 -1,-0.2 0.879 110.8 51.8 -65.6 -34.3 1.6 -11.4 53.6 125 122 A R H >< S+ 0 0 116 -4,-1.7 3,-0.8 -5,-0.2 -2,-0.2 0.945 111.4 45.7 -66.5 -46.2 -0.2 -13.8 55.9 126 123 A A H >< S+ 0 0 1 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.917 110.1 55.1 -61.1 -41.3 -3.0 -11.3 56.6 127 124 A A H 3< S+ 0 0 23 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.695 100.4 62.0 -66.7 -18.1 -3.3 -10.5 52.9 128 125 A S T << S+ 0 0 80 -4,-0.8 -1,-0.3 -3,-0.8 -2,-0.2 0.324 72.8 141.0 -90.8 8.8 -3.8 -14.2 52.2 129 126 A L < - 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