==== 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 05-DEC-95 1TSY . COMPND 2 MOLECULE: THYMIDYLATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS CASEI; . AUTHOR J.FINER-MOORE,R.M.STROUD . 316 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15440.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 224 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 13.0 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 26 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 29.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 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 1 2 0 1 0 1 1 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 2 1 0 0 0 1 0 0 1 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 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 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 0 137 0, 0.0 3,-1.9 0, 0.0 276,-0.0 0.000 360.0 360.0 360.0 158.0 4.5 28.2 -44.6 2 2 A L T 3 + 0 0 34 1,-0.3 4,-0.2 2,-0.1 37,-0.1 0.809 360.0 45.8 -50.5 -42.0 3.5 31.8 -44.7 3 3 A E T >> S+ 0 0 8 1,-0.2 3,-1.3 2,-0.1 4,-1.3 0.470 80.9 105.4 -85.3 1.9 6.7 33.2 -46.2 4 4 A Q H <> + 0 0 55 -3,-1.9 4,-2.9 1,-0.3 -1,-0.2 0.810 69.2 63.8 -52.5 -36.5 7.0 30.5 -48.8 5 5 A P H 3> S+ 0 0 33 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.907 102.4 50.5 -56.3 -38.3 5.9 32.8 -51.6 6 6 A Y H X> S+ 0 0 0 -3,-1.3 4,-2.1 2,-0.2 3,-0.6 0.954 111.2 46.6 -63.4 -50.2 9.1 34.9 -51.0 7 7 A L H 3X S+ 0 0 5 -4,-1.3 4,-2.2 1,-0.3 -1,-0.2 0.886 110.7 54.8 -58.1 -39.5 11.3 31.8 -51.1 8 8 A D H 3X S+ 0 0 76 -4,-2.9 4,-2.1 1,-0.2 -1,-0.3 0.799 106.9 50.3 -63.9 -30.9 9.4 30.7 -54.3 9 9 A L H X S+ 0 0 81 -4,-2.2 4,-2.7 2,-0.2 3,-0.7 0.958 109.9 52.2 -62.1 -53.0 14.0 30.3 -56.6 12 12 A K H 3X S+ 0 0 75 -4,-2.1 4,-3.0 1,-0.3 5,-0.3 0.861 108.3 50.1 -54.0 -42.3 12.2 31.4 -59.8 13 13 A V H 3X S+ 0 0 0 -4,-2.2 4,-1.1 1,-0.2 -1,-0.3 0.818 112.3 48.6 -68.5 -27.8 14.6 34.2 -60.4 14 14 A L H << S+ 0 0 53 -4,-1.2 -2,-0.2 -3,-0.7 -1,-0.2 0.906 117.2 41.5 -75.0 -42.6 17.5 31.8 -60.0 15 15 A D H < S+ 0 0 128 -4,-2.7 -2,-0.2 1,-0.1 -3,-0.2 0.907 137.7 5.1 -71.2 -47.3 15.9 29.3 -62.4 16 16 A E H < S+ 0 0 122 -4,-3.0 2,-0.3 -5,-0.2 -3,-0.2 0.240 85.9 126.7-129.6 15.3 14.6 31.5 -65.1 17 17 A G < - 0 0 13 -4,-1.1 2,-0.3 -5,-0.3 14,-0.2 -0.592 54.9-134.8 -75.2 128.9 15.7 35.1 -64.4 18 18 A H E -A 30 0A 110 12,-2.0 12,-2.6 -2,-0.3 2,-0.1 -0.670 24.9-103.6 -85.2 141.7 17.4 36.4 -67.5 19 19 A F E +A 29 0A 115 -2,-0.3 10,-0.2 10,-0.2 -1,-0.1 -0.457 46.9 177.0 -61.8 135.6 20.7 38.3 -67.0 20 20 A K E -A 28 0A 88 8,-2.2 8,-1.3 -2,-0.1 2,-0.1 -0.980 25.7-129.7-146.1 122.1 19.9 42.0 -67.3 21 21 A P - 0 0 98 0, 0.0 2,-0.3 0, 0.0 8,-0.0 -0.479 28.4-158.9 -70.0 149.8 22.4 44.8 -66.8 22 22 A D > - 0 0 27 -2,-0.1 3,-2.6 1,-0.0 4,-0.1 -0.866 32.7 -94.7-129.5 167.8 21.4 47.6 -64.5 23 23 A R T 3 S+ 0 0 170 1,-0.3 -1,-0.0 -2,-0.3 0, 0.0 0.735 119.4 59.7 -50.0 -30.6 22.3 51.2 -63.9 24 24 A T T 3 S- 0 0 25 1,-0.1 -1,-0.3 291,-0.0 292,-0.1 0.409 103.0-130.7 -82.3 5.2 24.7 50.4 -61.0 25 25 A H S < S+ 0 0 178 -3,-2.6 -2,-0.1 1,-0.1 -1,-0.1 0.582 79.1 115.2 55.2 11.9 26.8 48.3 -63.5 26 26 A T S S- 0 0 43 -4,-0.1 -1,-0.1 1,-0.1 2,-0.1 0.951 73.5-124.0 -73.6 -52.4 26.6 45.5 -60.9 27 27 A G - 0 0 3 -7,-0.1 235,-2.0 235,-0.1 236,-0.3 -0.018 27.2-157.6 112.7 139.7 24.5 43.0 -62.8 28 28 A T E -AB 20 261A 1 -8,-1.3 -8,-2.2 233,-0.3 2,-0.5 -0.905 20.1-134.3-143.2 170.6 21.2 41.3 -62.1 29 29 A Y E +AB 19 260A 77 231,-2.1 231,-2.3 -2,-0.3 2,-0.3 -1.000 43.8 178.7-125.0 117.9 19.0 38.3 -62.9 30 30 A S E -AB 18 259A 1 -12,-2.6 -12,-2.0 -2,-0.5 2,-0.3 -0.861 30.3-165.2-132.4 166.7 15.5 39.5 -63.4 31 31 A I E - B 0 258A 15 227,-1.8 227,-1.8 -2,-0.3 2,-0.6 -0.974 22.8-134.0-140.2 144.7 11.9 38.6 -64.3 32 32 A F E S+ B 0 257A 160 -2,-0.3 225,-0.2 225,-0.2 224,-0.1 -0.924 72.7 11.2-108.9 120.5 9.1 41.0 -65.3 33 33 A G E + 0 0 44 223,-2.5 2,-0.3 -2,-0.6 223,-0.2 0.710 65.8 155.7 84.5 110.9 5.7 40.7 -63.7 34 34 A H E - B 0 255A 42 221,-0.9 221,-3.0 -3,-0.1 2,-0.3 -0.965 18.2-162.9-159.8 153.8 5.0 38.5 -60.7 35 35 A Q E + B 0 254A 101 -2,-0.3 2,-0.3 219,-0.2 219,-0.2 -0.997 8.2 175.5-148.6 137.7 2.5 38.5 -57.9 36 36 A M E - B 0 253A 10 217,-1.8 217,-3.3 -2,-0.3 2,-0.3 -0.964 12.5-153.5-138.9 152.6 2.3 36.8 -54.5 37 37 A R E - B 0 252A 117 -2,-0.3 2,-0.4 215,-0.2 215,-0.2 -0.931 1.5-155.7-128.7 153.8 -0.3 37.1 -51.7 38 38 A F E - B 0 251A 4 213,-1.6 213,-1.8 -2,-0.3 2,-1.3 -0.999 18.6-134.2-129.5 129.8 -0.1 36.6 -48.0 39 39 A D E > - B 0 250A 61 -2,-0.4 3,-2.8 211,-0.2 4,-0.4 -0.712 17.0-164.3 -85.0 99.6 -3.1 35.6 -45.8 40 40 A L T 3 S+ 0 0 7 -2,-1.3 3,-0.4 209,-1.3 -1,-0.2 0.582 83.9 68.5 -61.0 -11.8 -2.7 38.1 -43.0 41 41 A S T 3 S+ 0 0 68 208,-0.4 -1,-0.3 1,-0.2 3,-0.1 0.609 96.0 57.1 -81.2 -11.5 -5.1 36.1 -40.9 42 42 A K S < S- 0 0 148 -3,-2.8 2,-0.3 1,-0.3 237,-0.2 0.563 123.3 -70.3 -93.9 -11.7 -2.4 33.4 -40.7 43 43 A G - 0 0 11 -3,-0.4 -1,-0.3 -4,-0.4 238,-0.2 -0.895 61.4 -54.1 147.5-179.6 0.3 35.6 -39.3 44 44 A F - 0 0 1 236,-2.9 2,-2.0 -2,-0.3 187,-0.1 -0.848 44.5-133.1 -96.3 126.8 2.6 38.4 -39.9 45 45 A P + 0 0 4 0, 0.0 2,-0.6 0, 0.0 189,-0.1 -0.292 56.5 135.4 -74.9 53.8 4.8 38.0 -43.0 46 46 A L - 0 0 2 -2,-2.0 -43,-0.1 234,-0.1 -2,-0.1 -0.920 65.4-104.6-100.8 123.5 8.1 39.0 -41.5 47 47 A L - 0 0 2 -2,-0.6 5,-0.4 180,-0.2 3,-0.1 -0.185 33.6-175.8 -52.9 139.3 10.7 36.4 -42.6 48 48 A T S S+ 0 0 0 229,-0.1 259,-2.1 258,-0.1 -1,-0.1 0.657 78.4 72.7-106.1 -25.8 11.9 33.7 -40.2 49 49 A T S S+ 0 0 0 257,-0.2 2,-0.2 1,-0.1 -1,-0.1 0.392 115.3 18.1 -70.6 7.7 14.5 32.2 -42.5 50 50 A K S S- 0 0 14 257,-0.1 2,-0.4 -3,-0.1 259,-0.2 -0.865 92.0-101.3-174.5 139.0 16.5 35.4 -41.9 51 51 A K - 0 0 124 256,-0.4 259,-0.3 257,-0.3 -3,-0.1 -0.561 36.0-171.8 -74.3 125.3 16.5 38.1 -39.2 52 52 A V - 0 0 4 -5,-0.4 2,-1.4 -2,-0.4 3,-0.1 -0.967 27.7-121.1-120.3 131.1 14.8 41.4 -40.2 53 53 A P >> - 0 0 59 0, 0.0 4,-0.9 0, 0.0 3,-0.9 -0.532 27.8-178.6 -73.2 91.9 14.9 44.5 -38.1 54 54 A F H 3> S+ 0 0 19 -2,-1.4 4,-2.9 1,-0.3 5,-0.2 0.752 77.4 68.1 -60.6 -27.2 11.2 45.3 -37.5 55 55 A G H 3> S+ 0 0 42 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.915 98.5 49.4 -61.0 -41.4 12.1 48.4 -35.6 56 56 A L H <> S+ 0 0 52 -3,-0.9 4,-1.5 1,-0.2 -1,-0.2 0.801 112.4 51.1 -66.7 -28.4 13.4 50.0 -38.7 57 57 A I H X S+ 0 0 2 -4,-0.9 4,-2.3 2,-0.2 -2,-0.2 0.948 111.2 43.4 -75.3 -50.3 10.1 49.0 -40.4 58 58 A K H X S+ 0 0 23 -4,-2.9 4,-2.5 2,-0.2 5,-0.2 0.924 115.4 48.4 -64.9 -42.4 7.7 50.4 -37.8 59 59 A S H X S+ 0 0 3 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.969 113.3 46.3 -62.5 -52.0 9.6 53.7 -37.3 60 60 A E H X S+ 0 0 24 -4,-1.5 4,-2.3 -5,-0.3 -1,-0.2 0.881 112.4 51.6 -58.5 -40.1 9.9 54.4 -41.0 61 61 A L H X S+ 0 0 4 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.949 110.6 47.0 -63.9 -47.6 6.2 53.6 -41.6 62 62 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 6,-0.3 0.896 107.7 57.8 -58.8 -40.9 5.1 55.9 -38.8 63 63 A W H <>S+ 0 0 0 -4,-2.6 5,-1.6 -5,-0.2 4,-0.5 0.959 109.8 44.6 -52.8 -49.7 7.4 58.6 -40.3 64 64 A F H ><5S+ 0 0 6 -4,-2.3 3,-2.4 1,-0.2 -2,-0.2 0.962 111.3 53.0 -58.8 -54.5 5.4 58.1 -43.5 65 65 A L H 3<5S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.751 103.3 57.0 -51.8 -34.2 2.1 58.2 -41.7 66 66 A H T 3<5S- 0 0 67 -4,-2.3 -1,-0.3 -3,-0.4 -2,-0.2 0.604 112.1-120.4 -75.8 -10.5 2.9 61.5 -40.0 67 67 A G T < 5 + 0 0 24 -3,-2.4 -3,-0.2 -4,-0.5 -2,-0.1 0.656 61.0 158.4 77.5 16.0 3.4 63.0 -43.4 68 68 A D < + 0 0 46 -5,-1.6 79,-0.3 -6,-0.3 -1,-0.2 -0.360 28.5 173.1 -74.1 149.7 6.9 63.7 -42.2 69 69 A T + 0 0 26 78,-0.1 73,-2.6 -3,-0.1 2,-0.6 0.271 49.3 102.4-137.5 0.9 9.8 64.3 -44.6 70 70 A N B > -F 141 0B 27 71,-0.3 3,-1.4 1,-0.1 4,-0.5 -0.840 62.0-148.0-100.8 123.3 12.5 65.3 -42.2 71 71 A I T >> S+ 0 0 0 69,-3.0 4,-1.9 -2,-0.6 3,-1.2 0.790 85.8 86.0 -52.7 -33.6 15.1 62.7 -41.4 72 72 A R H 3> S+ 0 0 43 1,-0.3 4,-2.0 68,-0.2 -1,-0.3 0.818 86.8 54.2 -39.0 -44.0 15.5 64.2 -37.9 73 73 A F H <4 S+ 0 0 26 -3,-1.4 4,-0.4 1,-0.2 -1,-0.3 0.922 109.5 47.4 -58.2 -49.4 12.6 62.0 -36.8 74 74 A L H X4>S+ 0 0 0 -3,-1.2 3,-2.5 -4,-0.5 5,-2.3 0.948 109.6 50.1 -59.1 -54.2 14.3 58.9 -38.0 75 75 A L H ><5S+ 0 0 11 -4,-1.9 3,-2.3 1,-0.3 -1,-0.2 0.859 102.4 63.9 -55.3 -34.1 17.7 59.6 -36.4 76 76 A Q T 3<5S+ 0 0 119 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.697 108.9 40.9 -61.1 -21.6 15.8 60.2 -33.2 77 77 A H T < 5S- 0 0 59 -3,-2.5 -1,-0.3 -4,-0.4 -2,-0.2 0.140 118.8-111.5-110.2 14.4 14.9 56.5 -33.5 78 78 A R T < 5S+ 0 0 214 -3,-2.3 2,-0.8 1,-0.2 -3,-0.2 0.637 71.0 144.6 64.8 15.2 18.4 55.4 -34.7 79 79 A N < + 0 0 0 -5,-2.3 3,-0.3 -6,-0.2 -1,-0.2 -0.757 21.0 172.1 -88.8 110.8 16.9 54.6 -38.1 80 80 A H > + 0 0 95 -2,-0.8 3,-1.2 1,-0.2 4,-0.5 0.320 38.3 117.6-103.2 12.7 19.5 55.5 -40.7 81 81 A I T 3 S+ 0 0 62 1,-0.3 -1,-0.2 2,-0.1 3,-0.0 0.710 85.8 33.2 -51.1 -27.4 17.7 54.1 -43.8 82 82 A W T >> S+ 0 0 40 -3,-0.3 3,-1.5 1,-0.1 4,-1.1 0.496 85.3 101.6-111.5 -3.5 17.5 57.5 -45.5 83 83 A D H X> S+ 0 0 7 -3,-1.2 4,-3.0 1,-0.3 3,-0.8 0.902 74.8 63.2 -46.1 -54.4 20.6 59.3 -44.3 84 84 A E H 3> S+ 0 0 78 -4,-0.5 4,-1.3 1,-0.3 -1,-0.3 0.796 102.5 52.4 -42.7 -36.6 22.5 58.7 -47.6 85 85 A W H <> S+ 0 0 97 -3,-1.5 4,-0.9 2,-0.2 -1,-0.3 0.917 114.8 37.5 -71.3 -44.1 19.8 60.8 -49.3 86 86 A A H < S+ 0 0 14 -4,-1.7 3,-2.2 1,-0.2 6,-0.4 0.940 108.4 51.7 -49.8 -55.6 24.9 68.6 -47.6 91 91 A V H 3< S+ 0 0 20 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.859 112.3 45.8 -52.0 -40.9 28.0 67.4 -49.4 92 92 A K T 3< S+ 0 0 139 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.262 93.4 107.2 -90.8 14.0 27.0 69.2 -52.6 93 93 A S S X S- 0 0 22 -3,-2.2 3,-0.7 -4,-0.2 -3,-0.0 -0.548 77.3-124.2 -90.0 159.4 26.1 72.5 -50.7 94 94 A D T 3 S+ 0 0 144 1,-0.2 -1,-0.1 -2,-0.2 -4,-0.1 0.655 112.9 59.1 -73.8 -16.7 28.1 75.7 -50.8 95 95 A E T 3 S+ 0 0 97 -5,-0.1 2,-0.7 2,-0.0 -1,-0.2 0.688 83.0 98.3 -83.4 -21.0 28.2 75.5 -47.0 96 96 A Y < + 0 0 21 -3,-0.7 2,-0.4 -6,-0.4 -5,-0.0 -0.573 44.8 166.3 -73.7 112.7 29.9 72.1 -47.1 97 97 A H + 0 0 168 -2,-0.7 -1,-0.1 3,-0.0 -3,-0.0 -0.828 37.0 80.4-132.1 91.0 33.6 72.6 -46.6 98 98 A G S S- 0 0 40 -2,-0.4 3,-0.1 -7,-0.1 -2,-0.0 -0.893 83.0 -15.4-164.3-166.8 35.4 69.3 -45.9 99 99 A P S S- 0 0 50 0, 0.0 2,-0.2 0, 0.0 -1,-0.0 -0.159 74.7-101.8 -51.6 130.9 36.8 66.2 -47.6 100 100 A D - 0 0 120 1,-0.1 -3,-0.0 -3,-0.0 -9,-0.0 -0.387 36.3-169.9 -57.2 119.5 35.6 65.7 -51.2 101 101 A M > + 0 0 1 -2,-0.2 3,-2.2 -10,-0.1 4,-0.2 0.106 20.2 160.8-102.3 22.0 32.9 63.0 -50.9 102 102 A T T 3 S- 0 0 77 1,-0.3 5,-0.0 2,-0.1 -2,-0.0 -0.119 76.3 -7.6 -48.9 131.5 32.4 62.2 -54.6 103 103 A D T >> S+ 0 0 105 1,-0.1 4,-2.4 4,-0.1 3,-1.0 0.719 83.8 163.5 48.4 31.1 30.7 58.9 -55.2 104 104 A F H <> + 0 0 8 -3,-2.2 4,-2.2 1,-0.2 5,-0.3 0.746 58.3 72.3 -45.5 -35.4 31.1 58.2 -51.4 105 105 A G H 34 S+ 0 0 10 1,-0.2 -1,-0.2 2,-0.2 4,-0.2 0.900 119.6 10.8 -50.4 -56.5 28.5 55.4 -51.6 106 106 A H H <> S+ 0 0 60 -3,-1.0 4,-0.7 210,-0.3 -1,-0.2 0.536 119.1 72.2-100.6 -13.5 30.7 52.9 -53.4 107 107 A R H >< S+ 0 0 64 -4,-2.4 3,-0.6 1,-0.2 8,-0.2 0.875 101.8 46.9 -67.2 -35.0 33.9 54.9 -53.0 108 108 A S G >< S+ 0 0 24 -4,-2.2 3,-1.3 -5,-0.3 7,-0.3 0.810 104.0 62.6 -73.0 -30.3 33.7 53.8 -49.4 109 109 A Q G 34 S+ 0 0 96 1,-0.3 -1,-0.2 -5,-0.3 -2,-0.2 0.708 109.7 40.9 -66.4 -20.1 33.0 50.3 -50.6 110 110 A K G << S+ 0 0 138 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 -0.026 114.2 51.2-119.0 30.9 36.5 50.4 -52.2 111 111 A D <> - 0 0 45 -3,-1.3 4,-2.8 1,-0.1 5,-0.2 -0.574 53.5-162.5-171.5 105.0 38.5 52.0 -49.5 112 112 A P T 4 S+ 0 0 106 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.767 100.6 42.8 -57.4 -32.0 38.7 51.2 -45.7 113 113 A E T > S+ 0 0 139 2,-0.2 4,-1.8 3,-0.1 5,-0.2 0.803 110.6 52.7 -87.6 -31.6 40.2 54.6 -45.0 114 114 A F H > S+ 0 0 23 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.936 107.2 54.4 -66.5 -43.8 37.9 56.6 -47.3 115 115 A A H X S+ 0 0 30 -4,-2.8 4,-2.2 -7,-0.3 -1,-0.2 0.738 105.4 57.2 -59.6 -21.2 35.0 54.9 -45.4 116 116 A A H > S+ 0 0 47 -5,-0.2 4,-0.9 2,-0.2 -2,-0.2 0.954 111.2 36.7 -75.2 -53.1 36.7 56.3 -42.3 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