==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 14-MAR-10 3M5Y . COMPND 2 MOLECULE: OROTIDINE 5'-PHOSPHATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER THERMAUTOTROPHICUS . AUTHOR A.A.FEDOROV,E.V.FEDOROV,B.M.WOOD,J.A.GERLT,S.C.ALMO . 424 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16889.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 317 74.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 73 17.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 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 . 20 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 158 37.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 0 2 0 2 2 2 2 2 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 11 0 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 5 A R > 0 0 156 0, 0.0 3,-1.0 0, 0.0 169,-0.0 0.000 360.0 360.0 360.0 136.9 13.9 31.4 -35.9 2 6 A V T 3 + 0 0 146 1,-0.2 4,-0.1 4,-0.0 0, 0.0 0.817 360.0 55.9 -68.9 -33.9 11.0 32.8 -38.0 3 7 A D T 3 S+ 0 0 75 2,-0.1 2,-0.3 167,-0.0 -1,-0.2 0.461 97.7 72.7 -86.0 -0.0 8.4 30.0 -37.5 4 8 A V S < S- 0 0 19 -3,-1.0 145,-0.0 1,-0.1 167,-0.0 -0.833 95.7 -80.9-113.7 157.3 8.4 30.1 -33.7 5 9 A M - 0 0 24 -2,-0.3 2,-0.7 1,-0.1 -1,-0.1 -0.104 32.4-132.3 -58.5 143.7 6.9 32.8 -31.5 6 10 A D - 0 0 123 -4,-0.1 2,-0.6 3,-0.0 -1,-0.1 -0.882 21.1-161.8 -95.1 114.0 8.6 36.0 -30.8 7 11 A V > - 0 0 11 -2,-0.7 3,-2.3 180,-0.1 5,-0.1 -0.897 25.4-115.2-102.2 119.0 8.4 36.7 -27.0 8 12 A M G > S- 0 0 51 -2,-0.6 3,-1.6 1,-0.3 27,-0.4 -0.240 93.0 -9.7 -57.0 128.4 9.1 40.3 -26.1 9 13 A N G 3 S- 0 0 68 1,-0.3 -1,-0.3 25,-0.1 3,-0.1 0.631 108.5 -90.3 57.9 14.6 12.3 40.7 -24.1 10 14 A R G < S+ 0 0 99 -3,-2.3 179,-2.8 1,-0.2 2,-0.5 0.756 97.6 122.0 56.3 27.5 12.5 36.9 -23.7 11 15 A L E < -a 189 0A 0 -3,-1.6 25,-0.5 177,-0.2 2,-0.4 -0.966 44.5-166.9-130.1 116.0 10.4 37.3 -20.5 12 16 A I E -a 190 0A 0 177,-3.1 179,-3.1 -2,-0.5 2,-0.6 -0.861 18.2-135.0-101.9 131.9 7.1 35.6 -19.9 13 17 A L E -ab 191 37A 0 23,-2.1 25,-3.6 -2,-0.4 2,-1.0 -0.754 7.3-151.6 -84.0 123.1 4.9 36.7 -17.0 14 18 A A E - b 0 38A 4 177,-2.9 2,-1.4 -2,-0.6 182,-0.2 -0.833 12.3-162.6 -91.2 99.3 3.4 33.8 -15.0 15 19 A M + 0 0 0 23,-2.2 25,-0.5 -2,-1.0 28,-0.2 -0.669 26.1 157.2 -89.6 87.6 0.3 35.5 -13.7 16 20 A D + 0 0 34 -2,-1.4 -1,-0.2 23,-0.1 2,-0.1 0.350 26.1 121.3 -99.0 2.6 -0.6 33.1 -10.9 17 21 A L - 0 0 29 1,-0.1 -2,-0.0 -3,-0.1 6,-0.0 -0.458 53.9-148.1 -66.5 140.2 -2.8 35.4 -8.8 18 22 A M S S+ 0 0 54 -2,-0.1 2,-0.5 28,-0.1 -1,-0.1 0.508 71.2 77.6 -96.6 -6.2 -6.3 34.1 -8.3 19 23 A N S > S- 0 0 61 1,-0.1 4,-2.4 28,-0.0 5,-0.2 -0.908 72.7-139.1-110.6 137.1 -8.3 37.2 -8.1 20 24 A R H > S+ 0 0 76 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 0.836 98.3 54.0 -62.0 -39.3 -9.1 39.1 -11.3 21 25 A D H > S+ 0 0 103 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.951 113.3 41.8 -61.2 -50.2 -8.5 42.6 -10.0 22 26 A D H > S+ 0 0 50 2,-0.2 4,-2.8 1,-0.2 5,-0.4 0.903 114.8 51.7 -62.8 -41.7 -5.0 41.9 -8.7 23 27 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.941 113.7 43.2 -63.5 -45.5 -4.2 39.9 -11.8 24 28 A L H X S+ 0 0 10 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.880 116.9 47.5 -66.0 -39.9 -5.3 42.7 -14.2 25 29 A R H X S+ 0 0 127 -4,-2.3 4,-1.2 -5,-0.2 -2,-0.2 0.958 113.4 44.4 -68.5 -53.1 -3.6 45.4 -12.1 26 30 A V H < S+ 0 0 10 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.880 119.2 46.0 -59.2 -37.3 -0.2 43.8 -11.6 27 31 A T H >X S+ 0 0 2 -4,-1.8 3,-2.3 -5,-0.4 4,-0.6 0.893 101.6 61.7 -73.2 -43.9 -0.2 42.8 -15.3 28 32 A G H >< S+ 0 0 34 -4,-2.5 3,-0.8 1,-0.3 -1,-0.2 0.857 100.7 58.5 -53.5 -33.3 -1.3 46.1 -16.8 29 33 A E T 3< S+ 0 0 97 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.567 106.9 44.0 -76.5 -9.9 1.8 47.7 -15.4 30 34 A V T X> S+ 0 0 1 -3,-2.3 4,-2.3 -4,-0.2 3,-2.1 0.367 74.7 104.9-117.0 3.7 4.2 45.4 -17.2 31 35 A R T << S+ 0 0 78 -3,-0.8 -1,-0.1 -4,-0.6 -2,-0.1 0.670 78.3 62.3 -63.3 -14.2 2.8 45.3 -20.7 32 36 A E T 34 S+ 0 0 151 -4,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.801 115.0 31.0 -75.2 -28.8 5.6 47.6 -21.6 33 37 A Y T <4 S+ 0 0 60 -3,-2.1 2,-0.4 1,-0.2 -2,-0.2 0.663 124.3 41.2-101.4 -22.3 8.1 44.9 -20.7 34 38 A I < + 0 0 2 -4,-2.3 -1,-0.2 -7,-0.1 -22,-0.1 -0.970 40.7 174.6-134.5 139.2 6.2 41.8 -21.5 35 39 A D S S+ 0 0 32 -2,-0.4 27,-3.3 -24,-0.4 2,-0.4 0.353 71.7 68.6-119.8 5.1 3.9 40.8 -24.3 36 40 A T E - c 0 62A 0 -25,-0.5 -23,-2.1 25,-0.2 2,-0.4 -0.977 58.9-175.7-133.3 118.7 3.4 37.1 -23.3 37 41 A V E -bc 13 63A 4 25,-2.8 27,-2.3 -2,-0.4 2,-0.5 -0.944 13.6-150.4-119.9 131.4 1.5 36.1 -20.2 38 42 A K E -bc 14 64A 17 -25,-3.6 -23,-2.2 -2,-0.4 2,-0.4 -0.885 18.2-176.3-100.3 123.7 1.1 32.5 -18.9 39 43 A I E - c 0 65A 2 25,-2.2 27,-3.2 -2,-0.5 2,-0.2 -0.943 2.4-168.2-120.9 146.9 -2.2 31.9 -17.0 40 44 A G E > - c 0 66A 5 -25,-0.5 4,-2.0 -2,-0.4 3,-0.5 -0.537 40.9 -80.1-121.3-173.1 -3.2 28.7 -15.2 41 45 A Y H > S+ 0 0 10 25,-0.7 4,-3.0 1,-0.2 5,-0.5 0.798 114.5 69.5 -63.6 -32.0 -6.2 27.0 -13.7 42 46 A P H > S+ 0 0 5 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.948 111.4 33.1 -55.4 -43.0 -6.0 28.9 -10.3 43 47 A L H > S+ 0 0 1 -3,-0.5 4,-2.7 -28,-0.2 5,-0.4 0.945 121.3 47.2 -74.8 -48.4 -7.0 32.1 -12.1 44 48 A V H X S+ 0 0 3 -4,-2.0 4,-2.1 1,-0.2 -3,-0.2 0.869 113.8 46.9 -67.0 -34.7 -9.3 30.6 -14.8 45 49 A L H < S+ 0 0 13 -4,-3.0 -1,-0.2 -5,-0.2 218,-0.2 0.822 117.1 45.5 -72.8 -29.7 -11.2 28.4 -12.4 46 50 A S H < S+ 0 0 49 -4,-1.0 -2,-0.2 -5,-0.5 -1,-0.2 0.858 130.7 18.2 -79.3 -37.2 -11.6 31.3 -9.9 47 51 A E H < S- 0 0 83 -4,-2.7 -3,-0.2 1,-0.1 -2,-0.2 0.529 110.7-100.9-117.9 -11.2 -12.6 34.0 -12.4 48 52 A G >< - 0 0 24 -4,-2.1 3,-1.8 -5,-0.4 4,-0.2 0.035 30.9 -87.2 102.8 149.2 -13.8 32.2 -15.6 49 53 A M T >> S+ 0 0 15 1,-0.3 3,-2.0 210,-0.2 4,-0.6 0.722 114.8 79.4 -64.6 -20.5 -12.3 31.4 -19.0 50 54 A D H 3> S+ 0 0 142 1,-0.3 4,-1.6 2,-0.2 -1,-0.3 0.727 75.9 76.0 -58.1 -21.3 -13.6 34.8 -20.2 51 55 A I H <> S+ 0 0 3 -3,-1.8 4,-2.3 1,-0.2 -1,-0.3 0.767 84.6 64.0 -64.6 -22.7 -10.5 36.3 -18.4 52 56 A I H <> S+ 0 0 1 -3,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.975 104.8 42.7 -64.5 -52.6 -8.4 35.1 -21.3 53 57 A A H X S+ 0 0 26 -4,-0.6 4,-2.5 33,-0.3 5,-0.2 0.844 111.2 58.5 -60.6 -33.2 -10.1 37.3 -23.8 54 58 A E H X S+ 0 0 36 -4,-1.6 4,-2.8 1,-0.2 5,-0.3 0.927 105.6 47.3 -64.7 -44.5 -10.0 40.1 -21.3 55 59 A F H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 6,-0.7 0.913 112.5 50.2 -58.7 -44.3 -6.2 40.0 -21.0 56 60 A R H X S+ 0 0 95 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.908 115.2 42.5 -66.5 -40.4 -5.8 39.9 -24.7 57 61 A K H < S+ 0 0 175 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.915 118.5 42.9 -71.3 -44.7 -8.1 42.9 -25.2 58 62 A R H < S+ 0 0 142 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.848 133.7 17.3 -71.5 -32.8 -6.8 45.0 -22.4 59 63 A F H < S- 0 0 30 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.2 0.545 88.5-130.7-117.8 -13.6 -3.1 44.4 -22.9 60 64 A G < + 0 0 50 -4,-1.6 -4,-0.2 -5,-0.5 2,-0.1 0.786 58.3 150.1 63.0 28.5 -2.8 43.0 -26.5 61 65 A C - 0 0 5 -6,-0.7 2,-0.3 1,-0.1 -25,-0.2 -0.478 52.9-110.6 -93.1 161.5 -0.7 40.2 -25.1 62 66 A R E -c 36 0A 56 -27,-3.3 -25,-2.8 -2,-0.1 2,-0.5 -0.690 34.0-145.2 -82.1 142.1 -0.2 36.6 -26.2 63 67 A I E -c 37 0A 0 -2,-0.3 26,-1.8 24,-0.3 27,-1.5 -0.962 12.5-166.3-116.3 127.3 -1.7 34.1 -23.7 64 68 A I E -cd 38 90A 0 -27,-2.3 -25,-2.2 -2,-0.5 2,-0.9 -0.962 18.0-142.6-106.7 120.7 -0.3 30.7 -22.9 65 69 A A E -cd 39 91A 0 25,-3.0 27,-2.5 -2,-0.6 2,-1.9 -0.746 7.0-158.5 -85.2 107.1 -2.7 28.5 -21.1 66 70 A D E +c 40 0A 15 -27,-3.2 -25,-0.7 -2,-0.9 -1,-0.1 -0.565 42.3 138.4 -86.5 76.4 -0.7 26.5 -18.5 67 71 A F E - 0 0 6 -2,-1.9 -1,-0.2 25,-0.4 3,-0.2 0.466 53.8-141.6-102.4 -5.5 -3.3 23.7 -18.2 68 72 A K E - 0 0 22 24,-0.3 25,-0.3 -3,-0.2 -2,-0.1 0.892 24.1-145.2 44.7 53.9 -0.9 20.8 -18.1 69 73 A V E + d 0 93A 3 23,-1.8 25,-2.5 1,-0.1 -1,-0.2 -0.248 34.3 161.4 -59.6 129.8 -3.3 18.8 -20.2 70 74 A A + 0 0 6 -3,-0.2 2,-0.2 23,-0.2 -1,-0.1 -0.209 29.4 104.5-151.7 44.1 -3.1 15.1 -19.1 71 75 A D S S- 0 0 11 1,-0.2 265,-0.0 30,-0.1 210,-0.0 -0.490 75.7 -66.8-119.3-173.3 -6.2 13.2 -20.2 72 76 A I > - 0 0 59 -2,-0.2 4,-3.1 1,-0.1 3,-0.3 -0.316 58.7 -98.4 -71.3 163.5 -7.1 10.7 -22.8 73 77 A P H > S+ 0 0 33 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.894 120.8 50.2 -53.9 -48.2 -7.1 11.9 -26.4 74 78 A E H > S+ 0 0 81 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.877 115.6 43.2 -60.5 -39.1 -10.8 12.6 -26.8 75 79 A T H > S+ 0 0 21 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.909 111.6 54.3 -74.5 -42.5 -10.9 14.6 -23.6 76 80 A N H X S+ 0 0 0 -4,-3.1 4,-2.8 1,-0.2 5,-0.2 0.917 105.6 54.3 -51.2 -45.9 -7.6 16.4 -24.5 77 81 A E H X S+ 0 0 74 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.926 110.2 46.2 -55.6 -45.9 -9.2 17.4 -27.8 78 82 A K H X S+ 0 0 35 -4,-1.4 4,-2.6 2,-0.2 5,-0.2 0.881 111.9 50.0 -67.7 -41.7 -12.1 19.0 -26.0 79 83 A I H X S+ 0 0 6 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.944 113.1 46.7 -61.2 -47.3 -10.0 20.8 -23.5 80 84 A C H X S+ 0 0 0 -4,-2.8 4,-2.9 -5,-0.2 5,-0.3 0.937 112.8 49.9 -62.0 -43.0 -7.8 22.2 -26.2 81 85 A R H X S+ 0 0 55 -4,-2.6 4,-2.6 -5,-0.2 -2,-0.2 0.934 112.6 45.4 -63.3 -45.7 -10.8 23.2 -28.3 82 86 A A H X S+ 0 0 11 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.905 114.8 49.9 -63.0 -39.9 -12.5 25.0 -25.4 83 87 A T H <>S+ 0 0 0 -4,-2.4 5,-1.8 -5,-0.2 -2,-0.2 0.905 113.4 43.2 -68.6 -43.4 -9.3 26.7 -24.4 84 88 A F H ><5S+ 0 0 1 -4,-2.9 3,-1.7 1,-0.2 -1,-0.2 0.872 109.6 57.5 -71.7 -35.3 -8.5 28.0 -27.9 85 89 A K H 3<5S+ 0 0 146 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.816 101.7 57.5 -61.8 -28.1 -12.1 29.1 -28.4 86 90 A A T 3<5S- 0 0 25 -4,-1.3 -33,-0.3 -5,-0.2 -1,-0.3 0.517 129.5 -99.6 -79.4 -5.3 -11.6 31.2 -25.3 87 91 A G T < 5 + 0 0 16 -3,-1.7 -24,-0.3 1,-0.3 -3,-0.2 0.400 66.2 155.1 107.8 -3.5 -8.7 32.9 -27.1 88 92 A A < - 0 0 0 -5,-1.8 -1,-0.3 1,-0.2 -24,-0.1 -0.332 32.5-154.9 -58.2 137.1 -5.6 31.2 -25.8 89 93 A D S S+ 0 0 35 -26,-1.8 26,-2.0 1,-0.2 2,-0.3 0.747 76.0 7.7 -81.1 -26.8 -2.7 31.4 -28.3 90 94 A A E -de 64 115A 0 -27,-1.5 -25,-3.0 24,-0.2 2,-0.3 -0.968 62.3-150.8-152.3 162.6 -1.0 28.3 -26.8 91 95 A I E -de 65 116A 0 24,-1.7 26,-2.8 -2,-0.3 2,-0.5 -0.999 16.5-131.9-142.1 140.1 -1.6 25.5 -24.4 92 96 A I E - e 0 117A 2 -27,-2.5 -23,-1.8 -2,-0.3 -25,-0.4 -0.819 27.8-170.3 -97.6 130.2 0.9 23.5 -22.3 93 97 A V E -de 69 118A 0 24,-2.9 26,-2.9 -2,-0.5 2,-0.2 -0.952 21.4-121.0-124.8 138.4 0.4 19.7 -22.4 94 98 A H E - e 0 119A 6 -25,-2.5 26,-0.1 -2,-0.4 -23,-0.1 -0.491 12.2-159.3 -72.1 146.6 1.9 16.8 -20.4 95 99 A G S > S+ 0 0 0 24,-1.0 3,-2.4 -2,-0.2 7,-0.1 0.618 75.0 85.6 -96.0 -19.9 3.8 14.2 -22.3 96 100 A F T 3 S+ 0 0 3 1,-0.3 249,-0.5 23,-0.2 248,-0.4 0.818 79.8 64.1 -60.8 -28.5 3.5 11.4 -19.7 97 101 A P T 3 S- 0 0 0 0, 0.0 4,-0.3 0, 0.0 -1,-0.3 0.560 111.9-117.7 -69.8 -3.6 0.1 10.3 -21.0 98 102 A G <> - 0 0 0 -3,-2.4 4,-1.5 1,-0.2 5,-0.1 -0.278 33.1 -51.6 99.4 179.0 1.8 9.3 -24.3 99 103 A A H > S+ 0 0 20 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.861 123.6 53.5 -70.2 -41.8 1.8 10.1 -27.9 100 104 A D H > S+ 0 0 28 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.913 109.0 51.3 -61.7 -40.3 -1.9 9.8 -28.8 101 105 A S H > S+ 0 0 0 -4,-0.3 4,-1.1 2,-0.2 -1,-0.2 0.874 113.7 44.3 -62.5 -38.1 -2.8 12.2 -26.0 102 106 A V H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 3,-0.4 0.925 111.0 53.7 -69.9 -44.3 -0.2 14.8 -27.3 103 107 A R H X S+ 0 0 110 -4,-3.1 4,-2.6 1,-0.2 -2,-0.2 0.867 100.7 61.3 -59.5 -37.6 -1.3 14.2 -30.9 104 108 A A H X S+ 0 0 8 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.914 108.1 44.0 -51.9 -46.1 -4.9 15.0 -29.9 105 109 A C H X S+ 0 0 0 -4,-1.1 4,-2.7 -3,-0.4 -2,-0.2 0.909 110.5 53.8 -66.6 -47.4 -3.8 18.5 -28.9 106 110 A L H X S+ 0 0 38 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.879 104.7 57.1 -53.3 -41.3 -1.6 18.9 -32.0 107 111 A N H X S+ 0 0 86 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.942 110.6 41.3 -57.1 -50.7 -4.7 18.1 -34.1 108 112 A V H X S+ 0 0 1 -4,-1.5 4,-2.8 1,-0.2 5,-0.2 0.910 112.8 54.5 -67.7 -40.6 -6.8 20.9 -32.6 109 113 A A H X>S+ 0 0 6 -4,-2.7 5,-2.4 1,-0.2 4,-1.2 0.901 110.4 47.3 -57.4 -41.9 -3.9 23.4 -32.6 110 114 A E H <5S+ 0 0 170 -4,-2.5 3,-0.4 -5,-0.2 -2,-0.2 0.937 112.4 49.6 -65.2 -46.3 -3.4 22.7 -36.3 111 115 A E H <5S+ 0 0 126 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.905 120.7 34.5 -55.8 -45.8 -7.1 23.2 -37.0 112 116 A M H <5S- 0 0 50 -4,-2.8 -1,-0.2 -5,-0.1 -2,-0.2 0.483 109.3-114.4 -97.3 -2.5 -7.4 26.4 -35.1 113 117 A G T <5S+ 0 0 62 -4,-1.2 -3,-0.2 -3,-0.4 2,-0.2 0.889 72.5 124.5 71.4 41.3 -3.9 27.9 -35.9 114 118 A R < - 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