==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 23-JAN-10 3LI0 . 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 . 450 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17292.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 341 75.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 76 16.9 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 . 2 0.4 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 . 25 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 160 35.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.8 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 4 0 0 2 0 1 1 6 1 2 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 10 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 3 A S 0 0 43 0, 0.0 171,-0.2 0, 0.0 170,-0.1 0.000 360.0 360.0 360.0 140.7 -21.5 -1.6 1.2 2 4 A R + 0 0 199 169,-3.5 170,-0.2 171,-0.1 2,-0.1 0.571 360.0 102.0-100.8 -14.5 -21.7 -5.3 2.0 3 5 A R - 0 0 65 168,-0.9 3,-0.1 170,-0.2 170,-0.0 -0.435 51.1-164.6 -74.6 147.4 -19.3 -6.5 -0.7 4 6 A V S S+ 0 0 140 1,-0.1 2,-1.2 -2,-0.1 -1,-0.1 0.471 74.9 85.6-104.6 -8.3 -15.8 -7.5 0.4 5 7 A D S S+ 0 0 122 2,-0.0 2,-0.3 3,-0.0 -1,-0.1 -0.437 71.8 101.2 -91.9 58.4 -14.4 -7.5 -3.2 6 8 A V S S- 0 0 38 -2,-1.2 2,-0.2 -3,-0.1 145,-0.0 -0.849 87.0 -75.4-133.1 168.9 -13.7 -3.7 -3.1 7 9 A M - 0 0 16 -2,-0.3 2,-1.1 1,-0.1 -2,-0.0 -0.513 46.6-129.6 -68.9 133.4 -10.6 -1.6 -2.7 8 10 A D - 0 0 112 -2,-0.2 2,-0.7 -4,-0.0 -1,-0.1 -0.735 23.6-159.8 -88.8 97.6 -9.6 -1.6 0.9 9 11 A V > - 0 0 13 -2,-1.1 3,-2.2 186,-0.1 5,-0.1 -0.686 20.0-121.7 -83.5 114.3 -9.2 2.0 1.8 10 12 A M G > S- 0 0 73 -2,-0.7 3,-1.8 1,-0.3 27,-0.3 -0.297 92.3 -8.1 -55.8 129.3 -7.0 2.5 4.9 11 13 A N G 3 S- 0 0 45 1,-0.3 -1,-0.3 25,-0.1 3,-0.1 0.635 109.9 -90.2 55.6 16.8 -9.0 4.5 7.6 12 14 A R G < S+ 0 0 51 -3,-2.2 185,-2.9 1,-0.2 2,-0.5 0.750 95.7 128.2 54.0 25.7 -11.7 5.1 4.9 13 15 A L E < -a 197 0A 0 -3,-1.8 2,-0.5 22,-0.3 25,-0.5 -0.942 40.4-170.5-121.3 116.0 -9.8 8.3 4.0 14 16 A I E -a 198 0A 0 183,-3.3 185,-2.8 -2,-0.5 2,-0.5 -0.894 19.6-135.6-105.1 126.9 -8.8 9.1 0.5 15 17 A L E -ab 199 39A 0 23,-1.7 25,-3.3 -2,-0.5 2,-1.1 -0.707 5.4-149.5 -84.2 124.7 -6.4 12.0 -0.1 16 18 A A E - b 0 40A 5 183,-2.6 2,-1.5 -2,-0.5 188,-0.2 -0.811 16.0-162.2 -92.5 96.4 -7.4 14.3 -3.0 17 19 A M E + b 0 41A 0 23,-2.1 25,-0.6 -2,-1.1 28,-0.3 -0.610 30.7 149.9 -86.1 84.9 -3.9 15.4 -4.0 18 20 A D + 0 0 15 -2,-1.5 -1,-0.2 23,-0.1 2,-0.2 0.112 22.7 127.0-103.4 20.2 -4.6 18.5 -6.1 19 21 A L - 0 0 24 1,-0.1 186,-0.0 2,-0.1 -2,-0.0 -0.519 54.5-144.2 -71.4 148.8 -1.4 20.4 -5.3 20 22 A M S S+ 0 0 57 -2,-0.2 2,-0.4 28,-0.1 -1,-0.1 0.309 72.6 77.9-103.1 12.4 0.2 21.4 -8.6 21 23 A N S > S- 0 0 52 1,-0.1 4,-2.9 28,-0.0 5,-0.2 -0.975 70.6-141.4-124.5 131.7 3.8 21.0 -7.7 22 24 A R H > S+ 0 0 90 -2,-0.4 4,-2.9 1,-0.2 5,-0.3 0.877 102.5 53.1 -56.6 -40.5 5.7 17.7 -7.5 23 25 A D H > S+ 0 0 95 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.954 114.6 38.3 -62.6 -51.8 7.6 18.9 -4.4 24 26 A D H > S+ 0 0 60 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.895 118.0 51.5 -66.4 -40.0 4.6 19.9 -2.4 25 27 A A H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 5,-0.2 0.929 113.5 42.7 -63.2 -46.8 2.5 16.9 -3.6 26 28 A L H X S+ 0 0 26 -4,-2.9 4,-1.9 -5,-0.2 -1,-0.2 0.875 115.4 51.4 -68.6 -35.1 5.2 14.4 -2.7 27 29 A R H X S+ 0 0 132 -4,-2.2 4,-2.3 -5,-0.3 -2,-0.2 0.960 113.2 41.3 -66.8 -52.3 5.9 16.2 0.6 28 30 A V H X S+ 0 0 4 -4,-2.8 4,-1.2 2,-0.2 -2,-0.2 0.924 115.6 50.0 -63.3 -44.8 2.3 16.3 1.8 29 31 A T H X S+ 0 0 4 -4,-2.0 4,-0.5 -5,-0.3 3,-0.5 0.914 112.0 49.2 -60.7 -41.9 1.5 12.7 0.6 30 32 A G H >< S+ 0 0 24 -4,-1.9 3,-0.9 -5,-0.2 4,-0.3 0.903 106.8 55.2 -63.7 -41.0 4.6 11.4 2.4 31 33 A E H 3< S+ 0 0 78 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.731 115.7 38.0 -65.4 -23.7 3.7 13.2 5.6 32 34 A V H >X S+ 0 0 1 -4,-1.2 3,-2.3 -3,-0.5 4,-1.7 0.358 80.7 107.9-109.1 5.0 0.3 11.5 5.7 33 35 A R T << S+ 0 0 124 -3,-0.9 -1,-0.1 -4,-0.5 -2,-0.1 0.778 72.3 65.5 -52.9 -29.3 1.3 8.1 4.4 34 36 A E T 34 S+ 0 0 134 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.746 113.6 30.1 -65.3 -25.1 0.8 6.7 7.9 35 37 A Y T <4 S+ 0 0 52 -3,-2.3 2,-0.4 1,-0.2 -22,-0.3 0.626 120.4 49.2-109.2 -20.5 -2.9 7.4 7.8 36 38 A I < + 0 0 8 -4,-1.7 -1,-0.2 -7,-0.2 -22,-0.1 -0.980 38.9 166.6-129.9 136.9 -3.7 7.1 4.1 37 39 A D + 0 0 34 -2,-0.4 27,-2.7 -24,-0.3 2,-0.4 0.188 68.9 69.3-127.9 10.9 -2.9 4.4 1.5 38 40 A T E - c 0 64A 0 -25,-0.5 -23,-1.7 25,-0.3 2,-0.4 -0.987 62.4-171.4-134.8 122.2 -5.3 5.4 -1.3 39 41 A V E -bc 15 65A 3 25,-2.9 27,-2.4 -2,-0.4 2,-0.7 -0.949 16.6-147.3-122.3 133.0 -4.7 8.6 -3.2 40 42 A K E -bc 16 66A 11 -25,-3.3 -23,-2.1 -2,-0.4 2,-0.5 -0.864 19.4-169.1 -96.1 117.6 -6.9 10.4 -5.7 41 43 A I E +bc 17 67A 1 25,-2.3 27,-2.4 -2,-0.7 2,-0.1 -0.942 9.9 179.3-110.7 128.8 -4.8 12.1 -8.4 42 44 A G E > - c 0 68A 2 -25,-0.6 4,-2.4 -2,-0.5 3,-0.3 -0.416 44.9 -79.9-115.2-168.0 -6.5 14.5 -10.7 43 45 A Y H > S+ 0 0 11 25,-0.7 4,-2.9 1,-0.2 5,-0.4 0.820 116.0 69.3 -67.8 -30.6 -5.7 16.7 -13.7 44 46 A P H 4 S+ 0 0 1 0, 0.0 4,-0.4 0, 0.0 -1,-0.2 0.947 114.1 29.2 -53.9 -45.4 -4.4 19.6 -11.5 45 47 A L H >> S+ 0 0 0 -3,-0.3 4,-2.9 -28,-0.3 3,-0.7 0.928 122.1 50.4 -79.2 -46.0 -1.3 17.4 -10.6 46 48 A V H 3X S+ 0 0 4 -4,-2.4 4,-2.4 1,-0.2 -3,-0.2 0.898 110.4 48.5 -60.2 -43.4 -1.2 15.3 -13.8 47 49 A L H 3< S+ 0 0 11 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.676 117.7 44.6 -72.3 -14.3 -1.3 18.3 -16.2 48 50 A S H <4 S+ 0 0 45 -3,-0.7 -2,-0.2 -5,-0.4 -1,-0.2 0.811 131.6 15.0 -96.2 -36.6 1.4 19.9 -14.1 49 51 A E H < S- 0 0 77 -4,-2.9 -3,-0.2 1,-0.2 -2,-0.2 0.517 105.2-114.1-117.9 -9.0 3.9 17.1 -13.6 50 52 A G >< - 0 0 23 -4,-2.4 3,-1.4 -5,-0.4 4,-0.2 -0.068 36.2 -70.9 95.3 162.3 2.9 14.4 -16.1 51 53 A M T >> S+ 0 0 19 1,-0.3 3,-2.2 2,-0.2 4,-0.6 0.754 118.2 75.6 -64.9 -26.3 1.4 10.9 -15.8 52 54 A D H 3> S+ 0 0 139 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.734 76.6 79.4 -58.7 -20.0 4.7 9.4 -14.4 53 55 A I H <> S+ 0 0 3 -3,-1.4 4,-1.9 1,-0.2 -1,-0.3 0.810 87.3 59.1 -57.1 -28.7 3.7 11.1 -11.2 54 56 A I H <> S+ 0 0 0 -3,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.955 105.4 45.6 -64.9 -51.2 1.4 8.1 -10.7 55 57 A A H X S+ 0 0 53 -4,-0.6 4,-1.8 1,-0.2 -2,-0.2 0.884 111.7 53.8 -59.6 -40.2 4.2 5.5 -10.9 56 58 A E H X S+ 0 0 54 -4,-2.2 4,-3.0 1,-0.2 5,-0.4 0.874 104.0 54.3 -64.8 -38.2 6.3 7.7 -8.5 57 59 A F H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 6,-0.4 0.915 110.6 45.9 -63.2 -41.8 3.6 7.8 -5.9 58 60 A R H < S+ 0 0 124 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.837 114.7 50.0 -69.2 -30.8 3.3 4.0 -5.8 59 61 A K H < S+ 0 0 169 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.2 0.983 121.2 30.8 -69.1 -59.0 7.1 3.8 -5.7 60 62 A R H < S+ 0 0 134 -4,-3.0 2,-0.4 1,-0.1 -2,-0.2 0.871 132.7 32.6 -67.7 -40.0 7.6 6.2 -2.8 61 63 A F S < S- 0 0 12 -4,-2.7 2,-1.5 -5,-0.4 -1,-0.1 -0.927 77.9-131.5-120.1 143.1 4.3 5.4 -1.2 62 64 A G + 0 0 69 -2,-0.4 2,-0.3 -29,-0.1 -4,-0.2 -0.415 62.2 140.6 -90.1 61.6 2.6 2.0 -1.2 63 65 A C - 0 0 11 -2,-1.5 -25,-0.3 -6,-0.4 2,-0.2 -0.717 55.2-120.7-109.9 155.7 -0.7 3.5 -2.2 64 66 A R E -c 38 0A 70 -27,-2.7 -25,-2.9 -2,-0.3 2,-0.5 -0.607 32.2-136.9 -84.4 152.0 -3.5 2.7 -4.5 65 67 A I E -c 39 0A 0 -2,-0.2 26,-2.3 24,-0.2 27,-1.5 -0.955 17.5-170.9-121.7 124.8 -4.2 5.3 -7.2 66 68 A I E -cd 40 92A 0 -27,-2.4 -25,-2.3 -2,-0.5 2,-1.0 -0.953 18.7-145.9-110.8 114.2 -7.6 6.6 -8.4 67 69 A A E -cd 41 93A 1 25,-3.0 27,-2.2 -2,-0.6 2,-1.8 -0.712 8.0-158.9 -83.2 105.3 -7.3 8.8 -11.5 68 70 A D E +c 42 0A 8 -27,-2.4 -25,-0.7 -2,-1.0 -1,-0.1 -0.583 40.0 139.9 -86.2 79.9 -9.9 11.4 -11.1 69 71 A F E - 0 0 6 -2,-1.8 3,-0.2 25,-0.4 -1,-0.2 0.397 52.9-140.8-103.1 1.7 -10.2 12.4 -14.8 70 72 A K E - 0 0 24 -3,-0.2 25,-0.3 1,-0.2 -2,-0.1 0.868 24.3-145.6 35.5 54.9 -14.0 12.8 -14.9 71 73 A V E + d 0 95A 4 23,-1.8 25,-2.4 1,-0.1 -1,-0.2 -0.233 35.5 159.3 -52.5 121.5 -14.0 11.2 -18.3 72 74 A A + 0 0 4 -3,-0.2 2,-0.2 23,-0.1 -1,-0.1 -0.223 28.7 104.4-147.2 51.7 -16.7 12.8 -20.3 73 75 A D S S- 0 0 12 1,-0.2 278,-0.0 30,-0.1 223,-0.0 -0.438 76.4 -64.3-118.8-169.1 -16.2 12.3 -24.0 74 76 A I > - 0 0 24 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.344 59.1 -97.5 -73.8 163.4 -17.6 10.2 -26.8 75 77 A P H > S+ 0 0 34 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.890 121.1 51.3 -49.2 -47.9 -17.2 6.4 -26.5 76 78 A E H > S+ 0 0 106 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.906 114.8 41.1 -59.2 -46.1 -14.1 6.3 -28.8 77 79 A T H > S+ 0 0 10 -3,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.878 111.4 56.9 -70.9 -37.7 -12.2 9.0 -27.0 78 80 A N H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.907 105.1 52.8 -58.7 -42.0 -13.2 7.6 -23.6 79 81 A E H X S+ 0 0 55 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.941 109.9 47.5 -59.3 -47.6 -11.7 4.3 -24.5 80 82 A K H X S+ 0 0 22 -4,-1.5 4,-2.5 1,-0.2 5,-0.2 0.910 111.1 51.0 -60.8 -44.5 -8.4 5.9 -25.4 81 83 A I H X S+ 0 0 5 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.940 111.6 47.1 -59.9 -47.7 -8.3 7.9 -22.2 82 84 A C H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.920 111.4 51.4 -61.3 -43.7 -9.0 4.9 -20.1 83 85 A R H X S+ 0 0 77 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.946 112.4 44.8 -59.0 -49.5 -6.3 2.8 -21.9 84 86 A A H X S+ 0 0 7 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.901 114.6 50.5 -61.5 -41.1 -3.7 5.5 -21.5 85 87 A T H <>S+ 0 0 0 -4,-2.4 5,-1.6 -5,-0.2 -2,-0.2 0.906 112.6 43.0 -66.2 -44.8 -4.6 6.0 -17.8 86 88 A F H ><5S+ 0 0 0 -4,-2.8 3,-1.7 1,-0.2 -1,-0.2 0.872 109.6 58.0 -70.2 -36.1 -4.5 2.3 -16.8 87 89 A K H 3<5S+ 0 0 184 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.878 101.8 58.0 -58.3 -37.0 -1.3 1.8 -18.7 88 90 A A T 3<5S- 0 0 30 -4,-1.5 -1,-0.3 -5,-0.2 -33,-0.2 0.475 129.7 -92.6 -73.8 -4.6 0.2 4.5 -16.6 89 91 A G T < 5S+ 0 0 9 -3,-1.7 2,-0.3 1,-0.3 -24,-0.2 0.579 70.7 151.4 106.6 8.6 -0.6 2.7 -13.4 90 92 A A < - 0 0 0 -5,-1.6 -1,-0.3 1,-0.1 -24,-0.2 -0.564 32.8-158.0 -75.0 137.2 -4.0 3.9 -12.3 91 93 A D S S+ 0 0 54 -26,-2.3 26,-1.4 -2,-0.3 2,-0.3 0.814 75.9 2.5 -81.9 -33.6 -6.0 1.4 -10.3 92 94 A A E -de 66 117A 0 -27,-1.5 -25,-3.0 24,-0.2 2,-0.3 -0.951 64.5-146.2-148.1 163.9 -9.3 3.0 -11.0 93 95 A I E -de 67 118A 0 24,-1.8 26,-2.6 -2,-0.3 2,-0.5 -0.992 16.4-129.4-137.4 141.6 -10.6 5.9 -13.0 94 96 A I E - e 0 119A 2 -27,-2.2 -23,-1.8 -2,-0.3 -25,-0.4 -0.813 28.5-170.3 -94.4 130.7 -13.6 8.3 -12.3 95 97 A V E -de 71 120A 0 24,-3.0 26,-3.0 -2,-0.5 2,-0.2 -0.936 20.9-121.2-124.9 141.5 -16.1 8.7 -15.2 96 98 A H E - e 0 121A 4 -25,-2.4 26,-0.1 -2,-0.4 -23,-0.1 -0.561 12.3-160.7 -79.0 144.4 -19.0 11.1 -15.7 97 99 A G S > S+ 0 0 0 24,-1.4 3,-1.9 -2,-0.2 7,-0.2 0.703 75.4 80.1 -96.5 -21.8 -22.4 9.6 -16.3 98 100 A F T 3 S+ 0 0 4 23,-0.3 262,-0.5 1,-0.3 261,-0.4 0.769 79.8 67.1 -60.4 -27.3 -24.1 12.6 -17.9 99 101 A P T 3 S- 0 0 0 0, 0.0 -1,-0.3 0, 0.0 4,-0.2 0.600 113.4-102.5 -70.7 -6.3 -22.6 12.0 -21.4 100 102 A G <> - 0 0 0 -3,-1.9 4,-1.6 1,-0.1 5,-0.2 -0.309 32.5 -65.2 113.8 166.5 -24.7 8.8 -21.6 101 103 A A H > S+ 0 0 26 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.848 123.1 53.8 -62.9 -40.4 -24.7 5.0 -21.4 102 104 A D H > S+ 0 0 18 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.894 107.9 51.2 -65.3 -36.7 -22.4 4.3 -24.4 103 105 A S H > S+ 0 0 0 2,-0.2 4,-1.1 -4,-0.2 -1,-0.2 0.887 114.0 44.1 -66.5 -38.0 -19.7 6.7 -23.0 104 106 A V H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 3,-0.4 0.927 110.5 54.6 -71.8 -44.1 -19.8 4.9 -19.7 105 107 A R H X S+ 0 0 136 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.890 101.6 59.2 -56.1 -41.2 -19.9 1.4 -21.3 106 108 A A H X S+ 0 0 12 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.907 109.1 43.9 -54.7 -44.0 -16.7 2.3 -23.2 107 109 A C H X S+ 0 0 0 -4,-1.1 4,-2.6 -3,-0.4 -1,-0.2 0.914 111.8 52.9 -68.0 -44.4 -14.9 2.9 -20.0 108 110 A L H X S+ 0 0 36 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.903 107.8 52.0 -58.2 -42.9 -16.3 -0.2 -18.3 109 111 A N H X S+ 0 0 98 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.925 111.1 45.6 -61.9 -45.9 -15.2 -2.4 -21.3 110 112 A V H X S+ 0 0 1 -4,-1.7 4,-2.7 -5,-0.2 6,-0.2 0.935 113.7 49.9 -63.0 -44.9 -11.6 -1.1 -21.1 111 113 A A H X>S+ 0 0 5 -4,-2.6 5,-2.3 1,-0.2 4,-0.8 0.929 110.9 50.6 -57.6 -46.4 -11.5 -1.5 -17.3 112 114 A E H ><5S+ 0 0 151 -4,-2.9 3,-0.9 1,-0.2 -2,-0.2 0.943 112.0 46.2 -56.9 -51.7 -12.9 -5.1 -17.7 113 115 A E H 3<5S+ 0 0 133 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.892 119.0 40.8 -59.8 -42.4 -10.2 -6.0 -20.3 114 116 A M H 3<5S- 0 0 60 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.417 110.1-119.1 -89.5 2.3 -7.4 -4.5 -18.2 115 117 A G T <<5S+ 0 0 67 -3,-0.9 -3,-0.2 -4,-0.8 2,-0.1 0.768 73.3 120.7 68.1 26.2 -8.7 -5.8 -14.9 116 118 A R < - 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