==== 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/LYASE INHIBITOR 05-FEB-11 3QMR . COMPND 2 MOLECULE: OROTIDINE 5'-PHOSPHATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER THERMAUTOTROPHICUS . AUTHOR A.A.FEDOROV,E.V.FEDOROV,B.DESAI,J.A.GERLT,S.C.ALMO . 437 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16749.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 336 76.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 76 17.4 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 0.5 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 . 24 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 160 36.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 4 0 0 2 0 1 3 4 0 2 2 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 8 A V 0 0 133 0, 0.0 145,-0.0 0, 0.0 167,-0.0 0.000 360.0 360.0 360.0 149.0 21.2 20.7 8.5 2 9 A M - 0 0 35 1,-0.1 2,-1.1 2,-0.0 0, 0.0 -0.253 360.0-123.8 -54.0 140.3 23.4 18.7 10.9 3 10 A D - 0 0 124 29,-0.1 2,-0.7 4,-0.0 -1,-0.1 -0.742 26.9-162.0 -93.2 94.0 27.0 18.8 9.8 4 11 A V > - 0 0 10 -2,-1.1 3,-2.0 1,-0.1 5,-0.1 -0.652 20.3-123.8 -83.0 113.6 28.1 15.2 9.5 5 12 A M G > S- 0 0 76 -2,-0.7 3,-1.7 1,-0.3 27,-0.3 -0.306 89.3 -6.6 -58.8 130.2 31.8 14.8 9.5 6 13 A N G 3 S- 0 0 46 1,-0.3 -1,-0.3 25,-0.1 3,-0.1 0.610 109.6 -89.6 60.3 14.2 33.1 13.0 6.4 7 14 A R G < S+ 0 0 62 -3,-2.0 185,-2.5 1,-0.2 2,-0.4 0.776 96.9 125.5 56.7 28.7 29.5 12.3 5.4 8 15 A L E < -a 192 0A 0 -3,-1.7 2,-0.5 183,-0.2 25,-0.4 -0.970 42.3-169.9-129.4 120.3 29.9 9.1 7.4 9 16 A I E -a 193 0A 0 183,-3.1 185,-2.9 -2,-0.4 2,-0.5 -0.936 20.1-135.3-112.3 122.2 27.6 7.9 10.2 10 17 A L E -ab 194 34A 0 23,-1.7 25,-3.2 -2,-0.5 2,-1.0 -0.610 6.7-149.6 -75.6 123.3 28.6 4.9 12.4 11 18 A A E - b 0 35A 4 183,-2.4 2,-1.5 -2,-0.5 188,-0.2 -0.819 14.2-160.9 -89.2 100.5 25.8 2.4 13.1 12 19 A M E + b 0 36A 0 23,-2.3 25,-0.5 -2,-1.0 28,-0.2 -0.630 30.9 150.9 -88.7 84.5 26.9 1.2 16.5 13 20 A D + 0 0 14 -2,-1.5 -1,-0.2 23,-0.1 2,-0.2 0.129 24.7 124.3-104.5 16.4 25.0 -2.1 16.7 14 21 A L - 0 0 25 1,-0.1 186,-0.0 2,-0.1 -2,-0.0 -0.509 52.2-150.4 -67.8 150.2 27.4 -4.0 19.0 15 22 A M + 0 0 51 -2,-0.2 2,-0.5 28,-0.1 -1,-0.1 0.347 68.5 86.1-112.3 6.3 25.5 -5.2 22.1 16 23 A N > - 0 0 64 1,-0.1 4,-2.8 28,-0.0 5,-0.3 -0.919 68.9-144.1-112.3 129.0 28.4 -5.1 24.5 17 24 A R H > S+ 0 0 85 -2,-0.5 4,-2.4 1,-0.2 5,-0.2 0.931 100.0 48.4 -58.3 -48.5 29.2 -1.8 26.4 18 25 A D H > S+ 0 0 103 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.895 115.4 43.8 -60.3 -44.7 32.9 -2.4 26.4 19 26 A D H > S+ 0 0 65 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.907 112.7 51.2 -68.0 -44.8 33.1 -3.3 22.7 20 27 A A H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.917 114.0 45.2 -59.6 -42.5 30.8 -0.4 21.6 21 28 A L H X S+ 0 0 8 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.908 112.9 50.4 -67.3 -42.9 32.9 2.1 23.5 22 29 A R H X S+ 0 0 117 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.975 114.9 41.9 -59.8 -55.5 36.2 0.7 22.2 23 30 A V H X S+ 0 0 0 -4,-2.7 4,-1.2 1,-0.2 -1,-0.2 0.905 114.7 50.0 -61.1 -43.6 35.1 0.7 18.6 24 31 A T H >< S+ 0 0 4 -4,-2.2 3,-0.6 -5,-0.3 4,-0.4 0.934 111.6 49.1 -63.8 -43.2 33.4 4.1 18.8 25 32 A G H >< S+ 0 0 14 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.845 106.7 57.4 -60.7 -36.5 36.5 5.6 20.5 26 33 A E H 3< S+ 0 0 77 -4,-2.0 3,-0.2 1,-0.2 -1,-0.2 0.755 112.6 38.5 -68.4 -26.9 38.8 4.1 17.8 27 34 A V T XX S+ 0 0 2 -4,-1.2 3,-2.4 -3,-0.6 4,-1.0 0.322 81.8 111.9-105.8 8.1 37.0 5.8 14.9 28 35 A R T <4 S+ 0 0 132 -3,-0.8 3,-0.2 -4,-0.4 -1,-0.1 0.754 70.5 60.3 -55.6 -30.5 36.4 9.1 16.7 29 36 A E T 34 S+ 0 0 133 -3,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.664 111.6 40.7 -72.5 -13.0 38.8 11.1 14.5 30 37 A Y T <4 S+ 0 0 54 -3,-2.4 2,-0.4 1,-0.2 -1,-0.2 0.617 116.3 41.4-107.0 -17.8 36.7 10.2 11.4 31 38 A I < + 0 0 10 -4,-1.0 -1,-0.2 -3,-0.2 -22,-0.1 -0.997 37.8 175.3-144.7 130.6 33.1 10.5 12.7 32 39 A D S S+ 0 0 30 -2,-0.4 27,-2.9 -24,-0.3 2,-0.4 0.230 72.5 70.9-116.4 11.9 31.2 12.9 14.8 33 40 A T E - c 0 59A 0 -25,-0.4 -23,-1.7 25,-0.3 2,-0.4 -0.983 58.8-175.2-137.3 122.9 27.8 11.3 14.3 34 41 A V E -bc 10 60A 3 25,-2.4 27,-2.4 -2,-0.4 2,-0.6 -0.959 16.8-146.9-125.7 128.7 26.7 8.0 15.7 35 42 A K E -bc 11 61A 13 -25,-3.2 -23,-2.3 -2,-0.4 2,-0.5 -0.869 17.7-167.9 -94.6 121.0 23.5 6.0 15.2 36 43 A I E +bc 12 62A 1 25,-2.5 27,-2.9 -2,-0.6 2,-0.1 -0.948 11.3 178.6-112.1 125.9 22.4 4.1 18.3 37 44 A G E > - c 0 63A 1 -25,-0.5 4,-2.3 -2,-0.5 3,-0.4 -0.430 44.9 -80.8-115.0-171.0 19.7 1.5 17.9 38 45 A Y H > S+ 0 0 13 25,-0.7 4,-2.7 1,-0.2 5,-0.4 0.791 115.5 69.1 -67.5 -29.5 17.8 -1.0 20.0 39 46 A P H > S+ 0 0 1 0, 0.0 4,-0.6 0, 0.0 -1,-0.2 0.954 114.5 29.2 -55.8 -43.1 20.4 -3.7 19.8 40 47 A L H > S+ 0 0 0 -3,-0.4 4,-2.4 -28,-0.2 5,-0.4 0.913 122.1 50.6 -80.4 -43.1 22.7 -1.6 22.1 41 48 A V H X S+ 0 0 4 -4,-2.3 4,-2.1 1,-0.2 -3,-0.2 0.878 111.3 47.8 -63.9 -38.2 20.0 0.3 24.0 42 49 A L H < S+ 0 0 9 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.747 117.1 44.5 -76.8 -20.4 18.1 -2.9 24.9 43 50 A S H < S+ 0 0 43 -4,-0.6 -2,-0.2 -5,-0.4 -1,-0.2 0.804 131.3 17.1 -87.1 -34.1 21.4 -4.5 26.0 44 51 A E H < S- 0 0 74 -4,-2.4 -3,-0.2 1,-0.1 3,-0.2 0.472 104.9-113.6-124.5 -7.1 22.9 -1.6 28.0 45 52 A G >< - 0 0 23 -4,-2.1 3,-1.9 -5,-0.4 4,-0.2 0.006 38.3 -71.6 91.9 160.3 20.1 0.9 28.8 46 53 A M T >> S+ 0 0 18 1,-0.3 3,-1.7 2,-0.2 4,-0.7 0.710 120.3 78.6 -62.5 -20.6 19.3 4.4 27.7 47 54 A D H 3> S+ 0 0 130 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.601 74.7 78.1 -62.4 -10.7 22.2 5.6 29.9 48 55 A I H <> S+ 0 0 2 -3,-1.9 4,-2.2 1,-0.2 -1,-0.3 0.838 88.4 56.0 -68.7 -29.0 24.4 4.4 27.0 49 56 A I H <> S+ 0 0 0 -3,-1.7 4,-2.1 -4,-0.2 -1,-0.2 0.927 107.2 48.9 -64.2 -42.5 23.5 7.6 25.2 50 57 A A H X S+ 0 0 53 -4,-0.7 4,-2.0 1,-0.2 -2,-0.2 0.875 110.7 50.3 -64.0 -40.3 24.7 9.6 28.3 51 58 A E H X S+ 0 0 48 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.879 109.5 50.3 -68.3 -37.9 28.0 7.6 28.3 52 59 A F H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 6,-0.3 0.885 111.3 48.6 -66.7 -38.6 28.6 8.2 24.6 53 60 A R H < S+ 0 0 124 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.876 113.7 47.4 -68.9 -36.6 28.0 11.9 25.0 54 61 A K H < S+ 0 0 177 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.943 120.5 37.1 -66.3 -46.8 30.4 12.0 28.0 55 62 A R H < S+ 0 0 107 -4,-2.6 2,-0.3 -5,-0.1 -2,-0.2 0.834 120.0 33.6 -78.7 -36.5 33.1 10.0 26.2 56 63 A F S < S- 0 0 11 -4,-2.7 2,-1.8 -5,-0.2 -1,-0.1 -0.880 72.8-119.9-127.4 153.4 32.9 11.3 22.6 57 64 A G + 0 0 75 -2,-0.3 2,-0.4 -29,-0.1 -4,-0.1 -0.461 69.0 140.0 -83.0 64.2 32.2 14.5 20.7 58 65 A C - 0 0 3 -2,-1.8 -25,-0.3 -6,-0.3 2,-0.1 -0.936 54.3-135.0-124.5 133.9 29.3 12.8 18.9 59 66 A R E -c 33 0A 64 -27,-2.9 -25,-2.4 -2,-0.4 2,-0.5 -0.473 31.4-136.7 -61.8 145.6 25.8 13.7 17.8 60 67 A I E -c 34 0A 0 24,-0.2 26,-2.1 -27,-0.2 27,-1.4 -0.950 19.0-172.2-119.7 120.9 23.4 10.9 18.6 61 68 A I E -cd 35 87A 0 -27,-2.4 -25,-2.5 -2,-0.5 2,-0.8 -0.945 19.4-144.4-105.2 119.0 20.6 9.7 16.3 62 69 A A E -cd 36 88A 1 25,-3.1 27,-2.2 -2,-0.6 2,-1.6 -0.740 7.2-157.6 -87.7 109.9 18.3 7.2 18.1 63 70 A D E +c 37 0A 8 -27,-2.9 -25,-0.7 -2,-0.8 25,-0.1 -0.612 40.9 139.2 -91.2 81.0 17.3 4.6 15.5 64 71 A F E - 0 0 7 -2,-1.6 -1,-0.2 25,-0.4 3,-0.2 0.403 52.6-141.4-107.7 -0.0 14.2 3.4 17.1 65 72 A K E - 0 0 22 -3,-0.2 25,-0.3 1,-0.2 -2,-0.1 0.866 24.4-143.6 37.7 54.1 12.0 3.1 14.0 66 73 A V E + d 0 90A 3 23,-1.9 25,-2.3 1,-0.1 -1,-0.2 -0.194 35.5 161.5 -53.1 126.9 9.1 4.4 15.9 67 74 A A + 0 0 5 -3,-0.2 2,-0.1 23,-0.1 -1,-0.1 -0.167 29.4 102.6-150.2 43.7 6.0 2.6 14.6 68 75 A D S S- 0 0 13 1,-0.2 270,-0.0 30,-0.1 23,-0.0 -0.428 76.2 -65.5-118.0-173.3 3.1 2.8 17.1 69 76 A I > - 0 0 13 -2,-0.1 4,-3.0 1,-0.1 3,-0.3 -0.372 59.1 -99.2 -68.9 161.3 -0.2 4.7 17.6 70 77 A P H > S+ 0 0 19 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.888 120.8 52.3 -55.2 -41.2 0.1 8.5 18.1 71 78 A E H > S+ 0 0 76 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.905 114.6 41.1 -64.5 -41.6 -0.2 8.3 21.9 72 79 A T H > S+ 0 0 14 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.901 111.2 57.0 -72.8 -39.5 2.5 5.7 22.3 73 80 A N H X S+ 0 0 1 -4,-3.0 4,-2.5 1,-0.2 5,-0.2 0.902 104.2 55.0 -54.5 -42.0 4.7 7.4 19.7 74 81 A E H X S+ 0 0 73 -4,-2.3 4,-2.4 -5,-0.3 -1,-0.2 0.928 108.8 45.5 -57.9 -48.3 4.6 10.6 21.8 75 82 A K H X S+ 0 0 46 -4,-1.3 4,-2.7 2,-0.2 5,-0.2 0.892 111.2 53.2 -64.0 -42.0 5.8 8.8 24.9 76 83 A I H X S+ 0 0 4 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.943 111.4 45.7 -60.3 -47.6 8.6 7.0 23.1 77 84 A C H X S+ 0 0 0 -4,-2.5 4,-2.9 -5,-0.2 5,-0.3 0.931 112.1 51.2 -61.7 -45.3 9.9 10.3 21.6 78 85 A R H X S+ 0 0 85 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.913 112.6 46.1 -57.0 -45.9 9.7 12.1 25.0 79 86 A A H X S+ 0 0 8 -4,-2.7 4,-1.3 2,-0.2 -1,-0.2 0.898 114.0 49.5 -62.7 -39.2 11.6 9.3 26.7 80 87 A T H <>S+ 0 0 0 -4,-2.3 5,-1.6 -5,-0.2 4,-0.4 0.930 113.9 42.4 -71.3 -46.6 14.2 9.3 23.9 81 88 A F H ><5S+ 0 0 2 -4,-2.9 3,-1.4 1,-0.2 -1,-0.2 0.881 108.7 60.3 -67.4 -35.7 14.8 13.0 23.9 82 89 A K H 3<5S+ 0 0 182 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.851 101.9 55.2 -57.6 -34.1 14.9 13.1 27.7 83 90 A A T 3<5S- 0 0 34 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.580 128.3 -96.3 -79.3 -11.6 17.8 10.7 27.6 84 91 A G T < 5 + 0 0 28 -3,-1.4 -24,-0.2 -4,-0.4 -3,-0.2 0.539 67.1 153.4 112.0 10.0 19.8 13.1 25.3 85 92 A A < - 0 0 0 -5,-1.6 -1,-0.3 1,-0.1 -24,-0.2 -0.473 34.6-152.7 -67.5 136.9 19.2 11.9 21.7 86 93 A D S S+ 0 0 52 -26,-2.1 26,-1.8 1,-0.2 2,-0.3 0.829 76.3 3.9 -76.4 -34.7 19.6 14.6 19.1 87 94 A A E -de 61 112A 0 -27,-1.4 -25,-3.1 24,-0.2 2,-0.3 -0.949 63.1-145.4-148.5 161.1 17.2 13.0 16.7 88 95 A I E -de 62 113A 0 24,-2.0 26,-3.0 -2,-0.3 2,-0.5 -0.980 16.1-130.5-133.0 143.5 15.0 10.0 16.4 89 96 A I E - e 0 114A 2 -27,-2.2 -23,-1.9 -2,-0.3 -25,-0.4 -0.868 27.8-171.6 -96.5 131.5 14.1 7.8 13.4 90 97 A V E -de 66 115A 0 24,-2.7 26,-2.7 -2,-0.5 2,-0.2 -0.955 21.6-123.5-128.0 136.3 10.4 7.2 12.7 91 98 A H E - e 0 116A 6 -25,-2.3 26,-0.1 -2,-0.4 -23,-0.1 -0.531 11.7-159.4 -76.3 142.9 8.5 4.8 10.3 92 99 A G S > S+ 0 0 0 24,-1.4 3,-2.0 -2,-0.2 7,-0.2 0.659 74.5 84.3 -93.1 -16.5 6.1 6.5 8.0 93 100 A F T 3 S+ 0 0 1 23,-0.3 254,-0.4 1,-0.3 253,-0.4 0.761 77.9 65.8 -65.1 -28.0 4.0 3.4 7.2 94 101 A P T 3 S- 0 0 0 0, 0.0 -1,-0.3 0, 0.0 4,-0.2 0.574 113.2-112.2 -70.4 -4.4 1.7 3.7 10.3 95 102 A G <> - 0 0 0 -3,-2.0 4,-1.6 1,-0.2 5,-0.1 -0.311 33.0 -55.4 106.1 177.2 0.4 6.9 8.7 96 103 A A H > S+ 0 0 18 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.843 122.9 53.9 -70.3 -40.6 0.3 10.6 9.1 97 104 A D H > S+ 0 0 23 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.906 109.2 51.2 -60.5 -39.2 -1.1 11.0 12.6 98 105 A S H > S+ 0 0 0 -4,-0.2 4,-1.0 2,-0.2 -2,-0.2 0.893 113.1 45.0 -66.4 -38.5 1.6 8.7 13.9 99 106 A V H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 3,-0.4 0.914 110.5 53.4 -68.3 -44.1 4.3 10.8 12.2 100 107 A R H X S+ 0 0 114 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.846 101.3 60.8 -62.1 -33.8 2.8 14.1 13.4 101 108 A A H X S+ 0 0 4 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.905 109.4 42.7 -56.9 -42.7 2.8 12.8 17.0 102 109 A C H X S+ 0 0 0 -4,-1.0 4,-2.7 -3,-0.4 -2,-0.2 0.904 112.3 52.4 -72.0 -43.5 6.6 12.5 16.7 103 110 A L H X S+ 0 0 36 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.883 107.8 53.2 -58.0 -40.5 7.0 15.8 14.9 104 111 A N H X S+ 0 0 89 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.904 111.0 44.8 -66.1 -40.7 5.0 17.6 17.6 105 112 A V H X S+ 0 0 2 -4,-1.5 4,-2.9 2,-0.2 -2,-0.2 0.928 112.4 51.3 -68.4 -43.5 7.2 16.3 20.4 106 113 A A H X>S+ 0 0 5 -4,-2.7 5,-2.2 1,-0.2 4,-1.0 0.912 111.3 49.1 -61.4 -38.7 10.4 17.0 18.5 107 114 A E H ><5S+ 0 0 156 -4,-2.4 3,-0.6 -5,-0.2 -1,-0.2 0.945 113.9 45.2 -63.3 -47.4 9.2 20.6 18.0 108 115 A E H 3<5S+ 0 0 128 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.886 119.4 41.6 -62.4 -39.0 8.3 21.0 21.7 109 116 A M H 3<5S- 0 0 61 -4,-2.9 -1,-0.2 -5,-0.1 -2,-0.2 0.456 109.7-117.0 -95.0 -1.3 11.6 19.5 22.8 110 117 A G T <<5S+ 0 0 62 -4,-1.0 -3,-0.2 -3,-0.6 2,-0.2 0.796 74.3 113.5 73.1 31.6 13.9 21.2 20.3 111 118 A R < - 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