==== 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 29-JUL-12 4GC4 . 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) . 16803.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 328 75.1 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 . 19 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 11.7 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 . 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 0 4 3 1 2 4 0 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 7 A D 0 0 200 0, 0.0 2,-0.2 0, 0.0 145,-0.1 0.000 360.0 360.0 360.0 137.9 42.9 23.7 5.8 2 8 A V - 0 0 37 1,-0.1 145,-0.0 166,-0.1 167,-0.0 -0.631 360.0 -85.3-110.1 165.4 43.5 22.9 2.2 3 9 A M - 0 0 23 -2,-0.2 2,-0.5 1,-0.1 -1,-0.1 -0.170 34.3-130.3 -63.1 154.9 46.4 21.3 0.2 4 10 A D - 0 0 132 4,-0.0 2,-0.5 2,-0.0 -1,-0.1 -0.950 15.5-155.8-108.4 132.2 49.3 23.3 -1.1 5 11 A V > - 0 0 7 -2,-0.5 3,-2.1 186,-0.1 5,-0.1 -0.928 25.4-115.0-108.8 120.7 50.3 22.9 -4.7 6 12 A M G > S- 0 0 68 -2,-0.5 3,-1.5 1,-0.3 27,-0.4 -0.282 95.0 -5.7 -58.9 131.3 53.9 23.7 -5.6 7 13 A N G 3 S- 0 0 71 1,-0.3 -1,-0.3 25,-0.1 3,-0.1 0.609 108.9 -91.4 59.5 14.4 54.2 26.7 -7.9 8 14 A R G < S+ 0 0 69 -3,-2.1 185,-2.6 1,-0.2 2,-0.5 0.758 96.6 122.8 55.5 27.7 50.4 26.9 -8.2 9 15 A L E < -a 193 0A 0 -3,-1.5 2,-0.5 183,-0.2 25,-0.4 -0.972 42.9-170.7-130.2 120.9 50.8 24.7 -11.3 10 16 A I E -a 194 0A 0 183,-3.1 185,-2.6 -2,-0.5 2,-0.5 -0.941 19.9-135.9-111.6 125.6 49.2 21.2 -11.8 11 17 A L E -ab 195 35A 0 23,-1.5 25,-3.3 -2,-0.5 2,-1.0 -0.684 7.1-148.6 -78.6 124.3 50.2 19.1 -14.8 12 18 A A E - b 0 36A 4 183,-2.5 2,-1.4 -2,-0.5 188,-0.2 -0.813 14.8-161.2 -87.9 101.1 47.4 17.5 -16.7 13 19 A M E + b 0 37A 0 23,-2.4 25,-0.6 -2,-1.0 28,-0.3 -0.645 30.7 150.4 -91.2 88.1 49.0 14.3 -17.8 14 20 A D + 0 0 15 -2,-1.4 -1,-0.2 23,-0.1 2,-0.1 0.165 24.3 125.2-108.6 14.9 46.8 13.1 -20.7 15 21 A L - 0 0 26 1,-0.1 186,-0.0 2,-0.1 -2,-0.0 -0.430 55.9-141.7 -62.9 153.3 49.4 11.3 -22.8 16 22 A M S S+ 0 0 56 -2,-0.1 2,-0.4 28,-0.1 -1,-0.1 0.232 71.1 68.3-117.4 13.0 48.2 7.7 -23.4 17 23 A N S > S- 0 0 57 1,-0.1 4,-2.5 28,-0.0 5,-0.2 -0.996 74.6-130.8-131.3 146.5 51.3 5.6 -23.1 18 24 A R H > S+ 0 0 77 -2,-0.4 4,-2.9 1,-0.2 5,-0.3 0.882 102.6 52.5 -59.9 -45.5 53.3 4.9 -20.0 19 25 A D H > S+ 0 0 105 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.935 114.4 41.3 -60.2 -48.6 56.8 5.7 -21.5 20 26 A D H > S+ 0 0 51 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.915 115.7 50.7 -65.5 -43.1 55.8 9.1 -22.8 21 27 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.936 114.9 42.4 -61.6 -47.3 53.8 10.0 -19.7 22 28 A L H X S+ 0 0 18 -4,-2.9 4,-2.3 -5,-0.2 -2,-0.2 0.908 116.3 48.9 -65.0 -41.9 56.6 9.1 -17.4 23 29 A R H X S+ 0 0 129 -4,-2.5 4,-1.9 -5,-0.3 -2,-0.2 0.931 113.4 44.5 -65.5 -47.3 59.3 10.7 -19.5 24 30 A V H X S+ 0 0 7 -4,-2.8 4,-1.2 2,-0.2 -1,-0.2 0.915 114.2 49.8 -66.3 -42.1 57.4 14.0 -20.0 25 31 A T H < S+ 0 0 5 -4,-2.1 3,-0.5 -5,-0.3 4,-0.4 0.904 109.3 53.4 -61.8 -39.3 56.5 14.2 -16.3 26 32 A G H >< S+ 0 0 27 -4,-2.3 3,-0.9 1,-0.2 4,-0.3 0.870 103.4 57.0 -60.8 -38.8 60.2 13.5 -15.5 27 33 A E H 3< S+ 0 0 70 -4,-1.9 -1,-0.2 1,-0.2 3,-0.2 0.819 117.7 32.5 -62.8 -30.0 61.2 16.4 -17.7 28 34 A V T >X S+ 0 0 2 -4,-1.2 3,-1.8 -3,-0.5 4,-0.5 0.257 83.0 112.7-112.0 12.3 59.0 18.8 -15.6 29 35 A R G X4 S+ 0 0 132 -3,-0.9 3,-0.5 -4,-0.4 -1,-0.1 0.748 71.8 60.8 -60.4 -26.4 59.3 17.2 -12.2 30 36 A E G 34 S+ 0 0 135 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.688 105.1 48.9 -73.1 -17.7 61.3 20.1 -10.7 31 37 A Y G <4 S+ 0 0 47 -3,-1.8 2,-0.3 1,-0.1 -1,-0.2 0.548 112.5 39.0 -98.8 -10.5 58.4 22.5 -11.4 32 38 A I << - 0 0 14 -4,-0.5 -25,-0.1 -3,-0.5 -22,-0.1 -0.969 38.2-176.0-145.2 148.5 55.5 20.6 -9.9 33 39 A D S S+ 0 0 52 -24,-0.4 27,-3.0 -27,-0.4 2,-0.4 0.276 77.3 65.1-123.0 8.6 54.4 18.4 -7.0 34 40 A T E - c 0 60A 0 -25,-0.4 -23,-1.5 25,-0.2 2,-0.4 -0.993 58.5-174.6-138.7 124.0 50.9 17.7 -8.1 35 41 A V E -bc 11 61A 5 25,-2.7 27,-2.4 -2,-0.4 2,-0.6 -0.967 17.0-144.4-123.1 133.9 49.8 15.8 -11.3 36 42 A K E -bc 12 62A 12 -25,-3.3 -23,-2.4 -2,-0.4 2,-0.5 -0.889 19.6-170.8 -96.3 120.4 46.2 15.3 -12.6 37 43 A I E +bc 13 63A 0 25,-2.5 27,-2.8 -2,-0.6 2,-0.2 -0.961 8.7 179.0-114.1 130.3 45.8 11.9 -14.1 38 44 A G E > - c 0 64A 1 -25,-0.6 4,-2.2 -2,-0.5 3,-0.4 -0.443 45.8 -76.4-117.6-169.2 42.6 11.1 -16.0 39 45 A Y H > S+ 0 0 10 25,-0.7 4,-2.9 1,-0.2 5,-0.4 0.807 115.7 69.5 -64.0 -31.2 41.0 8.3 -18.0 40 46 A P H > S+ 0 0 1 0, 0.0 4,-0.6 0, 0.0 -1,-0.2 0.936 113.8 29.6 -53.8 -44.9 43.1 8.7 -21.2 41 47 A L H > S+ 0 0 0 -3,-0.4 4,-2.1 -28,-0.3 5,-0.4 0.915 122.2 49.9 -78.8 -46.1 46.2 7.5 -19.3 42 48 A V H X S+ 0 0 3 -4,-2.2 4,-2.5 1,-0.2 -3,-0.2 0.894 111.5 47.4 -62.2 -42.9 44.4 5.1 -16.8 43 49 A L H < S+ 0 0 10 -4,-2.9 -1,-0.2 1,-0.2 225,-0.2 0.779 116.7 46.1 -72.0 -21.7 42.3 3.3 -19.4 44 50 A S H < S+ 0 0 46 -4,-0.6 -2,-0.2 -5,-0.4 -1,-0.2 0.808 130.9 16.1 -86.1 -32.0 45.4 2.9 -21.6 45 51 A E H < S- 0 0 81 -4,-2.1 -3,-0.2 1,-0.1 -2,-0.2 0.551 107.3-106.6-122.9 -13.7 47.9 1.7 -19.0 46 52 A G >< - 0 0 23 -4,-2.5 3,-1.9 -5,-0.4 4,-0.2 -0.035 35.8 -76.9 100.5 156.2 45.9 0.6 -15.9 47 53 A M T >> S+ 0 0 17 1,-0.3 3,-1.7 2,-0.2 4,-0.6 0.691 117.2 78.9 -62.3 -20.1 45.2 2.0 -12.4 48 54 A D H 3> S+ 0 0 138 1,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.703 75.7 77.1 -61.3 -19.1 48.7 0.9 -11.4 49 55 A I H <> S+ 0 0 6 -3,-1.9 4,-2.2 1,-0.2 -1,-0.3 0.806 85.9 61.3 -62.2 -27.2 50.0 4.0 -13.2 50 56 A I H <> S+ 0 0 0 -3,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.968 106.0 42.7 -65.1 -52.6 48.9 6.1 -10.2 51 57 A A H X S+ 0 0 53 -4,-0.6 4,-2.2 33,-0.3 5,-0.2 0.851 111.0 58.6 -60.5 -34.2 51.2 4.3 -7.7 52 58 A E H X S+ 0 0 41 -4,-1.8 4,-2.5 1,-0.2 5,-0.2 0.931 107.1 45.9 -61.5 -46.7 53.9 4.4 -10.3 53 59 A F H X>S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 6,-0.6 0.935 111.8 51.5 -60.3 -45.7 53.7 8.2 -10.5 54 60 A R H X5S+ 0 0 103 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.899 115.0 42.2 -62.6 -37.7 53.6 8.6 -6.7 55 61 A K H <5S+ 0 0 154 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.892 118.6 42.9 -76.6 -40.4 56.7 6.5 -6.2 56 62 A R H <5S+ 0 0 104 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.850 131.8 19.6 -75.5 -33.1 58.8 7.9 -9.1 57 63 A F H <5S- 0 0 33 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.549 88.8-130.2-116.8 -12.0 58.0 11.5 -8.5 58 64 A G << + 0 0 67 -4,-1.4 2,-0.2 -5,-0.5 -4,-0.2 0.782 59.4 148.7 63.0 28.4 56.8 11.8 -4.9 59 65 A C - 0 0 8 -6,-0.6 2,-0.3 1,-0.1 -25,-0.2 -0.528 55.1-110.4 -97.4 158.2 53.8 13.8 -6.2 60 66 A R E -c 34 0A 57 -27,-3.0 -25,-2.7 -2,-0.2 2,-0.5 -0.648 35.1-146.4 -73.9 139.8 50.2 14.2 -5.2 61 67 A I E -c 35 0A 0 -2,-0.3 26,-1.9 24,-0.2 27,-1.3 -0.967 11.3-164.6-116.4 123.9 47.9 12.6 -7.7 62 68 A I E -cd 36 88A 0 -27,-2.4 -25,-2.5 -2,-0.5 2,-0.8 -0.944 17.2-143.4-100.6 119.6 44.4 14.0 -8.5 63 69 A A E -cd 37 89A 0 25,-3.0 27,-2.4 -2,-0.6 2,-1.7 -0.758 8.2-158.3 -85.8 107.9 42.3 11.4 -10.3 64 70 A D E +c 38 0A 9 -27,-2.8 -25,-0.7 -2,-0.8 25,-0.1 -0.593 40.5 140.1 -88.9 78.3 40.3 13.3 -12.8 65 71 A F E - 0 0 7 -2,-1.7 3,-0.2 25,-0.4 -1,-0.2 0.382 53.4-140.3-105.1 2.7 37.6 10.7 -13.3 66 72 A K E - 0 0 21 -3,-0.2 25,-0.3 1,-0.2 -2,-0.1 0.860 25.1-145.2 36.8 55.0 34.7 13.2 -13.4 67 73 A V E + d 0 91A 2 23,-1.9 25,-2.3 1,-0.1 -1,-0.2 -0.210 35.5 160.0 -58.9 128.1 32.6 10.8 -11.4 68 74 A A + 0 0 5 -3,-0.2 2,-0.2 23,-0.1 -1,-0.1 -0.194 28.8 104.1-150.6 46.5 29.0 11.0 -12.5 69 75 A D S S- 0 0 12 1,-0.2 272,-0.0 30,-0.1 217,-0.0 -0.470 75.6 -65.6-118.3-171.8 27.0 8.0 -11.5 70 76 A I > - 0 0 24 -2,-0.2 4,-2.8 1,-0.1 5,-0.2 -0.321 58.2 -99.3 -71.2 161.9 24.4 7.0 -8.9 71 77 A P H > S+ 0 0 32 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.894 120.5 51.9 -54.3 -44.7 25.5 7.0 -5.3 72 78 A E H > S+ 0 0 127 1,-0.2 4,-1.4 2,-0.2 27,-0.0 0.910 115.0 42.0 -59.1 -45.0 26.1 3.2 -5.0 73 79 A T H > S+ 0 0 12 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.895 110.1 57.2 -71.3 -39.8 28.4 3.2 -8.1 74 80 A N H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.893 104.6 52.9 -56.4 -41.2 30.1 6.4 -7.1 75 81 A E H X S+ 0 0 53 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.916 109.7 48.5 -62.6 -40.6 31.2 4.8 -3.8 76 82 A K H X S+ 0 0 29 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.906 111.6 48.9 -64.2 -43.4 32.7 1.9 -5.7 77 83 A I H X S+ 0 0 6 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.939 113.2 47.3 -62.7 -46.4 34.6 4.1 -8.1 78 84 A C H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.3 0.913 111.5 50.5 -62.3 -42.7 36.0 6.2 -5.3 79 85 A R H X S+ 0 0 65 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.936 112.3 46.6 -62.1 -45.7 37.0 3.2 -3.3 80 86 A A H X S+ 0 0 9 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.901 114.6 48.6 -61.7 -39.5 38.8 1.6 -6.2 81 87 A T H <>S+ 0 0 0 -4,-2.3 5,-1.8 -5,-0.2 -2,-0.2 0.910 113.4 43.8 -71.1 -43.0 40.5 4.9 -7.0 82 88 A F H ><5S+ 0 0 1 -4,-2.8 3,-1.6 1,-0.2 -1,-0.2 0.858 109.0 58.4 -72.3 -33.4 41.7 5.7 -3.5 83 89 A K H 3<5S+ 0 0 152 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.832 101.3 57.5 -61.4 -30.2 42.8 2.0 -3.1 84 90 A A T 3<5S- 0 0 23 -4,-1.2 -33,-0.3 -5,-0.2 -1,-0.3 0.474 129.0 -99.0 -79.9 -3.4 45.1 2.7 -6.1 85 91 A G T < 5 + 0 0 14 -3,-1.6 -24,-0.2 1,-0.3 -3,-0.2 0.429 65.9 156.5 106.1 0.6 46.7 5.5 -4.2 86 92 A A < - 0 0 0 -5,-1.8 -1,-0.3 1,-0.1 -24,-0.1 -0.344 32.6-154.5 -62.1 138.7 45.0 8.6 -5.5 87 93 A D S S+ 0 0 37 -26,-1.9 26,-1.9 1,-0.2 2,-0.3 0.754 76.2 4.8 -81.9 -26.4 45.1 11.6 -3.1 88 94 A A E -de 62 113A 0 -27,-1.3 -25,-3.0 24,-0.2 2,-0.3 -0.973 62.7-147.5-154.4 159.1 42.0 13.2 -4.5 89 95 A I E -de 63 114A 0 24,-1.8 26,-2.8 -2,-0.3 2,-0.5 -0.986 16.6-130.9-134.1 144.1 39.2 12.5 -7.0 90 96 A I E - e 0 115A 2 -27,-2.4 -23,-1.9 -2,-0.3 -25,-0.4 -0.849 27.8-171.6 -97.9 130.0 37.3 15.0 -9.2 91 97 A V E -de 67 116A 0 24,-2.9 26,-2.9 -2,-0.5 2,-0.2 -0.952 22.2-122.1-125.3 135.0 33.5 14.5 -9.1 92 98 A H E - e 0 117A 6 -25,-2.3 26,-0.1 -2,-0.4 -23,-0.1 -0.555 12.4-158.2 -71.4 142.4 30.7 16.1 -11.2 93 99 A G S > S+ 0 0 0 24,-1.5 3,-2.3 -2,-0.2 7,-0.1 0.664 75.2 85.2 -90.7 -19.7 28.1 18.0 -9.3 94 100 A F T 3 S+ 0 0 2 23,-0.3 256,-0.5 1,-0.3 255,-0.4 0.800 79.9 63.1 -59.6 -30.4 25.3 17.8 -11.9 95 101 A P T 3 S- 0 0 1 0, 0.0 4,-0.3 0, 0.0 -1,-0.3 0.571 112.2-117.4 -71.8 -2.3 24.1 14.3 -10.8 96 102 A G <> - 0 0 0 -3,-2.3 4,-1.6 1,-0.2 5,-0.1 -0.251 31.4 -51.4 102.6 178.8 23.1 15.9 -7.5 97 103 A A H > S+ 0 0 19 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.817 122.5 54.1 -71.1 -39.0 23.8 15.9 -3.7 98 104 A D H > S+ 0 0 30 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.916 109.6 50.3 -61.5 -40.9 23.4 12.2 -2.9 99 105 A S H > S+ 0 0 1 -4,-0.3 4,-1.0 2,-0.2 -2,-0.2 0.871 112.6 46.5 -65.9 -36.9 26.0 11.3 -5.6 100 106 A V H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 3,-0.4 0.927 110.2 52.7 -69.0 -45.4 28.4 13.9 -4.2 101 107 A R H X S+ 0 0 112 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.857 101.3 60.7 -59.3 -35.9 27.9 12.7 -0.6 102 108 A A H X S+ 0 0 2 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.908 108.9 43.9 -57.7 -41.0 28.6 9.1 -1.7 103 109 A C H X S+ 0 0 0 -4,-1.0 4,-2.5 -3,-0.4 -2,-0.2 0.904 111.2 52.8 -70.5 -43.2 32.1 10.3 -2.7 104 110 A L H X S+ 0 0 42 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.885 105.3 57.1 -59.0 -38.7 32.6 12.4 0.4 105 111 A N H X S+ 0 0 83 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.937 110.9 41.0 -57.2 -48.3 31.8 9.3 2.5 106 112 A V H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.909 113.8 52.7 -70.4 -39.6 34.5 7.3 1.0 107 113 A A H X>S+ 0 0 5 -4,-2.5 5,-2.7 1,-0.2 4,-1.0 0.893 110.6 48.3 -63.6 -40.2 37.0 10.2 1.0 108 114 A E H ><5S+ 0 0 172 -4,-2.6 3,-0.5 -5,-0.2 -1,-0.2 0.933 111.9 49.3 -63.7 -45.5 36.4 10.7 4.7 109 115 A E H 3<5S+ 0 0 128 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.906 119.6 36.9 -59.4 -42.2 36.8 7.0 5.5 110 116 A M H 3<5S- 0 0 49 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.454 110.7-113.6 -97.4 0.8 40.1 6.8 3.6 111 117 A G T <<5S+ 0 0 66 -4,-1.0 -3,-0.2 -3,-0.5 2,-0.2 0.868 73.3 123.9 70.2 39.7 41.6 10.2 4.4 112 118 A R < - 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