==== 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 TETRAHYDROBIOPTERIN BIOSYNTHESIS 20-JAN-99 1B66 . COMPND 2 MOLECULE: 6-PYRUVOYL TETRAHYDROPTERIN SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS RATTUS; . AUTHOR T.PLOOM,B.THOENY,J.YIM,S.LEE,H.NAR,W.LEIMBACHER,R.HUBER,J.RI . 276 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16633.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 58 21.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 1 0.4 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 . 16 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 67 24.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.2 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 0 2 0 0 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 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 PARALLEL BRIDGES PER LADDER . 0 0 0 1 1 2 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 L 0 0 157 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -63.7 67.0 13.9 29.6 2 8 A R - 0 0 133 1,-0.0 55,-0.1 53,-0.0 2,-0.1 -0.901 360.0-116.8-121.2 143.7 65.8 15.1 26.2 3 9 A R - 0 0 209 -2,-0.4 53,-3.0 53,-0.2 2,-0.4 -0.348 28.6-140.5 -68.2 142.9 66.4 18.2 24.0 4 10 A R E +A 55 0A 147 51,-0.3 2,-0.3 -2,-0.1 51,-0.3 -0.866 25.9 168.0-108.7 143.4 63.4 20.4 23.2 5 11 A A E -A 54 0A 37 49,-2.6 49,-1.7 -2,-0.4 2,-0.5 -0.914 33.3-115.5-145.4 169.4 62.7 22.1 19.9 6 12 A R E -A 53 0A 154 -2,-0.3 2,-0.5 47,-0.2 47,-0.2 -0.955 25.7-163.2-111.7 132.6 60.0 23.9 17.9 7 13 A L E -A 52 0A 42 45,-2.8 45,-2.9 -2,-0.5 2,-0.4 -0.980 9.2-171.6-119.9 125.8 58.7 22.3 14.7 8 14 A S E -A 51 0A 59 -2,-0.5 2,-0.4 43,-0.2 43,-0.2 -0.920 11.1-172.9-122.6 146.3 56.7 24.3 12.2 9 15 A R E -A 50 0A 79 41,-1.9 41,-2.4 -2,-0.4 2,-0.3 -0.988 13.4-147.7-134.4 140.4 54.8 23.5 9.0 10 16 A L E +A 49 0A 85 -2,-0.4 2,-0.3 39,-0.2 39,-0.2 -0.818 20.1 166.9-110.6 146.3 53.3 26.0 6.6 11 17 A V E -A 48 0A 15 37,-1.8 37,-3.4 -2,-0.3 2,-0.4 -0.954 18.7-146.9-148.6 155.2 50.1 25.5 4.5 12 18 A S E -A 47 0A 66 -2,-0.3 2,-0.3 35,-0.2 35,-0.2 -0.982 11.7-174.4-130.8 146.1 48.0 28.0 2.5 13 19 A F E -A 46 0A 2 33,-1.7 33,-2.7 -2,-0.4 2,-0.5 -0.952 20.7-128.3-135.4 154.2 44.3 28.2 1.9 14 20 A S E +A 45 0A 37 -2,-0.3 69,-2.7 31,-0.2 70,-1.0 -0.914 38.0 155.2-105.2 130.3 42.1 30.5 -0.4 15 21 A A E -Ab 44 84A 10 29,-2.1 29,-2.6 -2,-0.5 2,-0.3 -0.983 31.1-141.4-154.9 154.4 39.1 32.3 1.1 16 22 A S E +Ab 43 85A 42 68,-1.9 70,-2.6 -2,-0.3 71,-0.3 -0.789 29.9 151.2-111.4 159.6 36.9 35.3 0.7 17 23 A H E -A 42 0A 2 25,-2.3 25,-1.8 -2,-0.3 2,-0.3 -0.959 32.7-134.6-170.6 176.2 35.5 37.5 3.5 18 24 A R - 0 0 63 -2,-0.3 2,-0.7 23,-0.2 80,-0.4 -0.980 22.8-128.3-145.8 130.9 34.3 41.0 4.3 19 25 A L + 0 0 19 17,-2.3 2,-0.3 -2,-0.3 14,-0.1 -0.773 53.3 138.4 -84.9 115.1 35.2 42.9 7.4 20 26 A H - 0 0 63 -2,-0.7 78,-0.1 13,-0.0 -2,-0.1 -0.903 36.0-160.1-161.6 131.9 31.9 44.0 8.9 21 27 A S > - 0 0 21 -2,-0.3 3,-1.7 4,-0.2 8,-0.1 -0.955 13.9-152.7-117.1 125.7 30.4 44.3 12.4 22 28 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.506 97.7 68.4 -73.1 0.9 26.6 44.5 12.9 23 29 A S T 3 S+ 0 0 107 2,-0.1 2,-0.3 0, 0.0 -3,-0.0 0.593 97.2 66.1 -87.0 -15.2 27.4 46.4 16.1 24 30 A L S < S- 0 0 57 -3,-1.7 0, 0.0 1,-0.1 0, 0.0 -0.790 91.9-110.7-106.9 150.8 28.7 49.2 13.9 25 31 A S > - 0 0 54 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.228 36.1-100.9 -72.4 169.0 26.6 51.4 11.6 26 32 A A H > S+ 0 0 82 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.936 126.3 43.4 -56.7 -43.5 27.0 51.1 7.8 27 33 A E H > S+ 0 0 154 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.821 110.6 52.1 -73.0 -36.1 29.1 54.2 7.9 28 34 A E H > S+ 0 0 87 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.920 108.0 53.6 -66.6 -41.1 31.3 53.3 10.9 29 35 A N H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.886 109.3 48.8 -56.7 -41.2 32.0 50.0 9.3 30 36 A L H X S+ 0 0 109 -4,-1.4 4,-1.8 -5,-0.2 -1,-0.2 0.921 113.4 46.6 -65.2 -46.0 33.2 51.9 6.2 31 37 A K H < S+ 0 0 145 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.924 120.3 38.2 -61.3 -48.2 35.4 54.2 8.3 32 38 A V H < S+ 0 0 83 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.916 129.6 27.2 -72.2 -48.1 36.9 51.4 10.3 33 39 A F H >< S- 0 0 38 -4,-2.8 3,-1.7 -5,-0.3 4,-0.2 0.564 83.5-179.0 -95.6 -10.3 37.4 48.7 7.7 34 40 A G G >< S+ 0 0 35 -4,-1.8 3,-2.7 -5,-0.3 -1,-0.2 -0.103 70.7 0.6 49.8-134.2 37.7 50.8 4.6 35 41 A K G > S+ 0 0 200 1,-0.3 3,-1.9 2,-0.2 -1,-0.3 0.770 126.1 68.7 -54.8 -30.2 38.2 48.9 1.4 36 42 A C G < S+ 0 0 16 -3,-1.7 -17,-2.3 1,-0.3 -1,-0.3 0.642 89.4 66.6 -67.3 -10.1 37.9 45.6 3.4 37 43 A N G < + 0 0 15 -3,-2.7 -1,-0.3 -4,-0.2 -2,-0.2 0.502 67.1 145.9 -88.1 -4.3 34.2 46.5 3.9 38 44 A N X - 0 0 77 -3,-1.9 3,-2.2 -4,-0.2 -3,-0.0 -0.028 54.6-129.4 -35.7 119.8 33.4 46.1 0.2 39 45 A P T 3 S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.812 103.6 45.8 -47.9 -41.3 29.8 44.8 0.3 40 46 A N T 3 S- 0 0 162 1,-0.2 -2,-0.1 -23,-0.0 2,-0.1 0.424 111.1-125.8 -86.8 4.4 30.4 41.9 -2.1 41 47 A G < - 0 0 19 -3,-2.2 2,-0.3 -4,-0.1 -1,-0.2 -0.227 16.9-130.6 86.3 179.1 33.6 40.8 -0.3 42 48 A H E -A 17 0A 58 -25,-1.8 -25,-2.3 -6,-0.1 2,-0.3 -0.878 21.0-131.3-156.7-174.9 37.2 40.2 -1.4 43 49 A G E -A 16 0A 44 -27,-0.3 2,-0.3 -2,-0.3 -27,-0.3 -0.930 10.0-155.9-150.2 174.3 39.7 37.4 -0.8 44 50 A H E -A 15 0A 35 -29,-2.6 -29,-2.1 -2,-0.3 2,-0.9 -0.975 27.4-128.5-149.7 157.3 43.2 36.1 0.1 45 51 A N E -A 14 0A 124 82,-0.3 -31,-0.2 -2,-0.3 2,-0.2 -0.930 44.3-154.2-104.0 93.5 45.6 33.3 -0.3 46 52 A Y E -A 13 0A 0 -33,-2.7 -33,-1.7 -2,-0.9 2,-0.5 -0.567 8.2-155.0 -72.2 139.5 46.2 32.9 3.5 47 53 A K E -AC 12 126A 65 79,-2.2 79,-3.1 -35,-0.2 2,-0.4 -0.978 12.4-169.3-114.8 126.5 49.6 31.4 4.6 48 54 A V E -AC 11 125A 0 -37,-3.4 -37,-1.8 -2,-0.5 2,-0.5 -0.965 10.3-167.3-120.4 128.6 49.5 29.7 8.0 49 55 A V E -AC 10 124A 25 75,-2.8 75,-2.6 -2,-0.4 2,-0.5 -0.980 9.1-166.2-114.2 119.9 52.5 28.5 10.0 50 56 A V E -AC 9 123A 0 -41,-2.4 -41,-1.9 -2,-0.5 2,-0.5 -0.936 4.0-164.5-106.8 127.0 51.7 26.2 12.9 51 57 A T E -AC 8 122A 10 71,-2.8 70,-3.0 -2,-0.5 71,-1.8 -0.946 8.2-178.5-115.6 129.2 54.4 25.6 15.5 52 58 A I E -AC 7 120A 2 -45,-2.9 -45,-2.8 -2,-0.5 2,-0.3 -0.810 10.5-157.9-116.4 158.8 54.4 22.8 18.0 53 59 A H E +A 6 0A 58 66,-2.0 2,-0.3 -2,-0.3 -47,-0.2 -0.964 29.1 114.8-135.5 156.1 57.1 22.3 20.6 54 60 A G E -A 5 0A 14 -49,-1.7 -49,-2.6 -2,-0.3 2,-0.2 -0.967 63.1 -44.1 168.9-173.8 58.3 19.3 22.7 55 61 A E E -A 4 0A 93 -2,-0.3 2,-0.6 -51,-0.3 -51,-0.3 -0.489 55.7-113.2 -80.6 148.9 61.2 17.0 23.2 56 62 A I - 0 0 57 -53,-3.0 7,-0.2 -2,-0.2 -53,-0.2 -0.742 37.7-113.7 -81.6 122.2 63.0 15.5 20.3 57 63 A D > - 0 0 60 5,-1.8 4,-1.4 -2,-0.6 -1,-0.1 -0.320 15.8-141.4 -56.2 131.6 62.4 11.8 20.2 58 64 A P T 4 S+ 0 0 82 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.756 97.9 34.7 -69.2 -23.1 65.6 9.9 20.9 59 65 A V T 4 S+ 0 0 131 3,-0.1 -2,-0.0 1,-0.0 -3,-0.0 0.910 129.8 26.8 -93.0 -59.7 64.7 7.1 18.4 60 66 A T T 4 S- 0 0 87 2,-0.1 3,-0.1 1,-0.0 -3,-0.0 0.681 91.7-133.4 -78.3 -20.8 62.8 8.9 15.5 61 67 A G < + 0 0 50 -4,-1.4 2,-0.4 1,-0.2 3,-0.1 0.637 63.3 128.9 75.5 14.1 64.4 12.4 16.0 62 68 A M - 0 0 70 1,-0.2 -5,-1.8 -6,-0.1 -1,-0.2 -0.851 54.4-161.7-108.6 137.8 61.0 14.0 15.7 63 69 A V S S- 0 0 34 1,-0.5 2,-0.3 -2,-0.4 -8,-0.2 0.885 97.1 -12.7 -74.5 -41.0 59.3 16.5 18.0 64 70 A M S S- 0 0 27 -3,-0.1 -1,-0.5 -10,-0.1 2,-0.4 -0.944 88.2 -98.5-155.2 138.7 56.1 15.3 16.3 65 71 A N >> - 0 0 59 -2,-0.3 4,-1.7 -3,-0.2 3,-1.1 -0.520 28.2-138.3 -63.9 119.4 55.9 13.3 13.1 66 72 A L H 3> S+ 0 0 65 -2,-0.4 4,-2.7 1,-0.3 5,-0.2 0.799 103.1 64.2 -50.1 -28.6 55.3 15.8 10.3 67 73 A T H 3> S+ 0 0 74 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.947 104.8 45.2 -61.4 -43.2 52.8 13.3 8.8 68 74 A D H <> S+ 0 0 68 -3,-1.1 4,-2.6 1,-0.2 -2,-0.2 0.888 111.5 51.5 -66.8 -41.2 50.6 13.8 12.0 69 75 A L H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 5,-0.2 0.914 108.4 52.0 -61.9 -42.7 51.0 17.6 11.9 70 76 A K H X S+ 0 0 96 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.920 111.0 48.2 -56.6 -48.8 49.9 17.6 8.2 71 77 A E H X S+ 0 0 116 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.905 111.5 48.7 -59.8 -46.9 46.8 15.5 9.2 72 78 A Y H X S+ 0 0 59 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.891 114.5 46.1 -61.0 -42.8 46.0 17.9 12.1 73 79 A M H X>S+ 0 0 1 -4,-2.6 4,-2.5 2,-0.2 5,-1.6 0.845 108.8 55.1 -69.5 -33.3 46.3 20.9 9.9 74 80 A E H <>S+ 0 0 105 -4,-2.4 5,-2.8 -5,-0.2 -2,-0.2 0.969 116.0 39.4 -61.3 -48.4 44.3 19.3 7.2 75 81 A E H <5S+ 0 0 96 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.874 123.2 38.8 -68.1 -41.9 41.5 18.8 9.7 76 82 A A H <5S+ 0 0 1 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.720 134.5 9.8 -84.9 -24.0 41.9 22.1 11.6 77 83 A I T X>S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.2 5,-0.5 0.736 123.9 45.4-120.3 -58.7 42.6 24.5 8.7 78 84 A M H ><5S+ 0 0 0 -4,-2.3 3,-1.0 3,-0.1 -3,-0.2 0.796 85.8 101.2-105.8 -33.0 38.7 27.1 5.6 82 88 A D T 3<> -b 16 0A 42 -2,-0.3 4,-3.3 -70,-0.2 3,-0.5 -0.960 29.4-149.8-104.7 108.1 33.8 32.3 2.2 86 92 A L H 3> S+ 0 0 0 -70,-2.6 4,-1.5 -2,-0.7 7,-0.4 0.905 89.0 45.4 -49.5 -49.1 34.7 32.8 5.9 87 93 A D H 34 S+ 0 0 36 -71,-0.3 -1,-0.2 1,-0.2 -70,-0.1 0.788 125.3 29.5 -71.8 -27.0 31.7 34.8 6.9 88 94 A L H <4 S+ 0 0 143 -3,-0.5 -1,-0.2 1,-0.1 -2,-0.2 0.677 126.1 40.2-105.6 -22.7 29.1 32.7 5.3 89 95 A D H < S+ 0 0 90 -4,-3.3 -3,-0.2 1,-0.2 -2,-0.2 0.478 103.9 67.6-104.8 -5.2 30.7 29.2 5.3 90 96 A V >< - 0 0 5 -4,-1.5 3,-2.3 -5,-0.4 4,-0.3 -0.902 64.4-157.0-120.8 106.4 32.3 29.2 8.8 91 97 A P G >> S+ 0 0 115 0, 0.0 3,-2.3 0, 0.0 4,-0.5 0.843 92.6 64.2 -44.1 -43.4 29.7 29.2 11.7 92 98 A Y G 34 S+ 0 0 61 1,-0.3 3,-0.5 2,-0.2 4,-0.1 0.802 102.7 49.6 -53.8 -32.4 32.4 30.6 14.1 93 99 A F G <4 S+ 0 0 6 -3,-2.3 -1,-0.3 -7,-0.4 5,-0.2 0.321 81.6 90.5 -93.1 8.3 32.4 33.8 11.9 94 100 A A T <4 S+ 0 0 82 -3,-2.3 -1,-0.2 -4,-0.3 -2,-0.2 0.914 110.0 18.2 -67.5 -35.7 28.7 34.3 11.8 95 101 A D S < S+ 0 0 137 -4,-0.5 2,-0.4 -3,-0.5 -1,-0.2 0.274 118.2 72.5-117.9 7.1 29.2 36.5 15.0 96 102 A V S S- 0 0 39 -4,-0.1 2,-0.3 -9,-0.1 -75,-0.0 -0.974 83.1-115.5-125.1 136.2 32.9 37.3 14.9 97 103 A V - 0 0 33 -2,-0.4 2,-1.5 1,-0.1 5,-0.2 -0.589 28.9-126.7 -69.2 132.5 34.6 39.8 12.5 98 104 A S + 0 0 0 -80,-0.4 -1,-0.1 -2,-0.3 -12,-0.1 -0.203 51.8 150.8 -80.4 49.0 37.0 37.8 10.2 99 105 A T > - 0 0 28 -2,-1.5 4,-1.7 1,-0.1 5,-0.2 -0.252 64.8-103.4 -69.1 167.5 40.1 39.9 10.8 100 106 A T H > S+ 0 0 9 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.884 123.9 58.9 -59.3 -39.0 43.5 38.1 10.6 101 107 A E H > S+ 0 0 112 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.946 108.0 43.2 -55.4 -51.1 43.5 38.2 14.4 102 108 A N H > S+ 0 0 45 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.760 110.2 54.9 -72.0 -23.1 40.3 36.2 14.6 103 109 A V H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.891 109.8 48.3 -73.5 -41.5 41.4 33.7 11.9 104 110 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.921 113.3 47.5 -61.4 -46.9 44.5 33.0 13.9 105 111 A V H X S+ 0 0 26 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.932 111.0 51.3 -58.9 -48.7 42.4 32.5 17.1 106 112 A Y H X S+ 0 0 18 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.894 112.6 45.3 -55.3 -45.2 40.0 30.3 15.2 107 113 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.908 111.3 52.7 -67.5 -42.5 42.8 28.1 14.0 108 114 A W H X S+ 0 0 27 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.977 112.3 46.0 -55.0 -54.2 44.5 28.0 17.4 109 115 A E H X S+ 0 0 72 -4,-2.9 4,-1.4 1,-0.2 -2,-0.2 0.914 112.1 50.4 -55.7 -49.3 41.2 26.8 18.9 110 116 A N H X S+ 0 0 20 -4,-2.4 4,-0.6 1,-0.2 3,-0.2 0.891 111.1 48.5 -55.6 -46.7 40.6 24.2 16.2 111 117 A L H >X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 3,-0.9 0.861 105.1 60.1 -62.9 -38.7 44.1 22.8 16.7 112 118 A Q H 3< S+ 0 0 81 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.852 97.3 58.6 -60.7 -34.4 43.6 22.6 20.5 113 119 A R H 3< S+ 0 0 173 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.798 121.0 28.2 -64.1 -25.1 40.6 20.3 20.1 114 120 A L H << S+ 0 0 59 -3,-0.9 -2,-0.2 -4,-0.6 -1,-0.2 0.777 99.7 84.9-106.2 -38.8 42.9 17.9 18.3 115 121 A L S < S- 0 0 11 -4,-3.1 3,-0.1 1,-0.1 -46,-0.0 -0.351 85.4 -95.6 -73.4 150.6 46.6 18.2 19.4 116 122 A P > - 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