==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 03-AUG-09 2WP4 . COMPND 2 MOLECULE: MOLYBDOPTERIN-CONVERTING FACTOR SUBUNIT 2 1; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR H.J.CHO,B.S.KANG . 253 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12868.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 189 74.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 69 27.3 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 . 14 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 73 28.9 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+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 0 0 0 0 2 0 0 0 0 0 0 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 0 1 2 1 3 1 2 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 2 0 0 0 0 0 1 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 10 A Y 0 0 274 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 153.4 6.7 -8.0 13.2 2 11 A P - 0 0 42 0, 0.0 2,-0.5 0, 0.0 69,-0.1 -0.379 360.0 -96.3 -72.1 156.4 6.9 -5.2 10.7 3 12 A Y + 0 0 32 67,-0.2 69,-2.0 13,-0.1 2,-0.3 -0.635 57.3 160.2 -70.2 120.8 9.3 -2.2 11.1 4 13 A C E +a 72 0A 18 -2,-0.5 2,-0.4 67,-0.2 69,-0.2 -0.824 10.0 171.5-152.4 102.8 7.1 0.5 12.7 5 14 A R E -a 73 0A 127 67,-2.5 69,-2.3 -2,-0.3 2,-0.5 -0.935 25.8-171.8-126.1 140.3 8.6 3.4 14.5 6 15 A L E +a 74 0A 27 -2,-0.4 2,-0.3 67,-0.2 69,-0.2 -0.978 34.2 164.1-122.3 116.8 7.7 6.7 16.0 7 16 A T E -a 75 0A 35 67,-2.2 69,-2.2 -2,-0.5 4,-0.1 -0.946 51.8-144.1-140.0 150.1 10.8 8.6 17.1 8 17 A D S S+ 0 0 119 -2,-0.3 70,-0.1 67,-0.2 67,-0.1 0.444 84.9 87.5 -81.2 -5.0 12.2 11.9 18.1 9 18 A Q S S- 0 0 131 1,-0.1 -2,-0.2 68,-0.0 67,-0.1 -0.605 96.4 -79.4 -99.1 155.9 15.4 11.0 16.2 10 19 A P - 0 0 96 0, 0.0 -1,-0.1 0, 0.0 75,-0.1 -0.267 57.1-110.9 -50.6 132.6 16.3 11.4 12.6 11 20 A L - 0 0 29 73,-0.4 2,-0.6 -4,-0.1 73,-0.1 -0.323 23.1-131.1 -71.6 150.2 14.7 8.7 10.4 12 21 A S > - 0 0 33 1,-0.2 4,-1.6 75,-0.1 5,-0.1 -0.908 19.3-175.7-109.9 115.4 16.7 5.9 8.8 13 22 A V H > S+ 0 0 17 -2,-0.6 4,-2.9 2,-0.2 5,-0.2 0.892 90.6 57.8 -70.0 -41.0 16.2 5.1 5.1 14 23 A D H > S+ 0 0 92 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.905 107.1 47.5 -50.9 -49.3 18.6 2.2 5.5 15 24 A E H > S+ 0 0 94 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.902 113.5 45.7 -62.4 -46.5 16.5 0.7 8.3 16 25 A V H X S+ 0 0 0 -4,-1.6 4,-0.8 2,-0.2 -2,-0.2 0.909 114.6 49.8 -64.0 -41.6 13.2 1.0 6.4 17 26 A L H >X S+ 0 0 35 -4,-2.9 3,-0.6 1,-0.2 4,-0.5 0.905 111.4 47.6 -63.8 -44.1 14.9 -0.3 3.2 18 27 A A H >< S+ 0 0 67 -4,-2.6 3,-1.0 1,-0.2 -2,-0.2 0.893 106.8 57.2 -65.3 -40.2 16.4 -3.3 5.1 19 28 A A H 3< S+ 0 0 45 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.726 113.2 40.7 -59.0 -23.2 13.0 -4.2 6.8 20 29 A V H << S+ 0 0 1 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.409 95.7 102.5-114.3 -4.1 11.4 -4.5 3.4 21 30 A S << + 0 0 47 -3,-1.0 3,-0.1 -4,-0.5 70,-0.1 -0.366 38.6 141.2 -84.9 162.6 14.1 -6.3 1.5 22 31 A G > - 0 0 17 3,-0.3 3,-1.7 -2,-0.1 195,-0.1 -0.830 61.3 -90.7 168.0 152.2 14.3 -10.0 0.7 23 32 A P T 3 S+ 0 0 78 0, 0.0 145,-1.0 0, 0.0 194,-0.2 0.751 123.6 42.3 -45.5 -34.4 15.2 -12.6 -2.0 24 33 A E T 3 S+ 0 0 112 143,-0.2 2,-1.0 192,-0.1 143,-0.1 0.495 86.1 101.3 -99.8 -5.6 11.7 -12.5 -3.5 25 34 A Q < + 0 0 3 -3,-1.7 -3,-0.3 1,-0.2 140,-0.1 -0.706 37.6 169.4 -85.9 100.1 11.1 -8.7 -3.5 26 35 A G + 0 0 11 -2,-1.0 139,-3.1 66,-0.5 2,-0.4 0.786 66.0 46.6 -78.8 -28.8 11.7 -7.6 -7.1 27 36 A G E -BC 92 164A 0 65,-2.5 65,-2.0 137,-0.2 2,-0.4 -0.963 59.9-179.5-125.2 131.8 10.3 -4.1 -6.5 28 37 A I E -BC 91 163A 1 135,-2.0 135,-2.9 -2,-0.4 2,-0.5 -0.993 4.2-171.2-130.2 123.6 10.8 -1.6 -3.6 29 38 A V E -BC 90 162A 0 61,-3.2 61,-2.6 -2,-0.4 2,-0.5 -0.958 5.0-170.7-112.3 130.9 9.2 1.8 -3.3 30 39 A I E -BC 89 161A 0 131,-2.8 131,-2.8 -2,-0.5 2,-0.5 -0.985 5.1-160.7-122.9 125.2 10.3 4.2 -0.7 31 40 A F E -BC 88 160A 8 57,-2.7 57,-2.8 -2,-0.5 2,-0.5 -0.932 4.8-169.6-107.2 129.9 8.5 7.4 0.1 32 41 A V E -BC 87 159A 4 127,-3.0 127,-2.3 -2,-0.5 2,-0.8 -0.975 7.4-158.9-118.3 121.0 10.3 10.2 2.0 33 42 A G E -BC 86 158A 8 53,-2.9 52,-3.7 -2,-0.5 53,-1.2 -0.880 18.9-170.6 -99.7 104.0 8.2 13.2 3.3 34 43 A N E -B 84 0A 26 123,-1.5 2,-0.4 -2,-0.8 50,-0.2 -0.661 27.7-108.5 -96.3 151.0 10.6 16.1 3.9 35 44 A V - 0 0 18 48,-2.4 47,-2.2 45,-0.3 121,-0.1 -0.649 40.8-150.5 -74.2 125.6 10.0 19.5 5.6 36 45 A R 0 0 103 -2,-0.4 119,-0.2 45,-0.2 47,-0.1 -0.394 360.0 360.0 -93.9 172.8 9.8 22.3 2.9 37 46 A D 0 0 150 117,-1.5 -1,-0.1 -2,-0.1 120,-0.0 -0.503 360.0 360.0 -74.5 360.0 10.7 26.0 3.1 38 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 39 54 A T 0 0 133 0, 0.0 2,-0.3 0, 0.0 82,-0.3 0.000 360.0 360.0 360.0 105.4 10.6 29.6 11.4 40 55 A R E -I 120 0B 108 80,-2.2 80,-2.1 40,-0.1 2,-0.4 -0.741 360.0-157.8-100.0 140.7 10.4 26.6 13.8 41 56 A L E -IJ 119 79B 17 38,-0.9 38,-3.3 -2,-0.3 2,-0.4 -0.959 8.7-176.7-124.6 131.8 8.3 23.4 13.3 42 57 A F E -IJ 118 78B 62 76,-2.7 76,-2.8 -2,-0.4 2,-0.5 -0.971 14.0-157.2-128.3 136.9 7.1 20.8 15.9 43 58 A Y E -IJ 117 77B 33 34,-2.2 34,-3.0 -2,-0.4 2,-0.4 -0.970 15.1-170.8-108.8 123.6 5.2 17.5 15.7 44 59 A E E +I 116 0B 112 72,-2.7 72,-3.1 -2,-0.5 2,-0.3 -0.947 15.7 154.9-116.0 134.5 3.4 16.5 18.8 45 60 A A - 0 0 30 -2,-0.4 70,-0.1 70,-0.2 -2,-0.0 -0.984 48.2-117.7-152.4 156.3 1.8 13.1 19.2 46 61 A Y >> - 0 0 154 68,-0.4 4,-2.0 -2,-0.3 3,-0.7 -0.889 33.5-152.9 -96.2 101.7 0.7 10.4 21.7 47 62 A P H 3> S+ 0 0 58 0, 0.0 4,-3.1 0, 0.0 5,-0.3 0.806 85.8 56.0 -53.5 -44.2 3.0 7.5 20.7 48 63 A P H 3> S+ 0 0 62 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.917 114.1 41.1 -53.6 -45.0 0.8 4.6 21.8 49 64 A M H <> S+ 0 0 75 -3,-0.7 4,-2.3 2,-0.2 5,-0.1 0.911 117.1 47.6 -67.9 -45.8 -2.1 5.7 19.7 50 65 A V H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.922 112.2 48.6 -61.2 -47.8 -0.0 6.7 16.7 51 66 A I H X S+ 0 0 62 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.912 111.3 50.8 -61.5 -44.0 2.0 3.5 16.7 52 67 A R H X S+ 0 0 159 -4,-1.8 4,-2.2 -5,-0.3 -1,-0.2 0.912 111.0 48.8 -57.5 -46.4 -1.2 1.5 16.9 53 68 A T H X S+ 0 0 27 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.907 109.8 51.9 -60.7 -43.3 -2.6 3.4 14.0 54 69 A L H X S+ 0 0 1 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.896 109.0 50.5 -61.8 -40.3 0.6 2.9 12.0 55 70 A M H X S+ 0 0 72 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.895 108.3 52.3 -63.1 -42.9 0.3 -0.9 12.6 56 71 A S H X S+ 0 0 59 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.920 111.0 47.5 -56.3 -47.3 -3.3 -0.9 11.4 57 72 A I H X S+ 0 0 2 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.925 109.7 52.5 -61.7 -47.6 -2.3 0.9 8.2 58 73 A I H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.907 109.1 51.0 -55.0 -44.5 0.6 -1.6 7.6 59 74 A G H X S+ 0 0 35 -4,-2.3 4,-0.8 1,-0.2 -1,-0.2 0.856 110.7 47.3 -63.0 -39.4 -1.7 -4.5 8.0 60 75 A R H < S+ 0 0 81 -4,-1.7 4,-0.4 2,-0.2 -1,-0.2 0.875 113.2 48.9 -70.1 -38.6 -4.2 -3.1 5.5 61 76 A C H >< S+ 0 0 0 -4,-2.4 3,-0.8 1,-0.2 4,-0.3 0.863 110.7 49.0 -68.5 -39.7 -1.5 -2.4 3.0 62 77 A E H 3< S+ 0 0 66 -4,-2.3 3,-0.5 1,-0.2 6,-0.4 0.715 103.1 65.4 -70.3 -20.1 0.1 -5.8 3.2 63 78 A D T 3< S+ 0 0 136 -4,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.618 83.5 76.1 -77.4 -17.5 -3.3 -7.3 2.8 64 79 A K S < S+ 0 0 155 -3,-0.8 2,-0.3 -4,-0.4 -1,-0.2 0.819 106.9 1.0 -70.3 -36.1 -3.8 -6.1 -0.8 65 80 A A S > S- 0 0 32 -3,-0.5 3,-1.0 -4,-0.3 -1,-0.1 -0.977 84.0 -85.1-151.5 158.9 -1.5 -8.5 -2.6 66 81 A E T 3 S+ 0 0 180 -2,-0.3 31,-0.1 1,-0.2 -3,-0.1 -0.415 106.9 15.6 -70.2 138.9 0.8 -11.6 -1.9 67 82 A G T 3 S+ 0 0 30 1,-0.2 2,-0.5 25,-0.1 -1,-0.2 0.642 85.0 149.2 77.3 17.8 4.4 -11.0 -0.8 68 83 A V < - 0 0 10 -3,-1.0 2,-0.4 -6,-0.4 -1,-0.2 -0.745 24.2-172.1 -90.6 123.0 3.8 -7.3 0.1 69 84 A R E - D 0 91A 91 22,-2.0 22,-2.4 -2,-0.5 2,-0.4 -0.945 0.3-170.6-116.6 133.9 6.0 -5.9 2.9 70 85 A V E - D 0 90A 4 -2,-0.4 2,-0.3 20,-0.2 -67,-0.2 -0.968 5.9-178.1-126.6 139.4 5.5 -2.5 4.4 71 86 A A E - D 0 89A 0 18,-2.8 18,-2.7 -2,-0.4 2,-0.4 -0.984 6.7-168.1-130.9 144.4 7.6 -0.5 6.9 72 87 A V E -aD 4 88A 1 -69,-2.0 -67,-2.5 -2,-0.3 2,-0.4 -0.999 11.7-179.2-137.5 138.4 7.0 3.0 8.4 73 88 A A E -aD 5 87A 0 14,-2.5 14,-2.9 -2,-0.4 2,-0.4 -0.999 9.0-176.8-129.1 129.7 8.9 5.5 10.4 74 89 A H E -aD 6 86A 5 -69,-2.3 -67,-2.2 -2,-0.4 2,-0.3 -0.981 15.8-139.6-124.2 139.4 7.4 8.8 11.5 75 90 A R E -a 7 0A 31 10,-3.3 2,-0.3 -2,-0.4 -67,-0.2 -0.711 14.7-170.3 -98.1 149.4 9.2 11.5 13.4 76 91 A T + 0 0 22 -69,-2.2 -32,-0.2 -2,-0.3 2,-0.2 -0.813 46.7 38.8-121.2 171.7 8.0 13.7 16.3 77 92 A G E S-J 43 0B 27 -34,-3.0 -34,-2.2 -2,-0.3 2,-0.3 -0.489 100.9 -7.3 91.6-158.6 9.5 16.8 17.9 78 93 A E E -J 42 0B 60 -36,-0.2 2,-0.3 -2,-0.2 -36,-0.2 -0.549 64.9-168.4 -78.7 140.1 11.2 19.7 16.4 79 94 A L E -J 41 0B 3 -38,-3.3 -38,-0.9 -2,-0.3 2,-0.3 -0.918 7.8-153.3-130.3 153.7 12.0 19.6 12.7 80 95 A Q > - 0 0 104 -2,-0.3 3,-2.2 -40,-0.1 -45,-0.3 -0.765 41.6 -76.6-118.7 162.6 14.1 21.6 10.3 81 96 A I T 3 S+ 0 0 73 -2,-0.3 -45,-0.2 1,-0.3 3,-0.1 -0.429 122.3 26.0 -55.1 126.9 14.0 22.3 6.6 82 97 A G T 3 S+ 0 0 45 -47,-2.2 -1,-0.3 1,-0.4 2,-0.2 0.195 91.6 128.1 100.2 -14.5 15.3 19.2 4.9 83 98 A D < - 0 0 42 -3,-2.2 -48,-2.4 -48,-0.1 2,-0.5 -0.524 62.9-118.9 -76.8 140.8 14.4 16.8 7.7 84 99 A A E -B 34 0A 19 -50,-0.2 -73,-0.4 -2,-0.2 -50,-0.3 -0.685 26.4-177.7 -78.2 123.6 12.4 13.7 6.9 85 100 A A E S+ 0 0 7 -52,-3.7 -10,-3.3 -2,-0.5 2,-0.3 0.791 74.2 12.6 -87.8 -34.9 9.0 13.7 8.8 86 101 A V E -BD 33 74A 3 -53,-1.2 -53,-2.9 -12,-0.2 2,-0.4 -0.999 58.1-169.0-144.2 141.9 8.0 10.3 7.4 87 102 A V E -BD 32 73A 1 -14,-2.9 -14,-2.5 -2,-0.3 2,-0.4 -0.991 13.2-176.4-130.8 124.2 9.8 7.4 5.6 88 103 A I E -BD 31 72A 0 -57,-2.8 -57,-2.7 -2,-0.4 2,-0.4 -0.952 4.9-168.5-122.1 138.9 7.7 4.6 4.2 89 104 A G E +BD 30 71A 0 -18,-2.7 -18,-2.8 -2,-0.4 2,-0.3 -0.992 7.2 175.2-126.6 136.1 8.9 1.4 2.5 90 105 A A E -BD 29 70A 0 -61,-2.6 -61,-3.2 -2,-0.4 2,-0.3 -0.990 4.8-178.7-138.7 135.1 6.9 -1.1 0.5 91 106 A S E +BD 28 69A 0 -22,-2.4 -22,-2.0 -2,-0.3 -63,-0.2 -0.900 5.9 165.3-129.7 160.2 8.1 -4.1 -1.4 92 107 A A E -B 27 0A 0 -65,-2.0 -65,-2.5 -2,-0.3 -66,-0.5 -0.962 52.8 -97.6-161.1 162.0 6.6 -6.8 -3.6 93 108 A P S S+ 0 0 37 0, 0.0 -67,-0.3 0, 0.0 2,-0.3 0.930 113.6 33.3 -51.2 -42.4 7.6 -9.5 -6.1 94 109 A H S > S- 0 0 104 -68,-0.2 4,-1.0 -69,-0.1 3,-0.5 -0.825 85.3-119.2-120.2 155.1 6.7 -7.0 -8.8 95 110 A R H > S+ 0 0 73 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.784 104.5 64.4 -63.9 -33.2 6.8 -3.2 -9.0 96 111 A A H > S+ 0 0 29 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.927 104.9 45.6 -57.1 -45.8 3.1 -2.5 -9.5 97 112 A E H > S+ 0 0 65 -3,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.781 111.0 52.4 -73.2 -27.9 2.2 -3.9 -6.1 98 113 A A H X S+ 0 0 0 -4,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.879 111.0 47.3 -73.6 -40.3 5.1 -2.0 -4.3 99 114 A F H X S+ 0 0 9 -4,-2.4 4,-2.1 2,-0.2 5,-0.2 0.930 112.9 50.2 -63.2 -45.1 3.9 1.3 -5.9 100 115 A D H X S+ 0 0 94 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.928 113.4 44.5 -57.0 -49.3 0.3 0.5 -4.9 101 116 A A H X S+ 0 0 4 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.881 112.7 49.6 -67.6 -43.8 1.2 -0.3 -1.2 102 117 A A H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.900 114.5 45.3 -61.2 -43.4 3.5 2.7 -0.7 103 118 A R H X S+ 0 0 79 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.918 113.9 48.6 -68.1 -43.3 0.9 5.1 -2.1 104 119 A M H X S+ 0 0 53 -4,-2.3 4,-2.5 -5,-0.2 5,-0.2 0.915 109.3 55.1 -60.1 -43.5 -1.9 3.5 -0.1 105 120 A C H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.885 110.7 42.2 -56.8 -46.9 0.3 3.7 3.1 106 121 A I H X S+ 0 0 2 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.858 113.3 51.6 -75.3 -36.2 1.0 7.4 2.9 107 122 A E H X S+ 0 0 43 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.941 114.0 44.6 -62.5 -47.3 -2.6 8.4 2.0 108 123 A L H X S+ 0 0 22 -4,-2.5 4,-2.3 2,-0.2 5,-0.4 0.898 112.9 51.7 -62.5 -41.8 -3.9 6.4 4.9 109 124 A L H X S+ 0 0 5 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.930 110.6 47.8 -60.4 -47.1 -1.2 7.8 7.2 110 125 A K H < S+ 0 0 110 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.835 117.4 43.0 -62.8 -35.6 -2.1 11.4 6.2 111 126 A Q H < S+ 0 0 141 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.809 128.7 21.6 -78.7 -33.0 -5.8 10.7 6.8 112 127 A E H < S+ 0 0 73 -4,-2.3 -3,-0.2 -5,-0.1 -2,-0.2 0.811 85.0 99.7-114.8 -39.7 -5.6 8.8 10.0 113 128 A V < - 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