==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 31-OCT-06 2NQT . COMPND 2 MOLECULE: N-ACETYL-GAMMA-GLUTAMYL-PHOSPHATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR L.T.CHERNEY,M.M.CHERNEY,C.R.GAREN,F.MORAIDIN,M.N.G.JAMES,TB . 692 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25674.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 503 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 78 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 1 0.1 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 . 65 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 95 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 142 20.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 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 6 3 1 0 2 2 0 2 4 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 4 4 2 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 PARALLEL BRIDGES PER LADDER . 2 2 0 0 0 0 2 4 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 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 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 6 A V 0 0 153 0, 0.0 332,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 130.8 33.9 36.0 26.3 2 7 A A + 0 0 21 330,-2.6 3,-0.1 1,-0.1 32,-0.1 -0.390 360.0 172.0 -73.8 149.7 33.5 34.1 23.0 3 8 A N S S+ 0 0 120 1,-0.3 2,-0.3 -2,-0.1 -1,-0.1 0.514 73.7 22.5-134.5 -26.1 36.3 34.2 20.3 4 9 A A + 0 0 31 2,-0.0 2,-0.5 32,-0.0 -1,-0.3 -0.845 68.8 173.0-148.7 111.7 35.3 31.7 17.6 5 10 A T E -a 35 0A 4 29,-3.3 31,-2.8 -2,-0.3 2,-0.5 -0.951 14.6-162.6-128.7 109.4 31.6 30.9 17.4 6 11 A K E -a 36 0A 85 -2,-0.5 72,-1.7 29,-0.2 71,-1.4 -0.842 17.9-159.0 -93.5 124.7 30.3 28.8 14.6 7 12 A V E -ab 37 78A 0 29,-3.3 31,-3.5 -2,-0.5 2,-0.3 -0.860 11.8-163.0-114.5 134.9 26.5 29.2 14.2 8 13 A A E - b 0 79A 0 70,-2.4 72,-2.7 -2,-0.4 2,-0.5 -0.852 8.5-151.0-106.2 152.1 23.9 27.0 12.6 9 14 A V E > -ab 40 80A 0 30,-2.4 32,-2.4 -2,-0.3 3,-0.6 -0.952 7.1-163.1-124.9 110.8 20.4 28.2 11.6 10 15 A A E 3 S+ab 41 81A 0 70,-3.0 72,-2.9 -2,-0.5 32,-0.2 -0.802 83.0 27.3 -91.4 130.4 17.7 25.5 11.7 11 16 A G T > S+ 0 0 8 30,-1.7 3,-1.3 -2,-0.5 6,-0.5 0.822 77.0 161.0 82.9 38.9 14.6 26.6 9.8 12 17 A A T < + 0 0 0 29,-2.9 30,-0.2 -3,-0.6 9,-0.1 0.723 62.6 62.5 -67.8 -21.8 16.7 28.8 7.6 13 18 A S T 3 S+ 0 0 32 28,-0.4 -1,-0.3 4,-0.1 29,-0.1 0.580 89.0 83.9 -84.9 -11.3 14.1 29.1 4.8 14 19 A G S <> S- 0 0 20 -3,-1.3 4,-2.2 68,-0.1 5,-0.2 -0.238 94.7 -99.4 -81.7 176.6 11.4 30.8 7.0 15 20 A Y H > S+ 0 0 91 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.916 122.3 48.9 -64.5 -44.6 11.2 34.6 7.8 16 21 A A H > S+ 0 0 3 66,-0.2 4,-2.7 1,-0.2 5,-0.2 0.923 112.7 49.3 -60.7 -44.2 12.8 34.3 11.2 17 22 A G H > S+ 0 0 0 65,-0.5 4,-2.2 -6,-0.5 -1,-0.2 0.912 110.9 49.3 -61.0 -44.9 15.7 32.3 9.7 18 23 A G H X S+ 0 0 1 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.874 112.4 48.2 -62.7 -38.5 16.2 34.8 6.9 19 24 A E H X S+ 0 0 3 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.900 107.8 53.1 -73.7 -40.4 16.2 37.7 9.3 20 25 A I H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.953 111.6 49.1 -53.2 -47.7 18.7 36.1 11.8 21 26 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.908 107.7 52.8 -61.5 -42.0 20.9 35.6 8.7 22 27 A R H X S+ 0 0 79 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.928 113.1 44.8 -56.7 -46.0 20.5 39.2 7.6 23 28 A L H < S+ 0 0 11 -4,-2.4 4,-0.5 1,-0.2 -2,-0.2 0.876 110.8 52.8 -68.1 -38.6 21.6 40.3 11.1 24 29 A L H >< S+ 0 0 0 -4,-2.7 3,-1.3 1,-0.2 6,-0.3 0.921 106.3 54.0 -64.6 -40.7 24.5 37.9 11.4 25 30 A L H 3< S+ 0 0 36 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.808 112.8 43.7 -62.3 -30.1 25.9 39.2 8.0 26 31 A G T 3< S+ 0 0 59 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.410 89.6 114.2 -92.1 -1.0 25.8 42.7 9.4 27 32 A H X> - 0 0 1 -3,-1.3 4,-1.8 -4,-0.5 3,-1.0 -0.486 69.3-133.3 -77.8 137.2 27.3 41.8 12.8 28 33 A P H 3> S+ 0 0 51 0, 0.0 4,-1.9 0, 0.0 6,-0.2 0.824 106.6 58.2 -61.6 -26.8 30.8 43.2 13.6 29 34 A A H 34>S+ 0 0 0 2,-0.2 6,-2.5 1,-0.2 5,-1.5 0.757 103.8 52.8 -73.0 -24.6 31.9 39.7 14.9 30 35 A Y H X45S+ 0 0 83 -3,-1.0 3,-0.9 -6,-0.3 -1,-0.2 0.942 110.5 47.0 -69.3 -47.5 31.1 38.3 11.4 31 36 A A H 3<5S+ 0 0 89 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.832 114.4 46.5 -63.6 -34.5 33.2 41.0 9.8 32 37 A D T 3<5S- 0 0 90 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.441 117.1-108.5 -94.5 0.9 36.2 40.4 12.2 33 38 A G T < 5S+ 0 0 34 -3,-0.9 -3,-0.2 -4,-0.4 -4,-0.1 0.433 91.4 105.2 97.7 0.9 36.1 36.6 11.9 34 39 A R S + 0 0 40 -2,-0.3 3,-2.4 1,-0.3 20,-0.2 0.498 61.2 163.1 80.8 7.3 13.9 21.8 0.4 46 51 A A T 3 + 0 0 52 1,-0.3 -1,-0.3 -4,-0.2 20,-0.2 -0.360 67.4 35.3 -54.2 135.9 17.3 20.2 1.3 47 52 A G T 3 S+ 0 0 58 18,-2.8 -1,-0.3 1,-0.5 19,-0.1 0.055 93.9 109.5 101.1 -23.3 19.5 20.5 -1.8 48 53 A S S < S- 0 0 20 -3,-2.4 17,-3.0 17,-0.1 -1,-0.5 -0.366 73.3-111.3 -72.7 162.9 18.0 23.8 -2.9 49 54 A T B > -G 64 0B 45 15,-0.2 3,-1.3 -3,-0.1 4,-0.4 -0.686 19.2-117.8 -96.3 155.5 20.2 26.9 -2.5 50 55 A L G >> S+ 0 0 0 13,-2.7 4,-3.1 10,-0.4 3,-1.7 0.843 111.2 65.3 -59.3 -33.6 19.5 29.7 0.0 51 56 A G G 34 S+ 0 0 19 10,-2.5 -1,-0.3 1,-0.3 11,-0.1 0.748 92.1 62.7 -62.0 -25.6 19.0 32.3 -2.8 52 57 A E G <4 S+ 0 0 134 -3,-1.3 -1,-0.3 9,-0.3 -2,-0.2 0.695 117.4 29.0 -72.1 -20.4 15.9 30.4 -3.9 53 58 A H T <4 S+ 0 0 35 -3,-1.7 -2,-0.2 -4,-0.4 -1,-0.2 0.736 134.7 25.9-103.5 -39.6 14.4 31.1 -0.5 54 59 A H >< + 0 0 6 -4,-3.1 3,-2.1 1,-0.1 -2,-0.2 -0.669 58.9 173.1-132.2 75.9 16.0 34.4 0.5 55 60 A P T 3 S+ 0 0 93 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.645 78.0 66.6 -63.3 -13.0 17.1 36.4 -2.6 56 61 A H T 3 S+ 0 0 101 1,-0.2 2,-1.0 -3,-0.1 -5,-0.1 0.677 86.6 71.0 -74.6 -18.3 18.0 39.4 -0.4 57 62 A L X + 0 0 4 -3,-2.1 3,-2.1 1,-0.2 4,-0.4 -0.361 59.3 157.0 -95.7 56.5 20.8 37.4 1.2 58 63 A T G > + 0 0 101 -2,-1.0 3,-1.4 1,-0.3 4,-0.4 0.809 63.5 64.4 -60.0 -32.8 23.1 37.4 -1.8 59 64 A P G 3 S+ 0 0 79 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.760 117.6 30.3 -59.4 -21.1 26.4 36.8 0.1 60 65 A L G X S+ 0 0 3 -3,-2.1 3,-2.2 1,-0.1 -10,-0.4 0.232 85.2 114.0-115.1 8.3 25.0 33.4 1.1 61 66 A A T < S+ 0 0 30 -3,-1.4 -10,-2.5 -4,-0.4 -9,-0.3 0.783 75.8 54.4 -54.6 -33.4 22.8 32.7 -2.0 62 67 A H T 3 S+ 0 0 127 -4,-0.4 -1,-0.3 -12,-0.2 -2,-0.1 0.538 79.1 117.8 -80.5 -12.4 25.0 29.8 -3.1 63 68 A R < - 0 0 73 -3,-2.2 -13,-2.7 -14,-0.1 2,-0.5 -0.353 65.8-128.0 -58.9 136.4 24.7 27.9 0.3 64 69 A V B -G 49 0B 81 -15,-0.2 -24,-0.4 -14,-0.1 -15,-0.2 -0.782 19.5-123.5 -90.8 124.4 23.0 24.6 -0.1 65 70 A V - 0 0 2 -17,-3.0 -18,-2.8 -2,-0.5 -24,-0.2 -0.450 30.2-158.3 -64.9 131.8 20.1 24.0 2.3 66 71 A E E -c 41 0A 82 -26,-2.7 -24,-2.2 -20,-0.2 2,-0.1 -0.710 26.4 -86.4-108.9 162.5 20.6 20.8 4.4 67 72 A P E -c 42 0A 49 0, 0.0 2,-1.3 0, 0.0 -24,-0.2 -0.417 42.4-109.9 -67.5 145.3 18.1 18.7 6.3 68 73 A T + 0 0 42 -26,-1.1 2,-0.3 -2,-0.1 3,-0.1 -0.651 68.2 136.1 -74.2 95.4 17.2 19.7 9.8 69 74 A E >> - 0 0 105 -2,-1.3 4,-1.8 1,-0.1 3,-0.6 -0.991 65.0-119.8-144.2 145.7 18.9 16.8 11.6 70 75 A A H 3> S+ 0 0 22 -2,-0.3 4,-1.2 1,-0.2 26,-0.1 0.873 111.9 58.5 -54.4 -40.5 21.0 16.7 14.8 71 76 A A H 34 S+ 0 0 91 1,-0.2 3,-0.3 2,-0.2 -1,-0.2 0.876 108.1 45.5 -59.7 -39.6 24.0 15.3 12.8 72 77 A V H <4 S+ 0 0 30 -3,-0.6 -1,-0.2 1,-0.2 -33,-0.2 0.861 112.3 51.6 -69.4 -37.1 24.1 18.3 10.5 73 78 A L H >< S+ 0 0 2 -4,-1.8 3,-0.6 -35,-0.1 -2,-0.2 0.594 89.1 106.4 -79.0 -12.6 23.7 20.7 13.4 74 79 A G T 3< + 0 0 41 -4,-1.2 3,-0.1 -3,-0.3 21,-0.0 -0.235 67.5 39.0 -61.5 155.3 26.6 19.1 15.3 75 80 A G T 3 S+ 0 0 66 1,-0.3 2,-0.4 2,-0.0 -1,-0.2 0.729 87.8 116.8 73.6 21.8 30.0 20.9 15.4 76 81 A H < - 0 0 14 -3,-0.6 -1,-0.3 1,-0.1 -69,-0.2 -0.985 57.5-150.5-119.6 137.5 28.4 24.3 15.9 77 82 A D S S+ 0 0 72 -71,-1.4 23,-2.7 -2,-0.4 2,-0.3 0.755 86.8 26.4 -74.7 -26.9 28.9 26.4 19.0 78 83 A A E -bd 7 100A 0 -72,-1.7 -70,-2.4 21,-0.2 2,-0.4 -0.997 65.8-166.9-138.4 141.1 25.4 28.1 18.7 79 84 A V E -bd 8 101A 0 21,-2.8 23,-2.8 -2,-0.3 2,-0.6 -0.986 9.0-154.2-131.2 121.8 22.2 26.9 17.0 80 85 A F E -bd 9 102A 0 -72,-2.7 -70,-3.0 -2,-0.4 2,-1.0 -0.848 5.8-155.3 -90.1 125.9 19.3 29.1 16.2 81 86 A L E -bd 10 103A 0 21,-3.1 23,-2.8 -2,-0.6 2,-1.2 -0.840 18.0-169.8 -99.6 90.9 16.0 27.1 16.1 82 87 A A + 0 0 3 -72,-2.9 -65,-0.5 -2,-1.0 -66,-0.2 -0.183 45.0 111.4 -92.2 45.5 14.4 29.6 13.9 83 88 A L > + 0 0 73 -2,-1.2 3,-1.8 1,-0.1 5,-0.1 -0.793 36.6 178.5-119.7 87.7 10.8 28.3 13.9 84 89 A P T 3 S+ 0 0 36 0, 0.0 22,-0.2 0, 0.0 -1,-0.1 0.716 88.7 39.3 -59.6 -24.2 8.6 30.8 15.9 85 90 A H T 3 S+ 0 0 117 20,-0.1 2,-0.2 -3,-0.1 20,-0.1 0.221 106.0 87.4-110.4 9.9 5.6 28.7 15.2 86 91 A G S < S- 0 0 20 -3,-1.8 20,-0.8 -5,-0.1 2,-0.5 -0.497 74.3-121.8-106.1 174.2 7.3 25.3 15.7 87 92 A H + 0 0 101 -2,-0.2 3,-0.2 18,-0.1 4,-0.2 -0.959 29.1 172.1-120.1 109.8 8.0 23.0 18.6 88 93 A S > + 0 0 8 -2,-0.5 4,-3.2 1,-0.2 5,-0.3 0.312 45.2 106.0-110.6 10.9 11.7 22.4 19.0 89 94 A A H > S+ 0 0 30 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.920 84.4 49.9 -50.7 -48.7 11.9 20.5 22.4 90 95 A V H > S+ 0 0 112 -3,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.918 115.3 41.6 -59.9 -47.2 12.5 17.2 20.5 91 96 A L H >> S+ 0 0 27 -4,-0.2 3,-1.4 1,-0.2 4,-0.7 0.918 111.0 55.7 -66.8 -45.3 15.3 18.6 18.4 92 97 A A H >< S+ 0 0 10 -4,-3.2 3,-0.9 1,-0.3 -1,-0.2 0.856 102.2 58.1 -56.8 -36.7 16.9 20.6 21.2 93 98 A Q H 3< S+ 0 0 167 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.735 102.7 55.4 -64.5 -24.3 17.2 17.4 23.2 94 99 A Q H << S+ 0 0 113 -3,-1.4 -1,-0.2 -4,-0.6 -2,-0.2 0.621 89.8 92.5 -86.6 -16.0 19.3 15.9 20.4 95 100 A L S << S- 0 0 12 -3,-0.9 -24,-0.1 -4,-0.7 -21,-0.1 -0.410 95.2 -89.0 -77.4 154.9 21.9 18.6 20.3 96 101 A S > - 0 0 59 -26,-0.1 3,-2.0 1,-0.1 -1,-0.1 -0.473 41.0-130.3 -61.1 128.8 25.2 18.5 22.3 97 102 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.667 101.8 64.6 -66.2 -15.0 24.2 20.1 25.6 98 103 A E T 3 S+ 0 0 122 2,-0.1 -2,-0.1 0, 0.0 2,-0.0 0.595 81.0 108.4 -80.0 -9.7 27.1 22.6 25.7 99 104 A T S < S- 0 0 9 -3,-2.0 2,-0.8 1,-0.1 -21,-0.2 -0.364 80.7-117.8 -63.7 141.4 25.7 24.2 22.5 100 105 A L E -d 78 0A 0 -23,-2.7 -21,-2.8 -24,-0.1 2,-0.5 -0.792 37.7-163.0 -77.4 112.0 24.2 27.7 22.9 101 106 A I E -de 79 147A 1 45,-2.6 47,-2.1 -2,-0.8 2,-0.6 -0.900 11.3-171.6-108.6 123.4 20.6 26.9 21.8 102 107 A I E -de 80 148A 0 -23,-2.8 -21,-3.1 -2,-0.5 2,-0.6 -0.933 7.4-162.4-119.9 105.1 18.4 29.8 20.9 103 108 A D E -de 81 149A 0 45,-2.8 47,-3.0 -2,-0.6 -21,-0.2 -0.807 15.7-173.2 -98.2 119.4 14.8 28.8 20.3 104 109 A C + 0 0 1 -23,-2.8 -1,-0.1 -2,-0.6 -22,-0.1 0.625 67.1 81.9 -78.7 -17.3 12.6 31.2 18.4 105 110 A G S S- 0 0 0 -24,-0.5 3,-0.3 -20,-0.1 45,-0.2 -0.064 90.2-106.2 -81.7-172.3 9.6 29.0 19.2 106 111 A A S >> S+ 0 0 5 -20,-0.8 3,-2.4 -22,-0.2 4,-0.7 0.601 85.2 99.3 -93.4 -14.7 7.4 28.8 22.3 107 112 A D T 34 S+ 0 0 9 -21,-0.4 18,-0.5 1,-0.3 19,-0.2 0.718 95.1 31.3 -55.6 -29.5 8.4 25.5 24.0 108 113 A F T 34 S+ 0 0 18 -3,-0.3 20,-2.5 1,-0.1 -1,-0.3 0.226 99.5 85.2-113.3 17.3 10.7 27.1 26.5 109 114 A R T <4 S+ 0 0 7 -3,-2.4 2,-0.2 18,-0.2 -2,-0.1 0.848 73.3 73.4 -85.2 -37.2 8.9 30.4 27.1 110 115 A L < - 0 0 0 -4,-0.7 16,-0.1 16,-0.3 107,-0.1 -0.516 51.8-165.6 -91.9 152.3 6.3 29.6 29.7 111 116 A T S S+ 0 0 92 -2,-0.2 2,-0.5 1,-0.1 -1,-0.1 0.322 70.1 76.1-115.3 2.0 6.8 29.0 33.4 112 117 A D > - 0 0 78 1,-0.1 4,-2.6 14,-0.1 5,-0.1 -0.961 60.1-160.6-120.1 115.7 3.4 27.5 34.3 113 118 A A H > S+ 0 0 53 -2,-0.5 4,-2.5 1,-0.2 11,-0.2 0.850 92.0 50.6 -61.5 -39.0 2.8 23.9 33.2 114 119 A A H > S+ 0 0 70 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.919 111.6 47.8 -67.9 -42.3 -1.0 24.1 33.5 115 120 A V H > S+ 0 0 35 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.941 111.7 51.6 -61.0 -48.5 -1.2 27.2 31.4 116 121 A W H X S+ 0 0 2 -4,-2.6 4,-2.7 1,-0.2 5,-0.4 0.937 111.2 46.2 -52.3 -53.1 1.2 25.6 28.8 117 122 A E H X S+ 0 0 110 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.878 110.7 53.9 -61.5 -38.6 -1.0 22.4 28.5 118 123 A R H < S+ 0 0 156 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.921 120.1 30.0 -61.4 -45.3 -4.2 24.5 28.2 119 124 A F H < S+ 0 0 29 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.731 131.2 32.1 -88.9 -25.4 -3.0 26.6 25.3 120 125 A Y H < S- 0 0 23 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.557 91.2-132.0-114.4 -12.3 -0.6 24.2 23.5 121 126 A G S < S+ 0 0 69 -4,-1.8 2,-0.3 -5,-0.4 -4,-0.2 0.747 72.4 87.3 69.0 27.2 -2.1 20.8 24.1 122 127 A S S S- 0 0 52 -6,-0.3 -1,-0.2 0, 0.0 -2,-0.2 -0.925 87.5 -78.3-144.8 167.8 1.1 19.0 25.3 123 128 A S - 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