==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 31-AUG-05 2D1Q . COMPND 2 MOLECULE: LUCIFERIN 4-MONOOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LUCIOLA CRUCIATA; . AUTHOR T.NAKATSU,S.ICHIYAMA,J.HIRATAKE,A.SALDANHA,N.KOBASHI, . 531 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20910.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 359 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 72 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 33 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 134 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 0 0 0 2 2 2 4 2 0 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 3 4 1 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 . 6 3 3 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 1 0 1 2 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 8 A E 0 0 129 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-104.0 21.6 35.1 -14.5 2 9 A N + 0 0 67 363,-0.1 363,-0.3 2,-0.1 2,-0.3 -0.206 360.0 139.5 -98.1 30.3 24.0 34.2 -11.6 3 10 A I - 0 0 64 361,-0.1 2,-0.6 370,-0.1 361,-0.2 -0.587 47.5-142.9 -83.7 138.4 21.3 31.7 -10.3 4 11 A V E -A 363 0A 11 359,-3.2 359,-2.4 -2,-0.3 2,-0.4 -0.916 17.3-159.9-106.4 124.2 22.4 28.3 -9.0 5 12 A V E -A 362 0A 96 -2,-0.6 357,-0.2 357,-0.2 352,-0.1 -0.849 9.7-134.5-110.2 134.6 20.0 25.5 -9.9 6 13 A G - 0 0 12 355,-2.7 354,-0.3 -2,-0.4 352,-0.2 -0.481 31.4-101.7 -83.1 160.6 19.8 22.2 -8.1 7 14 A P - 0 0 58 0, 0.0 353,-1.1 0, 0.0 354,-0.2 -0.088 41.7 -84.5 -75.6 173.9 19.6 18.9 -10.0 8 15 A K - 0 0 87 351,-0.2 2,-0.2 1,-0.1 3,-0.0 -0.517 55.6-102.6 -71.5 146.7 16.5 16.8 -10.8 9 16 A P - 0 0 24 0, 0.0 -1,-0.1 0, 0.0 204,-0.1 -0.497 15.5-133.6 -73.7 143.6 15.7 14.4 -7.9 10 17 A F S S+ 0 0 134 1,-0.2 203,-0.1 -2,-0.2 206,-0.1 0.950 100.6 39.7 -56.3 -51.2 16.7 10.7 -8.2 11 18 A Y S S- 0 0 84 201,-0.3 -1,-0.2 -3,-0.0 3,-0.1 -0.916 93.0-130.0-103.8 120.4 13.2 9.7 -6.9 12 19 A P - 0 0 98 0, 0.0 2,-0.4 0, 0.0 -2,-0.0 -0.208 38.4 -84.1 -60.1 156.0 10.3 11.8 -8.2 13 20 A I - 0 0 50 1,-0.1 196,-0.1 -4,-0.0 195,-0.0 -0.522 54.4-133.2 -63.3 120.4 7.7 13.3 -5.8 14 21 A E - 0 0 43 -2,-0.4 2,-0.1 194,-0.3 7,-0.1 -0.307 19.1-100.7 -74.8 162.4 5.3 10.4 -5.3 15 22 A E S S+ 0 0 178 5,-0.0 -1,-0.1 6,-0.0 2,-0.1 -0.394 77.7 54.9 -77.0 159.5 1.5 10.8 -5.4 16 23 A G S S- 0 0 16 -2,-0.1 192,-0.1 165,-0.1 164,-0.1 -0.111 86.4 -64.4 102.5 159.4 -0.6 11.1 -2.3 17 24 A S > - 0 0 0 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.126 54.5 -97.5 -68.0 172.1 -0.7 13.2 0.8 18 25 A A H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 74,-0.1 0.849 127.4 48.4 -58.7 -37.1 2.2 13.3 3.4 19 26 A G H > S+ 0 0 0 72,-0.6 4,-2.4 2,-0.2 5,-0.2 0.892 108.0 52.5 -72.4 -41.9 0.1 10.8 5.5 20 27 A T H > S+ 0 0 38 71,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.945 113.2 45.1 -60.5 -46.6 -0.5 8.4 2.6 21 28 A Q H X S+ 0 0 7 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.909 112.2 51.3 -64.0 -42.2 3.2 8.3 1.8 22 29 A L H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.897 110.4 48.0 -61.8 -44.3 4.2 7.9 5.4 23 30 A R H X S+ 0 0 46 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.893 107.4 58.2 -62.2 -38.5 1.8 5.0 5.9 24 31 A K H X S+ 0 0 87 -4,-1.9 4,-0.8 -5,-0.2 -2,-0.2 0.899 114.2 36.5 -58.7 -46.4 3.1 3.3 2.7 25 32 A Y H X S+ 0 0 6 -4,-1.8 4,-1.7 2,-0.2 3,-0.5 0.935 116.5 50.7 -73.5 -48.3 6.6 3.2 4.0 26 33 A M H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.861 104.7 58.4 -60.1 -39.1 5.9 2.5 7.7 27 34 A E H X S+ 0 0 78 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.886 106.0 51.5 -54.0 -42.3 3.6 -0.5 6.7 28 35 A R H X S+ 0 0 125 -4,-0.8 4,-1.1 -3,-0.5 -2,-0.2 0.924 112.1 42.7 -63.1 -51.0 6.6 -2.0 4.9 29 36 A Y H X>S+ 0 0 3 -4,-1.7 5,-2.1 1,-0.2 4,-0.7 0.794 108.0 63.2 -70.4 -27.6 9.0 -1.7 7.9 30 37 A A H ><5S+ 0 0 20 -4,-2.4 3,-0.8 18,-0.3 19,-0.3 0.903 103.5 46.1 -58.2 -47.6 6.2 -2.9 10.2 31 38 A K H 3<5S+ 0 0 134 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.803 106.6 61.6 -67.0 -30.6 6.0 -6.4 8.4 32 39 A L H 3<5S- 0 0 115 -4,-1.1 -1,-0.2 -5,-0.1 -2,-0.2 0.698 112.4-117.6 -67.2 -24.1 9.8 -6.6 8.5 33 40 A G T <<5 + 0 0 62 -3,-0.8 -3,-0.2 -4,-0.7 -2,-0.1 0.647 57.5 162.9 93.5 17.4 9.8 -6.5 12.3 34 41 A A < - 0 0 13 -5,-2.1 14,-2.7 13,-0.1 2,-0.5 -0.295 37.6-127.5 -78.3 151.6 11.8 -3.3 12.4 35 42 A I E -H 47 0B 44 12,-0.3 12,-0.3 1,-0.1 191,-0.2 -0.867 19.7-174.5 -96.6 131.5 12.2 -0.9 15.3 36 43 A A E + 0 0 0 10,-2.2 218,-3.1 -2,-0.5 2,-0.4 0.890 65.5 23.0 -88.2 -46.9 11.3 2.8 14.7 37 44 A F E -Hi 46 254B 0 9,-1.8 9,-2.5 216,-0.2 2,-0.4 -0.980 55.5-177.8-135.6 132.2 12.3 4.6 18.0 38 45 A T E -Hi 45 255B 0 216,-2.8 218,-3.0 -2,-0.4 2,-0.8 -0.999 21.8-142.8-130.2 127.8 14.6 3.8 20.8 39 46 A N E > - i 0 256B 15 5,-2.3 4,-2.8 -2,-0.4 5,-0.3 -0.856 14.8-156.8 -86.4 111.8 15.1 5.9 23.9 40 47 A A T 4 S+ 0 0 14 216,-2.5 -1,-0.1 -2,-0.8 217,-0.1 0.727 86.8 51.9 -62.5 -27.4 18.9 5.5 24.5 41 48 A V T 4 S+ 0 0 85 215,-0.4 -1,-0.2 1,-0.1 216,-0.1 0.863 124.7 22.9 -84.1 -35.0 18.6 6.4 28.2 42 49 A T T 4 S- 0 0 90 -3,-0.2 -2,-0.2 2,-0.1 -1,-0.1 0.660 96.5-130.0-102.8 -22.1 15.9 3.9 29.2 43 50 A G < + 0 0 31 -4,-2.8 2,-0.3 1,-0.3 -3,-0.2 0.541 50.3 157.0 79.9 8.1 16.4 1.4 26.4 44 51 A V - 0 0 66 -5,-0.3 -5,-2.3 -6,-0.0 2,-0.3 -0.520 25.3-156.4 -65.7 124.6 12.7 1.4 25.5 45 52 A D E -H 38 0B 70 -2,-0.3 2,-0.4 -7,-0.2 -7,-0.2 -0.762 13.5-163.7-100.1 144.6 11.9 0.3 21.9 46 53 A Y E -H 37 0B 6 -9,-2.5 -10,-2.2 -2,-0.3 -9,-1.8 -0.956 20.0-143.7-121.4 114.8 8.9 1.1 19.7 47 54 A S E > -H 35 0B 39 -2,-0.4 4,-2.5 -12,-0.3 -12,-0.3 -0.254 24.6-111.4 -63.6 159.3 8.6 -1.2 16.7 48 55 A Y H > S+ 0 0 0 -14,-2.7 4,-3.1 -19,-0.2 -18,-0.3 0.860 117.7 55.6 -58.0 -36.4 7.3 0.2 13.4 49 56 A A H > S+ 0 0 47 -15,-0.4 4,-2.5 -19,-0.3 -1,-0.2 0.894 110.0 43.1 -67.8 -43.0 4.2 -1.9 13.8 50 57 A E H > S+ 0 0 70 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.938 116.1 48.5 -68.3 -45.6 3.3 -0.6 17.2 51 58 A Y H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.916 113.9 47.1 -60.0 -44.5 4.0 3.0 16.1 52 59 A L H X S+ 0 0 19 -4,-3.1 4,-2.5 -5,-0.2 -2,-0.2 0.953 113.7 47.6 -59.6 -51.2 2.0 2.5 13.0 53 60 A E H X S+ 0 0 106 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.902 111.9 48.5 -59.8 -43.8 -0.9 1.0 14.9 54 61 A K H X S+ 0 0 29 -4,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.878 112.1 50.3 -66.7 -34.2 -1.0 3.7 17.6 55 62 A S H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.927 113.1 45.3 -67.7 -45.1 -0.9 6.4 14.9 56 63 A X H X S+ 0 0 5 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.922 114.5 48.6 -61.7 -48.8 -3.8 4.9 13.0 57 64 A X H X S+ 0 0 21 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.886 112.1 48.8 -57.4 -43.5 -5.8 4.3 16.2 58 65 A L H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 5,-0.2 0.928 107.6 55.8 -64.8 -43.5 -5.1 7.9 17.2 59 66 A G H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.938 110.3 44.7 -49.9 -51.5 -6.2 9.1 13.8 60 67 A K H X S+ 0 0 56 -4,-2.3 4,-2.5 1,-0.2 3,-0.3 0.930 111.1 54.3 -57.2 -47.2 -9.6 7.3 14.2 61 68 A A H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.838 106.2 51.2 -56.5 -38.7 -10.0 8.7 17.8 62 69 A L H X>S+ 0 0 0 -4,-2.2 5,-2.3 2,-0.2 4,-0.6 0.828 110.5 49.1 -72.7 -32.9 -9.5 12.3 16.7 63 70 A Q H ><5S+ 0 0 64 -4,-1.4 3,-1.0 -3,-0.3 -2,-0.2 0.924 111.9 47.8 -69.9 -45.3 -12.2 11.9 14.0 64 71 A N H 3<5S+ 0 0 74 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.802 105.4 60.5 -64.6 -30.0 -14.6 10.3 16.5 65 72 A Y H 3<5S- 0 0 58 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.716 126.9-101.2 -69.8 -23.5 -13.7 13.2 18.9 66 73 A G T <<5 + 0 0 52 -3,-1.0 2,-0.5 -4,-0.6 -3,-0.2 0.449 69.4 147.8 117.8 5.7 -15.1 15.6 16.2 67 74 A L < - 0 0 20 -5,-2.3 -1,-0.3 4,-0.0 2,-0.2 -0.601 27.5-163.9 -76.6 122.4 -12.0 17.0 14.5 68 75 A V > - 0 0 108 -2,-0.5 3,-1.9 1,-0.2 25,-0.1 -0.481 39.4 -64.8 -97.3 169.5 -12.6 17.8 10.9 69 76 A V T 3 S+ 0 0 70 1,-0.3 26,-0.2 -2,-0.2 -1,-0.2 -0.307 125.8 26.6 -53.0 132.4 -10.2 18.4 8.1 70 77 A D T 3 S+ 0 0 85 24,-2.8 -1,-0.3 1,-0.2 25,-0.2 0.544 90.3 135.5 80.7 13.3 -8.2 21.7 8.8 71 78 A G < - 0 0 16 -3,-1.9 25,-2.2 23,-0.2 2,-0.4 -0.218 49.0-122.8 -72.3 176.0 -8.7 21.3 12.6 72 79 A R E +n 96 0C 46 23,-0.2 47,-2.5 45,-0.2 48,-0.7 -0.984 29.1 170.1-134.2 134.2 -5.7 22.0 14.9 73 80 A I E -no 97 120C 1 23,-2.4 25,-2.2 -2,-0.4 2,-0.3 -0.918 15.0-156.4-128.4 161.9 -3.9 20.0 17.6 74 81 A A E -no 98 121C 0 46,-2.3 48,-2.9 -2,-0.3 2,-0.4 -0.928 8.2-146.4-133.8 165.0 -0.7 20.8 19.4 75 82 A L E -no 99 122C 0 23,-1.9 25,-1.6 -2,-0.3 2,-0.3 -0.955 6.9-174.0-122.4 146.3 2.1 19.1 21.2 76 83 A C E +no 100 123C 0 46,-2.3 48,-1.9 -2,-0.4 2,-0.3 -0.842 40.5 122.8-138.0 98.4 4.1 20.5 24.1 77 84 A S - 0 0 0 23,-2.0 159,-0.2 -2,-0.3 3,-0.1 -0.989 56.9-126.7-159.6 142.2 6.9 18.1 24.9 78 85 A E S S- 0 0 44 -2,-0.3 2,-0.2 23,-0.2 5,-0.1 -0.302 70.6 -59.0 -68.4 171.0 10.6 17.6 25.2 79 86 A N S S+ 0 0 16 179,-0.1 2,-0.3 -2,-0.1 -1,-0.2 -0.407 74.1 153.2 -56.4 122.0 12.0 14.8 23.1 80 87 A C > - 0 0 7 -2,-0.2 3,-1.8 -3,-0.1 4,-0.2 -0.966 56.6-107.9-144.3 161.6 10.4 11.5 24.0 81 88 A E T 3 S+ 0 0 19 -2,-0.3 3,-0.4 1,-0.3 4,-0.1 0.700 117.0 56.1 -63.1 -19.1 9.8 8.3 21.9 82 89 A E T > S+ 0 0 16 1,-0.2 3,-1.7 2,-0.1 -1,-0.3 0.542 76.8 104.0 -87.8 -8.1 6.0 9.0 21.7 83 90 A F T <> S+ 0 0 0 -3,-1.8 4,-0.7 1,-0.3 -1,-0.2 0.768 77.5 48.2 -44.1 -41.9 6.5 12.5 20.2 84 91 A F H 3> S+ 0 0 0 -3,-0.4 4,-3.5 -4,-0.2 5,-0.3 0.594 86.9 83.8 -87.0 -8.9 5.6 11.5 16.6 85 92 A I H <> S+ 0 0 0 -3,-1.7 4,-2.5 1,-0.2 5,-0.2 0.963 98.5 39.5 -59.3 -52.5 2.3 9.6 17.3 86 93 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.874 116.8 53.1 -60.8 -37.6 0.2 12.9 17.4 87 94 A V H X S+ 0 0 0 -4,-0.7 4,-1.9 2,-0.2 -2,-0.2 0.947 112.8 41.7 -61.5 -50.3 2.2 14.3 14.4 88 95 A I H X S+ 0 0 0 -4,-3.5 4,-1.9 1,-0.2 -1,-0.2 0.917 114.6 50.8 -66.7 -43.7 1.7 11.2 12.2 89 96 A A H X S+ 0 0 0 -4,-2.5 4,-1.3 -5,-0.3 -1,-0.2 0.905 108.6 52.3 -59.5 -44.5 -2.0 10.8 13.2 90 97 A G H >X>S+ 0 0 0 -4,-2.3 5,-2.1 1,-0.2 4,-1.0 0.910 110.3 49.0 -57.3 -43.5 -2.6 14.5 12.4 91 98 A L H 3<5S+ 0 0 1 -4,-1.9 -72,-0.6 1,-0.2 -1,-0.2 0.811 107.1 56.4 -65.9 -34.1 -1.0 14.0 9.0 92 99 A F H 3<5S+ 0 0 0 -4,-1.9 87,-2.6 1,-0.2 -1,-0.2 0.751 116.6 33.8 -67.1 -28.4 -3.2 10.9 8.4 93 100 A I H <<5S- 0 0 4 -4,-1.3 -2,-0.2 -3,-0.5 -1,-0.2 0.443 110.6-108.5-113.6 -0.8 -6.4 12.9 8.9 94 101 A G T <5 + 0 0 1 -4,-1.0 -24,-2.8 1,-0.3 2,-0.5 0.784 69.8 139.7 79.4 27.3 -5.6 16.3 7.5 95 102 A V < - 0 0 1 -5,-2.1 -1,-0.3 -26,-0.2 -23,-0.2 -0.891 55.3-116.2-101.6 130.0 -5.5 18.1 10.8 96 103 A G E -n 72 0C 0 -25,-2.2 -23,-2.4 -2,-0.5 2,-0.4 -0.437 26.8-150.0 -65.0 136.7 -2.7 20.7 11.3 97 104 A V E -np 73 189C 0 91,-2.4 93,-2.8 -25,-0.2 -23,-0.2 -0.935 8.1-163.5-113.2 129.8 -0.2 20.0 14.0 98 105 A A E -n 74 0C 4 -25,-2.2 -23,-1.9 -2,-0.4 2,-0.3 -0.869 11.6-159.2-113.3 100.2 1.7 22.7 16.1 99 106 A P E +n 75 0C 0 0, 0.0 2,-0.3 0, 0.0 93,-0.3 -0.614 16.7 168.5 -78.2 132.1 4.7 21.3 17.8 100 107 A T E -n 76 0C 0 -25,-1.6 -23,-2.0 -2,-0.3 2,-0.4 -0.925 28.0-120.6-129.8 164.5 6.1 23.2 20.8 101 108 A N > - 0 0 11 -2,-0.3 3,-1.8 -25,-0.2 -23,-0.2 -0.823 15.6-126.5-105.6 144.7 8.8 22.2 23.4 102 109 A E T 3 S+ 0 0 35 -2,-0.4 -24,-0.1 1,-0.3 -1,-0.1 0.756 106.5 69.3 -48.5 -32.5 8.4 22.0 27.2 103 110 A I T 3 S+ 0 0 95 -26,-0.1 -1,-0.3 2,-0.0 -25,-0.0 0.522 72.6 114.6 -76.6 -4.4 11.5 24.3 27.5 104 111 A Y S < S- 0 0 21 -3,-1.8 2,-0.1 1,-0.1 -4,-0.0 -0.328 74.4-115.6 -56.4 144.4 9.5 27.3 26.2 105 112 A T > - 0 0 76 1,-0.1 4,-2.1 4,-0.0 5,-0.2 -0.488 31.1-108.6 -69.8 157.8 9.0 30.1 28.7 106 113 A L H > S+ 0 0 72 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.835 120.3 57.1 -57.7 -34.2 5.3 30.5 29.5 107 114 A R H > S+ 0 0 147 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.933 108.1 46.2 -64.7 -44.3 5.2 33.8 27.6 108 115 A E H > S+ 0 0 78 1,-0.2 4,-3.1 2,-0.2 -2,-0.2 0.888 113.8 49.4 -63.3 -39.2 6.4 32.0 24.5 109 116 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.3 0.868 108.8 50.0 -71.5 -41.3 3.9 29.2 24.9 110 117 A V H X S+ 0 0 42 -4,-2.6 4,-1.4 2,-0.2 -1,-0.2 0.918 117.4 42.7 -62.2 -41.7 0.9 31.5 25.5 111 118 A H H X S+ 0 0 68 -4,-1.9 4,-1.2 -5,-0.2 -2,-0.2 0.940 115.3 47.9 -72.1 -46.5 1.9 33.4 22.3 112 119 A S H >X S+ 0 0 4 -4,-3.1 4,-1.7 1,-0.2 3,-0.7 0.945 119.0 38.3 -59.8 -51.0 2.7 30.3 20.2 113 120 A L H 3X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.765 108.7 65.1 -74.1 -24.5 -0.5 28.4 21.1 114 121 A G H 3< S+ 0 0 24 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.793 107.1 43.4 -58.4 -31.4 -2.4 31.7 21.0 115 122 A I H << S+ 0 0 43 -4,-1.2 -2,-0.2 -3,-0.7 -1,-0.2 0.901 118.4 39.7 -84.5 -43.4 -1.6 31.7 17.3 116 123 A S H < S- 0 0 9 -4,-1.7 -2,-0.2 -5,-0.1 -3,-0.2 0.786 87.7-153.6 -82.8 -28.4 -2.2 28.1 16.3 117 124 A K < - 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0 0 79 -8,-2.1 4,-1.8 1,-0.2 3,-0.2 -0.731 26.7-177.6 -84.1 85.0 21.4 35.2 21.6 524 534 A G H > S+ 0 0 17 -2,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.809 79.0 56.2 -51.8 -34.2 23.2 38.4 20.6 525 535 A R H > S+ 0 0 66 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.910 106.6 48.7 -69.6 -41.4 20.7 40.5 22.7 526 536 A A H > S+ 0 0 29 -3,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.882 112.9 48.5 -61.5 -40.6 21.5 38.5 25.8 527 537 A I H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.855 105.8 56.6 -70.7 -38.8 25.3 38.9 25.3 528 538 A R H X S+ 0 0 79 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.921 110.5 45.8 -54.4 -46.2 25.1 42.7 24.6 529 539 A E H < S+ 0 0 71 -4,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.902 110.3 51.5 -69.6 -44.5 23.4 43.1 28.0 530 540 A I H < S+ 0 0 67 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.921 113.6 46.6 -56.0 -44.3 25.9 40.9 29.9 531 541 A L H < 0 0 20 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.792 360.0 360.0 -70.4 -31.9 28.7 42.9 28.4 532 542 A K < 0 0 105 -4,-1.7 -3,-0.2 -5,-0.2 -2,-0.1 0.689 360.0 360.0-107.7 360.0 27.2 46.3 29.1