==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 09-FEB-12 4AIB . COMPND 2 MOLECULE: ORNITHINE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTAMOEBA HISTOLYTICA; . AUTHOR P.PREETI,P.KUMAR,S.TOMAR . 1315 26 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 61807.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 954 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 180 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 121 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 115 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 85 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 384 29.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 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 2 2 0 0 0 7 10 7 0 0 8 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 21 10 5 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 . 3 1 0 3 6 1 6 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 4 4 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 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 5 A S > 0 0 103 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 153.3 21.9 32.1 22.7 2 6 A L H > + 0 0 110 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.853 360.0 55.5 -75.6 -36.7 24.3 32.4 25.6 3 7 A E H > S+ 0 0 124 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.797 109.1 48.3 -65.7 -30.4 21.8 31.1 28.2 4 8 A V H > S+ 0 0 4 2,-0.2 4,-1.7 3,-0.1 -1,-0.2 0.871 112.0 48.8 -75.5 -39.8 21.4 27.9 26.2 5 9 A K H X S+ 0 0 51 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.888 113.0 46.5 -66.7 -42.5 25.2 27.4 25.8 6 10 A E H X S+ 0 0 116 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.842 112.2 50.1 -70.5 -35.9 25.9 27.9 29.5 7 11 A F H X S+ 0 0 41 -4,-1.2 4,-1.1 -5,-0.2 -1,-0.2 0.847 111.3 49.4 -70.7 -36.1 23.1 25.6 30.6 8 12 A A H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 3,-0.3 0.926 111.4 48.5 -66.5 -46.7 24.3 22.9 28.2 9 13 A L H X S+ 0 0 62 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.846 107.7 54.7 -62.4 -38.6 27.9 23.2 29.4 10 14 A N H < S+ 0 0 107 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.810 113.3 43.6 -64.3 -31.6 26.8 23.0 33.1 11 15 A L H >< S+ 0 0 24 -4,-1.1 3,-1.0 -3,-0.3 -2,-0.2 0.823 109.4 55.5 -81.8 -35.2 25.0 19.7 32.2 12 16 A I H >< S+ 0 0 14 -4,-2.3 3,-2.1 1,-0.2 -2,-0.2 0.843 96.2 66.5 -65.2 -35.5 27.9 18.3 30.1 13 17 A S T 3< S+ 0 0 77 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.636 88.1 68.9 -61.8 -16.1 30.3 18.8 33.1 14 18 A Q T < S+ 0 0 128 -3,-1.0 2,-0.4 -4,-0.1 -1,-0.3 0.495 95.5 73.7 -78.9 -4.4 28.3 16.1 34.9 15 19 A F < - 0 0 51 -3,-2.1 -3,-0.0 -4,-0.1 3,-0.0 -0.879 56.2-166.4-121.4 144.2 29.6 13.5 32.5 16 20 A E >> - 0 0 100 -2,-0.4 4,-1.7 1,-0.0 3,-0.9 -0.753 45.9 -98.9-109.9 165.0 32.8 11.6 31.7 17 21 A P T 34 S+ 0 0 37 0, 0.0 429,-0.4 0, 0.0 428,-0.2 0.836 122.1 56.3 -50.7 -35.9 33.5 9.6 28.5 18 22 A E T 34 S+ 0 0 88 1,-0.2 431,-0.1 427,-0.1 -3,-0.0 0.807 119.5 26.4 -68.0 -33.5 32.6 6.4 30.3 19 23 A N T <4 S+ 0 0 82 -3,-0.9 -1,-0.2 426,-0.1 -4,-0.0 0.463 86.2 125.9-113.0 -5.0 29.1 7.5 31.4 20 24 A Q < - 0 0 4 -4,-1.7 426,-0.3 300,-0.1 425,-0.1 -0.335 51.6-135.6 -64.4 131.7 28.0 10.1 28.8 21 25 A P - 0 0 39 0, 0.0 236,-0.1 0, 0.0 256,-0.1 -0.221 29.5 -97.6 -78.6 174.6 24.7 9.4 27.1 22 26 A L S S- 0 0 65 1,-0.2 235,-2.0 234,-0.1 255,-0.4 0.812 89.2 -59.2 -61.4 -32.3 23.9 9.7 23.4 23 27 A G E -A 256 0A 6 233,-0.3 314,-0.6 253,-0.1 2,-0.3 -0.956 46.7-123.2 169.7 178.2 22.5 13.2 24.0 24 28 A F E -Ab 255 337A 2 231,-1.5 231,-2.4 -2,-0.3 2,-0.3 -0.994 18.2-124.3-147.7 152.6 20.0 15.4 25.8 25 29 A W E -Ab 254 338A 34 312,-2.7 314,-3.2 -2,-0.3 2,-0.5 -0.715 11.5-149.6 -97.4 145.1 17.2 17.9 25.0 26 30 A I E -Ab 253 339A 0 227,-2.2 227,-1.4 -2,-0.3 2,-0.9 -0.967 12.8-144.4-114.1 117.8 16.9 21.4 26.3 27 31 A F E -Ab 252 340A 10 312,-2.5 314,-2.4 -2,-0.5 2,-1.2 -0.714 8.7-157.5 -85.8 104.6 13.3 22.7 26.6 28 32 A D > + 0 0 18 223,-2.7 4,-1.2 -2,-0.9 5,-0.1 -0.696 15.1 176.9 -84.9 93.9 13.3 26.4 25.7 29 33 A T H > S+ 0 0 19 -2,-1.2 4,-2.0 312,-0.3 3,-0.2 0.886 82.2 49.3 -65.8 -41.2 10.1 27.6 27.4 30 34 A E H > S+ 0 0 98 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.806 105.3 59.4 -66.9 -31.9 10.8 31.2 26.4 31 35 A G H > S+ 0 0 12 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.817 107.7 45.2 -65.8 -33.8 11.4 30.1 22.8 32 36 A V H X S+ 0 0 0 -4,-1.2 4,-1.5 -3,-0.2 3,-0.3 0.923 113.9 48.9 -72.0 -47.8 7.8 28.6 22.7 33 37 A E H X S+ 0 0 74 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.868 108.5 52.7 -61.5 -41.7 6.3 31.7 24.3 34 38 A K H X S+ 0 0 140 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.795 108.5 51.6 -66.0 -30.1 8.0 34.2 21.9 35 39 A A H X S+ 0 0 6 -4,-0.8 4,-1.2 -3,-0.3 -1,-0.2 0.825 111.8 46.7 -73.4 -34.4 6.7 32.2 18.9 36 40 A V H X S+ 0 0 3 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.933 113.2 45.7 -74.2 -49.1 3.1 32.3 20.2 37 41 A E H X S+ 0 0 127 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.725 111.1 55.7 -68.5 -22.1 3.1 36.1 21.1 38 42 A R H X S+ 0 0 90 -4,-0.9 4,-1.6 -5,-0.2 -1,-0.2 0.849 110.7 44.9 -72.2 -38.5 4.7 36.7 17.7 39 43 A W H X S+ 0 0 0 -4,-1.2 4,-3.0 2,-0.2 -2,-0.2 0.913 111.9 50.3 -70.0 -46.7 1.8 34.9 16.0 40 44 A K H < S+ 0 0 97 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.752 112.0 49.8 -64.5 -26.7 -0.9 36.5 18.1 41 45 A K H < S+ 0 0 156 -4,-0.9 -1,-0.2 -5,-0.2 -2,-0.2 0.875 119.8 33.1 -79.1 -42.0 0.6 40.0 17.3 42 46 A N H < S+ 0 0 31 -4,-1.6 -2,-0.2 1,-0.2 -3,-0.2 0.791 128.5 35.3 -88.7 -31.7 0.9 39.5 13.5 43 47 A M < + 0 0 2 -4,-3.0 3,-0.2 -5,-0.2 -1,-0.2 -0.737 65.1 158.3-122.6 81.5 -2.2 37.3 12.9 44 48 A P S S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.823 75.3 47.5 -72.9 -32.5 -4.9 38.5 15.4 45 49 A T S S+ 0 0 68 1,-0.1 194,-0.8 193,-0.0 2,-0.6 0.563 101.0 72.9 -88.3 -9.9 -7.9 37.1 13.5 46 50 A V E S-e 239 0B 2 -3,-0.2 194,-0.2 -7,-0.2 -1,-0.1 -0.916 71.2-152.0-111.7 111.0 -6.4 33.6 12.9 47 51 A R E -e 240 0B 94 192,-2.4 194,-1.8 -2,-0.6 2,-0.4 -0.673 19.9-125.7 -81.3 127.4 -6.2 31.3 16.0 48 52 A P E -e 241 0B 1 0, 0.0 22,-2.6 0, 0.0 2,-0.6 -0.588 19.1-166.0 -79.0 128.2 -3.3 28.8 15.8 49 53 A C E -f 70 0B 6 192,-2.3 22,-0.3 -2,-0.4 2,-0.1 -0.940 24.4-131.1-112.3 107.5 -4.1 25.1 16.2 50 54 A F E -f 71 0B 1 20,-1.6 22,-3.1 -2,-0.6 2,-1.0 -0.341 11.3-125.6 -65.2 128.8 -0.9 23.2 16.9 51 55 A A E >> -f 72 0B 12 192,-0.7 3,-1.4 20,-0.2 4,-0.8 -0.654 19.4-164.3 -72.9 101.8 -0.3 20.1 14.8 52 56 A V T 34 S+ 0 0 0 20,-1.9 -1,-0.2 -2,-1.0 21,-0.1 0.774 84.2 69.3 -59.6 -28.0 0.3 17.5 17.6 53 57 A K T 34 S+ 0 0 68 19,-0.6 -1,-0.3 1,-0.2 20,-0.1 0.812 91.5 59.0 -60.0 -34.3 1.8 15.2 14.9 54 58 A C T <4 S- 0 0 3 -3,-1.4 278,-0.8 1,-0.3 280,-0.4 0.929 132.8 -7.9 -63.4 -48.5 4.8 17.5 14.5 55 59 A N < - 0 0 3 -4,-0.8 -1,-0.3 276,-0.1 -2,-0.1 -0.731 60.4-177.9-153.7 101.2 5.9 17.2 18.1 56 60 A P + 0 0 45 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 0.089 30.3 146.6 -89.4 23.8 3.6 15.3 20.6 57 61 A E >> - 0 0 18 1,-0.1 4,-2.3 -5,-0.1 3,-0.7 -0.478 52.3-131.7 -63.7 120.6 5.9 16.0 23.7 58 62 A P H 3> S+ 0 0 68 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.766 102.4 50.5 -43.4 -42.1 3.5 16.3 26.7 59 63 A H H 3> S+ 0 0 77 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.891 112.9 43.9 -69.4 -42.4 5.2 19.5 28.0 60 64 A L H <> S+ 0 0 0 -3,-0.7 4,-2.5 2,-0.2 5,-0.2 0.897 114.6 48.9 -68.6 -43.5 5.1 21.4 24.7 61 65 A V H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.874 114.7 46.9 -63.3 -39.2 1.5 20.3 23.9 62 66 A K H X S+ 0 0 50 -4,-1.9 4,-1.9 -5,-0.3 -2,-0.2 0.922 113.0 47.8 -66.3 -47.7 0.5 21.4 27.5 63 67 A L H X S+ 0 0 23 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.883 111.8 49.0 -64.5 -42.5 2.4 24.8 27.2 64 68 A L H <>S+ 0 0 0 -4,-2.5 5,-2.1 2,-0.2 3,-0.3 0.903 111.9 48.7 -64.1 -43.9 0.9 25.7 23.8 65 69 A G H ><5S+ 0 0 12 -4,-1.6 3,-1.3 1,-0.2 -2,-0.2 0.836 108.1 53.8 -65.6 -36.3 -2.6 24.9 24.9 66 70 A E H 3<5S+ 0 0 102 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.741 103.3 58.9 -67.2 -25.6 -2.2 27.0 28.1 67 71 A L T 3<5S- 0 0 53 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.308 130.2 -95.8 -87.0 7.1 -1.1 29.8 25.8 68 72 A G T < 5S+ 0 0 30 -3,-1.3 -3,-0.2 1,-0.3 -2,-0.1 0.440 75.0 146.1 98.1 2.4 -4.5 29.6 24.0 69 73 A C < - 0 0 1 -5,-2.1 -1,-0.3 1,-0.1 -20,-0.2 -0.416 40.8-133.9 -72.5 145.3 -3.6 27.4 21.0 70 74 A G E -f 49 0B 0 -22,-2.6 -20,-1.6 171,-0.1 2,-0.4 -0.121 25.4-108.0 -80.1-172.3 -6.1 25.0 19.6 71 75 A F E -fg 50 92B 1 20,-2.4 22,-2.7 -22,-0.3 2,-0.7 -0.981 17.6-162.8-135.0 127.9 -5.2 21.4 18.7 72 76 A D E -fg 51 93B 12 -22,-3.1 -20,-1.9 -2,-0.4 -19,-0.6 -0.905 19.5-174.4-108.1 106.3 -4.7 19.6 15.3 73 77 A C E - g 0 94B 0 20,-1.8 22,-1.0 -2,-0.7 -22,-0.1 -0.891 20.3-179.3-112.9 128.8 -4.9 15.8 15.8 74 78 A A S S+ 0 0 9 -2,-0.5 2,-0.2 20,-0.2 -1,-0.1 0.796 72.1 27.9 -91.0 -35.4 -4.3 13.3 13.0 75 79 A S S > S- 0 0 37 1,-0.1 4,-1.4 24,-0.1 20,-0.1 -0.695 82.9-106.9-121.5 173.8 -4.9 10.1 15.0 76 80 A L H > S+ 0 0 23 -2,-0.2 4,-2.9 2,-0.2 5,-0.2 0.828 118.8 58.7 -68.0 -34.7 -6.9 8.9 18.0 77 81 A N H > S+ 0 0 125 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.872 106.5 47.2 -62.1 -39.2 -3.8 8.8 20.1 78 82 A E H > S+ 0 0 22 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.837 112.0 51.4 -68.8 -36.2 -3.1 12.5 19.4 79 83 A I H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.934 112.0 45.9 -62.4 -48.7 -6.8 13.1 20.3 80 84 A K H X S+ 0 0 92 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.844 107.4 57.7 -66.2 -36.2 -6.5 11.2 23.6 81 85 A E H X S+ 0 0 46 -4,-1.9 4,-0.8 2,-0.2 -1,-0.2 0.896 109.5 44.5 -61.2 -43.0 -3.2 12.9 24.5 82 86 A V H ><>S+ 0 0 0 -4,-1.4 5,-1.4 1,-0.2 3,-0.6 0.921 113.9 49.2 -67.1 -45.9 -4.8 16.4 24.3 83 87 A L H ><5S+ 0 0 24 -4,-2.0 3,-1.1 1,-0.2 -2,-0.2 0.810 106.4 56.7 -64.6 -33.2 -7.9 15.3 26.3 84 88 A D H 3<5S+ 0 0 74 -4,-2.1 922,-3.1 1,-0.2 -1,-0.2 0.748 98.7 61.1 -69.9 -25.2 -5.7 13.7 29.0 85 89 A L B <<5S-m 1006 0C 29 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.481 123.5-104.6 -80.6 -3.4 -4.0 17.0 29.6 86 90 A G T < 5S+ 0 0 25 -3,-1.1 2,-0.2 920,-0.6 -3,-0.2 0.435 71.7 144.3 98.2 1.9 -7.4 18.5 30.5 87 91 A F < - 0 0 29 -5,-1.4 -1,-0.3 919,-0.1 921,-0.1 -0.502 55.0-105.7 -77.5 142.3 -8.1 20.5 27.3 88 92 A N > - 0 0 72 -2,-0.2 3,-1.7 1,-0.1 4,-0.4 -0.437 19.1-128.4 -71.3 136.3 -11.6 20.7 26.1 89 93 A P G > S+ 0 0 22 0, 0.0 3,-0.6 0, 0.0 24,-0.5 0.624 103.8 70.3 -59.9 -16.5 -12.6 18.6 23.0 90 94 A E G 3 S+ 0 0 97 1,-0.2 -20,-0.0 22,-0.1 21,-0.0 0.788 93.2 55.7 -70.7 -29.6 -14.0 21.7 21.3 91 95 A D G < S+ 0 0 53 -3,-1.7 -20,-2.4 -21,-0.1 2,-0.3 0.619 95.7 88.8 -75.2 -14.1 -10.5 23.1 20.8 92 96 A I E < -g 71 0B 1 -3,-0.6 2,-0.5 -4,-0.4 21,-0.4 -0.655 58.1-165.3 -90.0 138.9 -9.5 19.9 19.0 93 97 A T E -g 72 0B 5 -22,-2.7 2,-2.0 -2,-0.3 -20,-1.8 -0.969 19.0-139.1-123.5 116.2 -9.9 19.4 15.2 94 98 A Y E -gh 73 115B 0 20,-3.2 2,-1.8 -2,-0.5 22,-1.1 -0.503 24.2-172.1 -74.3 82.4 -9.7 15.8 14.0 95 99 A S + 0 0 11 -2,-2.0 2,-0.4 -22,-1.0 -1,-0.1 -0.550 35.3 123.6 -82.9 78.1 -7.6 16.5 10.9 96 100 A Q - 0 0 35 -2,-1.8 20,-0.3 20,-0.2 3,-0.3 -0.938 44.6-162.1-140.1 116.0 -7.6 13.2 9.1 97 101 A T S S+ 0 0 4 -2,-0.4 2,-0.5 1,-0.3 21,-0.5 0.866 90.2 31.9 -64.3 -39.7 -8.9 12.9 5.5 98 102 A F S S- 0 0 11 19,-0.1 -1,-0.3 497,-0.1 497,-0.1 -0.900 81.9-169.5-125.4 102.9 -9.3 9.1 5.8 99 103 A K - 0 0 0 -2,-0.5 2,-0.1 -3,-0.3 -24,-0.1 -0.693 25.0-116.1 -96.6 138.5 -10.2 7.9 9.3 100 104 A P > - 0 0 7 0, 0.0 4,-2.2 0, 0.0 5,-0.2 -0.480 28.0-124.6 -64.8 143.2 -10.3 4.3 10.6 101 105 A Y H > S+ 0 0 12 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.904 108.3 50.3 -59.7 -47.0 -13.9 3.3 11.6 102 106 A N H > S+ 0 0 48 259,-0.4 4,-1.9 262,-0.3 -1,-0.2 0.849 113.0 46.9 -60.0 -37.7 -13.0 2.3 15.2 103 107 A Q H > S+ 0 0 30 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.860 110.0 52.4 -73.4 -38.1 -11.1 5.6 15.8 104 108 A L H X S+ 0 0 0 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.881 111.4 47.0 -65.1 -40.8 -14.0 7.8 14.3 105 109 A I H X S+ 0 0 35 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.934 112.9 49.0 -64.6 -47.7 -16.5 6.1 16.6 106 110 A E H X S+ 0 0 73 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.852 107.2 55.6 -61.8 -38.0 -14.3 6.5 19.7 107 111 A A H X>S+ 0 0 0 -4,-2.2 5,-2.9 1,-0.2 4,-1.0 0.870 105.7 51.9 -62.6 -39.2 -13.7 10.2 18.8 108 112 A S H <5S+ 0 0 47 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.864 111.3 47.2 -64.3 -38.2 -17.4 10.8 18.8 109 113 A H H <5S+ 0 0 135 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.777 108.9 54.5 -73.4 -29.5 -17.7 9.2 22.3 110 114 A L H <5S- 0 0 51 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.677 125.3-102.2 -77.7 -19.1 -14.7 11.2 23.5 111 115 A G T <5 + 0 0 31 -4,-1.0 2,-0.2 1,-0.3 -3,-0.2 0.520 64.7 155.8 111.6 10.6 -16.5 14.4 22.5 112 116 A I < + 0 0 4 -5,-2.9 -1,-0.3 -6,-0.1 -22,-0.1 -0.518 9.3 169.4 -71.7 132.8 -14.8 15.3 19.2 113 117 A N + 0 0 57 -24,-0.5 21,-2.8 -21,-0.4 2,-0.4 0.366 51.2 70.3-127.8 -2.1 -17.0 17.5 17.0 114 118 A H E + i 0 134B 14 -22,-0.3 -20,-3.2 19,-0.2 2,-0.3 -0.979 52.1 149.1-131.1 125.1 -14.7 18.7 14.2 115 119 A T E -hi 94 135B 0 19,-2.2 21,-1.8 -2,-0.4 2,-0.3 -0.899 33.9-117.6-145.1 171.9 -13.2 16.8 11.3 116 120 A I E - 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