==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL TRANSPORT 26-APR-12 4EVC . COMPND 2 MOLECULE: NEUTROPHIL-ACTIVATING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HELICOBACTER PYLORI; . AUTHOR H.YOKOYAMA,O.TSURUTA,N.AKAO,S.FUJII . 143 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8138.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 82.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 3 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.4 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 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 2 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 2 A K > 0 0 129 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 129.7 33.5 25.8 8.5 2 3 A T H > + 0 0 1 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.873 360.0 58.8 -61.4 -41.0 34.3 27.3 11.9 3 4 A F H > S+ 0 0 27 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.891 103.0 52.7 -56.7 -42.2 37.8 28.1 10.8 4 5 A E H > S+ 0 0 99 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.892 110.8 46.1 -63.6 -41.3 36.5 30.3 8.0 5 6 A I H X S+ 0 0 19 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.900 113.7 49.1 -68.5 -41.7 34.3 32.3 10.3 6 7 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.919 108.7 52.2 -62.2 -46.2 37.1 32.8 12.9 7 8 A K H X S+ 0 0 35 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.843 112.3 45.9 -63.0 -36.7 39.6 33.9 10.2 8 9 A H H X S+ 0 0 38 -4,-1.5 4,-1.9 -5,-0.2 68,-0.3 0.848 112.7 50.2 -72.9 -36.0 37.2 36.6 8.9 9 10 A L H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.862 106.2 56.3 -67.7 -36.5 36.4 37.7 12.5 10 11 A Q H X S+ 0 0 2 -4,-2.7 4,-1.3 2,-0.2 -1,-0.2 0.859 107.3 49.9 -60.8 -36.6 40.1 37.9 13.2 11 12 A A H X S+ 0 0 0 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.922 109.9 49.4 -68.6 -46.1 40.4 40.3 10.3 12 13 A D H X S+ 0 0 0 -4,-1.9 4,-2.9 1,-0.2 5,-0.2 0.877 105.9 58.3 -58.2 -41.4 37.5 42.5 11.5 13 14 A A H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.880 110.6 40.3 -61.9 -42.1 39.0 42.7 15.0 14 15 A I H X S+ 0 0 29 -4,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.894 114.9 52.3 -74.3 -40.4 42.3 44.3 13.9 15 16 A V H X S+ 0 0 6 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.888 113.5 45.0 -58.7 -40.8 40.6 46.5 11.3 16 17 A L H X S+ 0 0 3 -4,-2.9 4,-2.9 2,-0.2 5,-0.3 0.839 104.2 62.2 -73.9 -35.4 38.3 47.7 14.1 17 18 A F H X S+ 0 0 62 -4,-1.9 4,-1.1 -5,-0.2 -2,-0.2 0.942 111.2 40.8 -47.9 -50.0 41.2 48.1 16.5 18 19 A M H X S+ 0 0 82 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.917 113.8 51.7 -65.0 -48.5 42.5 50.7 13.9 19 20 A K H X S+ 0 0 15 -4,-2.1 4,-1.9 1,-0.2 3,-0.2 0.906 107.4 51.8 -58.4 -46.0 39.1 52.3 13.3 20 21 A V H X S+ 0 0 3 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.813 104.6 57.5 -66.1 -30.5 38.3 52.9 17.0 21 22 A H H X S+ 0 0 25 -4,-1.1 4,-2.6 -5,-0.3 5,-0.3 0.891 103.2 54.6 -61.6 -41.8 41.7 54.6 17.4 22 23 A N H X S+ 0 0 14 -4,-1.6 4,-2.7 2,-0.2 3,-0.2 0.974 111.1 43.4 -54.2 -55.0 40.5 57.0 14.7 23 24 A F H X S+ 0 0 0 -4,-1.9 4,-0.9 1,-0.2 -2,-0.2 0.887 112.3 56.1 -55.2 -41.8 37.4 57.8 16.7 24 25 A H H < S+ 0 0 11 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.872 116.1 33.9 -58.6 -44.6 39.6 57.9 19.9 25 26 A W H < S+ 0 0 137 -4,-2.6 -2,-0.2 -3,-0.2 -1,-0.2 0.837 122.4 44.7 -79.7 -34.6 42.0 60.6 18.4 26 27 A N H < S+ 0 0 35 -4,-2.7 59,-1.7 -5,-0.3 -2,-0.2 0.219 71.9 127.0-109.9 14.3 39.4 62.6 16.3 27 28 A V E < -a 85 0A 1 -4,-0.9 2,-0.3 -3,-0.2 59,-0.2 -0.483 40.1-160.9 -67.7 138.7 36.3 63.1 18.5 28 29 A K E +a 86 0A 91 57,-3.0 59,-0.6 -2,-0.2 3,-0.2 -0.899 39.3 61.1-120.0 152.7 35.2 66.7 18.8 29 30 A G S > S- 0 0 41 -2,-0.3 3,-2.3 57,-0.1 -2,-0.0 -0.290 94.8 -69.9 116.4 160.3 32.9 68.3 21.4 30 31 A T T 3 S+ 0 0 163 1,-0.3 3,-0.4 2,-0.1 -1,-0.1 0.672 126.3 71.9 -56.2 -17.5 32.6 69.0 25.1 31 32 A D T 3> + 0 0 61 1,-0.2 4,-1.8 -3,-0.2 5,-0.3 0.322 63.8 115.7 -71.3 -3.7 32.1 65.2 25.1 32 33 A F H <> S+ 0 0 73 -3,-2.3 4,-3.0 1,-0.2 5,-0.2 0.846 72.1 45.7 -45.7 -54.8 35.8 64.6 24.3 33 34 A F H > S+ 0 0 167 -3,-0.4 4,-3.1 1,-0.2 5,-0.3 0.886 110.5 51.5 -62.4 -45.4 36.9 62.8 27.5 34 35 A N H > S+ 0 0 91 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.937 117.9 38.5 -55.8 -50.6 33.9 60.4 27.7 35 36 A V H X S+ 0 0 0 -4,-1.8 4,-3.0 2,-0.2 5,-0.3 0.899 115.6 52.9 -66.5 -43.2 34.3 59.2 24.1 36 37 A H H X S+ 0 0 50 -4,-3.0 4,-1.2 -5,-0.3 -2,-0.2 0.905 114.2 42.7 -60.5 -44.6 38.1 59.3 24.4 37 38 A K H X S+ 0 0 126 -4,-3.1 4,-1.6 -5,-0.2 -2,-0.2 0.924 116.5 47.7 -66.1 -46.8 38.0 57.1 27.5 38 39 A A H X S+ 0 0 31 -4,-2.5 4,-2.1 -5,-0.3 -2,-0.2 0.865 110.2 50.7 -65.3 -39.8 35.3 54.7 26.1 39 40 A T H X S+ 0 0 2 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.827 106.2 57.3 -69.2 -31.5 37.0 54.2 22.7 40 41 A E H X S+ 0 0 65 -4,-1.2 4,-1.9 -5,-0.3 -2,-0.2 0.931 108.2 45.8 -60.3 -48.5 40.2 53.4 24.5 41 42 A E H X S+ 0 0 92 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.898 113.2 51.6 -60.8 -42.4 38.4 50.5 26.4 42 43 A I H X S+ 0 0 33 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.920 109.3 47.1 -63.1 -48.0 36.8 49.4 23.1 43 44 A Y H X S+ 0 0 38 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.845 110.7 52.6 -67.6 -31.3 40.1 49.2 21.1 44 45 A E H X S+ 0 0 86 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.881 106.9 55.1 -65.0 -37.3 41.7 47.3 23.9 45 46 A G H X S+ 0 0 37 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.868 108.7 46.8 -59.6 -39.4 38.7 45.0 23.7 46 47 A F H X S+ 0 0 6 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.839 107.4 54.1 -76.4 -34.5 39.5 44.4 20.0 47 48 A A H X S+ 0 0 41 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.902 112.6 48.4 -57.9 -40.2 43.2 43.8 20.5 48 49 A D H X S+ 0 0 97 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.925 112.6 44.4 -63.4 -50.8 41.9 41.2 23.0 49 50 A M H X S+ 0 0 10 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.869 110.4 57.4 -64.9 -37.4 39.4 39.6 20.6 50 51 A F H X S+ 0 0 56 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.951 111.1 41.3 -55.0 -55.5 42.1 39.7 17.8 51 52 A D H X S+ 0 0 77 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.899 114.9 50.8 -60.9 -46.4 44.5 37.6 19.9 52 53 A D H X S+ 0 0 61 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.890 110.8 48.0 -63.3 -43.1 41.9 35.2 21.2 53 54 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.913 112.0 51.0 -61.9 -43.9 40.5 34.5 17.7 54 55 A A H X S+ 0 0 14 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.890 111.9 45.7 -61.1 -42.7 44.0 33.9 16.4 55 56 A E H X S+ 0 0 94 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.844 110.4 53.5 -74.3 -33.0 44.8 31.5 19.2 56 57 A R H X S+ 0 0 30 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.922 109.0 50.0 -62.9 -44.1 41.5 29.6 18.8 57 58 A I H ><>S+ 0 0 0 -4,-2.4 5,-1.8 2,-0.2 3,-0.6 0.954 111.9 47.9 -55.8 -51.9 42.4 29.2 15.1 58 59 A A H ><5S+ 0 0 53 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.871 108.1 54.7 -56.3 -41.1 45.8 27.9 16.1 59 60 A Q H 3<5S+ 0 0 123 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.804 102.8 58.0 -62.6 -29.0 44.1 25.5 18.6 60 61 A L T <<5S- 0 0 55 -4,-1.5 -1,-0.3 -3,-0.6 -2,-0.2 0.461 124.5-104.6 -81.9 -1.6 42.0 24.2 15.8 61 62 A G T < 5S+ 0 0 68 -3,-1.5 -3,-0.2 1,-0.3 2,-0.2 0.496 85.4 107.9 94.6 6.5 45.2 23.2 13.9 62 63 A H S S- 0 0 65 1,-0.1 4,-2.1 0, 0.0 5,-0.1 -0.986 70.5-133.2-138.0 147.5 49.7 40.3 8.2 68 69 A L H > S+ 0 0 126 -2,-0.3 4,-2.7 2,-0.2 5,-0.2 0.770 111.7 62.8 -63.1 -27.5 47.7 43.5 7.9 69 70 A S H > S+ 0 0 95 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.927 105.0 43.3 -62.1 -48.6 47.6 42.6 4.1 70 71 A E H > S+ 0 0 55 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.905 111.8 56.2 -60.9 -42.3 45.6 39.4 4.9 71 72 A A H X S+ 0 0 3 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.938 108.7 45.3 -54.9 -52.0 43.5 41.5 7.3 72 73 A L H < S+ 0 0 94 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.843 113.8 50.6 -59.2 -37.7 42.5 44.0 4.6 73 74 A K H < S+ 0 0 174 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.900 118.9 35.2 -69.3 -40.7 41.8 41.1 2.2 74 75 A L H < S+ 0 0 28 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.596 92.7 108.6 -95.4 -12.0 39.6 39.2 4.5 75 76 A T < - 0 0 26 -4,-1.9 -66,-0.1 -5,-0.2 -67,-0.1 -0.286 46.4-165.7 -71.3 151.7 37.8 42.0 6.4 76 77 A R + 0 0 125 -68,-0.3 2,-0.5 2,-0.1 -1,-0.1 0.293 64.9 99.3-109.8 1.1 34.1 42.9 6.0 77 78 A V S S- 0 0 4 23,-0.0 2,-0.4 -5,-0.0 -2,-0.1 -0.806 71.0-136.3 -93.5 125.7 34.6 46.2 7.8 78 79 A K - 0 0 155 -2,-0.5 2,-0.2 1,-0.1 -2,-0.1 -0.680 27.0-118.5 -78.3 133.1 35.0 49.3 5.6 79 80 A E - 0 0 69 -2,-0.4 2,-0.6 1,-0.1 -63,-0.1 -0.463 21.5-121.8 -74.9 144.0 37.8 51.5 6.9 80 81 A E + 0 0 45 -2,-0.2 -1,-0.1 1,-0.1 -58,-0.0 -0.790 28.2 177.5 -93.7 119.8 37.0 55.1 8.1 81 82 A T + 0 0 129 -2,-0.6 -1,-0.1 -59,-0.0 2,-0.1 0.561 50.4 101.7 -98.7 -13.6 38.9 57.8 6.2 82 83 A K - 0 0 143 1,-0.1 -56,-0.1 2,-0.0 3,-0.1 -0.395 53.4-162.9 -67.6 151.3 37.2 60.8 7.9 83 84 A T + 0 0 97 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 -0.003 65.2 60.5-129.5 28.6 39.3 62.4 10.6 84 85 A S + 0 0 69 2,-0.0 2,-0.3 -56,-0.0 -57,-0.2 -0.937 56.8 157.9-160.0 128.5 36.7 64.5 12.6 85 86 A F E -a 27 0A 6 -59,-1.7 -57,-3.0 -2,-0.3 2,-0.3 -0.993 31.4-134.2-150.6 152.7 33.5 63.4 14.4 86 87 A H E >> -a 28 0A 99 -2,-0.3 4,-1.8 -59,-0.2 3,-0.8 -0.695 45.3 -98.5 -98.5 164.1 31.1 64.3 17.1 87 88 A S H 3> S+ 0 0 21 -59,-0.6 4,-2.6 -2,-0.3 5,-0.2 0.889 122.6 56.5 -48.1 -47.2 30.0 61.8 19.8 88 89 A K H 3> S+ 0 0 130 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.847 106.8 49.3 -52.9 -42.2 26.8 60.9 17.9 89 90 A D H <> S+ 0 0 72 -3,-0.8 4,-2.3 2,-0.2 -1,-0.2 0.916 111.3 48.7 -65.6 -46.2 28.7 60.0 14.7 90 91 A I H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 5,-0.2 0.925 111.2 49.1 -61.5 -47.7 31.1 57.7 16.6 91 92 A F H X S+ 0 0 19 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.859 110.9 51.3 -62.3 -35.8 28.4 55.9 18.4 92 93 A K H X S+ 0 0 91 -4,-1.7 4,-2.1 -5,-0.2 -2,-0.2 0.931 111.8 46.4 -65.4 -46.8 26.5 55.4 15.2 93 94 A E H X S+ 0 0 46 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.875 112.9 48.3 -64.3 -43.3 29.5 53.9 13.4 94 95 A I H X S+ 0 0 4 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.918 110.2 53.3 -63.6 -44.1 30.5 51.6 16.3 95 96 A L H X S+ 0 0 8 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.916 106.8 51.7 -54.4 -48.1 26.8 50.4 16.5 96 97 A E H X S+ 0 0 81 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.917 113.5 44.0 -57.8 -45.4 26.8 49.5 12.8 97 98 A D H X S+ 0 0 18 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.861 111.1 53.2 -69.0 -39.7 30.0 47.4 13.2 98 99 A Y H X S+ 0 0 20 -4,-2.8 4,-3.1 2,-0.2 -2,-0.2 0.888 106.6 53.3 -62.2 -41.2 28.8 45.8 16.4 99 100 A K H X S+ 0 0 87 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.895 110.1 48.6 -59.1 -41.2 25.6 44.7 14.6 100 101 A H H X S+ 0 0 34 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.933 113.0 46.7 -61.6 -48.1 27.8 43.1 11.9 101 102 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.902 108.4 56.8 -62.3 -41.6 30.0 41.4 14.5 102 103 A E H X S+ 0 0 33 -4,-3.1 4,-1.4 1,-0.2 -1,-0.2 0.890 107.3 47.4 -57.3 -43.7 26.8 40.2 16.4 103 104 A K H X S+ 0 0 132 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.902 112.0 51.8 -64.4 -39.1 25.5 38.4 13.2 104 105 A E H X S+ 0 0 22 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.895 110.3 45.6 -66.3 -42.5 29.0 36.9 12.7 105 106 A F H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.761 109.1 57.5 -71.4 -25.1 29.3 35.5 16.2 106 107 A K H X S+ 0 0 91 -4,-1.4 4,-1.9 -5,-0.3 -2,-0.2 0.931 111.7 41.9 -66.1 -46.9 25.7 34.2 15.9 107 108 A E H X S+ 0 0 90 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.885 111.0 56.9 -62.4 -44.2 26.8 32.3 12.8 108 109 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.932 109.1 46.2 -53.3 -49.7 30.0 31.2 14.6 109 110 A S H X S+ 0 0 13 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.903 114.7 46.0 -62.2 -46.6 28.0 29.7 17.4 110 111 A N H X S+ 0 0 87 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.898 115.5 46.5 -62.2 -44.6 25.6 27.8 15.0 111 112 A T H X S+ 0 0 28 -4,-3.0 4,-1.8 2,-0.2 -2,-0.2 0.900 112.1 48.9 -66.3 -44.7 28.4 26.6 12.8 112 113 A A H <>S+ 0 0 0 -4,-2.6 5,-3.5 -5,-0.3 -1,-0.2 0.843 108.8 55.6 -66.1 -34.2 30.6 25.4 15.7 113 114 A E H ><5S+ 0 0 129 -4,-1.7 3,-1.4 -5,-0.2 -1,-0.2 0.927 106.6 49.2 -60.2 -48.0 27.6 23.6 17.1 114 115 A K H 3<5S+ 0 0 173 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.881 112.8 47.7 -60.1 -39.8 27.0 21.6 13.9 115 116 A E T 3<5S- 0 0 90 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.395 116.3-116.8 -83.7 3.9 30.7 20.6 13.8 116 117 A G T < 5 + 0 0 53 -3,-1.4 2,-1.1 1,-0.2 -3,-0.2 0.777 62.7 150.4 66.7 29.5 30.5 19.6 17.5 117 118 A D >< + 0 0 24 -5,-3.5 4,-1.8 1,-0.2 -1,-0.2 -0.729 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52.3 -66.1 -39.4 23.7 50.8 25.4 138 139 A L H X S+ 0 0 13 -4,-3.0 4,-1.0 2,-0.2 3,-0.5 0.919 106.7 52.4 -62.0 -46.5 24.8 52.2 22.0 139 140 A Q H >X S+ 0 0 87 -4,-2.8 3,-0.6 1,-0.2 4,-0.6 0.876 106.4 55.0 -57.3 -38.3 21.2 52.5 20.8 140 141 A A H >< S+ 0 0 61 -4,-1.6 3,-0.5 1,-0.2 -1,-0.2 0.813 100.8 58.8 -66.3 -31.8 20.4 54.4 24.0 141 142 A H H 3< S+ 0 0 90 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.804 109.4 45.4 -60.5 -31.0 23.2 56.9 23.2 142 143 A L H << 0 0 58 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.475 360.0 360.0 -98.0 -7.4 21.5 57.7 19.9 143 144 A A << 0 0 139 -4,-0.6 -1,-0.2 -3,-0.5 -2,-0.1 0.481 360.0 360.0 -85.0 360.0 17.9 58.0 21.2