==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 19-JUL-11 3SZQ . COMPND 2 MOLECULE: APRATAXIN-LIKE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SCHIZOSACCHAROMYCES POMBE; . AUTHOR P.TUMBALE,J.KRAHN,R.S.WILLIAMS . 199 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10472.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 130 65.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 1 0.5 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 . 10 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 14.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 58 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 1 2 0 1 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 0 2 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 32 A Q 0 0 140 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -56.7 27.0 99.0 23.4 2 33 A S > - 0 0 40 1,-0.0 3,-1.8 0, 0.0 4,-0.1 -0.469 360.0 -91.5-103.9 178.4 26.4 97.2 20.1 3 34 A F G > S+ 0 0 109 1,-0.3 3,-1.9 2,-0.2 4,-0.2 0.744 116.7 75.7 -56.8 -23.9 27.8 97.5 16.5 4 35 A R G 3 S+ 0 0 108 1,-0.3 109,-3.1 2,-0.1 110,-0.5 0.619 92.0 52.5 -70.0 -11.7 24.8 99.8 15.8 5 36 A D G X S+ 0 0 45 -3,-1.8 3,-1.9 107,-0.2 4,-0.3 0.311 76.2 110.5-102.1 6.8 26.5 102.6 17.7 6 37 A N T X S+ 0 0 96 -3,-1.9 3,-0.5 1,-0.3 4,-0.2 0.733 72.1 55.5 -53.6 -30.2 29.7 102.3 15.7 7 38 A L T >> S+ 0 0 20 -3,-0.3 3,-1.4 1,-0.2 4,-0.6 0.625 85.3 88.5 -79.7 -12.3 29.2 105.6 13.9 8 39 A K H X> S+ 0 0 78 -3,-1.9 4,-1.7 1,-0.3 3,-1.0 0.828 74.6 63.6 -55.5 -40.0 29.0 107.5 17.2 9 40 A V H <> S+ 0 0 47 -3,-0.5 4,-2.5 -4,-0.3 -1,-0.3 0.789 95.0 62.4 -60.9 -25.0 32.7 108.1 17.6 10 41 A Y H <4 S+ 0 0 27 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.840 110.6 36.7 -70.8 -32.2 32.7 110.3 14.4 11 42 A I H << S+ 0 0 16 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 0.656 121.1 46.5 -94.2 -17.5 30.3 112.8 16.0 12 43 A E H < S+ 0 0 112 -4,-1.7 -2,-0.2 1,-0.1 -3,-0.2 0.885 133.8 10.4 -82.6 -46.1 31.8 112.6 19.5 13 44 A S >< + 0 0 31 -4,-2.5 3,-2.0 -5,-0.2 4,-0.2 -0.483 64.8 155.4-138.6 60.8 35.5 112.8 18.5 14 45 A P G > S+ 0 0 2 0, 0.0 3,-1.5 0, 0.0 6,-0.2 0.774 73.0 71.8 -59.3 -23.8 35.9 113.7 14.8 15 46 A E G 3 S+ 0 0 117 1,-0.3 -5,-0.1 -3,-0.1 3,-0.0 0.603 92.1 58.9 -68.9 -8.0 39.3 115.1 15.7 16 47 A S G < S+ 0 0 75 -3,-2.0 2,-0.5 -7,-0.2 -1,-0.3 0.485 94.0 72.1 -99.0 -3.8 40.5 111.5 16.1 17 48 A Y X - 0 0 85 -3,-1.5 3,-1.9 -4,-0.2 -1,-0.1 -0.934 55.2-161.7-128.0 116.8 39.8 110.2 12.6 18 49 A K T 3 S+ 0 0 111 -2,-0.5 -1,-0.1 1,-0.3 -3,-0.0 0.757 94.0 63.9 -63.9 -24.4 41.6 111.0 9.4 19 50 A N T 3 S+ 0 0 77 12,-0.1 12,-2.3 2,-0.1 2,-1.1 0.483 76.5 95.4 -82.4 -0.7 38.7 109.8 7.4 20 51 A V E < -A 30 0A 14 -3,-1.9 10,-0.3 10,-0.2 3,-0.1 -0.799 55.7-179.2 -81.3 100.7 36.6 112.6 8.8 21 52 A I E + 0 0 37 8,-1.4 2,-0.3 -2,-1.1 9,-0.2 0.519 63.9 19.0 -88.0 -4.3 37.2 115.0 5.9 22 53 A Y E +A 29 0A 58 7,-1.3 7,-2.6 -3,-0.1 2,-0.3 -0.918 63.8 163.0-158.6 138.8 35.1 117.8 7.5 23 54 A Y E +A 28 0A 116 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.984 4.8 153.1-151.2 150.4 33.7 118.7 10.9 24 55 A D - 0 0 40 3,-1.9 -2,-0.0 -2,-0.3 22,-0.0 -0.773 65.0 -70.1-144.2-162.2 32.3 121.7 12.8 25 56 A D S S+ 0 0 141 -2,-0.2 3,-0.1 1,-0.2 21,-0.0 0.788 128.8 35.3 -65.5 -26.2 30.0 122.0 15.8 26 57 A D S S+ 0 0 74 1,-0.2 20,-3.1 19,-0.1 21,-0.5 0.798 118.1 18.8-100.8 -36.6 26.9 120.8 13.8 27 58 A V E - B 0 45A 0 18,-0.3 -3,-1.9 19,-0.2 2,-0.4 -0.919 48.5-151.8-142.1 165.4 28.0 118.2 11.3 28 59 A V E -AB 23 44A 0 16,-2.1 16,-2.9 -2,-0.3 2,-0.6 -0.999 6.4-157.7-139.4 129.7 30.6 115.6 10.3 29 60 A L E +AB 22 43A 0 -7,-2.6 -8,-1.4 -2,-0.4 -7,-1.3 -0.960 26.5 170.8-107.7 117.5 31.5 114.3 6.8 30 61 A V E -AB 20 42A 0 12,-2.5 12,-3.0 -2,-0.6 -10,-0.2 -0.954 36.0-106.8-130.9 145.1 33.2 111.0 7.0 31 62 A R E - B 0 41A 87 -12,-2.3 2,-0.4 -2,-0.4 10,-0.2 -0.470 39.4-111.3 -64.6 138.9 34.2 108.3 4.5 32 63 A D - 0 0 26 8,-2.8 8,-0.1 -2,-0.2 -1,-0.1 -0.604 19.5-144.2 -71.2 127.7 32.1 105.1 4.5 33 64 A M S S+ 0 0 129 -2,-0.4 -1,-0.1 1,-0.3 -2,-0.0 0.736 99.3 34.7 -69.0 -21.0 34.3 102.3 5.8 34 65 A F S S- 0 0 118 6,-0.0 -1,-0.3 94,-0.0 -2,-0.0 -0.513 91.4-157.3-129.7 64.0 32.6 99.9 3.4 35 66 A P - 0 0 41 0, 0.0 93,-0.5 0, 0.0 94,-0.1 -0.070 13.5-162.8 -53.8 132.8 31.9 102.1 0.3 36 67 A K S S+ 0 0 27 92,-0.1 2,-0.3 91,-0.1 90,-0.1 0.435 78.9 30.6 -98.0 1.0 29.1 100.8 -1.9 37 68 A S S S- 0 0 1 87,-0.2 89,-0.1 86,-0.1 91,-0.1 -0.921 101.6 -91.0-143.3 169.6 30.3 103.0 -4.8 38 69 A K S S+ 0 0 71 -2,-0.3 2,-0.4 1,-0.2 88,-0.0 0.869 123.5 30.7 -53.2 -38.9 33.6 104.4 -5.9 39 70 A M S S+ 0 0 0 2,-0.0 82,-1.9 -8,-0.0 2,-0.3 -0.993 74.3 163.9-119.2 130.9 32.9 107.4 -3.7 40 71 A H E + C 0 120A 6 -2,-0.4 -8,-2.8 80,-0.2 2,-0.3 -0.882 6.3 168.5-150.0 110.1 30.7 106.9 -0.6 41 72 A L E -BC 31 119A 0 78,-3.3 78,-2.3 -2,-0.3 2,-0.4 -0.811 22.9-141.5-120.8 160.7 30.5 109.4 2.2 42 73 A L E -BC 30 118A 7 -12,-3.0 -12,-2.5 -2,-0.3 2,-0.6 -0.991 5.1-157.6-126.0 127.8 28.3 109.9 5.2 43 74 A L E -BC 29 117A 2 74,-2.7 74,-2.7 -2,-0.4 2,-0.4 -0.920 20.5-173.5-104.5 117.3 27.1 113.3 6.5 44 75 A M E -BC 28 116A 0 -16,-2.9 -16,-2.1 -2,-0.6 2,-0.2 -0.899 22.2-130.9-117.0 135.1 26.1 113.1 10.2 45 76 A T E -B 27 0A 7 70,-0.6 -18,-0.3 -2,-0.4 -19,-0.1 -0.598 7.6-153.5 -74.2 143.2 24.4 115.6 12.5 46 77 A R + 0 0 62 -20,-3.1 -19,-0.2 -2,-0.2 -1,-0.1 0.449 58.0 120.2 -95.2 -4.2 26.2 116.1 15.8 47 78 A D > - 0 0 71 -21,-0.5 4,-2.5 1,-0.2 -2,-0.1 -0.493 60.1-146.1 -64.9 118.9 23.0 117.2 17.5 48 79 A P T 4 S+ 0 0 109 0, 0.0 4,-0.2 0, 0.0 -1,-0.2 0.689 93.9 46.1 -68.6 -20.5 22.5 114.7 20.3 49 80 A H T >4 S+ 0 0 127 2,-0.1 3,-1.8 1,-0.1 4,-0.2 0.953 116.6 40.6 -76.3 -63.0 18.7 114.7 20.1 50 81 A L G >4 S+ 0 0 20 1,-0.3 3,-2.1 2,-0.2 65,-0.2 0.736 97.3 76.1 -58.4 -30.7 18.3 114.4 16.3 51 82 A T G 3< S+ 0 0 4 -4,-2.5 64,-3.4 1,-0.3 -1,-0.3 0.793 102.3 42.5 -55.5 -25.6 21.1 111.9 15.8 52 83 A H G < S+ 0 0 116 -3,-1.8 -1,-0.3 -4,-0.2 2,-0.3 0.406 88.5 110.7-101.6 -0.0 18.7 109.2 17.2 53 84 A V S < S- 0 0 18 -3,-2.1 62,-0.1 -4,-0.2 5,-0.1 -0.571 79.4-107.5 -73.5 135.8 15.6 110.4 15.3 54 85 A H >> - 0 0 80 -2,-0.3 4,-2.0 1,-0.1 3,-0.9 -0.426 25.8-122.9 -63.9 136.6 14.5 108.0 12.6 55 86 A P H 3> S+ 0 0 7 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.796 111.3 55.8 -54.1 -35.8 15.3 109.4 9.0 56 87 A L H 3> S+ 0 0 37 52,-0.3 4,-1.9 2,-0.2 5,-0.1 0.872 108.6 48.1 -64.3 -36.7 11.7 109.1 7.9 57 88 A E H <> S+ 0 0 74 -3,-0.9 4,-3.2 2,-0.2 5,-0.4 0.862 109.7 53.7 -67.7 -38.3 10.7 111.3 10.9 58 89 A I H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 8,-0.3 0.956 110.4 45.8 -57.5 -52.7 13.5 113.7 10.0 59 90 A M H < S+ 0 0 0 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.857 120.1 41.0 -59.0 -39.4 12.1 114.0 6.4 60 91 A M H < S+ 0 0 84 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.932 133.6 11.8 -75.7 -46.9 8.5 114.5 7.8 61 92 A K H < S+ 0 0 129 -4,-3.2 -3,-0.2 1,-0.2 -2,-0.2 0.335 116.5 61.7-124.8 3.8 9.0 116.7 10.8 62 93 A H >X + 0 0 50 -4,-2.4 4,-1.8 -5,-0.4 3,-0.6 -0.416 50.8 149.2-128.4 60.7 12.6 118.2 10.7 63 94 A R H 3> + 0 0 88 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.782 68.7 62.4 -63.6 -28.3 12.7 120.1 7.5 64 95 A S H 3> S+ 0 0 93 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.875 105.8 45.8 -71.3 -34.3 15.1 122.7 8.9 65 96 A L H <> S+ 0 0 9 -3,-0.6 4,-2.7 2,-0.2 5,-0.2 0.919 111.8 52.6 -67.2 -45.1 17.7 119.9 9.4 66 97 A V H X S+ 0 0 3 -4,-1.8 4,-1.9 -8,-0.3 -2,-0.2 0.927 111.6 45.9 -55.2 -46.8 17.0 118.6 5.9 67 98 A E H X S+ 0 0 128 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.896 111.6 51.8 -65.3 -41.3 17.6 122.1 4.5 68 99 A K H X S+ 0 0 82 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.927 108.7 50.1 -60.8 -45.4 20.8 122.6 6.5 69 100 A L H X S+ 0 0 2 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.901 111.7 48.6 -59.8 -42.0 22.2 119.3 5.3 70 101 A V H X S+ 0 0 40 -4,-1.9 4,-2.4 -5,-0.2 5,-0.2 0.872 107.7 55.5 -65.4 -39.0 21.4 120.2 1.7 71 102 A S H X S+ 0 0 76 -4,-2.3 4,-1.4 2,-0.2 6,-0.2 0.925 108.6 48.0 -59.3 -47.6 23.0 123.6 2.2 72 103 A Y H <>S+ 0 0 23 -4,-2.3 5,-2.4 2,-0.2 6,-0.4 0.933 112.3 48.9 -55.3 -49.6 26.3 122.0 3.3 73 104 A V H <5S+ 0 0 26 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.857 120.2 35.6 -64.0 -37.8 26.3 119.6 0.4 74 105 A Q H <5S+ 0 0 152 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.580 131.5 26.4 -89.7 -9.7 25.7 122.3 -2.2 75 106 A G T >X5S+ 0 0 31 -4,-1.4 3,-2.0 -3,-0.2 4,-0.6 0.482 123.1 13.3-117.7-106.1 27.8 124.9 -0.4 76 107 A D T 345S+ 0 0 132 1,-0.3 4,-0.3 -5,-0.2 -3,-0.1 0.673 132.6 40.6 -58.4 -20.1 30.7 124.6 2.0 77 108 A L T 3> S+ 0 0 36 -3,-2.0 4,-2.7 -6,-0.4 5,-0.2 0.930 89.0 44.1 -63.5 -47.7 30.7 121.0 -2.5 79 110 A G H X S+ 0 0 48 -4,-0.6 4,-1.8 1,-0.2 -1,-0.2 0.924 115.2 50.6 -59.0 -45.3 34.4 121.6 -3.5 80 111 A L H > S+ 0 0 58 -4,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.916 111.3 47.9 -58.1 -44.8 35.4 119.0 -1.0 81 112 A I H X S+ 0 0 7 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.924 109.4 51.8 -67.8 -43.3 32.9 116.5 -2.4 82 113 A F H X S+ 0 0 36 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.835 110.2 50.5 -61.3 -32.5 33.9 117.1 -6.0 83 114 A D H X S+ 0 0 78 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.931 108.8 49.8 -73.1 -44.7 37.6 116.5 -5.0 84 115 A E H X S+ 0 0 17 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.932 113.5 48.6 -52.6 -46.9 36.8 113.2 -3.2 85 116 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.4 0.922 110.4 49.2 -63.1 -45.6 34.9 112.2 -6.3 86 117 A R H < S+ 0 0 49 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.893 112.8 48.3 -62.7 -38.9 37.7 113.2 -8.7 87 118 A N H < S+ 0 0 106 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.793 117.1 42.3 -67.3 -27.8 40.2 111.2 -6.6 88 119 A C H < S+ 0 0 41 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.761 133.6 14.5 -92.6 -27.5 37.9 108.2 -6.5 89 120 A L S < S- 0 0 22 -4,-2.5 2,-0.3 -5,-0.2 -3,-0.2 0.715 122.3 -39.3-109.5 -84.0 36.8 108.2 -10.1 90 121 A S > - 0 0 20 -5,-0.4 3,-1.4 1,-0.1 -2,-0.1 -0.974 29.4-135.5-156.0 139.9 38.9 110.4 -12.4 91 122 A Q T 3 S+ 0 0 131 -2,-0.3 -5,-0.1 1,-0.3 -4,-0.1 0.742 103.4 68.9 -59.7 -24.2 40.6 113.8 -12.4 92 123 A Q T 3 S+ 0 0 135 -6,-0.1 2,-0.5 -3,-0.0 -1,-0.3 0.349 76.2 103.8 -83.3 7.8 39.2 114.4 -15.8 93 124 A L < - 0 0 2 -3,-1.4 2,-0.1 -7,-0.1 106,-0.1 -0.801 63.5-141.6 -95.2 128.7 35.6 114.7 -14.6 94 125 A T > - 0 0 85 -2,-0.5 4,-2.6 104,-0.3 5,-0.2 -0.396 26.9-106.2 -81.6 161.3 34.0 118.2 -14.3 95 126 A N H > S+ 0 0 76 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.862 121.3 53.4 -50.1 -42.2 31.7 119.3 -11.5 96 127 A E H > S+ 0 0 148 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.943 109.3 46.2 -64.5 -47.4 28.8 119.1 -13.9 97 128 A A H 4 S+ 0 0 20 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.924 116.9 46.4 -57.9 -43.0 29.5 115.5 -14.9 98 129 A L H >< S+ 0 0 0 -4,-2.6 3,-2.0 1,-0.2 -2,-0.2 0.887 105.7 58.1 -67.4 -41.4 30.0 114.6 -11.2 99 130 A C H >< S+ 0 0 78 -4,-2.9 3,-1.0 1,-0.3 -1,-0.2 0.879 106.9 48.6 -58.5 -39.6 26.9 116.4 -10.1 100 131 A N T 3< S+ 0 0 121 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.331 111.7 51.6 -80.6 6.1 24.7 114.3 -12.4 101 132 A Y T < S+ 0 0 4 -3,-2.0 21,-1.7 -5,-0.1 2,-0.4 0.094 94.7 86.0-130.0 20.3 26.5 111.1 -11.1 102 133 A I E < -D 121 0A 34 -3,-1.0 2,-0.3 19,-0.2 19,-0.2 -0.965 53.5-166.6-125.9 139.9 26.0 111.7 -7.4 103 134 A K E -D 120 0A 17 17,-3.0 17,-2.3 -2,-0.4 2,-0.4 -0.952 2.5-162.7-127.9 151.8 23.1 110.8 -5.2 104 135 A V E +D 119 0A 25 -2,-0.3 42,-2.5 15,-0.2 43,-0.3 -0.994 31.6 112.8-137.1 122.2 22.2 111.9 -1.7 105 136 A G E -DE 118 145A 0 13,-2.1 13,-2.6 -2,-0.4 2,-0.3 -0.994 51.7 -98.4-174.2 174.1 19.7 110.2 0.7 106 137 A F E - E 0 144A 4 38,-2.3 38,-3.4 -2,-0.3 2,-0.4 -0.778 35.8-115.3-101.3 149.3 18.8 108.2 3.8 107 138 A H E - E 0 143A 28 9,-0.4 36,-0.2 -2,-0.3 -51,-0.1 -0.717 21.6-135.8 -75.3 135.5 18.1 104.5 4.0 108 139 A A S S+ 0 0 6 34,-2.5 -52,-0.3 -2,-0.4 -1,-0.1 0.817 100.8 30.2 -64.0 -31.7 14.5 103.9 5.0 109 140 A G S S- 0 0 33 33,-0.2 -1,-0.3 -54,-0.1 33,-0.0 -0.790 86.2-163.3-128.7 92.3 15.6 101.3 7.5 110 141 A P - 0 0 46 0, 0.0 3,-0.0 0, 0.0 5,-0.0 -0.296 18.1-158.7 -68.9 154.6 19.1 102.1 8.9 111 142 A S S S+ 0 0 84 -108,-0.0 2,-0.3 1,-0.0 0, 0.0 0.725 80.4 68.2 -95.6 -36.2 21.3 99.5 10.7 112 143 A M S S- 0 0 52 1,-0.1 -107,-0.2 2,-0.1 4,-0.2 -0.662 75.9-145.4 -86.0 142.3 23.4 102.2 12.4 113 144 A N S S+ 0 0 73 -109,-3.1 2,-0.8 -2,-0.3 -108,-0.1 0.637 74.3 86.6 -85.5 -19.0 21.7 104.3 15.0 114 145 A N S S- 0 0 2 -110,-0.5 -62,-0.2 1,-0.1 -63,-0.1 -0.769 92.0-108.3 -90.2 112.7 23.4 107.6 14.5 115 146 A L + 0 0 11 -64,-3.4 -70,-0.6 -2,-0.8 2,-0.4 -0.014 48.4 173.2 -43.2 127.1 21.6 109.6 11.7 116 147 A H E -C 44 0A 19 -72,-0.2 2,-0.5 -4,-0.2 -9,-0.4 -0.990 26.4-144.7-146.7 132.6 23.7 109.6 8.6 117 148 A L E -C 43 0A 1 -74,-2.7 -74,-2.7 -2,-0.4 2,-0.4 -0.848 21.7-133.9 -98.0 124.5 23.1 110.9 5.1 118 149 A H E -CD 42 105A 8 -13,-2.6 -13,-2.1 -2,-0.5 2,-0.4 -0.631 21.8-178.2 -77.5 132.2 24.6 108.9 2.2 119 150 A I E +CD 41 104A 1 -78,-2.3 -78,-3.3 -2,-0.4 2,-0.3 -0.988 26.3 143.2-129.7 117.7 26.4 110.9 -0.5 120 151 A M E -CD 40 103A 0 -17,-2.3 -17,-3.0 -2,-0.4 -80,-0.2 -0.985 49.8 -97.7-157.6 155.7 27.8 108.6 -3.2 121 152 A T E - 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0 0 26 -3,-2.0 2,-0.1 1,-0.1 5,-0.1 -0.516 63.9-115.6 -66.3 127.9 11.7 113.4 -1.9 149 180 A P > - 0 0 79 0, 0.0 3,-2.1 0, 0.0 4,-0.1 -0.459 23.6-120.2 -63.2 143.6 8.5 115.2 -1.3 150 181 A T G > S+ 0 0 61 1,-0.3 3,-1.4 2,-0.2 -90,-0.1 0.833 111.5 57.8 -55.9 -38.2 7.1 114.3 2.1 151 182 A S G 3 S+ 0 0 111 1,-0.2 -1,-0.3 -91,-0.0 -91,-0.0 0.664 105.6 53.0 -68.6 -13.4 3.8 112.9 0.7 152 183 A N G < S+ 0 0 108 -3,-2.1 -1,-0.2 2,-0.0 -2,-0.2 0.265 73.8 133.5-107.6 13.9 5.9 110.4 -1.4 153 184 A L < - 0 0 23 -3,-1.4 -3,-0.0 -4,-0.1 -9,-0.0 -0.351 66.7-100.8 -58.0 143.2 8.0 108.9 1.4 154 185 A P - 0 0 18 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.334 38.5-143.6 -69.1 149.9 8.0 105.2 1.1 155 186 A T > - 0 0 82 1,-0.1 4,-2.2 -3,-0.1 3,-0.5 -0.786 28.0-106.6-113.3 160.9 5.7 103.2 3.4 156 187 A R H > S+ 0 0 222 -2,-0.3 4,-0.8 1,-0.3 -1,-0.1 0.886 124.7 54.0 -44.1 -42.3 6.0 99.8 5.1 157 188 A G H 4 S+ 0 0 54 1,-0.2 3,-0.5 2,-0.2 -1,-0.3 0.899 109.1 44.8 -60.3 -43.9 3.6 98.7 2.4 158 189 A T H 4 S+ 0 0 80 -3,-0.5 -2,-0.2 1,-0.2 -1,-0.2 0.746 111.8 52.5 -76.6 -24.5 5.7 99.9 -0.5 159 190 A L H >< S+ 0 0 36 -4,-2.2 3,-1.9 -18,-0.1 4,-0.3 0.610 79.9 130.3 -85.4 -12.9 9.0 98.5 1.0 160 191 A T T 3< S- 0 0 93 -4,-0.8 -3,-0.0 -3,-0.5 -5,-0.0 -0.123 84.2 -12.0 -52.2 127.2 7.6 95.0 1.5 161 192 A S T > S+ 0 0 69 1,-0.1 3,-1.3 2,-0.1 -1,-0.3 0.705 89.4 142.6 62.5 20.7 9.7 92.1 0.2 162 193 A L G X + 0 0 17 -3,-1.9 3,-1.3 1,-0.3 -2,-0.1 0.857 62.7 56.8 -64.7 -38.1 11.8 94.6 -1.7 163 194 A F G 3 S+ 0 0 59 -4,-0.3 -1,-0.3 1,-0.2 -27,-0.1 0.559 99.2 63.0 -74.4 -5.1 15.1 92.8 -1.2 164 195 A Q G < S+ 0 0 126 -3,-1.3 -1,-0.2 -31,-0.0 -2,-0.2 0.481 82.2 108.0 -94.4 -3.2 13.8 89.6 -2.8 165 196 A E S < S- 0 0 115 -3,-1.3 -29,-0.1 -4,-0.2 3,-0.0 -0.189 79.8 -84.6 -76.9 165.3 13.2 91.2 -6.2 166 197 A D - 0 0 111 1,-0.1 2,-0.4 12,-0.0 12,-0.2 -0.297 49.5-104.5 -61.6 152.8 15.1 90.6 -9.4 167 198 A L - 0 0 1 10,-3.3 9,-2.5 -3,-0.1 10,-0.4 -0.679 39.2-172.4 -84.7 130.6 18.3 92.6 -9.9 168 199 A K B -F 175 0B 118 -2,-0.4 7,-0.2 7,-0.2 2,-0.2 -0.987 28.3-115.8-127.4 129.3 18.0 95.5 -12.4 169 200 A C > - 0 0 2 5,-3.0 4,-1.4 -2,-0.4 14,-0.0 -0.454 19.7-146.9 -59.0 127.9 20.7 97.7 -13.8 170 201 A W T 4 S+ 0 0 79 -2,-0.2 -1,-0.2 1,-0.2 -47,-0.0 0.780 93.3 44.9 -69.4 -25.8 20.0 101.3 -12.6 171 202 A R T 4 S+ 0 0 74 -48,-0.1 -1,-0.2 1,-0.1 -2,-0.0 0.894 129.1 13.2 -89.2 -43.9 21.5 102.7 -15.8 172 203 A C T 4 S- 0 0 72 2,-0.1 -2,-0.1 0, 0.0 -1,-0.1 0.524 92.2-119.1-116.6 -7.7 20.1 100.7 -18.7 173 204 A G < + 0 0 25 -4,-1.4 -3,-0.1 1,-0.3 0, 0.0 0.334 56.1 152.4 88.1 -8.4 17.3 98.6 -17.2 174 205 A E - 0 0 92 -6,-0.1 -5,-3.0 1,-0.1 2,-0.3 -0.248 36.4-135.5 -57.9 144.2 18.7 95.2 -18.0 175 206 A T B +F 168 0B 88 -7,-0.2 -7,-0.2 1,-0.1 -1,-0.1 -0.730 24.6 179.0-106.7 151.8 17.6 92.4 -15.6 176 207 A F > - 0 0 26 -9,-2.5 3,-2.7 1,-0.4 6,-0.2 0.204 29.2-140.6-136.8 15.3 19.7 89.7 -14.0 177 208 A G T 3 S- 0 0 22 -10,-0.4 -10,-3.3 1,-0.3 -1,-0.4 -0.375 73.9 -35.3 55.1-127.6 17.3 87.7 -11.8 178 209 A R T 3 S+ 0 0 114 -12,-0.2 2,-2.1 -2,-0.1 -1,-0.3 0.079 101.2 125.4-110.4 21.9 19.2 86.9 -8.7 179 210 A H X> + 0 0 126 -3,-2.7 4,-1.9 1,-0.2 3,-1.2 -0.494 30.4 171.0 -80.7 73.3 22.6 86.5 -10.5 180 211 A F H 3> S+ 0 0 29 -2,-2.1 4,-2.6 1,-0.3 -1,-0.2 0.865 73.3 55.9 -53.6 -42.3 24.4 89.1 -8.3 181 212 A T H 3> S+ 0 0 114 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.784 106.6 51.4 -62.6 -29.5 27.8 88.2 -9.7 182 213 A K H <> S+ 0 0 60 -3,-1.2 4,-2.1 2,-0.2 -1,-0.2 0.885 108.2 50.7 -75.3 -42.8 26.5 88.9 -13.2 183 214 A L H X S+ 0 0 0 -4,-1.9 4,-3.3 2,-0.2 5,-0.2 0.948 107.3 55.9 -54.0 -50.3 25.2 92.3 -12.2 184 215 A K H X S+ 0 0 63 -4,-2.6 4,-1.9 1,-0.3 -2,-0.2 0.911 109.0 44.9 -50.2 -51.5 28.6 93.1 -10.6 185 216 A A H X S+ 0 0 52 -4,-1.5 4,-1.6 1,-0.2 -1,-0.3 0.870 113.8 51.0 -64.6 -37.0 30.4 92.5 -13.9 186 217 A H H X S+ 0 0 21 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.916 105.6 54.8 -66.1 -43.2 27.8 94.5 -15.7 187 218 A L H X S+ 0 0 1 -4,-3.3 4,-2.2 1,-0.2 -2,-0.2 0.904 105.6 54.1 -56.4 -40.5 28.1 97.4 -13.3 188 219 A Q H X S+ 0 0 75 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.927 110.0 46.1 -59.8 -44.2 31.8 97.5 -14.1 189 220 A E H X S+ 0 0 119 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.877 110.3 53.7 -65.3 -41.1 31.1 97.7 -17.8 190 221 A E H X S+ 0 0 22 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.867 109.6 49.2 -60.9 -37.7 28.5 100.4 -17.2 191 222 A Y H X S+ 0 0 11 -4,-2.2 4,-3.2 2,-0.2 5,-0.2 0.933 110.0 48.7 -70.6 -45.6 31.1 102.4 -15.3 192 223 A D H X S+ 0 0 81 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.889 113.2 49.5 -59.7 -38.7 33.8 102.1 -18.0 193 224 A D H X S+ 0 0 90 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.948 113.7 44.3 -66.0 -48.5 31.2 103.1 -20.6 194 225 A W H X S+ 0 0 16 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.912 114.6 49.5 -62.1 -44.3 30.1 106.1 -18.6 195 226 A L H X S+ 0 0 37 -4,-3.2 4,-2.6 1,-0.2 3,-0.3 0.932 110.2 50.0 -60.0 -47.0 33.6 107.2 -17.7 196 227 A D H < S+ 0 0 132 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.853 115.3 43.5 -63.3 -35.0 34.8 106.9 -21.4 197 228 A K H < S+ 0 0 140 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.701 117.8 46.2 -82.1 -20.4 31.8 109.1 -22.5 198 229 A S H < 0 0 28 -4,-1.5 -104,-0.3 -3,-0.3 -2,-0.2 0.805 360.0 360.0 -96.9 -32.8 32.2 111.6 -19.7 199 230 A V < 0 0 80 -4,-2.6 -3,-0.1 -5,-0.2 -2,-0.1 0.979 360.0 360.0 -60.2 360.0 35.9 112.3 -19.6