==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 24-APR-08 3CXN . COMPND 2 MOLECULE: UREASE ACCESSORY PROTEIN UREF; . SOURCE 2 ORGANISM_SCIENTIFIC: HELICOBACTER PYLORI; . AUTHOR R.LAM,K.JOHNS,V.ROMANOV,A.DONG,J.WU-BROWN,J.GUTHRIE,A.DHARAM . 620 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28591.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 482 77.7 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 . 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 . 21 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 368 59.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 3.9 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 3 0 1 0 0 4 7 0 6 8 1 0 0 0 0 0 3 0 0 3 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 . 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 . 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 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 27 A A 0 0 146 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -26.1 11.2 34.1 40.9 2 28 A H + 0 0 84 112,-0.2 2,-0.4 2,-0.0 113,-0.0 0.536 360.0 93.3 -94.0 -12.9 15.0 34.6 40.2 3 29 A V - 0 0 39 599,-0.1 2,-0.6 111,-0.1 3,-0.1 -0.686 59.5-161.4 -85.0 132.8 14.9 32.4 37.0 4 30 A D >> - 0 0 27 -2,-0.4 4,-2.8 1,-0.1 3,-1.1 -0.957 8.3-159.1-115.6 110.6 14.3 34.2 33.7 5 31 A N H 3> S+ 0 0 51 -2,-0.6 4,-2.3 1,-0.3 5,-0.2 0.786 92.8 63.1 -57.9 -30.3 13.1 31.8 31.0 6 32 A E H 34 S+ 0 0 72 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.807 113.7 34.4 -64.1 -32.2 14.2 34.3 28.3 7 33 A F H <> S+ 0 0 1 -3,-1.1 4,-2.4 2,-0.1 3,-0.3 0.836 114.5 56.6 -88.6 -36.7 17.8 33.8 29.7 8 34 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.876 102.2 56.4 -63.2 -37.2 17.5 30.1 30.5 9 35 A I H X S+ 0 0 1 -4,-2.3 4,-0.8 1,-0.2 -1,-0.2 0.877 110.8 44.9 -63.6 -35.3 16.5 29.3 26.9 10 36 A L H > S+ 0 0 17 -4,-0.5 4,-0.8 -3,-0.3 3,-0.3 0.907 112.7 52.5 -69.2 -42.8 19.7 30.9 25.7 11 37 A Q H >< S+ 0 0 1 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.930 109.7 45.3 -61.5 -47.6 21.7 29.2 28.4 12 38 A V H 3< S+ 0 0 1 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.694 115.5 48.1 -74.8 -17.5 20.6 25.7 27.7 13 39 A N H 3< S+ 0 0 14 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.451 84.8 114.4 -97.8 -1.5 21.0 26.1 23.9 14 40 A D S X< S- 0 0 26 -3,-0.9 3,-1.9 -4,-0.8 420,-0.0 -0.430 76.2-123.7 -68.1 141.2 24.5 27.6 24.2 15 41 A A T 3 S+ 0 0 85 1,-0.3 -1,-0.1 -2,-0.1 -4,-0.0 0.736 111.5 59.4 -55.3 -25.7 27.3 25.4 22.7 16 42 A V T 3 + 0 0 40 2,-0.1 -1,-0.3 -5,-0.1 4,-0.1 0.600 67.6 119.7 -82.6 -11.3 29.0 25.5 26.1 17 43 A F S < S- 0 0 7 -3,-1.9 2,-2.3 -6,-0.2 3,-0.3 -0.433 77.0-122.8 -55.9 116.2 26.1 23.9 27.9 18 44 A P S S+ 0 0 14 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.348 76.6 115.6 -81.2 67.9 28.1 21.0 29.1 19 45 A I S S- 0 0 3 -2,-2.3 85,-0.2 1,-0.4 86,-0.2 0.396 80.5-101.3-108.6 1.1 26.2 18.0 27.7 20 46 A G - 0 0 37 -3,-0.3 -1,-0.4 84,-0.1 2,-0.2 -0.286 58.6 -43.4 94.2 171.8 28.9 16.7 25.2 21 47 A S - 0 0 109 -2,-0.1 80,-0.1 1,-0.1 -6,-0.0 -0.487 61.5-107.6 -77.6 141.4 29.1 17.2 21.4 22 48 A Y - 0 0 20 -2,-0.2 3,-0.4 1,-0.1 -1,-0.1 -0.222 23.9-131.9 -59.6 157.4 26.0 16.8 19.2 23 49 A T S > S+ 0 0 25 1,-0.2 3,-1.7 2,-0.1 4,-0.3 0.313 79.1 102.0-103.8 7.5 25.9 13.7 17.1 24 50 A H T >> + 0 0 28 1,-0.3 3,-0.8 2,-0.2 4,-0.7 0.821 69.9 74.8 -58.8 -30.3 25.0 15.1 13.7 25 51 A S H 3> S+ 0 0 56 -3,-0.4 4,-1.0 1,-0.2 3,-0.4 0.733 78.9 77.6 -52.2 -27.7 28.7 14.7 12.7 26 52 A F H <4 S+ 0 0 78 -3,-1.7 3,-0.3 1,-0.2 4,-0.3 0.907 98.2 35.5 -52.3 -55.4 28.2 11.0 12.4 27 53 A G H <4 S+ 0 0 36 -3,-0.8 4,-0.5 -4,-0.3 3,-0.3 0.617 108.6 64.0 -80.7 -15.3 26.5 10.9 9.0 28 54 A L H >X S+ 0 0 3 -4,-0.7 4,-1.4 -3,-0.4 3,-0.6 0.797 83.1 74.8 -79.7 -29.9 28.3 13.7 7.2 29 55 A E H 3X S+ 0 0 120 -4,-1.0 4,-2.0 -3,-0.3 -1,-0.2 0.771 92.9 52.6 -63.0 -30.0 31.8 12.3 7.2 30 56 A T H 3> S+ 0 0 44 -4,-0.3 4,-2.4 -3,-0.3 -1,-0.3 0.878 105.8 56.1 -69.7 -36.5 31.1 9.8 4.4 31 57 A Y H <4>S+ 0 0 60 -3,-0.6 5,-3.7 -4,-0.5 6,-1.3 0.861 112.2 41.2 -63.0 -37.6 29.8 12.6 2.2 32 58 A I H ><5S+ 0 0 29 -4,-1.4 3,-1.8 3,-0.2 -2,-0.2 0.940 115.3 48.8 -73.2 -49.2 33.1 14.6 2.6 33 59 A Q H 3<5S+ 0 0 141 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.2 0.861 114.1 46.4 -62.6 -37.7 35.4 11.7 2.2 34 60 A Q T 3<5S- 0 0 94 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.333 117.6-119.5 -85.6 7.9 33.6 10.5 -0.9 35 61 A K T < 5S+ 0 0 169 -3,-1.8 -3,-0.2 2,-0.2 3,-0.2 0.853 76.9 123.7 61.8 42.9 33.7 14.1 -2.1 36 62 A K S S- 0 0 64 134,-0.0 4,-2.2 1,-0.0 5,-0.2 -0.895 89.6 -78.1-161.5-178.8 31.6 23.6 -1.3 40 66 A K H > S+ 0 0 66 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.883 123.7 51.8 -66.2 -37.1 28.9 25.9 0.2 41 67 A E H > S+ 0 0 101 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.936 113.6 41.7 -65.1 -48.1 26.3 24.9 -2.4 42 68 A S H > S+ 0 0 29 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.838 114.5 52.7 -70.5 -32.8 26.6 21.1 -1.9 43 69 A A H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.937 109.5 49.7 -63.3 -46.4 26.8 21.7 1.9 44 70 A L H X S+ 0 0 24 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.932 112.2 46.9 -58.8 -47.0 23.6 23.7 1.8 45 71 A E H X S+ 0 0 111 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.917 112.7 49.7 -62.0 -42.0 21.8 21.0 -0.2 46 72 A Y H X S+ 0 0 33 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.923 112.9 47.3 -59.7 -46.6 23.1 18.3 2.1 47 73 A L H X S+ 0 0 1 -4,-2.9 4,-3.0 2,-0.2 5,-0.2 0.917 110.2 51.2 -65.2 -43.0 21.9 20.2 5.2 48 74 A K H X S+ 0 0 70 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.925 113.4 46.2 -58.9 -44.2 18.5 21.0 3.7 49 75 A A H < S+ 0 0 62 -4,-2.3 4,-0.5 -5,-0.2 -2,-0.2 0.909 114.9 46.3 -66.8 -39.4 18.0 17.3 2.9 50 76 A N H ><>S+ 0 0 35 -4,-2.5 5,-1.4 1,-0.2 3,-1.0 0.913 111.2 51.1 -69.6 -42.8 19.2 16.2 6.3 51 77 A L H 3<5S+ 0 0 1 -4,-3.0 5,-0.3 1,-0.2 -1,-0.2 0.854 111.5 48.7 -62.8 -34.2 17.1 18.7 8.2 52 78 A S T 3<5S+ 0 0 60 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.458 117.8 38.9 -86.8 -5.4 13.9 17.6 6.3 53 79 A S T X>5S- 0 0 41 -3,-1.0 4,-2.7 -4,-0.5 3,-0.7 0.440 127.0 -1.9-112.1-110.9 14.5 13.9 6.9 54 80 A Q H 3>>S+ 0 0 85 1,-0.3 4,-2.2 2,-0.2 5,-1.1 0.844 130.6 55.5 -55.6 -39.1 15.7 12.2 10.1 55 81 A F H 34XS+ 0 0 5 -5,-1.4 5,-3.1 3,-0.2 6,-0.3 0.891 116.1 37.6 -64.7 -36.2 16.2 15.5 11.9 56 82 A L H <4>S+ 0 0 1 -3,-0.7 5,-2.1 -6,-0.4 -2,-0.2 0.944 121.6 41.1 -75.9 -54.1 12.6 16.4 11.3 57 83 A Y H <5S+ 0 0 38 -4,-2.7 148,-2.5 3,-0.2 149,-0.3 0.655 132.0 21.7 -79.2 -16.5 10.9 13.1 11.7 58 84 A T T X5S+ 0 0 23 -4,-2.2 4,-2.2 -5,-0.3 5,-0.2 0.721 130.9 28.6-107.0 -67.3 12.9 12.0 14.7 59 85 A E H >S+ 0 0 2 -4,-2.5 5,-2.9 1,-0.2 -1,-0.2 0.854 107.9 55.8 -72.3 -31.6 2.5 15.2 26.3 70 96 A A H ><5S+ 0 0 8 -4,-2.4 3,-1.5 1,-0.2 -1,-0.2 0.908 105.1 52.4 -65.0 -40.0 4.2 17.1 29.1 71 97 A L H 3<5S+ 0 0 101 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.798 110.6 48.3 -62.8 -29.7 1.5 19.8 29.0 72 98 A Q T 3<5S- 0 0 114 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.386 113.5-124.5 -85.2 0.0 -1.1 16.9 29.2 73 99 A Q T < 5 + 0 0 151 -3,-1.5 2,-0.8 1,-0.2 -3,-0.2 0.864 60.2 150.2 51.8 44.3 0.9 15.5 32.2 74 100 A D >< + 0 0 47 -5,-2.9 4,-1.4 1,-0.2 3,-0.2 -0.764 18.2 167.7-112.7 84.0 1.1 12.3 30.3 75 101 A L H > S+ 0 0 32 -2,-0.8 4,-2.6 1,-0.2 5,-0.2 0.846 74.8 61.9 -64.3 -37.7 4.3 10.5 31.2 76 102 A K H > S+ 0 0 175 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.925 104.9 47.7 -55.4 -44.6 3.4 7.3 29.6 77 103 A K H > S+ 0 0 95 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.881 110.5 51.7 -66.6 -39.4 3.2 8.9 26.2 78 104 A I H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.943 111.7 46.1 -61.0 -48.2 6.6 10.6 26.7 79 105 A L H X S+ 0 0 37 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.882 110.1 55.7 -63.6 -34.5 8.2 7.3 27.6 80 106 A G H X S+ 0 0 27 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.886 107.1 49.1 -64.7 -38.7 6.5 5.7 24.6 81 107 A V H X S+ 0 0 5 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.937 111.1 49.0 -65.5 -47.2 8.0 8.2 22.3 82 108 A E H X S+ 0 0 4 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.875 109.4 54.4 -60.9 -35.0 11.5 7.6 23.8 83 109 A E H X S+ 0 0 108 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.943 106.8 49.4 -63.7 -47.7 10.9 3.9 23.3 84 110 A V H X S+ 0 0 58 -4,-2.3 4,-0.8 1,-0.2 -1,-0.2 0.912 112.4 48.7 -55.4 -44.0 10.1 4.3 19.6 85 111 A I H >X S+ 0 0 7 -4,-2.1 4,-1.0 1,-0.2 3,-0.9 0.927 110.6 49.4 -66.4 -43.8 13.3 6.3 19.1 86 112 A X H 3< S+ 0 0 57 -4,-2.4 3,-0.5 1,-0.3 -1,-0.2 0.891 112.6 48.3 -61.5 -38.2 15.5 3.9 21.0 87 113 A L H 3< S+ 0 0 55 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.593 114.6 46.9 -78.4 -10.7 14.1 1.0 18.9 88 114 A S H << S+ 0 0 52 -3,-0.9 2,-0.4 -4,-0.8 -1,-0.2 0.539 84.6 109.5-106.4 -10.5 14.6 2.9 15.7 89 115 A T < - 0 0 15 -4,-1.0 6,-0.1 -3,-0.5 -4,-0.0 -0.587 54.5-144.0 -84.8 122.9 18.1 4.2 16.1 90 116 A S + 0 0 34 -2,-0.4 2,-0.1 4,-0.1 224,-0.0 -0.984 66.2 33.1-130.7 146.0 21.0 2.8 14.0 91 117 A P S >> S- 0 0 50 0, 0.0 4,-1.9 0, 0.0 3,-0.6 0.632 76.5-127.0 -82.1 179.2 23.9 2.2 14.4 92 118 A X H 3> S+ 0 0 113 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.826 107.6 55.9 -56.3 -39.3 24.3 1.1 18.0 93 119 A E H 3> S+ 0 0 103 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.854 107.9 48.3 -64.6 -37.0 27.1 3.6 18.7 94 120 A L H <> S+ 0 0 14 -3,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.873 110.0 53.4 -68.9 -38.9 24.9 6.5 17.6 95 121 A R H X S+ 0 0 82 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.956 111.8 44.6 -56.9 -52.3 22.1 5.1 19.8 96 122 A L H X S+ 0 0 55 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.895 112.9 50.7 -60.0 -45.3 24.5 5.1 22.8 97 123 A A H X S+ 0 0 32 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.877 109.8 50.8 -62.1 -40.3 25.8 8.6 22.0 98 124 A N H X S+ 0 0 31 -4,-2.4 4,-2.0 2,-0.2 35,-0.4 0.888 110.9 48.1 -64.8 -41.2 22.3 10.0 21.8 99 125 A Q H X S+ 0 0 61 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.949 110.2 51.4 -63.4 -50.4 21.3 8.4 25.2 100 126 A K H X S+ 0 0 122 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.893 111.0 49.7 -50.7 -43.0 24.5 9.8 26.8 101 127 A L H X S+ 0 0 11 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.885 111.4 48.7 -66.5 -39.4 23.6 13.2 25.4 102 128 A G H X S+ 0 0 0 -4,-2.0 4,-1.9 29,-0.5 30,-0.3 0.919 112.0 46.5 -65.9 -47.1 20.0 12.9 26.8 103 129 A N H X S+ 0 0 52 -4,-3.0 4,-2.7 28,-0.4 -2,-0.2 0.887 111.0 53.9 -65.7 -33.8 21.0 11.9 30.2 104 130 A R H X S+ 0 0 116 -4,-2.0 4,-2.3 -5,-0.3 -2,-0.2 0.875 104.3 54.0 -72.4 -35.0 23.6 14.7 30.3 105 131 A F H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.972 113.6 43.3 -54.2 -54.5 21.0 17.4 29.4 106 132 A I H X S+ 0 0 7 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.920 115.8 47.8 -58.3 -46.2 18.8 16.2 32.4 107 133 A K H X S+ 0 0 113 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.794 107.9 54.6 -71.3 -28.6 21.8 15.9 34.7 108 134 A T H X S+ 0 0 7 -4,-2.3 4,-0.8 2,-0.2 -1,-0.2 0.920 110.3 47.2 -68.0 -42.1 23.2 19.3 33.8 109 135 A L H >< S+ 0 0 1 -4,-2.1 3,-0.6 1,-0.2 6,-0.2 0.902 111.8 50.8 -61.5 -42.2 19.8 20.8 34.7 110 136 A Q H 3< S+ 0 0 85 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.815 100.4 62.0 -67.3 -33.2 19.7 18.9 38.0 111 137 A A H 3< S+ 0 0 28 -4,-1.7 2,-1.9 1,-0.2 -1,-0.2 0.782 85.5 82.2 -63.1 -27.0 23.2 20.0 39.0 112 138 A X X< - 0 0 3 -4,-0.8 3,-2.3 -3,-0.6 -1,-0.2 -0.575 66.3-177.1 -79.0 78.0 21.8 23.6 38.9 113 139 A N T 3 S+ 0 0 116 -2,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.689 74.5 60.3 -52.0 -26.3 20.3 23.3 42.5 114 140 A E T 3 S+ 0 0 102 -3,-0.1 2,-0.6 2,-0.1 -1,-0.3 0.371 87.6 86.9 -90.6 4.5 18.7 26.7 42.4 115 141 A L < - 0 0 16 -3,-2.3 2,-0.8 -6,-0.2 -3,-0.0 -0.935 66.9-155.1-103.9 121.0 16.5 25.8 39.3 116 142 A D - 0 0 124 -2,-0.6 3,-0.1 1,-0.1 -3,-0.1 -0.869 10.9-175.9 -98.0 109.7 13.2 24.2 40.2 117 143 A X > - 0 0 11 -2,-0.8 4,-0.5 1,-0.2 -1,-0.1 0.590 41.9-123.7 -81.5 -11.8 12.1 22.1 37.3 118 144 A G H > - 0 0 27 1,-0.1 4,-2.2 2,-0.1 -1,-0.2 -0.042 29.2 -66.2 90.1 166.7 8.8 21.2 39.0 119 145 A E H > S+ 0 0 165 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.864 126.8 49.2 -60.6 -42.7 7.1 18.0 40.0 120 146 A F H > S+ 0 0 40 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.930 111.6 46.9 -69.7 -45.7 6.4 16.7 36.5 121 147 A F H X S+ 0 0 0 -4,-0.5 4,-3.0 1,-0.2 -1,-0.2 0.918 111.7 52.7 -61.9 -41.9 9.9 17.1 35.1 122 148 A N H X S+ 0 0 67 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.910 109.3 48.9 -58.2 -42.6 11.3 15.5 38.3 123 149 A A H X S+ 0 0 42 -4,-2.1 4,-1.2 2,-0.2 -1,-0.2 0.884 111.2 50.4 -64.6 -40.3 9.0 12.5 37.8 124 150 A Y H >X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 3,-0.6 0.940 108.9 51.7 -60.9 -46.7 10.1 12.3 34.1 125 151 A A H 3< S+ 0 0 16 -4,-3.0 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16.5 5.5 -8.3 237 53 B G H X S+ 0 0 36 -4,-0.5 4,-0.5 -3,-0.4 3,-0.5 0.784 113.2 57.2 -66.3 -31.7 17.3 3.5 -11.5 238 54 B L H >X S+ 0 0 3 -4,-1.2 4,-1.1 1,-0.2 3,-0.6 0.793 86.2 78.6 -71.7 -30.4 14.1 4.4 -13.3 239 55 B E H 3X S+ 0 0 128 -4,-1.6 4,-1.5 -3,-0.4 3,-0.4 0.830 93.9 48.2 -50.9 -40.7 14.5 8.2 -13.0 240 56 B T H 3> S+ 0 0 70 -3,-0.5 4,-2.1 -4,-0.4 -1,-0.2 0.862 103.9 60.4 -70.9 -35.5 17.0 8.3 -15.9 241 57 B Y H <<>S+ 0 0 99 -3,-0.6 6,-2.2 -4,-0.5 5,-1.5 0.748 108.4 43.5 -65.4 -27.3 14.9 6.2 -18.3 242 58 B I H ><5S+ 0 0 38 -4,-1.1 3,-1.7 -3,-0.4 -1,-0.2 0.920 113.1 48.2 -84.9 -49.7 12.0 8.7 -18.2 243 59 B Q H 3<5S+ 0 0 139 -4,-1.5 -2,-0.2 1,-0.3 -3,-0.1 0.860 113.4 50.6 -56.0 -37.9 13.9 11.9 -18.6 244 60 B Q T 3<5S- 0 0 149 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.1 0.054 115.7-114.1 -96.6 24.5 15.9 10.4 -21.5 245 61 B K T < 5S+ 0 0 169 -3,-1.7 -3,-0.2 2,-0.2 3,-0.1 0.508 83.0 116.9 68.3 10.4 12.7 9.2 -23.3 246 62 B K S S- 0 0 65 1,-0.0 4,-2.2 134,-0.0 5,-0.2 -0.880 88.9 -76.4-160.6-178.6 4.2 4.1 -22.5 250 66 B K H > S+ 0 0 59 -2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.888 124.5 50.6 -62.4 -41.0 2.9 0.7 -21.3 251 67 B E H > S+ 0 0 109 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.928 113.8 41.8 -67.2 -47.8 4.9 -1.3 -23.8 252 68 B S H > S+ 0 0 16 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.816 113.9 53.7 -71.3 -30.9 8.3 0.4 -23.1 253 69 B A H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.940 109.2 49.0 -63.7 -45.3 7.6 0.3 -19.4 254 70 B L H X S+ 0 0 35 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.924 111.7 49.2 -59.1 -45.6 6.9 -3.5 -19.7 255 71 B E H X S+ 0 0 116 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.911 112.5 47.8 -57.5 -47.2 10.2 -3.9 -21.6 256 72 B Y H X S+ 0 0 23 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.910 112.5 49.1 -62.8 -44.2 12.2 -1.9 -19.0 257 73 B L H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 -2,-0.2 0.920 110.9 48.3 -65.4 -43.5 10.7 -3.9 -16.2 258 74 B K H X S+ 0 0 96 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.909 113.9 48.1 -61.1 -42.7 11.4 -7.3 -17.7 259 75 B A H < S+ 0 0 55 -4,-2.2 4,-0.5 -5,-0.2 -2,-0.2 0.920 114.5 45.4 -64.2 -43.0 15.0 -6.2 -18.4 260 76 B N H ><>S+ 0 0 40 -4,-2.6 5,-1.4 1,-0.2 3,-0.9 0.896 111.1 52.7 -66.9 -42.7 15.5 -4.9 -14.9 261 77 B L H 3<5S+ 0 0 2 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.875 112.5 44.9 -62.2 -36.0 13.9 -7.9 -13.3 262 78 B S T 3<5S+ 0 0 61 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.405 118.4 41.1 -93.3 1.9 16.2 -10.2 -15.1 263 79 B S T X>5S- 0 0 47 -3,-0.9 4,-2.8 -4,-0.5 3,-0.6 0.430 126.1 -4.1-113.0-108.8 19.4 -8.3 -14.6 264 80 B Q H 3>>S+ 0 0 96 1,-0.3 4,-2.1 2,-0.2 5,-1.2 0.857 130.9 55.9 -61.9 -38.5 20.6 -6.5 -11.4 265 81 B F H 34XS+ 0 0 0 -5,-1.4 5,-3.2 3,-0.2 6,-0.3 0.883 116.3 38.2 -61.6 -35.2 17.3 -7.3 -9.5 266 82 B L H <4>S+ 0 0 2 -3,-0.6 5,-2.1 -6,-0.5 -2,-0.2 0.952 121.0 41.0 -76.4 -55.8 17.9 -11.0 -10.2 267 83 B Y H <5S+ 0 0 42 -4,-2.8 148,-2.5 3,-0.1 149,-0.3 0.643 132.6 21.3 -78.3 -13.4 21.7 -11.3 -9.8 268 84 B T T X5S+ 0 0 16 -4,-2.1 4,-2.3 -5,-0.3 -3,-0.2 0.700 130.5 29.4-110.5 -67.4 21.9 -9.0 -6.8 269 85 B E H >S+ 0 0 9 -4,-2.6 5,-2.7 -5,-0.2 4,-0.3 0.882 107.7 56.0 -65.7 -35.2 23.1 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-1.0 -5.3 300 116 B S + 0 0 94 -2,-0.3 2,-0.1 4,-0.1 -3,-0.0 -0.983 65.4 34.1-136.1 147.7 26.9 2.4 -7.0 301 117 B P S >> S- 0 0 45 0, 0.0 4,-2.1 0, 0.0 3,-0.7 0.624 72.6-129.4 -82.4 177.2 26.3 5.3 -6.4 302 118 B X H 3> S+ 0 0 21 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.854 106.9 60.7 -56.9 -36.3 27.0 5.8 -2.7 303 119 B E H 3> S+ 0 0 69 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.889 107.5 44.9 -59.2 -39.7 23.6 7.5 -2.3 304 120 B L H <> S+ 0 0 24 -3,-0.7 4,-2.7 2,-0.2 -1,-0.2 0.904 110.8 53.6 -71.6 -40.6 21.9 4.3 -3.4 305 121 B R H X S+ 0 0 49 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.948 110.7 46.8 -56.0 -49.3 24.2 2.2 -1.2 306 122 B L H X S+ 0 0 36 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.883 111.9 50.6 -62.2 -39.2 23.3 4.3 1.9 307 123 B A H X S+ 0 0 39 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.888 111.1 49.0 -64.4 -40.5 19.6 4.1 1.1 308 124 B N H X S+ 0 0 30 -4,-2.7 4,-2.1 2,-0.2 35,-0.3 0.894 110.7 49.2 -65.8 -40.4 19.8 0.3 0.7 309 125 B Q H X S+ 0 0 54 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.884 110.4 52.2 -66.1 -38.5 21.7 -0.0 4.1 310 126 B K H X S+ 0 0 86 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.935 109.0 49.6 -64.3 -44.9 19.0 2.2 5.7 311 127 B L H X S+ 0 0 13 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.903 111.8 48.2 -59.7 -43.3 16.2 -0.0 4.4 312 128 B G H X S+ 0 0 0 -4,-2.1 4,-2.1 29,-0.5 30,-0.2 0.943 112.0 48.4 -65.0 -46.6 17.9 -3.2 5.6 313 129 B N H X S+ 0 0 38 -4,-2.8 4,-2.7 28,-0.3 -2,-0.2 0.915 111.8 50.1 -57.0 -43.0 18.5 -1.8 9.1 314 130 B R H X S+ 0 0 39 -4,-2.6 4,-2.6 -85,-0.2 5,-0.2 0.873 107.2 54.5 -68.3 -34.4 14.9 -0.6 9.3 315 131 B F H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.961 111.9 44.0 -61.0 -48.6 13.6 -4.0 8.3 316 132 B I H X S+ 0 0 5 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.941 115.2 48.1 -61.5 -46.6 15.6 -5.7 11.1 317 133 B K H X S+ 0 0 58 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.870 108.5 53.9 -65.7 -35.5 14.6 -3.0 13.7 318 134 B T H X S+ 0 0 26 -4,-2.6 4,-0.7 1,-0.2 -1,-0.2 0.916 110.3 47.0 -68.4 -39.5 10.9 -3.2 12.7 319 135 B L H >< S+ 0 0 1 -4,-2.0 3,-1.1 -5,-0.2 6,-0.2 0.933 112.2 50.5 -61.2 -44.1 10.9 -6.9 13.3 320 136 B Q H 3< S+ 0 0 76 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.801 99.8 63.9 -68.8 -27.4 12.8 -6.5 16.6 321 137 B A H 3< S+ 0 0 44 -4,-2.1 2,-1.8 1,-0.2 -1,-0.3 0.745 83.5 81.6 -66.3 -22.3 10.3 -3.9 17.8 322 138 B X X< - 0 0 54 -3,-1.1 3,-2.2 -4,-0.7 -1,-0.2 -0.639 65.9-177.1 -83.7 83.4 7.6 -6.6 17.7 323 139 B N T 3 S+ 0 0 135 -2,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.671 74.1 63.2 -59.0 -21.8 8.6 -8.0 21.1 324 140 B E T 3 S+ 0 0 138 -3,-0.1 2,-0.5 2,-0.1 -1,-0.3 0.391 88.4 83.5 -88.9 5.2 6.1 -10.8 20.9 325 141 B L < - 0 0 17 -3,-2.2 2,-0.7 -6,-0.2 -115,-0.1 -0.947 69.1-154.1-106.4 122.1 7.8 -12.3 17.8 326 142 B D - 0 0 58 -2,-0.5 3,-0.1 1,-0.1 -116,-0.1 -0.860 10.9-175.5 -97.4 110.3 10.8 -14.5 18.6 327 143 B X > - 0 0 9 -2,-0.7 4,-0.5 1,-0.2 -1,-0.1 0.585 42.4-120.6 -81.2 -10.9 13.2 -14.5 15.7 328 144 B G H > - 0 0 25 1,-0.1 4,-2.4 2,-0.1 -1,-0.2 0.063 28.0 -73.4 88.0 161.1 15.5 -17.1 17.3 329 145 B E H > S+ 0 0 128 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.865 125.8 55.2 -64.3 -36.7 19.1 -17.0 18.3 330 146 B F H > S+ 0 0 35 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.955 110.9 45.1 -64.7 -45.7 20.6 -17.2 14.8 331 147 B F H X S+ 0 0 0 -4,-0.5 4,-3.0 1,-0.2 -1,-0.2 0.915 110.8 55.3 -59.7 -40.8 18.6 -14.1 13.7 332 148 B N H X S+ 0 0 52 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.920 110.0 45.7 -56.8 -44.5 19.6 -12.4 16.9 333 149 B A H X S+ 0 0 19 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.899 111.3 51.8 -66.1 -42.0 23.2 -13.0 16.1 334 150 B Y H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 3,-0.4 0.931 109.9 49.3 -59.2 -46.8 22.9 -11.9 12.5 335 151 B A H < S+ 0 0 20 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.850 110.4 51.5 -63.6 -32.7 21.2 -8.6 13.7 336 152 B Q H < S+ 0 0 141 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.793 120.2 33.4 -69.5 -32.1 24.1 -8.0 16.2 337 153 B K H < S+ 0 0 103 -4,-1.5 -2,-0.2 -3,-0.4 -1,-0.2 0.668 84.1 113.9-102.8 -23.8 26.8 -8.5 13.6 338 154 B T < + 0 0 18 -4,-2.5 -49,-0.0 -5,-0.2 -4,-0.0 -0.269 29.4 172.0 -59.0 135.8 25.4 -7.2 10.3 339 155 B K S S+ 0 0 151 -50,-0.1 -1,-0.2 1,-0.1 -50,-0.0 0.670 79.1 27.3-109.2 -34.6 27.3 -4.1 9.0 340 156 B D S 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