==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 25-SEP-12 4HA6 . COMPND 2 MOLECULE: PYRIDOXINE 4-OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MESORHIZOBIUM LOTI; . AUTHOR A.N.MUGO,J.KOBAYASHI,B.MIKAMI,T.YAGI . 508 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18717.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 327 64.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 33 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 14.6 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 42 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 18.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 1 1 0 0 0 1 4 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 2 1 3 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 . 8 2 3 0 1 3 1 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 . 5 3 0 0 1 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 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 17 A N 0 0 73 0, 0.0 28,-0.3 0, 0.0 208,-0.0 0.000 360.0 360.0 360.0 -99.8 -1.8 17.9 -37.7 2 18 A C + 0 0 60 1,-0.1 243,-1.7 242,-0.1 244,-0.2 0.792 360.0 49.2 -81.4 -36.1 -0.2 21.3 -36.9 3 19 A D S S+ 0 0 38 24,-0.4 243,-1.6 1,-0.3 2,-0.4 0.973 118.8 8.4 -76.0 -55.0 -3.1 23.8 -36.5 4 20 A I E -ab 28 246A 1 23,-2.6 25,-2.4 241,-0.2 2,-0.5 -0.992 56.5-161.7-134.3 133.7 -5.5 22.0 -34.1 5 21 A V E -ab 29 247A 0 241,-2.6 243,-2.8 -2,-0.4 2,-0.5 -0.954 8.7-158.2-112.2 127.4 -5.2 18.8 -32.0 6 22 A I E -ab 30 248A 0 23,-3.3 25,-3.1 -2,-0.5 2,-0.8 -0.914 7.2-151.8-103.9 123.4 -8.4 17.2 -30.6 7 23 A V E +ab 31 249A 9 241,-2.8 243,-3.0 -2,-0.5 25,-0.2 -0.836 68.0 23.9 -99.6 110.0 -7.9 14.9 -27.6 8 24 A G - 0 0 10 23,-3.1 2,-0.5 -2,-0.8 24,-0.2 0.508 62.6-141.1 103.7 113.3 -10.5 12.2 -27.5 9 25 A G + 0 0 0 4,-0.1 73,-3.6 21,-0.1 74,-0.3 -0.341 62.7 113.5 -98.5 50.2 -12.5 10.8 -30.4 10 26 A G S > S- 0 0 12 240,-0.5 4,-2.1 -2,-0.5 73,-0.2 0.310 88.0 -50.0 -96.7-138.3 -15.8 10.4 -28.6 11 27 A S H > S+ 0 0 15 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.993 140.2 32.4 -66.2 -57.9 -19.1 12.2 -29.2 12 28 A A H > S+ 0 0 4 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.859 120.9 52.1 -64.5 -41.8 -17.8 15.7 -29.1 13 29 A G H > S+ 0 0 0 237,-0.4 4,-2.8 2,-0.2 5,-0.2 0.890 107.0 51.3 -63.9 -42.3 -14.4 14.7 -30.6 14 30 A S H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.941 112.4 47.3 -62.9 -44.2 -16.0 12.9 -33.6 15 31 A L H X S+ 0 0 0 -4,-1.7 4,-2.7 -5,-0.2 -1,-0.2 0.852 114.4 47.0 -60.7 -40.6 -18.1 16.0 -34.4 16 32 A L H X>S+ 0 0 0 -4,-1.9 4,-3.2 2,-0.2 5,-0.5 0.927 105.5 56.4 -72.7 -47.5 -15.2 18.4 -34.0 17 33 A A H X5S+ 0 0 0 -4,-2.8 4,-1.2 1,-0.2 -2,-0.2 0.918 115.8 40.3 -47.3 -48.1 -12.8 16.3 -36.2 18 34 A A H <5S+ 0 0 2 -4,-1.7 4,-0.4 -5,-0.2 -2,-0.2 0.970 120.0 42.7 -63.3 -55.2 -15.3 16.5 -39.0 19 35 A R H ><5S+ 0 0 39 -4,-2.7 3,-1.1 1,-0.2 4,-0.3 0.898 113.9 47.6 -68.9 -43.4 -16.4 20.1 -38.4 20 36 A L H ><5S+ 0 0 0 -4,-3.2 3,-1.6 1,-0.2 -1,-0.2 0.913 108.5 56.3 -62.7 -40.6 -13.0 21.8 -37.9 21 37 A S T 3< - 0 0 33 1,-0.2 3,-1.0 2,-0.1 4,-0.2 -0.530 56.5-157.3 -67.4 118.0 -17.5 -5.7 -32.7 40 56 A P G > S+ 0 0 97 0, 0.0 3,-1.4 0, 0.0 4,-0.4 0.738 85.4 73.5 -72.2 -24.9 -20.8 -6.0 -34.7 41 57 A D G > S+ 0 0 64 1,-0.2 3,-1.1 2,-0.2 6,-0.3 0.763 81.2 76.5 -57.0 -26.4 -23.0 -6.0 -31.5 42 58 A I G < S+ 0 0 1 -3,-1.0 -1,-0.2 1,-0.3 5,-0.1 0.816 95.7 44.5 -55.0 -36.0 -22.2 -2.3 -31.3 43 59 A W G < S+ 0 0 62 -3,-1.4 149,-2.1 -4,-0.2 -1,-0.3 0.502 89.6 95.5 -93.0 -5.5 -24.7 -1.4 -34.0 44 60 A N X - 0 0 78 -3,-1.1 3,-2.2 -4,-0.4 4,-0.3 -0.799 65.5-156.0 -85.3 106.5 -27.4 -3.7 -32.7 45 61 A P G > S+ 0 0 12 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.832 91.1 54.9 -53.7 -38.9 -29.6 -1.3 -30.5 46 62 A A G 3 S+ 0 0 33 1,-0.2 4,-0.1 2,-0.1 266,-0.1 0.440 100.5 61.9 -76.1 -2.2 -30.9 -4.2 -28.4 47 63 A A G X> + 0 0 14 -3,-2.2 4,-1.0 -6,-0.3 3,-0.8 0.434 67.9 109.3-103.5 -0.4 -27.4 -5.3 -27.5 48 64 A W T <4 S+ 0 0 33 -3,-1.1 3,-0.5 -4,-0.3 4,-0.4 0.801 76.4 50.0 -50.4 -41.4 -26.2 -2.1 -25.7 49 65 A P T >4 S+ 0 0 57 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 0.886 105.1 57.5 -68.1 -34.6 -26.2 -3.5 -22.1 50 66 A A T <4 S+ 0 0 62 -3,-0.8 -2,-0.2 1,-0.3 -3,-0.1 0.734 92.4 72.8 -64.5 -23.8 -24.1 -6.6 -23.2 51 67 A L T >< S+ 0 0 0 -4,-1.0 3,-1.4 -3,-0.5 -1,-0.3 0.769 77.6 97.6 -58.0 -30.3 -21.4 -4.1 -24.5 52 68 A Q T < S+ 0 0 79 -3,-1.4 3,-0.1 -4,-0.4 24,-0.0 -0.308 82.8 24.0 -67.0 144.7 -20.5 -3.2 -20.9 53 69 A G T 3 S+ 0 0 60 1,-0.3 -1,-0.2 2,-0.0 -2,-0.1 0.420 96.3 124.1 80.6 -2.9 -17.4 -5.0 -19.4 54 70 A R S X S- 0 0 71 -3,-1.4 3,-1.3 1,-0.1 -1,-0.3 -0.229 81.0 -86.7 -80.3 179.6 -16.0 -5.6 -22.9 55 71 A S T 3 S+ 0 0 105 1,-0.3 -1,-0.1 -3,-0.1 -3,-0.0 0.768 122.6 51.5 -61.0 -34.2 -12.6 -4.4 -24.1 56 72 A Y T 3 S+ 0 0 29 -5,-0.2 23,-3.2 -22,-0.1 2,-0.5 0.011 89.6 94.7 -98.3 27.3 -13.5 -0.9 -25.3 57 73 A D B < -G 78 0C 9 -3,-1.3 21,-0.2 21,-0.2 19,-0.1 -0.985 63.1-152.1-122.4 121.5 -15.2 0.1 -22.0 58 74 A W - 0 0 60 19,-2.7 18,-0.1 -2,-0.5 -1,-0.1 0.853 22.0-161.1 -60.4 -39.3 -13.2 2.0 -19.3 59 75 A D - 0 0 68 18,-0.2 17,-0.2 16,-0.1 2,-0.1 0.952 9.9-166.3 56.0 61.5 -15.3 0.6 -16.5 60 76 A Y E -H 75 0D 25 15,-2.1 15,-3.2 14,-0.0 2,-0.5 -0.385 10.1-142.0 -73.4 156.5 -14.5 3.0 -13.7 61 77 A R E -H 74 0D 125 13,-0.2 323,-0.4 321,-0.2 13,-0.2 -0.981 12.6-143.8-122.8 122.9 -15.4 2.2 -10.1 62 78 A T - 0 0 0 11,-2.9 323,-0.2 -2,-0.5 3,-0.1 -0.393 29.6 -92.9 -77.3 162.1 -16.7 5.0 -7.8 63 79 A E - 0 0 60 321,-2.9 10,-0.4 1,-0.1 -1,-0.1 -0.267 60.3 -77.3 -55.5 157.9 -15.9 5.3 -4.1 64 80 A A - 0 0 62 8,-0.2 2,-0.6 1,-0.1 8,-0.3 -0.393 51.3-134.5 -53.5 136.3 -18.4 3.7 -1.7 65 81 A Q B > > -I 71 0E 1 6,-2.2 3,-1.9 3,-0.2 5,-1.9 -0.882 15.7-163.7-109.1 112.7 -21.5 6.0 -1.5 66 82 A A G > 5S+ 0 0 85 -2,-0.6 3,-0.7 1,-0.3 -1,-0.1 0.801 94.4 55.8 -56.4 -33.0 -22.9 6.7 2.0 67 83 A G G 3 5S+ 0 0 9 321,-0.3 -1,-0.3 1,-0.3 -2,-0.0 0.579 106.8 50.2 -79.9 -10.8 -26.1 8.0 0.4 68 84 A T G X 5S- 0 0 0 -3,-1.9 3,-2.2 3,-0.2 -1,-0.3 -0.366 131.3 -83.0-122.3 54.9 -26.6 4.8 -1.6 69 85 A A T < 5S- 0 0 54 -3,-0.7 -3,-0.2 1,-0.3 -2,-0.1 0.785 83.2 -63.1 56.4 34.4 -26.3 2.3 1.3 70 86 A G T 3 S-f 35 0B 3 -46,-0.3 3,-3.1 -2,-0.2 -44,-0.2 -0.928 103.5 -49.5 177.8 166.7 -12.8 3.6 -29.0 81 97 A I T 3 S+ 0 0 0 -46,-2.0 -71,-0.2 1,-0.3 -2,-0.1 -0.385 131.1 30.0 -57.8 121.4 -13.6 5.8 -32.0 82 98 A G T > S- 0 0 0 -73,-3.6 3,-1.6 -2,-0.1 113,-0.3 0.123 96.2-153.2 108.9 -20.0 -17.1 7.2 -31.1 83 99 A G G X - 0 0 4 -3,-3.1 3,-1.4 -74,-0.3 4,-0.3 -0.226 66.9 -6.2 60.6-132.5 -16.5 7.0 -27.4 84 100 A S G >> S+ 0 0 33 -6,-0.3 4,-0.9 1,-0.3 3,-0.7 0.632 122.9 77.0 -75.4 -14.8 -19.6 6.6 -25.1 85 101 A S G <4 S+ 0 0 0 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.722 88.9 57.8 -65.0 -22.8 -21.8 7.0 -28.2 86 102 A X G <4 S+ 0 0 6 -3,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.780 111.4 40.9 -73.2 -27.6 -20.8 3.3 -29.0 87 103 A L T <4 S+ 0 0 16 -3,-0.7 -2,-0.2 -4,-0.3 -1,-0.2 0.462 93.4 133.9-102.8 -11.9 -22.2 2.2 -25.6 88 104 A H < - 0 0 27 -4,-0.9 -3,-0.1 1,-0.1 -40,-0.0 0.260 64.7-139.4 -25.2 151.8 -25.3 4.5 -25.7 89 105 A A - 0 0 34 2,-0.1 225,-0.1 -41,-0.0 -1,-0.1 0.274 48.7-131.8 -90.9 5.1 -28.9 3.6 -25.0 90 106 A M + 0 0 1 1,-0.2 96,-2.3 95,-0.1 2,-0.2 0.570 51.1 154.6 52.7 20.5 -29.2 5.9 -28.0 91 107 A G B -J 185 0F 10 94,-0.2 2,-0.6 221,-0.1 94,-0.2 -0.519 32.6-150.5 -70.8 139.5 -31.9 8.1 -26.5 92 108 A Y + 0 0 0 92,-2.3 92,-0.4 -2,-0.2 2,-0.4 -0.939 28.4 156.3-117.2 107.9 -32.0 11.7 -27.9 93 109 A M - 0 0 3 -2,-0.6 399,-0.4 395,-0.3 398,-0.4 -0.963 26.5-164.1-131.2 113.9 -33.2 14.4 -25.5 94 110 A R - 0 0 0 -2,-0.4 2,-0.2 1,-0.2 -1,-0.1 0.921 44.5-122.7 -59.3 -42.4 -32.2 18.0 -26.0 95 111 A G - 0 0 1 77,-0.3 -1,-0.2 390,-0.1 80,-0.2 -0.683 33.8 -61.5 117.2 178.4 -33.2 19.0 -22.5 96 112 A H >> - 0 0 18 -2,-0.2 3,-2.1 -3,-0.1 4,-0.9 -0.821 42.6-117.5-104.4 143.1 -35.7 21.6 -21.4 97 113 A P H >> S+ 0 0 34 0, 0.0 4,-1.4 0, 0.0 3,-0.6 0.813 115.0 57.9 -47.0 -39.8 -35.3 25.3 -22.1 98 114 A S H 3> S+ 0 0 52 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.791 96.4 63.8 -63.3 -28.9 -35.0 26.2 -18.4 99 115 A D H <> S+ 0 0 0 -3,-2.1 4,-0.6 1,-0.2 -1,-0.2 0.893 107.5 42.6 -57.8 -40.9 -32.0 23.8 -18.2 100 116 A F H - 0 0 47 -5,-0.5 3,-1.6 -6,-0.3 -1,-0.2 -0.975 61.6-151.1-132.2 125.8 -23.5 34.4 -22.3 110 126 A R G > S+ 0 0 175 -2,-0.4 3,-2.1 1,-0.3 6,-0.5 0.635 87.6 81.2 -61.3 -22.0 -26.8 34.2 -24.3 111 127 A R G 3 S+ 0 0 48 1,-0.3 -1,-0.3 5,-0.1 -7,-0.1 0.712 87.5 56.8 -61.5 -19.2 -25.3 31.7 -26.8 112 128 A W G < S+ 0 0 0 -3,-1.6 -1,-0.3 4,-0.1 -8,-0.2 0.242 87.5 103.7 -98.6 9.4 -26.0 28.9 -24.3 113 129 A G S <> S- 0 0 9 -3,-2.1 4,-2.6 -10,-0.1 3,-0.4 -0.578 85.2-108.8 -91.4 157.7 -29.7 29.6 -24.1 114 130 A W H > S+ 0 0 26 -17,-0.4 4,-2.1 1,-0.2 -1,-0.1 0.869 116.1 55.3 -50.2 -45.4 -32.4 27.6 -25.7 115 131 A D H 4 S+ 0 0 135 1,-0.2 -1,-0.2 2,-0.2 -4,-0.1 0.896 114.9 37.8 -59.3 -43.4 -33.2 30.3 -28.3 116 132 A E H 4 S+ 0 0 87 -6,-0.5 4,-0.5 -3,-0.4 -1,-0.2 0.802 115.8 53.6 -79.7 -29.5 -29.6 30.5 -29.6 117 133 A L H >X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 3,-0.9 0.787 90.1 81.3 -72.4 -25.9 -29.1 26.7 -29.2 118 134 A L H 3X S+ 0 0 31 -4,-2.1 4,-2.6 1,-0.3 -1,-0.2 0.906 93.5 43.4 -49.4 -52.7 -32.2 26.1 -31.4 119 135 A P H 3> S+ 0 0 56 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.772 113.7 55.2 -65.3 -22.8 -30.4 26.6 -34.7 120 136 A V H <> S+ 0 0 8 -3,-0.9 4,-1.4 -4,-0.5 -2,-0.2 0.948 108.9 44.0 -73.1 -50.7 -27.5 24.5 -33.3 121 137 A F H >X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 3,-0.8 0.951 113.7 53.4 -54.3 -49.6 -29.7 21.5 -32.5 122 138 A Q H 3< S+ 0 0 51 -4,-2.6 -1,-0.2 -5,-0.3 15,-0.2 0.854 105.1 53.1 -55.3 -40.0 -31.4 21.9 -35.9 123 139 A A H 3< S+ 0 0 39 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.808 113.5 45.3 -64.9 -28.6 -28.0 21.9 -37.7 124 140 A I H << S+ 0 0 2 -4,-1.4 17,-2.4 -3,-0.8 -2,-0.2 0.875 102.0 81.5 -80.0 -37.6 -27.3 18.6 -35.9 125 141 A E E < -l 141 0G 0 -4,-2.3 14,-1.6 15,-0.2 2,-0.5 -0.432 48.0-170.0 -84.8 137.9 -30.6 16.9 -36.4 126 142 A D E +l 142 0G 40 15,-2.7 17,-2.7 12,-0.3 11,-0.2 -0.880 38.4 171.5-111.5 95.5 -32.1 14.9 -39.3 127 143 A H > - 0 0 9 9,-2.6 3,-1.9 -2,-0.5 11,-0.1 -0.795 46.4-131.2-113.8 143.6 -35.6 14.8 -37.8 128 144 A P T 3 S+ 0 0 85 0, 0.0 -1,-0.1 0, 0.0 16,-0.1 0.755 113.6 51.0 -66.1 -21.1 -38.9 13.6 -39.3 129 145 A L T > S+ 0 0 43 7,-0.1 3,-1.5 2,-0.0 6,-0.4 0.322 81.6 138.5 -92.1 4.2 -40.5 16.9 -38.0 130 146 A G T < + 0 0 21 -3,-1.9 6,-0.2 6,-0.4 7,-0.1 -0.238 57.9 44.1 -51.1 132.5 -37.7 18.9 -39.7 131 147 A G T 3 S+ 0 0 66 4,-1.1 -1,-0.3 6,-0.1 5,-0.1 0.263 79.4 102.7 110.4 -10.4 -39.2 22.0 -41.3 132 148 A D S < S- 0 0 73 -3,-1.5 -2,-0.1 3,-0.2 4,-0.1 0.377 97.8-111.8 -83.9 4.7 -41.5 22.9 -38.4 133 149 A G S S+ 0 0 58 2,-0.4 -3,-0.1 -4,-0.1 3,-0.1 0.419 108.0 63.3 79.8 -2.9 -39.1 25.6 -37.4 134 150 A I S S+ 0 0 60 -5,-0.3 2,-0.2 1,-0.2 -12,-0.1 0.730 93.7 49.9-117.1 -51.0 -38.2 23.6 -34.2 135 151 A H S S- 0 0 9 -6,-0.4 -4,-1.1 1,-0.1 -2,-0.4 -0.606 88.2-103.9 -94.2 157.5 -36.7 20.3 -35.2 136 152 A G - 0 0 2 -2,-0.2 -9,-2.6 -6,-0.2 2,-0.4 -0.465 25.5-158.0 -85.1 149.8 -33.8 20.0 -37.6 137 153 A K S S+ 0 0 159 -11,-0.2 -11,-0.2 -15,-0.2 -12,-0.1 -0.993 71.3 6.0-125.6 131.2 -33.9 18.8 -41.2 138 154 A G S S+ 0 0 65 -2,-0.4 -12,-0.3 1,-0.2 -1,-0.1 0.654 85.4 142.9 81.1 16.7 -31.0 17.4 -43.2 139 155 A G - 0 0 14 -14,-1.6 -1,-0.2 2,-0.2 -15,-0.2 -0.366 63.5-106.6 -85.5 171.2 -28.5 17.2 -40.4 140 156 A P S S+ 0 0 54 0, 0.0 -15,-0.2 0, 0.0 -16,-0.1 0.731 99.4 72.6 -72.9 -22.5 -25.9 14.5 -40.0 141 157 A L E S-l 125 0G 0 -17,-2.4 -15,-2.7 58,-0.0 -2,-0.2 -0.847 77.5-139.4-101.4 109.5 -27.6 12.8 -37.0 142 158 A P E -l 126 0G 8 0, 0.0 2,-0.5 0, 0.0 -15,-0.2 -0.430 12.6-159.8 -63.5 133.3 -30.8 10.8 -37.7 143 159 A I - 0 0 3 -17,-2.7 2,-0.4 43,-0.2 43,-0.2 -0.983 8.9-158.9-113.6 122.5 -33.5 11.2 -35.1 144 160 A H B -K 185 0F 52 41,-3.3 41,-2.3 -2,-0.5 -52,-0.1 -0.845 10.7-155.8-105.8 135.2 -36.1 8.5 -35.2 145 161 A L - 0 0 38 -2,-0.4 39,-0.1 39,-0.2 38,-0.1 -0.900 22.5-145.9-105.6 100.7 -39.6 8.8 -33.7 146 162 A P + 0 0 9 0, 0.0 165,-0.0 0, 0.0 -2,-0.0 -0.392 39.8 139.3 -69.9 143.7 -40.7 5.2 -33.0 147 163 A A S > S+ 0 0 58 -2,-0.1 3,-1.8 3,-0.0 0, 0.0 0.269 70.4 35.1-139.0 -75.5 -44.4 4.3 -33.4 148 164 A D T 3 S+ 0 0 157 1,-0.3 0, 0.0 3,-0.0 0, 0.0 0.875 119.7 51.5 -55.0 -39.7 -45.2 0.9 -34.9 149 165 A E T 3 S+ 0 0 56 161,-0.1 161,-0.5 2,-0.1 -1,-0.3 0.466 80.2 120.7 -83.7 1.4 -42.2 -0.7 -33.3 150 166 A V S < S- 0 0 6 -3,-1.8 5,-0.1 1,-0.1 159,-0.0 -0.467 73.1-106.7 -66.4 130.7 -43.1 0.5 -29.8 151 167 A S > - 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0 0 33 -152,-2.8 -151,-0.1 -2,-0.1 -1,-0.1 0.407 47.2-113.7 -90.3 -1.1 -28.1 6.8 -15.6 445 461 A H S S+ 0 0 55 -153,-0.4 44,-0.1 1,-0.1 -152,-0.1 0.776 78.2 123.6 76.1 35.8 -24.7 7.3 -17.3 446 462 A H + 0 0 15 -154,-0.3 -156,-0.1 42,-0.1 -1,-0.1 -0.351 29.6 168.6-122.1 51.5 -24.6 11.1 -17.6 447 463 A P + 0 0 2 0, 0.0 -194,-0.3 0, 0.0 2,-0.3 -0.415 19.5 135.5 -67.0 143.2 -21.4 12.3 -15.8 448 464 A C B +Y 290 0N 0 -158,-1.5 -158,-2.6 -195,-0.1 31,-0.3 -0.961 25.0 68.3-169.0 168.4 -20.6 16.0 -16.4 449 465 A G > + 0 0 0 29,-1.8 3,-0.8 -2,-0.3 30,-0.2 0.355 54.3 122.3 98.3 -2.6 -19.5 19.3 -14.9 450 466 A T T 3 S+ 0 0 0 1,-0.3 -164,-3.2 -164,-0.1 -163,-0.4 0.495 84.4 36.2 -81.5 -6.5 -15.9 18.6 -13.9 451 467 A C T 3 S- 0 0 0 28,-2.8 -1,-0.3 -166,-0.2 10,-0.2 -0.463 97.1-159.5-131.6 60.4 -14.4 21.5 -16.0 452 468 A R < - 0 0 41 -3,-0.8 9,-1.8 -168,-0.4 8,-1.6 -0.070 12.7-133.6 -60.4 134.6 -17.4 23.8 -15.4 453 469 A M B +a 461 0P 1 27,-2.6 2,-0.3 7,-0.2 9,-0.2 -0.675 44.4 146.8 -74.7 134.7 -18.0 26.7 -17.7 454 470 A G - 0 0 0 7,-2.5 -347,-0.3 -2,-0.4 -348,-0.1 -0.982 55.4-130.7-166.5 159.5 -18.7 29.9 -15.7 455 471 A K S S+ 0 0 132 -349,-2.4 -348,-0.1 -2,-0.3 7,-0.1 0.565 80.0 98.1 -89.9 -10.5 -18.2 33.7 -15.7 456 472 A D S > S- 0 0 59 -350,-0.3 3,-1.7 1,-0.1 -2,-0.1 -0.407 88.9-107.2 -80.0 157.0 -16.8 33.8 -12.1 457 473 A P T 3 S+ 0 0 120 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.787 115.1 47.3 -60.0 -32.0 -13.0 33.9 -11.6 458 474 A D T 3 S+ 0 0 94 -176,-0.0 -174,-0.4 -175,-0.0 -3,-0.1 0.307 80.1 119.3 -97.0 10.3 -12.6 30.3 -10.5 459 475 A A < - 0 0 0 -3,-1.7 9,-0.2 1,-0.1 -6,-0.2 -0.347 67.5-129.5 -60.1 153.3 -14.6 28.6 -13.2 460 476 A V S S+ 0 0 0 -8,-1.6 8,-2.1 -176,-0.2 9,-0.3 0.927 86.4 18.0 -77.8 -44.3 -12.5 26.2 -15.3 461 477 A V B S-aB 453 467P 0 -9,-1.8 -7,-2.5 6,-0.3 6,-0.2 -0.883 75.4-129.3-122.7 157.7 -13.6 27.6 -18.7 462 478 A D > - 0 0 27 4,-1.7 3,-1.9 -2,-0.3 -7,-0.1 -0.212 48.8 -79.9 -87.5-169.2 -15.1 30.8 -19.8 463 479 A A T 3 S+ 0 0 13 1,-0.3 -8,-0.1 -356,-0.3 -356,-0.1 0.657 132.9 56.1 -71.1 -18.1 -18.2 31.1 -22.1 464 480 A N T 3 S- 0 0 66 2,-0.1 -1,-0.3 39,-0.0 3,-0.1 0.373 118.3-113.5 -90.6 0.6 -16.0 30.5 -25.1 465 481 A L < + 0 0 0 -3,-1.9 10,-2.5 1,-0.3 2,-0.5 0.617 68.4 144.4 75.6 18.3 -14.8 27.2 -23.5 466 482 A R B -E 474 0A 66 8,-0.2 -4,-1.7 1,-0.1 -1,-0.3 -0.740 61.5-110.6 -88.3 127.5 -11.2 28.4 -23.1 467 483 A L B > -B 461 0P 0 6,-2.4 3,-1.8 -2,-0.5 -6,-0.3 -0.435 31.7-131.6 -53.5 124.6 -9.4 27.3 -19.9 468 484 A K T 3 S+ 0 0 52 -8,-2.1 -1,-0.2 1,-0.3 -7,-0.1 0.756 99.3 53.5 -60.3 -26.2 -9.2 30.6 -18.0 469 485 A A T 3 S+ 0 0 36 -9,-0.3 2,-0.3 -189,-0.0 -1,-0.3 0.508 108.3 49.2 -89.3 -2.8 -5.5 30.3 -17.2 470 486 A L < - 0 0 1 -3,-1.8 -243,-0.2 3,-0.2 3,-0.1 -0.914 65.4-138.4-138.4 161.7 -4.2 29.7 -20.8 471 487 A D S S+ 0 0 93 -245,-3.1 -244,-0.2 -2,-0.3 -1,-0.1 0.761 96.1 30.3 -90.8 -27.1 -4.5 31.2 -24.3 472 488 A N S S+ 0 0 3 -246,-0.4 -225,-2.4 -226,-0.1 2,-0.5 0.112 92.5 97.0-128.9 24.7 -4.8 28.1 -26.6 473 489 A L E -d 247 0A 0 -6,-0.3 -6,-2.4 -227,-0.2 2,-0.3 -0.969 44.5-178.6-121.0 127.3 -6.5 25.4 -24.6 474 490 A F E -dE 248 466A 29 -227,-2.8 -225,-2.9 -2,-0.5 2,-0.5 -0.859 19.5-148.3-122.3 152.3 -10.2 24.6 -24.9 475 491 A V E +d 249 0A 0 -10,-2.5 2,-0.4 -2,-0.3 -225,-0.2 -0.975 22.5 170.8-120.8 113.2 -12.4 22.1 -23.1 476 492 A V + 0 0 0 -227,-2.9 2,-0.2 -2,-0.5 -2,-0.0 -0.684 40.6 69.5-131.8 79.6 -15.3 20.9 -25.3 477 493 A D S > S- 0 0 3 -2,-0.4 3,-1.6 -465,-0.1 4,-0.3 -0.883 99.7 -55.9-164.9-164.7 -17.2 18.0 -23.9 478 494 A A G > S+ 0 0 11 1,-0.3 -29,-1.8 -2,-0.2 3,-1.0 0.697 117.3 76.2 -64.3 -19.3 -19.6 17.0 -21.1 479 495 A S G 3 S+ 0 0 0 -31,-0.3 -28,-2.8 1,-0.2 -1,-0.3 0.797 88.6 56.9 -63.8 -27.9 -17.2 18.3 -18.5 480 496 A I G < S+ 0 0 0 -3,-1.6 -27,-2.6 -28,-0.2 -1,-0.2 0.688 74.5 121.0 -78.4 -15.5 -18.0 22.0 -19.2 481 497 A M < - 0 0 0 -3,-1.0 3,-0.1 -4,-0.3 -30,-0.1 -0.263 53.2-155.0 -52.9 118.1 -21.8 21.6 -18.4 482 498 A P S S- 0 0 12 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.909 78.4 -2.7 -59.7 -41.1 -22.7 24.0 -15.6 483 499 A N S S- 0 0 27 -384,-0.1 -34,-0.1 -193,-0.0 -380,-0.1 -0.993 84.3 -90.4-149.9 152.3 -25.6 21.7 -14.8 484 500 A L - 0 0 1 -2,-0.3 2,-0.1 -119,-0.2 -193,-0.0 -0.243 38.2-124.1 -48.9 139.4 -27.3 18.5 -16.0 485 501 A T - 0 0 0 2,-0.3 -390,-0.1 -392,-0.1 4,-0.1 -0.366 39.0 -96.7 -72.0 171.6 -30.1 18.8 -18.5 486 502 A A S S+ 0 0 2 -2,-0.1 3,-0.1 -390,-0.1 -1,-0.1 0.824 101.1 9.4 -63.5 -32.5 -33.3 17.2 -17.3 487 503 A G S S- 0 0 1 1,-0.3 -2,-0.3 -394,-0.1 -391,-0.1 -0.408 116.3 -12.9-129.6-157.8 -32.7 13.9 -19.2 488 504 A P - 0 0 15 0, 0.0 -1,-0.3 0, 0.0 3,-0.3 -0.133 55.8-147.8 -51.8 142.1 -29.9 12.2 -21.2 489 505 A I > + 0 0 10 1,-0.2 4,-2.3 2,-0.1 5,-0.2 0.363 69.0 97.9-100.5 0.1 -27.1 14.5 -22.1 490 506 A H H > S+ 0 0 16 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.918 85.4 52.7 -61.0 -40.8 -25.7 13.4 -25.4 491 507 A A H > S+ 0 0 1 -398,-0.4 4,-2.8 -3,-0.3 -1,-0.2 0.917 111.1 48.9 -58.7 -41.8 -27.7 16.0 -27.4 492 508 A A H > S+ 0 0 0 -399,-0.4 4,-2.8 -4,-0.2 -1,-0.2 0.874 108.2 51.6 -65.4 -41.7 -26.3 18.6 -25.1 493 509 A V H X S+ 0 0 13 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.901 112.4 47.6 -61.9 -39.3 -22.7 17.4 -25.5 494 510 A L H X S+ 0 0 0 -4,-2.4 4,-3.0 -5,-0.2 -2,-0.2 0.925 110.0 51.6 -70.3 -41.2 -23.2 17.6 -29.3 495 511 A A H X S+ 0 0 1 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.922 109.0 52.2 -59.2 -41.5 -24.7 21.0 -29.0 496 512 A I H X S+ 0 0 0 -4,-2.8 4,-1.7 2,-0.2 -1,-0.2 0.913 111.7 45.9 -58.3 -43.3 -21.6 22.1 -27.0 497 513 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.948 111.9 50.3 -69.4 -45.0 -19.3 20.7 -29.7 498 514 A E H X S+ 0 0 9 -4,-3.0 4,-2.5 1,-0.2 5,-0.2 0.906 109.0 51.2 -61.0 -41.5 -21.3 22.3 -32.6 499 515 A T H X S+ 0 0 8 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.901 110.9 49.3 -67.2 -32.5 -21.3 25.8 -30.9 500 516 A F H X S+ 0 0 3 -4,-1.7 4,-2.3 -5,-0.2 -1,-0.2 0.877 109.2 52.0 -69.1 -35.1 -17.6 25.5 -30.4 501 517 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.930 110.3 48.8 -64.4 -42.4 -17.1 24.5 -34.1 502 518 A R H X S+ 0 0 104 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.885 111.6 49.8 -63.0 -37.8 -19.1 27.5 -35.1 503 519 A Q H X S+ 0 0 19 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.867 109.2 51.5 -70.0 -38.2 -17.0 29.8 -32.9 504 520 A Y H < S+ 0 0 17 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.917 112.4 44.6 -65.6 -46.0 -13.7 28.4 -34.2 505 521 A H H < S+ 0 0 60 -4,-2.2 3,-0.3 1,-0.2 -2,-0.2 0.850 113.2 53.5 -66.1 -34.0 -14.8 29.0 -37.9 506 522 A H H < S+ 0 0 152 -4,-1.9 2,-0.7 1,-0.3 -2,-0.2 0.938 116.1 36.9 -65.4 -49.5 -16.1 32.5 -36.9 507 523 A H < 0 0 119 -4,-2.5 -1,-0.3 -5,-0.1 -4,-0.0 -0.850 360.0 360.0-106.8 94.5 -12.8 33.6 -35.2 508 524 A H 0 0 141 -2,-0.7 -3,-0.1 -3,-0.3 -2,-0.1 -0.146 360.0 360.0-152.5 360.0 -9.7 32.3 -37.0