==== 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 OXIDOREDUCTASE 19-DEC-08 3FM6 . COMPND 2 MOLECULE: VERSATILE PEROXIDASE VPL2; . SOURCE 2 ORGANISM_SCIENTIFIC: PLEUROTUS ERYNGII; . AUTHOR K.PIONTEK,A.T.MARTINEZ,T.CHOINOWSKI,D.A.PLATTNER . 319 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12780.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 189 59.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 10 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 16.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 1 1 1 1 0 0 2 0 0 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 3 4 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 . 4 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 1 A A 0 0 59 0, 0.0 8,-2.1 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 149.1 51.0 77.5 -9.3 2 2 A T B -A 8 0A 104 6,-0.2 6,-0.2 8,-0.1 5,-0.1 -0.950 360.0-143.6-113.3 124.4 47.6 77.9 -10.8 3 3 A a > - 0 0 11 4,-3.4 3,-2.2 -2,-0.5 9,-0.0 -0.317 32.9 -94.6 -82.0 171.1 46.6 75.4 -13.5 4 4 A D T 3 S+ 0 0 179 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.809 124.8 48.7 -60.1 -32.0 44.5 76.2 -16.5 5 5 A D T 3 S- 0 0 92 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.361 122.5-101.8 -92.5 7.1 41.2 75.2 -14.9 6 6 A G S < S+ 0 0 47 -3,-2.2 -2,-0.1 1,-0.4 2,-0.1 0.238 79.8 130.4 96.0 -14.5 41.9 77.2 -11.7 7 7 A R - 0 0 75 -5,-0.1 -4,-3.4 8,-0.1 -1,-0.4 -0.413 48.6-138.0 -68.2 152.0 43.1 74.3 -9.5 8 8 A T B +A 2 0A 93 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.818 26.1 169.1-118.3 153.3 46.4 75.0 -7.7 9 9 A T - 0 0 6 -8,-2.1 6,-0.1 -2,-0.3 269,-0.1 -0.963 41.0-116.5-157.4 151.2 49.5 72.9 -6.9 10 10 A A S S+ 0 0 68 -2,-0.3 2,-0.5 1,-0.2 268,-0.1 0.863 103.1 41.8 -62.6 -40.2 52.9 73.8 -5.6 11 11 A N S > S- 0 0 70 266,-0.3 3,-2.3 1,-0.1 4,-0.2 -0.953 75.8-143.0-116.3 122.6 54.8 72.8 -8.7 12 12 A A G > S+ 0 0 68 -2,-0.5 3,-1.8 1,-0.3 4,-0.3 0.739 96.2 69.6 -57.4 -30.0 53.4 73.7 -12.1 13 13 A A G > S+ 0 0 44 1,-0.3 3,-0.9 2,-0.1 -1,-0.3 0.758 89.9 65.9 -57.9 -24.8 54.6 70.5 -13.7 14 14 A b G X S+ 0 0 0 -3,-2.3 3,-2.2 1,-0.2 4,-0.4 0.614 74.4 88.1 -74.5 -13.4 51.9 68.7 -11.6 15 15 A a G X S+ 0 0 30 -3,-1.8 3,-1.6 1,-0.3 -1,-0.2 0.819 75.3 68.9 -57.0 -29.9 49.1 70.4 -13.4 16 16 A I G <> S+ 0 0 83 -3,-0.9 4,-0.6 -4,-0.3 -1,-0.3 0.707 90.2 64.9 -61.2 -20.5 49.0 67.6 -15.9 17 17 A L H <> S+ 0 0 0 -3,-2.2 4,-2.9 1,-0.2 -1,-0.3 0.707 81.7 76.6 -77.0 -21.8 47.8 65.3 -13.2 18 18 A F H <> S+ 0 0 12 -3,-1.6 4,-2.2 -4,-0.4 5,-0.2 0.934 96.6 43.9 -63.4 -43.0 44.4 67.0 -12.7 19 19 A P H > S+ 0 0 74 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.848 114.4 52.3 -66.9 -29.3 42.7 65.6 -15.8 20 20 A I H X S+ 0 0 3 -4,-0.6 4,-2.8 2,-0.2 5,-0.3 0.933 108.0 51.1 -68.1 -47.5 44.2 62.2 -15.0 21 21 A L H X S+ 0 0 14 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.935 111.4 47.5 -50.1 -51.4 42.8 62.4 -11.5 22 22 A D H X S+ 0 0 74 -4,-2.2 4,-1.7 1,-0.2 5,-0.2 0.901 112.4 49.6 -63.9 -42.3 39.3 63.3 -12.8 23 23 A D H X S+ 0 0 18 -4,-1.9 4,-3.0 -5,-0.2 5,-0.4 0.947 114.1 43.3 -63.0 -49.6 39.4 60.5 -15.4 24 24 A I H X>S+ 0 0 0 -4,-2.8 5,-2.6 1,-0.2 4,-2.2 0.895 108.5 58.1 -68.7 -35.1 40.5 57.8 -12.9 25 25 A Q H <5S+ 0 0 20 -4,-2.6 7,-2.4 -5,-0.3 6,-1.9 0.921 119.8 29.6 -59.9 -42.4 38.1 58.8 -10.2 26 26 A E H <5S+ 0 0 121 -4,-1.7 4,-0.4 5,-0.2 -2,-0.2 0.906 131.8 31.8 -78.2 -46.9 35.1 58.4 -12.5 27 27 A N H <5S+ 0 0 108 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.566 130.4 27.5-103.5 -10.6 36.3 55.6 -14.8 28 28 A L T <5S+ 0 0 5 -4,-2.2 -3,-0.2 -5,-0.4 9,-0.2 0.696 128.0 37.9-107.6 -42.8 38.6 53.5 -12.7 29 29 A F S > S- 0 0 23 -2,-0.9 4,-2.3 -6,-0.2 3,-0.5 -0.151 77.2 -45.9-120.2-156.1 36.1 49.6 -3.9 36 36 A E H > S+ 0 0 98 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.863 128.8 48.4 -50.9 -49.4 37.5 46.8 -6.1 37 37 A E H > S+ 0 0 33 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.844 110.1 52.3 -69.6 -31.2 39.6 48.9 -8.4 38 38 A V H > S+ 0 0 2 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.946 111.9 47.1 -62.5 -47.4 41.2 50.8 -5.5 39 39 A H H X S+ 0 0 32 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.936 115.0 45.5 -60.6 -46.7 42.1 47.5 -3.9 40 40 A E H X S+ 0 0 26 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.886 112.5 50.8 -63.7 -40.8 43.5 46.1 -7.2 41 41 A S H X S+ 0 0 0 -4,-2.4 4,-1.6 2,-0.2 66,-0.2 0.871 109.5 50.8 -67.0 -36.7 45.4 49.3 -8.0 42 42 A L H X S+ 0 0 8 -4,-2.5 4,-1.2 2,-0.2 3,-0.3 0.942 109.7 49.8 -67.1 -43.3 46.9 49.2 -4.5 43 43 A R H >X S+ 0 0 95 -4,-2.4 4,-2.4 1,-0.2 3,-0.5 0.921 107.4 56.8 -57.4 -40.4 48.0 45.6 -5.0 44 44 A L H 3X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.866 97.6 60.4 -62.3 -36.1 49.5 46.6 -8.3 45 45 A T H 3X S+ 0 0 1 -4,-1.6 4,-2.3 -3,-0.3 -1,-0.2 0.900 110.9 41.9 -56.1 -40.9 51.7 49.3 -6.7 46 46 A F H < S+ 0 0 0 -4,-2.4 3,-0.9 -5,-0.2 14,-0.2 0.948 119.4 41.0 -73.3 -53.8 55.2 46.6 -9.6 49 49 A A H 3< S+ 0 0 0 -4,-2.3 12,-0.2 -5,-0.3 -2,-0.2 0.832 104.7 61.5 -69.9 -36.5 57.6 48.0 -7.0 50 50 A I T 3< S+ 0 0 0 -4,-2.8 2,-2.4 1,-0.2 -1,-0.2 0.592 75.4 95.5 -76.4 -7.4 58.8 44.9 -5.3 51 51 A G < + 0 0 0 -3,-0.9 9,-2.4 -4,-0.2 2,-0.3 -0.459 65.2 107.9 -74.8 68.6 60.3 43.6 -8.5 52 52 A F E +B 59 0B 51 -2,-2.4 6,-0.2 7,-0.2 7,-0.1 -0.943 34.6 156.4-155.6 117.3 63.6 45.1 -7.3 53 53 A S E > -B 57 0B 4 4,-0.8 4,-2.9 5,-0.5 102,-0.1 -0.939 34.8-147.9-149.2 121.9 66.6 43.2 -6.0 54 54 A P T 4 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.918 106.4 38.2 -53.0 -41.5 70.2 44.4 -6.0 55 55 A T T 4 S+ 0 0 116 1,-0.1 -2,-0.0 2,-0.1 99,-0.0 0.903 127.7 30.8 -72.3 -48.1 71.3 40.9 -6.5 56 56 A L T 4 S- 0 0 108 1,-0.3 2,-0.1 2,-0.0 -1,-0.1 0.632 101.8-128.5 -98.4 -16.0 68.7 39.7 -9.0 57 57 A G E < +B 53 0B 31 -4,-2.9 -4,-0.8 1,-0.2 -1,-0.3 -0.470 45.8 138.7 93.8-169.5 67.7 42.9 -10.9 58 58 A G E - 0 0 20 -6,-0.2 -5,-0.5 -2,-0.1 -1,-0.2 0.224 52.7-114.8 92.5 141.2 64.4 44.6 -11.8 59 59 A G E -B 52 0B 26 72,-0.4 -7,-0.2 1,-0.3 2,-0.2 0.223 38.6-142.9 -98.3 14.4 63.8 48.3 -11.7 60 60 A G S S+ 0 0 0 -9,-2.4 2,-2.0 1,-0.1 4,-0.4 -0.435 77.5 16.5 70.2-134.8 61.3 48.6 -8.9 61 61 A A S S+ 0 0 0 207,-2.4 -12,-0.1 204,-0.2 -1,-0.1 -0.553 91.5 119.7 -80.5 75.5 58.4 51.1 -9.2 62 62 A D S S- 0 0 11 -2,-2.0 67,-0.7 -14,-0.2 38,-0.6 0.292 84.4-106.7-127.8 0.4 59.0 51.4 -13.0 63 63 A G S >> S+ 0 0 0 36,-0.3 4,-2.7 37,-0.3 3,-1.5 0.563 74.9 136.3 76.3 8.5 55.8 50.4 -14.7 64 64 A S H 3> + 0 0 0 -4,-0.4 4,-2.9 1,-0.3 8,-0.2 0.812 62.1 64.7 -59.0 -31.3 57.4 47.1 -15.8 65 65 A I H 34 S+ 0 0 0 1,-0.2 -1,-0.3 2,-0.2 8,-0.2 0.763 114.4 32.9 -68.7 -22.7 54.3 45.1 -14.8 66 66 A I H X4 S+ 0 0 9 -3,-1.5 3,-1.5 2,-0.1 -2,-0.2 0.852 121.5 46.3 -89.2 -52.1 52.4 47.0 -17.6 67 67 A A H 3< S+ 0 0 58 -4,-2.7 -3,-0.2 1,-0.3 -2,-0.2 0.830 128.2 29.0 -62.3 -34.3 55.2 47.5 -20.1 68 68 A F T >X S+ 0 0 70 -4,-2.9 4,-2.7 -5,-0.3 3,-0.8 -0.250 80.6 137.8-118.2 41.4 56.3 43.9 -19.8 69 69 A D H <> + 0 0 26 -3,-1.5 4,-2.5 1,-0.2 5,-0.3 0.853 62.6 64.7 -58.6 -38.4 52.9 42.5 -18.9 70 70 A T H 34 S+ 0 0 105 -4,-0.2 -1,-0.2 1,-0.2 4,-0.2 0.885 115.0 31.2 -56.2 -41.1 53.2 39.5 -21.2 71 71 A I H X4 S+ 0 0 98 -3,-0.8 3,-1.1 2,-0.1 4,-0.3 0.934 123.4 43.7 -77.0 -57.4 56.1 38.2 -19.1 72 72 A E H >< S+ 0 0 1 -4,-2.7 3,-1.6 1,-0.3 6,-0.2 0.863 105.0 59.1 -67.9 -36.6 55.2 39.5 -15.6 73 73 A T T 3< S+ 0 0 27 -4,-2.5 9,-0.3 -5,-0.3 -1,-0.3 0.675 100.3 60.1 -71.9 -11.0 51.5 38.7 -15.5 74 74 A N T < S+ 0 0 128 -3,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.516 76.8 109.5 -88.7 -6.4 52.3 35.0 -16.1 75 75 A F S X S- 0 0 25 -3,-1.6 3,-2.0 -4,-0.3 4,-0.0 -0.481 78.5-124.3 -64.5 139.6 54.4 34.8 -12.9 76 76 A P G > S+ 0 0 79 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.871 110.1 56.2 -55.4 -37.7 52.5 32.7 -10.3 77 77 A A G 3 S+ 0 0 13 1,-0.3 -2,-0.1 61,-0.1 -4,-0.1 0.621 100.4 62.0 -72.0 -11.9 52.6 35.4 -7.7 78 78 A N G X S+ 0 0 2 -3,-2.0 3,-2.3 -6,-0.2 4,-0.5 0.159 71.9 148.0 -97.3 19.2 50.9 37.7 -10.1 79 79 A A T < S+ 0 0 45 -3,-1.6 97,-0.2 1,-0.3 -5,-0.1 -0.256 73.4 11.5 -55.8 131.9 47.8 35.6 -10.4 80 80 A G T >> S+ 0 0 17 -7,-0.2 3,-0.7 95,-0.1 4,-0.5 0.299 97.6 107.3 83.6 -10.0 44.8 37.9 -11.0 81 81 A I H <> + 0 0 0 -3,-2.3 4,-2.3 1,-0.2 3,-0.3 0.754 61.3 75.6 -68.4 -30.9 47.0 41.0 -11.7 82 82 A D H 3> S+ 0 0 84 -4,-0.5 4,-2.6 -9,-0.3 -1,-0.2 0.836 87.7 60.8 -54.5 -33.2 46.2 40.8 -15.5 83 83 A E H <> S+ 0 0 75 -3,-0.7 4,-1.8 2,-0.2 -1,-0.2 0.949 109.6 37.8 -61.7 -51.6 42.8 42.3 -14.8 84 84 A I H X S+ 0 0 3 -4,-0.5 4,-2.4 -3,-0.3 5,-0.2 0.859 114.8 56.0 -72.1 -34.4 43.9 45.6 -13.3 85 85 A V H X S+ 0 0 1 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.949 109.5 46.2 -58.6 -46.4 46.8 45.8 -15.7 86 86 A S H < S+ 0 0 77 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.865 113.1 49.8 -65.5 -35.5 44.4 45.5 -18.6 87 87 A A H < S+ 0 0 41 -4,-1.8 4,-0.4 -5,-0.2 -1,-0.2 0.878 115.5 42.5 -69.1 -38.2 42.1 48.1 -17.0 88 88 A Q H >X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 3,-1.1 0.816 95.6 77.8 -77.6 -34.0 45.0 50.6 -16.4 89 89 A K H 3X S+ 0 0 83 -4,-2.3 4,-2.3 1,-0.3 5,-0.2 0.869 91.7 51.0 -51.6 -44.4 46.8 50.2 -19.7 90 90 A P H 3> S+ 0 0 80 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.816 108.1 53.6 -65.5 -29.3 44.3 52.4 -21.8 91 91 A F H <> S+ 0 0 26 -3,-1.1 4,-2.1 -4,-0.4 -2,-0.2 0.895 109.3 48.7 -66.9 -41.0 44.6 55.2 -19.2 92 92 A V H < S+ 0 0 26 -4,-1.9 5,-0.3 1,-0.2 -1,-0.2 0.924 112.2 48.7 -62.5 -42.6 48.4 55.1 -19.6 93 93 A A H < S+ 0 0 86 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.888 114.3 45.8 -64.8 -39.8 48.0 55.2 -23.4 94 94 A K H < S+ 0 0 141 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.848 110.5 54.0 -71.9 -39.3 45.6 58.1 -23.3 95 95 A H S < S- 0 0 31 -4,-2.1 -79,-0.0 -5,-0.1 0, 0.0 -0.272 86.8-116.6 -98.5 177.4 47.4 60.3 -20.9 96 96 A N S S+ 0 0 163 -80,-0.2 2,-0.3 -2,-0.1 -4,-0.1 -0.145 73.9 99.5-117.6 43.4 50.9 61.5 -21.1 97 97 A I S S- 0 0 19 -5,-0.3 -2,-0.1 1,-0.1 27,-0.0 -0.870 75.3 -96.5-120.8 157.3 52.6 60.0 -18.0 98 98 A S > - 0 0 15 -2,-0.3 4,-2.8 28,-0.2 5,-0.2 -0.290 31.3-115.5 -66.0 158.3 54.8 56.9 -17.7 99 99 A A H > S+ 0 0 13 1,-0.2 4,-2.4 2,-0.2 -36,-0.3 0.865 116.7 55.3 -62.2 -36.9 53.3 53.6 -16.6 100 100 A G H > S+ 0 0 1 -38,-0.6 4,-1.6 1,-0.2 -37,-0.3 0.921 110.8 44.2 -63.0 -44.0 55.4 53.7 -13.5 101 101 A D H > S+ 0 0 4 25,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.911 112.7 52.7 -61.9 -46.4 54.0 57.1 -12.5 102 102 A F H X S+ 0 0 0 -4,-2.8 4,-3.2 1,-0.2 5,-0.3 0.922 106.5 51.7 -59.8 -46.1 50.5 56.1 -13.4 103 103 A I H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.940 115.3 41.4 -58.5 -47.8 50.6 52.9 -11.2 104 104 A Q H X S+ 0 0 7 -4,-1.6 4,-2.3 -5,-0.2 -1,-0.2 0.900 115.3 51.1 -68.9 -37.2 51.7 54.9 -8.2 105 105 A F H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 5,-0.3 0.938 110.7 47.8 -63.3 -48.4 49.4 57.8 -8.9 106 106 A A H X S+ 0 0 0 -4,-3.2 4,-2.7 1,-0.2 -1,-0.2 0.910 112.0 50.6 -61.3 -40.6 46.3 55.5 -9.2 107 107 A G H X S+ 0 0 1 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.925 112.7 45.6 -62.8 -44.1 47.3 53.7 -6.0 108 108 A A H X S+ 0 0 2 -4,-2.3 4,-1.7 2,-0.2 12,-0.2 0.924 114.2 48.0 -67.2 -43.7 47.6 57.0 -4.1 109 109 A V H X S+ 0 0 0 -4,-3.0 4,-0.6 1,-0.2 -2,-0.2 0.944 112.6 50.4 -59.7 -46.2 44.4 58.4 -5.5 110 110 A G H >< S+ 0 0 0 -4,-2.7 3,-1.7 -5,-0.3 4,-0.3 0.936 107.6 50.5 -61.4 -47.7 42.6 55.2 -4.7 111 111 A V H >< S+ 0 0 0 -4,-2.4 3,-1.9 1,-0.3 -1,-0.2 0.869 102.4 63.6 -57.8 -35.4 43.7 55.0 -1.1 112 112 A S H 3< S+ 0 0 1 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.671 93.9 62.0 -65.7 -15.7 42.6 58.6 -0.6 113 113 A N T << S+ 0 0 19 -3,-1.7 -79,-0.3 -4,-0.6 -1,-0.3 0.553 86.2 93.0 -79.6 -12.9 39.0 57.5 -1.3 114 114 A c S X S- 0 0 0 -3,-1.9 3,-2.7 -4,-0.3 78,-0.2 -0.757 84.3-115.4 -91.9 123.1 39.0 55.2 1.8 115 115 A P T 3 S+ 0 0 28 0, 0.0 78,-2.5 0, 0.0 173,-0.3 -0.281 106.3 23.3 -51.1 137.4 37.7 56.5 5.1 116 116 A G T 3 S+ 0 0 0 170,-2.3 172,-0.2 1,-0.2 171,-0.1 0.260 103.0 133.0 85.2 -8.9 40.6 56.6 7.6 117 117 A G < - 0 0 7 -3,-2.7 2,-0.3 169,-0.4 -1,-0.2 0.171 44.6-135.6 -73.2-176.1 43.0 56.7 4.7 118 118 A V - 0 0 15 -10,-0.1 2,-0.7 -3,-0.1 -4,-0.2 -0.872 20.6-107.8-133.7 164.1 46.0 58.9 3.9 119 119 A R - 0 0 104 -2,-0.3 -10,-0.1 166,-0.1 -11,-0.1 -0.901 34.9-147.3 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-59.8 147.5 60.9 50.7 -17.7 130 130 A V + 0 0 141 1,-0.2 2,-0.3 -3,-0.1 -1,-0.1 0.388 67.6 29.0-120.6 -2.3 63.8 49.1 -19.4 131 131 A A S S- 0 0 48 3,-0.0 -72,-0.4 -74,-0.0 -1,-0.2 -0.988 76.4-113.4-152.3 153.4 63.7 45.6 -18.1 132 132 A A - 0 0 34 -2,-0.3 -74,-0.1 -74,-0.1 -67,-0.1 -0.538 42.1-101.7 -76.5 150.9 61.1 43.1 -16.8 133 133 A S - 0 0 7 -2,-0.2 -75,-0.1 -75,-0.1 -1,-0.1 -0.507 38.6-112.3 -60.7 143.3 61.1 42.1 -13.2 134 134 A P - 0 0 41 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 -0.328 38.4-103.4 -58.3 156.9 62.6 38.7 -12.6 135 135 A D S S+ 0 0 54 1,-0.2 -63,-0.0 2,-0.1 -60,-0.0 -0.276 98.7 42.1 -72.2 167.7 60.2 36.0 -11.4 136 136 A H S S+ 0 0 136 2,-0.1 -1,-0.2 1,-0.1 -85,-0.0 0.706 79.0 107.7 62.9 34.2 60.0 35.0 -7.8 137 137 A L + 0 0 3 -3,-0.4 -85,-0.2 -90,-0.1 -2,-0.1 0.557 57.5 81.3-108.5 -13.0 60.4 38.5 -6.3 138 138 A V S S- 0 0 14 -87,-0.1 -2,-0.1 1,-0.0 -61,-0.1 -0.835 84.7-119.2 -97.2 123.7 56.8 38.9 -5.0 139 139 A P - 0 0 27 0, 0.0 -2,-0.1 0, 0.0 -89,-0.0 -0.267 27.1-148.1 -57.1 146.4 56.0 37.2 -1.7 140 140 A E > - 0 0 42 4,-0.1 3,-2.1 1,-0.0 8,-0.1 -0.826 22.4-115.0-118.1 156.6 53.3 34.5 -1.7 141 141 A P T 3 S+ 0 0 33 0, 0.0 89,-0.8 0, 0.0 75,-0.1 0.662 114.2 56.4 -71.5 -15.1 50.8 33.6 1.0 142 142 A Q T 3 S+ 0 0 71 87,-0.1 2,-0.2 73,-0.1 74,-0.1 0.362 86.4 109.6 -88.7 0.7 52.3 30.1 1.4 143 143 A D S < S- 0 0 38 -3,-2.1 2,-0.0 1,-0.1 0, 0.0 -0.488 72.3-111.7 -80.9 150.3 55.8 31.6 2.2 144 144 A S > - 0 0 59 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.290 24.7-112.3 -70.2 161.3 57.4 31.5 5.6 145 145 A V H > S+ 0 0 7 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.937 120.5 53.9 -57.0 -44.8 57.9 34.6 7.7 146 146 A D H > S+ 0 0 109 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.921 110.7 46.0 -58.3 -44.2 61.7 34.1 7.3 147 147 A S H > S+ 0 0 52 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.929 114.5 46.7 -63.4 -48.0 61.2 34.0 3.5 148 148 A I H X S+ 0 0 10 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.936 114.3 46.6 -61.4 -47.6 58.9 37.0 3.4 149 149 A L H X S+ 0 0 16 -4,-3.1 4,-2.4 -5,-0.2 -1,-0.2 0.876 112.4 50.6 -66.1 -35.7 61.1 39.1 5.7 150 150 A A H X S+ 0 0 65 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 0.912 113.2 45.4 -67.7 -40.4 64.2 38.2 3.7 151 151 A R H X S+ 0 0 25 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.941 116.0 44.9 -67.3 -48.9 62.6 39.2 0.4 152 152 A M H X>S+ 0 0 8 -4,-2.8 5,-2.7 1,-0.2 4,-0.6 0.896 113.5 51.8 -62.7 -38.2 61.2 42.4 1.7 153 153 A G H ><5S+ 0 0 37 -4,-2.4 3,-0.9 -5,-0.3 -2,-0.2 0.884 103.7 57.4 -64.2 -38.4 64.6 43.1 3.4 154 154 A D H 3<5S+ 0 0 55 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.863 107.8 48.2 -59.7 -35.6 66.4 42.5 0.1 155 155 A A H 3<5S- 0 0 4 -4,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.577 133.1 -92.0 -80.0 -14.6 64.2 45.3 -1.4 156 156 A G T <<5S+ 0 0 38 -3,-0.9 2,-0.4 -4,-0.6 -3,-0.2 0.451 82.4 126.0 120.8 6.6 65.0 47.5 1.6 157 157 A F < - 0 0 4 -5,-2.7 -1,-0.3 -6,-0.1 -2,-0.1 -0.821 46.5-142.1-105.0 133.8 62.3 47.0 4.2 158 158 A S > - 0 0 44 -2,-0.4 4,-1.8 1,-0.1 5,-0.2 -0.336 36.4 -99.5 -76.0 167.4 62.7 46.1 7.8 159 159 A P H > S+ 0 0 48 0, 0.0 4,-1.8 0, 0.0 3,-0.2 0.902 124.9 51.4 -58.7 -40.3 60.3 43.7 9.6 160 160 A V H > S+ 0 0 49 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.902 106.9 54.7 -64.6 -36.1 58.4 46.5 11.2 161 161 A E H > S+ 0 0 27 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.842 103.8 55.2 -63.1 -34.2 58.0 48.2 7.8 162 162 A V H X S+ 0 0 5 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.933 108.6 47.9 -62.3 -46.5 56.5 45.0 6.4 163 163 A V H < S+ 0 0 0 -4,-1.8 4,-0.3 2,-0.2 -2,-0.2 0.928 111.3 51.0 -57.6 -45.5 53.9 45.1 9.2 164 164 A W H >< S+ 0 0 29 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.913 109.1 50.2 -61.4 -42.1 53.2 48.8 8.4 165 165 A L H >< S+ 0 0 13 -4,-2.4 3,-2.0 1,-0.3 -1,-0.2 0.809 97.7 69.0 -64.2 -32.7 52.8 48.0 4.7 166 166 A L G >< S+ 0 0 24 -4,-1.7 3,-2.0 1,-0.3 -1,-0.3 0.548 70.6 89.2 -72.8 -0.6 50.3 45.2 5.5 167 167 A A G X S+ 0 0 0 -3,-1.4 3,-2.2 -4,-0.3 -1,-0.3 0.794 73.1 77.0 -57.6 -23.6 47.8 47.9 6.7 168 168 A S G X S+ 0 0 27 -3,-2.0 3,-2.0 1,-0.3 -1,-0.3 0.796 78.3 68.7 -52.2 -32.1 47.0 47.6 2.9 169 169 A H G X S+ 0 0 36 -3,-2.0 3,-0.5 1,-0.3 17,-0.3 0.606 81.7 74.9 -71.8 -4.4 45.2 44.3 3.8 170 170 A S G < S+ 0 0 0 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-4,-0.1 -4,-0.1 -5,-0.0 0.640 109.0 34.1 -76.6 -16.0 35.1 29.4 -5.2 181 181 A I S X S- 0 0 30 -3,-2.1 3,-1.0 -6,-0.1 -1,-0.2 -0.443 82.9-179.4-135.5 57.4 34.6 32.6 -3.1 182 182 A P T 3 + 0 0 80 0, 0.0 -7,-0.3 0, 0.0 -6,-0.0 -0.295 65.8 29.9 -63.2 147.3 36.1 35.5 -5.2 183 183 A G T 3 S+ 0 0 44 -9,-1.2 -8,-0.2 1,-0.3 -11,-0.0 0.643 76.5 151.1 82.7 15.1 36.1 38.9 -3.6 184 184 A T E < -D 174 0D 19 -10,-1.3 -10,-2.1 -3,-1.0 -1,-0.3 -0.696 40.4-130.9 -82.9 126.8 36.2 37.8 -0.0 185 185 A P E -D 173 0D 23 0, 0.0 41,-2.3 0, 0.0 -12,-0.3 -0.297 8.7-132.1 -80.9 162.2 37.9 40.5 2.1 186 186 A F S S+ 0 0 15 -14,-2.4 2,-0.3 -17,-0.3 -13,-0.1 0.627 93.2 24.3 -84.4 -18.4 40.8 40.2 4.6 187 187 A D S S- 0 0 0 -15,-0.5 -15,-0.1 37,-0.1 10,-0.1 -0.917 86.1-107.1-137.1 172.9 38.9 42.3 7.2 188 188 A S S S+ 0 0 58 -2,-0.3 3,-0.1 1,-0.2 -18,-0.1 0.508 113.6 50.8 -76.0 -5.4 35.3 43.1 7.9 189 189 A T > + 0 0 30 3,-0.1 3,-2.2 -19,-0.1 -1,-0.2 -0.536 58.1 159.5-130.5 64.0 35.7 46.7 6.6 190 190 A P T 3 S+ 0 0 37 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.662 79.1 53.9 -69.9 -10.6 37.3 46.4 3.1 191 191 A G T 3 S+ 0 0 29 -3,-0.1 2,-0.4 -20,-0.1 -157,-0.1 0.308 102.0 70.1 -96.2 8.3 36.1 49.9 2.3 192 192 A V S < S- 0 0 21 -3,-2.2 2,-1.2 -22,-0.5 -76,-0.2 -0.992 74.4-139.0-133.8 125.4 37.6 51.5 5.4 193 193 A F + 0 0 0 -78,-2.5 2,-0.2 -2,-0.4 -22,-0.1 -0.714 60.5 122.1 -84.3 93.7 41.3 52.0 6.1 194 194 A D S > S- 0 0 11 -2,-1.2 3,-0.5 -5,-0.2 4,-0.2 -0.762 76.7 -89.8-146.1-178.7 41.3 50.9 9.8 195 195 A S T >> S+ 0 0 5 -2,-0.2 4,-1.7 1,-0.2 3,-0.7 0.437 88.5 104.3 -88.7 5.7 42.8 48.5 12.3 196 196 A Q H 3> S+ 0 0 2 1,-0.3 4,-3.1 2,-0.2 5,-0.3 0.865 76.7 58.2 -57.0 -37.5 40.2 45.8 11.8 197 197 A F H <> S+ 0 0 1 -3,-0.5 4,-2.0 1,-0.2 -1,-0.3 0.905 106.3 47.5 -56.4 -45.4 42.7 43.7 9.8 198 198 A F H <4 S+ 0 0 0 -3,-0.7 4,-0.3 -4,-0.2 -1,-0.2 0.815 116.8 44.4 -69.7 -30.6 45.2 43.7 12.7 199 199 A I H >< S+ 0 0 0 -4,-1.7 3,-1.0 2,-0.1 4,-0.5 0.935 114.3 46.3 -70.6 -53.4 42.4 42.7 15.2 200 200 A E H >< S+ 0 0 1 -4,-3.1 3,-1.0 1,-0.3 -2,-0.2 0.840 106.7 56.5 -72.9 -29.3 40.7 40.1 13.1 201 201 A T T 3< S+ 0 0 4 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.1 0.714 103.3 58.6 -69.2 -19.3 43.9 38.3 12.0 202 202 A Q T < S+ 0 0 1 -3,-1.0 102,-3.0 -4,-0.3 -1,-0.2 0.577 86.3 99.6 -83.3 -16.6 44.7 37.8 15.7 203 203 A L B < S-E 303 0E 0 -3,-1.0 100,-0.2 -4,-0.5 2,-0.2 -0.400 89.2 -94.0 -68.8 151.1 41.5 35.9 16.5 204 204 A K - 0 0 93 98,-2.7 -1,-0.1 -2,-0.1 -2,-0.1 -0.436 46.9-112.4 -60.2 131.4 41.4 32.2 16.7 205 205 A G + 0 0 25 -2,-0.2 15,-0.1 1,-0.1 14,-0.1 -0.393 40.3 170.8 -64.8 147.3 40.6 30.7 13.3 206 206 A R - 0 0 124 14,-2.6 2,-0.3 1,-0.4 -1,-0.1 0.620 51.6 -1.4-125.7 -34.7 37.2 28.9 13.2 207 207 A L B -F 220 0F 48 13,-2.1 13,-2.9 15,-0.1 -1,-0.4 -0.972 59.2-108.8-157.5 161.3 36.2 28.0 9.7 208 208 A F - 0 0 63 -2,-0.3 11,-0.1 11,-0.2 4,-0.1 -0.957 25.1-149.4-101.1 127.2 37.1 28.0 6.0 209 209 A P S S+ 0 0 11 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.770 84.8 1.4 -69.6 -24.8 34.7 30.4 4.2 210 210 A G S S- 0 0 32 1,-0.5 -2,-0.2 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