==== 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 18-OCT-02 1N1P . COMPND 2 MOLECULE: CHOLESTEROL OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES SP.; . AUTHOR A.VRIELINK,P.I.LARIO . 498 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18273.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 330 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 76 15.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 40 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 20.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.8 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 0 2 2 1 1 0 0 2 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 1 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 PARALLEL BRIDGES PER LADDER . 10 1 1 2 1 2 1 1 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 2 0 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 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 9 A G 0 0 85 0, 0.0 272,-2.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0-165.1 26.0 0.8 48.7 2 10 A Y E +a 273 0A 132 270,-0.2 272,-0.2 252,-0.1 3,-0.1 -0.965 360.0 177.9-120.9 138.1 29.0 -0.8 47.0 3 11 A V E -a 274 0A 30 270,-2.3 272,-0.5 -2,-0.4 273,-0.2 -0.989 34.8-124.7-136.2 142.4 29.0 -3.4 44.3 4 12 A P E S+ 0 0 42 0, 0.0 272,-2.5 0, 0.0 271,-2.0 0.915 94.2 20.2 -54.0 -51.0 32.3 -4.6 42.7 5 13 A A E -ab 276 28A 0 22,-2.1 24,-2.4 270,-0.2 2,-0.4 -0.973 65.5-167.9-121.1 139.0 31.3 -3.9 39.1 6 14 A V E -ab 277 29A 0 270,-2.2 272,-2.8 -2,-0.4 2,-0.5 -0.982 3.3-164.5-118.4 137.3 28.6 -1.6 37.8 7 15 A V E -ab 278 30A 0 22,-2.5 24,-2.4 -2,-0.4 2,-0.6 -0.987 13.0-145.2-116.7 124.6 27.4 -1.6 34.2 8 16 A I E +ab 279 31A 9 270,-2.8 272,-2.3 -2,-0.5 24,-0.2 -0.826 67.3 3.7 -91.6 122.9 25.4 1.4 33.1 9 17 A G - 0 0 8 22,-3.2 22,-0.2 -2,-0.6 272,-0.2 -0.121 66.9-119.7 89.8 170.1 22.7 0.4 30.6 10 18 A T + 0 0 0 93,-0.3 95,-0.3 270,-0.2 -1,-0.1 -0.028 67.2 112.9-143.1 29.3 21.6 -3.0 29.2 11 19 A G S > S- 0 0 12 269,-0.8 4,-2.8 93,-0.1 5,-0.2 0.101 87.2 -62.6 -82.8-157.5 22.2 -2.8 25.5 12 20 A Y H > S+ 0 0 22 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.937 133.2 42.4 -62.2 -52.9 24.7 -4.7 23.4 13 21 A G H > S+ 0 0 1 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.923 118.9 46.2 -61.2 -43.0 27.9 -3.5 25.0 14 22 A A H > S+ 0 0 0 266,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.902 111.5 50.6 -62.7 -45.4 26.5 -3.7 28.5 15 23 A A H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.908 111.3 46.9 -66.1 -43.7 25.0 -7.1 28.1 16 24 A V H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 5,-0.2 0.938 113.8 49.6 -58.0 -48.5 28.2 -8.7 26.7 17 25 A S H X S+ 0 0 2 -4,-1.9 4,-2.6 -5,-0.3 -2,-0.2 0.929 110.9 47.9 -59.7 -49.2 30.2 -7.1 29.5 18 26 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.889 109.3 53.3 -64.2 -37.1 27.9 -8.2 32.3 19 27 A L H X S+ 0 0 2 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.956 113.3 42.3 -58.6 -51.1 27.8 -11.8 31.0 20 28 A R H X S+ 0 0 40 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.892 113.6 52.6 -69.8 -36.7 31.6 -12.2 30.9 21 29 A L H <>S+ 0 0 0 -4,-2.6 5,-2.6 -5,-0.2 3,-0.3 0.938 111.0 47.6 -59.6 -46.6 32.0 -10.4 34.3 22 30 A G H ><5S+ 0 0 5 -4,-2.6 3,-1.6 1,-0.2 -2,-0.2 0.908 109.3 52.0 -63.9 -40.7 29.5 -12.7 35.9 23 31 A E H 3<5S+ 0 0 114 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.778 106.7 55.4 -64.4 -26.9 31.2 -15.8 34.4 24 32 A A T 3<5S- 0 0 53 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.409 122.9-107.9 -82.1 -1.3 34.5 -14.4 35.9 25 33 A G T < 5S+ 0 0 45 -3,-1.6 2,-0.7 1,-0.3 -3,-0.2 0.649 71.0 144.3 84.4 16.4 32.9 -14.3 39.3 26 34 A V < - 0 0 15 -5,-2.6 2,-0.3 -6,-0.2 -1,-0.3 -0.807 52.5-127.9 -91.9 116.1 32.6 -10.6 39.5 27 35 A Q - 0 0 69 -2,-0.7 -22,-2.1 -3,-0.1 2,-0.4 -0.502 37.4-170.8 -64.3 124.5 29.4 -9.4 41.3 28 36 A T E -bc 5 234A 0 205,-2.9 207,-2.2 -2,-0.3 2,-0.5 -0.969 21.5-160.9-132.8 131.9 27.9 -7.0 38.9 29 37 A L E -bc 6 235A 4 -24,-2.4 -22,-2.5 -2,-0.4 2,-0.4 -0.969 10.8-156.5-111.7 124.4 24.9 -4.5 39.1 30 38 A M E -bc 7 236A 0 205,-3.0 207,-2.8 -2,-0.5 2,-0.6 -0.862 4.7-155.7 -99.2 134.2 23.4 -3.3 35.9 31 39 A L E -bc 8 237A 2 -24,-2.4 -22,-3.2 -2,-0.4 2,-0.5 -0.956 13.7-178.3-112.6 113.9 21.5 0.1 36.0 32 40 A E E - c 0 238A 12 205,-2.6 208,-2.3 -2,-0.6 207,-0.6 -0.962 21.7-156.2-119.3 127.2 18.9 0.5 33.4 33 41 A M S S+ 0 0 32 -2,-0.5 208,-0.2 206,-0.3 227,-0.1 0.768 77.8 60.2 -73.0 -27.6 16.8 3.8 33.1 34 42 A G S S- 0 0 0 1,-0.2 205,-2.2 206,-0.1 206,-0.3 -0.169 93.1 -79.5 -88.0-169.6 14.0 2.0 31.2 35 43 A Q - 0 0 27 67,-0.5 69,-2.6 50,-0.4 2,-0.7 -0.463 29.0-113.7 -90.3 158.6 11.7 -0.8 32.2 36 44 A L - 0 0 77 67,-0.2 2,-1.5 -2,-0.2 3,-0.3 -0.841 40.1-137.5 -78.8 116.0 12.0 -4.6 32.2 37 45 A W + 0 0 16 -2,-0.7 9,-0.1 67,-0.3 10,-0.1 -0.630 68.5 105.7 -89.5 88.7 9.4 -5.3 29.5 38 46 A N + 0 0 78 -2,-1.5 -1,-0.2 8,-0.1 8,-0.1 0.322 43.9 102.7-147.1 13.3 7.5 -8.3 30.9 39 47 A Q - 0 0 135 -3,-0.3 2,-0.2 7,-0.1 6,-0.0 -0.853 69.7-124.4-107.8 121.9 4.0 -7.0 32.0 40 48 A P - 0 0 88 0, 0.0 6,-0.2 0, 0.0 5,-0.1 -0.474 33.1-147.9 -59.4 136.7 1.1 -7.7 29.9 41 49 A G > - 0 0 26 4,-2.3 3,-1.6 -2,-0.2 5,-0.1 -0.002 38.4 -67.9 -92.6-166.8 -0.5 -4.3 29.1 42 50 A P T 3 S+ 0 0 127 0, 0.0 4,-0.1 0, 0.0 -1,-0.0 0.718 134.6 49.0 -63.2 -28.6 -4.2 -3.4 28.5 43 51 A D T 3 S- 0 0 62 2,-0.3 3,-0.1 3,-0.0 4,-0.1 0.236 121.5-108.5 -86.4 7.2 -4.4 -5.3 25.1 44 52 A G S < S+ 0 0 47 -3,-1.6 2,-0.3 1,-0.3 0, 0.0 0.403 88.7 106.3 81.3 -5.7 -2.8 -8.3 26.9 45 53 A N S S- 0 0 58 -5,-0.1 -4,-2.3 1,-0.1 -2,-0.3 -0.762 71.1-134.3-104.7 155.1 0.5 -7.8 25.1 46 54 A I S S+ 0 0 47 -2,-0.3 2,-0.3 -6,-0.2 -7,-0.1 0.945 91.8 32.7 -67.7 -47.0 3.8 -6.5 26.4 47 55 A F S S- 0 0 14 -10,-0.1 2,-0.2 -6,-0.1 165,-0.1 -0.784 80.3-125.6-112.0 146.4 4.4 -4.2 23.4 48 56 A C - 0 0 1 163,-0.4 163,-0.2 -2,-0.3 2,-0.1 -0.531 27.7-121.3 -83.4 166.9 2.0 -2.3 21.2 49 57 A G > - 0 0 3 3,-0.2 3,-0.6 -2,-0.2 159,-0.2 -0.417 26.6-102.0 -93.3 175.3 2.1 -2.7 17.5 50 58 A M T 3 S+ 0 0 8 157,-3.1 158,-0.1 1,-0.2 27,-0.1 0.755 121.1 49.4 -75.2 -20.5 2.6 -0.1 14.8 51 59 A L T 3 S+ 0 0 71 156,-0.4 -1,-0.2 155,-0.2 157,-0.1 0.503 118.2 39.3 -91.4 -9.5 -1.1 0.1 14.0 52 60 A N S < S+ 0 0 81 -3,-0.6 -3,-0.2 2,-0.0 -1,-0.2 -0.297 79.1 173.9-133.8 53.9 -2.2 0.5 17.7 53 61 A P + 0 0 11 0, 0.0 2,-0.2 0, 0.0 11,-0.1 -0.328 5.9 160.3 -63.2 146.0 0.4 2.7 19.3 54 62 A D > - 0 0 43 -5,-0.1 3,-2.4 9,-0.1 4,-0.3 -0.649 61.6 -59.6-144.2-163.4 -0.1 3.8 22.8 55 63 A K G > S+ 0 0 78 1,-0.3 3,-1.4 -2,-0.2 31,-0.2 0.761 126.1 69.0 -61.6 -23.6 2.0 5.2 25.7 56 64 A R G 3 S+ 0 0 10 1,-0.3 31,-2.5 30,-0.2 -1,-0.3 0.645 90.8 64.6 -62.9 -19.2 4.2 2.0 25.5 57 65 A S G < S+ 0 0 4 -3,-2.4 31,-0.4 29,-0.2 2,-0.4 0.635 101.4 51.0 -75.3 -18.8 5.5 3.2 22.2 58 66 A S S < S- 0 0 10 -3,-1.4 28,-1.4 -4,-0.3 2,-1.0 -0.978 70.6-130.4-139.3 135.4 7.2 6.3 23.4 59 67 A W B S-H 85 0B 36 29,-2.2 26,-0.2 -2,-0.4 31,-0.2 -0.717 91.0 -34.2 -83.2 102.3 9.7 7.5 26.0 60 68 A F S S+ 0 0 64 24,-3.0 2,-0.3 -2,-1.0 -1,-0.2 0.888 97.3 137.0 50.5 58.4 8.0 10.5 27.7 61 69 A K - 0 0 40 -3,-0.3 23,-0.2 21,-0.2 -1,-0.2 -0.892 51.8-141.2-120.5 160.7 6.2 12.0 24.7 62 70 A N S S+ 0 0 116 -2,-0.3 19,-1.8 1,-0.2 2,-0.3 0.396 84.9 34.5-106.8 7.2 2.6 13.3 24.7 63 71 A R B S-I 80 0C 99 17,-0.3 17,-0.2 -9,-0.1 -1,-0.2 -0.972 81.7-116.1-153.5 140.1 1.6 12.0 21.3 64 72 A T - 0 0 2 15,-2.4 2,-0.3 -2,-0.3 -9,-0.1 -0.344 30.2-144.0 -68.1 160.9 2.4 8.9 19.4 65 73 A E - 0 0 70 13,-0.1 3,-0.1 -2,-0.1 -1,-0.0 -0.921 13.8-112.6-128.4 149.1 4.3 9.2 16.1 66 74 A A - 0 0 20 -2,-0.3 5,-0.2 1,-0.1 3,-0.1 -0.579 44.2 -96.1 -72.2 145.4 4.2 7.3 12.8 67 75 A P > - 0 0 16 0, 0.0 3,-2.8 0, 0.0 4,-0.3 -0.296 57.7 -87.1 -55.7 140.2 7.2 5.1 11.9 68 76 A L T 3 S+ 0 0 42 1,-0.3 357,-0.1 2,-0.2 356,-0.0 -0.301 118.3 25.8 -58.3 131.1 9.4 7.1 9.5 69 77 A G T 3 S+ 0 0 1 355,-0.5 -1,-0.3 -3,-0.1 3,-0.2 0.063 113.0 71.5 102.7 -21.9 8.3 6.7 6.0 70 78 A S X> + 0 0 1 -3,-2.8 4,-2.8 1,-0.1 3,-1.7 0.301 51.7 111.1-115.5 9.5 4.7 5.9 7.0 71 79 A F H 3> S+ 0 0 108 353,-0.5 4,-1.9 -4,-0.3 5,-0.2 0.860 75.3 62.9 -49.6 -40.8 3.1 9.1 8.2 72 80 A L H 34 S+ 0 0 79 352,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.790 120.1 22.4 -61.8 -24.7 0.8 9.3 5.2 73 81 A W H <4 S+ 0 0 57 -3,-1.7 -2,-0.2 2,-0.1 -1,-0.2 0.666 127.8 43.7-110.1 -28.7 -0.9 6.0 6.2 74 82 A L H >< S+ 0 0 3 -4,-2.8 3,-1.4 1,-0.2 4,-0.4 0.541 85.4 84.4-105.2 -4.4 -0.3 5.7 9.9 75 83 A D G >< S+ 0 0 56 -4,-1.9 3,-1.9 -5,-0.4 -1,-0.2 0.877 82.0 70.3 -62.5 -26.5 -0.9 9.2 11.2 76 84 A V G 3 S+ 0 0 111 1,-0.3 -1,-0.3 -5,-0.2 -2,-0.1 0.745 99.5 46.8 -61.3 -23.5 -4.6 8.2 11.3 77 85 A V G < S+ 0 0 35 -3,-1.4 -1,-0.3 -27,-0.1 -2,-0.2 0.433 86.8 115.2 -95.7 -3.6 -3.8 5.9 14.3 78 86 A N < + 0 0 5 -3,-1.9 2,-0.3 -4,-0.4 -13,-0.1 -0.422 42.2 177.2 -69.2 148.2 -1.8 8.4 16.2 79 87 A R - 0 0 143 -2,-0.1 -15,-2.4 -26,-0.0 2,-0.1 -0.975 35.7 -94.3-146.3 153.4 -3.2 9.6 19.6 80 88 A N B -I 63 0C 126 -2,-0.3 2,-0.3 -17,-0.2 -17,-0.3 -0.463 48.7-175.4 -62.9 143.5 -2.4 11.7 22.5 81 89 A I - 0 0 24 -19,-1.8 -27,-0.0 -2,-0.1 3,-0.0 -0.958 30.0-103.1-141.0 156.3 -0.8 9.8 25.3 82 90 A D - 0 0 121 -2,-0.3 -21,-0.2 1,-0.1 2,-0.1 -0.625 50.8 -98.6 -73.3 137.9 0.4 10.3 28.9 83 91 A P + 0 0 63 0, 0.0 2,-0.3 0, 0.0 -21,-0.1 -0.424 62.8 162.3 -58.2 131.0 4.2 10.7 29.1 84 92 A Y - 0 0 31 -26,-0.4 -24,-3.0 -29,-0.2 2,-2.4 -0.958 54.9 -92.5-151.1 160.0 5.4 7.3 30.2 85 93 A A B +H 59 0B 0 177,-1.9 -50,-0.4 -2,-0.3 -26,-0.2 -0.318 65.7 165.3 -77.6 59.4 8.5 5.1 30.3 86 94 A G - 0 0 0 -2,-2.4 -29,-0.2 -28,-1.4 -30,-0.2 -0.049 45.2-105.5 -77.1-178.2 7.8 3.6 26.9 87 95 A V S S+ 0 0 0 -31,-2.5 15,-2.4 124,-0.1 2,-0.5 0.709 92.8 56.7 -91.4 -25.9 10.2 1.7 24.7 88 96 A L E -J 101 0D 25 -31,-0.4 -29,-2.2 13,-0.2 2,-0.6 -0.952 60.9-164.8-116.3 124.5 11.3 4.0 21.8 89 97 A D E -J 100 0D 13 11,-3.1 11,-2.3 -2,-0.5 2,-0.8 -0.932 8.6-160.2-112.1 114.0 13.0 7.4 22.4 90 98 A R E -J 99 0D 80 -2,-0.6 2,-0.7 9,-0.2 9,-0.2 -0.830 17.1-158.9 -85.9 109.6 13.2 9.9 19.7 91 99 A V E -J 98 0D 20 7,-3.2 7,-2.6 -2,-0.8 2,-0.6 -0.852 7.0-149.5 -98.0 113.5 16.0 12.2 21.0 92 100 A N E +J 97 0D 90 -2,-0.7 5,-0.2 5,-0.2 2,-0.2 -0.781 19.8 174.0 -95.9 119.9 15.8 15.6 19.3 93 101 A Y - 0 0 32 3,-2.9 3,-0.4 -2,-0.6 299,-0.1 -0.513 53.5 -84.2-103.1 179.7 19.0 17.6 18.8 94 102 A D S S+ 0 0 129 297,-0.5 298,-0.1 1,-0.2 300,-0.1 0.881 120.8 2.9 -60.9 -41.4 19.0 20.9 16.8 95 103 A Q S S+ 0 0 64 298,-0.5 2,-0.3 296,-0.3 -1,-0.2 0.037 126.5 57.9-133.9 30.2 19.3 19.3 13.3 96 104 A M - 0 0 3 -3,-0.4 -3,-2.9 295,-0.1 2,-0.5 -0.958 57.1-155.1-160.9 136.0 19.2 15.5 14.0 97 105 A S E -Jk 92 436D 12 338,-1.9 340,-1.6 -2,-0.3 2,-0.5 -0.983 15.7-162.8-115.4 118.3 16.8 13.2 15.7 98 106 A V E -Jk 91 437D 0 -7,-2.6 -7,-3.2 -2,-0.5 2,-0.5 -0.906 6.6-149.0-106.9 127.8 18.4 10.0 17.1 99 107 A Y E +J 90 0D 33 338,-2.8 2,-0.3 -2,-0.5 -9,-0.2 -0.833 24.2 168.1-100.7 130.8 16.1 7.0 17.9 100 108 A V E -J 89 0D 28 -11,-2.3 -11,-3.1 -2,-0.5 2,-0.2 -0.967 33.1-111.8-139.2 153.2 17.1 4.7 20.7 101 109 A G E -J 88 0D 11 -2,-0.3 2,-0.4 -13,-0.2 6,-0.3 -0.552 21.7-159.0 -80.8 151.6 15.6 1.9 22.8 102 110 A R + 0 0 37 -15,-2.4 -67,-0.5 4,-0.3 2,-0.3 -0.943 51.5 55.4-132.3 109.6 14.8 2.4 26.5 103 111 A G S > S- 0 0 0 -2,-0.4 3,-2.8 -69,-0.3 2,-0.7 -0.892 98.7 -38.0 155.1 175.9 14.5 -0.8 28.5 104 112 A V T 3 S+ 0 0 3 -69,-2.6 117,-0.3 1,-0.3 -67,-0.3 -0.566 133.5 27.8 -69.9 109.1 16.2 -4.0 29.6 105 113 A G T > S- 0 0 0 -2,-0.7 3,-1.9 -95,-0.3 115,-0.3 0.253 96.2-146.1 115.3 -10.2 17.9 -4.9 26.3 106 114 A G G X S- 0 0 8 -3,-2.8 3,-2.0 1,-0.3 4,-0.4 -0.125 74.0 -2.9 54.9-138.1 18.3 -1.3 24.9 107 115 A G G >> S+ 0 0 26 -6,-0.3 4,-1.8 1,-0.3 3,-0.7 0.704 119.7 78.7 -64.8 -17.9 18.0 -1.0 21.2 108 116 A S G <4 S+ 0 0 0 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.742 89.2 59.2 -61.6 -20.1 17.6 -4.8 20.8 109 117 A L G <4 S+ 0 0 2 -3,-2.0 104,-0.4 -4,-0.2 -1,-0.2 0.867 118.5 25.2 -70.5 -38.9 14.0 -4.3 21.9 110 118 A V T <4 S+ 0 0 15 -3,-0.7 -2,-0.2 -4,-0.4 -1,-0.1 0.467 98.3 103.1-109.3 -6.8 13.1 -1.9 19.0 111 119 A N S < S- 0 0 37 -4,-1.8 101,-0.1 1,-0.1 100,-0.0 -0.162 79.2-109.5 -85.6 172.4 15.5 -2.8 16.2 112 120 A G - 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0 0 55 4,-2.3 3,-1.6 -2,-0.3 -4,-1.2 -0.084 62.3 -79.4 -73.9-172.7 42.7 2.9 24.7 452 460 A D T 3 S+ 0 0 26 1,-0.3 -6,-0.1 -6,-0.2 -1,-0.1 0.472 132.8 47.8 -79.9 8.7 42.2 0.2 22.0 453 461 A Y T 3 S- 0 0 51 2,-0.1 -1,-0.3 36,-0.0 40,-0.1 0.173 124.3 -95.2-126.0 12.0 40.0 -1.9 24.5 454 462 A G S < S+ 0 0 0 -3,-1.6 10,-2.5 1,-0.3 2,-0.6 0.555 70.3 151.3 83.9 11.1 37.7 0.9 25.7 455 463 A R B -G 463 0A 46 8,-0.2 -4,-2.3 1,-0.1 -1,-0.3 -0.651 53.3-116.5 -73.2 120.1 39.7 1.9 28.8 456 464 A V B > -X 450 0K 2 6,-2.7 3,-1.7 -2,-0.6 -6,-0.3 -0.368 29.8-111.0 -64.6 129.2 38.9 5.6 29.2 457 465 A A T 3 S+ 0 0 36 -8,-2.2 -154,-0.4 1,-0.2 -1,-0.1 -0.350 100.7 25.2 -62.0 134.8 42.0 7.7 28.9 458 466 A G T 3 S+ 0 0 41 1,-0.2 2,-0.3 -156,-0.1 -1,-0.2 0.240 112.7 76.1 99.7 -9.4 43.0 9.4 32.2 459 467 A Y < - 0 0 35 -3,-1.7 2,-0.4 3,-0.2 3,-0.3 -0.945 65.6-135.7-138.8 152.5 41.4 6.7 34.5 460 468 A K S S+ 0 0 152 -2,-0.3 -208,-0.1 1,-0.2 3,-0.1 -0.851 89.1 10.4-104.9 142.2 41.9 3.2 35.8 461 469 A N S S+ 0 0 17 -2,-0.4 -184,-2.5 1,-0.2 2,-0.5 0.741 94.6 121.0 63.6 27.7 39.0 0.7 35.9 462 470 A L E +f 277 0A 0 -3,-0.3 -6,-2.7 -6,-0.2 2,-0.4 -0.989 40.2 179.2-125.2 117.1 36.7 2.9 33.9 463 471 A Y E -fG 278 455A 0 -186,-2.9 -184,-3.1 -2,-0.5 2,-0.4 -0.932 25.5-154.0-130.0 144.7 35.5 1.4 30.6 464 472 A V E +f 279 0A 2 -10,-2.5 -184,-0.2 -2,-0.4 -2,-0.0 -0.947 18.1 172.0-115.9 139.4 33.3 2.2 27.7 465 473 A T + 0 0 9 -186,-2.5 -185,-0.1 -2,-0.4 24,-0.1 0.407 43.6 62.2-126.5 -3.7 31.7 -0.7 25.9 466 474 A D S > S- 0 0 7 -187,-0.3 3,-2.4 -184,-0.1 4,-0.3 -0.146 98.6 -50.8-127.4-160.9 29.2 0.4 23.3 467 475 A G G > S+ 0 0 5 1,-0.3 -25,-2.4 2,-0.2 3,-1.1 0.688 115.2 75.8 -60.1 -17.6 28.3 2.2 20.1 468 476 A S G 3 S+ 0 0 0 1,-0.2 -24,-2.5 -27,-0.2 -1,-0.3 0.735 89.1 61.5 -62.7 -22.2 30.1 5.3 21.4 469 477 A L G < S+ 0 0 2 -3,-2.4 -23,-2.6 -24,-0.2 -1,-0.2 0.688 83.6 93.4 -73.6 -25.9 33.4 3.5 20.6 470 478 A I S < S- 0 0 1 -3,-1.1 2,-2.5 -4,-0.3 -26,-0.2 -0.606 83.2-120.0 -83.4 138.6 32.8 3.2 16.9 471 479 A P - 0 0 21 0, 0.0 2,-0.2 0, 0.0 -29,-0.1 -0.353 60.5 -81.3 -79.4 64.8 34.2 5.9 14.6 472 480 A G S S+ 0 0 2 -2,-2.5 -159,-1.6 -163,-0.3 -158,-0.3 0.246 108.2 47.9 74.9 -15.6 30.9 7.1 13.1 473 481 A S + 0 0 3 -2,-0.2 -100,-0.1 -160,-0.2 -159,-0.0 -0.964 34.4 166.9-161.4 136.5 30.5 4.4 10.5 474 482 A V - 0 0 1 -2,-0.3 -355,-0.3 2,-0.2 3,-0.1 0.420 48.7-125.6-129.6 -4.9 30.6 0.6 10.0 475 483 A G S S+ 0 0 2 -103,-0.3 2,-0.3 1,-0.2 -104,-0.1 0.426 85.1 53.6 80.0 -0.9 29.0 0.2 6.6 476 484 A V S S- 0 0 10 -360,-0.1 -2,-0.2 -104,-0.1 -1,-0.2 -0.909 110.8 -58.6-149.9 170.8 26.4 -2.2 7.8 477 485 A N - 0 0 11 -2,-0.3 -361,-0.4 1,-0.1 3,-0.4 -0.419 60.4-139.5 -57.8 132.1 23.7 -2.4 10.5 478 486 A P S > S+ 0 0 15 0, 0.0 4,-2.2 0, 0.0 3,-0.3 0.553 74.2 87.5 -86.6 -13.2 25.9 -2.0 13.6 479 487 A F H > S+ 0 0 13 -365,-0.3 4,-2.6 1,-0.2 5,-0.2 0.837 88.2 54.3 -68.1 -30.1 24.9 -4.3 16.5 480 488 A V H > S+ 0 0 5 -3,-0.4 4,-2.8 -364,-0.3 -1,-0.2 0.925 111.0 47.6 -64.4 -39.9 27.0 -7.3 15.5 481 489 A T H > S+ 0 0 0 -365,-0.4 4,-2.7 -3,-0.3 5,-0.3 0.930 112.0 49.0 -63.6 -45.8 30.1 -5.1 15.4 482 490 A I H X S+ 0 0 20 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.930 113.9 47.6 -57.9 -45.3 29.3 -3.6 18.8 483 491 A T H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.937 113.6 45.1 -60.6 -51.3 28.7 -7.0 20.2 484 492 A A H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.903 113.4 50.0 -65.1 -41.0 32.0 -8.5 18.8 485 493 A L H X S+ 0 0 3 -4,-2.7 4,-2.8 -5,-0.2 -1,-0.2 0.905 110.2 51.7 -62.7 -40.4 34.1 -5.5 19.9 486 494 A A H X S+ 0 0 1 -4,-2.2 4,-2.5 -5,-0.3 5,-0.3 0.875 107.4 52.0 -65.6 -35.9 32.6 -5.8 23.3 487 495 A E H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.931 112.6 46.2 -61.2 -46.6 33.5 -9.5 23.5 488 496 A R H X S+ 0 0 4 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.930 115.3 46.2 -58.6 -48.5 37.1 -8.6 22.5 489 497 A N H X S+ 0 0 5 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.939 112.4 46.3 -67.2 -48.5 37.3 -5.7 25.0 490 498 A V H X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.859 109.8 54.8 -68.7 -32.8 35.8 -7.4 28.1 491 499 A E H X S+ 0 0 48 -4,-1.7 4,-1.9 -5,-0.3 -1,-0.2 0.938 114.4 40.9 -61.5 -47.3 37.9 -10.5 27.6 492 500 A R H X S+ 0 0 67 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.906 114.9 50.7 -67.5 -45.9 41.1 -8.4 27.5 493 501 A I H X>S+ 0 0 4 -4,-2.9 4,-2.9 1,-0.2 5,-0.9 0.921 111.1 48.6 -61.9 -43.6 40.1 -6.1 30.4 494 502 A I H X5S+ 0 0 32 -4,-2.5 4,-1.1 -5,-0.2 -1,-0.2 0.955 113.9 47.9 -60.4 -46.5 39.2 -9.0 32.6 495 503 A K H <5S+ 0 0 118 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.919 125.1 26.7 -60.8 -45.2 42.5 -10.7 31.9 496 504 A Q H <5S+ 0 0 114 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.762 133.5 25.6 -92.2 -24.1 44.7 -7.7 32.4 497 505 A D H <5 0 0 48 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.1 0.626 360.0 360.0-115.5 -26.2 42.8 -5.5 34.9 498 506 A V << 0 0 61 -4,-1.1 -1,-0.1 -5,-0.9 -472,-0.0 -0.820 360.0 360.0-103.7 360.0 40.4 -7.6 37.0