==== 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 31-JAN-01 1I19 . COMPND 2 MOLECULE: CHOLESTEROL OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BREVIBACTERIUM STEROLICUM; . AUTHOR R.COULOMBE,K.Q.YUE,S.GHISLA,A.VRIELINK . 1079 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38779.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 709 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 175 16.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 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 . 75 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 117 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 229 21.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.7 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 5 6 4 0 2 1 1 4 0 1 1 2 0 0 2 0 1 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 0 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 PARALLEL BRIDGES PER LADDER . 4 2 0 6 9 5 2 0 2 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 . 2 0 2 2 0 0 0 0 2 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 57 A V 0 0 132 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 138.9 3.1 6.9 54.7 2 58 A A - 0 0 79 1,-0.1 2,-0.1 30,-0.0 0, 0.0 -0.363 360.0-108.8 -62.2 135.2 2.2 5.2 51.4 3 59 A P - 0 0 112 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.417 32.0-117.4 -68.5 139.3 5.2 4.9 49.0 4 60 A L - 0 0 26 1,-0.1 29,-0.0 -2,-0.1 14,-0.0 -0.378 42.9 -82.7 -73.0 153.8 5.1 7.1 45.9 5 61 A P - 0 0 61 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.320 53.3-106.0 -57.3 136.1 5.0 5.4 42.5 6 62 A T - 0 0 122 1,-0.1 3,-0.1 -3,-0.1 73,-0.0 -0.489 36.6-113.0 -67.6 126.0 8.5 4.4 41.4 7 63 A P > - 0 0 6 0, 0.0 3,-0.9 0, 0.0 2,-0.2 -0.359 38.1-103.6 -60.7 135.9 9.7 6.8 38.7 8 64 A P T 3 S- 0 0 51 0, 0.0 46,-0.0 0, 0.0 0, 0.0 -0.434 87.7 -21.5 -67.2 125.5 10.1 5.0 35.3 9 65 A N T 3 S- 0 0 143 -2,-0.2 3,-0.1 1,-0.1 -3,-0.0 0.861 84.1-172.0 42.1 51.6 13.7 4.2 34.3 10 66 A F < - 0 0 23 -3,-0.9 -1,-0.1 1,-0.1 6,-0.1 -0.448 41.4 -79.2 -71.5 143.7 15.2 6.8 36.6 11 67 A P > - 0 0 23 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.196 40.4-142.3 -46.5 119.3 19.0 7.4 36.2 12 68 A N T 3 S+ 0 0 171 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.725 96.3 52.7 -59.2 -26.7 20.6 4.6 38.1 13 69 A D T 3 S+ 0 0 94 1,-0.1 2,-0.7 2,-0.1 -1,-0.3 0.379 93.0 81.0 -93.3 4.5 23.5 6.7 39.5 14 70 A I S < S- 0 0 13 -3,-1.7 -1,-0.1 24,-0.1 2,-0.0 -0.894 79.9-138.9-113.0 101.2 21.2 9.4 40.9 15 71 A A - 0 0 53 -2,-0.7 22,-0.5 22,-0.2 2,-0.4 -0.319 14.0-152.6 -61.4 135.9 19.8 8.2 44.3 16 72 A L - 0 0 44 20,-0.1 2,-0.4 -6,-0.1 20,-0.2 -0.920 12.0-174.6-112.8 136.7 16.2 8.9 44.9 17 73 A F E -A 35 0A 111 18,-2.9 18,-2.7 -2,-0.4 2,-0.7 -0.993 22.3-134.8-132.4 137.6 14.7 9.4 48.4 18 74 A Q E +A 34 0A 65 -2,-0.4 2,-0.3 16,-0.2 16,-0.2 -0.827 39.8 162.1 -92.4 116.1 11.1 9.8 49.5 19 75 A Q E -A 33 0A 79 14,-2.3 14,-1.6 -2,-0.7 2,-0.1 -0.917 39.5-109.3-131.8 158.6 10.9 12.7 52.0 20 76 A A E - 0 0 64 -2,-0.3 2,-0.4 12,-0.2 11,-0.2 -0.399 31.4-137.5 -78.7 163.2 8.2 14.9 53.4 21 77 A Y E +A 30 0A 8 9,-2.8 9,-2.5 -2,-0.1 2,-0.3 -0.994 28.3 163.6-126.6 134.9 8.2 18.5 52.4 22 78 A Q E -A 29 0A 81 -2,-0.4 7,-0.2 7,-0.2 2,-0.1 -0.950 25.2-142.7-150.1 123.9 7.6 21.4 54.7 23 79 A N > - 0 0 2 5,-1.8 3,-1.4 -2,-0.3 42,-0.2 -0.363 39.5 -93.7 -81.2 169.7 8.4 25.1 54.1 24 80 A W T 3 S+ 0 0 25 40,-1.8 41,-0.1 1,-0.3 42,-0.1 0.909 126.7 45.9 -49.9 -51.5 9.6 27.3 56.9 25 81 A S T 3 S- 0 0 4 40,-0.2 -1,-0.3 41,-0.1 40,-0.1 0.618 103.7-132.4 -69.6 -10.9 6.2 28.6 57.9 26 82 A K S < S+ 0 0 96 -3,-1.4 -2,-0.1 2,-0.2 -1,-0.1 0.619 75.0 120.9 67.3 14.6 4.8 25.1 57.7 27 83 A E S S+ 0 0 45 1,-0.2 2,-0.6 47,-0.0 -1,-0.1 0.729 70.6 54.5 -77.1 -23.2 1.9 26.4 55.7 28 84 A I S S+ 0 0 13 46,-0.1 -5,-1.8 -5,-0.1 2,-0.4 -0.939 71.9 160.8-114.7 108.3 3.0 24.0 52.9 29 85 A M E +A 22 0A 105 -2,-0.6 2,-0.4 -7,-0.2 46,-0.4 -0.980 11.9 174.9-134.0 122.3 3.2 20.4 54.1 30 86 A L E -A 21 0A 16 -9,-2.5 -9,-2.8 -2,-0.4 3,-0.1 -0.990 25.9-145.0-124.3 132.4 3.2 17.3 51.9 31 87 A D E S+ 0 0 121 -2,-0.4 2,-0.4 -11,-0.2 -1,-0.1 0.754 83.4 27.6 -68.3 -23.9 3.8 13.8 53.5 32 88 A A E + 0 0 12 -12,-0.1 2,-0.3 -11,-0.1 -12,-0.2 -0.974 58.5 151.5-149.9 133.1 5.7 12.6 50.4 33 89 A T E -A 19 0A 1 -14,-1.6 -14,-2.3 -2,-0.4 2,-0.5 -0.968 43.3-110.9-148.6 153.5 7.9 13.9 47.6 34 90 A W E -Ab 18 82A 28 47,-0.7 49,-2.9 44,-0.4 2,-0.4 -0.788 40.7-177.1 -90.2 131.2 10.7 12.4 45.5 35 91 A V E +Ab 17 83A 3 -18,-2.7 -18,-2.9 -2,-0.5 2,-0.3 -0.980 11.7 170.0-133.6 143.4 14.0 14.1 46.3 36 92 A C E - b 0 84A 0 47,-2.2 49,-2.8 -2,-0.4 -20,-0.1 -0.938 27.9-134.2-143.1 162.7 17.5 13.7 44.9 37 93 A S - 0 0 30 -22,-0.5 -22,-0.2 -2,-0.3 49,-0.1 -0.812 21.8-144.8-123.9 90.4 20.8 15.6 45.3 38 94 A P - 0 0 1 0, 0.0 51,-0.3 0, 0.0 52,-0.3 -0.308 2.6-153.1 -55.9 128.6 22.5 16.1 41.9 39 95 A K S S+ 0 0 128 50,-0.1 3,-0.0 1,-0.1 -25,-0.0 0.780 74.2 14.3 -75.2 -28.2 26.3 15.9 42.3 40 96 A T S >> S- 0 0 60 1,-0.1 3,-1.1 50,-0.1 4,-0.9 -0.935 81.0-104.6-143.2 164.2 27.1 18.2 39.4 41 97 A P H >> S+ 0 0 43 0, 0.0 4,-1.4 0, 0.0 3,-1.0 0.879 119.7 60.2 -57.7 -36.3 25.3 20.7 37.1 42 98 A Q H 3> S+ 0 0 99 1,-0.3 4,-2.1 2,-0.2 5,-0.1 0.787 97.0 59.8 -62.7 -27.4 25.4 18.0 34.3 43 99 A D H <> S+ 0 0 19 -3,-1.1 4,-1.8 2,-0.2 -1,-0.3 0.800 100.9 54.1 -71.7 -26.8 23.3 15.8 36.6 44 100 A V H <>S+ 0 0 0 -4,-2.9 5,-2.6 1,-0.2 3,-0.7 0.919 109.5 50.9 -59.4 -45.4 11.8 14.5 33.2 52 108 A H H ><5S+ 0 0 41 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.935 109.2 50.3 -58.2 -49.0 10.9 15.7 29.7 53 109 A E H 3<5S+ 0 0 136 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.644 119.4 36.9 -66.7 -15.9 10.9 12.1 28.3 54 110 A H T <<5S- 0 0 53 -4,-1.0 -1,-0.2 -3,-0.7 -2,-0.2 0.212 110.0-112.4-122.1 16.0 8.6 10.9 31.1 55 111 A D T < 5 + 0 0 120 -3,-1.1 2,-0.2 -4,-0.4 -3,-0.2 0.860 69.9 139.6 55.2 40.4 6.3 14.0 31.6 56 112 A Y < - 0 0 13 -5,-2.6 2,-0.3 -6,-0.2 25,-0.2 -0.699 45.9-131.4-106.4 163.1 7.7 14.7 35.1 57 113 A K E -c 81 0A 64 23,-2.2 25,-2.5 -2,-0.2 2,-0.4 -0.815 11.4-147.4-113.3 156.4 8.5 18.2 36.5 58 114 A I E -c 82 0A 0 473,-2.6 25,-0.2 -2,-0.3 475,-0.1 -0.988 12.4-175.0-126.0 132.5 11.7 19.2 38.2 59 115 A R E -c 83 0A 3 23,-2.1 25,-2.9 -2,-0.4 2,-0.2 -0.993 25.0-127.2-129.1 130.1 11.9 21.8 41.0 60 116 A P E -c 84 0A 32 0, 0.0 2,-0.6 0, 0.0 25,-0.2 -0.553 22.9-148.0 -73.2 138.5 15.2 23.1 42.6 61 117 A R E +c 85 0A 19 23,-2.9 25,-1.7 -2,-0.2 26,-0.7 -0.924 26.7 161.7-114.7 112.3 15.1 22.7 46.4 62 118 A G - 0 0 17 -2,-0.6 25,-0.1 23,-0.2 73,-0.1 0.349 68.9 -38.1 -95.2-130.8 17.0 25.3 48.4 63 119 A A S S- 0 0 24 1,-0.1 72,-0.1 73,-0.0 -2,-0.0 0.453 74.0-126.1 -79.2 -0.5 16.6 26.1 52.1 64 120 A M S S+ 0 0 60 1,-0.1 -40,-1.8 -41,-0.1 -1,-0.1 0.714 70.8 129.8 63.6 24.5 12.8 25.6 51.8 65 121 A H + 0 0 34 -42,-0.2 -40,-0.2 -41,-0.1 -1,-0.1 0.626 33.1 125.6 -81.6 -13.0 12.0 29.1 53.3 66 122 A G - 0 0 40 1,-0.2 -41,-0.1 -42,-0.1 5,-0.1 -0.219 36.8-178.8 -56.1 125.1 9.7 29.9 50.4 67 123 A W + 0 0 36 415,-0.7 -1,-0.2 -44,-0.1 416,-0.1 0.846 68.0 81.5 -85.1 -43.1 6.2 31.0 51.4 68 124 A T S S- 0 0 10 414,-0.6 2,-2.9 1,-0.1 3,-0.4 -0.472 93.7-118.5 -66.9 128.8 5.1 31.3 47.8 69 125 A P S S+ 0 0 12 0, 0.0 467,-0.3 0, 0.0 468,-0.2 -0.221 72.3 126.6 -68.1 55.8 4.2 27.9 46.3 70 126 A L S S+ 0 0 19 -2,-2.9 3,-0.1 466,-0.1 -2,-0.0 0.545 76.1 38.4 -90.9 -10.4 6.9 27.9 43.6 71 127 A T S S- 0 0 32 1,-0.4 2,-0.3 -3,-0.4 -10,-0.0 0.798 133.7 -12.4 -98.7 -72.9 8.4 24.5 44.6 72 128 A V - 0 0 6 462,-0.1 -1,-0.4 463,-0.0 2,-0.3 -0.955 67.4-127.0-130.1 149.2 5.3 22.5 45.5 73 129 A E > - 0 0 58 -2,-0.3 3,-2.0 -3,-0.1 -5,-0.0 -0.726 36.8 -95.1 -95.3 147.0 1.7 23.5 46.1 74 130 A K T 3 S+ 0 0 165 -2,-0.3 -44,-0.1 1,-0.3 -1,-0.1 -0.342 109.0 2.1 -58.1 130.5 -0.3 22.6 49.2 75 131 A G T 3 S+ 0 0 74 -46,-0.4 -1,-0.3 1,-0.2 2,-0.1 0.559 96.5 146.4 68.4 9.8 -2.3 19.4 48.5 76 132 A A < - 0 0 35 -3,-2.0 2,-0.7 1,-0.1 -1,-0.2 -0.406 57.7-109.0 -79.3 155.0 -1.0 19.0 45.0 77 133 A N + 0 0 115 1,-0.1 3,-0.3 -2,-0.1 -1,-0.1 -0.749 38.5 174.8 -82.4 116.0 -0.3 15.6 43.4 78 134 A V > + 0 0 14 -2,-0.7 3,-1.4 -46,-0.2 -44,-0.4 0.022 41.0 116.2-112.9 27.3 3.4 15.3 43.2 79 135 A E T 3 S+ 0 0 85 1,-0.3 -1,-0.2 -46,-0.1 -46,-0.0 0.777 85.4 42.4 -64.6 -24.9 3.7 11.7 41.9 80 136 A K T 3 S+ 0 0 116 -3,-0.3 -23,-2.2 -73,-0.1 2,-0.4 -0.199 98.1 95.4-115.3 40.9 5.3 13.2 38.8 81 137 A V E < - c 0 57A 22 -3,-1.4 -47,-0.7 -25,-0.2 2,-0.5 -0.992 51.0-163.2-132.5 138.5 7.6 15.7 40.4 82 138 A I E -bc 34 58A 0 -25,-2.5 -23,-2.1 -2,-0.4 2,-0.5 -0.987 11.2-149.1-121.4 127.3 11.2 15.4 41.4 83 139 A L E -bc 35 59A 1 -49,-2.9 -47,-2.2 -2,-0.5 2,-0.8 -0.850 7.7-152.0 -97.4 128.4 12.8 17.8 43.8 84 140 A A E -bc 36 60A 0 -25,-2.9 -23,-2.9 -2,-0.5 2,-0.6 -0.859 6.8-148.3-104.6 100.9 16.5 18.5 43.2 85 141 A D E - c 0 61A 22 -49,-2.8 4,-0.4 -2,-0.8 5,-0.2 -0.564 17.2-178.5 -69.0 112.7 18.2 19.5 46.5 86 142 A T > + 0 0 4 -25,-1.7 4,-0.8 -2,-0.6 23,-0.4 0.623 69.2 69.5 -89.7 -15.9 21.0 21.9 45.3 87 143 A M T 4 S+ 0 0 50 -26,-0.7 -1,-0.2 1,-0.2 24,-0.1 0.701 86.0 68.3 -78.9 -17.4 22.5 22.5 48.7 88 144 A T T 4 S- 0 0 59 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.950 128.8 -12.0 -65.7 -49.5 24.0 19.0 49.1 89 145 A H T 4 S+ 0 0 82 -4,-0.4 2,-2.0 -51,-0.3 3,-0.3 0.665 117.7 77.8-125.0 -32.0 26.6 19.3 46.3 90 146 A L < + 0 0 12 -4,-0.8 19,-2.9 -52,-0.3 20,-0.5 -0.318 68.6 103.6 -82.9 59.4 26.0 22.4 44.1 91 147 A N + 0 0 70 -2,-2.0 -1,-0.2 18,-0.3 20,-0.1 0.086 39.3 145.2-128.0 21.9 27.5 24.7 46.8 92 148 A G - 0 0 44 -3,-0.3 15,-2.5 14,-0.1 2,-0.4 -0.314 27.6-163.9 -64.7 146.6 31.0 25.5 45.5 93 149 A I E +D 106 0B 46 13,-0.2 2,-0.4 2,-0.0 13,-0.2 -0.981 13.4 169.2-137.4 124.3 32.4 29.0 46.3 94 150 A T E -D 105 0B 86 11,-2.7 11,-3.2 -2,-0.4 2,-0.4 -0.985 23.0-143.6-138.0 125.6 35.3 30.8 44.6 95 151 A V E -D 104 0B 22 -2,-0.4 2,-0.7 9,-0.2 9,-0.3 -0.747 10.3-159.0 -90.1 130.8 36.3 34.4 44.9 96 152 A N E +D 103 0B 55 7,-3.1 7,-2.5 -2,-0.4 5,-0.1 -0.910 19.9 167.1-112.5 105.3 37.7 36.1 41.8 97 153 A T + 0 0 97 -2,-0.7 2,-0.9 5,-0.2 5,-0.1 0.271 50.3 97.7-100.0 11.1 39.8 39.2 42.6 98 154 A G S S+ 0 0 77 5,-0.1 -1,-0.1 3,-0.1 3,-0.1 -0.762 71.5 43.1-105.1 91.6 41.3 39.5 39.1 99 155 A G S S- 0 0 53 -2,-0.9 3,-0.1 1,-0.1 4,-0.0 -0.982 102.5 -53.6 167.1-173.3 39.4 42.0 37.1 100 156 A P S S+ 0 0 127 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.820 124.2 12.1 -59.7 -33.2 37.6 45.5 36.9 101 157 A V S S- 0 0 18 -3,-0.1 114,-0.1 -5,-0.1 59,-0.1 -0.994 89.4-104.3-146.0 144.3 35.6 44.5 40.0 102 158 A A - 0 0 19 112,-0.4 112,-2.3 -2,-0.3 2,-0.3 -0.388 43.3-179.2 -67.9 146.2 35.9 41.6 42.4 103 159 A T E -DE 96 213B 18 -7,-2.5 -7,-3.1 110,-0.3 2,-0.4 -0.898 20.2-143.7-140.4 169.4 33.4 38.8 42.0 104 160 A V E -DE 95 212B 3 108,-2.1 108,-2.5 -2,-0.3 2,-0.5 -0.998 9.0-150.1-139.7 133.2 32.4 35.5 43.6 105 161 A T E +DE 94 211B 45 -11,-3.2 -11,-2.7 -2,-0.4 2,-0.4 -0.905 24.0 174.5-105.2 129.9 31.2 32.4 41.8 106 162 A A E -DE 93 210B 3 104,-2.9 104,-2.2 -2,-0.5 -13,-0.2 -0.997 35.4-113.5-141.6 141.3 28.9 30.1 43.7 107 163 A G E > - E 0 209B 11 -15,-2.5 3,-2.0 -2,-0.4 102,-0.3 -0.388 40.8-112.7 -63.3 149.2 26.9 27.0 43.0 108 164 A A T 3 S+ 0 0 4 100,-1.9 30,-2.2 1,-0.3 31,-0.4 0.654 115.1 59.3 -61.1 -16.3 23.2 27.8 43.2 109 165 A G T 3 S+ 0 0 1 -19,-2.9 -1,-0.3 -23,-0.4 -18,-0.3 0.464 78.4 110.6 -92.0 -3.2 22.9 25.7 46.4 110 166 A A S < S- 0 0 3 -3,-2.0 27,-2.7 -20,-0.5 28,-0.3 -0.483 72.1-118.3 -71.8 141.7 25.4 27.7 48.4 111 167 A S B > -H 136 0C 27 25,-0.3 4,-2.1 -2,-0.2 25,-0.3 -0.460 15.8-123.6 -77.7 152.8 23.9 29.7 51.3 112 168 A I H > S+ 0 0 0 23,-2.6 4,-2.7 21,-0.3 5,-0.2 0.854 113.0 56.5 -66.4 -29.7 24.3 33.5 51.2 113 169 A E H > S+ 0 0 53 20,-2.3 4,-1.9 22,-0.3 -1,-0.2 0.913 106.4 49.1 -66.4 -40.9 26.0 33.3 54.6 114 170 A A H > S+ 0 0 39 19,-0.4 4,-1.8 2,-0.2 -2,-0.2 0.931 112.7 49.2 -62.8 -43.7 28.6 30.9 53.2 115 171 A I H X S+ 0 0 1 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.948 114.4 41.9 -61.6 -51.4 29.2 33.2 50.3 116 172 A V H X S+ 0 0 4 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.768 109.2 60.0 -70.5 -23.1 29.6 36.4 52.3 117 173 A T H X S+ 0 0 48 -4,-1.9 4,-1.1 -5,-0.2 -1,-0.2 0.915 108.8 44.1 -68.1 -40.8 31.7 34.6 54.9 118 174 A E H X S+ 0 0 51 -4,-1.8 4,-0.6 1,-0.2 3,-0.5 0.899 110.3 55.2 -69.0 -39.4 34.2 33.8 52.1 119 175 A L H ><>S+ 0 0 0 -4,-2.1 5,-2.3 1,-0.2 3,-1.8 0.916 102.6 57.4 -58.5 -41.7 34.0 37.3 50.8 120 176 A Q H ><5S+ 0 0 52 -4,-2.2 3,-1.9 1,-0.3 -1,-0.2 0.843 96.2 62.7 -57.8 -35.4 34.9 38.6 54.3 121 177 A K H 3<5S+ 0 0 148 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.718 109.3 42.3 -63.5 -18.6 38.1 36.5 54.1 122 178 A H T <<5S- 0 0 79 -3,-1.8 -1,-0.3 -4,-0.6 -2,-0.2 0.112 121.7-105.1-113.3 18.2 39.1 38.7 51.1 123 179 A D T < 5S+ 0 0 118 -3,-1.9 94,-2.0 1,-0.2 2,-0.3 0.866 84.0 122.9 58.7 39.1 37.9 42.0 52.6 124 180 A L E < +I 216 0D 18 -5,-2.3 2,-0.3 92,-0.3 -1,-0.2 -0.809 30.4 153.4-123.7 165.3 34.8 42.0 50.4 125 181 A G E -I 215 0D 1 90,-2.3 90,-2.0 -2,-0.3 2,-0.4 -0.989 38.7 -98.3-176.5 174.4 31.1 42.1 51.1 126 182 A W - 0 0 2 -2,-0.3 3,-0.3 88,-0.2 35,-0.1 -0.895 20.2-148.6-112.2 142.9 27.6 42.9 50.0 127 183 A A S S+ 0 0 4 -2,-0.4 2,-0.3 35,-0.2 36,-0.1 0.760 86.3 40.8 -82.5 -28.1 25.8 46.1 51.1 128 184 A N S S+ 0 0 5 34,-0.3 19,-0.3 19,-0.1 -1,-0.2 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99.7 64.8 -64.4 -33.6 22.3 50.4 36.5 414 485 A A G 34 S+ 0 0 72 1,-0.3 -1,-0.2 3,-0.1 -2,-0.0 0.727 93.7 61.5 -62.8 -22.7 25.1 52.6 37.9 415 486 A D G <4 S+ 0 0 15 -3,-1.0 2,-0.6 -256,-0.1 -255,-0.5 0.758 84.2 89.6 -75.1 -25.7 25.8 50.0 40.6 416 487 A V << - 0 0 15 -3,-1.2 4,-0.1 -4,-0.5 -247,-0.1 -0.646 55.3-173.3 -78.8 118.2 26.7 47.4 37.9 417 488 A K + 0 0 98 -2,-0.6 -1,-0.1 2,-0.1 -3,-0.1 0.227 63.0 67.7 -97.2 12.3 30.4 47.5 37.2 418 489 A V S S- 0 0 29 -318,-0.0 -205,-0.0 1,-0.0 -2,-0.0 -0.872 105.8 -74.4-124.1 158.6 30.5 45.1 34.3 419 490 A P + 0 0 103 0, 0.0 2,-0.3 0, 0.0 -229,-0.1 -0.316 64.1 179.5 -53.8 134.6 28.9 45.6 30.8 420 491 A S - 0 0 45 -229,-0.2 -229,-0.3 -4,-0.1 -230,-0.1 -0.999 40.4-152.6-144.9 144.3 25.2 45.1 31.3 421 492 A V S S- 0 0 67 -231,-2.2 -230,-0.1 -2,-0.3 -1,-0.1 0.511 72.3 -74.6 -89.4 -6.3 22.0 45.3 29.2 422 493 A G - 0 0 11 -232,-0.4 -1,-0.3 -9,-0.1 3,-0.1 -0.913 61.1 -40.5 146.4-173.4 19.9 46.3 32.3 423 494 A P S S- 0 0 27 0, 0.0 -224,-0.1 0, 0.0 7,-0.1 -0.269 77.9 -65.8 -82.8 171.9 18.2 45.3 35.6 424 495 A P > - 0 0 0 0, 0.0 3,-0.5 0, 0.0 -228,-0.1 -0.355 49.0-130.8 -58.0 139.0 16.3 42.1 36.3 425 496 A T T 3 S+ 0 0 1 -229,-1.9 91,-0.1 1,-0.2 -229,-0.1 0.928 96.4 20.4 -60.7 -49.5 13.2 42.1 34.1 426 497 A I T 3 S+ 0 0 0 -226,-0.4 -1,-0.2 -230,-0.3 2,-0.2 0.076 85.2 129.9-113.5 25.7 10.6 41.3 36.8 427 498 A S X - 0 0 0 -3,-0.5 3,-1.6 1,-0.1 -283,-0.1 -0.526 61.2-131.9 -75.8 145.4 12.3 42.2 40.1 428 499 A A T 3 S+ 0 0 0 1,-0.3 -1,-0.1 -2,-0.2 -284,-0.1 0.740 109.2 59.8 -68.0 -19.3 10.1 44.3 42.3 429 500 A T T 3 S+ 0 0 0 -19,-0.1 -18,-2.9 12,-0.1 -1,-0.3 0.340 74.6 124.1 -90.1 6.0 13.2 46.4 42.7 430 501 A R < - 0 0 18 -3,-1.6 -18,-0.1 -20,-0.2 -5,-0.0 -0.503 67.5-113.7 -70.3 130.4 13.6 47.2 39.0 431 502 A P - 0 0 29 0, 0.0 8,-0.1 0, 0.0 -1,-0.1 -0.244 23.8-120.6 -61.6 151.9 13.7 51.0 38.4 432 503 A R > - 0 0 10 3,-0.4 3,-1.9 6,-0.3 6,-0.3 -0.867 13.9-155.6 -98.2 114.6 10.8 52.6 36.5 433 504 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 77,-0.1 0.841 94.8 55.8 -55.4 -37.7 12.0 54.3 33.3 434 505 A D T 3 S+ 0 0 69 75,-0.7 3,-0.1 1,-0.3 76,-0.1 0.471 113.7 43.0 -76.4 -1.1 9.0 56.6 33.3 435 506 A H X + 0 0 38 -3,-1.9 3,-1.8 74,-0.1 -3,-0.4 -0.547 59.1 167.9-145.7 74.2 9.9 57.8 36.8 436 507 A P T 3 S+ 0 0 119 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.730 78.7 63.4 -60.4 -21.3 13.6 58.4 37.2 437 508 A D T 3 S+ 0 0 85 -3,-0.1 2,-0.8 -68,-0.1 -67,-0.5 0.610 77.9 94.2 -80.3 -12.6 13.0 60.1 40.5 438 509 A W < + 0 0 4 -3,-1.8 -6,-0.3 -6,-0.3 -69,-0.3 -0.741 44.9 149.6 -81.0 112.7 11.6 56.9 42.1 439 510 A D + 0 0 64 -71,-1.1 -29,-0.5 -2,-0.8 2,-0.3 0.204 43.8 61.9-133.8 16.1 14.7 55.5 43.7 440 511 A V E -O 368 0E 1 -72,-1.9 -72,-1.9 -31,-0.2 2,-0.5 -0.976 58.7-144.1-142.3 156.4 13.6 53.5 46.8 441 512 A A E -OQ 367 408E 0 -33,-2.5 -33,-1.7 -2,-0.3 2,-0.7 -0.992 15.8-158.1-119.9 120.6 11.5 50.5 47.6 442 513 A I E -OQ 366 407E 0 -76,-2.4 -76,-2.4 -2,-0.5 2,-0.7 -0.907 9.0-150.8-103.4 113.3 9.6 50.8 50.8 443 514 A W E -OQ 365 406E 0 -37,-3.0 -37,-1.5 -2,-0.7 2,-0.7 -0.763 13.5-175.0 -90.1 113.2 8.7 47.4 52.2 444 515 A L E +OQ 364 405E 0 -80,-3.2 -80,-2.6 -2,-0.7 2,-0.3 -0.915 16.0 169.4-109.7 105.9 5.4 47.4 54.2 445 516 A N E -OQ 363 404E 0 -41,-2.8 -41,-2.6 -2,-0.7 2,-0.4 -0.855 24.5-161.2-120.8 154.6 4.8 44.0 55.7 446 517 A V E -OQ 362 403E 0 -84,-1.5 -84,-2.3 -2,-0.3 2,-0.3 -0.998 14.3-159.6-131.1 134.2 2.4 42.5 58.2 447 518 A L E +O 361 0E 8 -45,-2.4 -46,-0.7 -2,-0.4 2,-0.3 -0.829 14.6 167.1-114.4 153.2 3.1 39.2 59.9 448 519 A G E -O 360 0E 0 -88,-1.6 -88,-2.6 -2,-0.3 -49,-0.1 -0.990 42.1 -85.7-159.8 161.1 0.7 36.8 61.7 449 520 A V > - 0 0 4 -2,-0.3 3,-1.9 -90,-0.2 -90,-0.2 -0.551 54.1-107.1 -73.2 127.6 0.4 33.3 63.1 450 521 A P T 3 S+ 0 0 31 0, 0.0 -1,-0.1 0, 0.0 -92,-0.0 -0.249 104.2 27.2 -53.9 138.4 -0.6 30.8 60.4 451 522 A G T 3 S+ 0 0 70 1,-0.3 -2,-0.1 -3,-0.1 3,-0.0 0.356 78.7 150.6 91.5 -6.0 -4.2 29.6 60.8 452 523 A T X - 0 0 12 -3,-1.9 3,-2.0 1,-0.1 4,-0.5 -0.454 52.8-114.2 -64.4 118.8 -5.4 32.8 62.5 453 524 A P T 3 S+ 0 0 95 0, 0.0 -56,-0.1 0, 0.0 -1,-0.1 -0.271 96.8 9.5 -55.5 133.7 -9.1 33.2 61.7 454 525 A G T 3> S+ 0 0 39 1,-0.1 4,-2.0 -3,-0.0 5,-0.1 0.327 94.8 113.6 79.9 -9.1 -9.7 36.3 59.5 455 526 A M H <> S+ 0 0 1 -3,-2.0 4,-2.3 1,-0.2 5,-0.2 0.941 79.3 42.5 -61.0 -49.6 -6.0 37.0 58.9 456 527 A F H > S+ 0 0 39 -4,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.863 110.4 56.9 -67.7 -33.6 -6.1 36.3 55.2 457 528 A E H > S+ 0 0 95 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.913 110.2 46.7 -62.1 -39.1 -9.3 38.2 54.8 458 529 A F H X S+ 0 0 1 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.901 107.8 54.2 -69.2 -40.3 -7.5 41.1 56.4 459 530 A Y H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -96,-0.2 0.868 108.8 50.6 -61.4 -33.6 -4.4 40.6 54.1 460 531 A R H X S+ 0 0 60 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.920 109.6 49.9 -68.0 -42.4 -6.9 40.9 51.2 461 532 A E H X S+ 0 0 43 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.905 113.9 45.9 -61.4 -41.9 -8.3 44.1 52.6 462 533 A M H X S+ 0 0 0 -4,-2.8 4,-3.1 2,-0.2 5,-0.2 0.904 109.7 53.2 -68.3 -42.0 -4.8 45.4 52.9 463 534 A E H X S+ 0 0 5 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.914 111.4 47.2 -59.9 -41.9 -3.7 44.3 49.5 464 535 A Q H X S+ 0 0 114 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.896 112.5 49.3 -67.5 -39.4 -6.7 46.1 48.0 465 536 A W H X S+ 0 0 50 -4,-2.0 4,-3.1 -5,-0.2 5,-0.2 0.938 112.3 47.6 -65.9 -45.6 -6.0 49.3 50.0 466 537 A M H X S+ 0 0 0 -4,-3.1 4,-2.9 1,-0.2 -2,-0.2 0.909 110.3 51.7 -63.0 -41.9 -2.3 49.3 49.0 467 538 A R H < S+ 0 0 39 -4,-2.3 4,-0.3 -5,-0.2 -1,-0.2 0.901 117.3 39.8 -61.8 -39.5 -3.1 48.8 45.3 468 539 A S H < S+ 0 0 101 -4,-1.9 3,-0.4 -5,-0.2 -2,-0.2 0.890 121.4 42.1 -76.3 -39.4 -5.6 51.7 45.4 469 540 A H H < S+ 0 0 65 -4,-3.1 -2,-0.2 -5,-0.2 -3,-0.2 0.870 118.6 39.1 -77.5 -39.4 -3.5 54.0 47.7 470 541 A Y S < S+ 0 0 6 -4,-2.9 2,-0.6 -5,-0.2 -1,-0.2 0.137 90.6 88.7-103.2 20.5 0.0 53.6 46.3 471 542 A N + 0 0 64 -3,-0.4 2,-0.2 -4,-0.3 5,-0.2 -0.808 66.5 100.2-117.1 87.4 -0.6 53.4 42.5 472 543 A N B > S-R 475 0E 66 3,-2.5 3,-1.1 -2,-0.6 -3,-0.0 -0.775 90.1 -65.4-148.2-167.8 -0.5 57.0 41.4 473 544 A D T 3 S+ 0 0 134 1,-0.2 3,-0.1 -2,-0.2 -2,-0.0 0.698 130.9 42.3 -63.6 -19.5 1.7 59.7 39.8 474 545 A D T 3 S+ 0 0 100 1,-0.2 -105,-0.6 -106,-0.0 2,-0.3 0.408 122.2 10.0-110.1 1.2 4.1 59.6 42.8 475 546 A A E < -PR 368 472E 1 -3,-1.1 -3,-2.5 -107,-0.1 2,-0.3 -0.979 52.5-145.1-171.7 160.7 4.4 55.8 43.5 476 547 A T E -P 367 0E 1 -109,-2.0 -109,-2.7 -2,-0.3 2,-0.5 -0.982 19.5-135.2-134.8 144.5 3.6 52.3 42.3 477 548 A F E +P 366 0E 0 -2,-0.3 -111,-0.2 -111,-0.2 -2,-0.0 -0.882 22.2 178.3-105.5 131.5 2.8 49.2 44.4 478 549 A R E -P 365 0E 4 -113,-3.1 -113,-3.3 -2,-0.5 24,-0.0 -0.992 29.2-120.7-133.6 126.8 4.4 45.9 43.8 479 550 A P - 0 0 0 0, 0.0 2,-0.8 0, 0.0 -115,-0.2 -0.275 32.5-111.1 -60.4 150.3 3.8 42.7 45.8 480 551 A E > - 0 0 12 -117,-0.4 3,-2.1 4,-0.3 -336,-0.1 -0.785 26.3-142.4 -84.9 113.1 6.9 41.2 47.5 481 552 A W T 3 S+ 0 0 0 -2,-0.8 -1,-0.2 1,-0.3 -337,-0.1 0.829 96.1 52.5 -42.6 -46.3 7.4 38.0 45.4 482 553 A S T 3 S+ 0 0 26 -339,-0.4 -415,-0.7 -415,-0.1 -414,-0.6 0.632 107.5 58.7 -70.3 -16.6 8.5 36.0 48.5 483 554 A K S < S- 0 0 17 -3,-2.1 2,-0.2 1,-0.2 -121,-0.1 -0.237 100.3 -65.9-102.1-167.7 5.6 36.9 50.6 484 555 A G + 0 0 1 -123,-1.4 -4,-0.3 -2,-0.1 2,-0.3 -0.531 58.9 146.3 -82.3 149.2 1.8 36.5 50.3 485 556 A W + 0 0 2 -2,-0.2 7,-3.0 1,-0.1 8,-0.2 -0.945 46.5 54.5-166.3 172.4 -0.2 38.3 47.6 486 557 A A S S- 0 0 0 -2,-0.3 8,-2.5 5,-0.2 7,-1.5 0.930 70.6-170.6 55.9 46.4 -3.2 37.7 45.5 487 558 A F + 0 0 2 4,-0.2 3,-0.3 5,-0.2 -1,-0.2 -0.586 18.7 176.6 -72.2 118.3 -5.2 37.0 48.6 488 559 A G S S- 0 0 27 2,-2.5 7,-0.1 -2,-0.5 -1,-0.1 -0.001 91.0 -69.2-129.2 36.9 -8.6 35.7 47.6 489 560 A P S S+ 0 0 32 0, 0.0 3,-0.1 0, 0.0 5,-0.1 -0.974 140.2 60.7 -83.1 -23.4 -8.7 35.5 50.6 490 561 A D S > S- 0 0 87 -3,-0.3 -2,-2.5 1,-0.1 3,-1.3 -0.370 103.8 -93.8 -62.5 142.4 -6.1 32.7 50.8 491 562 A P T 3 S+ 0 0 19 0, 0.0 -5,-0.2 0, 0.0 -4,-0.2 -0.241 106.4 15.8 -60.0 147.0 -2.8 33.9 49.4 492 563 A Y T 3 S+ 0 0 32 -7,-3.0 -5,-0.2 -3,-0.1 -6,-0.2 0.655 103.3 95.2 66.6 19.0 -2.1 33.1 45.7 493 564 A T < + 0 0 75 -7,-1.5 2,-1.3 -3,-1.3 -6,-0.2 0.511 43.1 103.7-116.0 -8.8 -5.8 32.3 45.0 494 565 A D > - 0 0 39 -8,-2.5 4,-2.5 -4,-0.3 3,-0.3 -0.646 56.9-163.2 -75.6 101.4 -7.2 35.5 43.7 495 566 A N H > S+ 0 0 92 -2,-1.3 4,-2.7 1,-0.2 5,-0.3 0.834 82.1 54.7 -57.2 -37.4 -7.3 34.4 40.0 496 567 A D H >>S+ 0 0 73 2,-0.2 5,-2.1 1,-0.2 4,-1.7 0.906 111.7 43.9 -66.0 -40.5 -7.7 37.9 38.6 497 568 A I H 4>S+ 0 0 14 -3,-0.3 5,-2.4 3,-0.2 6,-0.3 0.950 117.0 46.0 -68.5 -47.5 -4.6 39.1 40.4 498 569 A V H <5S+ 0 0 5 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.915 124.9 29.8 -61.1 -46.2 -2.5 36.0 39.6 499 570 A T H <5S+ 0 0 46 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.576 138.3 11.2 -94.9 -10.6 -3.5 35.9 35.9 500 571 A N T X5S+ 0 0 83 -4,-1.7 4,-2.1 -5,-0.3 -3,-0.2 0.647 120.1 49.6-131.8 -50.1 -4.1 39.5 35.0 501 572 A K H >X S+ 0 0 39 -4,-2.1 3,-1.3 1,-0.2 4,-0.9 0.895 107.0 54.1 -55.7 -43.0 -0.3 44.6 34.4 505 576 A T H 3< S+ 0 0 17 -4,-2.6 -1,-0.2 1,-0.3 3,-0.2 0.888 111.8 45.5 -59.3 -40.0 2.0 45.6 37.2 506 577 A Y T 3< S+ 0 0 9 -4,-1.8 10,-1.9 -3,-0.3 -1,-0.3 0.144 110.2 49.4 -95.5 20.2 5.0 44.4 35.2 507 578 A I T X4 S+ 0 0 51 -3,-1.3 3,-0.9 8,-0.2 2,-0.3 0.373 86.2 110.4-125.4 -9.7 4.2 45.9 31.8 508 579 A E T 3< S- 0 0 88 -4,-0.9 -3,-0.0 -3,-0.2 -4,-0.0 -0.505 91.2 -5.5 -73.0 126.9 3.5 49.4 33.3 509 580 A G T 3 S+ 0 0 30 -2,-0.3 -75,-0.7 1,-0.2 -1,-0.2 0.477 112.0 101.3 70.8 3.8 6.0 52.1 32.5 510 581 A V S < S- 0 0 21 -3,-0.9 -1,-0.2 -77,-0.1 5,-0.1 -0.827 78.8 -88.7-120.3 159.4 8.4 49.7 30.7 511 582 A P > - 0 0 62 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.237 28.0-126.3 -62.3 149.4 9.3 49.0 27.0 512 583 A T T 3 S+ 0 0 126 1,-0.3 3,-0.3 2,-0.1 6,-0.0 0.585 111.9 61.4 -72.5 -7.9 7.3 46.3 25.2 513 584 A T T 3 S+ 0 0 111 1,-0.2 -1,-0.3 4,-0.0 2,-0.0 0.415 113.8 31.0 -96.6 -0.9 10.7 44.8 24.4 514 585 A E S < S+ 0 0 38 -3,-1.5 -1,-0.2 -7,-0.1 2,-0.2 -0.442 95.9 94.0-156.8 72.7 11.6 44.3 28.1 515 586 A N S > S- 0 0 8 -3,-0.3 4,-2.3 -5,-0.1 3,-0.4 -0.734 89.5 -57.7-144.3-165.8 8.6 43.5 30.3 516 587 A W H > S+ 0 0 4 -10,-1.9 4,-2.3 -13,-0.3 5,-0.2 0.874 132.7 48.1 -49.7 -44.3 6.5 40.8 31.8 517 588 A D H > S+ 0 0 51 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.858 107.7 54.7 -68.4 -35.2 5.8 39.3 28.4 518 589 A T H > S+ 0 0 38 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.906 109.9 49.0 -62.2 -41.8 9.4 39.5 27.3 519 590 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.942 109.4 49.4 -63.9 -50.0 10.2 37.4 30.4 520 591 A R H X S+ 0 0 57 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.910 110.6 52.1 -56.9 -42.5 7.6 34.8 29.8 521 592 A A H X S+ 0 0 60 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.904 110.7 47.4 -61.0 -42.0 8.8 34.4 26.2 522 593 A R H X S+ 0 0 66 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.923 111.5 50.3 -65.7 -45.2 12.4 33.9 27.5 523 594 A Y H X S+ 0 0 2 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.899 112.9 46.8 -60.0 -41.9 11.3 31.4 30.1 524 595 A N H < S+ 0 0 47 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.817 109.5 52.8 -72.0 -31.1 9.3 29.4 27.5 525 596 A Q H < S+ 0 0 82 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.923 113.7 44.1 -68.1 -42.8 12.1 29.5 24.9 526 597 A I H < S+ 0 0 1 -4,-2.2 -348,-2.1 1,-0.3 -2,-0.2 0.799 132.8 20.6 -70.2 -31.9 14.5 28.0 27.5 527 598 A D >< + 0 0 0 -4,-1.7 3,-1.7 -5,-0.2 -1,-0.3 -0.551 66.7 161.8-140.4 71.4 12.0 25.5 28.8 528 599 A P T 3 S+ 0 0 59 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.696 79.7 56.1 -64.9 -18.9 9.3 24.9 26.1 529 600 A H T 3 S- 0 0 63 -3,-0.1 -5,-0.1 -5,-0.0 -2,-0.0 0.416 105.7-129.4 -94.4 2.6 8.3 21.6 27.7 530 601 A R < + 0 0 44 -3,-1.7 3,-0.4 -6,-0.2 -6,-0.1 0.859 54.2 151.0 51.6 44.4 7.7 23.4 31.0 531 602 A V + 0 0 2 1,-0.3 -473,-2.6 -474,-0.1 2,-1.1 0.867 67.0 58.5 -69.4 -35.1 9.8 21.0 33.0 532 603 A F S S+ 0 0 1 -328,-0.2 2,-0.3 -475,-0.2 -1,-0.3 -0.470 96.5 80.2 -95.8 63.0 10.6 23.7 35.5 533 604 A T - 0 0 1 -2,-1.1 2,-0.3 -3,-0.4 -475,-0.1 -0.916 51.1-160.9-152.5 174.9 7.0 24.5 36.6 534 605 A N > - 0 0 20 -2,-0.3 4,-1.7 -477,-0.1 -462,-0.1 -0.872 50.6 -77.9-149.7 177.5 4.0 23.5 38.8 535 606 A G H > S+ 0 0 35 -2,-0.3 4,-0.8 1,-0.2 -465,-0.1 0.855 128.3 46.2 -51.9 -43.6 0.3 24.3 38.7 536 607 A F H >> S+ 0 0 5 -467,-0.3 4,-2.2 1,-0.2 3,-0.8 0.907 109.7 54.3 -67.6 -42.5 0.6 27.8 40.2 537 608 A M H 3> S+ 0 0 0 1,-0.3 4,-3.1 -468,-0.2 -1,-0.2 0.824 103.0 58.2 -61.3 -31.1 3.5 28.7 37.9 538 609 A D H 3< S+ 0 0 64 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.787 109.0 44.6 -70.3 -26.9 1.4 27.8 34.9 539 610 A K H << S+ 0 0 120 -3,-0.8 -2,-0.2 -4,-0.8 -1,-0.2 0.853 121.4 37.8 -82.8 -37.7 -1.2 30.3 36.0 540 611 A L H < S+ 0 0 4 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.907 130.2 25.9 -79.3 -45.6 1.3 33.1 36.8 541 612 A L < 0 0 1 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.1 -0.501 360.0 360.0-121.6 63.4 3.8 32.5 34.0 542 613 A P 0 0 68 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.844 360.0 360.0 -65.9 360.0 2.0 30.8 31.0 543 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 544 57 B V 0 0 135 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 134.5 52.5 8.9 50.8 545 58 B A - 0 0 78 1,-0.1 2,-0.2 30,-0.0 0, 0.0 -0.328 360.0-106.3 -64.1 141.4 53.3 5.2 50.5 546 59 B P - 0 0 113 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.459 31.6-120.2 -72.2 139.0 50.5 2.8 51.2 547 60 B L - 0 0 24 -2,-0.2 29,-0.0 1,-0.1 14,-0.0 -0.421 42.4 -84.0 -74.5 152.5 50.6 0.8 54.5 548 61 B P - 0 0 62 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.284 51.7-105.8 -56.8 140.1 50.6 -3.0 54.4 549 62 B T - 0 0 122 1,-0.1 3,-0.1 -3,-0.1 73,-0.0 -0.530 36.8-112.9 -70.8 128.3 47.1 -4.4 54.1 550 63 B P > - 0 0 7 0, 0.0 3,-0.9 0, 0.0 2,-0.3 -0.382 38.2-102.5 -62.4 136.8 45.9 -5.9 57.4 551 64 B P T 3 S- 0 0 51 0, 0.0 46,-0.0 0, 0.0 0, 0.0 -0.439 88.2 -22.7 -66.9 123.8 45.5 -9.7 57.1 552 65 B N T 3 S- 0 0 146 -2,-0.3 3,-0.1 1,-0.1 -3,-0.0 0.857 84.7-172.2 42.2 51.7 41.9 -10.9 56.8 553 66 B F < - 0 0 19 -3,-0.9 2,-0.2 1,-0.2 -1,-0.1 -0.364 42.3 -78.1 -69.7 149.5 40.4 -7.8 58.3 554 67 B P > - 0 0 21 0, 0.0 3,-2.1 0, 0.0 -1,-0.2 -0.316 41.9-145.1 -53.1 113.9 36.7 -7.8 59.0 555 68 B N T 3 S+ 0 0 174 1,-0.3 -2,-0.1 -2,-0.2 -3,-0.0 0.635 95.7 53.7 -57.4 -18.6 35.2 -7.2 55.6 556 69 B D T 3 S+ 0 0 93 1,-0.1 2,-0.8 2,-0.1 -1,-0.3 0.466 92.7 79.8 -97.0 -3.2 32.3 -5.1 57.0 557 70 B I S < S- 0 0 14 -3,-2.1 -1,-0.1 24,-0.1 2,-0.0 -0.882 81.2-139.3-107.2 101.9 34.6 -2.7 58.9 558 71 B A - 0 0 53 -2,-0.8 22,-0.5 22,-0.2 2,-0.4 -0.317 13.6-152.4 -63.0 137.7 35.9 -0.2 56.4 559 72 B L - 0 0 44 20,-0.1 2,-0.4 -6,-0.0 20,-0.2 -0.893 11.7-174.6-113.1 142.6 39.5 0.8 56.7 560 73 B F E -S 578 0F 110 18,-2.5 18,-2.5 -2,-0.4 2,-0.7 -1.000 22.4-134.7-137.6 137.6 41.0 4.2 55.6 561 74 B Q E +S 577 0F 66 -2,-0.4 2,-0.3 16,-0.2 16,-0.2 -0.836 39.8 160.4 -93.2 117.6 44.6 5.3 55.6 562 75 B Q E -S 576 0F 79 14,-2.2 14,-1.5 -2,-0.7 2,-0.1 -0.941 40.4-109.2-134.0 156.9 44.8 8.8 57.1 563 76 B A E - 0 0 63 -2,-0.3 2,-0.4 12,-0.2 11,-0.2 -0.389 31.2-134.3 -78.2 163.8 47.6 10.9 58.5 564 77 B Y E +S 573 0F 7 9,-3.1 9,-2.8 -2,-0.1 2,-0.3 -0.990 29.8 163.8-124.3 131.6 47.6 11.5 62.3 565 78 B Q E -S 572 0F 83 -2,-0.4 7,-0.2 7,-0.2 2,-0.1 -0.971 24.4-143.8-145.6 126.4 48.2 14.9 63.8 566 79 B N > - 0 0 1 5,-1.7 3,-1.5 -2,-0.3 42,-0.2 -0.405 38.3 -93.8 -85.1 169.0 47.4 15.9 67.4 567 80 B W T 3 S+ 0 0 26 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-111,-0.2 -2,-0.3 -2,-0.0 -0.809 24.8 174.7-104.6 137.6 53.4 17.1 93.4 1018 549 B R E -H 905 0J 5 -113,-2.8 -113,-3.1 -2,-0.4 24,-0.0 -0.986 32.3-120.6-138.7 125.8 51.7 15.0 90.7 1019 550 B P - 0 0 0 0, 0.0 2,-0.8 0, 0.0 -115,-0.2 -0.277 31.4-113.0 -60.6 152.6 52.2 15.5 86.9 1020 551 B E > - 0 0 8 -117,-0.4 3,-1.9 4,-0.3 -333,-0.1 -0.834 25.3-141.7 -87.8 114.8 49.1 16.4 85.0 1021 552 B W T 3 S+ 0 0 1 -2,-0.8 -1,-0.2 1,-0.3 -410,-0.1 0.834 96.4 52.4 -43.7 -45.7 48.6 13.3 82.9 1022 553 B S T 3 S+ 0 0 24 -336,-0.4 -412,-0.7 -412,-0.1 -411,-0.5 0.636 107.9 57.7 -70.0 -17.9 47.4 15.3 79.8 1023 554 B K S < S- 0 0 17 -3,-1.9 2,-0.2 1,-0.2 -121,-0.1 -0.211 100.9 -63.0-101.5-167.2 50.4 17.6 79.8 1024 555 B G + 0 0 2 -123,-1.4 -4,-0.3 -2,-0.1 2,-0.3 -0.534 59.4 145.4 -82.3 147.5 54.1 17.2 79.6 1025 556 B W + 0 0 2 -2,-0.2 7,-3.1 -6,-0.1 8,-0.2 -0.944 47.7 54.0-165.4 171.9 56.1 15.3 82.2 1026 557 B A S S- 0 0 0 -2,-0.3 8,-2.8 5,-0.2 7,-1.5 0.912 71.7-171.6 56.5 41.7 59.2 13.0 82.4 1027 558 B F + 0 0 2 4,-0.2 3,-0.3 5,-0.2 -1,-0.2 -0.536 18.2 176.8 -67.7 119.0 61.1 15.7 80.5 1028 559 B G S S- 0 0 27 2,-2.5 7,-0.1 -2,-0.4 -1,-0.1 0.076 90.5 -69.1-130.1 35.4 64.5 14.2 79.7 1029 560 B P S S+ 0 0 34 0, 0.0 3,-0.1 0, 0.0 5,-0.1 -0.980 140.5 61.5 -81.5 -22.9 64.6 17.0 78.4 1030 561 B D S > S- 0 0 84 -3,-0.3 -2,-2.5 1,-0.1 3,-1.4 -0.361 103.8 -93.8 -62.4 143.1 61.9 16.1 75.8 1031 562 B P T 3 S+ 0 0 19 0, 0.0 -5,-0.2 0, 0.0 -4,-0.2 -0.265 106.9 15.4 -60.5 147.1 58.6 15.2 77.4 1032 563 B Y T 3 S+ 0 0 32 -7,-3.1 -5,-0.2 -3,-0.1 -6,-0.2 0.622 103.8 95.0 66.6 18.2 58.0 11.5 78.1 1033 564 B T < + 0 0 74 -7,-1.5 2,-1.1 -3,-1.4 -6,-0.2 0.533 43.1 102.5-115.6 -10.3 61.7 10.6 77.6 1034 565 B D > - 0 0 39 -8,-2.8 4,-2.5 -4,-0.3 3,-0.2 -0.667 57.6-161.9 -75.7 106.1 63.2 10.6 81.1 1035 566 B N H > S+ 0 0 91 -2,-1.1 4,-2.9 1,-0.2 5,-0.3 0.860 83.3 55.0 -59.6 -40.2 63.3 6.8 81.6 1036 567 B D H >>S+ 0 0 69 2,-0.2 5,-2.1 1,-0.2 4,-1.9 0.900 112.0 44.2 -62.1 -40.4 63.6 6.9 85.4 1037 568 B I H 4>S+ 0 0 12 3,-0.2 5,-2.2 -3,-0.2 6,-0.3 0.946 116.4 45.8 -69.9 -46.6 60.5 9.1 85.7 1038 569 B V H <5S+ 0 0 6 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.926 126.0 28.9 -61.5 -46.0 58.5 7.1 83.3 1039 570 B T H <5S+ 0 0 47 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.621 138.1 12.9 -94.0 -14.8 59.4 3.7 84.7 1040 571 B N T X5S+ 0 0 86 -4,-1.9 4,-2.0 -5,-0.3 -3,-0.2 0.690 120.4 48.1-126.3 -51.5 60.1 4.4 88.3 1041 572 B K H >X S+ 0 0 42 -4,-2.0 3,-1.5 1,-0.2 4,-1.0 0.929 107.0 53.0 -54.4 -46.4 56.4 6.0 93.2 1045 576 B T H 3< S+ 0 0 19 -4,-2.6 3,-0.4 1,-0.3 -1,-0.2 0.898 111.9 45.6 -56.8 -42.0 54.0 8.9 92.9 1046 577 B Y T 3< S+ 0 0 9 -4,-1.9 10,-1.8 1,-0.2 -1,-0.3 0.199 111.7 48.0 -93.9 18.8 51.0 6.6 92.7 1047 578 B I T X4 S+ 0 0 51 -3,-1.5 3,-0.8 -4,-0.2 2,-0.3 0.336 86.2 112.3-125.5 -5.8 51.9 4.2 95.5 1048 579 B E T 3< S- 0 0 77 -4,-1.0 -3,-0.0 -3,-0.4 -4,-0.0 -0.533 91.2 -8.0 -75.7 127.2 52.7 7.0 98.0 1049 580 B G T 3 S+ 0 0 29 -2,-0.3 -75,-0.8 1,-0.2 -1,-0.2 0.524 111.4 104.0 68.9 6.7 50.3 7.4 100.9 1050 581 B V S < S- 0 0 20 -3,-0.8 -1,-0.2 -77,-0.1 5,-0.1 -0.835 77.4 -93.6-119.3 157.2 47.8 4.8 99.6 1051 582 B P > - 0 0 58 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.313 28.1-122.7 -67.5 150.4 47.1 1.1 100.5 1052 583 B T T 3 S+ 0 0 120 1,-0.3 3,-0.3 2,-0.1 6,-0.0 0.551 111.7 63.7 -69.0 -4.5 48.8 -1.7 98.7 1053 584 B T T 3 S+ 0 0 110 1,-0.2 -1,-0.3 4,-0.0 2,-0.0 0.463 113.0 29.1 -96.9 -3.5 45.4 -3.0 97.9 1054 585 B E S < S+ 0 0 47 -3,-1.9 -1,-0.2 -7,-0.1 2,-0.2 -0.481 97.1 93.9-156.4 75.0 44.4 0.1 95.8 1055 586 B N S > S- 0 0 9 -3,-0.3 4,-2.1 -5,-0.1 -8,-0.2 -0.699 88.3 -58.4-145.1-163.1 47.4 1.7 94.1 1056 587 B W H > S+ 0 0 5 -10,-1.8 4,-2.2 -13,-0.3 5,-0.2 0.896 129.7 48.3 -54.6 -45.5 49.5 1.9 91.0 1057 588 B D H > S+ 0 0 44 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.891 111.3 47.9 -66.9 -40.6 50.4 -1.8 91.1 1058 589 B T H > S+ 0 0 39 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.837 110.7 54.1 -70.1 -28.8 46.8 -2.9 91.6 1059 590 B A H X S+ 0 0 1 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.939 109.9 45.4 -68.4 -46.0 45.8 -0.7 88.8 1060 591 B R H X S+ 0 0 50 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.884 109.9 55.9 -63.9 -37.0 48.3 -2.2 86.4 1061 592 B A H X S+ 0 0 59 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.888 109.4 46.9 -61.6 -38.2 47.2 -5.7 87.6 1062 593 B R H X S+ 0 0 69 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.910 110.3 51.8 -69.5 -43.5 43.6 -4.8 86.7 1063 594 B Y H X S+ 0 0 3 -4,-2.4 4,-1.3 1,-0.2 -2,-0.2 0.901 111.4 47.5 -59.8 -42.4 44.7 -3.5 83.3 1064 595 B N H < S+ 0 0 43 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.792 109.3 53.7 -71.7 -26.5 46.6 -6.7 82.5 1065 596 B Q H < S+ 0 0 70 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.901 112.5 44.1 -71.4 -40.7 43.6 -8.8 83.7 1066 597 B I H < S+ 0 0 1 -4,-2.3 -345,-2.5 1,-0.3 -2,-0.2 0.716 135.1 15.9 -75.4 -22.5 41.3 -7.0 81.3 1067 598 B D >< + 0 0 0 -4,-1.3 3,-1.5 -5,-0.2 -1,-0.3 -0.473 65.6 162.5-153.2 71.5 43.8 -7.1 78.4 1068 599 B P T 3 S+ 0 0 59 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 0.754 80.0 57.5 -65.4 -24.2 46.6 -9.6 79.1 1069 600 B H T 3 S- 0 0 76 -5,-0.0 -5,-0.1 1,-0.0 -2,-0.0 0.433 106.3-129.5 -86.7 1.3 47.6 -9.7 75.4 1070 601 B R < + 0 0 41 -3,-1.5 3,-0.5 -6,-0.2 -6,-0.1 0.869 53.8 152.0 51.8 45.2 48.1 -5.9 75.5 1071 602 B V + 0 0 2 1,-0.3 -470,-2.7 -471,-0.1 2,-1.1 0.874 68.0 56.9 -68.5 -37.4 46.0 -5.2 72.5 1072 603 B F S S+ 0 0 0 -325,-0.2 2,-0.3 -472,-0.2 -1,-0.3 -0.458 96.1 84.2 -95.3 62.3 45.2 -1.7 73.9 1073 604 B T - 0 0 1 -2,-1.1 2,-0.3 -3,-0.5 -472,-0.1 -0.905 51.6-159.3-149.3 173.2 48.8 -0.4 74.2 1074 605 B N > - 0 0 19 -2,-0.3 4,-1.7 -474,-0.1 3,-0.1 -0.882 48.7 -81.7-146.7 175.7 51.7 1.2 72.4 1075 606 B G H > S+ 0 0 31 -2,-0.3 4,-0.8 1,-0.2 -462,-0.1 0.835 127.6 48.1 -52.9 -39.3 55.4 1.4 73.0 1076 607 B F H >> S+ 0 0 6 -464,-0.3 4,-2.3 1,-0.2 3,-0.9 0.910 109.8 51.9 -69.0 -42.8 55.2 4.2 75.5 1077 608 B M H 3> S+ 0 0 0 1,-0.3 4,-2.8 -465,-0.2 -1,-0.2 0.785 102.3 61.4 -64.7 -26.3 52.4 2.5 77.5 1078 609 B D H 3< S+ 0 0 66 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.801 109.5 41.4 -70.9 -26.7 54.6 -0.6 77.7 1079 610 B K H << S+ 0 0 121 -3,-0.9 -2,-0.2 -4,-0.8 -1,-0.2 0.863 123.0 37.9 -85.3 -40.0 57.1 1.4 79.6 1080 611 B L H < S+ 0 0 3 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.908 129.5 27.0 -77.3 -45.1 54.7 3.3 81.8 1081 612 B L < 0 0 1 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.1 -0.556 360.0 360.0-121.3 66.2 52.1 0.6 82.4 1082 613 B P 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.768 360.0 360.0 -66.7 360.0 53.9 -2.8 82.2