==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 08-JUL-10 3NVD . COMPND 2 MOLECULE: UNCHARACTERIZED LIPOPROTEIN YBBD; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR K.DIEDERICHS . 1234 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 47810.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 855 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 104 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.5 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 . 2 0.2 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 . 80 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 119 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 381 30.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 35 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 4 0 2 4 2 4 2 4 0 1 5 2 5 3 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 5 8 2 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 0 PARALLEL BRIDGES PER LADDER . 5 8 2 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 0 ANTIPARALLEL BRIDGES PER LADDER . 13 2 2 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 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 26 A A > 0 0 94 0, 0.0 4,-1.4 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -62.6 63.4 24.8 71.3 2 27 A S H > + 0 0 89 2,-0.2 4,-1.1 3,-0.1 5,-0.1 0.764 360.0 49.8 -73.0 -31.5 65.4 26.3 74.2 3 28 A A H > S+ 0 0 43 2,-0.2 4,-1.5 1,-0.2 -1,-0.1 0.826 109.7 50.0 -71.5 -32.3 62.4 28.6 74.4 4 29 A S H > S+ 0 0 36 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.902 113.1 45.6 -74.4 -38.2 60.0 25.7 74.3 5 30 A K H X S+ 0 0 127 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.706 109.1 56.1 -76.4 -23.3 61.9 23.9 77.1 6 31 A R H X S+ 0 0 57 -4,-1.1 4,-2.0 2,-0.2 -1,-0.2 0.874 105.3 50.6 -80.2 -37.1 62.1 27.0 79.2 7 32 A A H X S+ 0 0 55 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.891 111.4 48.2 -66.5 -37.6 58.4 27.5 79.2 8 33 A I H X S+ 0 0 95 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.907 110.1 52.7 -70.2 -36.9 57.8 23.9 80.2 9 34 A D H X S+ 0 0 50 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.905 108.7 48.9 -63.4 -43.2 60.3 24.2 83.0 10 35 A A H X S+ 0 0 1 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.890 110.0 53.1 -63.6 -42.4 58.7 27.4 84.5 11 36 A N H X S+ 0 0 31 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.898 110.6 46.3 -57.5 -42.1 55.3 25.7 84.4 12 37 A Q H X S+ 0 0 83 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.913 113.4 48.7 -71.8 -40.5 56.6 22.7 86.4 13 38 A I H >< S+ 0 0 30 -4,-2.1 3,-0.5 2,-0.2 -2,-0.2 0.932 115.0 44.4 -67.2 -45.9 58.4 24.8 88.9 14 39 A V H >< S+ 0 0 0 -4,-2.5 3,-2.1 1,-0.2 -2,-0.2 0.915 106.3 58.8 -67.2 -46.3 55.3 27.0 89.5 15 40 A N H 3< S+ 0 0 102 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.727 105.3 53.7 -47.3 -28.3 52.8 24.0 89.6 16 41 A R T << S+ 0 0 180 -4,-0.9 2,-0.3 -3,-0.5 -1,-0.3 0.449 94.0 97.2 -89.4 -1.7 55.0 22.8 92.6 17 42 A M S < S- 0 0 25 -3,-2.1 2,-0.1 -4,-0.2 -3,-0.0 -0.662 71.2-125.6 -90.8 143.3 54.6 26.1 94.5 18 43 A S > - 0 0 55 -2,-0.3 4,-2.2 1,-0.1 3,-0.3 -0.405 32.8-106.9 -68.1 159.7 52.2 27.1 97.3 19 44 A L H > S+ 0 0 38 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.863 122.0 53.9 -61.7 -33.5 50.0 30.2 96.9 20 45 A D H > S+ 0 0 80 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.896 109.1 46.6 -62.4 -44.4 52.2 32.0 99.4 21 46 A E H > S+ 0 0 21 -3,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.851 112.4 50.7 -71.7 -30.1 55.3 31.3 97.5 22 47 A K H X S+ 0 0 13 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.970 111.1 46.3 -74.3 -47.6 53.8 32.4 94.3 23 48 A L H < S+ 0 0 0 -4,-2.6 4,-0.2 1,-0.2 -2,-0.2 0.879 109.7 58.0 -58.6 -40.5 52.5 35.7 95.7 24 49 A G H >< S+ 0 0 0 -4,-2.3 3,-2.4 1,-0.2 38,-2.0 0.939 100.4 54.4 -53.9 -50.1 56.0 36.2 97.3 25 50 A Q H 3< S+ 0 0 5 -4,-1.9 -1,-0.2 36,-0.3 -2,-0.2 0.876 102.2 61.2 -50.3 -39.5 57.7 35.9 93.8 26 51 A M T 3< S+ 0 0 4 -4,-1.3 295,-2.7 -3,-0.2 2,-0.4 0.487 92.9 81.7 -72.3 1.1 55.4 38.8 92.8 27 52 A L E < -a 321 0A 1 -3,-2.4 35,-1.0 -4,-0.2 36,-1.0 -0.886 50.1-179.6-113.2 131.9 56.8 41.2 95.4 28 53 A M E +a 322 0A 1 293,-2.4 295,-3.8 -2,-0.4 36,-0.2 -0.846 16.8 177.6-126.0 92.5 60.0 43.1 95.0 29 54 A P - 0 0 0 0, 0.0 36,-1.8 0, 0.0 2,-0.4 -0.463 22.5-130.4 -85.8 168.5 60.7 45.2 98.1 30 55 A D B -b 65 0B 13 295,-0.3 297,-0.4 34,-0.2 36,-0.1 -0.875 11.6-168.7-107.2 151.2 63.6 47.5 98.9 31 56 A F + 0 0 2 34,-0.6 14,-0.3 -2,-0.4 36,-0.1 -0.442 30.4 150.6-124.3 57.8 65.6 47.4 102.1 32 57 A R S S+ 0 0 73 12,-0.1 13,-2.8 33,-0.1 2,-0.3 0.939 71.3 12.6 -51.3 -55.1 67.4 50.6 101.5 33 58 A N E S-D 44 0C 50 11,-0.3 2,-0.3 -3,-0.1 11,-0.3 -0.845 71.1-167.4-123.0 156.0 67.7 51.4 105.3 34 59 A W E -D 43 0C 4 9,-3.1 9,-2.2 -2,-0.3 2,-0.7 -0.996 19.1-148.5-150.9 142.5 67.1 49.2 108.4 35 60 A Q - 0 0 41 293,-3.4 295,-0.4 -2,-0.3 3,-0.1 -0.870 27.1-157.1-113.5 92.2 66.8 49.7 112.1 36 61 A K > - 0 0 86 -2,-0.7 3,-2.6 1,-0.2 5,-0.1 -0.279 41.8 -69.3 -67.7 152.7 68.2 46.5 113.7 37 62 A E T 3 S+ 0 0 146 1,-0.3 -1,-0.2 3,-0.0 3,-0.1 -0.135 126.2 18.5 -37.5 127.6 67.1 45.5 117.2 38 63 A G T 3 S+ 0 0 76 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.057 97.3 114.2 93.6 -25.5 68.6 48.1 119.6 39 64 A E < - 0 0 68 -3,-2.6 -1,-0.3 1,-0.1 -4,-0.1 -0.366 65.3-134.4 -77.2 160.5 69.4 50.8 117.0 40 65 A S S S- 0 0 109 1,-0.2 -1,-0.1 -3,-0.1 -5,-0.1 0.712 74.4 -4.8 -96.6 -19.6 67.5 54.1 117.3 41 66 A S S S- 0 0 51 -7,-0.1 -1,-0.2 -5,-0.1 -5,-0.2 -0.978 92.2 -62.6-165.8 164.0 66.4 54.7 113.6 42 67 A P - 0 0 48 0, 0.0 -7,-0.3 0, 0.0 2,-0.2 -0.256 51.4-172.4 -62.1 120.1 66.8 53.2 110.1 43 68 A Q E -D 34 0C 100 -9,-2.2 -9,-3.1 285,-0.2 -4,-0.0 -0.708 39.0 -76.7 -96.3 155.2 70.4 53.3 108.8 44 69 A A E -D 33 0C 39 -11,-0.3 2,-0.9 -2,-0.2 -11,-0.3 -0.286 45.2-131.2 -41.6 126.8 71.8 52.4 105.3 45 70 A L + 0 0 9 -13,-2.8 -1,-0.1 -14,-0.3 -14,-0.1 -0.792 48.5 146.7 -90.6 100.8 71.8 48.6 104.8 46 71 A T + 0 0 32 -2,-0.9 2,-0.3 1,-0.1 34,-0.2 0.521 65.8 41.9-108.6 -10.3 75.3 47.7 103.5 47 72 A K S S- 0 0 154 -3,-0.2 2,-0.2 32,-0.1 -1,-0.1 -0.967 89.6-108.5-134.3 148.2 75.7 44.3 105.2 48 73 A M - 0 0 27 -2,-0.3 2,-0.3 -3,-0.1 -2,-0.0 -0.518 33.4-166.2 -74.2 142.6 73.1 41.5 105.6 49 74 A N > - 0 0 20 -2,-0.2 4,-2.3 1,-0.0 5,-0.2 -0.880 34.2-110.7-122.4 164.8 71.7 40.9 109.1 50 75 A D H > S+ 0 0 145 -2,-0.3 4,-1.1 1,-0.2 -2,-0.0 0.688 113.9 61.7 -69.6 -14.2 69.6 38.0 110.4 51 76 A E H > S+ 0 0 35 2,-0.2 4,-1.2 3,-0.1 3,-0.2 0.973 109.3 37.1 -71.2 -58.0 66.6 40.2 110.7 52 77 A V H >> S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 3,-0.6 0.932 114.3 57.2 -60.3 -42.9 66.3 41.1 107.0 53 78 A A H 3X S+ 0 0 11 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.894 102.7 57.1 -52.6 -36.7 67.4 37.6 106.1 54 79 A S H 3X S+ 0 0 52 -4,-1.1 4,-1.9 1,-0.2 -1,-0.2 0.812 104.7 48.6 -71.0 -33.2 64.4 36.3 108.1 55 80 A L H > - 0 0 8 -2,-0.3 3,-2.6 30,-0.1 4,-0.7 -0.783 43.6 -89.1-120.6 171.8 69.8 51.7 96.1 68 93 A A G >4 S+ 0 0 39 1,-0.3 3,-1.2 -2,-0.3 40,-0.1 0.820 124.8 64.0 -44.5 -40.3 73.0 53.7 96.4 69 94 A E G 34 S+ 0 0 57 1,-0.3 3,-0.3 2,-0.2 -1,-0.3 0.714 106.4 43.8 -54.2 -30.1 72.8 53.1 100.2 70 95 A N G <4 S+ 0 0 1 -3,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.547 117.1 42.7 -96.6 -11.4 73.2 49.4 99.6 71 96 A V << + 0 0 1 -3,-1.2 37,-2.5 -4,-0.7 38,-0.3 -0.209 63.3 133.5-136.1 40.7 76.0 49.5 97.1 72 97 A K S S+ 0 0 92 -3,-0.3 2,-0.3 35,-0.2 -1,-0.1 0.808 74.7 27.2 -68.4 -33.7 78.5 52.0 98.2 73 98 A T S > S- 0 0 39 35,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.967 71.6-128.5-131.5 155.3 81.6 49.8 97.6 74 99 A T H > S+ 0 0 4 -2,-0.3 4,-2.3 2,-0.2 5,-0.2 0.942 110.6 50.8 -63.7 -48.3 82.3 47.0 95.3 75 100 A K H > S+ 0 0 122 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.950 114.0 43.6 -53.1 -54.7 83.6 44.8 98.1 76 101 A Q H > S+ 0 0 75 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.822 112.1 54.3 -61.7 -35.1 80.5 45.4 100.2 77 102 A T H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.914 105.5 50.6 -69.3 -41.5 78.1 44.9 97.2 78 103 A V H X S+ 0 0 2 -4,-2.3 4,-2.4 1,-0.2 5,-0.2 0.929 113.6 47.4 -63.4 -40.1 79.5 41.5 96.2 79 104 A Q H X S+ 0 0 62 -4,-1.8 4,-2.7 -5,-0.2 -1,-0.2 0.901 110.4 50.9 -66.9 -42.5 79.0 40.4 99.9 80 105 A L H X S+ 0 0 1 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.906 113.1 45.7 -61.7 -42.7 75.5 41.8 100.1 81 106 A T H X S+ 0 0 3 -4,-2.2 4,-2.5 61,-0.3 5,-0.3 0.936 113.3 48.0 -73.2 -42.6 74.4 40.0 96.9 82 107 A D H X S+ 0 0 28 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.970 115.4 47.9 -53.1 -53.8 76.0 36.7 97.8 83 108 A D H X S+ 0 0 31 -4,-2.7 4,-1.4 1,-0.2 -2,-0.2 0.846 109.6 50.8 -58.2 -45.4 74.3 37.0 101.2 84 109 A Y H X S+ 0 0 0 -4,-2.7 4,-1.6 2,-0.2 3,-0.3 0.901 110.6 48.7 -54.0 -47.1 70.9 37.9 99.8 85 110 A Q H < S+ 0 0 58 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.864 108.2 57.5 -67.6 -31.5 71.0 34.8 97.5 86 111 A K H < S+ 0 0 168 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.863 106.9 46.9 -62.1 -37.6 71.9 32.9 100.6 87 112 A A H < S+ 0 0 2 -4,-1.4 -2,-0.2 -3,-0.3 -1,-0.2 0.787 86.4 97.1 -75.5 -32.4 68.7 34.0 102.4 88 113 A S < - 0 0 15 -4,-1.6 -31,-0.1 1,-0.1 -32,-0.0 -0.465 67.1-152.9 -65.0 123.8 66.3 33.3 99.6 89 114 A P S S- 0 0 62 0, 0.0 -1,-0.1 0, 0.0 -32,-0.1 0.843 71.2 -4.9 -75.3 -36.4 65.0 29.8 100.4 90 115 A K S S+ 0 0 134 1,-0.3 -2,-0.1 -33,-0.0 -33,-0.0 0.678 122.8 41.6-127.6 -39.8 64.0 28.1 97.2 91 116 A I S S- 0 0 11 284,-0.0 -1,-0.3 283,-0.0 283,-0.1 -0.966 82.8-108.7-126.9 127.1 64.4 30.4 94.1 92 117 A P - 0 0 22 0, 0.0 2,-0.1 0, 0.0 -7,-0.1 -0.256 41.2-115.6 -54.8 133.2 67.2 32.9 93.4 93 118 A L - 0 0 0 1,-0.1 2,-0.8 -9,-0.1 -30,-0.3 -0.362 11.4-122.0 -67.4 144.1 66.3 36.5 93.7 94 119 A M E -c 63 0B 1 -32,-2.1 -30,-2.0 -2,-0.1 2,-0.7 -0.830 29.4-161.7 -75.6 114.6 66.1 39.1 91.0 95 120 A L E -c 64 0B 0 -2,-0.8 50,-2.0 -32,-0.2 51,-1.5 -0.923 19.4-178.5-100.5 110.3 68.5 41.7 92.4 96 121 A S E +c 65 0B 0 -32,-2.2 -30,-2.6 -2,-0.7 2,-0.3 -0.581 13.2 178.4-112.3 169.6 67.7 44.9 90.5 97 122 A I - 0 0 0 49,-0.4 51,-2.7 -32,-0.2 2,-0.9 -0.986 38.8-113.1-161.3 155.7 69.0 48.5 90.4 98 123 A D + 0 0 16 -32,-0.5 2,-1.2 -2,-0.3 3,-0.3 -0.635 49.0 154.9 -95.1 72.3 68.5 51.9 88.6 99 124 A Q + 0 0 0 -2,-0.9 6,-0.2 1,-0.2 40,-0.1 -0.722 11.5 145.8 -92.0 77.4 72.0 51.9 86.8 100 125 A E - 0 0 6 4,-1.5 5,-0.2 -2,-1.2 -1,-0.2 0.815 53.1-129.2 -82.1 -33.7 70.7 54.2 84.1 101 126 A G B > S+E 104 0D 5 3,-1.8 3,-1.2 -3,-0.3 15,-0.4 -0.127 73.4 43.2 95.2 165.1 74.1 56.0 83.7 102 127 A G T 3 S- 0 0 0 10,-2.5 13,-0.2 11,-0.9 -1,-0.2 -0.538 127.4 -1.0 71.4-128.6 74.4 59.7 83.8 103 128 A I T 3 S+ 0 0 19 -2,-0.3 2,-0.5 453,-0.2 -1,-0.2 0.561 130.7 58.5 -78.5 -8.1 72.3 61.5 86.4 104 129 A V B < +E 101 0D 15 -3,-1.2 -3,-1.8 8,-0.1 -4,-1.5 -0.881 69.7 130.4-124.7 98.2 70.7 58.3 87.8 105 130 A T - 0 0 18 -2,-0.5 -6,-0.2 -5,-0.2 -37,-0.1 -0.945 29.2-177.0-138.3 157.9 73.4 55.9 89.0 106 131 A R + 0 0 64 -2,-0.3 -35,-0.2 -39,-0.1 2,-0.1 0.595 48.0 108.8-122.7 -32.0 73.7 53.9 92.3 107 132 A L - 0 0 6 1,-0.1 3,-0.2 4,-0.1 -35,-0.2 -0.330 56.1-150.8 -68.8 129.4 77.1 52.1 92.2 108 133 A G S S+ 0 0 22 -37,-2.5 -35,-0.2 1,-0.2 -36,-0.2 0.966 92.0 18.7 -64.9 -53.3 79.5 53.6 94.5 109 134 A E S S+ 0 0 78 -38,-0.3 -1,-0.2 2,-0.1 -2,-0.1 0.217 104.0 108.5-107.3 10.9 82.7 52.7 92.7 110 135 A G S S- 0 0 3 -3,-0.2 2,-0.5 1,-0.1 283,-0.1 -0.071 79.3 -82.1 -81.9-175.5 81.2 52.0 89.2 111 136 A T - 0 0 0 1,-0.1 -4,-0.1 23,-0.1 -1,-0.1 -0.786 36.3-167.7 -91.1 125.5 81.4 53.9 85.9 112 137 A N - 0 0 8 -2,-0.5 -10,-2.5 454,-0.2 -1,-0.1 0.873 18.0-163.1 -88.6 -39.0 78.8 56.6 85.8 113 138 A F - 0 0 0 -12,-0.2 -11,-0.9 1,-0.2 457,-0.2 0.309 37.7 -79.8 68.9 159.6 78.8 57.6 82.1 114 139 A P S S- 0 0 1 0, 0.0 4,-0.3 0, 0.0 -11,-0.2 0.693 70.9-119.7 -70.3 -22.0 77.3 60.8 80.6 115 140 A G > - 0 0 6 -13,-0.2 4,-2.1 1,-0.2 -13,-0.2 -0.217 33.6 -62.4 100.3 166.3 73.6 59.7 80.6 116 141 A N H > S+ 0 0 6 -15,-0.4 4,-2.9 1,-0.2 5,-0.2 0.901 127.5 49.2 -60.4 -43.3 71.0 59.2 78.0 117 142 A M H > S+ 0 0 0 48,-1.9 4,-2.5 1,-0.3 -1,-0.2 0.885 109.5 53.0 -72.6 -31.1 70.6 62.7 76.6 118 143 A A H > S+ 0 0 0 438,-0.3 4,-1.7 47,-0.3 -1,-0.3 0.908 109.6 51.2 -62.4 -37.8 74.4 62.9 76.2 119 144 A L H X S+ 0 0 4 -4,-2.1 4,-1.0 2,-0.2 -2,-0.2 0.931 108.2 50.4 -63.6 -45.5 74.0 59.6 74.2 120 145 A G H >< S+ 0 0 0 -4,-2.9 3,-0.8 1,-0.2 -2,-0.2 0.916 108.4 53.0 -54.3 -43.0 71.3 61.1 72.1 121 146 A A H 3< S+ 0 0 0 -4,-2.5 466,-1.6 1,-0.3 -1,-0.2 0.862 107.7 50.7 -61.2 -35.1 73.6 64.1 71.5 122 147 A A H 3< S- 0 0 10 -4,-1.7 2,-2.2 464,-0.2 -1,-0.3 0.636 93.2-161.3 -78.7 -14.6 76.3 61.6 70.3 123 148 A R << + 0 0 68 -4,-1.0 2,-0.2 -3,-0.8 -1,-0.1 -0.226 45.3 118.8 74.0 -49.3 73.7 60.0 68.0 124 149 A S >> - 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0 0 30 45,-1.2 3,-1.8 -3,-0.2 7,-0.2 -0.967 69.0-160.2-106.7 112.3 57.9 68.5 77.1 158 183 A P T 3 S+ 0 0 37 0, 0.0 336,-0.3 0, 0.0 383,-0.1 0.673 88.7 64.1 -73.1 -8.9 60.8 70.7 78.1 159 184 A D T 3 + 0 0 53 334,-0.1 334,-0.1 44,-0.1 44,-0.1 0.352 70.0 135.5 -90.5 8.8 59.2 71.3 81.5 160 185 A N < - 0 0 0 -3,-1.8 45,-0.2 42,-0.2 47,-0.1 -0.425 34.3-172.8 -60.8 115.4 59.5 67.6 82.3 161 186 A P S S+ 0 0 36 0, 0.0 -1,-0.2 0, 0.0 46,-0.1 0.673 77.4 35.5 -89.0 -18.6 60.8 67.6 85.9 162 187 A V S S+ 0 0 11 42,-0.2 45,-0.1 44,-0.2 40,-0.1 0.746 124.0 32.1-106.8 -32.1 61.4 63.9 86.4 163 188 A I S > S+ 0 0 1 38,-0.2 3,-2.0 41,-0.2 4,-0.1 0.895 75.9 119.5 -91.9 -75.6 62.7 62.6 82.9 164 189 A G G > S+ 0 0 2 1,-0.3 3,-2.2 -7,-0.2 -9,-0.1 -0.261 90.5 11.5 45.7-119.7 64.6 65.5 81.2 165 190 A V G 3 S+ 0 0 2 1,-0.3 -48,-1.9 -49,-0.1 -47,-0.3 0.533 115.5 77.4 -70.6 -1.9 68.2 64.3 80.6 166 191 A R G < S+ 0 0 28 -3,-2.0 2,-0.4 -50,-0.2 -1,-0.3 0.698 86.5 77.8 -75.9 -16.9 67.2 60.7 81.5 167 192 A S S < S- 0 0 0 -3,-2.2 -47,-0.1 1,-0.1 -13,-0.1 -0.748 76.4-142.3 -89.0 138.9 65.7 60.6 77.9 168 193 A F S S- 0 0 0 -17,-0.4 2,-0.3 -2,-0.4 -1,-0.1 0.852 74.0 -24.7 -55.4 -39.0 67.8 60.2 74.8 169 194 A S - 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0 0 3 -5,-2.1 -1,-0.3 -6,-0.1 -45,-0.2 -0.872 56.1-125.6 -98.6 125.4 71.3 41.4 82.8 192 217 A A E -f 146 0E 0 -47,-2.5 -45,-2.5 -2,-0.5 2,-0.4 -0.538 29.1-147.9 -68.8 134.5 67.5 41.5 82.5 193 218 A S E -f 147 0E 0 -2,-0.2 47,-1.4 -47,-0.2 46,-0.6 -0.913 9.2-156.9-112.1 135.0 66.6 44.8 81.1 194 219 A A E -h 240 0G 0 -47,-1.6 2,-0.3 -45,-0.6 47,-0.3 -0.941 9.6-144.7-108.1 122.0 63.4 46.9 81.9 195 220 A L E -h 241 0G 0 45,-2.6 47,-3.6 -2,-0.5 3,-0.3 -0.660 36.0-117.5 -74.7 142.4 62.0 49.5 79.5 196 221 A K E -g 151 0F 2 -46,-1.7 -44,-2.5 -2,-0.3 -43,-0.7 -0.994 61.0 -0.1-146.7 150.9 60.4 52.5 81.3 197 222 A H E > S- 0 0 5 45,-0.4 3,-2.3 -2,-0.3 4,-0.4 0.245 75.4-131.3-124.2 120.9 58.0 54.1 81.9 198 223 A F E 3 S+h 243 0G 0 44,-3.7 46,-1.8 -3,-0.3 29,-0.1 -0.484 87.1 15.0 -89.6 136.3 55.2 52.6 80.0 199 224 A P T 3 S- 0 0 0 0, 0.0 -1,-0.3 0, 0.0 31,-0.1 -0.904 127.5 -72.3 -94.7 18.1 53.1 53.9 78.2 200 225 A G < - 0 0 1 -3,-2.3 3,-0.4 27,-0.1 -2,-0.2 0.383 35.0-168.4 128.1 106.3 55.4 57.0 78.2 201 226 A H > + 0 0 2 -4,-0.4 3,-0.7 1,-0.2 -38,-0.2 0.211 64.1 101.0 -94.7 11.6 56.3 59.5 80.9 202 227 A G T 3 S+ 0 0 0 1,-0.2 -45,-1.2 -5,-0.1 -46,-0.3 0.662 76.9 52.0 -85.2 -17.4 58.1 62.0 78.6 203 228 A D T 3 S+ 0 0 28 -3,-0.4 -1,-0.2 -47,-0.2 -2,-0.1 0.543 83.3 111.0 -93.8 -3.1 55.3 64.5 78.2 204 229 A T < - 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0 0 1 1,-0.1 -4,-0.1 23,-0.1 -1,-0.1 -0.759 36.1-164.3 -83.6 126.4 51.1 46.6 49.5 730 137 B N - 0 0 7 -2,-0.5 -10,-1.6 454,-0.2 -8,-0.2 0.874 15.4-161.0 -85.7 -38.0 48.3 44.1 49.5 731 138 B F - 0 0 0 -12,-0.3 -11,-0.9 1,-0.1 457,-0.2 0.201 36.6 -87.2 69.6 162.9 48.0 43.2 53.2 732 139 B P - 0 0 1 0, 0.0 4,-0.2 0, 0.0 -11,-0.2 0.653 68.2-124.3 -81.1 -13.0 46.2 40.0 54.4 733 140 B G > - 0 0 5 -13,-0.2 4,-1.8 1,-0.1 3,-0.4 -0.245 33.8 -54.1 92.6 173.7 42.7 41.5 54.5 734 141 B N H > S+ 0 0 4 -15,-0.3 4,-2.5 1,-0.2 50,-0.2 0.846 126.6 48.5 -64.3 -47.3 39.9 42.0 57.0 735 142 B M H > S+ 0 0 0 48,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.793 112.7 52.4 -70.6 -22.9 39.2 38.6 58.4 736 143 B A H > S+ 0 0 1 -3,-0.4 4,-2.5 47,-0.3 -2,-0.2 0.858 107.9 52.1 -68.5 -38.7 43.0 38.2 58.9 737 144 B L H X S+ 0 0 2 -4,-1.8 4,-1.2 2,-0.2 5,-0.5 0.883 110.4 48.7 -58.0 -41.5 42.7 41.5 60.7 738 145 B G H >< S+ 0 0 0 -4,-2.5 3,-0.6 2,-0.2 -2,-0.2 0.947 109.0 51.3 -64.6 -48.5 40.0 39.9 62.8 739 146 B A H 3< S+ 0 0 0 -4,-2.2 466,-1.7 1,-0.2 -2,-0.2 0.940 110.6 48.2 -57.2 -45.7 42.0 36.8 63.5 740 147 B A H 3< S- 0 0 15 -4,-2.5 -1,-0.2 464,-0.2 -2,-0.2 0.718 95.2-153.1 -69.4 -19.8 45.0 38.9 64.7 741 148 B R << + 0 0 63 -4,-1.2 2,-0.7 -3,-0.6 -3,-0.1 0.494 40.1 142.0 70.7 6.1 42.5 41.0 67.0 742 149 B S > - 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0 0 0 0, 0.0 46,-1.7 0, 0.0 2,-0.5 0.403 54.4-148.9 -91.7 150.8 36.3 49.6 55.2 769 176 B V B +d 814 0S 0 15,-0.3 17,-0.4 44,-0.2 46,-0.2 -0.639 17.7 178.9 -62.1 122.7 33.8 46.7 54.6 770 177 B V + 0 0 0 44,-3.3 45,-0.2 -2,-0.5 78,-0.2 0.042 32.8 130.2-123.9 23.4 31.9 46.6 57.9 771 178 B D - 0 0 0 43,-0.5 2,-0.6 13,-0.1 16,-0.4 -0.451 58.5-128.9 -62.7 151.5 29.5 43.8 56.9 772 179 B I - 0 0 4 -2,-0.1 2,-1.8 13,-0.1 3,-0.3 -0.936 10.0-143.9-111.4 120.7 29.4 41.0 59.5 773 180 B N + 0 0 1 14,-1.4 15,-0.1 -2,-0.6 48,-0.1 -0.482 47.4 142.8 -93.3 70.6 29.9 37.7 57.9 774 181 B N + 0 0 58 -2,-1.8 -1,-0.2 13,-0.1 47,-0.2 0.483 56.2 74.1 -87.5 -6.1 27.5 35.8 60.1 775 182 B N > - 0 0 27 45,-1.4 3,-2.1 -3,-0.3 7,-0.2 -0.914 68.4-159.3-102.5 106.9 26.4 33.6 57.1 776 183 B P T 3 S+ 0 0 36 0, 0.0 336,-0.3 0, 0.0 383,-0.2 0.741 90.6 59.0 -52.0 -23.9 29.2 31.1 56.4 777 184 B D T 3 + 0 0 47 334,-0.1 334,-0.1 44,-0.1 44,-0.1 0.347 68.9 134.9 -91.3 6.3 27.7 30.7 52.8 778 185 B N < - 0 0 0 -3,-2.1 45,-0.2 42,-0.2 47,-0.1 -0.392 36.8-169.0 -53.6 111.1 28.1 34.3 51.9 779 186 B P S S+ 0 0 39 0, 0.0 -1,-0.2 0, 0.0 46,-0.1 0.588 79.5 37.2 -82.3 -8.6 29.7 34.1 48.4 780 187 B V S S+ 0 0 10 42,-0.3 45,-0.1 44,-0.2 40,-0.1 0.723 120.0 34.0-117.0 -30.3 30.5 37.8 48.2 781 188 B I S > S+ 0 0 1 41,-0.2 3,-2.2 38,-0.2 4,-0.1 0.868 75.8 121.8 -96.8 -75.9 31.7 39.1 51.6 782 189 B G G > S+ 0 0 3 1,-0.3 3,-2.1 -7,-0.2 -9,-0.1 -0.289 88.7 6.3 57.2-131.2 33.6 36.2 53.3 783 190 B V G 3 S+ 0 0 4 1,-0.3 -48,-2.3 -49,-0.1 -47,-0.3 0.568 117.5 78.4 -70.1 -7.7 37.3 37.1 54.2 784 191 B R G < S+ 0 0 30 -3,-2.2 2,-0.4 -50,-0.2 -1,-0.3 0.603 87.3 72.2 -71.1 -11.5 36.5 40.6 53.2 785 192 B S S < S- 0 0 0 -3,-2.1 -47,-0.1 -4,-0.1 -13,-0.1 -0.852 78.7-138.8 -98.1 143.2 34.7 41.0 56.6 786 193 B F S S- 0 0 0 -17,-0.4 2,-0.3 -2,-0.4 -1,-0.1 0.881 73.2 -24.1 -62.1 -38.4 36.6 41.2 59.9 787 194 B S - 0 0 0 -16,-0.4 -14,-1.4 -49,-0.1 421,-0.2 -0.992 44.1-116.7-166.4 159.4 34.3 38.9 61.9 788 195 B S S S+ 0 0 28 419,-2.1 2,-0.5 -2,-0.3 420,-0.1 0.378 94.6 93.5 -83.2 -1.9 30.9 37.4 62.5 789 196 B N S > S- 0 0 58 418,-0.5 4,-2.4 1,-0.1 5,-0.3 -0.832 72.3-146.5 -97.7 128.8 31.0 39.4 65.8 790 197 B R H > S+ 0 0 61 -2,-0.5 4,-1.9 1,-0.2 -1,-0.1 0.831 96.9 48.0 -65.8 -32.2 29.4 42.8 65.7 791 198 B E H > S+ 0 0 57 2,-0.2 4,-2.5 3,-0.2 -1,-0.2 0.914 111.6 46.3 -75.7 -44.1 31.8 44.3 68.2 792 199 B L H > S+ 0 0 5 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.929 115.8 47.9 -64.3 -44.4 35.1 43.1 66.6 793 200 B T H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.953 112.9 48.8 -55.2 -48.3 33.8 44.2 63.1 794 201 B S H X S+ 0 0 8 -4,-1.9 4,-2.4 -5,-0.3 -2,-0.2 0.932 114.1 46.2 -63.3 -43.3 32.8 47.6 64.6 795 202 B R H X S+ 0 0 80 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.943 113.8 43.8 -62.2 -56.8 36.2 48.1 66.3 796 203 B L H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.876 114.5 54.9 -64.2 -29.9 38.5 47.1 63.5 797 204 B G H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.929 105.7 48.2 -64.8 -52.5 36.3 49.1 61.2 798 205 B L H X S+ 0 0 44 -4,-2.4 4,-2.8 -5,-0.2 -2,-0.2 0.940 115.3 47.4 -50.1 -44.6 36.6 52.4 63.2 799 206 B Y H X S+ 0 0 22 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.879 110.0 50.5 -73.5 -39.3 40.3 51.9 63.3 800 207 B T H X S+ 0 0 7 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.937 113.1 47.3 -55.2 -54.7 40.7 51.2 59.6 801 208 B M H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.876 109.7 52.0 -54.3 -49.1 38.7 54.3 58.8 802 209 B K H X S+ 0 0 68 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.919 109.2 51.1 -57.5 -44.4 40.7 56.5 61.2 803 210 B G H X S+ 0 0 0 -4,-2.1 4,-1.0 1,-0.2 -2,-0.2 0.947 112.1 47.3 -59.7 -44.3 44.0 55.3 59.6 804 211 B L H ><>S+ 0 0 1 -4,-2.4 5,-1.6 1,-0.2 3,-0.9 0.947 112.5 48.0 -60.0 -45.8 42.6 56.2 56.2 805 212 B Q H ><5S+ 0 0 18 -4,-2.5 3,-2.1 1,-0.3 -1,-0.2 0.836 102.0 63.0 -73.4 -30.9 41.3 59.6 57.2 806 213 B R H 3<5S+ 0 0 142 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.799 102.7 50.9 -56.9 -34.5 44.6 60.6 58.9 807 214 B Q T <<5S- 0 0 40 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.232 124.8-107.3 -86.3 12.5 46.2 60.3 55.5 808 215 B D T < 5S+ 0 0 57 -3,-2.1 2,-0.5 1,-0.2 -3,-0.2 0.808 73.2 143.6 58.2 38.9 43.5 62.6 54.1 809 216 B I < - 0 0 1 -5,-1.6 -1,-0.2 -6,-0.1 -45,-0.2 -0.917 53.9-123.1-106.2 125.0 41.8 59.8 52.2 810 217 B A E -a 764 0P 0 -47,-2.4 -45,-2.8 -2,-0.5 2,-0.4 -0.490 31.7-146.7 -65.6 144.2 38.0 59.9 52.1 811 218 B S E -a 765 0P 0 -47,-0.2 47,-1.7 -2,-0.1 46,-0.6 -0.953 12.6-161.6-129.5 128.6 36.6 56.7 53.6 812 219 B A E -e 858 0T 0 -47,-1.5 2,-0.3 -45,-0.9 47,-0.3 -0.925 11.1-145.9-116.0 128.8 33.4 54.7 52.7 813 220 B L E -e 859 0T 0 45,-2.2 47,-2.8 -2,-0.5 3,-0.4 -0.721 36.6-117.6 -84.0 140.5 31.8 52.2 55.0 814 221 B K E +d 769 0S 3 -46,-1.7 -44,-3.3 -2,-0.3 -43,-0.5 -0.983 62.1 2.0-139.6 152.5 30.2 49.3 53.0 815 222 B H E > S- 0 0 9 45,-0.5 3,-2.6 -2,-0.3 46,-0.2 0.261 76.2-127.3-124.6 114.8 27.8 47.9 52.3 816 223 B F E 3 S+e 861 0T 0 44,-3.1 46,-1.1 -3,-0.4 -1,-0.1 -0.384 88.7 12.0 -76.6 137.8 24.8 49.6 54.0 817 224 B P T 3 S- 0 0 1 0, 0.0 -1,-0.3 0, 0.0 31,-0.1 -0.844 127.1 -72.2 -94.7 25.0 22.7 48.3 55.7 818 225 B G < - 0 0 2 -3,-2.6 3,-0.2 27,-0.1 -2,-0.1 0.340 34.9-165.7 124.0 113.4 24.9 45.2 55.9 819 226 B H > + 0 0 1 1,-0.1 3,-0.9 25,-0.1 -38,-0.2 0.245 65.5 98.2 -99.5 6.8 25.6 42.5 53.2 820 227 B G T 3 S+ 0 0 2 1,-0.2 -45,-1.4 -5,-0.1 -42,-0.2 0.588 74.2 60.3 -78.0 -13.6 27.1 39.8 55.5 821 228 B D T 3 S+ 0 0 31 -3,-0.2 2,-0.3 -47,-0.2 -1,-0.2 0.441 83.1 106.2 -94.5 -1.8 23.9 37.7 55.9 822 229 B T < - 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