==== 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 (OXYGENASE) 30-AUG-95 1HAN . COMPND 2 MOLECULE: 2,3-DIHYDROXYBIPHENYL 1,2-DIOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA XENOVORANS; . AUTHOR S.HAN,J.T.BOLIN . 287 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12220.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 198 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 9.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 79 27.5 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 . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 19 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 0 0 0 1 0 0 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 PARALLEL BRIDGES PER LADDER . 4 1 3 3 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 1 0 0 1 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 2 A S 0 0 80 0, 0.0 66,-0.5 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 134.0 16.8 -3.0 87.5 2 3 A I E -A 66 0A 14 162,-0.5 64,-0.2 1,-0.1 3,-0.1 -0.444 360.0-175.0 -67.2 130.7 19.1 -4.3 84.9 3 4 A R E - 0 0 145 62,-3.5 2,-0.3 1,-0.3 63,-0.2 0.758 57.5 -36.6 -97.0 -31.7 18.0 -3.2 81.4 4 5 A S E -A 65 0A 5 61,-1.1 61,-2.9 186,-0.1 2,-0.6 -0.983 65.2 -75.2-176.3 172.6 20.5 -5.2 79.3 5 6 A L E +A 64 0A 1 136,-0.3 138,-2.9 139,-0.3 59,-0.2 -0.791 47.6 178.5 -83.5 122.4 24.0 -6.6 78.7 6 7 A G E - 0 0 1 57,-2.8 2,-0.3 -2,-0.6 58,-0.2 0.839 51.0 -6.5 -98.1 -42.2 26.0 -3.5 77.8 7 8 A Y E -A 63 0A 5 56,-1.4 56,-2.7 2,-0.0 2,-0.3 -0.969 50.5-153.8-152.2 164.9 29.6 -4.5 77.3 8 9 A M E -Ab 62 49A 2 40,-2.1 42,-2.1 -2,-0.3 2,-0.4 -0.992 6.1-155.5-141.5 148.4 32.1 -7.5 77.6 9 10 A G E -Ab 61 50A 0 52,-2.7 51,-3.0 -2,-0.3 52,-1.5 -0.982 6.7-161.0-128.0 136.9 35.8 -7.7 78.1 10 11 A F E -Ab 59 51A 0 40,-2.7 42,-3.0 -2,-0.4 2,-0.6 -0.917 9.2-151.8-116.3 143.0 38.1 -10.6 77.0 11 12 A A E +Ab 58 52A 11 47,-2.4 47,-1.5 -2,-0.4 46,-1.1 -0.965 32.6 175.1-114.9 109.4 41.6 -11.3 78.4 12 13 A V E - b 0 53A 0 40,-3.0 42,-2.4 -2,-0.6 3,-0.3 -0.843 43.0-138.4-123.8 157.6 43.4 -13.1 75.6 13 14 A S S S+ 0 0 65 -2,-0.3 2,-0.5 1,-0.2 -1,-0.1 0.793 100.6 42.7 -80.6 -26.6 46.9 -14.5 74.8 14 15 A D > + 0 0 80 1,-0.1 4,-1.7 2,-0.1 -1,-0.2 -0.801 60.0 171.5-125.8 91.2 46.9 -13.3 71.2 15 16 A V H > S+ 0 0 28 -2,-0.5 4,-2.4 -3,-0.3 -1,-0.1 0.844 79.7 54.8 -66.5 -34.0 45.5 -9.7 70.8 16 17 A A H > S+ 0 0 55 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.906 106.6 50.6 -68.4 -40.6 46.4 -9.4 67.2 17 18 A A H > S+ 0 0 30 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.909 111.9 49.0 -62.6 -41.3 44.5 -12.6 66.2 18 19 A W H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 5,-0.3 0.912 108.6 52.7 -64.6 -42.2 41.5 -11.3 68.1 19 20 A R H X S+ 0 0 78 -4,-2.4 4,-2.1 1,-0.2 5,-0.3 0.941 113.2 43.5 -59.0 -49.6 41.7 -7.9 66.3 20 21 A S H X>S+ 0 0 47 -4,-2.3 4,-1.9 1,-0.2 5,-0.8 0.882 114.4 50.2 -62.9 -42.1 41.8 -9.5 62.9 21 22 A F H X>S+ 0 0 8 -4,-2.4 5,-1.9 -5,-0.2 4,-1.1 0.935 112.6 45.7 -63.3 -50.3 39.0 -12.0 63.7 22 23 A L H <5S+ 0 0 0 -4,-2.7 6,-2.8 3,-0.2 5,-0.2 0.910 123.7 31.9 -63.1 -43.4 36.6 -9.4 65.1 23 24 A T H X5S+ 0 0 16 -4,-2.1 4,-0.6 -5,-0.3 -3,-0.2 0.963 127.3 33.5 -82.3 -51.7 37.1 -6.9 62.3 24 25 A Q H <5S+ 0 0 119 -4,-1.9 -3,-0.2 -5,-0.3 -2,-0.1 0.813 130.2 29.4 -77.6 -33.2 37.7 -9.0 59.2 25 26 A K T < -C 37 0A 66 3,-2.5 3,-1.7 -2,-0.4 62,-0.0 -0.660 63.5 -79.0-134.9-169.6 43.0 2.7 75.5 35 36 A D T 3 S+ 0 0 107 1,-0.3 3,-0.1 -2,-0.2 61,-0.1 0.524 130.8 64.1 -73.3 -5.7 43.9 1.6 79.1 36 37 A N T 3 S- 0 0 0 1,-0.4 -1,-0.3 60,-0.1 2,-0.2 0.491 117.2-115.8 -89.8 -8.5 40.6 -0.3 78.7 37 38 A G E < -C 34 0A 13 -3,-1.7 -3,-2.5 13,-0.1 2,-0.5 -0.670 59.1 -18.0 107.7-167.7 42.3 -2.3 75.9 38 39 A D E S-CD 33 51A 12 13,-2.6 13,-2.5 -5,-0.2 2,-0.4 -0.709 74.4-146.3 -74.8 126.9 41.6 -2.6 72.2 39 40 A L E - D 0 50A 15 -7,-3.1 -8,-3.4 -2,-0.5 2,-0.4 -0.796 16.0-168.9-104.9 142.7 38.1 -1.4 71.7 40 41 A F E -CD 30 49A 0 9,-2.4 8,-2.7 -2,-0.4 9,-1.7 -0.982 4.2-157.6-132.1 141.6 35.5 -2.6 69.2 41 42 A R E +C 29 0A 8 -12,-2.7 -12,-2.5 -2,-0.4 5,-0.1 -0.804 23.8 171.3-117.7 155.9 32.1 -1.1 68.2 42 43 A I S S- 0 0 4 -2,-0.3 94,-0.5 3,-0.2 2,-0.2 0.267 78.1 -0.5-136.7 -3.5 28.9 -2.5 66.6 43 44 A D S S- 0 0 22 2,-0.4 85,-0.1 -14,-0.1 -14,-0.0 -0.736 106.0 -47.2-159.3-153.1 26.7 0.6 67.1 44 45 A S S S+ 0 0 30 -2,-0.2 78,-2.9 -3,-0.1 81,-0.1 0.687 96.3 103.0 -71.5 -20.8 26.7 4.2 68.4 45 46 A R B S-H 121 0B 40 76,-0.2 -2,-0.4 1,-0.1 76,-0.3 -0.325 84.6-117.3 -64.3 147.3 28.3 3.3 71.8 46 47 A A S S- 0 0 27 74,-2.7 2,-0.3 1,-0.2 -1,-0.1 0.775 92.0 -16.1 -54.1 -32.2 32.0 4.2 72.2 47 48 A W - 0 0 20 73,-0.3 -6,-0.2 50,-0.1 -1,-0.2 -0.943 46.3-177.5-168.2 154.8 32.7 0.4 72.6 48 49 A R S S+ 0 0 6 -8,-2.7 -40,-2.1 1,-0.4 2,-0.4 0.504 79.9 40.5-127.2 -31.5 30.9 -2.8 73.3 49 50 A I E -bD 8 40A 2 -9,-1.7 -9,-2.4 -42,-0.2 -1,-0.4 -0.987 63.3-167.3-126.9 131.9 33.8 -5.3 73.3 50 51 A A E -bD 9 39A 0 -42,-2.1 -40,-2.7 -2,-0.4 2,-0.5 -0.955 5.3-159.2-117.0 137.1 37.2 -4.8 74.9 51 52 A V E +bD 10 38A 2 -13,-2.5 -13,-2.6 -2,-0.4 2,-0.3 -0.980 15.6 176.8-119.7 120.6 40.2 -7.1 74.2 52 53 A Q E -b 11 0A 56 -42,-3.0 -40,-3.0 -2,-0.5 2,-0.3 -0.876 37.4-101.5-121.4 154.5 43.1 -7.0 76.8 53 54 A Q E +b 12 0A 119 -2,-0.3 2,-0.3 -42,-0.2 -40,-0.2 -0.581 61.8 140.4 -74.5 134.3 46.2 -9.1 76.9 54 55 A G - 0 0 12 -42,-2.4 3,-0.2 -2,-0.3 -40,-0.0 -0.964 56.8-121.3-168.9 163.0 45.8 -11.8 79.5 55 56 A E S S+ 0 0 155 -2,-0.3 -42,-0.1 1,-0.2 -1,-0.1 0.716 96.3 70.7 -86.8 -24.1 46.5 -15.5 80.3 56 57 A V S S- 0 0 78 -44,-0.1 -1,-0.2 2,-0.1 -44,-0.2 0.801 78.3-151.5 -66.9 -27.4 43.0 -16.8 80.8 57 58 A D + 0 0 30 -46,-1.1 2,-0.3 -3,-0.2 -45,-0.2 0.967 63.1 89.1 52.4 59.3 41.9 -16.6 77.1 58 59 A D E S-A 11 0A 8 -47,-1.5 -47,-2.4 147,-0.1 2,-0.3 -0.926 91.5 -48.2-164.7-179.7 38.3 -16.1 78.2 59 60 A L E -A 10 0A 0 -2,-0.3 -49,-0.3 -49,-0.2 3,-0.1 -0.503 45.9-173.9 -66.0 125.1 35.7 -13.6 79.2 60 61 A A E - 0 0 16 -51,-3.0 2,-0.3 1,-0.4 -50,-0.2 0.784 61.3 -17.0 -93.3 -35.3 37.3 -11.3 81.8 61 62 A F E -A 9 0A 9 -52,-1.5 -52,-2.7 50,-0.1 -1,-0.4 -0.964 52.7-149.7-165.3 159.1 34.2 -9.2 82.8 62 63 A A E -Ae 8 113A 0 50,-1.1 52,-2.1 -2,-0.3 2,-0.5 -0.990 13.1-145.8-136.2 141.7 30.7 -8.3 81.6 63 64 A G E -Ae 7 114A 0 -56,-2.7 -57,-2.8 -2,-0.3 -56,-1.4 -0.947 6.0-157.2-116.6 128.3 28.8 -5.1 82.3 64 65 A Y E -Ae 5 115A 0 50,-3.3 52,-2.5 -2,-0.5 2,-0.4 -0.864 17.6-134.4-101.9 138.4 25.1 -4.9 82.8 65 66 A E E -Ae 4 116A 33 -61,-2.9 -62,-3.5 -2,-0.4 -61,-1.1 -0.744 17.4-170.9-100.7 133.6 23.3 -1.6 82.2 66 67 A V E -A 2 0A 3 50,-2.6 52,-0.4 -2,-0.4 -64,-0.1 -0.769 33.3-115.2-111.6 163.1 20.8 0.1 84.3 67 68 A A S S- 0 0 55 -66,-0.5 2,-0.3 -2,-0.3 51,-0.2 0.835 79.8 -25.2 -69.2 -33.5 18.8 3.2 83.2 68 69 A D S > S- 0 0 80 49,-0.1 4,-1.9 48,-0.1 5,-0.1 -0.914 78.0 -67.9-163.1-172.7 20.1 5.7 85.7 69 70 A A H > S+ 0 0 52 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.820 125.4 54.8 -63.1 -34.5 21.7 6.5 89.0 70 71 A A H > S+ 0 0 63 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.938 107.4 50.6 -65.7 -43.7 18.6 5.5 90.9 71 72 A G H > S+ 0 0 6 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.882 109.4 50.9 -60.1 -39.8 18.8 2.1 89.2 72 73 A L H X S+ 0 0 20 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.934 109.7 50.1 -63.9 -45.1 22.4 1.7 90.2 73 74 A A H X S+ 0 0 61 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.912 108.9 52.6 -58.6 -46.0 21.6 2.5 93.8 74 75 A Q H X S+ 0 0 106 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.930 111.6 45.1 -54.4 -54.6 18.8 -0.1 93.8 75 76 A M H X S+ 0 0 4 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.892 110.6 52.5 -59.9 -43.2 21.0 -2.8 92.5 76 77 A A H X S+ 0 0 17 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.932 112.8 46.8 -59.0 -42.4 23.9 -2.0 94.9 77 78 A D H X S+ 0 0 90 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.926 110.2 51.8 -65.3 -44.2 21.4 -2.2 97.7 78 79 A K H X S+ 0 0 100 -4,-2.7 4,-0.7 1,-0.2 -1,-0.2 0.900 111.4 47.4 -60.6 -40.8 19.9 -5.5 96.5 79 80 A L H <>S+ 0 0 0 -4,-2.6 5,-2.6 2,-0.2 3,-0.5 0.900 112.0 49.9 -68.9 -41.0 23.4 -7.0 96.3 80 81 A K H ><5S+ 0 0 127 -4,-2.2 3,-2.3 1,-0.2 -2,-0.2 0.943 107.0 53.4 -63.5 -46.5 24.3 -5.8 99.8 81 82 A Q H 3<5S+ 0 0 159 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.713 108.0 53.6 -63.3 -15.5 21.1 -7.2 101.3 82 83 A A T 3<5S- 0 0 52 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.409 120.4-110.1 -96.4 -2.0 22.1 -10.5 99.8 83 84 A G T < 5 + 0 0 66 -3,-2.3 2,-0.4 1,-0.3 -3,-0.2 0.717 66.6 148.9 81.3 21.7 25.5 -10.4 101.4 84 85 A I < - 0 0 43 -5,-2.6 2,-0.7 -6,-0.1 -1,-0.3 -0.727 53.2-117.6 -91.7 135.7 27.4 -9.9 98.2 85 86 A A - 0 0 85 -2,-0.4 2,-0.4 21,-0.1 21,-0.3 -0.616 39.9-175.5 -73.2 110.7 30.7 -7.9 98.4 86 87 A V - 0 0 36 -2,-0.7 2,-0.4 19,-0.1 19,-0.2 -0.915 11.9-161.5-111.4 140.0 30.1 -4.8 96.2 87 88 A T E -F 104 0A 84 17,-2.6 17,-2.8 -2,-0.4 2,-0.7 -0.973 20.7-129.4-121.4 128.7 32.7 -2.2 95.4 88 89 A T E -F 103 0A 114 -2,-0.4 15,-0.3 15,-0.2 -2,-0.0 -0.718 37.0-116.3 -76.8 115.5 31.7 1.2 94.2 89 90 A G - 0 0 14 13,-2.3 13,-0.3 -2,-0.7 2,-0.1 -0.253 30.3-123.3 -52.5 135.7 33.8 1.7 91.1 90 91 A D >> - 0 0 92 1,-0.1 4,-2.7 11,-0.1 3,-0.7 -0.413 25.7-101.1 -80.9 163.3 36.3 4.6 91.5 91 92 A A H 3> S+ 0 0 56 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.839 123.2 57.2 -49.6 -38.4 36.4 7.5 89.1 92 93 A S H 3> S+ 0 0 51 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.907 109.7 42.9 -61.9 -44.8 39.5 6.0 87.5 93 94 A L H <> S+ 0 0 26 -3,-0.7 4,-2.2 2,-0.2 5,-0.2 0.927 112.9 52.8 -67.6 -44.5 37.6 2.8 86.7 94 95 A A H X>S+ 0 0 11 -4,-2.7 5,-2.4 1,-0.2 4,-1.1 0.899 111.4 47.8 -57.3 -40.0 34.5 4.7 85.5 95 96 A R H <5S+ 0 0 196 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.893 108.5 53.0 -69.0 -41.3 36.8 6.7 83.2 96 97 A R H <5S+ 0 0 74 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.876 115.3 41.3 -61.9 -37.3 38.5 3.6 81.8 97 98 A R H <5S- 0 0 21 -4,-2.2 23,-0.3 -5,-0.1 -1,-0.2 0.626 108.4-125.6 -83.9 -16.1 35.0 2.1 81.0 98 99 A G T <5 + 0 0 22 -4,-1.1 22,-0.6 1,-0.3 2,-0.2 0.824 66.2 129.5 74.7 30.8 33.7 5.4 79.7 99 100 A V < - 0 0 15 -5,-2.4 -1,-0.3 20,-0.2 20,-0.2 -0.706 63.8-129.0-115.2 167.9 30.7 5.3 82.1 100 101 A T S S- 0 0 85 17,-1.7 2,-0.3 1,-0.3 18,-0.2 0.900 86.5 -9.6 -82.1 -44.1 29.1 7.7 84.6 101 102 A G E + G 0 117A 15 16,-1.5 16,-1.9 -7,-0.1 -1,-0.3 -0.986 67.1 172.5-154.4 147.7 28.9 5.4 87.6 102 103 A L E - G 0 116A 3 -13,-0.3 -13,-2.3 -2,-0.3 2,-0.3 -0.991 19.5-149.4-157.0 157.8 29.4 1.7 88.3 103 104 A I E -FG 88 115A 4 12,-2.2 12,-2.1 -2,-0.3 2,-0.3 -0.943 17.9-150.7-126.8 146.6 29.7 -1.0 90.9 104 105 A T E +FG 87 114A 30 -17,-2.8 -17,-2.6 -2,-0.3 2,-0.3 -0.894 29.4 133.1-121.9 150.7 31.8 -4.2 90.7 105 106 A F E - G 0 113A 17 8,-2.1 8,-3.2 -2,-0.3 2,-0.3 -0.912 41.8-107.4-171.2-171.7 31.3 -7.6 92.2 106 107 A A E - G 0 112A 44 -21,-0.3 -21,-0.1 6,-0.3 -45,-0.0 -0.941 23.9-111.9-136.8 156.5 31.5 -11.3 91.1 107 108 A D > - 0 0 6 4,-2.2 3,-2.4 -2,-0.3 4,-0.1 -0.401 52.1 -86.8 -79.3 168.8 29.1 -14.1 90.4 108 109 A P T 3 S+ 0 0 45 0, 0.0 -1,-0.1 0, 0.0 48,-0.1 0.644 128.4 46.1 -50.7 -17.1 29.1 -17.1 92.8 109 110 A F T 3 S- 0 0 56 2,-0.1 47,-0.0 47,-0.0 -2,-0.0 0.071 125.5 -89.0-117.9 23.0 31.8 -18.8 90.8 110 111 A G S < S+ 0 0 39 -3,-2.4 0, 0.0 1,-0.2 0, 0.0 0.557 72.0 142.9 90.8 6.6 34.2 -15.9 90.2 111 112 A L - 0 0 0 -4,-0.1 -4,-2.2 95,-0.1 2,-0.3 -0.749 52.0-125.8 -83.7 122.0 33.2 -14.1 87.0 112 113 A P E - G 0 106A 49 0, 0.0 -50,-1.1 0, 0.0 2,-0.3 -0.532 34.0-173.7 -67.1 128.5 33.8 -10.4 87.5 113 114 A L E -eG 62 105A 0 -8,-3.2 -8,-2.1 -2,-0.3 2,-0.3 -0.915 10.9-163.9-124.8 152.8 30.6 -8.4 86.8 114 115 A E E -eG 63 104A 10 -52,-2.1 -50,-3.3 -2,-0.3 2,-0.4 -0.980 6.2-160.7-137.5 140.1 29.9 -4.7 86.6 115 116 A I E +eG 64 103A 0 -12,-2.1 -12,-2.2 -2,-0.3 2,-0.3 -0.998 29.4 160.0-120.0 128.2 26.6 -2.8 86.8 116 117 A Y E -eG 65 102A 1 -52,-2.5 -50,-2.6 -2,-0.4 2,-0.3 -0.897 27.1-153.8-142.4 172.3 26.8 0.7 85.4 117 118 A Y E + G 0 101A 55 -16,-1.9 -17,-1.7 -2,-0.3 -16,-1.5 -0.948 67.1 40.0-144.7 159.8 24.8 3.6 84.0 118 119 A G - 0 0 32 -52,-0.4 -1,-0.1 -2,-0.3 -18,-0.1 0.929 65.5-177.6 68.8 52.0 25.6 6.5 81.6 119 120 A A - 0 0 31 -20,-0.2 2,-0.4 -3,-0.1 -20,-0.2 -0.261 32.3 -92.9 -72.8 167.8 27.8 4.9 79.0 120 121 A S - 0 0 55 -22,-0.6 -74,-2.7 -23,-0.3 -73,-0.3 -0.696 31.3-157.8 -92.4 134.3 29.3 7.0 76.2 121 122 A E B -H 45 0B 79 -2,-0.4 -76,-0.2 -76,-0.3 3,-0.1 -0.778 5.4-167.6-103.1 151.2 27.7 7.5 72.8 122 123 A V > + 0 0 21 -78,-2.9 3,-1.9 -2,-0.3 -77,-0.1 -0.433 27.5 150.0-138.0 59.3 29.7 8.6 69.7 123 124 A F T 3 S+ 0 0 145 1,-0.3 -1,-0.1 3,-0.1 -78,-0.1 0.779 72.4 66.7 -60.8 -26.3 27.2 9.6 67.1 124 125 A E T 3 S+ 0 0 147 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.570 98.4 53.9 -73.2 -10.2 29.8 12.0 65.7 125 126 A K S < S- 0 0 134 -3,-1.9 -1,-0.3 -81,-0.1 3,-0.1 -0.751 94.4-145.7-122.7 79.8 31.9 9.0 64.7 126 127 A P - 0 0 101 0, 0.0 2,-0.1 0, 0.0 -3,-0.1 -0.119 23.4-100.2 -51.8 133.7 29.4 7.0 62.5 127 128 A F + 0 0 57 -4,-0.0 -83,-0.1 -85,-0.0 -85,-0.0 -0.368 41.1 179.2 -57.8 127.9 29.7 3.3 62.7 128 129 A L - 0 0 128 -3,-0.1 -87,-0.1 -2,-0.1 -85,-0.1 -0.951 24.7-131.2-133.0 111.5 31.6 1.7 59.7 129 130 A P - 0 0 35 0, 0.0 -101,-0.2 0, 0.0 -100,-0.2 -0.237 9.0-130.3 -65.1 153.7 31.9 -2.1 59.9 130 131 A G S S+ 0 0 43 -103,-0.7 2,-0.3 -102,-0.6 -102,-0.2 0.538 94.4 19.6 -77.9 -9.9 35.2 -3.8 59.3 131 132 A A S S- 0 0 18 -104,-0.5 2,-1.0 -105,-0.1 -106,-0.1 -0.920 111.0 -66.4-149.2 167.2 33.6 -6.1 56.8 132 133 A A S S+ 0 0 76 -2,-0.3 2,-0.4 90,-0.0 91,-0.1 -0.484 70.1 146.0 -67.0 99.1 30.3 -6.0 54.8 133 134 A V - 0 0 13 -2,-1.0 3,-0.1 -106,-0.1 -2,-0.1 -0.990 43.7-148.6-135.7 125.1 27.6 -6.2 57.4 134 135 A S - 0 0 81 -2,-0.4 2,-0.2 1,-0.2 -1,-0.1 0.762 69.5 -55.1 -65.5 -28.3 24.3 -4.3 57.0 135 136 A G - 0 0 16 81,-0.1 80,-2.5 -3,-0.1 2,-0.4 -0.828 44.0-108.2 161.7 160.7 24.0 -3.8 60.7 136 137 A F B -I 214 0C 23 -94,-0.5 2,-0.8 78,-0.3 78,-0.3 -0.878 30.5-124.5-110.4 147.2 23.9 -5.3 64.2 137 138 A L + 0 0 63 76,-3.0 76,-0.4 -2,-0.4 -94,-0.1 -0.816 58.1 121.4 -95.0 110.7 20.8 -5.5 66.4 138 139 A T > + 0 0 25 -2,-0.8 3,-2.1 74,-0.1 4,-0.1 0.278 20.8 110.8-128.5 -99.4 21.3 -3.8 69.8 139 140 A G G > S- 0 0 55 1,-0.3 3,-1.9 2,-0.2 -2,-0.0 -0.271 102.3 -5.9 57.0-136.0 19.1 -1.0 71.0 140 141 A E G 3 S+ 0 0 141 1,-0.3 -1,-0.3 -136,-0.0 52,-0.2 0.638 133.5 64.3 -67.1 -12.9 16.9 -2.0 73.9 141 142 A Q G < S- 0 0 30 -3,-2.1 -136,-0.3 1,-0.2 3,-0.3 0.469 97.3-148.9 -88.2 -2.7 18.0 -5.6 73.5 142 143 A G < - 0 0 0 -3,-1.9 -1,-0.2 1,-0.2 -136,-0.2 -0.153 44.7 -32.7 70.4-163.1 21.6 -4.7 74.4 143 144 A L S S- 0 0 2 -138,-2.9 70,-0.4 1,-0.1 2,-0.3 0.861 91.4 -98.9 -61.9 -45.3 24.8 -6.4 73.2 144 145 A G - 0 0 0 -3,-0.3 -139,-0.3 -139,-0.2 2,-0.3 -0.947 48.2 -72.6 157.1-134.4 23.5 -9.9 72.7 145 146 A H E -J 211 0D 2 66,-0.7 66,-2.6 -2,-0.3 2,-0.3 -0.937 26.7-157.7-151.7 168.9 23.9 -12.9 75.1 146 147 A F E -Jk 210 196D 0 49,-1.0 51,-1.5 -2,-0.3 2,-0.6 -0.978 21.5-124.9-149.0 153.5 26.3 -15.5 76.5 147 148 A V E - k 0 197D 6 62,-2.1 61,-2.2 -2,-0.3 2,-0.5 -0.942 24.0-149.2-104.5 116.9 26.0 -18.9 78.1 148 149 A R E -Jk 207 198D 10 49,-2.9 51,-1.8 -2,-0.6 2,-0.4 -0.769 7.1-144.7 -89.1 121.3 27.7 -19.1 81.5 149 150 A C E + k 0 199D 10 57,-2.3 51,-0.2 -2,-0.5 49,-0.0 -0.755 27.3 175.9 -86.5 133.6 29.1 -22.5 82.4 150 151 A V - 0 0 7 49,-1.9 3,-0.2 -2,-0.4 48,-0.0 -0.944 40.6-135.8-139.0 155.6 28.7 -23.3 86.1 151 152 A P S S+ 0 0 108 0, 0.0 2,-0.4 0, 0.0 49,-0.1 0.783 102.1 32.5 -81.5 -23.1 29.4 -26.2 88.5 152 153 A D > - 0 0 70 1,-0.1 4,-2.1 47,-0.1 5,-0.1 -0.865 63.1-172.4-138.9 104.2 26.0 -25.8 90.2 153 154 A S H > S+ 0 0 12 -2,-0.4 4,-3.2 -3,-0.2 5,-0.2 0.831 85.6 54.1 -65.3 -34.5 23.1 -24.5 88.2 154 155 A D H > S+ 0 0 108 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.906 110.2 46.6 -71.2 -36.6 20.7 -24.1 91.2 155 156 A K H > S+ 0 0 108 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.914 115.4 47.1 -68.3 -41.9 23.1 -21.9 93.0 156 157 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.929 111.0 52.0 -64.8 -43.4 23.7 -19.9 89.8 157 158 A L H X>S+ 0 0 31 -4,-3.2 4,-2.6 1,-0.2 5,-0.5 0.917 106.9 52.4 -58.9 -46.6 20.0 -19.7 89.2 158 159 A A H X>S+ 0 0 42 -4,-2.3 4,-1.2 2,-0.2 5,-0.9 0.886 112.7 45.3 -57.9 -43.5 19.3 -18.3 92.7 159 160 A F H X>S+ 0 0 12 -4,-1.7 5,-2.3 3,-0.2 4,-1.1 0.963 116.2 43.4 -66.2 -53.5 21.9 -15.6 92.3 160 161 A Y H <5S+ 0 0 0 -4,-2.6 6,-2.5 3,-0.2 -2,-0.2 0.828 126.9 29.2 -66.8 -31.2 20.9 -14.5 88.7 161 162 A T H X5S+ 0 0 36 -4,-2.6 4,-0.9 4,-0.2 -3,-0.2 0.921 127.5 36.9 -94.0 -51.8 17.1 -14.5 89.3 162 163 A D H < S- 0 0 34 -81,-0.3 4,-1.2 1,-0.1 3,-0.4 -0.942 70.2-119.3-139.2 161.0 20.0 -9.7 57.4 217 218 A L H > S+ 0 0 82 -2,-0.3 4,-2.6 1,-0.2 3,-0.3 0.888 113.9 58.8 -59.9 -40.4 20.4 -13.3 56.4 218 219 A D H > S+ 0 0 107 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.857 97.3 59.9 -60.2 -33.7 23.1 -12.3 53.9 219 220 A D H > S+ 0 0 8 -3,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.928 111.0 42.1 -58.3 -43.6 25.2 -10.8 56.8 220 221 A V H X S+ 0 0 0 -4,-1.2 4,-2.3 -3,-0.3 -2,-0.2 0.921 114.6 50.3 -68.2 -46.4 25.2 -14.3 58.2 221 222 A G H X S+ 0 0 29 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.906 113.1 44.8 -60.8 -45.8 25.8 -16.1 54.9 222 223 A F H X S+ 0 0 126 -4,-3.2 4,-1.8 1,-0.2 -1,-0.2 0.921 113.5 50.0 -65.3 -44.0 28.8 -13.8 53.9 223 224 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.3 5,-0.3 0.871 105.0 59.0 -61.8 -38.0 30.3 -14.1 57.4 224 225 A F H X S+ 0 0 33 -4,-2.3 4,-3.2 1,-0.2 -1,-0.2 0.940 107.3 45.8 -56.5 -48.6 30.0 -17.9 57.3 225 226 A D H X S+ 0 0 107 -4,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.867 110.7 53.4 -63.7 -38.5 32.2 -18.1 54.2 226 227 A R H < S+ 0 0 56 -4,-1.8 4,-0.4 2,-0.2 -1,-0.2 0.910 116.6 38.4 -61.7 -43.5 34.7 -15.6 55.6 227 228 A V H ><>S+ 0 0 0 -4,-2.4 5,-1.8 1,-0.2 3,-1.4 0.889 112.9 55.8 -73.6 -42.3 35.1 -17.8 58.7 228 229 A D H ><5S+ 0 0 81 -4,-3.2 3,-1.9 1,-0.3 -2,-0.2 0.823 95.1 68.4 -61.7 -31.7 34.8 -21.1 56.8 229 230 A A T 3<5S+ 0 0 80 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.810 105.1 42.1 -58.8 -28.9 37.8 -20.0 54.7 230 231 A D T < 5S- 0 0 99 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.295 116.6-113.6-101.2 8.7 40.0 -20.3 57.7 231 232 A G T < 5S+ 0 0 60 -3,-1.9 -3,-0.2 -4,-0.1 -2,-0.1 0.770 77.7 128.3 66.1 31.4 38.4 -23.6 58.9 232 233 A L < + 0 0 55 -5,-1.8 19,-2.5 18,-0.0 -4,-0.2 0.409 28.1 117.6 -98.9 -1.1 36.9 -22.0 62.1 233 234 A I E +P 250 0D 14 17,-0.2 17,-0.3 -6,-0.2 3,-0.1 -0.467 31.4 174.4 -68.9 135.0 33.3 -23.1 61.7 234 235 A T E + 0 0 32 15,-2.6 53,-2.7 1,-0.4 2,-0.3 0.577 69.7 23.7-113.3 -19.3 32.2 -25.3 64.6 235 236 A S E S-PQ 249 286D 16 14,-1.5 14,-1.6 51,-0.3 -1,-0.4 -0.964 78.5-125.3-153.0 126.5 28.5 -25.7 63.8 236 237 A T E - 0 0 39 49,-2.3 48,-0.3 -2,-0.3 11,-0.1 -0.055 51.6 -65.8 -63.7 169.5 26.7 -25.3 60.4 237 238 A L E S+ 0 0 61 46,-0.1 47,-1.3 47,-0.1 48,-0.3 -0.305 72.8 142.0 -57.0 140.6 23.8 -22.9 59.9 238 239 A G E -PR 247 283D 0 9,-1.6 9,-2.4 45,-0.4 2,-0.4 -0.954 46.1-110.5-165.9 177.2 20.7 -23.9 61.8 239 240 A R E -PR 246 282D 65 43,-2.1 42,-2.8 -2,-0.3 43,-1.0 -0.994 28.9-127.2-126.6 131.1 17.8 -22.5 63.8 240 241 A H E - R 0 280D 19 5,-2.2 4,-0.5 -2,-0.4 40,-0.3 -0.454 10.5-134.7 -75.4 150.0 17.4 -22.8 67.5 241 242 A T S S+ 0 0 19 38,-1.5 39,-0.1 37,-0.1 -1,-0.1 0.782 97.4 36.1 -73.3 -31.0 14.2 -24.2 69.1 242 243 A N S S+ 0 0 3 37,-0.4 -1,-0.1 1,-0.1 38,-0.1 0.943 130.1 21.6 -94.7 -52.7 13.8 -21.6 71.8 243 244 A D S S- 0 0 2 2,-0.1 22,-3.0 21,-0.1 -50,-0.1 0.560 91.9-135.0 -92.2 -6.2 14.9 -18.2 70.5 244 245 A H + 0 0 51 -4,-0.5 2,-0.2 20,-0.2 -3,-0.1 0.690 44.3 164.3 59.4 23.6 14.5 -19.2 66.9 245 246 A M - 0 0 2 19,-0.1 -5,-2.2 20,-0.1 2,-0.7 -0.498 34.4-143.5 -72.4 133.7 17.8 -17.6 66.0 246 247 A V E +PS 239 262D 5 16,-2.7 16,-2.1 -7,-0.2 2,-0.3 -0.914 48.0 135.6 -96.2 118.5 19.2 -18.7 62.6 247 248 A S E -PS 238 261D 0 -9,-2.4 -9,-1.6 -2,-0.7 2,-0.3 -0.946 47.8-138.3-157.0 172.0 23.0 -18.9 63.2 248 249 A F E - S 0 260D 0 12,-1.2 12,-2.1 -2,-0.3 2,-0.4 -0.871 24.1-133.6-130.8 161.7 26.3 -20.6 62.9 249 250 A Y E -PS 235 259D 18 -14,-1.6 -15,-2.6 -2,-0.3 -14,-1.5 -0.915 23.0-179.9-118.4 147.7 29.0 -21.1 65.5 250 251 A A E -PS 233 258D 0 8,-2.3 8,-2.5 -2,-0.4 2,-0.4 -0.966 29.8-106.4-142.7 162.2 32.7 -20.5 65.1 251 252 A S E - S 0 257D 33 -19,-2.5 6,-0.2 -2,-0.3 5,-0.1 -0.754 26.8-149.4 -95.3 130.0 35.8 -20.7 67.2 252 253 A T > - 0 0 6 4,-2.3 3,-1.9 -2,-0.4 -234,-0.1 -0.419 39.7 -94.7 -83.7 171.5 37.5 -17.4 68.4 253 254 A P T 3 S+ 0 0 56 0, 0.0 -1,-0.1 0, 0.0 -240,-0.1 0.743 126.1 56.6 -62.7 -18.7 41.3 -17.4 68.9 254 255 A S T 3 S- 0 0 9 2,-0.2 3,-0.1 -242,-0.0 -3,-0.0 0.450 115.4-112.2 -90.2 -1.0 40.7 -18.2 72.6 255 256 A G S < S+ 0 0 44 -3,-1.9 -50,-0.1 1,-0.4 2,-0.1 0.100 81.5 123.6 93.8 -27.9 38.7 -21.3 72.0 256 257 A V - 0 0 3 -199,-0.2 -4,-2.3 -5,-0.1 -1,-0.4 -0.426 63.1-123.1 -62.7 141.0 35.6 -19.7 73.3 257 258 A E E -oS 209 251D 46 -49,-1.4 -47,-1.2 -6,-0.2 2,-0.4 -0.603 17.1-151.0 -93.1 155.2 32.9 -19.9 70.6 258 259 A V E -oS 210 250D 0 -8,-2.5 -8,-2.3 -49,-0.2 2,-0.5 -0.963 4.6-150.8-122.5 139.8 30.9 -17.1 69.0 259 260 A E E -oS 211 249D 1 -49,-2.6 -47,-2.1 -2,-0.4 2,-0.5 -0.952 8.2-165.7-109.5 132.1 27.4 -17.4 67.6 260 261 A Y E +oS 212 248D 0 -12,-2.1 -12,-1.2 -2,-0.5 2,-0.2 -0.953 26.8 161.6-121.7 108.3 26.6 -15.1 64.7 261 262 A G E -oS 213 247D 0 -49,-2.2 -47,-2.8 -2,-0.5 2,-0.3 -0.720 29.0-158.2-131.4-179.4 22.8 -15.0 64.1 262 263 A W E + S 0 246D 70 -16,-2.1 -16,-2.7 -2,-0.2 -47,-0.1 -0.977 65.0 25.2-154.9 150.6 19.8 -13.4 62.6 263 264 A S + 0 0 50 -49,-0.5 -1,-0.1 -2,-0.3 -16,-0.1 0.748 64.0 170.7 67.1 34.6 16.0 -13.3 63.1 264 265 A A - 0 0 25 -18,-0.1 -20,-0.2 -19,-0.1 2,-0.2 -0.384 31.6-121.7 -71.9 151.5 15.6 -14.3 66.7 265 266 A R - 0 0 90 -22,-3.0 -72,-0.8 -2,-0.1 2,-0.2 -0.569 26.0-127.6 -89.8 159.5 12.1 -14.0 68.2 266 267 A T B -T 192 0E 58 -2,-0.2 2,-0.5 -74,-0.2 -74,-0.2 -0.634 14.2-111.3-107.1 166.6 11.5 -11.8 71.3 267 268 A V - 0 0 11 -76,-2.9 2,-0.2 -2,-0.2 -98,-0.0 -0.824 36.9-173.3 -97.5 130.6 9.8 -12.3 74.6 268 269 A D > - 0 0 88 -2,-0.5 3,-1.2 1,-0.0 -78,-0.0 -0.502 40.9 -89.8-112.2-172.9 6.5 -10.5 75.2 269 270 A R T 3 S+ 0 0 256 1,-0.3 -2,-0.0 -2,-0.2 -1,-0.0 0.768 123.3 54.2 -72.4 -26.2 4.2 -10.0 78.2 270 271 A S T 3 S+ 0 0 89 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.332 81.3 132.5 -90.8 11.5 2.1 -13.1 77.4 271 272 A W < - 0 0 46 -3,-1.2 2,-0.4 1,-0.0 -4,-0.1 -0.260 37.6-164.8 -61.1 144.2 5.3 -15.3 77.4 272 273 A V - 0 0 102 -103,-0.0 2,-0.1 0, 0.0 -2,-0.1 -0.985 26.2-105.0-132.3 144.5 5.1 -18.6 79.4 273 274 A V + 0 0 79 -2,-0.4 2,-0.3 -103,-0.1 -103,-0.2 -0.454 46.6 170.3 -67.1 136.3 7.9 -20.8 80.4 274 275 A V E -m 170 0D 62 -105,-0.6 -103,-1.7 -2,-0.1 2,-0.3 -0.848 24.2-128.1-138.2 172.3 8.2 -24.0 78.4 275 276 A R E -m 171 0D 125 -2,-0.3 2,-0.3 -105,-0.2 -103,-0.2 -0.912 15.2-163.6-125.5 155.0 10.7 -26.9 78.0 276 277 A H E -m 172 0D 36 -105,-1.8 -103,-2.6 -2,-0.3 -34,-0.0 -0.959 18.8-155.9-134.3 154.6 12.5 -28.4 75.0 277 278 A D S S+ 0 0 80 -2,-0.3 -102,-0.3 -105,-0.2 -105,-0.1 0.459 83.8 48.1-106.7 -7.3 14.3 -31.7 74.5 278 279 A S - 0 0 69 -104,-0.1 -37,-0.1 1,-0.1 -1,-0.1 -0.989 64.6-149.1-134.0 143.5 16.4 -30.4 71.5 279 280 A P S S+ 0 0 48 0, 0.0 -38,-1.5 0, 0.0 -37,-0.4 0.687 82.3 45.3 -85.2 -16.6 18.4 -27.2 71.1 280 281 A S E -R 240 0D 28 -40,-0.3 -40,-0.3 -39,-0.1 3,-0.1 -0.981 53.4-159.5-135.1 142.4 17.8 -26.9 67.3 281 282 A M E S- 0 0 87 -42,-2.8 2,-0.3 -2,-0.4 -41,-0.1 0.855 86.4 -14.7 -75.5 -47.4 14.9 -27.2 64.8 282 283 A W E S+R 239 0D 133 -43,-1.0 -43,-2.1 3,-0.0 -1,-0.3 -0.971 111.8 9.2-153.5 160.1 17.2 -27.8 61.9 283 284 A G E +R 238 0D 44 -2,-0.3 -45,-0.4 -45,-0.3 -46,-0.1 -0.245 55.0 124.2 69.5-149.9 20.9 -27.5 61.0 284 285 A H - 0 0 23 -47,-1.3 2,-0.4 -48,-0.3 -46,-0.1 0.902 43.0-179.6 57.1 43.0 23.6 -26.7 63.5 285 286 A K - 0 0 156 -48,-0.3 -49,-2.3 1,-0.1 2,-0.2 -0.616 31.6-115.7 -76.1 124.5 25.5 -29.9 62.5 286 287 A S B Q 235 0D 110 -2,-0.4 -51,-0.3 -51,-0.2 -1,-0.1 -0.492 360.0 360.0 -66.1 128.4 28.6 -30.1 64.7 287 288 A V 0 0 108 -53,-2.7 -52,-0.2 -2,-0.2 -1,-0.1 0.231 360.0 360.0-127.1 360.0 31.8 -29.8 62.6