==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 02-DEC-11 3UWR . COMPND 2 MOLECULE: CARVEOL DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM AVIUM; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 1103 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41617.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 782 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 140 12.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 56 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 128 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 389 35.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 2.2 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 4 0 3 1 4 12 0 0 4 0 4 0 0 0 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 4 8 8 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 10 A T 0 0 182 0, 0.0 28,-0.0 0, 0.0 29,-0.0 0.000 360.0 360.0 360.0 137.4 24.4 -4.7 191.8 2 11 A G > - 0 0 27 1,-0.1 3,-1.5 2,-0.1 27,-0.1 -0.113 360.0-130.5 -64.7 145.4 23.3 -2.1 189.3 3 12 A R T 3 S+ 0 0 91 1,-0.3 255,-0.7 254,-0.1 256,-0.2 0.661 112.4 29.3 -69.4 -16.8 23.8 -2.4 185.5 4 13 A V T > S+ 0 0 0 25,-2.5 3,-1.8 22,-0.2 -1,-0.3 -0.108 87.9 163.2-127.8 37.5 25.3 1.1 185.4 5 14 A A T < + 0 0 46 -3,-1.5 26,-0.2 1,-0.2 25,-0.1 -0.237 66.9 13.6 -56.7 139.1 26.7 1.2 188.9 6 15 A G T 3 S+ 0 0 52 24,-0.9 -1,-0.2 1,-0.2 2,-0.1 0.391 102.2 118.6 77.9 -4.4 29.3 4.0 189.5 7 16 A K < - 0 0 35 -3,-1.8 25,-2.3 90,-0.0 2,-0.4 -0.475 55.1-140.3 -92.0 165.3 28.4 5.8 186.3 8 17 A V E -a 32 0A 3 23,-0.2 89,-2.5 -2,-0.1 90,-2.2 -0.994 15.8-160.4-123.2 133.0 27.1 9.3 185.7 9 18 A A E -ab 33 98A 0 23,-2.9 25,-3.1 -2,-0.4 2,-0.6 -0.941 7.7-154.7-118.1 131.1 24.4 10.0 182.9 10 19 A F E -ab 34 99A 0 88,-3.1 90,-3.1 -2,-0.4 2,-0.5 -0.927 19.8-175.1-102.4 121.7 23.6 13.3 181.3 11 20 A I E > -ab 35 100A 0 23,-3.0 25,-2.0 -2,-0.6 3,-0.5 -0.967 13.4-151.6-126.0 121.3 20.1 13.4 179.9 12 21 A S E 3 S+a 36 0A 1 88,-2.2 90,-0.4 -2,-0.5 25,-0.2 -0.622 82.1 24.2 -87.9 150.7 18.4 16.1 177.9 13 22 A G T > S+ 0 0 8 23,-1.1 3,-0.6 -2,-0.2 6,-0.5 0.862 76.6 150.2 66.8 37.3 14.6 16.7 178.1 14 23 A A T < + 0 0 0 22,-2.3 23,-0.2 -3,-0.5 -1,-0.1 0.351 37.5 95.1 -87.2 7.9 14.5 15.0 181.5 15 24 A A T 3 S- 0 0 0 21,-0.2 43,-0.3 1,-0.1 2,-0.3 0.823 100.5 -29.2 -69.5 -29.2 11.5 16.9 182.9 16 25 A R S X> S+ 0 0 49 -3,-0.6 4,-1.5 41,-0.1 3,-0.8 -0.920 104.9 35.8-165.5-177.5 8.9 14.3 182.0 17 26 A G H 3> S- 0 0 27 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 -0.144 119.3 -10.2 60.6-142.4 8.1 11.5 179.5 18 27 A Q H 3> S+ 0 0 30 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.862 136.1 55.5 -61.3 -37.8 11.0 9.4 178.1 19 28 A G H <> S+ 0 0 0 -3,-0.8 4,-2.3 -6,-0.5 -5,-0.2 0.933 110.1 44.4 -63.6 -46.8 13.7 11.6 179.5 20 29 A R H X S+ 0 0 59 -4,-1.5 4,-2.7 -7,-0.4 5,-0.2 0.940 113.2 52.7 -59.3 -45.2 12.3 11.3 183.1 21 30 A S H X S+ 0 0 29 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.895 108.6 49.7 -60.7 -38.5 11.9 7.6 182.5 22 31 A H H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.3 0.924 110.7 50.4 -65.2 -43.5 15.5 7.3 181.4 23 32 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.938 114.4 43.3 -57.4 -49.5 16.7 9.2 184.5 24 33 A V H X S+ 0 0 28 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.922 115.2 48.8 -65.1 -44.1 14.7 7.0 186.8 25 34 A R H X S+ 0 0 50 -4,-2.6 4,-1.1 -5,-0.2 -2,-0.2 0.907 113.8 44.6 -65.9 -42.6 15.7 3.8 185.1 26 35 A L H <>S+ 0 0 1 -4,-2.8 5,-2.4 -5,-0.2 -1,-0.2 0.884 113.4 52.1 -71.8 -34.0 19.4 4.6 185.0 27 36 A A H ><5S+ 0 0 3 -4,-2.2 3,-2.1 -5,-0.3 -2,-0.2 0.924 104.2 56.1 -64.1 -44.3 19.2 5.7 188.6 28 37 A Q H 3<5S+ 0 0 100 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.830 108.6 49.8 -52.6 -34.1 17.5 2.4 189.6 29 38 A E T 3<5S- 0 0 33 -4,-1.1 -25,-2.5 -5,-0.2 -1,-0.3 0.218 131.6 -88.7 -98.7 12.7 20.6 0.7 188.0 30 39 A G T < 5S+ 0 0 12 -3,-2.1 -24,-0.9 1,-0.3 2,-0.2 0.351 79.8 131.2 112.5 -4.6 23.1 2.8 189.9 31 40 A A < - 0 0 0 -5,-2.4 -1,-0.3 -26,-0.2 -23,-0.2 -0.589 48.9-134.7 -87.9 142.3 23.9 5.9 187.9 32 41 A D E -a 8 0A 23 -25,-2.3 -23,-2.9 -2,-0.2 2,-0.4 -0.602 32.5-131.0 -83.3 159.7 23.9 9.5 189.2 33 42 A I E -ac 9 69A 0 35,-2.5 37,-2.9 -2,-0.2 2,-0.6 -0.912 26.3-166.4-127.5 135.1 22.2 11.9 186.9 34 43 A I E -ac 10 70A 2 -25,-3.1 -23,-3.0 -2,-0.4 2,-0.5 -0.979 30.1-174.6-109.5 114.4 22.6 15.3 185.2 35 44 A A E +ac 11 71A 0 35,-3.3 37,-1.6 -2,-0.6 2,-0.3 -0.944 8.1 175.6-120.6 119.9 19.2 16.2 184.0 36 45 A I E +ac 12 72A 1 -25,-2.0 -22,-2.3 -2,-0.5 -23,-1.1 -0.902 5.1 161.4-121.3 153.9 18.3 19.3 181.9 37 46 A D E - c 0 73A 14 35,-1.6 37,-1.3 -2,-0.3 38,-0.1 -0.962 45.4-122.1-162.6 151.2 15.1 20.6 180.3 38 47 A I - 0 0 49 -2,-0.3 37,-0.1 35,-0.2 -1,-0.1 0.829 35.6-163.2 -67.2 -30.2 13.8 23.9 179.0 39 48 A C + 0 0 8 1,-0.2 14,-0.1 12,-0.2 -1,-0.1 0.841 57.0 71.3 50.9 38.6 10.9 23.7 181.4 40 49 A G S S- 0 0 11 11,-0.2 10,-0.5 12,-0.1 -1,-0.2 -0.951 88.6 -47.7-165.9-179.3 9.0 26.3 179.5 41 50 A P - 0 0 98 0, 0.0 2,-0.4 0, 0.0 -1,-0.0 -0.144 38.4-160.9 -64.7 154.0 7.0 27.2 176.3 42 51 A I > - 0 0 29 3,-0.0 3,-1.8 0, 0.0 7,-0.0 -0.997 32.9 -97.5-134.8 134.5 8.1 26.4 172.8 43 52 A E T 3 S- 0 0 129 -2,-0.4 79,-0.0 1,-0.3 0, 0.0 -0.237 103.2 -0.7 -52.6 132.8 6.8 28.2 169.7 44 53 A N T 3 S+ 0 0 79 1,-0.2 64,-0.9 63,-0.1 -1,-0.3 0.671 84.5 170.4 62.7 18.0 4.0 26.3 167.9 45 54 A L B < -G 107 0B 32 -3,-1.8 -1,-0.2 62,-0.2 62,-0.2 -0.450 29.8-145.9 -63.9 132.5 4.1 23.4 170.3 46 55 A A S S+ 0 0 34 60,-1.2 165,-0.5 -2,-0.2 166,-0.3 0.231 75.2 22.5 -86.6 14.3 1.2 21.1 169.6 47 56 A Y S S- 0 0 25 59,-0.1 159,-0.1 164,-0.1 162,-0.1 -0.942 106.2 -50.1-167.6 171.5 0.6 20.1 173.3 48 57 A P - 0 0 88 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 -0.339 55.8-131.9 -63.6 141.2 1.3 21.3 176.8 49 58 A H - 0 0 74 1,-0.1 2,-0.1 -4,-0.1 0, 0.0 -0.364 27.3 -94.7 -84.7 167.8 4.9 22.3 177.5 50 59 A S - 0 0 10 -10,-0.5 -1,-0.1 -2,-0.1 -34,-0.0 -0.362 36.2-146.3 -81.9 164.7 7.0 21.1 180.5 51 60 A T > - 0 0 42 -36,-0.1 4,-1.4 -2,-0.1 3,-0.4 -0.822 28.9-108.5-126.9 164.0 7.4 23.1 183.8 52 61 A P H > S+ 0 0 50 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.851 120.9 59.1 -59.2 -33.4 10.0 23.6 186.4 53 62 A E H > S+ 0 0 133 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.864 98.9 57.2 -63.4 -37.4 7.8 21.5 188.7 54 63 A D H > S+ 0 0 45 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.942 109.6 44.4 -55.3 -48.7 8.1 18.6 186.2 55 64 A L H X S+ 0 0 5 -4,-1.4 4,-2.5 1,-0.2 -2,-0.2 0.889 109.8 54.7 -69.4 -37.9 11.9 18.6 186.5 56 65 A A H X S+ 0 0 50 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.859 107.3 52.3 -61.0 -34.2 11.8 18.9 190.2 57 66 A E H X S+ 0 0 81 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.911 106.4 51.9 -69.1 -40.1 9.6 15.8 190.3 58 67 A T H X S+ 0 0 0 -4,-1.9 4,-2.1 -43,-0.3 -2,-0.2 0.944 109.8 50.9 -58.4 -44.0 12.2 13.9 188.2 59 68 A A H X S+ 0 0 8 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.932 109.0 50.3 -59.4 -46.9 14.8 15.0 190.8 60 69 A D H X S+ 0 0 74 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.897 109.0 51.7 -57.9 -42.9 12.6 13.7 193.7 61 70 A L H < S+ 0 0 55 -4,-2.4 4,-0.5 2,-0.2 -1,-0.2 0.892 112.8 45.4 -63.3 -38.7 12.1 10.3 192.0 62 71 A V H ><>S+ 0 0 0 -4,-2.1 5,-1.3 -5,-0.2 3,-1.3 0.927 112.1 49.9 -73.0 -43.6 15.9 10.0 191.5 63 72 A K H ><5S+ 0 0 116 -4,-3.0 3,-2.5 1,-0.3 -2,-0.2 0.867 101.2 64.8 -61.4 -35.2 16.7 11.1 195.0 64 73 A D T 3<5S+ 0 0 131 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.767 98.0 55.6 -56.3 -24.4 14.1 8.6 196.3 65 74 A L T < 5S- 0 0 69 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.268 121.7-111.2 -92.7 12.0 16.4 5.9 194.8 66 75 A D T < 5S+ 0 0 147 -3,-2.5 2,-0.3 1,-0.2 -3,-0.2 0.828 77.0 130.5 62.2 34.2 19.3 7.3 197.0 67 76 A R < - 0 0 80 -5,-1.3 2,-0.3 -36,-0.0 -1,-0.2 -0.810 59.6-113.1-112.7 157.3 21.1 8.6 193.9 68 77 A R - 0 0 134 -2,-0.3 -35,-2.5 -3,-0.1 2,-0.4 -0.673 33.1-175.6 -87.2 144.8 22.5 12.1 193.2 69 78 A I E -c 33 0A 26 -2,-0.3 2,-0.5 -37,-0.2 -35,-0.2 -0.992 15.8-161.2-142.4 134.0 21.0 14.3 190.6 70 79 A V E -c 34 0A 18 -37,-2.9 -35,-3.3 -2,-0.4 2,-0.3 -0.958 18.6-167.6-106.0 129.9 22.0 17.8 189.3 71 80 A T E +c 35 0A 63 -2,-0.5 2,-0.3 -37,-0.2 -35,-0.2 -0.858 9.5 177.4-114.6 154.0 19.2 19.6 187.4 72 81 A A E -c 36 0A 27 -37,-1.6 -35,-1.6 -2,-0.3 2,-0.8 -0.964 28.6-133.2-151.6 139.9 19.2 22.7 185.2 73 82 A Q E +c 37 0A 126 -2,-0.3 2,-0.3 -37,-0.2 -35,-0.2 -0.834 52.6 140.3 -88.4 108.6 16.6 24.7 183.3 74 83 A V - 0 0 14 -37,-1.3 2,-0.5 -2,-0.8 -35,-0.1 -0.995 51.2-124.5-154.7 144.2 18.3 25.2 179.9 75 84 A D > - 0 0 39 -2,-0.3 3,-2.3 -37,-0.1 7,-0.3 -0.821 18.3-139.7 -90.3 126.2 17.4 25.2 176.2 76 85 A V T 3 S+ 0 0 9 -2,-0.5 -1,-0.1 1,-0.3 57,-0.1 0.662 101.1 69.3 -61.1 -15.3 19.5 22.8 174.1 77 86 A R T 3 S+ 0 0 72 1,-0.2 2,-1.0 56,-0.1 -1,-0.3 0.710 86.3 73.0 -72.8 -19.1 19.5 25.6 171.4 78 87 A D <> - 0 0 85 -3,-2.3 4,-2.5 1,-0.2 5,-0.2 -0.767 64.9-177.3 -98.6 90.6 21.7 27.7 173.7 79 88 A F H > S+ 0 0 25 -2,-1.0 4,-3.5 1,-0.2 5,-0.3 0.885 77.9 50.2 -57.8 -44.8 25.1 25.9 173.5 80 89 A E H > S+ 0 0 131 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.888 113.4 45.1 -67.1 -39.6 27.0 28.1 176.0 81 90 A A H > S+ 0 0 38 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.900 115.5 49.0 -66.2 -39.8 24.3 27.8 178.7 82 91 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 -7,-0.3 -2,-0.2 0.949 111.8 47.5 -64.7 -49.4 24.1 24.0 178.0 83 92 A K H X S+ 0 0 79 -4,-3.5 4,-2.9 1,-0.2 5,-0.2 0.908 111.7 51.7 -58.0 -42.2 27.8 23.6 178.2 84 93 A S H X S+ 0 0 74 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.933 110.3 47.9 -63.2 -44.6 27.9 25.6 181.4 85 94 A A H X S+ 0 0 14 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.919 114.5 46.6 -59.5 -45.5 25.2 23.5 183.0 86 95 A V H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 5,-0.3 0.932 110.7 51.2 -65.1 -44.5 27.0 20.3 182.0 87 96 A D H X S+ 0 0 46 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.909 111.7 48.5 -59.5 -42.5 30.4 21.4 183.2 88 97 A S H X S+ 0 0 55 -4,-2.1 4,-1.6 -5,-0.2 -1,-0.2 0.904 111.6 49.3 -65.2 -43.2 28.9 22.4 186.6 89 98 A G H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.916 111.6 47.8 -62.5 -43.7 27.1 19.0 186.8 90 99 A V H X S+ 0 0 15 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.842 107.4 58.0 -66.5 -31.7 30.3 17.1 186.0 91 100 A E H < S+ 0 0 163 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.888 112.8 39.4 -62.1 -40.5 32.2 19.2 188.6 92 101 A Q H < S+ 0 0 103 -4,-1.6 -2,-0.2 1,-0.1 -1,-0.2 0.885 122.1 40.0 -76.9 -41.8 29.7 18.0 191.3 93 102 A L H < S- 0 0 18 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.652 99.8-130.9 -90.3 -16.8 29.4 14.4 190.2 94 103 A G S < S+ 0 0 58 -4,-2.3 2,-0.3 -5,-0.2 -4,-0.1 0.219 70.8 19.4 96.4 -13.7 33.0 13.8 189.3 95 104 A R - 0 0 62 -6,-0.2 2,-0.3 -5,-0.0 47,-0.1 -0.975 59.7-133.0-169.9 171.2 32.7 12.2 185.9 96 105 A L + 0 0 3 45,-0.5 49,-0.2 -2,-0.3 -87,-0.2 -0.951 29.7 153.6-144.8 127.8 30.5 11.6 182.8 97 106 A D + 0 0 6 -89,-2.5 53,-2.5 -2,-0.3 2,-0.4 0.664 62.2 43.2-120.8 -32.5 30.0 8.2 181.2 98 107 A I E -bd 9 150A 2 -90,-2.2 -88,-3.1 51,-0.2 2,-0.4 -0.955 53.8-170.9-130.3 135.3 26.6 8.2 179.5 99 108 A I E -bd 10 151A 0 51,-1.9 53,-3.4 -2,-0.4 2,-0.6 -0.993 0.9-171.9-127.2 127.3 24.8 10.8 177.3 100 109 A V E -bd 11 152A 0 -90,-3.1 -88,-2.2 -2,-0.4 2,-1.6 -0.933 8.3-161.6-120.3 106.9 21.2 10.5 176.3 101 110 A A E + d 0 153A 0 51,-2.7 53,-2.2 -2,-0.6 -90,-0.1 -0.628 39.6 138.9 -89.6 81.8 20.2 13.2 173.7 102 111 A N + 0 0 19 -2,-1.6 -1,-0.2 -90,-0.4 -89,-0.2 0.698 21.9 114.1-102.7 -26.8 16.5 12.8 174.3 103 112 A A + 0 0 20 -3,-0.3 2,-0.3 27,-0.1 -90,-0.1 -0.219 42.1 132.8 -54.5 135.8 15.0 16.4 174.2 104 113 A G - 0 0 26 -91,-0.1 2,-0.3 26,-0.0 19,-0.0 -0.978 37.3-138.9-173.8 168.9 12.8 17.0 171.3 105 114 A V - 0 0 3 -2,-0.3 2,-0.4 18,-0.1 22,-0.1 -0.914 8.2-145.2-134.9 157.2 9.4 18.4 170.0 106 115 A G + 0 0 18 -2,-0.3 -60,-1.2 -59,-0.0 2,-0.3 -0.999 33.7 171.0-114.4 128.8 6.6 17.6 167.6 107 116 A T B -G 45 0B 13 -2,-0.4 62,-0.2 -62,-0.2 -62,-0.2 -0.939 38.8 -18.0-130.7 160.4 5.1 20.7 166.0 108 117 A D - 0 0 65 -64,-0.9 58,-0.0 -2,-0.3 -2,-0.0 -0.157 53.3-141.1 62.9-128.3 2.7 21.7 163.2 109 118 A G + 0 0 40 1,-0.1 2,-0.3 2,-0.1 57,-0.2 0.521 39.9 139.6 117.4 77.0 1.8 19.1 160.6 110 119 A R - 0 0 117 55,-0.2 57,-0.5 6,-0.0 5,-0.1 -0.910 63.3 -73.8-133.4 164.0 1.5 20.5 157.0 111 120 A K >> - 0 0 76 -2,-0.3 3,-2.8 1,-0.1 4,-0.8 -0.340 53.4-114.5 -53.5 140.7 2.5 19.3 153.6 112 121 A L G >4 S+ 0 0 0 1,-0.3 3,-0.7 2,-0.2 -1,-0.1 0.828 114.7 52.4 -59.8 -36.3 6.2 19.8 153.4 113 122 A H G 34 S+ 0 0 27 1,-0.2 -1,-0.3 300,-0.1 -2,-0.1 0.524 111.7 49.7 -76.7 -0.7 6.2 22.4 150.7 114 123 A K G <4 S+ 0 0 118 -3,-2.8 -1,-0.2 2,-0.1 -2,-0.2 0.477 79.1 116.6-111.5 -7.0 3.7 24.4 152.8 115 124 A I S << S- 0 0 0 -4,-0.8 2,-0.1 -3,-0.7 -7,-0.0 -0.400 70.3-115.5 -64.6 135.9 5.6 24.4 156.1 116 125 A R > - 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0 0 15 17,-0.2 3,-2.0 42,-0.2 44,-0.2 -0.950 32.1 -91.1-176.1 166.2 26.3 12.1 149.1 435 166 B V G >> S+ 0 0 3 42,-2.1 3,-2.2 -2,-0.3 4,-2.1 0.870 128.5 65.9 -56.2 -34.3 27.9 8.8 150.2 436 167 B G G 34 S+ 0 0 2 41,-0.3 -1,-0.3 1,-0.3 16,-0.3 0.503 85.1 70.6 -66.9 -3.1 28.0 10.9 153.4 437 168 B G G <4 S+ 0 0 4 -3,-2.0 -1,-0.3 14,-0.2 -2,-0.2 0.514 112.6 27.0 -86.3 -6.8 24.2 10.7 153.4 438 169 B R T <4 S+ 0 0 132 -3,-2.2 2,-0.3 1,-0.4 -2,-0.2 0.564 129.6 22.0-128.2 -24.1 24.4 7.0 154.3 439 170 B K S < S- 0 0 44 -4,-2.1 -1,-0.4 -5,-0.1 2,-0.3 -0.979 72.4-117.9-142.6 164.9 27.7 6.6 156.1 440 171 B A - 0 0 12 -2,-0.3 -3,-0.1 -259,-0.1 5,-0.1 -0.727 13.8-168.1-103.5 146.5 30.2 8.8 158.0 441 172 B Y > - 0 0 46 -2,-0.3 3,-1.0 -5,-0.1 7,-0.1 -0.955 42.4 -93.2-119.1 147.5 33.8 9.7 157.4 442 173 B P T 3 S+ 0 0 62 0, 0.0 -53,-0.1 0, 0.0 -259,-0.1 -0.239 103.3 19.0 -60.8 147.4 35.8 11.4 160.2 443 174 B N T 3 S+ 0 0 56 -261,-0.1 -55,-0.2 1,-0.1 -54,-0.1 0.644 105.0 81.7 71.4 21.1 36.0 15.2 160.4 444 175 B T <> + 0 0 47 -3,-1.0 4,-2.6 -57,-0.2 3,-0.4 0.018 47.9 132.9-136.0 27.7 33.0 15.9 158.1 445 176 B G H > + 0 0 0 -57,-0.5 4,-2.5 1,-0.3 5,-0.1 0.762 69.9 51.6 -61.6 -33.1 30.2 15.5 160.7 446 177 B H H > S+ 0 0 2 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.921 113.6 46.2 -69.2 -41.9 28.2 18.6 159.9 447 178 B Y H > S+ 0 0 48 -3,-0.4 4,-2.9 2,-0.2 -2,-0.2 0.916 111.9 51.8 -60.5 -45.3 28.2 17.6 156.2 448 179 B I H X S+ 0 0 1 -4,-2.6 4,-2.2 2,-0.2 5,-0.2 0.938 110.2 48.8 -59.1 -48.3 27.2 14.0 157.2 449 180 B A H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.935 113.8 45.7 -57.5 -48.3 24.3 15.3 159.3 450 181 B A H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.926 112.5 50.1 -63.4 -43.8 23.1 17.6 156.5 451 182 B K H X S+ 0 0 8 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.812 109.5 50.7 -68.6 -31.1 23.4 14.9 153.8 452 183 B H H X S+ 0 0 7 -4,-2.2 4,-1.8 -16,-0.3 3,-0.3 0.887 107.1 55.5 -67.8 -39.6 21.5 12.4 155.9 453 184 B G H X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.882 101.9 57.9 -58.2 -37.3 18.8 15.1 156.4 454 185 B V H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.880 101.9 53.0 -63.8 -37.6 18.6 15.3 152.5 455 186 B I H X S+ 0 0 8 -4,-1.1 4,-2.2 -3,-0.3 -1,-0.2 0.915 108.3 52.8 -62.0 -41.0 17.7 11.6 152.3 456 187 B G H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.920 107.9 49.6 -57.0 -47.4 15.0 12.4 154.8 457 188 B L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.3 0.862 108.2 54.3 -58.5 -40.0 13.7 15.2 152.6 458 189 B M H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.945 111.2 44.5 -63.1 -43.8 13.7 12.8 149.6 459 190 B R H X S+ 0 0 50 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.914 114.6 47.8 -68.9 -40.9 11.5 10.3 151.5 460 191 B A H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.960 115.4 44.4 -64.4 -51.9 9.1 12.8 152.8 461 192 B F H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.3 0.896 111.7 54.7 -58.3 -39.5 8.6 14.5 149.5 462 193 B A H X S+ 0 0 9 -4,-2.3 4,-1.8 -5,-0.3 -1,-0.2 0.926 110.7 44.8 -62.7 -44.2 8.3 11.2 147.8 463 194 B V H < S+ 0 0 64 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.890 118.8 41.9 -66.1 -41.1 5.5 10.1 150.0 464 195 B E H < S+ 0 0 10 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.841 121.8 38.2 -77.3 -33.7 3.6 13.4 149.8 465 196 B L H ><>S+ 0 0 3 -4,-2.8 3,-2.0 -5,-0.2 5,-1.5 0.666 92.9 86.2 -95.2 -20.0 4.1 14.0 146.1 466 197 B G G ><5S+ 0 0 28 -4,-1.8 3,-2.9 -5,-0.3 -1,-0.2 0.880 81.2 61.1 -44.7 -50.0 3.7 10.4 144.9 467 198 B P G 3 5S+ 0 0 108 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.702 103.8 52.2 -58.8 -16.5 -0.1 10.6 144.7 468 199 B H G < 5S- 0 0 111 -3,-2.0 -2,-0.2 2,-0.2 -42,-0.2 0.132 122.1-108.2 -99.7 17.8 0.4 13.4 142.1 469 200 B M T < 5S+ 0 0 119 -3,-2.9 -42,-1.8 1,-0.2 2,-0.6 0.823 74.8 140.4 59.7 31.1 2.7 11.2 140.0 470 201 B I E < -m 427 0D 2 -5,-1.5 2,-0.3 -44,-0.3 -1,-0.2 -0.942 40.9-150.4-105.1 120.0 5.7 13.3 141.1 471 202 B R E -m 428 0D 25 -44,-2.7 -42,-3.0 -2,-0.6 2,-0.4 -0.629 9.5-165.8 -90.6 143.4 8.8 11.1 141.7 472 203 B V E +m 429 0D 0 -2,-0.3 71,-3.2 -44,-0.2 72,-0.3 -0.986 18.2 155.4-133.3 126.1 11.4 12.1 144.2 473 204 B N E -m 430 0D 0 -44,-2.4 -42,-2.4 -2,-0.4 2,-0.4 -0.883 28.2-134.5-140.6 167.8 14.8 10.4 144.4 474 205 B A E -mn 431 545D 0 70,-2.9 72,-3.4 -2,-0.3 2,-0.4 -0.960 6.1-146.3-126.6 147.2 18.3 11.2 145.6 475 206 B V E -mn 432 546D 0 -44,-2.3 -42,-2.6 -2,-0.4 51,-0.0 -0.927 9.8-158.6-107.6 142.8 21.8 10.6 144.0 476 207 B L E - 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0 0 8 -3,-1.8 37,-0.2 -4,-0.2 36,-0.1 -0.668 64.6-151.3-110.2 157.6 67.5 65.0 163.8 1070 246 D T S S+ 0 0 72 35,-2.6 36,-0.2 -2,-0.2 -1,-0.1 0.775 90.1 63.7 -91.7 -36.8 66.8 68.6 164.4 1071 247 D L S S- 0 0 101 34,-2.3 2,-2.5 2,-0.1 -2,-0.1 -0.720 101.7-110.8 -82.3 141.8 67.5 68.4 168.2 1072 248 D P S S+ 0 0 104 0, 0.0 -6,-0.1 0, 0.0 -5,-0.1 -0.344 80.0 108.9 -77.6 67.0 71.1 67.5 168.9 1073 249 D V - 0 0 57 -2,-2.5 -4,-0.1 -7,-0.2 3,-0.1 -0.968 64.1-139.4-135.2 152.4 70.6 63.9 170.2 1074 250 D P S S- 0 0 28 0, 0.0 2,-0.3 0, 0.0 -40,-0.1 0.703 79.5 -16.3 -87.8 -19.8 71.4 60.6 168.5 1075 251 D W - 0 0 57 -42,-0.1 -40,-0.2 -9,-0.1 2,-0.2 -0.957 64.7-112.8-166.4 169.1 68.2 58.8 169.5 1076 252 D V B -f 1035 0L 15 -42,-2.9 -40,-2.3 -2,-0.3 2,-0.2 -0.645 33.1-113.6-106.0 172.0 65.3 58.9 171.9 1077 253 D D >> - 0 0 75 -42,-0.2 3,-1.3 -2,-0.2 4,-1.2 -0.695 23.6-111.6-104.7 161.2 64.5 56.5 174.8 1078 254 D A H 3> S+ 0 0 19 1,-0.3 4,-2.7 -2,-0.2 3,-0.3 0.886 118.2 63.2 -54.5 -38.2 61.7 54.0 175.2 1079 255 D S H 3> S+ 0 0 60 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.833 97.5 56.8 -58.2 -32.1 60.5 56.3 178.1 1080 256 D D H <> S+ 0 0 68 -3,-1.3 4,-1.5 2,-0.2 -1,-0.3 0.917 109.1 44.7 -66.5 -40.8 60.0 59.1 175.5 1081 257 D I H X S+ 0 0 0 -4,-1.2 4,-2.5 -3,-0.3 -2,-0.2 0.935 111.7 53.6 -67.7 -40.8 57.7 56.9 173.5 1082 258 D S H X S+ 0 0 2 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.867 104.7 54.7 -62.3 -36.7 55.8 55.7 176.6 1083 259 D N H X S+ 0 0 71 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.920 109.8 46.7 -63.2 -40.0 55.2 59.3 177.7 1084 260 D A H X S+ 0 0 12 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.924 113.2 49.3 -66.4 -41.6 53.5 60.0 174.3 1085 261 D V H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.897 109.0 52.6 -64.0 -41.8 51.5 56.8 174.6 1086 262 D L H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.931 108.5 50.3 -59.9 -47.1 50.4 57.7 178.2 1087 263 D F H < S+ 0 0 78 -4,-2.2 6,-0.2 1,-0.2 3,-0.2 0.950 114.4 44.1 -55.5 -49.1 49.2 61.1 176.9 1088 264 D L H < S+ 0 0 2 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.831 115.0 49.5 -67.3 -31.4 47.2 59.4 174.1 1089 265 D A H < S+ 0 0 1 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.772 101.8 76.8 -77.0 -28.5 45.9 56.7 176.5 1090 266 D S S >< S- 0 0 1 -4,-2.1 3,-2.1 -3,-0.2 -253,-0.1 -0.376 92.9-107.4 -87.5 164.4 44.7 59.0 179.2 1091 267 D D G > S+ 0 0 99 -255,-0.7 3,-1.9 1,-0.3 4,-0.2 0.645 109.3 82.2 -61.1 -16.6 41.6 61.3 179.5 1092 268 D E G 3 S+ 0 0 126 1,-0.3 -1,-0.3 -256,-0.2 3,-0.1 0.638 100.3 37.6 -63.1 -12.7 44.0 64.2 179.0 1093 269 D S G X S+ 0 0 1 -3,-2.1 3,-2.5 -6,-0.2 -1,-0.3 -0.016 77.5 136.2-123.4 30.0 43.7 63.4 175.3 1094 270 D R T < S+ 0 0 146 -3,-1.9 -2,-0.1 1,-0.3 -112,-0.1 0.709 78.1 36.8 -55.9 -27.1 40.0 62.5 175.4 1095 271 D Y T 3 S+ 0 0 166 -4,-0.2 2,-0.6 -3,-0.1 -1,-0.3 0.166 92.3 106.1-111.4 20.0 39.2 64.4 172.2 1096 272 D V < + 0 0 41 -3,-2.5 2,-0.3 -8,-0.1 -3,-0.1 -0.875 42.3 145.1 -99.2 116.9 42.4 63.7 170.3 1097 273 D T + 0 0 65 -2,-0.6 -69,-0.2 -71,-0.1 -71,-0.1 -0.997 49.1 29.4-150.0 151.4 41.9 61.1 167.5 1098 274 D G S S+ 0 0 30 -71,-3.2 2,-0.4 -2,-0.3 -70,-0.2 0.652 82.9 143.3 81.0 17.2 43.3 60.4 164.0 1099 275 D V - 0 0 61 -72,-0.3 -70,-2.8 -86,-0.1 2,-0.8 -0.734 48.2-149.2-101.9 136.7 46.6 61.9 164.8 1100 276 D S E -d 1029 0J 37 -2,-0.4 -70,-0.2 -72,-0.2 -72,-0.0 -0.901 22.7-166.3 -93.6 107.5 50.1 60.9 163.8 1101 277 D L E -d 1030 0J 54 -72,-3.3 -70,-2.5 -2,-0.8 2,-0.3 -0.835 4.5-154.4-103.1 103.3 52.3 61.9 166.7 1102 278 D P E -d 1031 0J 50 0, 0.0 2,-0.4 0, 0.0 3,-0.1 -0.563 16.2-173.7 -72.6 135.7 56.0 61.9 165.9 1103 279 D V E +d 1032 0J 27 -72,-1.8 -70,-1.6 -2,-0.3 -27,-0.1 -0.778 46.5 128.3-117.4 80.7 58.4 61.5 168.8 1104 280 D D S > S- 0 0 21 -2,-0.4 3,-2.0 -72,-0.2 -34,-0.2 0.198 76.2-115.7-134.3 13.2 61.3 62.1 166.4 1105 281 D A T 3 S- 0 0 11 1,-0.3 -35,-2.6 -36,-0.1 -34,-2.3 0.778 84.4 -56.8 49.4 28.4 63.7 64.8 167.7 1106 282 D G T > S+ 0 0 11 -37,-0.2 3,-1.6 -36,-0.2 4,-0.3 0.676 94.8 141.0 80.4 18.9 62.6 66.8 164.6 1107 283 D S G X S+ 0 0 0 -3,-2.0 3,-1.8 1,-0.3 -2,-0.1 0.886 70.4 58.0 -54.8 -43.9 63.5 64.2 161.9 1108 284 D L G 3 S+ 0 0 52 1,-0.3 -1,-0.3 -114,-0.0 -39,-0.1 0.458 92.1 69.9 -74.2 2.3 60.3 65.1 159.9 1109 285 D L G < 0 0 133 -3,-1.6 -1,-0.3 0, 0.0 -2,-0.2 0.583 360.0 360.0 -87.8 -14.4 61.4 68.7 159.7 1110 286 D K < 0 0 162 -3,-1.8 -42,-0.0 -4,-0.3 -40,-0.0 -0.176 360.0 360.0 -66.2 360.0 64.2 67.8 157.3