==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE/RNA/DNA 30-JUL-06 2HVR . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.NANDAKUMAR,C.D.LIMA . 638 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33242.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 445 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 112 17.6 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 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 . 52 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 178 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 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 2 0 3 2 2 3 1 2 0 0 1 0 1 1 1 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 PARALLEL BRIDGES PER LADDER . 5 3 2 4 2 1 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 0 A S 0 0 119 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -73.5 59.4 100.2 70.0 2 1 A M + 0 0 20 43,-0.1 94,-0.1 91,-0.1 92,-0.0 0.654 360.0 126.7 -71.3 -14.1 57.5 97.7 67.9 3 2 A F - 0 0 32 42,-0.1 2,-0.4 1,-0.0 93,-0.0 -0.125 36.7-178.3 -51.6 133.9 55.0 100.5 67.3 4 3 A K - 0 0 73 54,-0.0 54,-0.1 119,-0.0 3,-0.1 -0.979 28.5-121.3-138.8 121.3 54.1 101.3 63.7 5 4 A K - 0 0 116 -2,-0.4 2,-0.1 52,-0.1 52,-0.1 -0.365 40.7-102.9 -60.6 136.6 51.8 104.1 62.7 6 5 A Y - 0 0 15 50,-0.3 -1,-0.1 1,-0.1 35,-0.0 -0.376 41.8 -94.1 -67.1 138.7 48.8 102.8 60.7 7 6 A S - 0 0 14 -2,-0.1 -1,-0.1 1,-0.1 2,-0.1 -0.208 41.1-124.4 -52.3 132.4 48.8 103.3 57.0 8 7 A S - 0 0 57 -3,-0.1 214,-0.4 1,-0.1 2,-0.2 -0.459 25.0-136.5 -79.5 158.1 47.0 106.4 55.9 9 8 A L - 0 0 25 -2,-0.1 2,-0.4 212,-0.1 216,-0.2 -0.745 6.7-121.9-115.0 160.9 44.2 106.1 53.4 10 9 A E E -a 225 0A 44 214,-2.1 216,-2.5 -2,-0.2 2,-0.1 -0.877 28.4-114.3-106.3 133.7 43.1 108.0 50.3 11 10 A N E > -a 226 0A 35 -2,-0.4 3,-1.5 214,-0.2 216,-0.2 -0.365 24.7-121.7 -64.2 136.3 39.7 109.7 49.9 12 11 A H T 3 S+ 0 0 66 214,-1.8 -1,-0.1 1,-0.3 215,-0.1 0.698 109.8 60.5 -52.8 -19.1 37.6 108.1 47.1 13 12 A Y T 3 S+ 0 0 167 1,-0.1 2,-2.0 2,-0.0 -1,-0.3 0.806 71.1 97.6 -83.1 -28.1 37.4 111.5 45.5 14 13 A N <> - 0 0 47 -3,-1.5 4,-1.9 1,-0.2 3,-0.3 -0.392 52.2-179.7 -61.2 85.9 41.1 112.1 44.9 15 14 A S H > S+ 0 0 57 -2,-2.0 4,-3.0 1,-0.2 5,-0.3 0.748 71.1 73.2 -63.2 -24.3 40.9 110.9 41.3 16 15 A K H > S+ 0 0 144 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.984 106.2 35.2 -50.1 -61.8 44.6 111.5 40.9 17 16 A F H > S+ 0 0 4 -3,-0.3 4,-2.5 2,-0.2 5,-0.3 0.921 113.3 57.0 -58.1 -52.1 45.2 108.4 43.0 18 17 A I H X S+ 0 0 23 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.891 111.7 45.7 -48.9 -41.8 42.2 106.4 41.7 19 18 A E H X S+ 0 0 90 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.940 106.2 58.5 -66.7 -48.6 43.7 107.0 38.3 20 19 A K H X S+ 0 0 81 -4,-2.5 4,-2.3 -5,-0.3 6,-0.2 0.930 108.4 46.6 -44.2 -55.7 47.2 106.0 39.5 21 20 A L H <>S+ 0 0 0 -4,-2.5 5,-2.3 1,-0.2 6,-0.5 0.884 108.9 54.2 -56.9 -44.4 45.9 102.6 40.5 22 21 A Y H ><5S+ 0 0 98 -4,-1.7 3,-0.9 -5,-0.3 -1,-0.2 0.914 110.1 47.0 -58.4 -44.2 44.0 102.0 37.3 23 22 A S H 3<5S+ 0 0 98 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.953 112.9 47.2 -62.5 -52.5 47.1 102.6 35.2 24 23 A L T 3<5S- 0 0 113 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.431 113.5-119.1 -71.8 3.0 49.4 100.4 37.3 25 24 A G T X 5S+ 0 0 51 -3,-0.9 3,-1.1 -4,-0.4 -3,-0.2 0.695 70.1 139.0 67.1 20.5 46.6 97.7 37.2 26 25 A L T 3 < + 0 0 45 -5,-2.3 -4,-0.2 1,-0.2 -1,-0.1 0.426 53.3 74.6 -77.1 2.8 46.3 97.8 41.0 27 26 A T T 3 S+ 0 0 13 -6,-0.5 132,-0.6 -5,-0.2 133,-0.3 0.321 79.3 90.4 -98.4 9.3 42.5 97.6 40.8 28 27 A G < + 0 0 45 -3,-1.1 131,-0.0 130,-0.1 -3,-0.0 -0.020 61.4 50.0 -86.4-163.5 42.4 93.9 39.9 29 28 A G S S- 0 0 65 182,-0.1 130,-0.4 129,-0.1 2,-0.4 0.034 102.7 -41.5 61.9-177.2 42.2 90.9 42.3 30 29 A E - 0 0 86 128,-0.1 182,-2.7 126,-0.0 183,-0.5 -0.681 59.7-166.0 -88.8 136.2 39.7 90.6 45.1 31 30 A W E -BC 157 211A 0 126,-3.5 126,-1.6 -2,-0.4 2,-0.4 -0.695 6.0-146.6-114.1 168.3 38.9 93.6 47.3 32 31 A V E -BC 156 210A 0 178,-2.9 178,-2.0 124,-0.2 2,-0.4 -0.998 3.1-158.9-140.2 140.1 37.2 94.1 50.6 33 32 A A E -BC 155 209A 0 122,-2.4 121,-3.6 -2,-0.4 122,-0.8 -0.960 11.5-179.6-120.4 137.5 35.0 96.8 52.1 34 33 A R E -BC 153 208A 7 174,-1.8 174,-2.7 -2,-0.4 119,-0.2 -0.987 39.3 -94.1-134.6 143.5 34.4 97.4 55.8 35 34 A E E - C 0 207A 4 117,-1.9 2,-1.0 -2,-0.4 172,-0.3 -0.287 37.6-129.0 -53.7 133.3 32.3 99.9 57.6 36 35 A K - 0 0 43 170,-3.6 169,-0.8 191,-0.2 170,-0.4 -0.791 28.6-148.2 -86.7 107.2 34.5 102.8 58.6 37 36 A I - 0 0 8 -2,-1.0 2,-1.2 168,-0.1 64,-0.1 -0.565 7.2-131.5 -80.9 140.4 33.7 103.1 62.3 38 37 A H + 0 0 59 -2,-0.3 -1,-0.1 62,-0.1 2,-0.1 -0.679 68.4 93.9 -95.5 87.9 33.8 106.6 63.9 39 38 A G S S- 0 0 4 -2,-1.2 2,-0.3 63,-0.1 63,-0.2 0.047 81.6 -64.7-133.0-117.9 35.9 106.2 67.0 40 39 A T E -E 101 0B 28 61,-1.1 61,-2.5 -2,-0.1 2,-0.1 -0.978 50.0-100.7-148.7 136.6 39.6 106.7 67.7 41 40 A N E +E 100 0B 16 -2,-0.3 15,-0.6 59,-0.2 2,-0.3 -0.398 52.3 167.2 -61.8 130.4 42.5 104.8 66.2 42 41 A F E -EF 99 55B 0 57,-2.1 57,-2.2 13,-0.2 2,-0.3 -0.935 12.8-175.8-141.5 159.9 43.7 102.2 68.7 43 42 A S E -EF 98 54B 0 11,-1.8 11,-2.2 -2,-0.3 2,-0.6 -0.983 22.1-137.7-160.9 149.2 46.1 99.3 68.6 44 43 A L E -EF 97 53B 0 53,-1.9 53,-2.2 -2,-0.3 2,-1.3 -0.947 15.0-153.3-110.1 116.7 47.4 96.5 70.8 45 44 A I E -EF 96 52B 3 7,-3.3 7,-2.2 -2,-0.6 2,-0.9 -0.728 17.6-164.5 -92.6 91.8 51.1 95.8 70.4 46 45 A I E +EF 95 51B 0 49,-2.5 49,-1.8 -2,-1.3 5,-0.2 -0.678 14.2 171.1 -84.9 106.3 51.3 92.1 71.3 47 46 A E E -E 94 0B 25 3,-2.6 47,-0.2 -2,-0.9 40,-0.1 -0.526 45.3-104.9-104.8 174.9 54.8 91.0 72.1 48 47 A R S S+ 0 0 61 45,-0.6 40,-0.1 1,-0.2 -1,-0.1 0.951 118.4 26.0 -67.3 -47.3 56.0 87.7 73.5 49 48 A D S S+ 0 0 138 1,-0.1 2,-0.3 -3,-0.0 -1,-0.2 0.378 130.5 13.1 -98.9 4.7 56.9 89.1 77.0 50 49 A K - 0 0 109 2,-0.0 -3,-2.6 -5,-0.0 2,-0.4 -0.986 57.7-131.7-168.8 164.8 54.5 92.0 77.1 51 50 A V E -F 46 0B 50 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.999 21.7-168.2-129.4 129.4 51.4 93.8 75.6 52 51 A T E -F 45 0B 29 -7,-2.2 -7,-3.3 -2,-0.4 2,-0.2 -0.976 10.7-145.3-122.8 122.0 51.5 97.6 74.8 53 52 A C E -F 44 0B 9 -2,-0.5 7,-2.1 -9,-0.2 2,-0.3 -0.509 22.7-176.6 -82.7 154.8 48.5 99.7 74.0 54 53 A A E -FG 43 59B 0 -11,-2.2 -11,-1.8 5,-0.3 2,-0.1 -0.997 19.4-146.8-152.4 152.9 48.8 102.6 71.5 55 54 A K E > -FG 42 58B 41 3,-2.3 3,-0.5 -2,-0.3 -13,-0.2 -0.317 55.3 -68.4-102.7-169.1 46.9 105.4 69.9 56 55 A R T 3 S+ 0 0 94 -15,-0.6 -50,-0.3 1,-0.2 -14,-0.1 0.779 128.5 31.8 -55.4 -35.5 47.3 106.8 66.4 57 56 A T T 3 S- 0 0 105 1,-0.3 -1,-0.2 -16,-0.1 -52,-0.1 0.532 126.1 -37.1-106.7 -4.9 50.7 108.4 66.8 58 57 A G E < S-G 55 0B 9 -3,-0.5 -3,-2.3 -54,-0.1 -1,-0.3 -0.963 81.7 -41.0 168.5 179.4 52.5 106.2 69.3 59 58 A P E -G 54 0B 48 0, 0.0 2,-0.7 0, 0.0 -5,-0.3 -0.174 59.1-111.1 -62.0 160.3 52.2 104.0 72.5 60 59 A I - 0 0 14 -7,-2.1 -7,-0.2 4,-0.1 6,-0.1 -0.869 36.5-123.0 -97.4 117.3 50.1 105.3 75.3 61 60 A L - 0 0 115 -2,-0.7 3,-0.4 1,-0.1 -1,-0.0 -0.206 20.6-109.8 -61.6 149.5 52.3 106.2 78.2 62 61 A P S S+ 0 0 132 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.731 120.5 41.2 -48.3 -29.5 51.8 104.5 81.7 63 62 A A S S+ 0 0 100 2,-0.1 -2,-0.0 0, 0.0 -3,-0.0 0.784 94.2 102.3 -91.4 -32.2 50.5 107.8 83.1 64 63 A E - 0 0 64 -3,-0.4 2,-0.5 1,-0.1 -4,-0.1 -0.135 61.2-145.2 -56.7 143.5 48.4 108.9 80.1 65 64 A D - 0 0 123 3,-0.0 2,-0.3 4,-0.0 -4,-0.1 -0.954 16.5-176.7-111.9 131.0 44.6 108.5 80.1 66 65 A F > - 0 0 22 -2,-0.5 3,-1.6 -6,-0.1 -6,-0.0 -0.707 63.3 -60.5-136.0 83.6 43.1 107.6 76.8 67 66 A F T 3 S- 0 0 98 -2,-0.3 39,-0.1 1,-0.3 -2,-0.0 0.628 98.2 -63.6 54.6 19.5 39.3 107.4 76.7 68 67 A G T > S+ 0 0 23 1,-0.1 3,-2.0 2,-0.1 -1,-0.3 0.806 80.4 162.6 77.3 30.6 39.2 104.6 79.3 69 68 A Y T X> + 0 0 25 -3,-1.6 3,-3.0 1,-0.3 4,-1.1 0.689 56.2 84.8 -54.9 -25.0 41.1 102.2 77.0 70 69 A E H 3> S+ 0 0 84 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.787 78.2 69.4 -51.3 -27.3 42.0 100.0 80.0 71 70 A I H <> S+ 0 0 65 -3,-2.0 4,-1.8 1,-0.2 -1,-0.3 0.693 97.1 50.4 -65.4 -20.2 38.6 98.4 79.5 72 71 A I H <> S+ 0 0 1 -3,-3.0 4,-1.2 2,-0.2 -1,-0.2 0.828 108.3 51.3 -86.8 -32.8 39.8 96.8 76.2 73 72 A L H < S+ 0 0 52 -4,-1.1 3,-0.3 2,-0.2 4,-0.3 0.939 115.9 42.3 -65.5 -46.6 42.9 95.4 77.9 74 73 A K H >< S+ 0 0 160 -4,-2.4 3,-1.1 1,-0.2 4,-0.3 0.955 115.8 48.6 -63.2 -53.1 40.7 93.9 80.6 75 74 A N H 3< S+ 0 0 99 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.610 121.2 34.2 -66.3 -16.5 38.0 92.7 78.2 76 75 A Y T 3X S+ 0 0 22 -4,-1.2 4,-2.9 -3,-0.3 5,-0.3 0.168 79.1 117.7-124.0 17.6 40.4 91.1 75.7 77 76 A A H <> S+ 0 0 43 -3,-1.1 4,-1.9 -4,-0.3 5,-0.1 0.862 79.5 48.9 -51.0 -40.8 43.0 89.9 78.3 78 77 A D H > S+ 0 0 122 -4,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.908 110.7 49.5 -71.0 -38.2 42.3 86.3 77.3 79 78 A S H > S+ 0 0 11 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.971 111.4 48.5 -62.3 -51.3 42.6 87.0 73.5 80 79 A I H X S+ 0 0 6 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.881 112.3 50.3 -53.8 -41.4 45.9 88.8 74.0 81 80 A K H X S+ 0 0 110 -4,-1.9 4,-2.6 -5,-0.3 -1,-0.2 0.962 107.0 54.4 -62.7 -50.3 47.1 85.9 76.1 82 81 A A H X S+ 0 0 34 -4,-2.9 4,-0.7 1,-0.2 -2,-0.2 0.849 108.1 49.2 -52.2 -40.0 46.0 83.5 73.4 83 82 A V H >X S+ 0 0 0 -4,-2.1 4,-1.3 1,-0.2 3,-1.1 0.937 111.3 48.6 -67.5 -46.1 48.1 85.4 70.8 84 83 A Q H 3X S+ 0 0 39 -4,-2.1 4,-1.1 1,-0.3 -2,-0.2 0.853 104.0 62.4 -61.5 -34.5 51.2 85.3 73.1 85 84 A D H 3< S+ 0 0 109 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.764 111.8 36.3 -63.6 -24.9 50.7 81.6 73.7 86 85 A I H X>S+ 0 0 0 -4,-1.3 3,-1.2 1,-0.2 5,-0.8 0.867 78.9 81.2 -67.7 -38.8 53.9 83.5 69.2 88 87 A E H 3<5S+ 0 0 112 -4,-1.1 -1,-0.2 1,-0.3 3,-0.2 0.790 109.3 20.2 -31.6 -50.9 56.5 81.5 71.2 89 88 A T H 345S+ 0 0 131 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.2 0.406 107.0 77.8-107.8 -2.5 57.1 79.2 68.3 90 89 A S H <<5S- 0 0 50 -3,-1.2 -2,-0.1 -4,-0.6 -1,-0.1 0.298 94.7-121.6 -95.3 15.2 55.9 81.0 65.2 91 90 A A T <5 + 0 0 37 -4,-0.5 36,-1.2 1,-0.2 2,-0.6 0.847 67.2 138.0 52.9 33.8 58.9 83.3 64.8 92 91 A V E < - H 0 126B 9 -5,-0.8 34,-0.3 34,-0.2 -1,-0.2 -0.965 37.4-168.0-110.4 116.4 56.6 86.3 65.1 93 92 A V E - 0 0 6 32,-2.0 -45,-0.6 -2,-0.6 2,-0.3 0.798 69.2 -11.1 -75.9 -27.5 58.2 88.9 67.2 94 93 A S E -EH 47 125B 1 31,-1.8 31,-2.5 -47,-0.2 2,-0.5 -0.959 48.1-147.6-170.3 150.8 55.0 90.9 67.4 95 94 A Y E -EH 46 124B 32 -49,-1.8 -49,-2.5 -2,-0.3 2,-0.9 -0.996 14.1-159.9-121.3 119.1 51.5 91.5 66.1 96 95 A Q E -EH 45 123B 3 27,-2.8 27,-1.9 -2,-0.5 2,-0.6 -0.850 14.8-156.4-102.1 97.3 50.3 95.1 66.1 97 96 A V E -EH 44 122B 0 -53,-2.2 -53,-1.9 -2,-0.9 2,-0.3 -0.656 7.7-159.2 -78.8 114.8 46.6 94.7 66.0 98 97 A F E +EH 43 121B 1 23,-3.1 22,-2.3 -2,-0.6 23,-1.6 -0.730 27.2 129.4 -96.8 142.9 44.9 97.8 64.5 99 98 A G E -EH 42 119B 0 -57,-2.2 -57,-2.1 -2,-0.3 2,-0.5 -0.978 54.5 -77.2-173.2 177.8 41.2 98.6 65.1 100 99 A E E -EH 41 118B 25 18,-2.5 18,-2.2 -2,-0.3 2,-0.8 -0.829 28.3-150.0-100.5 125.1 38.7 101.3 66.1 101 100 A F E +EH 40 117B 0 -61,-2.5 -61,-1.1 -2,-0.5 2,-0.3 -0.819 33.7 173.3 -89.6 112.7 38.2 102.0 69.8 102 101 A A E + H 0 116B 0 14,-2.4 14,-2.4 -2,-0.8 -63,-0.1 -0.917 13.4 93.4-128.2 154.7 34.5 103.1 69.9 103 102 A G >> - 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0 0 0 -5,-1.0 -1,-0.2 -6,-0.1 -30,-0.1 -0.800 44.8-115.6-105.0 151.1 38.6 89.8 68.5 149 148 A K E -i 118 0B 23 -32,-0.6 -30,-2.2 -2,-0.3 2,-0.3 -0.423 32.6-144.2 -78.7 162.5 35.7 91.8 67.0 150 149 A M E -i 119 0B 2 -32,-0.3 -30,-0.2 -2,-0.1 -51,-0.1 -0.898 25.3 -97.1-127.7 159.8 36.1 93.1 63.5 151 150 A A - 0 0 3 -32,-2.8 -115,-0.0 -2,-0.3 -33,-0.0 -0.675 69.7 -91.2 -73.4 111.3 35.1 96.2 61.6 152 151 A P - 0 0 2 0, 0.0 -117,-1.9 0, 0.0 2,-0.3 0.137 38.8-117.5 -30.4 123.4 31.9 94.7 59.9 153 152 A L E +B 34 0A 6 38,-0.4 40,-2.3 -119,-0.2 -119,-0.2 -0.481 30.4 178.2 -69.0 125.3 32.4 93.1 56.5 154 153 A L E - 0 0 8 -121,-3.6 -120,-0.2 1,-0.3 2,-0.2 0.438 61.7 -50.7-106.4 -3.8 30.5 94.8 53.7 155 154 A G E -B 33 0A 7 -122,-0.8 -122,-2.4 36,-0.1 2,-0.5 -0.509 34.4-130.1 143.4 149.1 31.8 92.6 50.9 156 155 A R E +B 32 0A 73 -124,-0.2 2,-0.3 -2,-0.2 -124,-0.2 -0.985 59.7 90.7-126.4 116.4 34.6 90.9 49.1 157 156 A G E S-B 31 0A 24 -126,-1.6 -126,-3.5 -2,-0.5 2,-0.1 -0.907 72.4 -22.2-173.2-157.5 34.7 91.2 45.3 158 157 A K >> - 0 0 141 -2,-0.3 4,-1.9 -128,-0.2 3,-1.4 -0.419 54.0-120.7 -75.7 145.7 35.9 93.3 42.4 159 158 A F H 3> S+ 0 0 3 -132,-0.6 4,-2.8 -130,-0.4 5,-0.2 0.913 110.9 56.3 -47.6 -54.8 36.9 96.9 42.8 160 159 A E H 34 S+ 0 0 77 -133,-0.3 -1,-0.3 1,-0.2 -2,-0.0 0.724 110.9 47.4 -54.6 -23.8 34.3 98.3 40.3 161 160 A E H X4 S+ 0 0 120 -3,-1.4 3,-1.7 2,-0.1 4,-0.5 0.959 114.7 39.8 -81.4 -60.3 31.6 96.6 42.3 162 161 A L H >< S+ 0 0 13 -4,-1.9 3,-1.2 1,-0.3 -2,-0.2 0.841 101.2 70.5 -59.5 -37.2 32.4 97.6 45.9 163 162 A I T 3< S+ 0 0 54 -4,-2.8 -1,-0.3 -5,-0.3 -3,-0.1 0.626 95.2 61.1 -60.0 -5.7 33.4 101.2 45.0 164 163 A K T < S+ 0 0 150 -3,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.842 72.0 116.1 -88.5 -35.6 29.6 101.6 44.3 165 164 A L S < S- 0 0 40 -3,-1.2 2,-0.2 -4,-0.5 42,-0.1 0.035 81.0 -98.6 -35.8 132.1 28.4 100.8 47.9 166 165 A P > - 0 0 47 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 -0.385 23.8-151.1 -61.6 125.6 26.7 103.9 49.3 167 166 A N T 3 S+ 0 0 39 1,-0.3 62,-0.7 -2,-0.2 -2,-0.1 0.546 96.3 59.0 -75.7 -5.0 29.0 105.8 51.6 168 167 A D T 3 S+ 0 0 50 60,-0.1 -1,-0.3 27,-0.1 3,-0.1 -0.033 79.8 145.5-110.0 28.4 26.0 107.0 53.5 169 168 A L < - 0 0 0 -3,-1.2 35,-2.5 1,-0.1 28,-0.3 -0.152 58.6 -95.2 -61.5 158.8 24.9 103.5 54.4 170 169 A D B -K 203 0C 10 26,-3.2 26,-0.3 33,-0.2 33,-0.2 -0.578 47.1-100.5 -76.4 140.7 23.3 102.8 57.7 171 170 A S - 0 0 2 31,-2.5 -1,-0.1 -2,-0.2 30,-0.1 -0.217 31.1-168.2 -55.0 152.3 25.7 101.6 60.4 172 171 A V > + 0 0 11 2,-0.1 4,-3.0 -3,-0.1 5,-0.2 0.206 58.5 106.2-125.9 8.5 25.6 97.8 60.8 173 172 A V H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.880 78.7 49.5 -59.6 -39.1 27.6 97.7 63.9 174 173 A Q H > S+ 0 0 64 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.864 111.6 49.8 -69.2 -33.2 24.6 97.0 66.1 175 174 A D H > S+ 0 0 77 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.954 111.9 49.4 -65.5 -46.7 23.5 94.2 63.8 176 175 A Y H X S+ 0 0 1 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.946 112.2 46.4 -55.2 -54.0 27.1 92.9 64.0 177 176 A N H X S+ 0 0 21 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.804 108.6 57.0 -61.9 -29.6 27.2 93.1 67.8 178 177 A F H < S+ 0 0 135 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.928 107.9 46.3 -68.2 -42.6 23.8 91.4 68.0 179 178 A T H ><>S+ 0 0 35 -4,-2.2 5,-2.7 1,-0.2 3,-1.6 0.892 110.0 54.7 -65.3 -38.3 25.0 88.4 66.0 180 179 A V H 3<5S+ 0 0 25 -4,-2.2 5,-0.3 1,-0.3 -1,-0.2 0.960 106.9 50.9 -58.9 -48.6 28.1 88.2 68.2 181 180 A D T 3<5S+ 0 0 113 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.344 127.7 18.7 -73.5 9.1 26.0 88.1 71.3 182 181 A H T < 5S+ 0 0 124 -3,-1.6 -3,-0.2 -5,-0.1 -2,-0.1 0.344 131.9 25.1-136.8 -83.9 23.9 85.2 69.9 183 182 A A T 5S- 0 0 66 -4,-0.2 -3,-0.2 1,-0.2 2,-0.1 0.862 114.2-103.1 -58.3 -37.9 25.1 83.1 67.0 184 183 A G >< - 0 0 21 -5,-2.7 4,-2.3 1,-0.1 5,-0.2 -0.429 25.2 -77.4 129.3 157.5 28.7 83.8 67.9 185 184 A L H > S+ 0 0 28 -5,-0.3 4,-2.6 1,-0.2 5,-0.2 0.893 121.9 54.5 -54.6 -45.1 31.7 85.9 66.9 186 185 A V H > S+ 0 0 70 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.916 109.9 43.5 -59.0 -48.1 32.6 83.6 64.0 187 186 A D H >> S+ 0 0 69 1,-0.2 4,-1.7 2,-0.2 3,-0.9 0.909 114.5 53.2 -64.4 -39.9 29.3 83.8 62.2 188 187 A A H 3< S+ 0 0 1 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.878 107.1 51.9 -61.8 -37.5 29.3 87.5 62.9 189 188 A N H 3< S+ 0 0 4 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.639 113.7 42.9 -77.0 -10.9 32.7 87.8 61.3 190 189 A K H << S+ 0 0 111 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 0.620 86.4 107.0-107.7 -15.4 31.7 86.0 58.2 191 190 A C < - 0 0 42 -4,-1.7 2,-0.8 -5,-0.2 -38,-0.4 -0.356 64.8-139.7 -63.7 141.2 28.3 87.7 57.7 192 191 A V - 0 0 85 -38,-0.1 -38,-0.2 -40,-0.1 -1,-0.1 -0.893 24.1-145.1-105.7 102.8 28.3 90.2 54.8 193 192 A W - 0 0 25 -40,-2.3 2,-0.1 -2,-0.8 -21,-0.1 -0.333 16.5-103.3 -74.9 149.2 26.3 93.1 56.0 194 193 A N - 0 0 121 -2,-0.1 2,-0.6 1,-0.1 -1,-0.1 -0.414 23.8-152.3 -68.8 140.9 24.0 95.3 53.8 195 194 A A + 0 0 11 -41,-0.1 2,-0.3 -2,-0.1 -27,-0.1 -0.860 43.0 130.4-116.4 92.0 25.3 98.7 52.8 196 195 A E - 0 0 89 -2,-0.6 -26,-3.2 -26,-0.3 2,-1.0 -0.991 59.0-127.5-144.6 153.0 22.2 100.9 52.3 197 196 A A + 0 0 55 -2,-0.3 -28,-0.1 -28,-0.3 6,-0.1 -0.508 49.7 143.2 -99.6 67.9 21.0 104.3 53.4 198 197 A K - 0 0 125 -2,-1.0 -1,-0.2 1,-0.1 -29,-0.1 0.456 59.1-130.7 -83.5 -0.0 17.5 103.3 54.8 199 198 A G S S+ 0 0 63 -3,-0.2 -2,-0.1 2,-0.1 4,-0.1 0.668 70.6 129.1 59.6 11.7 17.7 105.9 57.5 200 199 A E S S+ 0 0 146 2,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.835 78.6 0.5 -65.1 -38.3 16.7 103.0 59.8 201 200 A V S S- 0 0 56 1,-0.1 -2,-0.1 -30,-0.1 3,-0.1 -0.874 109.3 -49.2-141.4 173.8 19.5 103.7 62.2 202 201 A F - 0 0 48 -2,-0.3 -31,-2.5 -32,-0.1 2,-0.3 -0.053 64.8-100.6 -51.3 148.9 22.3 106.2 62.4 203 202 A T B -K 170 0C 45 -33,-0.2 -33,-0.2 -94,-0.1 -1,-0.1 -0.551 34.1-123.3 -76.4 127.7 24.4 106.8 59.3 204 203 A A - 0 0 0 -35,-2.5 25,-0.2 -2,-0.3 -167,-0.1 -0.192 20.4-117.5 -63.9 159.9 27.8 105.2 59.2 205 204 A E - 0 0 33 -169,-0.8 24,-1.0 1,-0.3 2,-0.3 0.698 68.5 -93.7 -73.2 -16.8 30.8 107.4 58.7 206 205 A G E - D 0 228A 0 -170,-0.4 -170,-3.6 22,-0.2 -1,-0.3 -0.941 45.7 -80.0 137.3-157.6 31.4 105.5 55.5 207 206 A Y E -CD 35 227A 4 20,-1.7 20,-2.9 -172,-0.3 2,-0.4 -0.931 25.6-124.0-141.1 165.3 33.5 102.4 54.5 208 207 A V E -CD 34 226A 23 -174,-2.7 -174,-1.8 -2,-0.3 2,-0.5 -0.943 20.1-159.4-114.9 134.9 37.0 101.5 53.7 209 208 A L E +CD 33 225A 0 16,-2.7 16,-3.7 -2,-0.4 -176,-0.2 -0.955 24.5 145.9-117.5 127.7 38.0 99.8 50.5 210 209 A K E -C 32 0A 9 -178,-2.0 -178,-2.9 -2,-0.5 14,-0.2 -0.982 50.9 -86.2-155.3 161.6 41.2 97.9 50.0 211 210 A P E -C 31 0A 12 0, 0.0 -180,-0.3 0, 0.0 -75,-0.2 -0.429 33.7-130.3 -69.0 146.6 42.8 94.9 48.3 212 211 A C S S+ 0 0 1 -182,-2.7 -76,-2.6 1,-0.2 -75,-0.3 0.842 105.1 50.2 -65.1 -32.5 42.4 91.6 50.3 213 212 A Y S S- 0 0 123 -183,-0.5 -1,-0.2 -78,-0.2 -78,-0.1 -0.914 108.5-111.0-110.4 105.4 46.1 91.1 49.7 214 213 A P - 0 0 33 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.081 39.1-175.3 -34.2 130.7 47.9 94.3 50.7 215 214 A S - 0 0 24 8,-0.3 8,-2.3 -4,-0.1 2,-0.2 -0.963 1.6-167.1-133.2 150.6 49.5 96.2 47.8 216 215 A W B -L 222 0D 103 -2,-0.3 6,-0.2 6,-0.2 2,-0.2 -0.790 17.0-115.6-132.3 174.3 51.7 99.3 47.9 217 216 A L > - 0 0 18 4,-1.8 3,-1.1 -2,-0.2 6,-0.0 -0.598 33.4-107.8-105.4 169.4 53.1 102.0 45.7 218 217 A R T 3 S+ 0 0 259 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.964 123.0 51.8 -59.4 -48.6 56.7 102.8 44.8 219 218 A N T 3 S- 0 0 103 1,-0.1 -1,-0.3 -3,-0.0 0, 0.0 0.523 123.8-105.8 -66.1 -6.8 56.5 105.8 47.0 220 219 A G < + 0 0 43 -3,-1.1 -1,-0.1 1,-0.3 -2,-0.1 0.234 69.6 144.9 102.5 -16.6 55.2 103.8 49.9 221 220 A N - 0 0 53 -5,-0.1 -4,-1.8 1,-0.1 2,-0.3 -0.268 49.9-120.5 -56.9 141.6 51.5 104.8 49.8 222 221 A R B -L 216 0D 9 -214,-0.4 2,-1.3 -6,-0.2 -6,-0.2 -0.656 17.4-120.9 -87.6 140.4 49.1 102.0 50.7 223 222 A V S S+ 0 0 0 -8,-2.3 -8,-0.3 -2,-0.3 2,-0.3 -0.677 70.3 112.9 -82.2 98.4 46.5 100.9 48.2 224 223 A A - 0 0 0 -2,-1.3 -214,-2.1 -14,-0.2 2,-0.3 -0.875 48.4-149.7-168.6 133.5 43.4 101.6 50.2 225 224 A I E -aD 10 209A 0 -16,-3.7 -16,-2.7 -2,-0.3 2,-0.5 -0.769 3.2-149.6-111.5 153.9 40.5 104.0 49.8 226 225 A K E -aD 11 208A 47 -216,-2.5 -214,-1.8 -2,-0.3 2,-0.8 -0.979 5.6-164.9-125.1 120.4 38.2 105.7 52.3 227 226 A C E + D 0 207A 0 -20,-2.9 -20,-1.7 -2,-0.5 2,-0.5 -0.844 17.1 173.1-106.3 97.0 34.7 106.6 51.4 228 227 A K E - D 0 206A 79 -2,-0.8 -22,-0.2 -22,-0.2 -60,-0.1 -0.882 27.5-133.5-106.9 133.1 33.3 109.0 53.9 229 228 A N - 0 0 25 -24,-1.0 -61,-0.0 -62,-0.7 -2,-0.0 -0.451 13.0-140.6 -75.8 158.3 29.9 110.7 53.5 230 229 A S + 0 0 121 -2,-0.1 -1,-0.1 2,-0.0 -62,-0.0 0.847 67.8 102.4 -91.0 -37.2 30.0 114.5 54.2 231 230 A K 0 0 119 1,-0.2 -2,-0.1 0, 0.0 0, 0.0 -0.267 360.0 360.0 -54.2 123.5 26.7 115.0 56.0 232 231 A F 0 0 120 -2,-0.0 -1,-0.2 0, 0.0 -29,-0.0 0.613 360.0 360.0-108.2 360.0 27.3 115.3 59.8 233 ! 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 0.0 234 246 A E 0 0 172 0, 0.0 66,-0.1 0, 0.0 -219,-0.0 0.000 360.0 360.0 360.0 -0.2 41.1 116.9 36.5 235 247 A L - 0 0 113 1,-0.1 2,-0.2 4,-0.0 4,-0.1 -0.080 360.0-152.4 -60.8 164.9 41.2 116.2 32.8 236 248 A S - 0 0 23 1,-0.1 -1,-0.1 2,-0.1 61,-0.0 -0.771 18.0-129.3-131.2 175.9 40.9 112.7 31.4 237 249 A E S S+ 0 0 171 -2,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.870 101.9 32.0 -94.4 -49.8 42.1 110.9 28.3 238 250 A A S > S+ 0 0 54 1,-0.1 3,-2.6 2,-0.1 4,-0.2 0.973 122.5 41.5 -68.0 -84.8 38.9 109.3 27.1 239 251 A D T >> S+ 0 0 8 1,-0.3 3,-2.2 2,-0.2 4,-0.5 0.730 99.4 74.0 -31.9 -43.7 36.1 111.6 28.2 240 252 A N H 3> S+ 0 0 58 1,-0.3 4,-0.9 2,-0.2 -1,-0.3 0.522 81.6 76.9 -56.4 -1.9 38.1 114.7 27.1 241 253 A K H <> S+ 0 0 135 -3,-2.6 4,-1.5 2,-0.2 -1,-0.3 0.891 83.0 62.8 -74.4 -42.0 37.2 113.5 23.6 242 254 A L H X> S+ 0 0 35 -3,-2.2 4,-2.4 1,-0.2 3,-1.5 0.940 95.3 58.1 -45.5 -62.8 33.7 114.9 24.0 243 255 A V H 3X S+ 0 0 28 -4,-0.5 4,-4.0 1,-0.3 5,-0.3 0.859 101.5 55.0 -35.5 -57.7 34.9 118.5 24.4 244 256 A G H 3< S+ 0 0 42 -4,-0.9 4,-0.4 1,-0.2 -1,-0.3 0.889 113.0 44.2 -45.8 -43.9 36.6 118.3 21.0 245 257 A I H X< S+ 0 0 80 -3,-1.5 3,-1.5 -4,-1.5 4,-0.3 0.946 115.0 46.3 -66.6 -50.6 33.2 117.3 19.6 246 258 A L H >< S+ 0 0 12 -4,-2.4 3,-2.3 1,-0.3 4,-0.4 0.837 101.5 65.3 -62.6 -34.1 31.3 119.9 21.6 247 259 A A G >< S+ 0 0 31 -4,-4.0 3,-0.7 -5,-0.3 -1,-0.3 0.749 92.2 68.2 -59.0 -20.1 33.8 122.6 20.6 248 260 A C G < S+ 0 0 85 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.717 99.3 46.5 -71.0 -24.3 32.4 121.8 17.2 249 261 A Y G < S+ 0 0 41 -3,-2.3 2,-1.1 -4,-0.3 -1,-0.2 0.407 88.8 96.2 -99.1 0.7 29.1 123.3 18.1 250 262 A V < + 0 0 18 -3,-0.7 2,-0.3 -4,-0.4 -1,-0.1 -0.729 52.4 131.1 -95.4 92.3 30.6 126.4 19.7 251 263 A T > - 0 0 61 -2,-1.1 4,-1.6 1,-0.1 3,-0.3 -0.919 66.7-115.6-135.5 164.3 30.5 129.1 17.0 252 264 A L H > S+ 0 0 76 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.926 111.7 64.6 -64.8 -42.8 29.3 132.7 16.7 253 265 A N H > S+ 0 0 104 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.854 102.7 47.1 -48.0 -43.4 26.7 131.7 14.2 254 266 A R H > S+ 0 0 31 -3,-0.3 4,-2.9 1,-0.2 3,-0.3 0.948 110.5 52.4 -66.5 -45.2 24.9 129.6 16.9 255 267 A V H X S+ 0 0 3 -4,-1.6 4,-2.9 1,-0.2 -2,-0.2 0.887 108.2 52.7 -55.6 -39.1 25.2 132.5 19.3 256 268 A N H X S+ 0 0 75 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.856 110.3 45.8 -66.5 -36.4 23.6 134.7 16.7 257 269 A N H X S+ 0 0 80 -4,-1.7 4,-1.5 -3,-0.3 -2,-0.2 0.890 112.1 52.5 -73.1 -38.0 20.6 132.4 16.2 258 270 A V H >< S+ 0 0 9 -4,-2.9 3,-0.6 1,-0.2 -2,-0.2 0.964 111.1 46.2 -59.2 -52.5 20.3 132.1 20.0 259 271 A I H >< S+ 0 0 21 -4,-2.9 3,-1.3 1,-0.2 -1,-0.2 0.902 103.0 65.5 -55.8 -44.5 20.3 135.9 20.3 260 272 A S H 3< S+ 0 0 89 -4,-2.1 2,-0.8 1,-0.3 -1,-0.2 0.875 94.5 58.4 -46.3 -44.9 17.7 136.1 17.4 261 273 A K T << S+ 0 0 170 -4,-1.5 -1,-0.3 -3,-0.6 2,-0.3 -0.074 110.7 53.3 -80.3 38.0 15.2 134.3 19.6 262 274 A I < - 0 0 49 -3,-1.3 3,-0.1 -2,-0.8 -3,-0.0 -0.884 61.0-158.0-153.4 179.2 15.6 137.2 22.1 263 275 A G + 0 0 58 -2,-0.3 2,-1.6 1,-0.1 -1,-0.1 0.529 64.8 97.1-136.1 -37.0 15.4 140.9 22.1 264 276 A E + 0 0 105 1,-0.1 2,-0.6 4,-0.0 -1,-0.1 -0.418 40.5 167.1 -64.4 88.0 17.4 142.1 25.1 265 277 A I + 0 0 89 -2,-1.6 -1,-0.1 -3,-0.1 5,-0.0 -0.419 29.3 137.0-100.1 55.9 20.7 142.9 23.4 266 278 A G S > S- 0 0 10 -2,-0.6 3,-1.3 1,-0.1 4,-0.2 -0.707 71.2-112.2-105.9 157.8 22.1 144.8 26.4 267 279 A P T 3 S+ 0 0 113 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.641 116.2 64.9 -57.8 -12.7 25.6 144.8 28.1 268 280 A K T 3 S+ 0 0 132 1,-0.2 4,-0.1 2,-0.1 -4,-0.0 -0.105 88.0 68.2-102.4 34.0 23.8 143.2 31.0 269 281 A D <> + 0 0 5 -3,-1.3 4,-3.2 2,-0.1 5,-0.2 0.383 60.7 104.6-130.1 -0.8 22.9 140.0 29.1 270 282 A F H > S+ 0 0 51 -3,-0.5 4,-2.0 1,-0.2 5,-0.4 0.936 87.4 44.3 -46.9 -58.4 26.3 138.4 28.6 271 283 A G H > S+ 0 0 53 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.899 116.6 48.2 -55.4 -41.9 25.7 135.8 31.3 272 284 A K H > S+ 0 0 100 2,-0.2 4,-2.4 3,-0.2 3,-0.3 0.992 110.6 49.3 -59.9 -65.2 22.2 135.2 29.9 273 285 A V H >X S+ 0 0 5 -4,-3.2 4,-3.0 1,-0.3 3,-0.5 0.898 114.9 41.6 -38.5 -67.2 23.1 134.8 26.3 274 286 A M H 3X S+ 0 0 19 -4,-2.0 4,-3.4 1,-0.3 -1,-0.3 0.835 111.1 58.5 -57.3 -32.5 25.9 132.3 26.8 275 287 A G H 3X S+ 0 0 27 -4,-1.5 4,-2.5 -5,-0.4 -1,-0.3 0.922 111.4 42.1 -62.5 -40.0 23.7 130.6 29.3 276 288 A L H S+ 0 0 2 -4,-3.4 5,-0.9 -5,-0.3 4,-0.4 0.859 109.9 46.9 -70.3 -36.7 24.1 117.9 20.8 286 298 A S H ><5S+ 0 0 52 -4,-2.1 3,-0.9 -5,-0.3 -1,-0.2 0.800 103.0 66.1 -73.7 -28.0 22.1 115.3 22.8 287 299 A R H 3<5S+ 0 0 180 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.854 97.3 53.9 -60.4 -35.6 19.7 115.1 19.9 288 300 A E T 3<5S- 0 0 121 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.688 127.1-101.0 -71.9 -20.0 22.4 113.6 17.7 289 301 A G T < 5S+ 0 0 53 -3,-0.9 2,-1.3 -4,-0.4 -3,-0.2 0.021 77.7 140.1 121.2 -25.4 23.0 110.9 20.4 290 302 A I < - 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0 0 169 -3,-0.1 2,-0.3 -4,-0.0 -3,-0.0 -0.713 62.5-177.8-100.9 149.0 56.0 138.9 22.9 584 277 B I - 0 0 36 -2,-0.3 -2,-0.0 56,-0.1 -6,-0.0 -0.912 9.6-156.7-148.9 117.7 59.4 139.0 24.7 585 278 B G > - 0 0 24 -2,-0.3 3,-1.9 1,-0.1 4,-0.1 -0.460 41.1 -97.3 -87.6 163.7 60.5 141.4 27.3 586 279 B P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 54,-0.1 0.277 122.2 50.1 -65.0 17.1 64.2 142.2 28.1 587 280 B K T > S+ 0 0 181 2,-0.1 3,-0.6 1,-0.0 4,-0.3 0.341 71.8 99.6-136.6 5.0 64.0 139.7 30.9 588 281 B D T <> + 0 0 35 -3,-1.9 4,-3.6 1,-0.2 5,-0.2 0.285 45.4 119.5 -79.8 14.9 62.5 136.5 29.5 589 282 B F H 3> S+ 0 0 52 1,-0.3 4,-2.2 2,-0.2 5,-0.3 0.902 81.3 39.5 -42.4 -54.9 66.0 135.1 29.2 590 283 B G H <> S+ 0 0 45 -3,-0.6 4,-2.3 1,-0.2 5,-0.4 0.898 112.5 56.2 -65.2 -41.3 65.0 132.3 31.5 591 284 B K H > S+ 0 0 111 -4,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.947 113.4 42.0 -56.0 -48.5 61.6 131.9 29.9 592 285 B V H X S+ 0 0 0 -4,-3.6 4,-1.0 2,-0.2 3,-0.4 0.997 117.3 41.6 -62.6 -70.0 63.3 131.4 26.5 593 286 B M H >X S+ 0 0 17 -4,-2.2 4,-2.9 1,-0.3 3,-1.8 0.900 114.6 52.2 -46.5 -51.7 66.2 129.1 27.4 594 287 B G H 3X S+ 0 0 31 -4,-2.3 4,-1.7 1,-0.3 -1,-0.3 0.930 110.6 48.3 -51.8 -45.5 64.1 127.0 29.7 595 288 B L H 3< S+ 0 0 64 -4,-1.8 4,-0.5 -5,-0.4 -1,-0.3 0.631 113.0 50.6 -70.6 -11.1 61.5 126.6 26.9 596 289 B T H S+ 0 0 29 -4,-0.5 4,-2.1 -5,-0.2 5,-0.3 0.923 109.5 47.3 -61.6 -39.9 62.1 121.6 23.3 600 293 B I H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.874 109.5 50.6 -68.1 -39.3 65.5 119.9 22.9 601 294 B L H X S+ 0 0 35 -4,-1.9 4,-2.1 3,-0.2 5,-0.5 0.839 110.4 54.3 -67.7 -30.4 64.7 117.1 25.3 602 295 B E H X S+ 0 0 83 -4,-2.3 4,-3.7 2,-0.2 5,-0.2 1.000 115.9 32.7 -63.0 -71.3 61.5 116.6 23.3 603 296 B E H < S+ 0 0 68 -4,-2.1 4,-0.3 1,-0.2 -2,-0.2 0.875 119.4 55.3 -54.3 -41.7 63.0 116.2 19.8 604 297 B T H ><>S+ 0 0 1 -4,-2.5 5,-1.3 -5,-0.3 3,-0.9 0.965 119.3 29.4 -59.1 -56.3 66.1 114.5 21.2 605 298 B S H ><5S+ 0 0 48 -4,-2.1 3,-2.8 1,-0.3 4,-0.4 0.937 112.5 65.7 -68.7 -44.4 64.3 111.7 23.1 606 299 B R T 3<5S+ 0 0 167 -4,-3.7 -1,-0.3 -5,-0.5 -2,-0.2 0.598 102.9 52.8 -52.8 -9.0 61.5 111.8 20.5 607 300 B E T < 5S- 0 0 104 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.2 -0.038 136.8 -80.9-118.0 28.6 64.3 110.6 18.2 608 301 B G T < 5S+ 0 0 71 -3,-2.8 2,-0.5 1,-0.1 -3,-0.2 0.632 100.4 113.4 85.1 13.5 65.5 107.7 20.2 609 302 B I < + 0 0 38 -5,-1.3 2,-0.2 -4,-0.4 -3,-0.2 -0.641 43.2 177.9-117.9 73.1 67.7 109.6 22.6 610 303 B T - 0 0 64 -2,-0.5 3,-0.1 -5,-0.2 -9,-0.0 -0.516 27.2-144.2 -75.9 142.4 65.9 109.1 26.0 611 304 B L S S+ 0 0 30 -2,-0.2 -1,-0.1 1,-0.2 -2,-0.0 -0.052 75.5 101.0 -97.7 31.1 67.6 110.7 29.0 612 305 B T + 0 0 119 4,-0.0 -1,-0.2 5,-0.0 2,-0.1 -0.237 61.3 114.0-105.7 41.4 66.6 107.9 31.4 613 306 B Q S S- 0 0 87 2,-0.1 -2,-0.1 -3,-0.1 0, 0.0 -0.229 84.2 -79.3-100.0-170.2 70.1 106.3 31.1 614 307 B A S S+ 0 0 98 -2,-0.1 -56,-0.1 2,-0.1 -3,-0.0 0.970 96.0 93.3 -55.0 -65.5 73.0 105.8 33.6 615 308 B D S S- 0 0 23 -58,-0.2 -2,-0.1 1,-0.2 -57,-0.0 0.129 97.2 -89.1 -31.5 140.4 74.5 109.3 33.5 616 309 B N > - 0 0 56 1,-0.2 4,-1.2 -4,-0.0 2,-0.3 -0.439 30.5-137.0 -63.3 117.7 73.1 111.5 36.3 617 310 B P T 4 S+ 0 0 70 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.260 97.5 52.0 -60.0 16.1 70.0 113.3 35.0 618 311 B S T > S+ 0 0 79 -2,-0.3 4,-2.3 3,-0.1 5,-0.3 0.730 101.0 46.3-116.7 -66.3 71.3 116.4 36.7 619 312 B L H > S+ 0 0 66 1,-0.2 4,-1.2 2,-0.2 -4,-0.0 0.715 118.7 50.9 -55.3 -19.4 74.9 117.3 35.8 620 313 B I H X S+ 0 0 1 -4,-1.2 4,-3.1 2,-0.2 3,-0.3 0.958 108.9 44.3 -81.3 -62.4 73.8 116.6 32.2 621 314 B K H > S+ 0 0 99 1,-0.3 4,-2.1 -5,-0.3 -2,-0.2 0.749 116.2 52.6 -54.8 -22.1 70.7 118.8 32.0 622 315 B K H X S+ 0 0 129 -4,-2.3 4,-2.3 2,-0.2 -1,-0.3 0.891 108.5 47.2 -79.9 -41.7 72.9 121.3 33.7 623 316 B E H X S+ 0 0 89 -4,-1.2 4,-1.7 -3,-0.3 -2,-0.2 0.881 114.4 48.3 -64.2 -38.2 75.6 121.0 31.1 624 317 B L H >X S+ 0 0 1 -4,-3.1 4,-2.8 2,-0.2 3,-0.5 0.970 111.6 48.6 -64.7 -53.8 72.9 121.3 28.4 625 318 B V H 3X S+ 0 0 25 -4,-2.1 4,-2.0 1,-0.3 -2,-0.2 0.853 107.6 56.9 -53.1 -38.0 71.4 124.3 30.1 626 319 B K H 3X S+ 0 0 100 -4,-2.3 4,-2.2 2,-0.2 -1,-0.3 0.902 110.1 44.8 -61.7 -40.9 74.9 125.7 30.3 627 320 B M H X S+ 0 0 0 -4,-1.9 3,-1.6 -5,-0.2 4,-1.1 0.928 98.7 63.6 -61.5 -50.8 71.5 132.9 23.9 633 326 B R H >X S+ 0 0 124 -4,-2.0 3,-2.4 1,-0.3 4,-1.0 0.903 94.9 55.8 -41.8 -68.0 73.8 135.6 25.4 634 327 B P H 34 S+ 0 0 105 0, 0.0 -1,-0.3 0, 0.0 4,-0.2 0.730 125.8 26.2 -40.5 -27.5 75.8 136.6 22.2 635 328 B A H <> S+ 0 0 6 -3,-1.6 4,-2.0 -4,-0.5 -2,-0.2 0.349 97.1 90.2-121.0 4.3 72.4 137.4 20.7 636 329 B W H X S+ 0 0 126 -4,-1.0 4,-1.9 1,-0.2 3,-0.7 0.953 115.8 44.7 -60.8 -45.9 71.1 141.8 23.5 638 331 B E H 34 S+ 0 0 150 -5,-0.3 -2,-0.2 1,-0.2 -1,-0.2 0.759 107.6 58.5 -69.0 -28.6 70.1 141.6 19.8 639 332 B L H 3< S+ 0 0 57 -4,-2.0 -1,-0.2 -7,-0.2 -2,-0.2 0.613 119.5 24.5 -81.1 -12.5 67.0 139.6 20.4 640 333 B V H << 0 0 38 -4,-0.9 -2,-0.2 -3,-0.7 -1,-0.1 0.597 360.0 360.0-122.7 -21.5 65.2 142.1 22.7 641 334 B S < 0 0 144 -4,-1.9 -3,-0.2 -5,-0.3 -4,-0.1 0.804 360.0 360.0-110.0 360.0 66.8 145.4 21.8