==== 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 TRANSFERASE 29-AUG-08 3ECD . COMPND 2 MOLECULE: SERINE HYDROXYMETHYLTRANSFERASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA PSEUDOMALLEI; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 1544 16 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 56692.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1083 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 91 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 88 5.7 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 . 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 . 68 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 146 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 611 39.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 28 1.8 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 8 8 0 4 0 0 8 8 4 2 6 0 8 0 1 0 3 0 0 4 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 5 7 0 8 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 . 2 8 4 4 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 ANTIPARALLEL BRIDGES PER LADDER . 4 0 4 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 3 A N 0 0 74 0, 0.0 6,-0.0 0, 0.0 1557,-0.0 0.000 360.0 360.0 360.0 149.1 1.2 32.5 -27.7 2 4 A A + 0 0 100 4,-0.1 3,-0.0 5,-0.0 0, 0.0 0.544 360.0 82.0 -74.0 -14.1 0.8 32.9 -31.5 3 5 A N S >> S- 0 0 56 1,-0.1 4,-2.0 5,-0.0 3,-1.9 -0.877 72.0-146.0-105.6 122.3 2.1 29.5 -32.4 4 6 A P H 3> S+ 0 0 52 0, 0.0 4,-1.9 0, 0.0 1212,-0.1 0.732 98.2 69.2 -62.0 -22.1 -0.3 26.6 -32.1 5 7 A F H 34 S+ 0 0 15 1,-0.2 1211,-2.1 2,-0.2 1212,-0.5 0.873 116.7 24.6 -57.7 -35.6 2.6 24.4 -31.0 6 8 A F H <4 S+ 0 0 1 -3,-1.9 -1,-0.2 1209,-0.2 -4,-0.1 0.732 127.6 45.4-100.4 -28.9 2.5 26.4 -27.8 7 9 A S H < S+ 0 0 59 -4,-2.0 2,-0.3 2,-0.1 -2,-0.2 0.772 94.1 80.1 -95.5 -29.7 -1.0 27.7 -27.6 8 10 A Q < - 0 0 68 -4,-1.9 1209,-0.2 -5,-0.2 1208,-0.1 -0.608 69.3-130.3 -92.9 142.0 -3.2 24.7 -28.4 9 11 A S > - 0 0 30 -2,-0.3 4,-1.6 1207,-0.1 3,-0.4 -0.280 25.8-110.4 -76.9 165.0 -4.2 22.0 -26.1 10 12 A L H > S+ 0 0 3 1206,-0.3 4,-3.0 1,-0.2 8,-0.3 0.912 120.5 59.9 -57.6 -42.5 -4.0 18.2 -26.6 11 13 A A H 4 S+ 0 0 46 1,-0.2 -1,-0.2 2,-0.2 7,-0.1 0.845 111.0 40.1 -56.3 -35.3 -7.8 18.3 -26.7 12 14 A E H 4 S+ 0 0 129 -3,-0.4 -1,-0.2 1,-0.1 -2,-0.2 0.748 124.2 36.9 -85.2 -26.1 -7.6 20.6 -29.7 13 15 A R H < S+ 0 0 81 -4,-1.6 2,-0.4 1,-0.2 -2,-0.2 0.778 118.0 37.1-101.6 -34.5 -4.6 19.0 -31.5 14 16 A D X + 0 0 16 -4,-3.0 4,-2.5 -5,-0.2 5,-0.2 -0.784 54.4 176.5-133.3 88.1 -4.9 15.2 -31.0 15 17 A A H > S+ 0 0 82 -2,-0.4 4,-2.1 1,-0.2 5,-0.2 0.864 81.5 52.0 -62.3 -37.6 -8.4 13.8 -31.1 16 18 A S H > S+ 0 0 58 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.907 113.7 41.4 -71.9 -41.0 -7.4 10.2 -30.7 17 19 A V H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.900 113.6 54.3 -73.6 -35.8 -5.2 10.7 -27.6 18 20 A R H X S+ 0 0 97 -4,-2.5 4,-2.4 -8,-0.3 -2,-0.2 0.894 107.6 51.2 -62.4 -37.9 -7.8 13.1 -26.1 19 21 A G H X S+ 0 0 24 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.883 109.0 50.0 -66.6 -37.1 -10.4 10.4 -26.6 20 22 A A H X S+ 0 0 8 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.889 111.0 49.8 -70.3 -36.7 -8.2 7.8 -24.8 21 23 A I H X S+ 0 0 11 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.908 110.0 50.1 -69.9 -40.4 -7.7 10.3 -22.0 22 24 A L H X S+ 0 0 80 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.882 109.3 51.7 -65.5 -38.0 -11.4 10.9 -21.7 23 25 A K H X S+ 0 0 131 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.901 110.3 49.0 -64.9 -40.7 -12.2 7.2 -21.6 24 26 A E H X S+ 0 0 12 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.898 109.1 52.5 -66.1 -39.8 -9.6 6.8 -18.8 25 27 A L H X S+ 0 0 53 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.906 108.7 50.6 -61.7 -39.9 -11.2 9.6 -16.9 26 28 A E H X S+ 0 0 87 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.860 107.2 54.1 -69.3 -32.5 -14.6 8.0 -17.2 27 29 A R H X S+ 0 0 61 -4,-1.7 4,-1.0 1,-0.2 -1,-0.2 0.931 113.5 41.9 -65.0 -43.9 -13.1 4.7 -15.9 28 30 A Q H < S+ 0 0 17 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.832 116.9 49.5 -73.6 -30.3 -11.8 6.5 -12.9 29 31 A Q H < S+ 0 0 36 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.883 117.6 34.3 -77.8 -37.6 -14.9 8.5 -12.4 30 32 A S H < S+ 0 0 16 -4,-2.5 2,-0.3 -5,-0.1 354,-0.2 0.382 107.1 68.2-111.1 1.1 -17.5 5.8 -12.6 31 33 A Q S < S- 0 0 21 -4,-1.0 2,-0.7 -5,-0.2 280,-0.2 -0.884 77.1-120.7-117.4 154.4 -15.9 2.8 -11.0 32 34 A V E -a 311 0A 1 278,-2.2 280,-2.1 -2,-0.3 2,-0.7 -0.855 25.3-149.7 -92.7 117.0 -14.9 2.1 -7.4 33 35 A E E +a 312 0A 30 -2,-0.7 305,-0.6 278,-0.2 304,-0.2 -0.803 29.2 160.7 -91.6 115.0 -11.1 1.5 -7.2 34 36 A L + 0 0 0 278,-2.6 300,-2.0 -2,-0.7 2,-0.3 0.273 28.7 127.8-116.8 4.7 -10.2 -0.9 -4.3 35 37 A I > - 0 0 28 277,-0.3 3,-1.8 298,-0.2 302,-0.3 -0.526 61.3-137.2 -61.8 123.3 -6.8 -1.9 -5.5 36 38 A A T 3 S+ 0 0 5 -2,-0.3 -1,-0.2 1,-0.3 297,-0.1 0.713 98.1 48.2 -68.4 -19.3 -4.8 -1.1 -2.4 37 39 A S T 3 S+ 0 0 27 167,-0.1 167,-0.5 297,-0.1 -1,-0.3 0.452 93.9 97.6 -98.3 -2.0 -1.9 0.5 -4.2 38 40 A E < + 0 0 15 -3,-1.8 299,-0.4 165,-0.1 2,-0.3 -0.547 45.1 159.5 -89.6 152.3 -4.0 2.7 -6.4 39 41 A N - 0 0 12 -2,-0.2 2,-0.5 297,-0.1 298,-0.1 -0.933 38.0-113.6-155.8-179.4 -4.8 6.3 -5.7 40 42 A I - 0 0 13 -2,-0.3 2,-0.1 296,-0.2 1185,-0.0 -0.969 32.5-141.0-128.9 111.0 -6.0 9.6 -7.3 41 43 A V - 0 0 4 -2,-0.5 167,-0.1 1,-0.1 1187,-0.1 -0.325 22.7-101.3 -78.4 155.0 -3.5 12.4 -7.4 42 44 A S > - 0 0 0 165,-0.5 4,-1.9 1,-0.1 1137,-0.2 -0.214 27.7-112.6 -66.8 159.5 -4.3 16.1 -6.8 43 45 A R H > S+ 0 0 82 1135,-2.2 4,-2.5 1,-0.2 1140,-0.3 0.891 120.3 59.4 -56.9 -37.1 -4.7 18.6 -9.5 44 46 A A H > S+ 0 0 1 1134,-0.4 4,-1.8 1137,-0.3 -1,-0.2 0.894 103.8 48.6 -61.2 -41.3 -1.5 20.2 -8.1 45 47 A V H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.907 110.7 51.3 -68.2 -36.0 0.5 16.9 -8.7 46 48 A L H X S+ 0 0 1 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.902 107.2 53.7 -63.8 -41.7 -0.9 16.8 -12.3 47 49 A D H < S+ 0 0 57 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.883 110.1 47.8 -62.0 -39.0 0.2 20.4 -12.8 48 50 A A H >< S+ 0 0 0 -4,-1.8 3,-1.6 1,-0.2 5,-0.3 0.923 111.1 48.4 -68.5 -44.5 3.7 19.4 -11.7 49 51 A Q H 3< S+ 0 0 4 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.764 114.3 48.3 -67.8 -25.4 3.9 16.4 -13.9 50 52 A G T 3< S+ 0 0 17 -4,-1.8 -1,-0.3 1173,-0.2 1173,-0.2 0.088 92.9 118.0 -99.1 18.5 2.7 18.4 -16.8 51 53 A S S X S- 0 0 11 -3,-1.6 3,-1.3 1171,-0.1 185,-0.1 -0.379 81.4-105.8 -86.4 166.3 5.1 21.3 -16.1 52 54 A V G > S+ 0 0 13 1,-0.3 3,-2.1 2,-0.1 1162,-0.1 0.505 99.9 95.8 -68.0 -3.5 7.9 22.6 -18.3 53 55 A L G 3 + 0 0 2 1,-0.3 182,-0.5 -5,-0.3 -1,-0.3 0.661 66.8 76.4 -64.0 -11.6 10.4 20.9 -16.0 54 56 A T G < S+ 0 0 20 -3,-1.3 2,-1.4 1,-0.2 -1,-0.3 0.755 77.8 75.5 -68.7 -23.6 10.3 18.1 -18.6 55 57 A N S < S+ 0 0 7 -3,-2.1 2,-0.3 -4,-0.1 -1,-0.2 -0.393 84.2 87.4 -89.4 53.8 12.6 20.3 -20.8 56 58 A K S S+ 0 0 34 -2,-1.4 179,-0.2 -3,-0.2 4,-0.1 -0.995 77.6 14.5-153.4 148.1 15.7 19.6 -18.7 57 59 A Y > + 0 0 84 -2,-0.3 3,-1.5 1,-0.1 -1,-0.1 0.870 58.9 161.2 58.6 45.2 18.6 17.2 -18.4 58 60 A A T 3 S+ 0 0 6 1,-0.3 -1,-0.1 174,-0.1 1315,-0.1 0.753 78.4 48.2 -64.3 -23.2 18.0 15.5 -21.7 59 61 A E T 3 0 0 72 1,-0.4 -1,-0.3 0, 0.0 -2,-0.1 0.305 360.0 360.0-101.8 4.0 21.6 14.2 -21.6 60 62 A G < 0 0 55 -3,-1.5 -1,-0.4 173,-0.1 -2,-0.0 -0.631 360.0 360.0 86.9 360.0 21.0 13.1 -18.0 61 ! 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 62 75 A A 0 0 118 0, 0.0 2,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0-151.5 20.9 20.5 -5.8 63 76 A D >> - 0 0 31 1,-0.1 4,-2.7 4,-0.0 3,-0.5 -0.344 360.0-116.5 -64.1 142.5 18.1 21.6 -8.0 64 77 A E H 3> S+ 0 0 71 1,-0.3 4,-2.1 2,-0.2 5,-0.1 0.843 112.8 45.8 -55.1 -45.1 15.4 23.7 -6.3 65 78 A V H 3> S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.846 115.0 49.3 -69.2 -31.1 12.5 21.2 -6.8 66 79 A E H <> S+ 0 0 25 -3,-0.5 4,-2.7 2,-0.2 -2,-0.2 0.893 109.5 50.8 -74.0 -39.5 14.7 18.4 -5.6 67 80 A A H X S+ 0 0 45 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.886 110.7 50.6 -64.3 -36.6 15.9 20.3 -2.6 68 81 A L H X S+ 0 0 27 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.926 110.0 48.9 -66.4 -44.6 12.3 21.0 -1.8 69 82 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 5,-0.3 0.942 113.5 47.6 -60.9 -45.6 11.4 17.4 -2.1 70 83 A I H X S+ 0 0 42 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.930 112.3 47.6 -61.7 -48.5 14.3 16.4 0.1 71 84 A E H X S+ 0 0 82 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.915 115.3 47.6 -58.7 -42.7 13.5 19.0 2.8 72 85 A R H X S+ 0 0 23 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.908 111.6 45.4 -71.2 -45.2 9.9 18.0 2.8 73 86 A V H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 6,-0.3 0.852 111.5 55.1 -71.7 -31.5 10.2 14.2 3.0 74 87 A K H X>S+ 0 0 72 -4,-2.1 5,-1.9 -5,-0.3 4,-0.7 0.929 112.2 42.6 -62.5 -45.5 12.9 14.6 5.8 75 88 A R H <5S+ 0 0 123 -4,-1.9 3,-0.3 -5,-0.2 -2,-0.2 0.883 112.2 55.5 -66.5 -37.1 10.5 16.7 7.8 76 89 A L H <5S+ 0 0 14 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.867 122.4 25.0 -67.3 -37.6 7.6 14.3 7.0 77 90 A F H <5S- 0 0 0 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.248 104.0-118.7-114.6 9.3 9.4 11.2 8.3 78 91 A N T <5 + 0 0 127 -4,-0.7 2,-0.3 -3,-0.3 -3,-0.2 0.907 60.2 158.2 51.1 45.1 11.8 12.9 10.8 79 92 A A < - 0 0 7 -5,-1.9 -1,-0.2 -6,-0.3 138,-0.2 -0.801 45.7-146.9-102.8 142.4 14.7 11.5 8.7 80 93 A G S S+ 0 0 30 -2,-0.3 2,-0.3 1,-0.2 137,-0.2 0.748 84.4 24.4 -78.3 -23.2 18.2 13.0 8.8 81 94 A H E -B 216 0B 56 135,-1.6 135,-1.8 -7,-0.1 2,-0.3 -0.995 63.4-176.9-147.8 146.3 18.8 12.1 5.1 82 95 A A E -B 215 0B 16 -2,-0.3 2,-0.4 133,-0.2 133,-0.2 -0.997 15.5-164.0-146.2 146.8 16.8 11.5 1.9 83 96 A N E +B 214 0B 7 131,-2.2 131,-2.1 -2,-0.3 -2,-0.0 -0.998 9.4 177.4-127.2 123.3 17.3 10.5 -1.7 84 97 A V + 0 0 0 -2,-0.4 128,-0.1 129,-0.2 157,-0.1 0.119 54.5 96.4-115.2 18.6 14.3 11.2 -3.9 85 98 A Q + 0 0 63 126,-0.1 149,-0.2 129,-0.1 -1,-0.1 0.803 45.7 111.7 -83.0 -34.2 15.8 10.1 -7.2 86 99 A P - 0 0 7 0, 0.0 126,-2.5 0, 0.0 3,-0.1 -0.099 57.7-147.0 -50.6 139.6 14.6 6.5 -7.7 87 100 A H S S+ 0 0 84 124,-0.3 2,-0.3 1,-0.1 3,-0.1 0.577 78.8 9.2 -84.3 -10.6 12.2 6.0 -10.5 88 101 A S S > S- 0 0 12 123,-0.2 4,-1.7 1,-0.1 124,-0.3 -0.985 74.4-106.8-161.0 168.4 10.4 3.3 -8.6 89 102 A G H > S+ 0 0 9 -2,-0.3 4,-2.6 122,-0.2 5,-0.2 0.875 120.2 52.0 -66.8 -38.1 10.1 1.5 -5.4 90 103 A A H > S+ 0 0 74 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.862 107.9 51.8 -69.2 -35.2 11.8 -1.5 -6.8 91 104 A Q H > S+ 0 0 104 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.863 110.6 48.7 -69.5 -34.6 14.7 0.7 -7.9 92 105 A A H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.934 113.1 46.7 -69.4 -46.1 15.0 2.1 -4.4 93 106 A N H X S+ 0 0 13 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.896 111.2 53.2 -61.5 -39.4 14.9 -1.4 -2.9 94 107 A G H X S+ 0 0 31 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.895 108.3 48.8 -66.0 -39.1 17.5 -2.5 -5.4 95 108 A A H X S+ 0 0 10 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.886 111.3 49.1 -70.4 -38.8 19.9 0.3 -4.6 96 109 A V H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 5,-0.3 0.870 107.3 55.5 -71.7 -33.6 19.7 -0.3 -0.9 97 110 A M H X S+ 0 0 40 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.870 110.9 45.0 -67.6 -33.1 20.3 -4.0 -1.3 98 111 A L H < S+ 0 0 129 -4,-1.4 -1,-0.2 2,-0.2 -2,-0.2 0.774 112.8 52.6 -80.9 -27.6 23.5 -3.3 -3.2 99 112 A A H < S+ 0 0 26 -4,-1.6 -2,-0.2 -5,-0.1 -1,-0.2 0.961 122.9 25.8 -65.9 -53.0 24.5 -0.7 -0.6 100 113 A L H < S+ 0 0 20 -4,-2.7 2,-0.4 -5,-0.1 -2,-0.2 0.588 116.1 59.0 -95.2 -17.6 24.1 -2.9 2.4 101 114 A A < - 0 0 10 -4,-1.7 6,-0.0 -5,-0.3 3,-0.0 -0.915 64.4-140.8-125.0 146.0 24.6 -6.4 1.0 102 115 A K > - 0 0 48 -2,-0.4 3,-2.4 1,-0.1 41,-0.1 -0.716 41.2 -87.5 -98.3 148.9 27.4 -8.3 -0.7 103 116 A P T 3 S+ 0 0 129 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.335 117.3 26.1 -56.7 134.6 26.9 -10.7 -3.5 104 117 A G T 3 S+ 0 0 62 1,-0.4 11,-0.0 -3,-0.0 -3,-0.0 0.172 92.1 135.2 98.0 -15.4 26.3 -14.2 -2.1 105 118 A D < - 0 0 49 -3,-2.4 10,-3.1 1,-0.1 2,-0.5 -0.267 59.6-116.7 -59.4 150.0 25.0 -12.8 1.1 106 119 A T E -c 115 0B 26 35,-0.3 37,-2.4 8,-0.2 38,-1.0 -0.800 30.1-165.5 -88.6 129.7 21.9 -14.3 2.6 107 120 A V E -cd 116 144B 9 8,-2.4 10,-3.3 -2,-0.5 2,-0.6 -0.983 6.3-154.4-121.7 131.5 19.0 -11.9 2.8 108 121 A L E +cd 117 145B 2 36,-2.6 38,-2.8 -2,-0.4 2,-0.3 -0.927 26.2 161.4-114.3 114.2 16.0 -12.6 5.0 109 122 A G E -cd 118 146B 13 8,-2.6 10,-2.1 -2,-0.6 2,-0.2 -0.869 38.2 -92.5-134.0 160.5 12.7 -10.9 3.9 110 123 A M E +c 119 0B 6 36,-0.7 2,-0.3 -2,-0.3 10,-0.2 -0.484 35.9 173.7 -76.1 139.4 9.0 -11.1 4.3 111 124 A S 0 0 44 8,-2.7 10,-0.2 -2,-0.2 38,-0.0 -0.974 360.0 360.0-141.6 134.5 6.7 -13.0 2.0 112 125 A L 0 0 61 -2,-0.3 208,-0.1 8,-0.1 8,-0.1 0.224 360.0 360.0 -96.6 360.0 3.0 -13.6 2.4 113 ! 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 0.0 114 144 A F 0 0 99 0, 0.0 2,-1.1 0, 0.0 -8,-0.2 0.000 360.0 360.0 360.0 149.6 21.8 -13.0 -3.1 115 145 A N E -c 106 0B 81 -10,-3.1 -8,-2.4 2,-0.0 2,-0.6 -0.835 360.0-153.7 -88.8 95.8 20.6 -16.1 -1.2 116 146 A A E +c 107 0B 80 -2,-1.1 2,-0.3 -10,-0.2 -8,-0.2 -0.664 17.4 179.3 -85.1 116.8 17.0 -14.9 -0.7 117 147 A L E -c 108 0B 41 -10,-3.3 -8,-2.6 -2,-0.6 2,-0.4 -0.864 12.1-145.5-115.4 150.7 15.3 -16.4 2.3 118 148 A Q E -c 109 0B 137 -2,-0.3 2,-0.3 -10,-0.2 -8,-0.2 -0.875 14.2-171.0-121.4 146.4 11.8 -15.8 3.4 119 149 A Y E +c 110 0B 6 -10,-2.1 -8,-2.7 -2,-0.4 2,-0.2 -0.937 17.0 168.0-122.2 154.1 9.8 -15.5 6.6 120 150 A G - 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0 0 5 -2,-0.4 2,-0.4 -10,-0.2 -280,-0.2 -0.853 46.1-101.7-148.3-174.4 -38.4 19.6 33.4 707 348 B N E -T 725 0F 27 18,-1.4 18,-2.6 -2,-0.2 -280,-0.1 -0.972 25.3-123.3-119.2 135.4 -35.7 22.2 33.5 708 349 B K E -T 724 0F 70 -2,-0.4 2,-0.3 16,-0.2 16,-0.3 -0.394 39.2-168.6 -61.1 152.6 -35.9 25.9 33.0 709 350 B N - 0 0 25 14,-2.7 13,-0.2 11,-0.2 2,-0.2 -0.932 22.6-120.5-157.0 126.5 -33.5 26.8 30.3 710 351 B G - 0 0 26 -2,-0.3 3,-0.1 11,-0.2 14,-0.0 -0.438 27.8-139.5 -66.3 134.4 -32.1 30.0 28.8 711 352 B I > - 0 0 8 -2,-0.2 3,-1.6 1,-0.1 12,-0.1 -0.466 41.1 -76.0 -83.4 161.9 -32.9 30.5 25.2 712 353 B P T 3 S+ 0 0 10 0, 0.0 -1,-0.1 0, 0.0 -208,-0.1 -0.430 121.7 5.8 -59.7 140.7 -30.2 32.0 22.9 713 354 B F T 3 S- 0 0 95 1,-0.2 -2,-0.0 -3,-0.1 -209,-0.0 0.829 93.1-171.4 53.9 37.2 -29.8 35.7 23.5 714 355 B D < - 0 0 34 -3,-1.6 -1,-0.2 1,-0.2 -4,-0.1 -0.344 21.8-153.5 -59.6 132.0 -32.3 35.3 26.4 715 356 B P S S+ 0 0 93 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.624 72.2 83.9 -85.3 -11.6 -33.3 38.7 27.8 716 357 B E S S- 0 0 64 1,-0.1 6,-0.2 -5,-0.1 -2,-0.1 -0.599 91.3-101.0 -87.9 150.1 -34.0 37.1 31.2 717 358 B K >> - 0 0 51 -2,-0.2 4,-3.0 4,-0.1 3,-1.7 -0.274 37.3-112.0 -59.7 157.2 -31.5 36.4 33.9 718 359 B P T 34 S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -8,-0.1 0.589 116.9 63.7 -78.1 -7.1 -30.4 32.8 34.0 719 360 B T T 34 S+ 0 0 100 -27,-0.0 -2,-0.1 2,-0.0 -11,-0.0 0.465 121.6 22.7 -87.7 -4.5 -32.1 32.3 37.4 720 361 B I T <4 S+ 0 0 62 -3,-1.7 -27,-2.1 -27,-0.1 3,-0.2 0.669 88.9 174.4-121.4 -64.9 -35.3 33.0 35.5 721 362 B T < - 0 0 4 -4,-3.0 -29,-2.1 -29,-0.2 -28,-0.3 0.301 41.7-111.0 64.0 168.2 -34.9 32.4 31.8 722 363 B S S S+ 0 0 2 -31,-0.3 -37,-2.9 -13,-0.2 -36,-0.5 0.051 87.5 47.2-117.1 17.2 -37.5 32.5 29.0 723 364 B G E -S 684 0F 0 -39,-0.2 -14,-2.7 -3,-0.2 2,-0.3 -0.940 57.7-140.2-152.6 167.5 -37.6 28.8 28.3 724 365 B I E -ST 683 708F 1 -41,-1.3 -41,-3.0 -16,-0.3 2,-0.5 -0.959 19.2-137.2-130.1 153.6 -37.8 25.2 29.3 725 366 B R E -ST 682 707F 40 -18,-2.6 -18,-1.4 -2,-0.3 2,-0.3 -0.958 23.3-176.1-111.9 129.6 -35.9 22.1 28.1 726 367 B L E -S 681 0F 0 -45,-2.7 -45,-2.6 -2,-0.5 2,-0.3 -0.900 5.8-173.8-121.7 151.4 -37.8 18.9 27.5 727 368 B G E -S 680 0F 2 -302,-1.9 4,-0.3 -2,-0.3 3,-0.2 -0.997 20.8-148.2-146.0 147.2 -36.8 15.4 26.4 728 369 B T > + 0 0 0 -49,-1.4 4,-2.1 -2,-0.3 5,-0.2 0.435 69.9 97.4 -90.7 -2.2 -38.6 12.2 25.6 729 370 B P H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -298,-0.2 0.908 86.4 42.6 -59.1 -44.2 -36.2 9.5 26.8 730 371 B A H > S+ 0 0 3 -301,-0.4 4,-1.5 -304,-0.3 6,-0.1 0.924 116.6 46.2 -69.9 -42.7 -37.7 8.7 30.2 731 372 B G H 4>S+ 0 0 1 -307,-0.5 5,-2.2 -4,-0.3 4,-0.3 0.871 112.4 52.2 -68.1 -34.0 -41.3 8.7 29.0 732 373 B T H ><5S+ 0 0 4 -4,-2.1 3,-1.4 1,-0.2 -1,-0.2 0.901 104.2 57.4 -67.6 -37.0 -40.4 6.6 26.1 733 374 B T H 3<5S+ 0 0 7 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.884 102.8 53.0 -64.1 -36.3 -38.7 4.1 28.3 734 375 B R T 3<5S- 0 0 11 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.539 131.4 -92.7 -80.7 -4.0 -41.9 3.5 30.3 735 376 B G T < 5 + 0 0 22 -3,-1.4 -3,-0.2 -4,-0.3 -2,-0.1 0.364 69.7 154.6 115.7 -2.1 -43.7 2.8 27.0 736 377 B F < - 0 0 0 -5,-2.2 -1,-0.3 -6,-0.1 2,-0.1 -0.301 20.1-169.6 -58.1 138.1 -45.1 6.1 25.9 737 378 B G > - 0 0 8 -81,-0.1 4,-2.0 -82,-0.0 5,-0.2 -0.365 44.7 -73.2-110.0-163.3 -45.7 6.5 22.2 738 379 B A H > S+ 0 0 33 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.902 129.5 51.9 -64.5 -41.7 -46.6 9.4 20.0 739 380 B A H > S+ 0 0 59 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.891 109.4 50.6 -62.4 -39.4 -50.2 9.6 21.2 740 381 B E H > S+ 0 0 37 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.908 110.0 48.8 -68.5 -40.4 -49.1 9.6 24.9 741 382 B F H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.835 107.5 55.2 -70.4 -30.7 -46.6 12.5 24.4 742 383 B R H X S+ 0 0 101 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.902 107.8 50.9 -65.5 -36.4 -49.2 14.5 22.5 743 384 B E H X S+ 0 0 36 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.919 108.4 50.7 -64.9 -42.7 -51.4 14.1 25.6 744 385 B V H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.922 109.1 52.7 -61.6 -40.6 -48.5 15.2 27.8 745 386 B G H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.908 106.5 51.7 -60.7 -43.3 -48.2 18.2 25.5 746 387 B R H X S+ 0 0 136 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.907 110.3 49.5 -62.7 -38.1 -51.9 19.1 25.9 747 388 B L H X S+ 0 0 4 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.871 108.7 52.1 -71.1 -36.0 -51.5 18.9 29.7 748 389 B I H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 3,-0.3 0.937 108.0 51.8 -62.2 -44.1 -48.4 21.2 29.6 749 390 B L H X S+ 0 0 28 -4,-2.4 4,-2.2 1,-0.3 -1,-0.2 0.805 104.0 58.5 -65.2 -27.3 -50.4 23.7 27.5 750 391 B E H X S+ 0 0 63 -4,-1.3 4,-1.8 2,-0.2 -1,-0.3 0.910 108.0 45.2 -69.6 -41.3 -53.1 23.6 30.1 751 392 B V H X S+ 0 0 2 -4,-1.6 4,-1.8 -3,-0.3 -2,-0.2 0.886 109.6 55.9 -68.9 -39.5 -50.7 24.7 32.8 752 393 B F H X S+ 0 0 0 -4,-2.3 4,-0.8 1,-0.2 -2,-0.2 0.935 107.5 49.1 -56.8 -46.6 -49.3 27.4 30.5 753 394 B E H >X S+ 0 0 84 -4,-2.2 3,-0.9 1,-0.2 4,-0.6 0.904 107.5 53.0 -67.5 -39.3 -52.7 28.9 30.0 754 395 B A H >X S+ 0 0 16 -4,-1.8 4,-2.3 1,-0.3 3,-0.9 0.871 107.9 53.4 -59.8 -36.6 -53.5 29.0 33.7 755 396 B L H 3< S+ 0 0 3 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.651 89.0 76.0 -74.9 -16.9 -50.2 30.8 34.2 756 397 B R H << S+ 0 0 127 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 0.829 114.2 24.2 -66.6 -24.8 -51.1 33.4 31.7 757 398 B T H << S+ 0 0 108 -3,-0.9 -2,-0.2 -4,-0.6 -1,-0.2 0.794 136.1 30.6-102.7 -36.4 -53.4 34.8 34.4 758 399 B N >< + 0 0 72 -4,-2.3 3,-2.1 -5,-0.1 -1,-0.2 -0.733 61.3 173.4-123.8 83.0 -51.8 33.5 37.6 759 400 B P T 3 S+ 0 0 72 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.675 78.5 65.5 -62.9 -17.4 -48.0 33.3 37.0 760 401 B E T 3 S- 0 0 96 1,-0.3 2,-0.1 -3,-0.1 -5,-0.1 0.622 122.7 -86.8 -81.2 -12.5 -47.5 32.5 40.7 761 402 B G < - 0 0 21 -3,-2.1 2,-0.4 -7,-0.1 -1,-0.3 -0.355 25.3-118.7 122.0 154.7 -49.4 29.3 40.0 762 403 B D > - 0 0 43 -2,-0.1 4,-2.8 1,-0.1 5,-0.3 -0.878 17.6-168.4-130.3 102.0 -52.9 27.9 39.9 763 404 B H H > S+ 0 0 135 -2,-0.4 4,-2.8 1,-0.2 5,-0.3 0.871 85.8 56.7 -56.8 -40.0 -53.4 25.1 42.4 764 405 B A H > S+ 0 0 61 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.957 113.9 37.7 -58.6 -53.2 -56.7 24.1 40.9 765 406 B T H > S+ 0 0 13 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.905 115.3 52.9 -66.1 -47.7 -55.3 23.5 37.5 766 407 B E H X S+ 0 0 5 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.889 111.7 46.1 -56.7 -42.4 -52.0 22.0 38.7 767 408 B Q H X S+ 0 0 60 -4,-2.8 4,-1.3 -5,-0.3 -1,-0.2 0.846 111.7 51.3 -73.6 -31.3 -53.8 19.5 40.8 768 409 B R H X S+ 0 0 87 -4,-1.7 4,-1.4 -5,-0.3 -2,-0.2 0.907 112.5 46.4 -69.9 -41.0 -56.2 18.5 38.1 769 410 B V H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.884 106.9 58.5 -68.8 -37.7 -53.3 18.0 35.7 770 411 B R H X S+ 0 0 68 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.874 105.8 49.6 -61.8 -34.0 -51.4 16.0 38.3 771 412 B R H X S+ 0 0 157 -4,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.855 109.7 49.3 -76.1 -31.9 -54.3 13.6 38.5 772 413 B E H X S+ 0 0 80 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.871 111.7 50.9 -71.9 -32.0 -54.5 13.1 34.7 773 414 B I H X S+ 0 0 1 -4,-2.3 4,-2.7 -71,-0.2 -2,-0.2 0.904 107.8 52.3 -71.5 -40.5 -50.8 12.6 34.8 774 415 B F H X S+ 0 0 85 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.901 110.3 48.5 -62.2 -40.4 -51.1 10.0 37.5 775 416 B A H X S+ 0 0 43 -4,-1.8 4,-0.6 2,-0.2 -1,-0.2 0.866 111.0 49.7 -71.1 -37.6 -53.7 8.2 35.4 776 417 B L H >< S+ 0 0 1 -4,-2.0 3,-1.0 1,-0.2 4,-0.4 0.933 111.6 49.8 -63.6 -45.1 -51.6 8.2 32.3 777 418 B C H >< S+ 0 0 0 -4,-2.7 3,-1.6 1,-0.3 -2,-0.2 0.850 101.5 60.1 -66.7 -34.1 -48.6 6.9 34.3 778 419 B E H 3< S+ 0 0 117 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.732 99.8 58.6 -72.0 -13.7 -50.6 4.0 35.8 779 420 B R T << S+ 0 0 136 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.662 112.5 41.0 -82.1 -16.1 -51.2 2.8 32.3 780 421 B F S < S- 0 0 36 -3,-1.6 -1,-0.3 -4,-0.4 -44,-0.1 -0.578 87.1-172.7-131.0 66.0 -47.5 2.6 31.8 781 422 B P - 0 0 62 0, 0.0 2,-0.3 0, 0.0 6,-0.1 -0.256 10.4-142.6 -70.7 150.2 -46.1 1.2 35.0 782 423 B I 0 0 9 1,-0.2 -48,-0.1 -366,-0.1 -362,-0.1 -0.821 360.0 360.0-110.8 150.7 -42.4 0.9 35.8 783 424 B Y 0 0 47 -2,-0.3 -1,-0.2 4,-0.1 -363,-0.0 0.782 360.0 360.0 52.5 360.0 -40.5 -1.8 37.6 784 !* 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 0.0 785 3 C N 0 0 76 0, 0.0 6,-0.0 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 145.4 -44.2 -6.0 35.2 786 4 C A + 0 0 107 -5,-0.1 3,-0.0 4,-0.1 0, 0.0 0.689 360.0 84.0 -76.4 -15.7 -45.3 -7.1 31.8 787 5 C N S >> S- 0 0 54 -6,-0.1 4,-1.9 1,-0.1 3,-1.4 -0.780 71.4-149.4 -94.8 120.5 -42.3 -5.4 30.2 788 6 C P H 3> S+ 0 0 57 0, 0.0 4,-2.3 0, 0.0 -354,-0.2 0.746 95.2 67.3 -64.3 -23.3 -39.1 -7.5 30.2 789 7 C F H 34 S+ 0 0 11 1,-0.2 -355,-2.2 2,-0.2 -354,-0.4 0.878 116.6 27.9 -60.9 -33.4 -36.9 -4.4 30.5 790 8 C F H <4 S+ 0 0 3 -3,-1.4 -1,-0.2 -357,-0.2 -4,-0.1 0.720 127.7 43.1 -98.4 -25.8 -38.4 -4.0 33.9 791 9 C S H < S+ 0 0 58 -4,-1.9 2,-0.3 2,-0.1 -2,-0.2 0.784 92.0 83.2 -99.6 -27.1 -39.2 -7.6 34.8 792 10 C Q < - 0 0 72 -4,-2.3 -357,-0.2 -5,-0.2 -358,-0.1 -0.584 69.9-126.8 -93.2 140.8 -36.2 -9.7 33.7 793 11 C S >> - 0 0 31 -2,-0.3 4,-1.4 1,-0.1 3,-0.7 -0.354 23.2-113.0 -77.5 160.0 -33.1 -10.1 35.7 794 12 C L H >> S+ 0 0 4 -360,-0.3 4,-3.1 1,-0.3 3,-0.6 0.923 120.2 58.7 -52.5 -45.0 -29.5 -9.5 34.6 795 13 C A H 34 S+ 0 0 45 1,-0.2 -1,-0.3 2,-0.2 7,-0.1 0.852 109.0 43.3 -53.5 -38.3 -29.1 -13.3 34.9 796 14 C E H <4 S+ 0 0 132 -3,-0.7 -1,-0.2 1,-0.1 -2,-0.2 0.718 123.7 35.5 -80.9 -22.4 -31.8 -13.8 32.4 797 15 C R H << S+ 0 0 87 -4,-1.4 2,-0.4 -3,-0.6 -2,-0.2 0.737 118.1 37.8-107.0 -30.5 -30.7 -11.1 30.0 798 16 C D X + 0 0 14 -4,-3.1 4,-2.6 -5,-0.2 5,-0.2 -0.747 51.9 177.0-138.6 86.3 -26.9 -11.0 30.0 799 17 C A H > S+ 0 0 82 -2,-0.4 4,-2.5 1,-0.2 -1,-0.1 0.847 82.3 52.3 -58.5 -38.7 -25.1 -14.3 30.2 800 18 C S H > S+ 0 0 59 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.941 113.4 40.3 -69.8 -47.8 -21.6 -12.7 29.9 801 19 C V H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.898 114.9 53.7 -69.7 -37.1 -22.0 -10.2 32.7 802 20 C R H X S+ 0 0 98 -4,-2.6 4,-2.4 -8,-0.3 -2,-0.2 0.924 107.6 52.0 -60.6 -40.7 -23.8 -12.7 34.8 803 21 C G H X S+ 0 0 22 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.903 109.1 49.2 -62.1 -41.8 -20.9 -15.1 34.3 804 22 C A H X S+ 0 0 6 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.885 110.3 51.0 -66.8 -36.5 -18.4 -12.4 35.4 805 23 C I H X S+ 0 0 12 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.909 109.9 49.6 -69.9 -39.5 -20.5 -11.7 38.5 806 24 C L H X S+ 0 0 81 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.869 109.0 52.2 -66.5 -37.0 -20.6 -15.4 39.4 807 25 C K H X S+ 0 0 129 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.896 111.4 47.2 -66.8 -37.2 -16.8 -15.7 39.0 808 26 C E H X S+ 0 0 11 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.884 109.0 54.1 -71.8 -37.2 -16.4 -12.7 41.3 809 27 C L H X S+ 0 0 53 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.919 108.8 49.5 -62.7 -38.9 -18.8 -14.2 43.8 810 28 C E H X S+ 0 0 90 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.881 106.6 55.2 -69.7 -36.8 -16.7 -17.4 43.8 811 29 C R H X S+ 0 0 51 -4,-1.8 4,-1.0 1,-0.2 -1,-0.2 0.931 113.7 41.6 -57.7 -44.4 -13.6 -15.4 44.4 812 30 C Q H < S+ 0 0 14 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.833 117.2 47.8 -75.2 -32.9 -15.1 -13.9 47.4 813 31 C Q H < S+ 0 0 36 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.866 118.2 36.0 -76.5 -36.0 -16.7 -17.1 48.6 814 32 C S H < S+ 0 0 11 -4,-2.5 2,-0.3 -5,-0.2 353,-0.2 0.406 106.5 65.3-111.7 -1.7 -13.7 -19.4 48.3 815 33 C Q S < S- 0 0 31 -4,-1.0 2,-0.7 -5,-0.2 279,-0.2 -0.866 77.9-117.6-118.6 156.1 -10.7 -17.3 49.2 816 34 C V E -u 1094 0G 0 277,-2.5 279,-2.2 -2,-0.3 2,-0.7 -0.849 26.0-149.2 -93.3 116.2 -9.7 -15.6 52.5 817 35 C E E +u 1095 0G 26 -2,-0.7 304,-0.5 277,-0.2 303,-0.2 -0.793 29.0 161.4 -90.7 113.1 -9.5 -11.9 52.1 818 36 C L + 0 0 0 277,-2.6 299,-1.9 -2,-0.7 2,-0.3 0.291 28.7 127.7-114.6 3.9 -6.9 -10.3 54.3 819 37 C I > - 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0 0 19 -3,-2.9 2,-0.5 -7,-0.2 -1,-0.2 -0.219 22.5-116.0 122.6 148.2 36.1 35.2 -18.3 1538 403 D D > - 0 0 47 1,-0.1 4,-2.4 -3,-0.1 3,-0.4 -0.909 21.1-166.2-117.5 104.5 35.2 38.8 -19.1 1539 404 D H H > S+ 0 0 130 -2,-0.5 4,-2.2 1,-0.3 5,-0.2 0.873 85.1 54.8 -55.9 -42.8 32.3 39.8 -17.0 1540 405 D A H > S+ 0 0 66 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.905 111.7 43.5 -62.5 -41.2 31.5 42.9 -19.0 1541 406 D T H > S+ 0 0 23 -3,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.904 112.0 52.9 -73.0 -41.7 31.2 41.0 -22.3 1542 407 D E H X S+ 0 0 6 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.879 109.4 49.8 -61.5 -38.7 29.2 38.2 -20.8 1543 408 D Q H X S+ 0 0 75 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.898 110.6 48.5 -69.8 -40.6 26.7 40.6 -19.4 1544 409 D R H X S+ 0 0 107 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.945 113.8 46.9 -64.3 -48.3 26.2 42.5 -22.6 1545 410 D V H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.885 108.7 55.6 -59.3 -41.1 25.8 39.3 -24.5 1546 411 D R H X S+ 0 0 73 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.893 108.8 47.7 -61.2 -38.3 23.4 38.0 -21.9 1547 412 D R H X S+ 0 0 194 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.866 111.1 49.4 -73.9 -33.6 21.2 41.0 -22.3 1548 413 D E H X S+ 0 0 61 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.855 110.4 52.1 -72.3 -31.2 21.2 40.8 -26.1 1549 414 D I H X S+ 0 0 0 -4,-2.2 4,-2.5 -71,-0.2 -2,-0.2 0.897 107.8 51.7 -70.4 -38.5 20.3 37.1 -25.7 1550 415 D F H X S+ 0 0 93 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.912 110.4 48.9 -63.2 -40.8 17.4 38.1 -23.5 1551 416 D A H X S+ 0 0 45 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.877 111.3 48.6 -69.4 -39.1 16.2 40.6 -26.1 1552 417 D L H >< S+ 0 0 6 -4,-2.1 3,-1.0 1,-0.2 4,-0.3 0.916 111.5 50.3 -66.4 -42.4 16.4 38.1 -28.9 1553 418 D C H >< S+ 0 0 0 -4,-2.5 3,-1.3 1,-0.3 -1,-0.2 0.820 101.9 60.2 -68.3 -28.5 14.5 35.5 -26.9 1554 419 D E H 3< S+ 0 0 113 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.706 99.6 58.1 -78.0 -11.8 11.7 37.9 -26.0 1555 420 D R T << S+ 0 0 154 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.571 112.4 42.0 -88.8 -11.0 11.1 38.2 -29.8 1556 421 D F S < S- 0 0 38 -3,-1.3 -1,-0.3 -4,-0.3 -44,-0.1 -0.545 86.3-172.0-135.3 65.7 10.5 34.5 -29.9 1557 422 D P - 0 0 60 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 -0.245 10.2-145.1 -71.3 148.4 8.5 33.6 -26.8 1558 423 D I 0 0 9 1,-0.2 -48,-0.1 -360,-0.1 -356,-0.0 -0.809 360.0 360.0-108.4 151.1 7.7 30.1 -25.6 1559 424 D Y 0 0 44 -2,-0.3 -1,-0.2 -1556,-0.1 -357,-0.0 0.827 360.0 360.0 49.1 360.0 4.6 28.8 -24.0