==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/ANTIBIOTIC 13-JUN-03 1PNV . COMPND 2 MOLECULE: GLYCOSYLTRANSFERASE GTFA; . SOURCE 2 ORGANISM_SCIENTIFIC: AMYCOLATOPSIS ORIENTALIS; . AUTHOR A.M.MULICHAK,H.C.LOSEY,W.LU,Z.WAWRZAK,C.T.WALSH,R.M.GARAVITO . 773 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31893.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 513 66.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 95 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 1 0.1 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 . 41 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 264 34.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.9 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 1 2 2 1 5 0 3 3 1 1 1 2 5 1 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 5 8 4 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 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 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 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 1 A M 0 0 18 0, 0.0 29,-2.1 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 100.8 19.5 96.2 24.1 2 2 A R E -a 30 0A 106 90,-0.3 92,-3.1 27,-0.2 93,-0.6 -0.669 360.0-170.3 -83.6 136.8 22.4 95.9 21.7 3 3 A V E -ab 31 95A 0 27,-1.3 29,-1.4 -2,-0.3 2,-0.5 -0.993 11.6-149.1-127.1 133.5 25.7 95.2 23.4 4 4 A L E -ab 32 96A 0 91,-2.0 93,-2.6 -2,-0.4 2,-0.5 -0.913 13.3-166.6-104.5 128.0 29.0 95.3 21.6 5 5 A I E +ab 33 97A 0 27,-3.1 29,-1.6 -2,-0.5 2,-0.3 -0.956 15.9 166.5-116.6 132.0 31.6 92.9 22.9 6 6 A T E +ab 34 98A 1 91,-3.1 93,-0.8 -2,-0.5 2,-0.3 -0.951 8.9 136.6-143.9 164.5 35.3 93.3 21.9 7 7 A G E - b 0 99A 3 27,-1.6 2,-0.4 -2,-0.3 93,-0.2 -0.922 33.7-133.6 169.6 164.6 38.9 92.3 22.6 8 8 A C E + b 0 100A 11 91,-0.7 93,-2.2 -2,-0.3 2,-0.3 -0.974 57.6 93.4-138.8 119.0 42.2 91.2 21.1 9 9 A G S S- 0 0 13 -2,-0.4 48,-0.2 91,-0.2 -2,-0.0 -0.976 72.1 -49.8 175.3-179.9 43.9 88.3 22.8 10 10 A S S >> S- 0 0 42 -2,-0.3 3,-0.9 1,-0.1 4,-0.7 0.101 70.0 -85.5 -61.6-176.8 44.5 84.5 22.9 11 11 A R H 3> S+ 0 0 59 1,-0.2 4,-3.1 2,-0.2 3,-0.4 0.821 128.5 59.8 -64.8 -28.5 41.6 82.1 22.8 12 12 A G H 34 S+ 0 0 33 1,-0.2 -1,-0.2 2,-0.2 -2,-0.0 0.727 104.0 49.0 -71.5 -22.5 41.2 82.4 26.6 13 13 A D H <4 S+ 0 0 47 -3,-0.9 4,-0.2 2,-0.1 -1,-0.2 0.593 119.6 40.3 -89.5 -12.8 40.6 86.1 26.4 14 14 A T H >X S+ 0 0 2 -4,-0.7 4,-2.4 -3,-0.4 3,-0.9 0.864 99.5 65.0-101.7 -50.2 38.0 85.5 23.7 15 15 A E H 3X S+ 0 0 43 -4,-3.1 4,-1.2 1,-0.3 -3,-0.1 0.848 103.2 51.4 -44.8 -43.3 36.0 82.4 24.6 16 16 A P H 3> S+ 0 0 14 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.895 110.3 49.4 -64.8 -36.2 34.5 84.1 27.7 17 17 A L H <> S+ 0 0 3 -3,-0.9 4,-2.1 -4,-0.2 -2,-0.2 0.893 107.8 52.8 -66.6 -41.1 33.5 87.1 25.5 18 18 A V H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.765 107.9 55.1 -65.0 -22.9 31.8 84.8 23.0 19 19 A A H X S+ 0 0 3 -4,-1.2 4,-2.2 -5,-0.3 -2,-0.2 0.883 106.5 47.0 -76.8 -41.6 30.0 83.3 26.0 20 20 A L H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.875 114.1 49.4 -67.5 -36.9 28.6 86.6 27.1 21 21 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.937 112.1 46.1 -67.1 -47.6 27.5 87.4 23.6 22 22 A A H X S+ 0 0 16 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.872 114.7 49.4 -62.4 -38.4 25.8 84.0 23.1 23 23 A R H X S+ 0 0 34 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.880 108.7 51.9 -68.3 -41.1 24.1 84.4 26.4 24 24 A L H X>S+ 0 0 0 -4,-2.2 5,-1.3 1,-0.2 4,-0.9 0.952 111.1 47.1 -62.1 -47.0 22.9 87.9 25.7 25 25 A R H <5S+ 0 0 100 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.794 110.3 54.1 -65.8 -24.6 21.4 86.7 22.4 26 26 A E H <5S+ 0 0 61 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.830 106.2 52.6 -76.7 -30.5 19.8 83.8 24.3 27 27 A L H <5S- 0 0 34 -4,-1.8 617,-0.4 -3,-0.4 -1,-0.2 0.621 125.5 -98.4 -78.7 -16.2 18.2 86.1 26.8 28 28 A G T <5S+ 0 0 39 -4,-0.9 -3,-0.2 1,-0.5 -4,-0.1 0.101 91.9 110.5 118.1 -22.1 16.6 88.3 24.1 29 29 A A < - 0 0 6 -5,-1.3 -1,-0.5 -6,-0.2 2,-0.3 -0.121 66.5-121.2 -71.6 178.7 19.2 91.0 24.0 30 30 A D E -a 2 0A 43 -29,-2.1 -27,-1.3 614,-0.3 2,-0.3 -0.869 24.7-166.4-122.1 160.2 21.4 91.3 20.9 31 31 A A E -a 3 0A 0 -2,-0.3 2,-0.3 -29,-0.2 -27,-0.2 -0.980 8.4-174.6-144.6 156.7 25.2 91.2 20.7 32 32 A R E -a 4 0A 51 -29,-1.4 -27,-3.1 -2,-0.3 2,-0.4 -0.971 15.1-146.4-147.3 150.6 27.9 91.9 18.2 33 33 A M E -ac 5 50A 0 16,-1.7 18,-4.2 -2,-0.3 2,-0.5 -0.959 16.4-162.6-132.4 147.1 31.6 91.3 18.3 34 34 A C E +ac 6 51A 0 -29,-1.6 -27,-1.6 -2,-0.4 16,-0.0 -0.957 38.1 153.1-121.3 103.4 34.8 92.9 17.1 35 35 A L E - c 0 52A 0 16,-1.5 18,-2.1 -2,-0.5 -27,-0.2 -0.923 50.3 -85.2-133.5 157.7 37.5 90.2 17.4 36 36 A P > - 0 0 0 0, 0.0 3,-2.3 0, 0.0 20,-0.2 -0.349 53.6-100.2 -61.6 143.5 40.8 89.4 15.7 37 37 A P G > S+ 0 0 44 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.623 111.8 80.5 -34.7 -28.2 40.4 87.3 12.4 38 38 A D G 3 S+ 0 0 40 1,-0.2 4,-0.4 17,-0.2 3,-0.3 0.791 89.7 50.8 -56.6 -32.5 41.2 84.1 14.2 39 39 A Y G <> S+ 0 0 9 -3,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.282 73.8 101.8 -98.0 16.2 37.7 83.7 15.7 40 40 A V H <> S+ 0 0 71 -3,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.927 89.0 42.1 -61.8 -48.1 35.5 84.1 12.6 41 41 A E H > S+ 0 0 69 -3,-0.3 4,-2.1 -4,-0.3 -1,-0.2 0.919 114.3 52.9 -65.0 -43.8 34.9 80.3 12.2 42 42 A R H > S+ 0 0 23 -4,-0.4 4,-1.2 1,-0.2 -2,-0.2 0.884 112.3 44.5 -59.2 -41.3 34.5 80.0 16.0 43 43 A C H X>S+ 0 0 3 -4,-2.6 5,-1.7 2,-0.2 4,-1.4 0.892 109.6 54.3 -71.2 -39.7 31.8 82.7 16.1 44 44 A A H <5S+ 0 0 78 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.887 107.6 53.9 -58.4 -38.6 30.0 81.4 13.0 45 45 A E H <5S+ 0 0 97 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.816 112.9 40.3 -64.5 -37.7 29.8 78.1 14.9 46 46 A V H <5S- 0 0 38 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.544 111.6-121.2 -90.0 -10.4 28.2 79.7 18.0 47 47 A G T <5 + 0 0 37 -4,-1.4 -3,-0.2 1,-0.3 -4,-0.1 0.668 63.3 141.4 80.4 15.9 26.0 81.9 15.8 48 48 A V < - 0 0 4 -5,-1.7 2,-0.3 -6,-0.1 -1,-0.3 -0.816 55.2-120.9 -94.8 124.8 27.3 85.2 17.2 49 49 A P - 0 0 53 0, 0.0 -16,-1.7 0, 0.0 2,-0.4 -0.489 40.3-178.9 -67.6 124.3 27.7 88.0 14.6 50 50 A M E -c 33 0A 33 -2,-0.3 -16,-0.2 -18,-0.2 -6,-0.0 -0.982 25.9-148.1-135.0 135.8 31.3 89.2 14.5 51 51 A V E -c 34 0A 52 -18,-4.2 -16,-1.5 -2,-0.4 2,-0.4 -0.863 26.4-128.6-100.3 125.7 33.3 91.8 12.7 52 52 A P E -c 35 0A 62 0, 0.0 2,-0.4 0, 0.0 -18,-0.1 -0.603 31.8-177.4 -75.9 126.8 37.0 90.9 12.0 53 53 A V - 0 0 2 -18,-2.1 29,-0.1 -2,-0.4 28,-0.0 -0.987 38.4 -21.3-133.0 130.0 39.4 93.6 13.2 54 54 A G S S- 0 0 20 -2,-0.4 3,-0.1 -18,-0.1 -19,-0.0 -0.194 95.4 -25.1 77.0-168.5 43.2 93.9 12.9 55 55 A R S S- 0 0 61 1,-0.1 -17,-0.2 -19,-0.1 2,-0.2 -0.285 72.5 -94.2 -75.5 164.7 45.8 91.2 12.5 56 56 A A - 0 0 11 -20,-0.2 -1,-0.1 1,-0.1 6,-0.1 -0.515 25.6-148.1 -78.4 147.8 45.4 87.6 13.6 57 57 A V S S+ 0 0 22 -2,-0.2 2,-0.2 -48,-0.2 -1,-0.1 0.910 73.8 84.5 -83.9 -44.3 46.7 86.7 17.1 58 58 A R S > S- 0 0 93 1,-0.1 3,-2.2 2,-0.1 4,-0.4 -0.422 77.9-136.1 -63.8 125.8 47.8 83.1 16.5 59 59 A A G > S+ 0 0 60 1,-0.3 3,-1.6 -2,-0.2 -1,-0.1 0.894 102.5 52.2 -48.1 -52.6 51.3 83.0 15.1 60 60 A G G 3 S+ 0 0 56 200,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.370 100.0 67.6 -70.8 9.4 50.6 80.4 12.4 61 61 A A G < S+ 0 0 43 -3,-2.2 -1,-0.3 2,-0.1 2,-0.2 0.586 93.0 63.6-103.3 -13.5 47.6 82.4 11.2 62 62 A R S < S- 0 0 37 -3,-1.6 3,-0.1 -4,-0.4 4,-0.0 -0.682 99.1 -81.2-108.0 164.4 49.6 85.4 9.8 63 63 A E > - 0 0 138 -2,-0.2 3,-1.7 1,-0.1 -1,-0.2 -0.164 65.3 -82.6 -56.9 155.2 52.1 85.5 7.0 64 64 A P T 3 S+ 0 0 130 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.418 116.8 14.5 -65.9 136.4 55.6 84.4 7.9 65 65 A G T 3 S+ 0 0 89 1,-0.3 2,-0.2 -3,-0.1 -2,-0.1 0.342 93.9 140.0 82.8 -7.1 57.7 87.0 9.6 66 66 A E < - 0 0 58 -3,-1.7 -1,-0.3 -7,-0.1 -4,-0.1 -0.481 53.2-118.3 -73.1 136.4 54.6 89.1 10.2 67 67 A L - 0 0 68 -2,-0.2 -1,-0.1 -3,-0.1 -4,-0.1 -0.386 24.6-118.4 -75.7 151.0 54.3 91.0 13.5 68 68 A P > - 0 0 43 0, 0.0 3,-1.0 0, 0.0 6,-0.3 -0.399 28.5-104.2 -83.5 164.5 51.5 90.2 16.0 69 69 A P T 3 S+ 0 0 13 0, 0.0 9,-0.1 0, 0.0 -12,-0.1 0.602 118.5 56.3 -65.5 -11.8 48.9 92.8 17.2 70 70 A G T 3 S+ 0 0 51 -13,-0.1 2,-0.2 4,-0.0 5,-0.1 0.697 77.2 113.5 -92.6 -20.1 50.6 93.2 20.5 71 71 A A S X> S- 0 0 18 -3,-1.0 4,-1.1 1,-0.2 3,-0.9 -0.351 71.8-132.1 -58.0 117.3 54.0 94.2 19.1 72 72 A A T 34 S+ 0 0 50 1,-0.2 4,-0.3 -2,-0.2 -1,-0.2 0.686 100.6 70.8 -42.2 -26.2 54.8 97.8 20.0 73 73 A E T >4 S+ 0 0 132 1,-0.2 3,-0.6 2,-0.1 -1,-0.2 0.983 102.0 37.6 -56.2 -64.5 55.8 98.3 16.3 74 74 A V T X> S+ 0 0 11 -3,-0.9 3,-3.7 -6,-0.3 4,-1.5 0.690 82.0 113.7 -62.6 -25.3 52.2 98.1 14.9 75 75 A V H 3X S+ 0 0 7 -4,-1.1 4,-2.9 1,-0.3 -1,-0.2 0.645 78.0 48.0 -17.0 -52.9 50.6 100.0 17.8 76 76 A T H <> S+ 0 0 80 -3,-0.6 4,-2.3 -4,-0.3 -1,-0.3 0.836 111.8 49.5 -68.7 -31.3 49.6 103.0 15.7 77 77 A E H <> S+ 0 0 91 -3,-3.7 4,-3.7 2,-0.2 -2,-0.2 0.919 111.8 50.2 -70.4 -43.8 48.2 100.8 12.9 78 78 A V H X S+ 0 0 7 -4,-1.5 4,-2.6 2,-0.2 5,-0.3 0.986 112.1 45.6 -54.7 -63.4 46.2 98.9 15.6 79 79 A V H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.919 116.7 47.2 -45.0 -50.9 44.9 102.1 17.1 80 80 A A H X S+ 0 0 31 -4,-2.3 4,-0.9 1,-0.2 -1,-0.2 0.909 110.7 51.4 -59.7 -45.6 44.1 103.3 13.6 81 81 A E H X S+ 0 0 42 -4,-3.7 4,-2.1 1,-0.2 3,-0.4 0.905 111.5 45.2 -61.5 -45.2 42.4 100.1 12.6 82 82 A W H X S+ 0 0 5 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.922 109.8 53.8 -66.7 -42.6 40.1 99.9 15.5 83 83 A F H < S+ 0 0 17 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.725 114.5 46.8 -63.7 -17.1 39.1 103.5 15.2 84 84 A D H < S+ 0 0 110 -4,-0.9 4,-0.2 -3,-0.4 -2,-0.2 0.821 120.4 29.8 -93.6 -37.5 38.3 102.7 11.6 85 85 A K H X S+ 0 0 83 -4,-2.1 4,-0.6 2,-0.1 3,-0.3 0.678 103.7 72.1-100.5 -18.2 36.3 99.4 11.8 86 86 A V H >X S+ 0 0 0 -4,-2.3 4,-3.5 -5,-0.3 3,-1.0 0.876 84.5 66.5 -67.6 -38.0 34.5 99.7 15.2 87 87 A P H 3> S+ 0 0 37 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.872 96.9 54.5 -52.3 -41.4 31.9 102.4 14.3 88 88 A A H 34 S+ 0 0 75 -3,-0.3 -2,-0.2 -4,-0.2 -3,-0.1 0.842 118.8 37.2 -61.0 -31.0 30.1 100.2 11.9 89 89 A A H << S+ 0 0 1 -3,-1.0 -1,-0.2 -4,-0.6 -3,-0.1 0.880 117.7 47.0 -87.0 -44.7 29.8 97.7 14.7 90 90 A I H >< S+ 0 0 3 -4,-3.5 3,-2.1 2,-0.1 2,-0.2 0.687 82.5 109.2 -75.0 -20.1 29.2 100.0 17.7 91 91 A E T 3< S+ 0 0 123 -4,-2.2 24,-0.0 -5,-0.3 0, 0.0 -0.407 87.4 17.6 -59.5 123.6 26.6 102.1 16.0 92 92 A G T 3 S+ 0 0 52 1,-0.3 -90,-0.3 -2,-0.2 -1,-0.3 0.560 94.9 129.7 93.2 8.7 23.3 101.3 17.6 93 93 A C < - 0 0 7 -3,-2.1 -1,-0.3 1,-0.1 -90,-0.2 -0.636 47.0-156.4 -97.2 157.4 24.7 99.7 20.8 94 94 A D S S- 0 0 36 -92,-3.1 2,-0.3 1,-0.3 -91,-0.2 0.460 76.5 -2.1-109.0 -4.5 23.7 100.6 24.4 95 95 A A E -b 3 0A 0 -93,-0.6 -91,-2.0 22,-0.2 2,-0.3 -0.957 63.9-139.9-170.9 169.5 26.8 99.4 26.1 96 96 A V E -bd 4 119A 0 22,-1.5 24,-1.6 -2,-0.3 2,-0.4 -0.999 4.0-159.1-147.6 142.8 30.2 97.8 25.4 97 97 A V E +bd 5 120A 0 -93,-2.6 -91,-3.1 -2,-0.3 2,-0.3 -0.989 19.5 175.4-125.5 132.0 32.3 95.1 27.0 98 98 A T E +bd 6 121A 2 22,-2.7 24,-2.6 -2,-0.4 2,-0.3 -0.855 14.8 167.3-133.5 167.4 36.0 94.7 26.4 99 99 A T E +b 7 0A 7 -93,-0.8 -91,-0.7 -2,-0.3 2,-0.1 -0.920 47.4 36.5-163.3 167.2 39.1 92.8 27.4 100 100 A G E S+b 8 0A 15 22,-0.4 -91,-0.2 -2,-0.3 5,-0.1 -0.432 87.2 41.8 89.9-157.3 42.6 92.3 25.9 101 101 A L >> - 0 0 37 -93,-2.2 4,-2.0 1,-0.1 3,-1.6 -0.066 63.0-147.3 -40.9 105.8 45.0 94.6 24.0 102 102 A L H 3> S+ 0 0 26 1,-0.3 4,-2.2 2,-0.2 5,-0.3 0.802 94.4 57.4 -45.8 -46.0 44.9 98.0 25.8 103 103 A P H 3> S+ 0 0 11 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.834 113.1 41.9 -61.0 -27.8 45.6 100.1 22.6 104 104 A A H <> S+ 0 0 4 -3,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.832 111.4 55.4 -84.1 -34.7 42.4 98.5 21.1 105 105 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -3,-0.2 0.827 107.9 49.4 -65.7 -34.0 40.4 98.8 24.4 106 106 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.866 106.7 54.4 -75.1 -37.6 41.1 102.5 24.5 107 107 A A H X S+ 0 0 0 -4,-0.9 4,-1.7 -5,-0.3 -2,-0.2 0.912 112.4 45.5 -61.4 -40.6 40.0 103.1 20.9 108 108 A V H X S+ 0 0 0 -4,-1.8 4,-1.9 1,-0.2 5,-0.2 0.959 109.2 52.6 -68.7 -49.9 36.7 101.4 21.8 109 109 A R H X S+ 0 0 54 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.816 108.1 54.1 -56.6 -29.8 36.1 103.2 25.0 110 110 A S H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.953 108.4 46.2 -69.0 -48.7 36.6 106.5 23.1 111 111 A M H X S+ 0 0 16 -4,-1.7 4,-0.9 1,-0.2 -2,-0.2 0.759 113.1 51.5 -64.7 -25.0 34.0 105.7 20.5 112 112 A A H X>S+ 0 0 1 -4,-1.9 5,-1.7 2,-0.2 4,-1.4 0.868 106.6 54.6 -76.3 -38.1 31.7 104.6 23.4 113 113 A E H <5S+ 0 0 85 -4,-2.0 3,-0.3 -5,-0.2 -2,-0.2 0.890 106.4 51.4 -60.4 -42.2 32.4 107.9 25.1 114 114 A K H <5S+ 0 0 115 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.808 112.9 45.4 -66.1 -31.5 31.3 109.7 21.9 115 115 A L H <5S- 0 0 84 -4,-0.9 -1,-0.2 -5,-0.2 -2,-0.2 0.632 108.1-124.0 -87.5 -16.7 28.0 107.7 21.8 116 116 A G T <5 + 0 0 68 -4,-1.4 -3,-0.2 -3,-0.3 -2,-0.1 0.833 62.9 133.8 77.8 34.7 27.2 108.1 25.5 117 117 A I < - 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0 0 5 -19,-1.1 173,-0.3 -2,-0.7 -18,-0.2 0.647 44.7-106.6 -85.0 -16.7 30.7 88.0 38.4 199 199 A G - 0 0 2 -20,-0.8 -17,-0.3 -18,-0.8 173,-0.1 0.158 57.3 -49.1 96.5 140.9 31.9 84.4 38.2 200 200 A A - 0 0 11 1,-0.1 2,-0.9 165,-0.1 168,-0.3 0.013 52.1-125.9 -44.5 145.4 33.5 82.9 35.1 201 201 A W + 0 0 11 -21,-0.5 2,-0.4 167,-0.2 -182,-0.2 -0.857 40.0 173.6 -98.5 102.9 31.7 83.4 31.7 202 202 A I - 0 0 24 -2,-0.9 167,-0.3 -183,-0.1 -187,-0.0 -0.902 27.6-141.8-115.8 140.9 31.3 79.9 30.3 203 203 A L - 0 0 34 -2,-0.4 2,-0.1 166,-0.0 -183,-0.1 -0.852 26.8-122.6-103.9 104.5 29.4 78.9 27.2 204 204 A P - 0 0 37 0, 0.0 2,-0.3 0, 0.0 221,-0.1 -0.220 32.5-146.2 -47.6 108.7 27.6 75.6 27.7 205 205 A D + 0 0 22 1,-0.1 74,-0.0 -2,-0.1 -3,-0.0 -0.618 28.5 173.3 -83.9 136.9 29.1 73.5 24.9 206 206 A E + 0 0 127 -2,-0.3 -1,-0.1 2,-0.1 73,-0.0 0.339 36.7 126.3-121.3 -0.8 26.9 70.9 23.1 207 207 A R - 0 0 51 1,-0.1 2,-0.1 71,-0.0 75,-0.1 -0.367 57.1-129.6 -62.3 134.4 29.3 69.9 20.4 208 208 A P - 0 0 114 0, 0.0 2,-0.1 0, 0.0 71,-0.1 -0.478 20.3-109.4 -83.9 157.9 29.9 66.1 20.3 209 209 A L - 0 0 10 1,-0.2 69,-0.1 -2,-0.1 5,-0.0 -0.476 48.7 -91.6 -77.5 157.7 33.4 64.6 20.2 210 210 A S > - 0 0 62 -2,-0.1 4,-1.4 1,-0.1 -1,-0.2 -0.043 32.2-107.9 -65.3 175.2 34.3 63.0 16.9 211 211 A A H > S+ 0 0 74 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.896 119.4 48.5 -70.4 -42.3 33.6 59.4 16.0 212 212 A E H > S+ 0 0 120 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.915 109.7 51.7 -65.2 -44.5 37.3 58.4 16.2 213 213 A L H > S+ 0 0 1 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.860 111.7 48.4 -61.1 -34.9 37.7 60.2 19.5 214 214 A E H X S+ 0 0 61 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.927 109.3 52.2 -68.3 -45.8 34.8 58.2 20.8 215 215 A A H X S+ 0 0 57 -4,-2.5 4,-3.5 2,-0.2 -2,-0.2 0.903 111.7 47.6 -55.5 -45.6 36.2 55.0 19.4 216 216 A F H < S+ 0 0 20 -4,-2.7 -2,-0.2 2,-0.2 -1,-0.2 0.995 109.2 50.5 -58.9 -66.1 39.5 55.7 21.2 217 217 A L H < S+ 0 0 26 -4,-2.3 3,-0.3 1,-0.2 -1,-0.2 0.798 118.5 42.6 -42.6 -33.4 37.8 56.5 24.6 218 218 A A H < S+ 0 0 81 -4,-1.9 2,-2.9 1,-0.2 -1,-0.2 0.935 101.0 66.7 -80.6 -51.7 35.9 53.3 24.2 219 219 A A S < S- 0 0 81 -4,-3.5 2,-0.3 -5,-0.2 -1,-0.2 -0.248 113.6 -18.2 -69.0 54.3 38.7 51.0 22.9 220 220 A G S S- 0 0 45 -2,-2.9 51,-0.0 -3,-0.3 0, 0.0 -0.913 94.0 -15.1 146.9-173.6 40.7 51.1 26.2 221 221 A S S S- 0 0 64 -2,-0.3 -2,-0.0 1,-0.1 31,-0.0 -0.194 72.0 -88.3 -66.1 156.5 41.6 52.6 29.5 222 222 A T - 0 0 81 1,-0.1 31,-0.2 65,-0.1 -1,-0.1 -0.552 53.0-137.0 -71.8 122.1 40.6 56.1 30.6 223 223 A P - 0 0 2 0, 0.0 65,-3.1 0, 0.0 66,-0.5 -0.162 4.6-120.2 -79.4 167.2 43.3 58.6 29.4 224 224 A V E -gh 254 289C 0 29,-2.3 31,-1.4 63,-0.2 2,-0.3 -0.922 31.7-126.5-108.0 131.7 45.1 61.7 30.9 225 225 A Y E -gh 255 290C 7 64,-3.1 66,-3.4 -2,-0.5 2,-0.4 -0.617 25.3-175.7 -83.5 136.6 44.7 64.9 29.0 226 226 A V E +gh 256 291C 0 29,-2.3 31,-1.8 -2,-0.3 2,-0.3 -0.995 24.1 126.2-133.8 123.7 47.8 66.9 27.9 227 227 A G E - h 0 292C 0 64,-1.7 66,-0.7 -2,-0.4 31,-0.1 -0.925 39.5-158.7-173.6 150.2 47.5 70.3 26.2 228 228 A F > - 0 0 9 29,-0.4 3,-2.5 1,-0.3 32,-0.1 0.027 28.9-152.9-127.1 27.5 48.7 73.9 26.5 229 229 A G T 3 S+ 0 0 27 1,-0.3 31,-2.2 30,-0.1 32,-0.4 0.026 75.2 1.3 39.5-130.3 46.1 75.9 24.6 230 230 A S T 3 S+ 0 0 30 29,-0.2 -1,-0.3 30,-0.1 2,-0.1 0.417 95.6 125.8 -69.3 0.9 47.4 79.1 23.1 231 231 A S < + 0 0 35 -3,-2.5 29,-0.2 1,-0.1 30,-0.2 -0.429 24.4 162.4 -61.3 132.3 50.9 78.5 24.4 232 232 A S + 0 0 57 -2,-0.1 -1,-0.1 28,-0.1 -2,-0.0 0.168 24.9 124.9-140.3 16.7 53.3 78.7 21.4 233 233 A R S >> S- 0 0 61 1,-0.1 3,-0.7 3,-0.0 4,-0.5 -0.384 73.4-108.5 -75.0 159.2 56.7 79.2 22.9 234 234 A P H >> S+ 0 0 116 0, 0.0 3,-1.1 0, 0.0 4,-0.8 0.899 116.6 61.8 -55.7 -43.9 59.5 76.7 21.8 235 235 A A H >> S+ 0 0 20 1,-0.2 4,-2.9 2,-0.2 3,-1.2 0.863 88.0 76.4 -49.8 -40.9 59.5 75.0 25.2 236 236 A T H <> S+ 0 0 15 -3,-0.7 4,-2.0 1,-0.3 -1,-0.2 0.818 92.3 48.9 -39.3 -51.3 55.9 74.0 24.7 237 237 A A H S+ 0 0 0 -4,-2.2 5,-2.2 2,-0.2 4,-0.3 0.884 115.8 45.6 -76.1 -36.9 51.8 59.6 31.5 248 248 A R H ><5S+ 0 0 74 -4,-2.5 3,-1.4 2,-0.2 -2,-0.2 0.877 106.3 58.7 -71.5 -37.1 53.1 56.6 29.6 249 249 A A H 3<5S+ 0 0 77 -4,-4.0 -1,-0.2 1,-0.3 -2,-0.2 0.868 105.9 51.8 -58.4 -33.5 55.6 55.8 32.3 250 250 A S T 3<5S- 0 0 43 -4,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.630 118.7-118.2 -76.6 -14.9 52.5 55.5 34.4 251 251 A G T < 5 + 0 0 67 -3,-1.4 2,-0.3 -4,-0.3 -3,-0.2 0.806 69.9 129.3 81.6 30.7 51.0 53.1 31.9 252 252 A R < - 0 0 87 -5,-2.2 -1,-0.3 1,-0.0 -2,-0.1 -0.855 56.4-117.0-117.4 154.4 48.0 55.3 31.0 253 253 A R - 0 0 25 -2,-0.3 -29,-2.3 -31,-0.2 2,-0.3 -0.334 31.7-145.2 -81.6 168.7 46.7 56.4 27.6 254 254 A I E -g 224 0C 0 17,-2.2 19,-0.5 -31,-0.3 2,-0.5 -0.976 18.7-152.9-143.0 155.9 46.6 60.0 26.5 255 255 A V E -g 225 0C 0 -31,-1.4 -29,-2.3 -2,-0.3 2,-0.4 -0.993 24.8-162.8-121.3 123.4 44.6 62.6 24.5 256 256 A L E -gi 226 274C 2 17,-4.3 19,-2.8 -2,-0.5 2,-0.5 -0.926 10.3-143.0-115.8 136.5 46.8 65.5 23.2 257 257 A S E - i 0 275C 9 -31,-1.8 -29,-0.4 -2,-0.4 6,-0.2 -0.839 8.8-145.0 -98.1 128.3 45.6 68.8 22.0 258 258 A R >>> + 0 0 107 17,-2.6 5,-1.8 -2,-0.5 4,-0.8 0.880 39.9 174.4 -55.2 -40.5 47.4 70.3 19.0 259 259 A G G >45 - 0 0 28 16,-0.3 3,-1.2 1,-0.2 -29,-0.2 -0.019 59.1 -50.4 59.0-170.0 46.9 73.8 20.5 260 260 A W G 345S+ 0 0 53 -31,-2.2 -200,-0.3 1,-0.2 -1,-0.2 0.564 137.1 67.1 -74.2 -6.2 48.4 76.8 19.0 261 261 A A G <45S- 0 0 31 -3,-0.6 -1,-0.2 -32,-0.4 -2,-0.2 0.605 98.0-135.4 -88.5 -14.3 51.7 74.9 19.1 262 262 A D T <<5 - 0 0 101 -3,-1.2 -3,-0.2 -4,-0.8 2,-0.1 0.958 33.2-168.0 55.5 51.4 50.6 72.4 16.5 263 263 A L < - 0 0 11 -5,-1.8 2,-0.4 -6,-0.2 -1,-0.2 -0.458 6.4-153.8 -71.7 143.4 52.1 69.6 18.7 264 264 A V - 0 0 120 -2,-0.1 -7,-0.1 -3,-0.1 -1,-0.0 -0.907 24.9-101.9-119.7 147.2 52.4 66.2 17.1 265 265 A L - 0 0 37 -2,-0.4 -24,-0.1 1,-0.1 3,-0.0 -0.386 31.9-122.2 -63.1 145.5 52.4 62.8 18.9 266 266 A P S S- 0 0 75 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.717 85.2 -3.8 -63.5 -23.0 56.0 61.4 19.2 267 267 A D S S- 0 0 73 2,-0.1 5,-0.1 0, 0.0 -2,-0.0 -0.981 79.9 -90.6-163.0 168.0 55.1 58.2 17.4 268 268 A D + 0 0 107 -2,-0.3 4,-0.0 2,-0.1 -3,-0.0 0.206 68.1 153.1 -71.9 17.8 52.3 56.3 15.8 269 269 A G > - 0 0 20 1,-0.1 3,-0.7 2,-0.1 -2,-0.1 -0.165 45.4-140.4 -49.3 142.1 51.7 54.6 19.2 270 270 A A T 3 S+ 0 0 92 1,-0.2 -1,-0.1 3,-0.0 -2,-0.1 0.402 92.0 72.9 -88.6 1.5 48.1 53.5 19.6 271 271 A D T 3 S+ 0 0 52 -18,-0.1 -17,-2.2 -19,-0.1 2,-0.2 0.395 93.8 63.4 -95.7 3.6 47.8 54.5 23.2 272 272 A C < - 0 0 9 -3,-0.7 2,-0.3 -19,-0.2 -17,-0.2 -0.697 60.5-164.7-119.7 172.9 47.7 58.2 22.3 273 273 A F - 0 0 42 -19,-0.5 -17,-4.3 -2,-0.2 2,-0.4 -0.931 9.1-148.8-161.1 132.7 45.3 60.5 20.4 274 274 A V E -i 256 0C 30 -2,-0.3 2,-0.3 -19,-0.2 -17,-0.2 -0.904 18.1-175.7-108.0 134.8 45.7 64.0 18.9 275 275 A V E -i 257 0C 11 -19,-2.8 -17,-2.6 -2,-0.4 -16,-0.3 -0.877 12.6-165.1-124.9 158.2 42.7 66.3 18.7 276 276 A G S S+ 0 0 41 1,-0.6 -17,-0.2 -2,-0.3 -1,-0.1 0.371 72.9 5.1-105.8-116.5 42.3 69.8 17.2 277 277 A E S S+ 0 0 91 -20,-0.1 -1,-0.6 -19,-0.1 2,-0.3 -0.425 84.2 158.2 -65.9 143.9 39.2 71.8 18.1 278 278 A V - 0 0 23 -3,-0.1 2,-1.5 -2,-0.1 3,-0.2 -0.977 53.6 -97.8-167.7 154.8 37.1 70.0 20.7 279 279 A N > - 0 0 5 -2,-0.3 4,-3.1 1,-0.2 3,-0.3 -0.646 37.2-176.5 -76.3 93.7 34.5 70.3 23.4 280 280 A L H > S+ 0 0 32 -2,-1.5 4,-4.0 1,-0.2 5,-0.3 0.919 81.5 60.1 -59.6 -42.0 36.9 70.4 26.4 281 281 A Q H 4 S+ 0 0 45 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.882 113.2 38.6 -52.0 -39.2 33.9 70.5 28.7 282 282 A E H >4 S+ 0 0 74 -3,-0.3 3,-1.4 2,-0.2 -2,-0.2 0.964 118.7 45.3 -75.9 -55.0 32.9 67.2 27.2 283 283 A L H >< S+ 0 0 0 -4,-3.1 3,-2.4 1,-0.3 -2,-0.2 0.882 108.7 57.1 -55.9 -43.8 36.4 65.6 26.9 284 284 A F G >< S+ 0 0 0 -4,-4.0 3,-0.6 1,-0.3 -1,-0.3 0.679 100.1 60.3 -61.7 -19.8 37.4 66.7 30.4 285 285 A G G < S+ 0 0 53 -3,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.305 108.1 46.6 -89.4 9.2 34.4 64.8 31.6 286 286 A R G < S+ 0 0 86 -3,-2.4 2,-0.3 -63,-0.0 -1,-0.2 0.162 97.0 76.7-138.0 22.8 36.0 61.7 30.1 287 287 A V S < S- 0 0 13 -3,-0.6 -63,-0.2 -65,-0.1 3,-0.1 -0.853 72.4-127.1-128.5 165.1 39.6 61.7 31.2 288 288 A A S S- 0 0 21 -65,-3.1 2,-0.3 -2,-0.3 -64,-0.2 0.823 83.3 -23.5 -82.0 -33.7 41.3 60.9 34.5 289 289 A A E -h 224 0C 0 -66,-0.5 -64,-3.1 18,-0.2 2,-0.4 -0.964 59.9-122.1-167.3 169.9 43.3 64.1 34.9 290 290 A A E -hj 225 309C 0 18,-1.7 20,-2.5 -2,-0.3 2,-0.6 -0.995 7.0-162.3-133.8 132.7 44.7 67.0 32.9 291 291 A I E +hj 226 310C 0 -66,-3.4 -64,-1.7 -2,-0.4 2,-0.3 -0.971 40.1 140.6-109.7 115.3 48.2 68.2 32.6 292 292 A H E -hj 227 311C 0 18,-2.3 20,-2.1 -2,-0.6 -64,-0.2 -0.884 47.8 -78.8-148.4 179.1 48.1 71.8 31.2 293 293 A H - 0 0 32 -66,-0.7 2,-1.1 -2,-0.3 20,-0.1 -0.109 56.5 -83.8 -76.5 177.3 49.4 75.3 31.2 294 294 A D S S+ 0 0 58 18,-0.5 2,-0.3 17,-0.1 -1,-0.1 -0.732 72.8 139.5 -85.7 98.5 48.7 78.1 33.7 295 295 A S > - 0 0 23 -2,-1.1 4,-2.0 1,-0.1 5,-0.3 -0.993 56.4-134.6-149.3 140.5 45.5 79.6 32.4 296 296 A A H > S+ 0 0 23 -2,-0.3 4,-1.5 1,-0.2 5,-0.2 0.914 103.3 47.1 -53.8 -50.7 42.2 80.9 33.8 297 297 A G H > S+ 0 0 39 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.938 115.3 38.5 -62.3 -55.5 40.0 79.1 31.3 298 298 A T H > S+ 0 0 19 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.900 112.4 56.8 -66.8 -40.3 41.3 75.6 31.3 299 299 A T H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.888 112.4 43.3 -58.3 -37.5 42.0 75.5 35.0 300 300 A L H X S+ 0 0 8 -4,-1.5 4,-2.0 -5,-0.3 -1,-0.2 0.869 110.6 53.3 -76.4 -38.7 38.3 76.3 35.6 301 301 A L H < S+ 0 0 29 -4,-2.1 4,-0.2 2,-0.2 -2,-0.2 0.869 114.9 42.6 -64.7 -35.0 36.9 73.9 33.0 302 302 A A H >X>S+ 0 0 0 -4,-2.3 5,-1.5 2,-0.2 3,-1.1 0.918 112.5 53.7 -75.4 -43.3 38.8 71.1 34.5 303 303 A M H 3<5S+ 0 0 3 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.776 111.9 44.0 -62.3 -28.0 38.0 72.2 38.1 304 304 A R T 3<5S+ 0 0 81 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.505 107.1 61.9 -93.7 -3.5 34.3 72.2 37.2 305 305 A A T <45S- 0 0 34 -3,-1.1 -2,-0.2 -4,-0.2 -1,-0.2 0.538 110.0-125.4 -92.7 -11.4 34.8 68.9 35.5 306 306 A G T <5 + 0 0 9 -4,-0.7 52,-0.2 1,-0.2 -3,-0.2 0.761 62.6 134.1 73.3 28.0 35.9 67.4 38.8 307 307 A I < - 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0 0 23 -5,-1.6 -1,-0.2 -6,-0.2 -22,-0.2 -0.560 60.4 -91.5 -94.6 159.4 6.2 52.2 38.3 502 118 B P - 0 0 6 0, 0.0 -22,-2.3 0, 0.0 2,-0.4 -0.412 37.1-158.9 -71.7 141.5 3.7 55.0 39.2 503 119 B Y E -o 480 0D 14 -24,-0.2 2,-0.4 -2,-0.1 -22,-0.2 -0.973 5.8-168.3-125.2 132.9 3.1 57.9 36.8 504 120 B R E -o 481 0D 55 -24,-3.4 -22,-3.3 -2,-0.4 2,-0.5 -0.972 5.4-160.5-123.9 131.3 1.6 61.3 37.6 505 121 B Y E -o 482 0D 10 -2,-0.4 57,-3.4 52,-0.3 2,-0.3 -0.921 14.7-161.2-108.2 134.5 0.4 64.0 35.1 506 122 B T E -p 562 0E 1 -24,-2.9 -22,-0.4 -2,-0.5 2,-0.3 -0.884 9.6-166.7-119.2 148.6 0.1 67.5 36.3 507 123 B V E -p 563 0E 8 55,-2.6 57,-2.1 -2,-0.3 6,-0.0 -0.902 20.5-136.8-124.8 155.7 -1.7 70.6 35.0 508 124 B L S S+ 0 0 54 -2,-0.3 55,-0.1 55,-0.2 -1,-0.1 0.689 80.7 26.9 -91.7 -16.9 -1.3 74.2 36.1 509 125 B S S > S- 0 0 18 56,-0.1 3,-1.0 1,-0.1 -1,-0.1 -0.976 75.0-116.6-141.7 157.0 -4.9 75.4 36.4 510 126 B P G > S+ 0 0 8 0, 0.0 3,-2.0 0, 0.0 6,-0.2 0.768 108.9 70.4 -61.7 -27.1 -8.4 73.9 37.0 511 127 B D G 3 S+ 0 0 85 1,-0.3 5,-0.1 3,-0.0 0, 0.0 0.880 95.0 55.6 -55.9 -39.8 -9.5 75.0 33.5 512 128 B H G < S+ 0 0 74 -3,-1.0 -1,-0.3 3,-0.1 5,-0.1 0.228 81.7 118.5 -79.5 12.8 -7.2 72.3 32.1 513 129 B L X - 0 0 0 -3,-2.0 3,-1.6 1,-0.1 4,-0.1 -0.649 65.7-139.1 -83.3 135.8 -8.8 69.5 34.2 514 130 B P G > S+ 0 0 4 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.892 105.9 59.1 -57.5 -37.9 -10.5 66.7 32.2 515 131 B S G 3 S+ 0 0 39 1,-0.3 4,-0.1 44,-0.1 -3,-0.1 0.613 97.6 59.2 -67.1 -14.4 -13.3 66.9 34.7 516 132 B E G < S+ 0 0 56 -3,-1.6 -1,-0.3 -6,-0.2 2,-0.2 0.295 96.0 80.4 -97.6 10.3 -14.0 70.5 33.9 517 133 B Q S < S- 0 0 51 -3,-1.7 2,-0.2 -4,-0.1 -5,-0.0 -0.711 89.9 -97.3-111.0 162.8 -14.6 69.6 30.3 518 134 B S > - 0 0 50 -2,-0.2 4,-2.7 1,-0.1 5,-0.3 -0.485 30.7-116.2 -79.0 151.0 -17.8 68.2 28.7 519 135 B Q H > S+ 0 0 121 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.859 119.7 48.5 -53.8 -34.1 -18.1 64.5 28.1 520 136 B A H >> S+ 0 0 62 2,-0.2 4,-1.6 1,-0.2 3,-0.6 0.923 107.0 53.5 -72.6 -44.5 -18.3 65.3 24.4 521 137 B E H 3> S+ 0 0 86 1,-0.3 4,-2.2 2,-0.2 3,-0.4 0.917 105.8 54.7 -55.7 -42.5 -15.3 67.6 24.5 522 138 B R H 3X S+ 0 0 52 -4,-2.7 4,-2.1 1,-0.2 -1,-0.3 0.824 105.1 55.1 -60.9 -29.7 -13.3 64.8 26.1 523 139 B D H S+ 0 0 0 -4,-2.9 4,-2.3 -5,-0.4 5,-0.5 0.940 114.4 41.8 -60.6 -48.3 -5.3 62.5 19.8 530 146 B D H X5S+ 0 0 38 -4,-2.6 4,-1.8 1,-0.2 5,-0.5 0.927 113.8 51.8 -65.7 -45.2 -5.7 59.0 18.6 531 147 B R H <5S+ 0 0 204 -4,-3.4 -1,-0.2 -5,-0.2 -2,-0.2 0.698 114.5 45.7 -64.5 -19.9 -6.2 60.0 15.0 532 148 B L H <5S- 0 0 48 -4,-1.3 -2,-0.2 -3,-0.3 -1,-0.2 0.874 138.2 -5.9 -93.5 -45.2 -3.0 62.1 15.2 533 149 B F H X5S+ 0 0 3 -4,-2.3 4,-2.0 -5,-0.2 -3,-0.2 0.293 96.5 110.6-134.6 9.7 -0.4 59.9 16.9 534 150 B G H X S+ 0 0 144 -5,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.944 111.8 51.3 -57.7 -51.5 -0.7 54.4 15.4 536 152 B A H > S+ 0 0 16 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.850 111.3 50.1 -54.7 -37.8 2.8 55.6 16.1 537 153 B V H >X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 3,-1.0 0.981 111.5 44.5 -65.6 -58.3 2.1 55.1 19.8 538 154 B N H 3X S+ 0 0 39 -4,-2.5 4,-2.0 1,-0.3 -2,-0.2 0.736 108.2 61.2 -59.8 -24.2 0.8 51.5 19.6 539 155 B S H 3X S+ 0 0 69 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.3 0.825 110.2 38.9 -72.4 -33.9 3.7 50.7 17.2 540 156 B H H << S+ 0 0 54 -4,-1.1 -2,-0.2 -3,-1.0 -1,-0.2 0.673 113.1 55.5 -88.9 -20.6 6.3 51.4 19.8 541 157 B R H >X S+ 0 0 0 -4,-1.7 3,-1.0 2,-0.2 4,-0.6 0.906 115.0 40.4 -73.9 -42.3 4.2 49.9 22.6 542 158 B A H >< S+ 0 0 66 -4,-2.0 3,-1.9 1,-0.3 2,-0.5 0.970 106.3 63.6 -66.4 -53.0 4.1 46.8 20.6 543 159 B S T 3< S+ 0 0 80 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.309 117.0 30.7 -57.1 14.2 7.7 47.2 19.6 544 160 B I T <4 S- 0 0 96 -3,-1.0 -1,-0.3 -2,-0.5 -2,-0.2 0.370 122.6 -86.4-152.2 -0.3 8.6 46.8 23.3 545 161 B G S << S+ 0 0 65 -3,-1.9 -3,-0.1 -4,-0.6 -4,-0.1 -0.249 83.2 115.9 125.1 -51.1 6.0 44.5 24.9 546 162 B L - 0 0 20 -5,-0.5 -1,-0.4 -6,-0.2 -2,-0.3 -0.148 63.7-113.2 -58.6 149.2 3.0 46.6 26.0 547 163 B P - 0 0 81 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 -0.404 42.7 -79.4 -80.1 159.3 -0.5 46.0 24.4 548 164 B P - 0 0 105 0, 0.0 2,-0.3 0, 0.0 -10,-0.0 -0.301 46.6-157.0 -63.1 138.0 -2.3 48.6 22.2 549 165 B V - 0 0 28 -15,-0.2 2,-0.3 -3,-0.1 -11,-0.2 -0.783 7.1-161.1-114.6 158.3 -4.1 51.5 23.9 550 166 B E + 0 0 60 -2,-0.3 -23,-0.1 1,-0.2 5,-0.1 -0.924 67.7 45.3-133.3 155.6 -7.0 53.7 22.8 551 167 B H > - 0 0 107 -2,-0.3 4,-2.5 -25,-0.3 3,-0.3 0.974 59.6-175.7 72.6 59.0 -8.1 57.1 24.2 552 168 B L H > S+ 0 0 0 -26,-0.5 4,-2.1 1,-0.2 5,-0.2 0.669 78.4 59.1 -61.5 -20.1 -4.6 58.7 24.3 553 169 B Y H > S+ 0 0 4 2,-0.2 4,-2.4 3,-0.2 5,-0.3 0.929 110.9 39.7 -75.1 -46.1 -6.0 61.8 25.9 554 170 B D H > S+ 0 0 41 -3,-0.3 4,-1.6 1,-0.2 -2,-0.2 0.882 116.2 54.6 -67.8 -35.7 -7.4 59.9 28.9 555 171 B Y H < S+ 0 0 23 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.926 114.5 36.7 -64.2 -47.0 -4.2 57.8 28.9 556 172 B G H < S+ 0 0 0 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.888 120.5 44.1 -75.3 -40.6 -1.8 60.7 29.1 557 173 B Y H < S- 0 0 16 -4,-2.4 -52,-0.3 -5,-0.2 -1,-0.2 0.749 104.0-138.7 -77.4 -21.3 -3.7 63.0 31.4 558 174 B T < - 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0 0 10 -5,-1.5 -1,-0.3 51,-0.2 -18,-0.2 -0.915 58.1-107.4-115.6 145.2 -0.1 93.8 48.0 692 308 B P - 0 0 3 0, 0.0 -18,-1.7 0, 0.0 2,-0.4 -0.314 42.7-157.5 -64.7 154.4 -3.2 95.2 46.2 693 309 B Q E -uv 674 713F 0 19,-0.9 21,-2.3 -20,-0.2 2,-0.5 -0.992 22.4-150.3-144.6 148.9 -3.1 94.6 42.5 694 310 B I E -uv 675 714F 0 -20,-3.2 -18,-3.1 -2,-0.4 2,-0.5 -0.971 20.5-166.7-114.7 120.3 -4.5 95.9 39.2 695 311 B V E -u 676 0F 0 19,-2.2 2,-0.8 -2,-0.5 21,-0.5 -0.941 13.7-149.1-115.2 124.6 -4.8 93.3 36.5 696 312 B V E -u 677 0F 12 -20,-2.0 -18,-1.0 -2,-0.5 21,-0.2 -0.801 30.9-131.0 -88.9 111.7 -5.5 94.2 32.9 697 313 B R - 0 0 63 19,-1.6 21,-0.3 -2,-0.8 -20,-0.0 -0.327 17.4-102.1 -73.5 148.8 -7.5 91.3 31.5 698 314 B R 0 0 67 1,-0.3 20,-0.1 19,-0.1 -1,-0.1 -0.282 360.0 360.0 -62.8 144.8 -6.8 89.4 28.2 699 315 B V 0 0 133 18,-0.1 -1,-0.3 2,-0.0 -2,-0.1 0.516 360.0 360.0 38.4 360.0 -9.0 90.2 25.2 700 ! 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 0.0 701 323 B A > 0 0 55 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 9.7 -10.0 87.3 32.2 702 324 B Y H > + 0 0 56 2,-0.2 4,-1.3 1,-0.2 3,-0.3 0.966 360.0 27.2 -50.4 -77.7 -9.6 84.4 34.6 703 325 B H H > S+ 0 0 36 1,-0.2 4,-2.1 2,-0.2 3,-0.4 0.882 113.3 66.7 -58.1 -41.3 -7.1 85.7 37.3 704 326 B A H > S+ 0 0 0 1,-0.3 4,-0.9 2,-0.2 3,-0.5 0.937 108.6 39.8 -42.8 -56.4 -8.0 89.3 36.7 705 327 B D H X S+ 0 0 56 -4,-1.9 4,-2.7 -3,-0.3 -1,-0.3 0.721 105.5 63.1 -68.0 -27.4 -11.4 88.5 38.1 706 328 B R H X S+ 0 0 55 -4,-1.3 4,-2.3 -3,-0.4 -1,-0.2 0.869 100.4 57.3 -66.4 -32.1 -10.2 86.2 40.9 707 329 B V H <>S+ 0 0 0 -4,-2.1 5,-2.4 -3,-0.5 6,-1.2 0.900 111.6 39.8 -62.9 -41.0 -8.4 89.3 42.2 708 330 B A H <5S+ 0 0 48 -4,-0.9 -2,-0.2 2,-0.2 -1,-0.2 0.845 110.3 58.4 -78.0 -35.0 -11.7 91.1 42.4 709 331 B E H <5S+ 0 0 136 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.926 110.9 43.6 -58.0 -44.4 -13.6 88.0 43.7 710 332 B L T <5S- 0 0 43 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.653 110.5-130.5 -75.4 -14.8 -11.2 88.0 46.6 711 333 B G T 5S+ 0 0 22 -4,-0.4 -3,-0.2 -5,-0.2 30,-0.1 0.807 77.0 115.8 67.7 31.1 -11.6 91.8 46.9 712 334 B V S - 0 0 73 1,-0.1 4,-2.9 -92,-0.0 5,-0.3 -0.411 22.9-113.0 -84.7 163.8 -7.7 104.5 29.7 723 345 B I H > S+ 0 0 70 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.870 122.3 49.7 -63.0 -35.8 -5.9 106.8 32.1 724 346 B D H > S+ 0 0 127 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.919 111.0 48.6 -68.6 -42.3 -9.2 107.3 33.8 725 347 B S H > S+ 0 0 43 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.934 116.5 40.8 -62.6 -49.3 -9.8 103.5 34.0 726 348 B L H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.763 114.5 55.4 -71.3 -25.3 -6.3 102.8 35.4 727 349 B S H X S+ 0 0 32 -4,-1.6 4,-1.8 -5,-0.3 -2,-0.2 0.845 107.6 46.1 -78.2 -34.5 -6.6 105.8 37.7 728 350 B A H X S+ 0 0 62 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.851 113.4 51.2 -74.3 -34.5 -9.8 104.8 39.3 729 351 B A H X S+ 0 0 5 -4,-1.6 4,-3.2 -5,-0.2 3,-0.5 0.947 109.9 48.6 -66.1 -48.0 -8.5 101.3 39.8 730 352 B L H X S+ 0 0 0 -4,-2.0 4,-3.3 1,-0.3 -2,-0.2 0.911 106.4 56.7 -58.5 -43.6 -5.3 102.6 41.4 731 353 B D H < S+ 0 0 108 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.837 112.7 42.5 -58.6 -32.4 -7.3 104.8 43.7 732 354 B T H >< S+ 0 0 63 -4,-1.2 3,-1.7 -3,-0.5 6,-0.3 0.923 112.9 52.2 -77.2 -47.3 -9.1 101.7 44.9 733 355 B A H 3< S+ 0 0 0 -4,-3.2 -2,-0.2 1,-0.3 -3,-0.2 0.899 108.4 50.8 -54.7 -45.3 -6.0 99.6 45.1 734 356 B L T 3< S+ 0 0 30 -4,-3.3 -1,-0.3 -5,-0.2 -2,-0.2 0.458 84.8 116.4 -76.8 2.2 -4.2 102.2 47.2 735 357 B A S X> S- 0 0 23 -3,-1.7 4,-2.2 -5,-0.2 3,-1.2 -0.509 72.2-128.1 -72.5 131.9 -7.2 102.3 49.7 736 358 B P H 3> S+ 0 0 101 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.871 108.0 55.1 -46.5 -44.9 -6.3 101.2 53.2 737 359 B E H 3> S+ 0 0 130 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.829 108.9 47.9 -60.5 -33.8 -9.3 98.7 53.3 738 360 B I H <> S+ 0 0 21 -3,-1.2 4,-2.6 -6,-0.3 -1,-0.2 0.907 110.3 51.2 -73.9 -41.6 -8.0 97.0 50.1 739 361 B R H X S+ 0 0 84 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.894 109.8 51.2 -61.1 -38.3 -4.5 96.8 51.5 740 362 B A H X S+ 0 0 55 -4,-2.5 4,-2.4 -5,-0.3 -1,-0.2 0.877 110.6 48.7 -65.7 -37.3 -5.9 95.2 54.6 741 363 B R H X S+ 0 0 128 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.900 108.9 51.1 -70.2 -39.5 -7.8 92.7 52.5 742 364 B A H X S+ 0 0 1 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.872 111.8 50.3 -64.0 -35.6 -4.7 91.9 50.4 743 365 B T H X S+ 0 0 73 -4,-2.0 4,-1.4 -5,-0.2 -2,-0.2 0.927 109.4 48.8 -67.9 -47.2 -2.9 91.3 53.7 744 366 B T H < S+ 0 0 92 -4,-2.4 3,-0.5 1,-0.2 4,-0.3 0.937 111.5 51.4 -57.7 -47.4 -5.7 89.0 55.1 745 367 B V H >< S+ 0 0 15 -4,-2.6 3,-3.1 1,-0.2 4,-0.4 0.946 104.5 54.9 -56.3 -52.4 -5.6 87.0 51.9 746 368 B A H >< S+ 0 0 18 -4,-2.2 3,-1.5 1,-0.3 -1,-0.2 0.819 97.2 66.0 -52.0 -33.1 -1.9 86.5 51.9 747 369 B D T 3< S+ 0 0 134 -4,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 0.626 103.2 49.0 -65.8 -8.8 -2.2 85.0 55.4 748 370 B T T < S+ 0 0 76 -3,-3.1 2,-0.4 -4,-0.3 -1,-0.3 0.431 87.3 105.8-109.5 -0.9 -4.1 82.2 53.7 749 371 B I < - 0 0 23 -3,-1.5 2,-0.1 -4,-0.4 -183,-0.0 -0.681 61.9-133.6 -90.4 135.8 -1.8 81.4 50.8 750 372 B R - 0 0 145 -2,-0.4 -166,-0.2 1,-0.1 3,-0.1 -0.419 19.8-177.5 -79.5 152.5 0.4 78.2 50.8 751 373 B A + 0 0 81 -2,-0.1 3,-0.1 -168,-0.1 -1,-0.1 0.114 68.6 79.5-136.2 20.4 4.1 78.0 50.0 752 374 B D > + 0 0 51 -170,-0.1 4,-2.6 1,-0.1 5,-0.3 0.029 45.6 122.5-120.5 26.2 4.6 74.3 50.3 753 375 B G H > S+ 0 0 2 -169,-0.6 4,-3.2 1,-0.2 -168,-0.2 0.937 77.6 49.5 -52.9 -54.6 3.2 72.8 47.0 754 376 B T H > S+ 0 0 16 -170,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.821 113.1 48.0 -56.6 -34.5 6.5 71.1 46.0 755 377 B T H > S+ 0 0 48 -3,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.910 112.1 47.6 -73.7 -41.5 6.8 69.5 49.5 756 378 B V H X S+ 0 0 39 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.908 112.8 51.0 -63.7 -39.1 3.2 68.4 49.4 757 379 B A H >X S+ 0 0 0 -4,-3.2 4,-2.2 -5,-0.3 3,-0.6 0.969 110.0 49.9 -59.8 -51.6 3.9 67.0 46.0 758 380 B A H 3X S+ 0 0 1 -4,-2.5 4,-2.9 1,-0.3 5,-0.2 0.925 107.2 52.8 -52.3 -52.1 7.0 65.2 47.3 759 381 B Q H 3X S+ 0 0 117 -4,-3.0 4,-1.8 1,-0.2 -1,-0.3 0.835 109.6 50.5 -56.6 -31.3 5.0 63.7 50.2 760 382 B L H X S+ 0 0 7 -4,-1.7 4,-2.0 2,-0.2 3,-1.7 0.970 109.3 41.3 -60.9 -57.5 3.1 56.5 45.9 765 387 B V H 3X S+ 0 0 20 -4,-2.3 4,-1.9 1,-0.3 -1,-0.2 0.907 109.9 61.3 -56.7 -43.6 6.3 54.5 45.6 766 388 B S H 3< S+ 0 0 93 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.454 118.4 26.3 -65.4 -1.4 5.7 53.2 49.1 767 389 B L H <4 S+ 0 0 154 -3,-1.7 -1,-0.2 -4,-0.2 -2,-0.2 0.499 126.7 39.8-136.7 -14.1 2.5 51.5 48.1 768 390 B E H < 0 0 109 -4,-2.0 -3,-0.2 -3,-0.2 -2,-0.2 0.680 360.0 360.0-110.8 -26.2 2.8 50.8 44.4 769 391 B K < 0 0 93 -4,-1.9 -1,-0.2 -5,-0.4 -268,-0.1 -0.552 360.0 360.0 -97.3 360.0 6.4 49.7 44.0 770 !* 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 0.0 771 1 C X 0 0 146 0, 0.0 -239,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-127.5 -4.8 69.4 16.4 772 2 C X + 0 0 31 2,-0.1 -239,-0.1 -240,-0.1 -240,-0.1 0.321 360.0 78.5 132.2 -10.3 -4.5 66.8 19.2 773 3 C N S S- 0 0 3 1,-0.3 -287,-2.7 -319,-0.2 2,-0.5 0.734 75.0-140.1-102.6 -28.0 -1.0 67.4 20.9 774 4 C X + 0 0 57 -289,-0.2 2,-0.3 -288,-0.1 -1,-0.3 -0.881 27.2 170.5 108.9-136.5 -1.2 70.4 23.2 775 5 C X - 0 0 8 -2,-0.5 -290,-0.4 -383,-0.2 -383,-0.1 -0.920 41.3-151.6 161.5-143.2 1.6 72.9 23.5 776 6 C X 0 0 120 -2,-0.3 -382,-1.2 -383,-0.2 -1,-0.2 0.409 360.0 360.0-103.2 116.8 2.3 75.7 24.8 777 7 C X 0 0 175 -3,-0.2 -334,-0.3 -384,-0.1 -384,-0.1 0.347 360.0 360.0 -50.2 360.0 4.9 76.8 22.2