==== 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 LYASE 20-NOV-06 2NXW . COMPND 2 MOLECULE: PHENYL-3-PYRUVATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AZOSPIRILLUM BRASILENSE; . AUTHOR W.VERSEES,S.SPAEPEN,J.VANDERLEYDEN,J.STEYAERT . 1066 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36582.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 769 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 139 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 2.8 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 . 4 0.4 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 . 3 0.3 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 . 99 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 128 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 323 30.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.0 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 5 3 5 3 2 3 3 7 1 4 0 4 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 4 7 3 8 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 5 1 3 1 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 . 1 0 0 0 4 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 -6 A L 0 0 210 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 143.0 27.4 32.8 -0.6 2 -5 A V - 0 0 116 1,-0.1 170,-0.1 136,-0.0 135,-0.0 -0.517 360.0-105.5 -67.8 130.3 25.0 33.1 2.3 3 -4 A P + 0 0 24 0, 0.0 2,-0.3 0, 0.0 168,-0.3 -0.241 46.6 168.8 -60.8 144.4 22.2 30.6 1.8 4 -3 A R + 0 0 103 166,-0.1 166,-0.0 -3,-0.1 169,-0.0 -0.959 50.4 27.6-156.0 135.6 18.8 31.9 0.7 5 -2 A G S S+ 0 0 42 -2,-0.3 168,-0.0 168,-0.0 167,-0.0 0.321 73.0 109.1 101.6 -9.6 15.6 30.1 -0.6 6 -1 A S - 0 0 42 2,-0.2 3,-0.1 1,-0.1 167,-0.0 0.730 69.1-143.3 -72.5 -21.0 15.6 26.6 0.9 7 0 A H + 0 0 162 1,-0.2 2,-0.4 166,-0.0 -1,-0.1 0.807 64.2 117.2 60.6 28.9 12.7 27.6 3.2 8 1 A M - 0 0 36 164,-0.2 164,-2.3 161,-0.0 -1,-0.2 -0.969 60.8-139.1-131.9 117.8 14.4 25.4 5.8 9 2 A K B > -A 171 0A 77 -2,-0.4 4,-2.6 162,-0.2 5,-0.2 -0.408 24.0-118.1 -70.8 148.7 15.7 26.9 9.1 10 3 A L H > S+ 0 0 0 160,-1.9 4,-2.2 157,-0.4 159,-0.2 0.916 116.5 51.4 -53.1 -46.6 19.1 25.6 10.4 11 4 A A H > S+ 0 0 0 157,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.890 110.2 49.0 -59.7 -39.8 17.4 24.2 13.5 12 5 A E H > S+ 0 0 33 156,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.901 109.3 52.1 -65.9 -42.5 14.8 22.4 11.4 13 6 A A H X S+ 0 0 2 -4,-2.6 4,-2.1 2,-0.2 162,-0.2 0.884 111.3 47.9 -61.1 -39.4 17.5 20.9 9.1 14 7 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.940 111.3 48.6 -68.0 -47.6 19.3 19.6 12.2 15 8 A L H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.909 113.7 48.3 -59.4 -40.6 16.2 18.1 13.8 16 9 A R H X S+ 0 0 117 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.893 108.7 53.0 -67.1 -39.2 15.4 16.4 10.4 17 10 A A H X S+ 0 0 1 -4,-2.1 4,-0.9 2,-0.2 -1,-0.2 0.869 110.5 48.5 -63.0 -36.7 19.0 15.1 10.1 18 11 A L H ><>S+ 0 0 0 -4,-2.2 5,-2.3 2,-0.2 3,-0.6 0.927 111.6 48.2 -69.5 -44.2 18.7 13.5 13.5 19 12 A K H ><5S+ 0 0 121 -4,-2.3 3,-1.9 1,-0.2 -2,-0.2 0.889 106.5 57.9 -62.9 -38.3 15.3 12.0 12.7 20 13 A D H 3<5S+ 0 0 121 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.790 107.0 50.1 -60.4 -28.7 16.8 10.6 9.4 21 14 A R T <<5S- 0 0 20 -4,-0.9 51,-0.5 -3,-0.6 -1,-0.3 0.257 130.4 -91.6 -95.7 10.5 19.4 8.8 11.6 22 15 A G T < 5 + 0 0 31 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.1 0.356 67.8 155.6 101.2 -5.8 16.9 7.3 13.9 23 16 A A < - 0 0 6 -5,-2.3 -1,-0.3 1,-0.1 50,-0.1 -0.270 20.2-171.4 -56.7 140.1 16.5 9.8 16.8 24 17 A Q - 0 0 85 48,-0.5 2,-0.3 1,-0.3 -1,-0.1 0.508 59.2 -2.2-113.6 -9.0 13.2 9.3 18.5 25 18 A A - 0 0 5 22,-0.2 2,-0.4 37,-0.1 -1,-0.3 -0.979 56.8-127.1-169.2 167.9 13.0 12.3 20.9 26 19 A M E -b 49 0B 0 22,-2.7 24,-2.9 -2,-0.3 2,-0.3 -0.991 20.4-162.3-131.7 122.5 14.9 15.3 22.2 27 20 A F E +bc 50 75B 1 47,-2.7 49,-3.2 -2,-0.4 2,-0.3 -0.792 28.7 134.8 -99.4 146.2 15.3 15.8 25.9 28 21 A G E -bc 51 76B 0 22,-1.9 24,-0.9 -2,-0.3 49,-0.2 -0.991 48.3-131.5-177.8 169.1 16.3 19.2 27.2 29 22 A I - 0 0 4 47,-1.8 49,-0.2 -2,-0.3 24,-0.1 -0.989 36.3-138.3-133.9 124.4 16.1 22.2 29.5 30 23 A P + 0 0 8 0, 0.0 2,-0.3 0, 0.0 48,-0.2 -0.193 22.9 172.4 -79.8 172.9 15.9 25.7 27.9 31 24 A G >> - 0 0 8 46,-0.1 3,-1.2 1,-0.1 4,-1.1 -0.934 51.9 -76.3-166.1 169.7 17.6 29.0 28.7 32 25 A D G >4 S+ 0 0 75 -2,-0.3 3,-1.0 1,-0.3 74,-0.1 0.881 128.4 44.7 -42.0 -56.8 17.9 32.4 27.1 33 26 A F G 34 S+ 0 0 56 1,-0.2 73,-0.7 46,-0.2 -1,-0.3 0.725 118.3 44.9 -66.6 -20.4 20.4 31.5 24.5 34 27 A A G <> S+ 0 0 1 -3,-1.2 4,-2.3 71,-0.2 -1,-0.2 0.467 83.3 97.2-102.0 -2.2 18.5 28.3 23.6 35 28 A L H S+ 0 0 30 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.899 111.7 48.8 -58.0 -39.4 14.8 30.2 19.7 37 30 A F H > S+ 0 0 7 -3,-0.2 4,-2.3 -4,-0.2 -2,-0.2 0.918 110.7 48.9 -66.5 -43.7 16.0 26.6 19.2 38 31 A F H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.843 106.9 58.2 -66.0 -29.8 13.4 25.2 21.6 39 32 A K H X S+ 0 0 69 -4,-2.1 4,-2.7 -5,-0.2 5,-0.3 0.924 107.4 46.1 -64.3 -45.5 10.7 27.2 19.8 40 33 A V H X S+ 0 0 6 -4,-1.7 4,-2.7 1,-0.2 5,-0.4 0.934 113.0 50.4 -63.2 -44.1 11.5 25.5 16.5 41 34 A A H X S+ 0 0 1 -4,-2.3 4,-1.8 1,-0.2 5,-0.3 0.930 115.0 42.5 -60.1 -45.0 11.5 22.1 18.2 42 35 A E H < S+ 0 0 36 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.900 118.0 44.3 -69.3 -42.2 8.2 22.7 19.9 43 36 A E H < S+ 0 0 118 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.888 120.8 37.9 -72.4 -38.3 6.5 24.3 16.9 44 37 A T H < S- 0 0 44 -4,-2.7 -2,-0.2 -5,-0.3 -1,-0.2 0.773 82.9-157.3 -83.8 -27.7 7.7 21.8 14.3 45 38 A Q < + 0 0 111 -4,-1.8 -3,-0.1 -5,-0.4 -4,-0.1 0.825 38.7 148.1 53.0 34.0 7.5 18.7 16.4 46 39 A I S S+ 0 0 12 -5,-0.3 -1,-0.1 -6,-0.3 -5,-0.1 0.905 77.5 19.1 -63.3 -38.8 10.0 17.0 14.2 47 40 A L S S- 0 0 4 -6,-0.3 -1,-0.2 -21,-0.0 -22,-0.2 -0.984 101.7-100.1-129.1 139.1 11.2 15.1 17.3 48 41 A P - 0 0 56 0, 0.0 -22,-2.7 0, 0.0 2,-0.6 -0.412 40.0-137.1 -58.6 132.5 9.0 14.8 20.4 49 42 A L E -b 26 0B 29 -24,-0.2 2,-0.5 -8,-0.1 -22,-0.2 -0.861 24.2-178.5-101.3 117.9 10.3 17.4 22.9 50 43 A H E -b 27 0B 32 -24,-2.9 -22,-1.9 -2,-0.6 2,-0.3 -0.955 8.2-160.2-118.5 120.5 10.6 16.2 26.5 51 44 A T E -b 28 0B 10 -2,-0.5 2,-0.2 -24,-0.2 -22,-0.2 -0.654 7.4-169.4 -96.9 154.9 11.8 18.5 29.3 52 45 A L - 0 0 1 -24,-0.9 3,-0.1 -2,-0.3 386,-0.0 -0.724 30.5-109.6-128.6-178.8 13.2 17.4 32.6 53 46 A S S S+ 0 0 0 -2,-0.2 2,-0.3 1,-0.2 914,-0.1 0.894 93.5 21.3 -82.7 -42.7 14.0 19.1 35.8 54 47 A H S >> S- 0 0 6 912,-0.1 4,-1.0 381,-0.1 3,-0.9 -0.966 75.6-118.5-132.8 144.1 17.8 19.1 36.0 55 48 A E H 3> S+ 0 0 10 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.783 107.9 65.2 -55.7 -33.5 20.5 18.8 33.3 56 49 A P H 3> S+ 0 0 2 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.952 104.7 48.4 -54.8 -42.5 22.0 15.5 34.6 57 50 A A H <> S+ 0 0 1 -3,-0.9 4,-2.6 1,-0.2 5,-0.2 0.815 105.4 57.7 -65.0 -32.8 18.7 13.9 33.8 58 51 A V H X S+ 0 0 0 -4,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.955 112.1 41.9 -61.8 -46.7 18.6 15.4 30.3 59 52 A G H X S+ 0 0 1 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.924 116.3 47.0 -66.1 -45.5 21.9 13.7 29.6 60 53 A F H X S+ 0 0 6 -4,-2.7 4,-2.8 -5,-0.2 -1,-0.2 0.884 112.8 49.8 -64.4 -39.9 21.1 10.4 31.2 61 54 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.918 111.8 47.9 -65.9 -43.1 17.7 10.2 29.5 62 55 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.902 112.5 49.7 -64.2 -40.9 19.2 11.0 26.1 63 56 A D H X S+ 0 0 2 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.951 111.5 48.9 -60.8 -49.3 21.9 8.3 26.7 64 57 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.875 109.3 51.9 -59.1 -40.1 19.2 5.8 27.8 65 58 A A H X S+ 0 0 6 -4,-2.4 4,-1.7 2,-0.2 6,-0.3 0.897 110.2 49.5 -63.7 -39.7 17.1 6.6 24.7 66 59 A A H X>S+ 0 0 2 -4,-2.1 5,-1.7 1,-0.2 4,-1.0 0.939 114.1 44.9 -64.3 -45.7 20.2 6.0 22.5 67 60 A R H <5S+ 0 0 18 -4,-2.6 3,-0.3 1,-0.2 -2,-0.2 0.889 108.3 58.2 -65.7 -39.4 20.9 2.7 24.2 68 61 A Y H <5S+ 0 0 71 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.903 123.4 20.7 -58.8 -44.5 17.3 1.6 24.1 69 62 A S H <5S- 0 0 44 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.273 101.9-119.5-109.8 9.8 17.0 1.8 20.3 70 63 A S T <5S+ 0 0 53 -4,-1.0 2,-0.2 -3,-0.3 -3,-0.2 0.927 80.1 105.3 49.2 50.8 20.7 1.6 19.4 71 64 A T S - 0 0 18 -2,-0.2 5,-1.4 -49,-0.2 28,-0.1 -0.692 47.6 -82.4-104.4 161.1 21.5 26.3 27.1 79 72 A Y T > 5S+ 0 0 63 -2,-0.3 3,-0.6 3,-0.2 2,-0.4 -0.252 93.5 0.1 -62.5 143.6 24.9 28.0 27.2 80 73 A G T 3>5S+ 0 0 15 1,-0.2 4,-2.7 2,-0.1 3,-0.3 -0.669 130.4 18.4 87.6-130.8 26.9 28.2 30.4 81 74 A A H 3>5S+ 0 0 15 -2,-0.4 4,-2.1 853,-0.4 -1,-0.2 0.852 123.7 56.5 -47.2 -45.2 25.6 26.6 33.5 82 75 A G H <45S+ 0 0 5 -3,-0.6 -1,-0.2 1,-0.2 -3,-0.2 0.947 113.3 38.9 -55.0 -51.7 23.1 24.4 31.7 83 76 A A H >4< S+ 0 0 4 -4,-2.7 3,-1.2 1,-0.3 540,-0.4 0.825 101.7 63.1 -62.4 -28.3 28.3 22.5 32.2 85 78 A N T 3< S+ 0 0 8 -4,-2.1 -1,-0.3 -5,-0.3 4,-0.2 0.510 102.2 50.5 -73.7 -5.5 25.7 20.8 34.4 86 79 A M T <> S+ 0 0 0 -3,-2.0 4,-2.2 -4,-0.1 -1,-0.2 0.337 77.7 101.6-112.6 5.2 25.5 17.9 31.8 87 80 A V H <> S+ 0 0 0 -3,-1.2 4,-2.5 -4,-0.3 5,-0.2 0.898 82.1 49.6 -57.0 -44.2 29.3 17.2 31.6 88 81 A N H > S+ 0 0 4 532,-0.5 4,-2.5 -4,-0.3 -1,-0.2 0.946 110.3 48.4 -63.3 -48.4 29.1 14.2 33.8 89 82 A A H > S+ 0 0 2 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.896 113.9 48.3 -59.9 -37.8 26.2 12.5 32.0 90 83 A V H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.904 109.1 51.7 -70.0 -39.9 28.0 13.1 28.7 91 84 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.897 109.3 52.2 -62.1 -38.5 31.3 11.7 30.0 92 85 A G H X S+ 0 0 4 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.896 108.7 49.2 -63.6 -40.1 29.3 8.6 31.1 93 86 A A H <>S+ 0 0 0 -4,-1.8 5,-2.7 2,-0.2 -2,-0.2 0.905 112.0 49.1 -65.5 -41.1 27.8 8.2 27.6 94 87 A Y H ><5S+ 0 0 46 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.959 109.6 52.3 -61.9 -47.9 31.3 8.5 26.1 95 88 A A H 3<5S+ 0 0 1 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.814 115.7 40.1 -57.8 -33.8 32.7 6.0 28.6 96 89 A E T 3<5S- 0 0 2 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.089 114.3-110.3-108.5 24.4 30.0 3.5 27.6 97 90 A K T < 5 + 0 0 0 -3,-1.7 -3,-0.2 1,-0.2 60,-0.2 0.880 64.2 148.1 53.0 51.6 29.9 4.1 23.9 98 91 A S < - 0 0 0 -5,-2.7 2,-1.6 -6,-0.1 -1,-0.2 -0.967 46.6-132.4-118.5 121.4 26.5 5.8 23.6 99 92 A P + 0 0 11 0, 0.0 -26,-2.5 0, 0.0 2,-0.6 -0.514 32.5 172.8 -77.8 82.8 26.1 8.4 20.9 100 93 A V E -d 73 0B 1 -2,-1.6 59,-1.9 -28,-0.2 2,-0.8 -0.800 24.2-145.7 -91.1 124.2 24.4 11.3 22.7 101 94 A V E -de 74 159B 0 -28,-3.1 -26,-2.5 -2,-0.6 2,-0.5 -0.831 13.7-156.4 -91.7 110.4 24.2 14.4 20.4 102 95 A V E -de 75 160B 0 57,-2.9 59,-2.9 -2,-0.8 2,-0.5 -0.795 9.5-171.8 -89.8 125.8 24.6 17.4 22.7 103 96 A I E -de 76 161B 3 -28,-2.6 -26,-2.4 -2,-0.5 2,-0.4 -0.968 5.6-174.0-121.0 113.3 23.1 20.6 21.3 104 97 A S E -de 77 162B 1 57,-2.8 59,-2.9 -2,-0.5 -26,-0.2 -0.896 21.2-132.1-111.5 138.6 23.8 23.8 23.1 105 98 A G E - e 0 163B 6 -28,-2.0 -71,-0.2 -2,-0.4 -72,-0.1 -0.348 33.0-175.3 -72.3 165.7 22.4 27.2 22.5 106 99 A A E - e 0 164B 2 57,-1.2 59,-2.6 -73,-0.7 60,-0.1 -0.980 32.4 -72.2-158.3 163.7 25.1 30.0 22.4 107 100 A P - 0 0 19 0, 0.0 -74,-0.0 0, 0.0 59,-0.0 -0.243 64.5 -90.4 -58.5 151.4 25.4 33.8 22.1 108 101 A G > - 0 0 4 56,-0.2 3,-2.2 1,-0.1 28,-0.0 -0.244 37.5-108.2 -61.4 153.7 24.7 35.2 18.6 109 102 A T T 3 S+ 0 0 52 1,-0.3 -1,-0.1 -3,-0.1 27,-0.0 0.697 120.1 46.0 -58.5 -20.3 27.6 35.5 16.2 110 103 A T T 3 S+ 0 0 125 2,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.200 104.6 72.1-108.4 16.7 27.6 39.2 16.6 111 104 A E < 0 0 88 -3,-2.2 -2,-0.1 1,-0.1 0, 0.0 0.441 360.0 360.0 -96.2-125.9 27.3 39.3 20.4 112 105 A G 0 0 73 -4,-0.0 -1,-0.1 703,-0.0 -2,-0.0 -0.926 360.0 360.0 163.0 360.0 30.0 38.4 22.9 113 ! 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 0.0 114 108 A G 0 0 94 0, 0.0 699,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 36.7 33.6 36.7 29.5 115 109 A L + 0 0 31 818,-0.1 2,-0.1 697,-0.1 819,-0.1 0.765 360.0 44.8 -82.8 -27.5 33.2 35.3 33.0 116 110 A L 0 0 30 1,-0.1 545,-0.1 515,-0.0 544,-0.0 -0.336 360.0 360.0-107.2-170.6 35.5 32.2 32.6 117 111 A L 0 0 135 543,-0.6 545,-0.1 -2,-0.1 -1,-0.1 -0.497 360.0 360.0 97.6 360.0 38.9 31.4 31.1 118 ! 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 0.0 119 119 A D > 0 0 70 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 150.1 35.9 29.3 24.6 120 120 A T H > + 0 0 6 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.881 360.0 50.5 -51.1 -47.3 35.8 27.4 27.9 121 121 A Q H > S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.938 111.8 45.9 -61.9 -47.8 32.6 25.5 27.1 122 122 A F H > S+ 0 0 39 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.926 112.5 52.6 -60.7 -42.6 33.8 24.3 23.8 123 123 A Q H < S+ 0 0 87 -4,-2.6 4,-0.5 1,-0.2 -1,-0.2 0.836 110.4 47.2 -63.1 -35.2 37.2 23.3 25.3 124 124 A V H >< S+ 0 0 0 -4,-2.1 3,-1.2 -5,-0.2 4,-0.4 0.939 113.0 47.5 -72.4 -46.0 35.5 21.3 28.0 125 125 A F H >< S+ 0 0 0 -4,-2.6 3,-1.3 1,-0.3 4,-0.3 0.820 100.5 65.7 -67.1 -26.6 33.2 19.4 25.7 126 126 A K T 3< S+ 0 0 31 -4,-2.1 3,-0.5 1,-0.3 -1,-0.3 0.771 97.1 58.9 -63.9 -23.2 35.9 18.6 23.2 127 127 A E T < S+ 0 0 72 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.682 112.7 36.0 -78.5 -18.7 37.4 16.4 26.0 128 128 A I S < S+ 0 0 0 -3,-1.3 2,-0.3 -4,-0.4 -1,-0.2 0.115 109.8 63.9-124.1 22.5 34.3 14.3 26.3 129 129 A T - 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0 0 14 -4,-1.2 70,-0.1 -5,-0.2 68,-0.0 -0.361 62.8-150.6 -66.0 141.2 37.9 63.7 35.4 736 203 B T S S+ 0 0 128 1,-0.2 -1,-0.1 -2,-0.1 67,-0.1 0.783 97.9 22.7 -81.1 -26.1 34.9 66.0 35.3 737 204 B S S S- 0 0 42 65,-0.1 68,-0.6 2,-0.0 67,-0.6 -0.543 80.6-179.2-140.0 73.7 32.8 63.2 36.7 738 205 B P E -a 805 0J 22 0, 0.0 2,-0.4 0, 0.0 68,-0.2 -0.423 4.4-170.8 -72.8 147.7 34.8 60.7 38.6 739 206 B V E -a 806 0J 0 66,-2.4 68,-2.9 25,-0.1 2,-0.7 -0.995 14.9-148.7-142.0 131.7 33.1 57.7 40.2 740 207 B L E -ab 807 766J 0 25,-3.0 27,-2.3 -2,-0.4 2,-0.5 -0.905 14.1-164.1-102.6 115.7 34.4 55.1 42.6 741 208 B M E -ab 808 767J 0 66,-3.0 68,-2.0 -2,-0.7 2,-0.6 -0.880 6.7-152.1-100.0 126.9 32.8 51.7 42.2 742 209 B V E +ab 809 768J 0 25,-2.4 27,-1.5 -2,-0.5 2,-0.2 -0.889 29.7 172.5-101.0 124.3 33.3 49.3 45.1 743 210 B C >> - 0 0 0 66,-1.9 3,-1.5 -2,-0.6 4,-1.0 -0.483 42.9 -64.6-126.2-170.4 33.1 45.7 43.9 744 211 B V H >> S+ 0 0 1 1,-0.3 4,-2.6 2,-0.2 3,-0.6 0.828 119.2 56.6 -50.7 -45.2 33.6 42.0 44.5 745 212 B E H 3> S+ 0 0 1 65,-2.1 4,-2.5 1,-0.2 6,-0.3 0.811 98.7 62.9 -61.1 -27.3 37.3 41.9 45.1 746 213 B V H <4>S+ 0 0 0 -3,-1.5 5,-2.5 63,-0.4 6,-0.4 0.926 111.2 38.3 -61.4 -42.1 37.0 44.5 47.9 747 214 B R H X<5S+ 0 0 62 -4,-1.0 3,-1.6 -3,-0.6 -2,-0.2 0.951 114.8 53.1 -72.8 -48.1 34.9 42.0 49.8 748 215 B R H 3<5S+ 0 0 22 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.866 113.9 42.0 -56.9 -39.6 36.9 38.9 48.9 749 216 B Y T 3<5S- 0 0 65 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.342 111.1-118.0 -91.8 7.6 40.2 40.4 50.0 750 217 B G T < 5 + 0 0 44 -3,-1.6 3,-0.3 -4,-0.1 4,-0.2 0.864 68.0 139.6 60.8 39.3 38.7 41.9 53.2 751 218 B L >< + 0 0 17 -5,-2.5 4,-2.7 -6,-0.3 5,-0.3 0.180 24.8 114.9 -99.1 17.6 39.5 45.5 52.2 752 219 B E H > S+ 0 0 73 -6,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.914 78.8 44.9 -54.6 -48.9 36.3 47.1 53.4 753 220 B A H > S+ 0 0 81 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.933 115.5 47.2 -62.5 -45.9 38.0 49.2 56.1 754 221 B K H > S+ 0 0 94 1,-0.2 4,-2.3 -4,-0.2 -1,-0.2 0.876 113.7 47.9 -63.1 -39.0 40.8 50.4 53.8 755 222 B V H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.800 106.1 56.9 -75.1 -27.2 38.4 51.2 51.0 756 223 B A H X S+ 0 0 16 -4,-2.0 4,-2.0 -5,-0.3 -1,-0.2 0.922 110.6 46.1 -66.2 -41.1 36.1 53.1 53.4 757 224 B E H X S+ 0 0 63 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.929 112.3 49.6 -65.1 -45.8 39.2 55.2 54.1 758 225 B L H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.921 109.7 51.7 -59.0 -45.1 40.1 55.6 50.5 759 226 B A H X S+ 0 0 0 -4,-2.7 4,-1.3 1,-0.2 5,-0.3 0.899 109.9 49.0 -61.4 -40.6 36.5 56.6 49.6 760 227 B Q H < S+ 0 0 23 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.943 116.7 41.5 -65.4 -44.6 36.5 59.3 52.3 761 228 B R H < S+ 0 0 66 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.824 110.2 56.2 -72.0 -33.1 39.9 60.7 51.2 762 229 B L H < S- 0 0 25 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.806 89.5-152.6 -70.2 -30.9 39.2 60.5 47.4 763 230 B G < + 0 0 40 -4,-1.3 -3,-0.1 -5,-0.2 -4,-0.1 0.610 47.7 122.9 69.8 16.0 36.1 62.6 47.7 764 231 B V S S- 0 0 17 -5,-0.3 -1,-0.2 1,-0.1 -25,-0.1 -0.685 71.7 -79.4-107.2 161.3 34.2 61.2 44.7 765 232 B P - 0 0 51 0, 0.0 -25,-3.0 0, 0.0 2,-0.4 -0.303 44.2-141.9 -59.1 139.4 30.8 59.6 44.6 766 233 B V E +b 740 0J 3 16,-0.3 18,-3.3 -27,-0.2 19,-0.5 -0.872 23.9 170.5-107.5 134.3 30.7 55.9 45.6 767 234 B V E -b 741 0J 0 -27,-2.3 -25,-2.4 -2,-0.4 2,-0.3 -0.976 21.2-138.5-137.2 146.7 28.5 53.3 43.9 768 235 B T E -bc 742 786J 2 17,-2.3 19,-3.0 -2,-0.3 -25,-0.2 -0.765 11.0-131.3-106.5 158.4 28.5 49.5 44.4 769 236 B T > - 0 0 2 -27,-1.5 3,-1.6 -2,-0.3 4,-0.3 -0.469 42.2 -92.7 -90.7 174.5 28.3 46.8 41.7 770 237 B F G > S+ 0 0 11 48,-0.6 3,-1.4 17,-0.4 49,-0.1 0.927 130.3 45.4 -55.8 -46.8 25.8 43.9 42.3 771 238 B M G 3 S+ 0 0 17 1,-0.3 -1,-0.3 41,-0.1 -24,-0.1 0.447 108.7 57.9 -79.0 3.4 28.4 41.8 43.9 772 239 B G G X S+ 0 0 0 -3,-1.6 3,-2.5 -30,-0.1 -1,-0.3 0.278 76.3 143.7-108.9 5.8 29.6 44.8 46.0 773 240 B R T < + 0 0 43 -3,-1.4 155,-0.2 1,-0.3 3,-0.1 -0.180 69.5 16.2 -49.1 130.0 26.1 45.2 47.5 774 241 B G T > S+ 0 0 49 1,-0.3 3,-1.4 153,-0.1 -1,-0.3 0.239 89.2 139.4 89.5 -14.0 26.3 46.3 51.1 775 242 B L T < S+ 0 0 4 -3,-2.5 -1,-0.3 1,-0.3 -33,-0.1 -0.383 72.8 8.0 -67.1 142.7 29.9 47.4 51.0 776 243 B L T > S+ 0 0 12 6,-0.1 3,-1.5 -3,-0.1 -1,-0.3 0.684 81.0 140.0 61.8 20.9 30.8 50.5 52.8 777 244 B A T < S+ 0 0 51 -3,-1.4 -2,-0.1 1,-0.3 -1,-0.1 0.860 80.1 38.5 -60.6 -34.4 27.3 50.7 54.4 778 245 B D T 3 S+ 0 0 149 -4,-0.2 -1,-0.3 3,-0.1 -2,-0.1 0.197 96.9 117.9-100.7 16.1 28.9 51.8 57.6 779 246 B A S < S- 0 0 3 -3,-1.5 -22,-0.0 1,-0.1 -26,-0.0 -0.397 79.7-111.1 -82.7 159.5 31.5 54.0 55.9 780 247 B P S S+ 0 0 39 0, 0.0 88,-2.3 0, 0.0 89,-0.6 0.856 119.1 30.1 -55.5 -36.0 31.9 57.8 56.3 781 248 B T S S- 0 0 4 86,-0.2 3,-0.1 -25,-0.2 -3,-0.1 -0.724 89.1-165.3-126.4 81.2 30.7 58.1 52.7 782 249 B P - 0 0 13 0, 0.0 -16,-0.3 0, 0.0 -5,-0.2 -0.194 36.6 -76.3 -63.7 157.2 28.4 55.2 52.0 783 250 B P - 0 0 22 0, 0.0 -16,-0.2 0, 0.0 3,-0.1 -0.171 27.0-136.9 -56.0 144.6 27.4 54.3 48.4 784 251 B L S S- 0 0 88 -18,-3.3 2,-0.3 1,-0.3 -17,-0.2 0.772 76.1 -59.1 -69.9 -25.7 24.8 56.4 46.7 785 252 B G - 0 0 23 -19,-0.5 -17,-2.3 11,-0.1 2,-0.4 -0.976 61.9 -69.8 168.7-172.2 23.3 53.1 45.5 786 253 B T B -c 768 0J 42 -2,-0.3 2,-0.5 -19,-0.2 7,-0.4 -0.935 33.6-138.1-115.6 131.6 23.9 49.9 43.6 787 254 B Y + 0 0 1 -19,-3.0 -17,-0.4 -2,-0.4 3,-0.1 -0.744 34.1 155.8 -87.7 127.0 24.4 49.7 39.8 788 255 B I > - 0 0 16 -2,-0.5 3,-0.5 1,-0.5 2,-0.2 0.082 52.3-110.2-136.9 21.2 22.6 46.7 38.3 789 256 B G G > S- 0 0 4 1,-0.2 3,-2.0 29,-0.2 -1,-0.5 -0.495 77.7 -8.4 87.5-154.6 22.1 47.9 34.7 790 257 B V G 3 S+ 0 0 73 1,-0.3 -1,-0.2 27,-0.2 7,-0.1 0.767 130.3 56.3 -52.9 -33.5 18.8 48.8 33.0 791 258 B A G < S+ 0 0 1 -3,-0.5 -1,-0.3 26,-0.1 274,-0.1 0.499 95.8 84.6 -81.7 -2.0 16.6 47.7 35.9 792 259 B G S < S- 0 0 16 -3,-2.0 2,-0.2 1,-0.2 -5,-0.1 -0.137 97.9 -52.4 -90.5-172.2 18.3 49.9 38.5 793 260 B D > - 0 0 96 -7,-0.4 4,-2.6 1,-0.1 3,-0.2 -0.432 47.9-138.5 -61.9 125.7 17.9 53.5 39.6 794 261 B A H > S+ 0 0 80 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.850 101.1 52.2 -55.1 -40.9 18.1 55.7 36.5 795 262 B E H > S+ 0 0 165 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.897 112.1 45.8 -65.3 -40.9 20.3 58.3 38.2 796 263 B I H > S+ 0 0 11 -3,-0.2 4,-2.2 2,-0.2 5,-0.2 0.920 111.2 52.5 -67.3 -45.1 22.8 55.7 39.3 797 264 B T H X S+ 0 0 20 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.928 113.0 44.3 -56.8 -46.5 22.9 54.0 35.9 798 265 B R H X S+ 0 0 157 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.895 109.1 56.2 -66.9 -40.8 23.6 57.4 34.2 799 266 B L H < S+ 0 0 40 -4,-2.1 4,-0.3 -5,-0.2 -1,-0.2 0.911 114.7 39.8 -57.6 -42.7 26.2 58.4 36.8 800 267 B V H >< S+ 0 0 1 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.960 118.5 44.6 -71.4 -52.5 28.1 55.2 36.1 801 268 B E H 3< S+ 0 0 54 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.758 116.7 45.0 -67.6 -24.7 27.7 55.0 32.4 802 269 B E T 3< S+ 0 0 118 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.373 84.4 122.4 -99.7 2.5 28.5 58.7 31.8 803 270 B S < - 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0 0 9 6,-1.8 -2,-0.0 -2,-0.4 5,-0.0 -0.970 62.5-111.3-170.3 165.8 30.6 41.0 31.7 815 282 B D S S+ 0 0 98 -2,-0.3 6,-0.1 6,-0.1 -2,-0.0 0.262 74.6 125.1 -90.8 12.0 27.6 41.5 29.5 816 283 B T S > S- 0 0 33 4,-0.1 3,-1.1 1,-0.1 -2,-0.2 -0.322 77.8 -97.3 -67.9 156.9 25.5 39.6 31.9 817 284 B N T 3 S+ 0 0 44 1,-0.2 -27,-0.2 116,-0.1 -26,-0.1 0.873 115.2 30.3 -39.1 -69.9 22.3 41.4 33.2 818 285 B F T 3 S+ 0 0 6 114,-0.6 -48,-0.6 -29,-0.1 -1,-0.2 0.421 101.7 97.2 -78.9 -0.7 23.5 42.9 36.6 819 286 B A S < S- 0 0 4 -3,-1.1 2,-0.5 -31,-0.1 -6,-0.1 -0.465 83.2-102.0 -92.3 162.4 27.1 43.4 35.8 820 287 B V B -g 813 0K 0 -8,-0.6 -6,-1.8 -2,-0.1 2,-0.4 -0.707 45.5-151.2 -76.6 126.2 29.0 46.4 34.6 821 288 B S >> - 0 0 6 -2,-0.5 3,-1.6 -8,-0.2 4,-0.5 -0.851 19.0-136.0-107.0 139.2 29.5 45.8 30.9 822 289 B Q G >4 S+ 0 0 40 -2,-0.4 3,-0.5 1,-0.3 5,-0.2 0.785 105.2 59.5 -61.0 -26.6 32.4 47.1 28.8 823 290 B R G 34 S+ 0 0 102 1,-0.2 -1,-0.3 3,-0.1 -8,-0.0 0.615 104.3 49.5 -79.2 -11.1 30.0 48.1 26.0 824 291 B K G <4 S+ 0 0 62 -3,-1.6 2,-0.2 2,-0.0 -1,-0.2 0.473 105.6 62.5-105.4 -3.1 28.1 50.5 28.3 825 292 B I S << S- 0 0 16 -3,-0.5 2,-1.0 -4,-0.5 -24,-0.1 -0.723 91.0 -97.0-119.4 168.5 31.0 52.4 29.8 826 293 B D >> - 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0 0 145 -3,-1.2 -1,-0.3 -6,-0.1 -3,-0.2 -0.581 54.9-127.3 -76.6 130.9 22.9 32.6 62.6 955 422 B R - 0 0 14 -2,-0.3 -47,-0.6 -3,-0.1 2,-0.4 -0.458 20.1-140.7 -76.9 147.2 19.9 31.4 60.7 956 423 B I E -i 908 0M 2 -49,-0.1 27,-2.3 -2,-0.1 2,-0.5 -0.881 1.6-146.3-113.5 142.9 19.8 31.8 56.9 957 424 B L E -ik 909 983M 3 -49,-2.4 -47,-2.5 -2,-0.4 2,-0.4 -0.926 17.1-166.9-106.5 125.2 16.9 32.8 54.6 958 425 B T E -ik 910 984M 1 25,-3.1 27,-3.0 -2,-0.5 2,-0.4 -0.930 6.3-165.9-113.9 136.3 16.8 31.1 51.2 959 426 B V E +ik 911 985M 0 -49,-2.3 -47,-1.6 -2,-0.4 2,-0.3 -0.976 20.7 160.3-119.7 137.2 14.6 32.2 48.3 960 427 B V E - k 0 986M 0 25,-2.1 27,-2.9 -2,-0.4 2,-0.1 -0.990 32.5-123.7-158.5 144.1 14.2 29.9 45.4 961 428 B G E > - k 0 987M 14 -2,-0.3 4,-2.4 -48,-0.3 27,-0.2 -0.354 33.4-107.5 -85.3 169.5 11.8 29.2 42.4 962 429 B D H > S+ 0 0 2 25,-1.5 4,-2.1 29,-0.2 5,-0.1 0.890 117.9 52.2 -66.1 -39.4 10.0 26.0 41.7 963 430 B G H > S+ 0 0 4 28,-0.5 4,-0.6 1,-0.2 -1,-0.2 0.944 113.7 43.5 -61.9 -47.6 12.2 25.2 38.7 964 431 B A H >> S+ 0 0 2 1,-0.2 4,-1.9 2,-0.2 3,-1.0 0.882 110.0 56.2 -66.2 -37.3 15.4 25.6 40.7 965 432 B F H 3X>S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.3 5,-0.6 0.900 99.7 59.7 -62.1 -38.8 14.0 23.7 43.7 966 433 B Q H 3<5S+ 0 0 4 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.753 109.3 47.5 -58.9 -23.1 13.3 20.7 41.4 967 434 B M H <<5S- 0 0 6 -3,-1.0 -2,-0.2 -4,-0.6 -1,-0.2 0.946 138.3 -10.5 -83.1 -54.4 17.1 20.7 40.8 968 435 B T H ><5S+ 0 0 5 -4,-1.9 3,-1.7 2,-0.1 -3,-0.2 0.354 97.6 102.8-133.1 5.7 18.7 21.0 44.3 969 436 B G G ><5S+ 0 0 0 -4,-2.2 3,-2.0 -5,-0.5 -3,-0.1 0.802 72.3 74.1 -61.8 -27.5 16.0 21.8 46.8 970 437 B W G > S+ 0 0 14 -3,-2.3 4,-2.1 1,-0.2 -1,-0.3 0.503 76.7 92.5 -89.6 -6.1 20.5 16.9 55.0 975 442 B C H <>>S+ 0 0 2 -3,-1.9 5,-2.0 44,-0.2 4,-1.3 0.857 80.1 57.3 -58.1 -39.3 19.6 19.6 57.5 976 443 B R H >45S+ 0 0 61 -4,-0.3 3,-0.5 -3,-0.3 -1,-0.2 0.947 111.1 41.0 -58.1 -50.1 18.9 17.3 60.4 977 444 B R H 345S+ 0 0 95 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.884 115.6 51.4 -66.3 -37.9 22.3 15.7 60.2 978 445 B L H 3<5S- 0 0 27 -4,-2.1 -1,-0.2 2,-0.1 -2,-0.2 0.647 108.6-126.7 -73.9 -15.5 24.0 19.0 59.7 979 446 B G T <<5 + 0 0 68 -4,-1.3 2,-0.3 -3,-0.5 -3,-0.2 0.837 65.4 123.9 74.0 33.3 22.2 20.5 62.7 980 447 B I < - 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