==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-FEB-11 3QR0 . COMPND 2 MOLECULE: PHOSPHOLIPASE C-BETA (PLC-BETA); . SOURCE 2 ORGANISM_SCIENTIFIC: SEPIA OFFICINALIS; . AUTHOR A.M.LYON,J.K.NORTHUP,J.J.G.TESMER . 781 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33527.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 514 65.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 110 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 53 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 83 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 194 24.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.3 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 6 1 0 2 4 4 2 2 0 0 3 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 0 2 0 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 PARALLEL BRIDGES PER LADDER . 5 4 3 3 2 1 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 3 0 1 0 1 0 0 1 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 11 A I 0 0 129 0, 0.0 306,-0.1 0, 0.0 305,-0.0 0.000 360.0 360.0 360.0 126.5 10.5 -2.5 -1.9 2 12 A E + 0 0 153 2,-0.0 2,-0.1 309,-0.0 0, 0.0 0.596 360.0 113.7 -84.2 -12.9 12.9 -0.7 -4.3 3 13 A L - 0 0 42 303,-0.1 2,-0.3 131,-0.0 307,-0.1 -0.374 45.3-173.1 -65.5 136.0 10.1 1.0 -6.3 4 14 A K - 0 0 161 -2,-0.1 131,-0.3 3,-0.0 3,-0.1 -0.951 25.6-112.1-130.5 148.4 9.9 4.8 -6.1 5 15 A W - 0 0 112 -2,-0.3 34,-0.1 1,-0.1 129,-0.0 -0.381 57.3 -75.6 -69.0 155.5 7.4 7.4 -7.4 6 16 A P - 0 0 23 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.271 43.0-159.5 -53.2 137.4 8.7 9.8 -10.1 7 17 A K - 0 0 182 -3,-0.1 31,-0.1 119,-0.1 123,-0.0 -0.958 9.0-158.5-123.0 106.5 11.1 12.5 -8.8 8 18 A V - 0 0 17 29,-0.6 5,-0.1 -2,-0.5 31,-0.0 -0.784 15.6-126.3 -97.1 117.8 11.2 15.3 -11.3 9 19 A P >> - 0 0 34 0, 0.0 4,-1.6 0, 0.0 3,-1.1 -0.251 20.8-118.2 -58.1 146.6 14.2 17.7 -11.1 10 20 A E H 3> S+ 0 0 146 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.822 114.0 65.3 -52.3 -33.7 13.5 21.4 -10.7 11 21 A Q H 3> S+ 0 0 69 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.882 105.3 41.4 -56.1 -43.4 15.3 21.8 -14.1 12 22 A L H <4 S+ 0 0 0 -3,-1.1 23,-2.1 2,-0.2 -1,-0.2 0.777 112.7 54.4 -78.1 -28.6 12.6 19.8 -15.9 13 23 A I H < S+ 0 0 31 -4,-1.6 -2,-0.2 21,-0.2 -1,-0.2 0.909 115.2 39.4 -68.4 -45.4 9.8 21.5 -13.9 14 24 A K H < S- 0 0 126 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.926 116.0-141.1 -65.1 -49.2 11.1 24.9 -15.0 15 25 A G < - 0 0 0 -4,-2.5 2,-0.3 -5,-0.3 19,-0.2 -0.169 7.4-107.9 109.1 163.0 11.8 23.5 -18.5 16 26 A D E -A 33 0A 16 17,-1.6 17,-2.5 -4,-0.2 2,-0.3 -0.899 29.4-107.3-127.5 156.6 14.4 23.7 -21.2 17 27 A K E +A 32 0A 99 -2,-0.3 98,-0.5 15,-0.2 2,-0.3 -0.667 41.8 170.0 -85.1 134.2 14.4 25.3 -24.7 18 28 A F E -AB 31 114A 1 13,-2.4 13,-3.2 -2,-0.3 2,-0.5 -0.980 34.8-125.7-137.5 152.3 14.2 22.9 -27.7 19 29 A L E -AB 30 113A 13 94,-2.3 94,-2.1 -2,-0.3 2,-0.4 -0.901 30.7-155.5 -93.3 127.6 13.7 23.3 -31.4 20 30 A K E +AB 29 112A 30 9,-3.0 9,-1.9 -2,-0.5 2,-0.3 -0.885 18.2 169.5-106.0 135.5 10.8 21.1 -32.5 21 31 A W E - B 0 111A 16 90,-1.8 90,-0.8 -2,-0.4 2,-0.3 -0.930 19.5-141.8-140.6 164.3 10.5 19.8 -36.1 22 32 A E > - 0 0 116 5,-0.5 3,-1.1 -2,-0.3 2,-0.2 -0.951 25.4-107.3-127.8 146.7 8.4 17.3 -38.0 23 33 A E T 3 S+ 0 0 103 -2,-0.3 3,-0.1 1,-0.2 88,-0.0 -0.501 105.8 28.8 -65.4 138.8 9.0 14.9 -40.8 24 34 A G T 3 S+ 0 0 93 1,-0.2 2,-0.3 -2,-0.2 -1,-0.2 0.552 109.0 81.7 85.9 9.8 7.5 16.1 -44.1 25 35 A S < - 0 0 62 -3,-1.1 -3,-0.3 2,-0.1 -1,-0.2 -0.994 64.7-147.9-145.6 143.9 7.8 19.8 -43.3 26 36 A S + 0 0 60 -2,-0.3 -3,-0.1 -3,-0.1 -1,-0.0 0.472 68.6 105.9 -87.3 -4.9 10.6 22.3 -43.5 27 37 A G - 0 0 38 -5,-0.1 -5,-0.5 49,-0.0 2,-0.3 -0.174 43.4-179.5 -73.0 165.1 9.3 24.3 -40.5 28 38 A F - 0 0 103 -7,-0.1 2,-0.3 2,-0.0 -7,-0.2 -0.951 7.2-164.0-158.0 153.4 10.7 24.5 -36.9 29 39 A I E -A 20 0A 56 -9,-1.9 -9,-3.0 -2,-0.3 2,-0.4 -0.999 21.8-125.2-141.5 137.7 9.6 26.2 -33.7 30 40 A E E -A 19 0A 102 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.695 37.3-177.9 -79.7 130.3 11.5 26.9 -30.5 31 41 A I E -A 18 0A 5 -13,-3.2 -13,-2.4 -2,-0.4 2,-0.7 -0.889 33.2-129.3-126.3 156.3 9.5 25.6 -27.5 32 42 A L E -A 17 0A 84 13,-0.3 13,-0.4 -2,-0.3 2,-0.4 -0.938 32.9-158.4-100.2 105.4 9.9 25.6 -23.7 33 43 A L E +A 16 0A 4 -17,-2.5 -17,-1.6 -2,-0.7 2,-0.3 -0.702 15.6 178.7 -87.3 135.3 9.3 21.9 -22.9 34 44 A R E -E 43 0B 77 9,-2.4 9,-2.6 -2,-0.4 2,-0.4 -0.944 23.7-144.5-136.5 156.4 8.3 21.2 -19.3 35 45 A V E -E 42 0B 0 -23,-2.1 7,-0.2 -2,-0.3 -20,-0.0 -0.952 29.5-117.3-114.2 139.4 7.3 18.2 -17.0 36 46 A D > - 0 0 0 5,-1.5 3,-2.1 -2,-0.4 5,-0.1 -0.375 36.6-102.3 -68.7 159.0 4.7 18.5 -14.4 37 47 A P T 3 S+ 0 0 53 0, 0.0 -29,-0.6 0, 0.0 -1,-0.1 0.676 120.7 51.8 -60.7 -16.9 5.9 18.0 -10.8 38 48 A K T 3 S- 0 0 78 -31,-0.1 109,-0.0 109,-0.1 -2,-0.0 0.414 110.7-116.8 -97.8 0.5 4.5 14.4 -10.7 39 49 A G S < S+ 0 0 1 -3,-2.1 3,-0.1 2,-0.2 -32,-0.1 0.887 79.7 118.4 67.3 42.1 6.1 13.2 -13.9 40 50 A Y + 0 0 8 1,-0.3 17,-2.2 107,-0.1 18,-0.4 0.693 67.9 31.3-107.0 -27.7 2.8 12.5 -15.8 41 51 A F E - F 0 56B 7 15,-0.2 -5,-1.5 16,-0.1 2,-0.4 -0.985 52.7-149.9-136.8 142.4 3.0 14.9 -18.7 42 52 A L E +EF 35 55B 1 13,-2.3 13,-2.6 -2,-0.3 2,-0.3 -0.923 37.6 176.3 -93.9 136.7 5.4 16.6 -21.1 43 53 A Y E +EF 34 54B 9 -9,-2.6 -9,-2.4 -2,-0.4 2,-0.3 -0.987 15.9 164.5-146.1 156.0 3.9 20.0 -22.1 44 54 A W E - F 0 53B 15 9,-2.2 9,-2.4 -2,-0.3 2,-0.4 -0.976 29.7-117.9-163.0 155.7 4.7 23.0 -24.1 45 55 A K - 0 0 117 -13,-0.4 2,-0.5 -2,-0.3 -13,-0.3 -0.844 13.7-154.3-104.9 138.8 3.0 26.1 -25.7 46 56 A I > - 0 0 35 -2,-0.4 3,-2.3 5,-0.3 2,-0.1 -0.967 33.8-110.8-107.6 125.4 2.9 26.9 -29.4 47 57 A E T 3 S+ 0 0 189 -2,-0.5 3,-0.1 1,-0.3 -2,-0.0 -0.344 102.8 14.6 -58.9 124.3 2.5 30.6 -30.1 48 58 A G T 3 S+ 0 0 85 1,-0.3 2,-0.4 -2,-0.1 -1,-0.3 0.307 96.9 117.8 92.3 -9.5 -1.0 31.2 -31.5 49 59 A K < - 0 0 123 -3,-2.3 -1,-0.3 1,-0.1 -3,-0.2 -0.808 57.4-148.0 -91.4 132.7 -2.4 27.8 -30.6 50 60 A E S S+ 0 0 151 -2,-0.4 2,-0.3 -3,-0.1 -1,-0.1 0.938 78.9 58.3 -63.9 -51.2 -5.3 27.9 -28.1 51 61 A D S S- 0 0 69 1,-0.1 -5,-0.3 -6,-0.0 2,-0.2 -0.623 88.0-117.2 -87.7 137.1 -4.6 24.6 -26.3 52 62 A T - 0 0 14 -2,-0.3 2,-0.2 103,-0.1 -7,-0.2 -0.523 36.9-123.1 -62.5 135.5 -1.3 23.9 -24.5 53 63 A Q E +F 44 0B 57 -9,-2.4 -9,-2.2 -2,-0.2 2,-0.3 -0.572 39.5 169.9 -84.3 148.0 0.3 20.9 -26.3 54 64 A L E -F 43 0B 48 -11,-0.2 2,-0.4 -2,-0.2 -11,-0.2 -0.989 33.6-143.7-153.8 160.9 1.1 17.8 -24.3 55 65 A L E -F 42 0B 22 -13,-2.6 -13,-2.3 -2,-0.3 2,-0.7 -0.994 24.0-137.3-124.8 123.2 2.2 14.2 -24.3 56 66 A D E > -F 41 0B 45 -2,-0.4 3,-2.2 -15,-0.2 4,-0.2 -0.725 11.8-147.2 -76.9 115.1 0.7 11.9 -21.7 57 67 A L G > S+ 0 0 4 -17,-2.2 3,-0.9 -2,-0.7 -1,-0.1 0.649 89.6 80.9 -65.2 -13.7 3.7 9.9 -20.5 58 68 A A G 3 S+ 0 0 8 -18,-0.4 -1,-0.3 1,-0.2 -17,-0.1 0.727 102.3 35.8 -57.8 -24.8 1.3 6.9 -20.0 59 69 A Y G < S+ 0 0 42 -3,-2.2 42,-2.8 678,-0.1 2,-0.3 0.299 86.6 118.5-116.0 8.2 1.7 6.3 -23.8 60 70 A V E < -C 100 0A 1 -3,-0.9 40,-0.3 40,-0.2 3,-0.1 -0.618 36.5-179.5 -75.6 131.3 5.4 7.3 -24.2 61 71 A R E - 0 0 8 38,-3.1 2,-0.3 1,-0.4 39,-0.2 0.769 58.4 -9.9-104.4 -38.9 7.3 4.3 -25.5 62 72 A D E -C 99 0A 0 37,-1.8 37,-2.4 2,-0.0 -1,-0.4 -0.987 44.9-159.5-157.9 156.4 10.8 5.5 -25.8 63 73 A I E -C 98 0A 2 -2,-0.3 2,-0.3 35,-0.2 35,-0.2 -0.974 22.6-176.7-138.3 130.4 13.0 8.6 -25.7 64 74 A R E -C 97 0A 14 33,-2.7 33,-2.6 -2,-0.4 2,-0.3 -0.919 5.5-173.9-130.1 151.6 16.4 8.6 -27.4 65 75 A C E > +C 96 0A 27 -2,-0.3 3,-1.8 31,-0.2 31,-0.2 -0.883 49.9 3.0-139.3 170.5 19.3 11.0 -27.8 66 76 A A G > S+ 0 0 30 29,-1.2 3,-1.8 26,-0.4 28,-0.1 -0.256 129.7 4.0 56.7-129.5 22.7 11.3 -29.5 67 77 A K G 3 S+ 0 0 156 1,-0.3 -1,-0.3 26,-0.1 26,-0.1 0.712 135.9 52.2 -63.0 -21.7 23.5 8.4 -31.8 68 78 A Y G < S+ 0 0 92 -3,-1.8 -1,-0.3 27,-0.1 -2,-0.2 0.512 93.1 89.7 -91.9 -7.4 20.1 6.8 -31.2 69 79 A A S < S- 0 0 6 -3,-1.8 -4,-0.1 23,-0.2 26,-0.1 -0.511 82.5-117.1 -84.0 158.3 18.1 9.9 -32.0 70 80 A K - 0 0 92 -2,-0.2 26,-0.1 -6,-0.1 -2,-0.1 -0.870 30.7-149.8 -97.3 109.7 16.9 10.6 -35.6 71 81 A P - 0 0 39 0, 0.0 7,-0.1 0, 0.0 21,-0.1 -0.441 25.3 -96.5 -78.8 154.9 18.5 13.9 -36.8 72 82 A P - 0 0 4 0, 0.0 -49,-0.0 0, 0.0 20,-0.0 -0.374 26.5-167.9 -68.6 147.9 16.8 16.1 -39.3 73 83 A K + 0 0 183 -2,-0.1 2,-0.1 5,-0.0 -50,-0.0 0.591 56.5 105.4-106.2 -21.6 17.6 15.8 -43.0 74 84 A D S > S- 0 0 47 -49,-0.1 4,-2.8 1,-0.1 5,-0.2 -0.427 72.1-134.1 -62.6 131.9 15.9 19.0 -44.2 75 85 A K H > S+ 0 0 150 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.895 101.9 46.6 -55.1 -48.8 18.5 21.7 -45.0 76 86 A K H > S+ 0 0 138 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.866 114.9 46.3 -68.6 -36.8 16.7 24.5 -43.2 77 87 A I H > S+ 0 0 4 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.931 112.0 51.4 -69.1 -47.5 16.0 22.5 -40.1 78 88 A K H X S+ 0 0 100 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.892 110.9 48.5 -54.1 -44.9 19.6 21.1 -40.0 79 89 A E H X S+ 0 0 104 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.924 114.0 45.6 -64.3 -44.6 21.0 24.6 -40.2 80 90 A A H X S+ 0 0 19 -4,-1.9 4,-1.0 1,-0.2 -2,-0.2 0.910 114.0 49.3 -63.9 -43.9 18.7 25.9 -37.5 81 91 A G H < S+ 0 0 1 -4,-3.2 3,-0.2 2,-0.2 -2,-0.2 0.857 109.0 51.9 -63.8 -38.6 19.5 22.9 -35.3 82 92 A T H < S+ 0 0 54 -4,-2.3 7,-0.2 -5,-0.2 -1,-0.2 0.883 113.5 44.8 -66.2 -38.6 23.3 23.3 -35.8 83 93 A N H < S+ 0 0 119 -4,-1.8 2,-0.4 -5,-0.2 4,-0.2 0.604 89.8 105.5 -78.5 -13.7 23.0 27.0 -34.7 84 94 A F S < S- 0 0 22 -4,-1.0 2,-0.6 -3,-0.2 -65,-0.1 -0.565 99.3 -26.2 -76.6 123.4 20.7 26.2 -31.7 85 95 A G S S+ 0 0 47 -2,-0.4 2,-0.5 2,-0.0 31,-0.2 -0.676 135.1 3.6 74.2-117.6 22.6 26.5 -28.4 86 96 A S > - 0 0 46 29,-1.7 3,-1.2 -2,-0.6 -2,-0.1 -0.900 55.1-160.2-105.0 125.0 26.3 25.8 -29.3 87 97 A S T 3 S+ 0 0 73 -2,-0.5 4,-0.1 1,-0.2 -1,-0.1 0.607 91.5 69.4 -72.4 -12.7 27.3 25.2 -32.9 88 98 A N T 3 S+ 0 0 145 2,-0.1 -1,-0.2 -5,-0.1 -5,-0.1 0.549 83.4 81.6 -81.8 -9.6 30.4 23.5 -31.7 89 99 A I S < S- 0 0 37 -3,-1.2 5,-0.1 -7,-0.2 -3,-0.0 -0.884 97.4-109.1 -93.6 123.4 28.3 20.6 -30.4 90 100 A P >> - 0 0 78 0, 0.0 4,-0.8 0, 0.0 3,-0.8 -0.210 25.7-117.9 -54.6 142.2 27.6 18.2 -33.3 91 101 A L H >> S+ 0 0 24 1,-0.2 3,-1.4 2,-0.2 4,-0.5 0.879 110.7 51.3 -49.4 -50.3 23.9 18.3 -34.4 92 102 A Q H >4 S+ 0 0 74 1,-0.3 3,-0.9 2,-0.2 -26,-0.4 0.801 100.3 62.6 -65.5 -30.5 23.1 14.7 -33.6 93 103 A D H <4 S+ 0 0 65 -3,-0.8 -1,-0.3 1,-0.2 -27,-0.2 0.750 106.8 47.0 -62.1 -25.5 24.5 15.0 -30.0 94 104 A K H << S+ 0 0 0 -3,-1.4 20,-3.4 -4,-0.8 -1,-0.2 0.536 91.4 107.9 -91.3 -10.1 21.8 17.6 -29.4 95 105 A C E << - D 0 113A 1 -3,-0.9 -29,-1.2 -4,-0.5 2,-0.4 -0.474 44.2-173.4 -80.1 140.6 18.9 15.6 -30.9 96 106 A V E -CD 65 112A 2 16,-2.8 16,-2.9 -31,-0.2 2,-0.4 -1.000 3.2-166.8-131.3 131.0 16.2 13.9 -28.9 97 107 A T E -CD 64 111A 3 -33,-2.6 -33,-2.7 -2,-0.4 2,-0.4 -0.977 2.2-167.9-121.8 129.7 13.5 11.6 -30.4 98 108 A I E -CD 63 110A 2 12,-3.0 12,-2.6 -2,-0.4 2,-0.4 -0.955 2.2-165.0-116.6 132.9 10.4 10.5 -28.6 99 109 A C E +CD 62 109A 1 -37,-2.4 -38,-3.1 -2,-0.4 -37,-1.8 -0.977 15.0 171.1-116.8 140.0 8.0 7.8 -29.7 100 110 A H E +CD 60 108A 20 8,-2.5 8,-3.1 -2,-0.4 2,-0.3 -0.976 5.2 153.8-144.1 148.5 4.5 7.4 -28.3 101 111 A G - 0 0 10 -42,-2.8 6,-0.1 -2,-0.3 -2,-0.0 -0.865 49.6-121.9-175.7 144.5 1.4 5.4 -28.9 102 112 A Y S S+ 0 0 100 -2,-0.3 633,-0.3 4,-0.2 2,-0.3 0.904 113.3 18.4 -51.4 -47.8 -1.7 4.0 -27.3 103 113 A N S S- 0 0 42 3,-0.4 -3,-0.0 -3,-0.1 -44,-0.0 -0.764 89.0-117.8-114.0 167.7 -0.4 0.7 -28.5 104 114 A Y S S+ 0 0 3 -2,-0.3 3,-0.2 1,-0.2 244,-0.1 0.437 105.7 61.2 -90.8 0.2 3.2 -0.0 -29.6 105 115 A I S S+ 0 0 54 1,-0.2 2,-1.0 476,-0.1 -1,-0.2 0.848 101.2 52.1 -88.9 -41.6 2.5 -0.9 -33.2 106 116 A D S S+ 0 0 112 2,-0.0 -3,-0.4 0, 0.0 2,-0.3 -0.772 82.1 177.2 -98.7 90.4 0.9 2.4 -34.2 107 117 A L - 0 0 29 -2,-1.0 2,-0.3 -3,-0.2 -6,-0.2 -0.648 19.9-162.3 -96.5 147.8 3.6 4.9 -33.1 108 118 A E E - D 0 100A 130 -8,-3.1 -8,-2.5 -2,-0.3 2,-0.4 -0.856 18.2-140.4-119.0 163.1 3.7 8.7 -33.5 109 119 A W E - D 0 99A 88 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.950 14.5-163.6-133.4 142.5 7.0 10.7 -33.1 110 120 A T E - D 0 98A 12 -12,-2.6 -12,-3.0 -2,-0.4 2,-0.4 -0.997 15.1-159.8-125.0 130.9 8.2 13.9 -31.6 111 121 A H E +BD 21 97A 5 -90,-0.8 -90,-1.8 -2,-0.4 2,-0.3 -0.951 13.9 173.7-120.7 130.6 11.6 15.3 -32.7 112 122 A L E -BD 20 96A 3 -16,-2.9 -16,-2.8 -2,-0.4 2,-0.5 -0.938 24.6-149.6-135.9 150.0 13.6 17.9 -30.7 113 123 A V E -BD 19 95A 2 -94,-2.1 -94,-2.3 -2,-0.3 -18,-0.2 -0.992 21.0-154.3-119.1 119.4 17.0 19.6 -30.8 114 124 A A E -B 18 0A 0 -20,-3.4 -96,-0.1 -2,-0.5 -20,-0.1 -0.349 28.2-111.8 -80.5 169.8 18.4 20.6 -27.3 115 125 A E S S- 0 0 61 -98,-0.5 -29,-1.7 -30,-0.1 2,-0.3 0.710 95.3 -3.0 -73.8 -23.6 20.9 23.4 -26.8 116 126 A N S > S- 0 0 50 -22,-0.2 4,-1.5 -31,-0.2 -2,-0.1 -0.948 77.0 -96.7-158.4 176.8 23.6 20.9 -25.9 117 127 A S H > S+ 0 0 53 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.823 115.0 57.5 -74.3 -32.7 24.3 17.2 -25.3 118 128 A S H > S+ 0 0 86 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.894 107.1 47.8 -65.7 -42.2 23.9 17.2 -21.5 119 129 A V H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.919 111.9 50.2 -63.6 -45.0 20.3 18.6 -21.7 120 130 A A H X S+ 0 0 0 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.907 114.1 45.2 -59.3 -43.9 19.4 16.0 -24.3 121 131 A K H X S+ 0 0 120 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.945 112.3 50.0 -66.2 -49.7 20.9 13.2 -22.2 122 132 A K H X S+ 0 0 67 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.911 113.2 45.9 -57.4 -46.6 19.3 14.4 -18.9 123 133 A W H X S+ 0 0 2 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.902 111.9 52.3 -63.4 -41.3 15.8 14.7 -20.5 124 134 A S H X S+ 0 0 12 -4,-1.9 4,-1.6 -5,-0.3 -2,-0.2 0.912 113.6 42.5 -61.7 -44.6 16.1 11.3 -22.2 125 135 A E H X S+ 0 0 115 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.902 118.6 44.5 -69.2 -41.7 17.1 9.5 -18.9 126 136 A E H X S+ 0 0 40 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.954 114.4 45.9 -69.8 -51.1 14.5 11.3 -16.8 127 137 A V H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.879 111.1 53.3 -63.2 -39.6 11.5 11.0 -19.2 128 138 A F H X S+ 0 0 24 -4,-1.6 4,-1.7 -5,-0.3 -1,-0.2 0.943 107.6 51.3 -59.2 -47.2 12.2 7.3 -19.9 129 139 A S H < S+ 0 0 54 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.858 111.0 48.6 -59.9 -35.0 12.2 6.6 -16.1 130 140 A Y H >< S+ 0 0 5 -4,-1.7 3,-0.8 1,-0.2 -1,-0.2 0.861 109.7 51.4 -72.6 -36.9 8.8 8.4 -15.7 131 141 A A H 3< S+ 0 0 1 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.769 117.7 38.9 -69.5 -29.5 7.2 6.5 -18.7 132 142 A Y T 3< S+ 0 0 43 -4,-1.7 2,-0.7 -5,-0.2 -1,-0.2 0.106 80.8 132.6-108.7 20.9 8.3 3.2 -17.2 133 143 A N <> - 0 0 24 -3,-0.8 4,-2.5 1,-0.2 5,-0.2 -0.624 44.2-157.6 -76.4 114.0 7.6 3.9 -13.6 134 144 A L H > S+ 0 0 18 -2,-0.7 4,-1.1 1,-0.2 -1,-0.2 0.839 90.0 53.3 -65.3 -35.8 5.7 1.0 -12.2 135 145 A L H 4 S+ 0 0 14 -131,-0.3 3,-0.5 2,-0.2 -1,-0.2 0.936 111.6 46.1 -62.6 -45.5 4.1 2.9 -9.3 136 146 A S H >4 S+ 0 0 9 1,-0.2 3,-1.1 2,-0.2 -2,-0.2 0.912 112.4 50.9 -61.7 -44.5 2.8 5.5 -11.7 137 147 A L H 3< S+ 0 0 19 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.691 116.1 42.4 -65.5 -21.0 1.5 2.8 -14.1 138 148 A N T 3< S+ 0 0 2 -4,-1.1 166,-0.3 -3,-0.5 -1,-0.2 0.210 81.4 139.0-111.6 14.5 -0.3 1.1 -11.2 139 149 A K < - 0 0 4 -3,-1.1 -3,-0.1 -4,-0.2 159,-0.1 -0.216 50.8-118.1 -67.8 151.2 -1.8 4.0 -9.3 140 150 A N > - 0 0 2 589,-0.1 4,-1.5 1,-0.1 3,-0.5 -0.158 39.8 -85.6 -79.5 178.2 -5.3 3.7 -7.9 141 151 A Q H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 157,-0.1 0.829 127.2 56.0 -60.3 -36.9 -8.2 6.0 -9.0 142 152 A L H > S+ 0 0 15 155,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.884 106.6 52.3 -61.4 -39.3 -7.4 8.8 -6.5 143 153 A G H > S+ 0 0 9 154,-0.5 4,-1.8 -3,-0.5 -1,-0.2 0.857 109.1 49.2 -61.1 -37.6 -3.9 8.9 -8.1 144 154 A E H X S+ 0 0 9 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.811 108.8 52.8 -71.4 -31.0 -5.5 9.3 -11.5 145 155 A W H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.889 109.0 49.9 -67.8 -40.4 -7.7 12.0 -10.1 146 156 A E H X S+ 0 0 53 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.852 106.2 56.0 -65.4 -37.4 -4.6 13.8 -8.9 147 157 A K H X S+ 0 0 10 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.932 108.9 46.6 -57.1 -47.9 -3.0 13.3 -12.4 148 158 A L H X S+ 0 0 15 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.893 110.2 54.6 -59.7 -42.1 -6.0 15.2 -13.8 149 159 A Y H X S+ 0 0 30 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.912 109.2 46.8 -58.1 -45.4 -5.6 17.8 -11.1 150 160 A F H X>S+ 0 0 35 -4,-2.5 4,-0.9 2,-0.2 5,-0.6 0.830 109.5 54.2 -70.4 -30.7 -1.9 18.3 -12.1 151 161 A R H >X>S+ 0 0 56 -4,-2.1 5,-2.4 3,-0.2 4,-0.7 0.954 111.3 46.1 -61.2 -48.8 -2.9 18.6 -15.8 152 162 A L H 3<5S+ 0 0 1 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.842 117.0 42.6 -63.6 -36.7 -5.4 21.3 -14.9 153 163 A T H 3<5S+ 0 0 14 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.456 130.7 20.6 -94.3 -2.8 -3.0 23.3 -12.7 154 164 A T H <<5S+ 0 0 23 -4,-0.9 -3,-0.2 -3,-0.6 -2,-0.1 0.612 130.5 31.3-124.2 -60.8 0.1 23.0 -14.9 155 165 A V T <> -G 197 0C 23 0, 0.0 4,-1.3 0, 0.0 3,-0.7 -0.442 6.0-138.5 -69.2 138.8 -10.5 27.7 -17.2 164 174 A V H 3> S+ 0 0 0 32,-2.2 4,-2.4 1,-0.2 5,-0.2 0.872 106.2 63.7 -60.2 -38.4 -13.9 25.8 -16.8 165 175 A K H 3> S+ 0 0 104 31,-0.5 4,-2.0 29,-0.3 -1,-0.2 0.850 101.7 50.1 -48.5 -40.8 -13.5 25.1 -20.5 166 176 A A H <> S+ 0 0 3 -3,-0.7 4,-1.5 2,-0.2 -1,-0.2 0.851 107.7 52.6 -71.8 -36.0 -10.4 23.0 -19.7 167 177 A I H X S+ 0 0 1 -4,-1.3 4,-0.7 -3,-0.2 -2,-0.2 0.931 112.4 44.9 -65.1 -46.4 -12.1 21.1 -16.9 168 178 A Q H >X S+ 0 0 12 -4,-2.4 4,-2.9 1,-0.2 3,-0.9 0.915 111.1 51.8 -65.1 -45.1 -15.0 20.0 -19.2 169 179 A K H 3< S+ 0 0 57 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.833 107.0 54.0 -63.6 -33.6 -12.7 19.1 -22.2 170 180 A C H 3< S+ 0 0 29 -4,-1.5 -1,-0.2 1,-0.1 -2,-0.2 0.722 119.9 32.8 -71.6 -21.0 -10.6 16.8 -20.0 171 181 A L H << S- 0 0 12 -3,-0.9 2,-0.3 -4,-0.7 -2,-0.2 0.800 121.9 -0.7-105.9 -38.8 -13.7 14.9 -18.8 172 182 A S < - 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0 0 38 17,-2.8 19,-0.3 -2,-0.4 2,-0.2 -0.916 40.1 -89.2-130.0 156.5 18.2 -30.0 -31.0 506 525 A H - 0 0 146 -2,-0.3 2,-0.3 17,-0.1 17,-0.0 -0.464 46.0-127.6 -59.0 123.6 15.8 -32.4 -32.8 507 526 A F + 0 0 17 -2,-0.2 3,-0.1 1,-0.2 -1,-0.1 -0.626 38.6 161.8 -77.5 134.9 13.3 -33.8 -30.2 508 527 A T - 0 0 72 1,-0.4 2,-0.3 -2,-0.3 -1,-0.2 0.657 58.5 -32.8-112.4 -77.7 13.0 -37.6 -30.1 509 528 A T > - 0 0 65 1,-0.1 4,-1.7 0, 0.0 -1,-0.4 -0.941 45.7-116.6-140.7 165.2 11.4 -38.7 -26.8 510 529 A F H > S+ 0 0 21 -2,-0.3 4,-2.2 2,-0.2 5,-0.2 0.877 116.7 57.0 -67.3 -38.4 11.3 -37.6 -23.1 511 530 A E H > S+ 0 0 117 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.923 107.9 48.0 -56.5 -45.5 13.0 -40.9 -22.1 512 531 A Q H > S+ 0 0 67 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.872 108.4 53.0 -65.8 -39.9 15.9 -40.0 -24.5 513 532 A A H X>S+ 0 0 13 -4,-1.7 4,-1.9 2,-0.2 5,-0.5 0.911 111.5 47.1 -60.2 -42.7 16.2 -36.4 -23.1 514 533 A Q H <5S+ 0 0 155 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.919 110.6 51.7 -65.6 -44.9 16.5 -37.8 -19.6 515 534 A K H <5S+ 0 0 154 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.913 111.0 47.1 -57.4 -46.6 19.1 -40.4 -20.5 516 535 A K H <5S- 0 0 58 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.842 88.2-161.1 -68.3 -35.7 21.3 -37.8 -22.2 517 536 A D T <5 + 0 0 57 -4,-1.9 -74,-3.0 1,-0.2 2,-0.8 0.790 31.0 152.3 63.3 31.6 21.0 -35.5 -19.2 518 537 A R > < - 0 0 93 -5,-0.5 3,-1.4 -76,-0.2 -1,-0.2 -0.835 25.6-173.6 -99.4 103.4 22.1 -32.4 -21.2 519 538 A H T 3 S+ 0 0 14 -2,-0.8 30,-0.3 -75,-0.3 -1,-0.1 0.636 81.9 59.9 -72.8 -15.4 20.5 -29.4 -19.6 520 539 A Y T 3 S+ 0 0 26 28,-0.1 -17,-2.4 -79,-0.1 2,-0.4 0.394 84.8 92.1 -95.9 -2.0 21.8 -27.1 -22.4 521 540 A E E < +s 503 0I 12 -3,-1.4 28,-0.4 -19,-0.2 2,-0.3 -0.797 56.1 169.5 -89.1 137.2 19.9 -29.0 -25.1 522 541 A M E -s 504 0I 3 -19,-2.8 -17,-2.8 -2,-0.4 2,-0.4 -0.902 25.0-134.4-140.2 167.7 16.5 -27.6 -25.8 523 542 A S E -t 550 0J 4 26,-1.5 28,-2.4 -2,-0.3 2,-0.6 -0.987 2.1-151.6-130.6 141.0 13.7 -27.9 -28.4 524 543 A S E -t 551 0J 30 -2,-0.4 2,-0.5 -19,-0.3 28,-0.2 -0.964 26.6-167.6-109.5 111.4 11.7 -25.4 -30.2 525 544 A M E -t 552 0J 0 26,-3.2 28,-1.6 -2,-0.6 -2,-0.0 -0.884 22.2-128.7-109.2 130.9 8.3 -26.9 -31.0 526 545 A V E >> -t 553 0J 4 -2,-0.5 4,-2.1 26,-0.2 3,-0.8 -0.382 41.7-105.1 -61.4 151.6 5.6 -25.7 -33.3 527 546 A E H 3> S+ 0 0 7 26,-2.2 4,-2.5 1,-0.3 5,-0.2 0.859 121.1 59.6 -54.9 -36.0 2.3 -25.8 -31.4 528 547 A T H 3> S+ 0 0 20 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.893 108.3 43.9 -58.5 -42.2 1.2 -28.9 -33.3 529 548 A Q H <> S+ 0 0 34 -3,-0.8 4,-2.0 2,-0.2 -2,-0.2 0.943 113.7 49.7 -68.3 -47.7 4.2 -30.9 -32.0 530 549 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.845 108.7 53.8 -60.7 -37.1 3.9 -29.5 -28.4 531 550 A L H X S+ 0 0 39 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.879 106.6 51.8 -65.0 -40.8 0.2 -30.5 -28.4 532 551 A N H X S+ 0 0 32 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.906 113.5 44.0 -60.9 -42.2 1.0 -34.1 -29.4 533 552 A K H X S+ 0 0 42 -4,-2.0 4,-3.1 2,-0.2 -2,-0.2 0.920 113.6 50.8 -68.0 -43.6 3.5 -34.3 -26.5 534 553 A L H < S+ 0 0 3 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.887 115.1 42.6 -60.6 -42.6 1.1 -32.7 -24.1 535 554 A K H < S+ 0 0 50 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.767 121.2 40.7 -76.9 -27.0 -1.7 -35.0 -25.0 536 555 A D H < S+ 0 0 54 -4,-1.7 -2,-0.2 -5,-0.2 -3,-0.2 0.877 135.6 7.2 -86.7 -42.8 0.5 -38.2 -25.1 537 556 A N X + 0 0 72 -4,-3.1 4,-1.9 -5,-0.2 -2,-0.2 -0.484 66.6 161.0-144.9 65.1 2.8 -37.7 -22.1 538 557 A P H > S+ 0 0 1 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.877 78.3 49.1 -61.5 -43.2 1.7 -34.6 -20.0 539 558 A E H > S+ 0 0 51 1,-0.2 4,-2.0 2,-0.2 78,-0.3 0.896 111.5 49.7 -63.3 -42.8 3.5 -35.6 -16.8 540 559 A D H > S+ 0 0 50 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.836 107.1 55.9 -64.3 -33.9 6.8 -36.3 -18.6 541 560 A F H X S+ 0 0 1 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.942 108.0 47.6 -64.0 -47.9 6.5 -32.9 -20.4 542 561 A V H < S+ 0 0 1 -4,-1.9 -2,-0.2 75,-0.3 -1,-0.2 0.905 113.2 48.8 -57.7 -42.8 6.3 -31.2 -17.0 543 562 A D H >< S+ 0 0 45 -4,-2.0 3,-1.6 1,-0.2 4,-0.5 0.899 107.2 54.7 -66.5 -42.7 9.3 -33.2 -15.8 544 563 A Y H >X S+ 0 0 18 -4,-2.7 4,-2.5 1,-0.3 3,-1.3 0.908 104.3 56.3 -53.1 -44.3 11.3 -32.4 -18.9 545 564 A N T 3< S+ 0 0 0 -4,-1.9 -1,-0.3 27,-0.3 -2,-0.2 0.429 90.0 74.0 -75.0 0.7 10.8 -28.7 -18.3 546 565 A K T <4 S+ 0 0 16 -3,-1.6 -1,-0.2 -4,-0.1 -2,-0.2 0.777 118.8 12.6 -78.9 -27.0 12.3 -28.9 -14.8 547 566 A K T <4 S+ 0 0 82 -3,-1.3 -101,-0.4 -4,-0.5 -227,-0.2 0.674 127.6 46.3-118.2 -32.7 15.8 -29.2 -16.2 548 567 A Q S < S- 0 0 15 -4,-2.5 2,-0.4 -5,-0.2 -26,-0.1 -0.720 76.9-112.8-117.7 165.2 15.5 -28.3 -19.9 549 568 A I - 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0 0 63 -123,-3.0 2,-0.8 -61,-0.2 -123,-0.2 -0.519 33.7-153.1 -67.9 116.4 -11.5 -23.9 -1.3 754 773 A V 0 0 102 -2,-0.5 -1,-0.1 -3,-0.0 -123,-0.0 -0.832 360.0 360.0 -96.0 106.6 -13.8 -25.3 1.5 755 774 A S 0 0 145 -2,-0.8 -1,-0.0 -64,-0.0 -64,-0.0 0.070 360.0 360.0 -64.2 360.0 -15.0 -28.7 0.4 756 ! 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 0.0 757 790 A Y 0 0 187 0, 0.0 3,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 150.9 -13.8 -40.6 -24.2 758 791 A Q + 0 0 180 1,-0.1 2,-0.3 2,-0.0 3,-0.1 0.489 360.0 13.1 -84.5 -4.5 -12.2 -43.4 -26.1 759 792 A S S > S- 0 0 41 1,-0.1 4,-1.9 0, 0.0 5,-0.2 -0.965 72.7-114.7-161.6 156.5 -8.7 -42.4 -25.3 760 793 A A H > S+ 0 0 46 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.871 117.1 58.0 -56.2 -38.8 -6.8 -40.1 -22.9 761 794 A Q H > S+ 0 0 74 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.909 106.3 46.6 -59.6 -46.2 -5.7 -38.1 -25.9 762 795 A E H > S+ 0 0 90 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.877 112.0 50.4 -65.3 -40.8 -9.3 -37.4 -27.0 763 796 A A H X S+ 0 0 37 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.862 112.0 48.5 -64.0 -37.1 -10.3 -36.4 -23.4 764 797 A R H X S+ 0 0 40 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.873 108.3 52.6 -72.5 -39.1 -7.3 -34.0 -23.2 765 798 A A H < S+ 0 0 35 -4,-2.2 4,-0.4 1,-0.2 -2,-0.2 0.890 109.4 50.9 -60.3 -41.5 -8.0 -32.4 -26.6 766 799 A A H >< S+ 0 0 11 -4,-1.8 3,-1.4 1,-0.2 4,-0.3 0.880 104.5 56.9 -63.3 -41.4 -11.6 -31.8 -25.3 767 800 A A H >< S+ 0 0 34 -4,-1.7 3,-1.3 1,-0.3 -1,-0.2 0.857 100.1 59.8 -56.2 -37.1 -10.2 -30.2 -22.2 768 801 A L G >< S+ 0 0 20 -4,-1.4 3,-1.2 1,-0.3 4,-0.3 0.593 83.7 79.7 -73.3 -11.3 -8.3 -27.7 -24.4 769 802 A C G X S+ 0 0 16 -3,-1.4 3,-1.6 -4,-0.4 -1,-0.3 0.775 75.7 76.1 -62.8 -27.0 -11.5 -26.4 -25.9 770 803 A A G < S+ 0 0 24 -3,-1.3 -1,-0.2 -4,-0.3 -105,-0.2 0.741 90.5 56.1 -55.3 -26.3 -12.0 -24.3 -22.7 771 804 A F G < S+ 0 0 4 -3,-1.2 -1,-0.3 -4,-0.1 -2,-0.2 0.649 86.7 103.6 -80.1 -17.1 -9.4 -21.9 -24.1 772 805 A E S < S- 0 0 92 -3,-1.6 4,-0.1 -4,-0.3 -107,-0.0 -0.198 84.6-113.9 -71.1 158.5 -11.1 -21.2 -27.4 773 806 A D S S+ 0 0 102 1,-0.3 -1,-0.1 2,-0.1 -3,-0.0 0.740 118.3 28.0 -61.2 -25.9 -13.1 -18.0 -28.1 774 807 A D S > S- 0 0 93 -5,-0.1 4,-2.4 1,-0.1 -1,-0.3 -0.734 75.3-179.6-134.9 84.9 -16.2 -20.2 -28.3 775 808 A P H > S+ 0 0 21 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.872 80.4 49.1 -56.1 -45.0 -15.6 -23.2 -26.0 776 809 A D H > S+ 0 0 118 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.915 112.8 47.0 -62.7 -45.3 -19.0 -24.9 -26.5 777 810 A A H > S+ 0 0 44 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.876 112.5 50.3 -63.9 -40.0 -18.7 -24.6 -30.4 778 811 A A H X S+ 0 0 29 -4,-2.4 4,-0.9 2,-0.2 -2,-0.2 0.897 112.2 47.3 -63.3 -41.5 -15.1 -25.9 -30.3 779 812 A L H X S+ 0 0 62 -4,-2.3 4,-1.3 -5,-0.2 3,-0.3 0.883 112.5 49.4 -67.9 -40.3 -16.2 -28.9 -28.1 780 813 A N H < S+ 0 0 101 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.842 108.3 54.1 -64.9 -36.3 -19.2 -29.6 -30.4 781 814 A A H < S+ 0 0 87 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.717 103.8 56.8 -72.3 -22.4 -16.9 -29.5 -33.5 782 815 A A H < 0 0 73 -4,-0.9 -2,-0.2 -3,-0.3 -1,-0.2 0.944 360.0 360.0 -75.8 -50.6 -14.5 -32.1 -32.1 783 816 A K < 0 0 200 -4,-1.3 -1,-0.2 -17,-0.0 -2,-0.1 0.270 360.0 360.0 -68.7 360.0 -16.9 -35.0 -31.4