==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-MAR-07 2P8N . COMPND 2 MOLECULE: RICIN A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RICINUS COMMUNIS; . AUTHOR J.H.CARRA,C.A.MCHUGH,S.MULLIGAN,L.M.MACHIESKY,C.B.MILLARD . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12197.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 173 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 . 12 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 29.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.3 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 0 0 1 0 1 0 0 0 2 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 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 PARALLEL BRIDGES PER LADDER . 3 1 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 Y 0 0 87 0, 0.0 52,-0.2 0, 0.0 49,-0.1 0.000 360.0 360.0 360.0 145.5 -21.6 -9.5 -10.1 2 7 A P - 0 0 45 0, 0.0 52,-3.2 0, 0.0 2,-0.4 -0.243 360.0-150.1 -60.4 144.9 -18.0 -8.5 -11.3 3 8 A I E -a 54 0A 81 50,-0.2 2,-0.4 52,-0.1 52,-0.2 -0.968 11.4-168.6-124.6 135.2 -15.7 -7.1 -8.7 4 9 A I E -a 55 0A 9 50,-2.7 52,-2.3 -2,-0.4 2,-0.3 -0.987 14.2-152.3-121.8 128.5 -12.8 -4.6 -9.1 5 10 A N E +a 56 0A 103 -2,-0.4 2,-0.3 50,-0.2 52,-0.2 -0.736 18.6 166.8-104.4 150.2 -10.3 -4.0 -6.3 6 11 A F E -a 57 0A 14 50,-1.9 52,-2.0 -2,-0.3 2,-0.4 -0.967 14.3-158.5-155.4 145.7 -8.3 -0.9 -5.4 7 12 A T E -a 58 0A 54 -2,-0.3 52,-0.2 50,-0.2 133,-0.1 -0.995 19.6-152.8-134.3 138.4 -6.3 0.0 -2.4 8 13 A T S > S+ 0 0 2 50,-2.1 3,-1.5 -2,-0.4 2,-0.6 0.639 72.0 107.1 -77.5 -15.6 -5.1 3.4 -1.2 9 14 A A T 3 S- 0 0 37 49,-0.3 -2,-0.1 1,-0.3 49,-0.0 -0.527 105.1 -15.6 -68.0 112.2 -2.2 1.6 0.5 10 15 A G T 3 S+ 0 0 72 -2,-0.6 -1,-0.3 1,-0.2 5,-0.1 0.752 92.7 179.4 65.0 23.8 0.8 2.5 -1.5 11 16 A A < - 0 0 18 -3,-1.5 2,-0.3 4,-0.1 -1,-0.2 -0.290 4.5-174.0 -60.4 141.3 -1.3 3.7 -4.4 12 17 A T > - 0 0 71 1,-0.1 4,-2.1 0, 0.0 5,-0.2 -0.803 42.1-100.1-127.6 169.8 0.6 5.0 -7.4 13 18 A V H > S+ 0 0 32 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.914 124.2 51.0 -58.8 -39.6 -0.6 6.8 -10.6 14 19 A Q H > S+ 0 0 103 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.899 109.0 47.1 -66.4 -42.4 -0.2 3.4 -12.4 15 20 A S H > S+ 0 0 41 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.840 114.9 47.9 -70.0 -29.4 -2.3 1.4 -9.9 16 21 A Y H X S+ 0 0 2 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.891 111.4 50.6 -74.3 -40.2 -5.0 4.0 -9.9 17 22 A T H X S+ 0 0 9 -4,-2.4 4,-2.4 -5,-0.2 5,-0.2 0.914 109.6 50.2 -62.0 -44.0 -4.9 4.1 -13.7 18 23 A N H X S+ 0 0 78 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.908 110.8 51.8 -60.8 -41.8 -5.2 0.3 -13.9 19 24 A F H X S+ 0 0 6 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.955 110.9 44.1 -59.5 -56.2 -8.2 0.5 -11.5 20 25 A I H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.903 113.3 51.5 -59.2 -42.7 -10.2 3.1 -13.4 21 26 A R H X S+ 0 0 148 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.918 110.0 50.4 -60.3 -42.3 -9.5 1.3 -16.7 22 27 A A H X S+ 0 0 41 -4,-2.2 4,-1.2 -5,-0.2 -2,-0.2 0.893 109.3 51.0 -62.7 -41.5 -10.8 -1.9 -15.2 23 28 A V H >X S+ 0 0 0 -4,-2.3 4,-1.5 1,-0.2 3,-0.6 0.929 110.7 47.8 -62.2 -47.1 -13.9 -0.2 -13.9 24 29 A R H 3X S+ 0 0 44 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.887 106.9 58.4 -59.6 -40.9 -14.7 1.2 -17.4 25 30 A G H 3< S+ 0 0 49 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.798 111.0 41.5 -59.7 -30.6 -14.1 -2.2 -18.8 26 31 A R H << S+ 0 0 125 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.656 113.0 54.8 -90.5 -19.8 -16.8 -3.6 -16.6 27 32 A L H < S+ 0 0 1 -4,-1.5 2,-0.2 -3,-0.2 -2,-0.2 0.917 109.4 43.4 -79.0 -46.6 -19.2 -0.6 -17.2 28 33 A T < - 0 0 29 -4,-2.5 12,-0.1 12,-0.1 44,-0.0 -0.616 59.2-158.6-100.7 161.1 -19.3 -0.7 -21.0 29 34 A T - 0 0 109 10,-0.4 -1,-0.1 -2,-0.2 11,-0.1 0.530 41.0-117.2-113.1 -12.5 -19.6 -3.6 -23.3 30 35 A G S S+ 0 0 57 9,-0.3 3,-0.1 2,-0.2 10,-0.1 0.503 88.8 109.9 85.1 5.3 -18.2 -2.2 -26.5 31 36 A A S S+ 0 0 89 1,-0.2 2,-0.5 8,-0.2 -3,-0.0 0.744 75.8 42.9 -82.6 -24.4 -21.6 -2.6 -28.2 32 37 A D + 0 0 30 7,-0.3 7,-2.8 2,-0.0 2,-0.4 -0.955 62.0 155.1-132.1 114.0 -22.4 1.1 -28.3 33 38 A V E -F 38 0B 74 -2,-0.5 2,-0.5 5,-0.3 3,-0.1 -0.992 16.4-169.8-138.6 127.2 -19.9 3.8 -29.3 34 39 A R E > S-F 37 0B 19 3,-2.6 3,-2.1 -2,-0.4 180,-0.0 -0.979 77.8 -13.4-120.6 121.8 -20.8 7.2 -30.8 35 40 A H T 3 S- 0 0 76 -2,-0.5 -1,-0.2 1,-0.3 179,-0.0 0.869 129.1 -55.9 56.5 37.9 -18.1 9.4 -32.2 36 41 A E T 3 S+ 0 0 148 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.454 115.3 118.8 74.5 2.3 -15.5 7.2 -30.6 37 42 A I E < -F 34 0B 3 -3,-2.1 -3,-2.6 212,-0.0 -1,-0.2 -0.892 63.8-127.5-105.6 118.6 -17.1 7.7 -27.1 38 43 A P E -F 33 0B 37 0, 0.0 212,-2.0 0, 0.0 2,-0.4 -0.242 17.9-145.3 -60.4 144.6 -18.5 4.6 -25.4 39 44 A V B -g 250 0C 2 -7,-2.8 -10,-0.4 210,-0.2 -7,-0.3 -0.937 16.2-119.0-116.5 138.3 -22.1 4.6 -24.2 40 45 A L - 0 0 1 210,-3.1 32,-0.1 -2,-0.4 -12,-0.1 -0.298 48.9 -74.8 -69.5 156.4 -23.2 2.8 -21.0 41 46 A P - 0 0 24 0, 0.0 2,-0.3 0, 0.0 211,-0.3 -0.161 50.1-108.7 -52.2 141.2 -25.8 -0.0 -21.3 42 47 A N - 0 0 57 1,-0.2 4,-0.1 2,-0.1 30,-0.1 -0.584 20.4-142.7 -73.2 128.8 -29.4 1.1 -21.9 43 48 A R S > S+ 0 0 104 -2,-0.3 3,-1.9 209,-0.2 2,-0.3 0.886 78.2 92.2 -60.4 -38.1 -31.4 0.5 -18.7 44 49 A V T 3 S+ 0 0 119 1,-0.3 -2,-0.1 -3,-0.0 0, 0.0 -0.426 104.6 0.7 -63.4 117.7 -34.5 -0.6 -20.8 45 50 A G T 3 S+ 0 0 76 -2,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.455 90.9 147.2 83.9 3.0 -34.4 -4.4 -21.2 46 51 A L < - 0 0 37 -3,-1.9 -1,-0.2 -4,-0.1 5,-0.1 -0.607 50.8-121.3 -77.3 118.9 -31.2 -4.9 -19.2 47 52 A P > - 0 0 59 0, 0.0 3,-1.9 0, 0.0 4,-0.1 -0.272 17.2-124.8 -57.5 141.6 -31.2 -8.2 -17.4 48 53 A I G > S+ 0 0 58 1,-0.3 3,-1.6 2,-0.2 4,-0.4 0.815 108.3 65.5 -59.4 -31.0 -30.8 -7.8 -13.6 49 54 A N G 3 S+ 0 0 106 1,-0.3 -1,-0.3 2,-0.1 -3,-0.0 0.499 107.2 42.5 -71.5 -1.1 -27.7 -10.1 -13.6 50 55 A Q G < S+ 0 0 105 -3,-1.9 -1,-0.3 -49,-0.1 -2,-0.2 0.216 90.8 93.5-124.6 10.5 -25.9 -7.5 -15.7 51 56 A R S < S+ 0 0 20 -3,-1.6 20,-2.5 -4,-0.1 21,-0.4 0.756 81.8 34.1 -80.2 -28.8 -27.1 -4.4 -13.8 52 57 A F E - B 0 70A 3 -4,-0.4 2,-0.3 18,-0.2 18,-0.2 -0.839 51.4-162.3-129.5 165.2 -24.3 -3.8 -11.2 53 58 A I E - B 0 69A 3 16,-1.8 16,-2.4 -2,-0.3 2,-0.4 -0.941 22.2-130.3-137.1 156.7 -20.6 -4.1 -10.7 54 59 A L E -aB 3 68A 22 -52,-3.2 -50,-2.7 -2,-0.3 2,-0.5 -0.916 10.2-162.0-117.1 141.1 -18.7 -4.0 -7.4 55 60 A V E -aB 4 67A 0 12,-2.4 12,-2.7 -2,-0.4 2,-0.8 -0.956 9.5-159.0-120.5 109.0 -15.7 -1.9 -6.3 56 61 A E E -aB 5 66A 58 -52,-2.3 -50,-1.9 -2,-0.5 2,-0.4 -0.809 10.4-164.7 -94.7 112.9 -13.9 -3.3 -3.3 57 62 A L E +aB 6 65A 0 8,-2.9 8,-2.3 -2,-0.8 2,-0.3 -0.822 9.2 178.6-100.6 131.6 -11.9 -0.5 -1.6 58 63 A S E -aB 7 64A 29 -52,-2.0 -50,-2.1 -2,-0.4 -49,-0.3 -0.891 7.8-160.3-125.8 155.3 -9.1 -1.3 0.9 59 64 A N > - 0 0 3 4,-1.6 3,-2.1 -2,-0.3 4,-0.3 -0.817 39.2 -94.4-132.0 174.0 -6.8 1.1 2.8 60 65 A H T 3 S+ 0 0 147 1,-0.3 -1,-0.0 -2,-0.3 80,-0.0 0.762 119.3 68.5 -57.9 -24.3 -3.5 1.2 4.7 61 66 A A T 3 S- 0 0 51 79,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.338 115.6-115.5 -77.9 8.8 -5.6 0.7 7.9 62 67 A E S < S+ 0 0 169 -3,-2.1 2,-0.3 1,-0.2 -2,-0.1 0.820 73.0 133.3 60.8 33.7 -6.4 -2.8 6.7 63 68 A L - 0 0 16 -4,-0.3 -4,-1.6 2,-0.0 2,-0.3 -0.865 36.7-163.0-114.0 149.3 -10.1 -1.9 6.4 64 69 A S E +B 58 0A 41 -2,-0.3 2,-0.3 -6,-0.2 18,-0.3 -0.983 12.6 175.5-136.4 146.6 -12.3 -2.7 3.4 65 70 A V E -B 57 0A 1 -8,-2.3 -8,-2.9 -2,-0.3 2,-0.5 -0.965 20.3-140.2-141.4 153.3 -15.7 -1.6 2.0 66 71 A T E -BC 56 80A 4 14,-2.4 14,-2.4 -2,-0.3 -10,-0.2 -0.964 12.2-158.9-124.3 118.1 -17.5 -2.5 -1.2 67 72 A L E -BC 55 79A 1 -12,-2.7 -12,-2.4 -2,-0.5 2,-0.5 -0.625 10.1-141.4 -90.9 150.9 -19.4 0.0 -3.2 68 73 A A E -BC 54 78A 0 10,-2.6 9,-3.0 -2,-0.2 10,-0.8 -0.962 16.5-165.5-115.4 124.7 -22.1 -1.0 -5.7 69 74 A L E -BC 53 76A 0 -16,-2.4 -16,-1.8 -2,-0.5 2,-0.5 -0.914 20.0-130.1-114.3 139.3 -22.4 0.9 -9.0 70 75 A D E >>> -BC 52 75A 7 5,-2.5 4,-2.2 -2,-0.4 3,-1.1 -0.736 15.7-147.1 -81.9 123.4 -25.3 0.8 -11.4 71 76 A V T 345S+ 0 0 5 -20,-2.5 -1,-0.1 -2,-0.5 -19,-0.1 0.738 91.7 67.2 -67.8 -22.0 -23.8 0.1 -14.9 72 77 A T T 345S+ 0 0 11 -21,-0.4 180,-0.5 1,-0.2 -1,-0.2 0.707 127.2 3.0 -71.0 -20.4 -26.4 2.3 -16.7 73 78 A N T <45S- 0 0 42 -3,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.353 92.0-115.6-146.4 4.2 -25.1 5.5 -15.1 74 79 A A T <5 + 0 0 0 -4,-2.2 2,-0.3 1,-0.2 -3,-0.2 0.658 61.8 159.9 64.0 16.5 -22.0 4.6 -13.0 75 80 A Y E < -C 70 0A 59 -5,-0.6 -5,-2.5 1,-0.1 2,-0.6 -0.516 45.3-127.8 -75.9 129.3 -24.0 5.7 -10.0 76 81 A V E +C 69 0A 5 -2,-0.3 -7,-0.3 -7,-0.2 3,-0.1 -0.705 30.5 178.3 -74.8 117.6 -22.9 4.5 -6.6 77 82 A V E - 0 0 13 -9,-3.0 11,-2.0 -2,-0.6 2,-0.3 0.558 54.4 -45.1-100.7 -11.1 -26.1 3.1 -5.2 78 83 A G E -CD 68 87A 2 -10,-0.8 -10,-2.6 9,-0.3 2,-0.3 -0.973 52.9-122.8 167.8-175.3 -24.8 1.8 -1.8 79 84 A Y E -CD 67 86A 0 7,-2.4 7,-2.6 -2,-0.3 2,-0.4 -0.988 6.7-134.5-155.5 162.4 -22.1 -0.1 -0.0 80 85 A R E +CD 66 85A 64 -14,-2.4 -14,-2.4 -2,-0.3 2,-0.3 -0.954 16.2 176.8-121.9 141.1 -21.3 -3.0 2.2 81 86 A A E > - D 0 84A 9 3,-3.0 3,-1.6 -2,-0.4 2,-0.2 -0.897 64.2 -54.5-143.7 106.4 -19.0 -3.0 5.3 82 87 A G T 3 S- 0 0 37 -2,-0.3 -1,-0.0 -18,-0.3 65,-0.0 -0.403 123.2 -8.8 63.7-123.8 -18.8 -6.3 7.2 83 88 A N T 3 S+ 0 0 121 -2,-0.2 25,-1.6 23,-0.1 2,-0.3 0.207 124.4 74.8 -93.6 15.5 -22.2 -7.5 8.2 84 89 A S E < -De 81 108A 9 -3,-1.6 -3,-3.0 23,-0.2 2,-0.4 -0.969 53.6-170.3-132.2 145.6 -24.1 -4.3 7.1 85 90 A A E -De 80 109A 0 23,-2.5 25,-2.7 -2,-0.3 2,-0.4 -0.993 6.0-162.1-133.2 140.1 -25.1 -2.7 3.8 86 91 A Y E -De 79 110A 15 -7,-2.6 -7,-2.4 -2,-0.4 2,-0.4 -0.985 5.4-169.6-125.5 132.6 -26.5 0.8 3.2 87 92 A F E -De 78 111A 2 23,-2.2 25,-3.4 -2,-0.4 -9,-0.3 -0.948 24.2-117.6-123.4 142.3 -28.3 1.9 0.1 88 93 A F - 0 0 6 -11,-2.0 27,-0.2 -2,-0.4 25,-0.1 -0.303 52.4 -79.4 -68.5 160.1 -29.3 5.4 -1.0 89 94 A H - 0 0 103 25,-2.8 27,-0.3 22,-0.1 -1,-0.1 -0.491 55.3-119.8 -65.4 117.5 -33.1 6.1 -1.3 90 95 A P - 0 0 29 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.225 7.0-138.4 -59.4 145.7 -34.1 4.7 -4.7 91 96 A D S S+ 0 0 130 1,-0.1 2,-0.3 2,-0.0 -2,-0.0 0.755 80.1 2.1 -76.2 -27.8 -35.6 7.0 -7.3 92 97 A N S > S- 0 0 46 1,-0.1 4,-1.7 0, 0.0 3,-0.2 -0.933 79.5 -94.0-152.0 174.0 -38.3 4.6 -8.4 93 98 A Q H > S+ 0 0 145 -2,-0.3 4,-1.8 1,-0.2 5,-0.2 0.861 118.5 57.6 -63.5 -37.1 -39.9 1.2 -7.7 94 99 A E H > S+ 0 0 115 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.896 109.1 45.3 -61.9 -40.7 -37.8 -0.5 -10.4 95 100 A D H > S+ 0 0 21 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.837 107.9 57.2 -72.6 -32.7 -34.6 0.6 -8.8 96 101 A A H < S+ 0 0 33 -4,-1.7 4,-0.5 1,-0.2 -1,-0.2 0.880 110.6 44.6 -65.3 -35.9 -35.8 -0.4 -5.3 97 102 A E H >< S+ 0 0 104 -4,-1.8 3,-1.1 2,-0.2 4,-0.3 0.905 109.0 56.9 -73.4 -41.3 -36.3 -4.0 -6.6 98 103 A A H >< S+ 0 0 3 -4,-1.9 3,-2.0 1,-0.3 -2,-0.2 0.910 101.6 55.9 -56.3 -45.5 -33.0 -4.0 -8.4 99 104 A I G >< S+ 0 0 15 -4,-2.1 3,-1.8 1,-0.3 -1,-0.3 0.694 88.9 74.1 -64.9 -17.5 -31.0 -3.3 -5.2 100 105 A T G < S+ 0 0 78 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.677 89.5 64.1 -67.8 -12.3 -32.5 -6.3 -3.4 101 106 A H G < S+ 0 0 69 -3,-2.0 3,-0.4 -4,-0.3 2,-0.4 0.453 87.9 88.4 -88.9 -1.9 -30.2 -8.2 -5.7 102 107 A L S < S- 0 0 2 -3,-1.8 -34,-0.0 1,-0.2 -3,-0.0 -0.797 100.3 -5.1-102.3 141.3 -27.1 -6.7 -4.1 103 108 A F S > S+ 0 0 17 -2,-0.4 3,-1.0 1,-0.1 -1,-0.2 0.910 72.4 173.2 45.7 52.5 -25.3 -8.1 -1.0 104 109 A T T 3 S+ 0 0 105 -3,-0.4 -1,-0.1 1,-0.2 -2,-0.1 0.616 71.1 55.4 -66.0 -10.5 -28.0 -10.7 -0.6 105 110 A D T 3 S+ 0 0 131 3,-0.0 -1,-0.2 2,-0.0 -2,-0.1 0.678 75.8 115.8 -96.9 -20.1 -25.9 -12.3 2.2 106 111 A V < - 0 0 16 -3,-1.0 3,-0.2 1,-0.1 -23,-0.1 -0.176 62.6-139.0 -53.7 141.3 -25.4 -9.4 4.6 107 112 A Q S S+ 0 0 147 1,-0.2 2,-0.4 -24,-0.2 -23,-0.2 0.777 90.1 33.8 -72.8 -28.4 -27.1 -9.8 8.0 108 113 A N E -e 84 0A 65 -25,-1.6 -23,-2.5 2,-0.0 2,-0.4 -0.934 64.4-179.5-135.0 112.8 -28.3 -6.2 8.0 109 114 A R E -e 85 0A 94 -2,-0.4 2,-0.4 -25,-0.2 -23,-0.2 -0.914 8.9-176.7-110.1 136.5 -29.4 -4.1 5.0 110 115 A Y E -e 86 0A 113 -25,-2.7 -23,-2.2 -2,-0.4 2,-0.5 -0.971 16.1-150.4-130.5 146.0 -30.5 -0.5 5.5 111 116 A T E -e 87 0A 86 -2,-0.4 -23,-0.2 -25,-0.2 -22,-0.1 -0.982 23.3-127.9-118.1 121.3 -31.9 2.0 3.0 112 117 A F - 0 0 18 -25,-3.4 -26,-0.0 -2,-0.5 -2,-0.0 -0.341 9.7-133.3 -64.1 149.1 -31.2 5.6 3.7 113 118 A A S S+ 0 0 94 -24,-0.1 2,-0.3 -25,-0.1 -1,-0.1 0.544 87.6 68.3 -80.5 -6.7 -34.2 7.9 3.7 114 119 A F S S- 0 0 36 1,-0.1 -25,-2.8 2,-0.0 -2,-0.1 -0.769 84.1-112.7-113.6 159.7 -32.1 10.3 1.6 115 120 A G - 0 0 14 -2,-0.3 -1,-0.1 -27,-0.2 -2,-0.1 -0.281 19.8-122.7 -82.9 171.4 -30.8 10.2 -2.0 116 121 A G + 0 0 4 -27,-0.3 -40,-0.1 4,-0.1 2,-0.1 0.176 66.9 124.7-101.1 18.0 -27.2 10.0 -3.1 117 122 A N S > S- 0 0 71 1,-0.1 4,-2.4 4,-0.0 3,-0.3 -0.417 72.3-114.8 -75.6 152.1 -27.2 13.1 -5.3 118 123 A Y H > S+ 0 0 29 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.892 112.1 61.4 -54.2 -44.4 -24.6 15.9 -4.6 119 124 A D H > S+ 0 0 117 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.927 112.5 37.2 -49.2 -50.1 -27.2 18.4 -3.5 120 125 A R H > S+ 0 0 119 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.910 116.3 51.5 -69.2 -45.3 -28.4 16.2 -0.6 121 126 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.881 109.9 50.1 -60.3 -40.2 -24.9 14.9 0.3 122 127 A E H X>S+ 0 0 22 -4,-3.2 5,-1.4 -5,-0.2 4,-1.4 0.850 109.5 52.2 -67.4 -34.8 -23.5 18.4 0.5 123 128 A Q H <5S+ 0 0 144 -4,-1.3 -2,-0.2 -5,-0.3 -1,-0.2 0.932 113.6 43.1 -65.5 -46.6 -26.4 19.4 2.7 124 129 A L H <5S+ 0 0 46 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.918 115.9 47.7 -65.9 -43.5 -25.7 16.5 5.1 125 130 A A H <5S- 0 0 9 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.709 102.2-132.6 -70.7 -22.5 -21.9 17.0 5.0 126 131 A G T <5S+ 0 0 57 -4,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.807 76.4 82.9 73.0 29.3 -22.3 20.8 5.6 127 132 A N S - 0 0 81 -2,-0.3 3,-1.5 1,-0.1 4,-0.2 -0.386 35.3-105.9 -84.7 167.4 -19.9 21.8 -0.9 129 134 A R G > S+ 0 0 19 1,-0.3 3,-2.2 2,-0.2 -1,-0.1 0.905 118.7 64.9 -58.5 -41.3 -17.7 19.8 -3.3 130 135 A E G 3 S+ 0 0 112 1,-0.3 -1,-0.3 64,-0.1 64,-0.2 0.645 107.4 42.8 -58.7 -13.4 -15.5 22.9 -3.9 131 136 A N G < S+ 0 0 91 -3,-1.5 2,-0.6 62,-0.1 -1,-0.3 0.275 93.8 89.8-116.8 9.3 -14.6 22.8 -0.2 132 137 A I S < S- 0 0 0 -3,-2.2 2,-0.1 -4,-0.2 61,-0.1 -0.938 75.0-130.1-110.9 116.6 -14.0 19.0 0.2 133 138 A E - 0 0 90 -2,-0.6 2,-0.3 61,-0.2 61,-0.3 -0.390 20.5-159.0 -70.1 140.4 -10.4 17.9 -0.5 134 139 A L B +H 193 0D 0 59,-1.8 59,-2.0 -2,-0.1 2,-0.3 -0.840 36.6 90.2-117.4 154.7 -9.7 15.0 -2.8 135 140 A G S > S- 0 0 0 -2,-0.3 4,-1.9 57,-0.2 5,-0.2 -0.887 86.5 -58.8 148.3-176.9 -6.7 12.7 -3.1 136 141 A N H > S+ 0 0 25 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.861 129.8 52.8 -66.0 -36.7 -5.3 9.5 -1.7 137 142 A G H > S+ 0 0 21 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.942 110.1 46.8 -63.9 -49.4 -5.3 10.7 1.8 138 143 A P H > S+ 0 0 2 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.880 114.9 47.2 -60.1 -38.8 -9.0 11.7 1.7 139 144 A L H X S+ 0 0 1 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.915 110.0 52.3 -69.0 -43.2 -10.0 8.4 0.1 140 145 A E H X S+ 0 0 37 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.934 115.6 42.6 -55.4 -46.5 -7.9 6.5 2.7 141 146 A E H X S+ 0 0 105 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.878 110.9 54.5 -67.7 -42.3 -9.9 8.4 5.4 142 147 A A H X S+ 0 0 1 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.876 103.5 56.1 -61.3 -39.3 -13.2 8.0 3.6 143 148 A I H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.897 108.7 47.3 -62.1 -39.6 -12.8 4.3 3.5 144 149 A S H X S+ 0 0 29 -4,-1.2 4,-2.1 -5,-0.2 -2,-0.2 0.925 110.0 53.4 -67.4 -42.6 -12.4 4.2 7.3 145 150 A A H < S+ 0 0 11 -4,-2.2 4,-0.4 1,-0.2 -2,-0.2 0.926 110.6 45.3 -58.4 -48.2 -15.4 6.4 7.8 146 151 A L H >< S+ 0 0 0 -4,-2.5 3,-1.1 1,-0.2 4,-0.4 0.903 111.0 55.6 -62.8 -39.4 -17.7 4.2 5.8 147 152 A Y H 3< S+ 0 0 83 -4,-1.9 3,-0.3 -5,-0.2 -1,-0.2 0.872 110.2 43.4 -61.7 -38.8 -16.3 1.2 7.5 148 153 A Y T 3<>S+ 0 0 103 -4,-2.1 5,-1.4 1,-0.2 6,-0.8 0.328 84.7 98.5 -91.7 8.7 -17.1 2.4 11.0 149 154 A Y T X 5S+ 0 0 55 -3,-1.1 3,-1.4 -4,-0.4 -1,-0.2 0.915 77.9 54.2 -62.8 -44.7 -20.6 3.8 10.4 150 155 A S T 3 5S+ 0 0 62 -4,-0.4 -1,-0.2 -3,-0.3 -2,-0.1 0.781 106.8 52.9 -61.2 -28.6 -22.6 0.8 11.7 151 156 A T T 3 5S- 0 0 106 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.2 0.532 116.5-111.0 -85.1 -7.9 -20.8 1.0 15.0 152 157 A G T < 5S+ 0 0 50 -3,-1.4 -3,-0.2 -4,-0.5 -2,-0.1 0.440 87.0 116.5 93.1 0.6 -21.6 4.7 15.6 153 158 A G < + 0 0 56 -5,-1.4 2,-0.5 1,-0.1 -4,-0.2 0.724 64.5 67.3 -74.3 -20.1 -18.0 5.9 15.2 154 159 A T S S- 0 0 14 -6,-0.8 -2,-0.1 -5,-0.2 2,-0.1 -0.893 76.5-141.7-108.2 123.5 -18.9 7.9 12.1 155 160 A Q > - 0 0 123 -2,-0.5 4,-2.1 1,-0.1 5,-0.2 -0.421 27.3-110.1 -77.3 156.6 -21.1 11.0 12.2 156 161 A L H > S+ 0 0 63 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.881 117.0 52.2 -54.6 -45.4 -23.6 11.7 9.4 157 162 A P H > S+ 0 0 62 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.925 111.9 47.0 -59.0 -42.0 -21.7 14.8 8.1 158 163 A T H > S+ 0 0 66 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.832 110.6 51.9 -68.9 -32.3 -18.5 12.7 7.9 159 164 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.946 111.8 46.6 -67.6 -47.4 -20.3 9.8 6.2 160 165 A A H X S+ 0 0 2 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.896 111.4 51.3 -60.2 -42.6 -21.8 12.2 3.6 161 166 A R H X S+ 0 0 76 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.896 109.5 51.5 -61.1 -41.9 -18.4 13.9 3.1 162 167 A S H X S+ 0 0 5 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.857 108.0 50.4 -65.0 -38.9 -16.9 10.4 2.6 163 168 A F H X S+ 0 0 3 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.927 107.0 55.3 -65.1 -44.2 -19.4 9.4 -0.1 164 169 A I H X S+ 0 0 0 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.874 110.5 46.6 -55.8 -36.5 -18.7 12.7 -1.9 165 170 A I H X S+ 0 0 10 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.955 113.7 45.3 -71.7 -50.7 -15.0 11.7 -2.0 166 171 A C H X>S+ 0 0 2 -4,-2.5 4,-1.4 1,-0.2 5,-0.5 0.920 112.0 52.9 -58.7 -46.8 -15.6 8.1 -3.2 167 172 A I H X>S+ 0 0 13 -4,-3.1 5,-2.2 1,-0.2 4,-0.8 0.912 113.1 42.6 -57.5 -46.0 -18.1 9.1 -5.8 168 173 A Q H <>S+ 0 0 0 -4,-1.5 5,-0.8 -5,-0.3 -1,-0.2 0.909 116.2 46.4 -70.8 -39.8 -15.8 11.7 -7.4 169 174 A M H <5S+ 0 0 1 -4,-2.4 -1,-0.2 3,-0.2 -2,-0.2 0.633 130.1 21.8 -78.6 -11.6 -12.6 9.6 -7.3 170 175 A I H X5S+ 0 0 1 -4,-1.4 4,-1.9 -5,-0.2 -3,-0.2 0.730 130.9 30.5-117.5 -64.8 -14.4 6.5 -8.7 171 176 A S H X S+ 0 0 64 69,-0.7 4,-2.5 -2,-0.5 70,-0.2 0.853 99.3 61.1 -60.7 -31.6 -10.6 11.0 -18.5 178 183 A Y H > S+ 0 0 57 68,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.903 106.8 41.3 -60.9 -44.1 -10.1 14.6 -17.4 179 184 A I H > S+ 0 0 0 67,-0.3 4,-2.1 -7,-0.3 5,-0.2 0.895 111.5 55.2 -73.1 -39.7 -11.1 14.0 -13.8 180 185 A E H X S+ 0 0 14 -4,-2.5 4,-2.1 -7,-0.5 -2,-0.2 0.935 108.0 53.2 -56.0 -41.8 -9.2 10.7 -13.7 181 186 A G H X S+ 0 0 28 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.868 105.6 50.9 -60.6 -40.9 -6.2 12.9 -14.8 182 187 A E H X S+ 0 0 8 -4,-1.5 4,-1.6 1,-0.2 -1,-0.2 0.852 111.2 48.8 -67.4 -33.7 -6.7 15.3 -11.9 183 188 A M H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.864 107.4 54.9 -73.2 -35.4 -6.8 12.5 -9.4 184 189 A R H X S+ 0 0 79 -4,-2.1 4,-3.2 -5,-0.2 -2,-0.2 0.928 106.9 51.7 -62.1 -43.4 -3.6 10.9 -10.9 185 190 A T H X S+ 0 0 64 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.930 108.7 50.0 -57.9 -47.6 -1.8 14.3 -10.4 186 191 A R H <>S+ 0 0 16 -4,-1.6 5,-2.0 1,-0.2 4,-0.4 0.894 114.1 45.6 -58.7 -41.3 -2.9 14.4 -6.7 187 192 A I H ><5S+ 0 0 12 -4,-2.2 3,-0.8 3,-0.2 -2,-0.2 0.927 107.4 57.3 -68.6 -45.9 -1.6 10.8 -6.2 188 193 A R H 3<5S+ 0 0 117 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.893 121.9 26.5 -52.9 -44.4 1.6 11.4 -8.1 189 194 A Y T 3<5S- 0 0 143 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.327 103.5-127.1-103.2 8.3 2.6 14.3 -5.7 190 195 A N T < 5 + 0 0 113 -3,-0.8 2,-0.4 -4,-0.4 -3,-0.2 0.906 60.3 144.0 43.9 52.8 0.6 13.0 -2.8 191 196 A R < - 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0 0 2 -74,-1.6 2,-0.3 -212,-0.1 -1,-0.2 -0.993 62.7-145.0-155.1 153.8 -18.2 7.3 -21.3 250 255 A M B -g 39 0C 0 -212,-2.0 -210,-3.1 -2,-0.3 2,-0.3 -0.859 23.2-112.5-121.2 157.7 -21.8 8.6 -21.6 251 256 A V - 0 0 14 -2,-0.3 2,-0.4 -45,-0.3 -178,-0.1 -0.653 47.0-100.8 -84.2 142.2 -25.2 7.7 -20.2 252 257 A Y + 0 0 59 -180,-0.5 -209,-0.2 -211,-0.3 3,-0.1 -0.519 54.5 157.7 -67.3 121.3 -27.6 6.3 -22.8 253 258 A R - 0 0 128 1,-0.4 2,-0.3 -2,-0.4 -1,-0.2 0.713 60.3 -3.7-114.7 -37.5 -29.9 9.1 -23.8 254 259 A C S S- 0 0 25 3,-0.0 -1,-0.4 -43,-0.0 -39,-0.0 -0.972 78.7 -87.2-152.9 163.9 -31.3 8.1 -27.3 255 260 A A - 0 0 65 -2,-0.3 0, 0.0 -3,-0.1 0, 0.0 -0.456 51.5-104.2 -73.2 148.4 -30.9 5.5 -30.0 256 261 A P - 0 0 70 0, 0.0 -1,-0.1 0, 0.0 -41,-0.1 -0.597 37.4-117.8 -76.6 129.2 -28.1 6.1 -32.5 257 262 A P 0 0 98 0, 0.0 -3,-0.0 0, 0.0 -42,-0.0 -0.150 360.0 360.0 -60.0 160.7 -29.4 7.3 -35.9 258 263 A P 0 0 184 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.205 360.0 360.0 -49.6 360.0 -28.8 5.1 -39.0