==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 15-OCT-03 1UQ5 . COMPND 2 MOLECULE: RICIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RICINUS COMMUNIS; . AUTHOR C.J.MARSDEN,V.FULOP . 263 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12712.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 12.5 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 1.1 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 0.4 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 . 13 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 30.0 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 0 1 1 0 0 0 1 1 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 . 2 1 0 2 1 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 5 A Q 0 0 219 0, 0.0 3,-0.1 0, 0.0 49,-0.0 0.000 360.0 360.0 360.0 149.6 80.2 -21.8 97.1 2 6 A Y - 0 0 31 1,-0.1 52,-0.2 52,-0.1 49,-0.1 -0.453 360.0 -81.4 -61.1 150.3 76.8 -21.5 95.4 3 7 A P - 0 0 39 0, 0.0 52,-2.8 0, 0.0 2,-0.4 -0.325 46.4-149.9 -55.1 141.1 76.0 -17.9 94.2 4 8 A I E -a 55 0A 84 50,-0.2 2,-0.4 -3,-0.1 52,-0.2 -0.951 11.4-169.7-115.9 135.9 74.7 -15.6 96.9 5 9 A I E -a 56 0A 14 50,-2.4 52,-2.4 -2,-0.4 2,-0.3 -0.992 16.2-147.1-123.2 131.8 72.3 -12.7 96.3 6 10 A N E +a 57 0A 103 -2,-0.4 2,-0.3 50,-0.2 52,-0.2 -0.738 20.7 169.7 -99.8 141.8 71.7 -10.2 99.2 7 11 A F E -a 58 0A 13 50,-2.4 52,-2.3 -2,-0.3 2,-0.4 -0.978 10.9-164.7-145.2 142.7 68.5 -8.4 100.0 8 12 A T E -a 59 0A 53 -2,-0.3 52,-0.2 50,-0.2 133,-0.1 -0.990 20.6-153.3-125.2 142.6 67.5 -6.3 103.0 9 13 A T S > S+ 0 0 1 50,-2.1 3,-1.6 -2,-0.4 2,-0.5 0.639 70.6 106.7 -75.5 -15.5 64.1 -5.1 104.2 10 14 A A T 3 S- 0 0 34 1,-0.3 -2,-0.1 49,-0.3 49,-0.0 -0.534 104.5 -13.1 -75.3 119.1 65.9 -2.2 106.0 11 15 A G T 3 S+ 0 0 73 -2,-0.5 -1,-0.3 1,-0.2 5,-0.1 0.777 94.0 178.7 62.9 27.5 65.1 0.8 103.9 12 16 A A < - 0 0 15 -3,-1.6 2,-0.3 4,-0.1 -1,-0.2 -0.331 4.4-175.8 -59.9 144.5 63.8 -1.3 101.0 13 17 A T > - 0 0 73 1,-0.1 4,-2.7 176,-0.0 5,-0.3 -0.835 43.3 -98.9-131.4 172.6 62.6 0.5 98.0 14 18 A V H > S+ 0 0 19 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.933 124.1 48.2 -56.2 -46.0 60.9 -0.5 94.8 15 19 A Q H > S+ 0 0 110 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.911 109.4 49.6 -67.6 -40.8 64.3 -0.2 93.1 16 20 A S H > S+ 0 0 40 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.910 114.8 45.7 -69.3 -32.9 66.3 -2.2 95.6 17 21 A Y H X S+ 0 0 3 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.919 112.1 52.0 -72.1 -36.8 63.7 -5.0 95.5 18 22 A T H X S+ 0 0 9 -4,-2.8 4,-2.6 -5,-0.3 5,-0.2 0.914 109.3 49.3 -59.6 -45.0 63.6 -4.9 91.7 19 23 A N H X S+ 0 0 86 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.894 111.4 50.9 -60.1 -45.3 67.4 -5.2 91.6 20 24 A F H X S+ 0 0 7 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.946 111.0 45.2 -56.8 -51.6 67.2 -8.1 93.9 21 25 A I H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.897 112.5 51.9 -63.5 -39.2 64.6 -10.1 91.9 22 26 A R H X S+ 0 0 150 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.923 110.9 48.5 -64.7 -38.7 66.4 -9.4 88.7 23 27 A A H X S+ 0 0 43 -4,-2.3 4,-1.4 -5,-0.2 -2,-0.2 0.919 110.1 51.6 -66.4 -38.7 69.7 -10.7 90.2 24 28 A V H >X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 3,-0.6 0.961 109.9 48.6 -60.0 -52.4 67.9 -13.8 91.5 25 29 A R H 3X S+ 0 0 38 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.904 107.2 57.0 -56.4 -38.8 66.4 -14.6 88.1 26 30 A G H 3< S+ 0 0 54 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.778 111.4 42.7 -68.1 -26.3 69.9 -14.1 86.5 27 31 A R H << S+ 0 0 147 -4,-1.4 -1,-0.2 -3,-0.6 -2,-0.2 0.656 111.8 54.0 -88.8 -19.1 71.3 -16.8 88.8 28 32 A L H < S+ 0 0 3 -4,-1.7 2,-0.4 1,-0.2 -2,-0.2 0.887 114.7 32.3 -77.3 -37.5 68.4 -19.1 88.4 29 33 A T < - 0 0 25 -4,-2.0 -1,-0.2 12,-0.1 12,-0.1 -0.972 61.5-154.3-125.7 153.5 68.4 -19.3 84.5 30 34 A T - 0 0 108 -2,-0.4 11,-0.1 10,-0.2 -4,-0.1 0.305 42.9-107.0-106.4 -7.7 71.3 -19.1 82.2 31 35 A G S S+ 0 0 57 9,-0.2 3,-0.1 2,-0.2 10,-0.1 0.340 90.1 109.4 99.6 -21.0 69.9 -17.9 79.0 32 36 A A S S+ 0 0 93 1,-0.2 2,-0.5 8,-0.1 -1,-0.0 0.781 77.1 43.7 -63.0 -30.2 70.1 -21.2 77.2 33 37 A D + 0 0 32 7,-0.3 7,-2.8 2,-0.0 2,-0.4 -0.944 58.2 154.2-135.4 108.7 66.4 -21.9 77.1 34 38 A V E -F 39 0B 75 -2,-0.5 2,-0.5 5,-0.3 3,-0.1 -0.981 14.9-174.1-142.5 118.4 63.8 -19.3 76.2 35 39 A R E > S-F 38 0B 20 3,-2.7 3,-2.4 -2,-0.4 -2,-0.0 -0.946 75.7 -9.1-119.9 125.6 60.5 -20.4 74.7 36 40 A H T 3 S- 0 0 79 -2,-0.5 -1,-0.2 1,-0.3 179,-0.0 0.869 129.2 -55.8 53.1 38.8 58.1 -17.6 73.6 37 41 A E T 3 S+ 0 0 149 1,-0.2 -1,-0.3 -3,-0.1 0, 0.0 0.236 118.9 115.4 76.8 0.3 60.2 -15.0 75.1 38 42 A I E < -F 35 0B 3 -3,-2.4 -3,-2.7 212,-0.0 -1,-0.2 -0.811 63.1-131.2-112.8 119.5 59.9 -16.9 78.5 39 43 A P E -F 34 0B 39 0, 0.0 212,-1.6 0, 0.0 2,-0.4 -0.345 14.1-142.4 -65.3 149.7 62.9 -18.3 80.0 40 44 A V B -g 251 0C 6 -7,-2.8 -7,-0.3 210,-0.2 -10,-0.2 -0.897 15.6-122.0-111.3 139.4 63.1 -21.9 81.3 41 45 A L - 0 0 0 210,-3.1 -12,-0.1 -2,-0.4 32,-0.1 -0.314 49.0 -77.9 -67.0 161.2 64.9 -23.0 84.4 42 46 A P - 0 0 30 0, 0.0 211,-0.3 0, 0.0 2,-0.3 -0.253 49.3-105.4 -65.7 147.1 67.6 -25.7 84.0 43 47 A N - 0 0 54 1,-0.1 4,-0.1 -3,-0.1 30,-0.1 -0.525 19.3-143.1 -64.8 131.8 66.4 -29.3 83.5 44 48 A R S > S+ 0 0 92 -2,-0.3 3,-1.8 209,-0.2 2,-0.3 0.820 76.3 98.3 -64.2 -30.9 67.1 -31.3 86.7 45 49 A V T 3 S- 0 0 115 1,-0.3 -2,-0.1 3,-0.0 0, 0.0 -0.443 105.2 -5.0 -68.4 121.1 68.0 -34.3 84.6 46 50 A G T 3 S+ 0 0 74 -2,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.469 92.0 150.8 80.1 -1.5 71.8 -34.4 84.4 47 51 A L < - 0 0 32 -3,-1.8 -1,-0.2 -4,-0.1 5,-0.1 -0.520 47.7-122.2 -71.5 124.3 72.3 -31.1 86.3 48 52 A P > - 0 0 61 0, 0.0 3,-2.5 0, 0.0 4,-0.2 -0.319 15.0-122.2 -66.0 145.7 75.6 -31.1 88.2 49 53 A I G > S+ 0 0 56 1,-0.3 3,-1.6 2,-0.2 4,-0.4 0.807 109.6 63.9 -58.9 -30.1 75.3 -30.6 91.9 50 54 A N G 3 S+ 0 0 113 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.586 108.4 42.6 -69.0 -7.8 77.6 -27.6 91.8 51 55 A Q G < S+ 0 0 106 -3,-2.5 -1,-0.3 1,-0.1 -2,-0.2 0.206 91.7 91.6-115.6 12.6 75.0 -25.8 89.6 52 56 A R S < S+ 0 0 20 -3,-1.6 20,-2.6 -4,-0.2 21,-0.4 0.762 82.1 33.9 -91.4 -24.4 71.9 -26.9 91.6 53 57 A F E - B 0 71A 3 -4,-0.4 2,-0.3 18,-0.2 18,-0.2 -0.881 50.1-163.0-130.2 159.8 71.3 -24.2 94.2 54 58 A I E - B 0 70A 2 16,-2.1 16,-2.9 -2,-0.3 2,-0.4 -0.925 21.1-131.5-132.8 161.9 71.6 -20.5 94.8 55 59 A L E -aB 4 69A 18 -52,-2.8 -50,-2.4 -2,-0.3 2,-0.6 -0.935 8.3-160.4-119.6 136.6 71.5 -18.7 98.2 56 60 A V E -aB 5 68A 0 12,-2.9 12,-3.1 -2,-0.4 2,-0.7 -0.983 9.7-157.3-117.8 110.2 69.5 -15.6 99.2 57 61 A E E -aB 6 67A 59 -52,-2.4 -50,-2.4 -2,-0.6 2,-0.5 -0.860 12.9-166.6 -91.4 112.4 70.9 -13.8 102.2 58 62 A L E +aB 7 66A 0 8,-2.9 8,-2.3 -2,-0.7 2,-0.3 -0.875 8.1 179.8-104.7 126.4 68.1 -11.8 103.8 59 63 A S E -aB 8 65A 30 -52,-2.3 -50,-2.1 -2,-0.5 -49,-0.3 -0.854 7.5-159.2-117.8 163.2 68.8 -9.1 106.4 60 64 A N > - 0 0 4 4,-1.7 3,-2.1 -2,-0.3 4,-0.1 -0.815 38.6 -96.1-136.5 173.4 66.4 -6.9 108.3 61 65 A H T 3 S+ 0 0 148 1,-0.3 -1,-0.0 -2,-0.3 -53,-0.0 0.791 119.7 67.7 -64.7 -25.3 66.4 -3.6 110.1 62 66 A A T 3 S- 0 0 51 79,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.419 116.3-115.2 -73.9 9.0 66.8 -5.6 113.4 63 67 A E S < S+ 0 0 169 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.744 73.0 132.5 62.1 35.4 70.3 -6.5 112.1 64 68 A L - 0 0 16 -4,-0.1 -4,-1.7 2,-0.0 2,-0.4 -0.800 35.9-165.5-109.7 154.4 69.4 -10.2 111.8 65 69 A S E -B 59 0A 41 -2,-0.3 2,-0.3 -6,-0.2 18,-0.3 -0.994 11.4-179.3-136.8 145.2 70.1 -12.4 108.7 66 70 A V E -B 58 0A 2 -8,-2.3 -8,-2.9 -2,-0.4 2,-0.5 -0.960 20.8-137.5-131.6 157.7 69.1 -15.7 107.4 67 71 A T E -BC 57 81A 7 14,-2.8 14,-2.3 -2,-0.3 2,-0.3 -0.959 14.7-159.4-115.3 117.2 70.2 -17.5 104.2 68 72 A L E -BC 56 80A 0 -12,-3.1 -12,-2.9 -2,-0.5 2,-0.5 -0.755 9.3-143.5 -88.8 143.4 67.5 -19.3 102.1 69 73 A A E -BC 55 79A 0 10,-2.6 9,-2.6 -2,-0.3 10,-0.9 -0.929 15.8-164.2-106.2 129.7 68.6 -21.9 99.7 70 74 A L E -BC 54 77A 0 -16,-2.9 -16,-2.1 -2,-0.5 2,-0.5 -0.943 18.7-130.1-114.0 135.5 66.7 -22.1 96.4 71 75 A D E >> -B 53 0A 5 5,-2.4 4,-2.2 -2,-0.4 3,-1.3 -0.739 14.2-146.4 -76.0 126.1 66.7 -25.0 94.0 72 76 A V T 34 S+ 0 0 5 -20,-2.6 -1,-0.1 -2,-0.5 -19,-0.1 0.723 92.5 67.3 -70.5 -16.0 67.4 -23.7 90.5 73 77 A T T 34 S+ 0 0 4 -21,-0.4 180,-0.5 1,-0.2 -1,-0.3 0.731 125.2 5.8 -78.8 -19.7 65.2 -26.2 88.9 74 78 A N T <4 S- 0 0 46 -3,-1.3 -2,-0.2 2,-0.1 -1,-0.2 0.372 91.8-123.0-139.5 -1.0 62.0 -24.8 90.4 75 79 A A < + 0 0 0 -4,-2.2 2,-0.2 1,-0.2 -3,-0.2 0.529 65.9 137.6 65.5 10.9 63.1 -21.6 92.2 76 80 A Y - 0 0 38 -5,-0.4 -5,-2.4 1,-0.1 2,-0.4 -0.452 61.0-103.8 -99.8 154.3 61.6 -22.8 95.4 77 81 A V E +C 70 0A 3 -7,-0.2 -7,-0.2 -2,-0.2 3,-0.1 -0.656 32.3 177.1 -67.5 125.6 63.0 -22.6 98.9 78 82 A V E - 0 0 26 -9,-2.6 11,-2.2 -2,-0.4 2,-0.3 0.527 61.8 -43.0-105.9 -12.7 64.5 -25.9 100.1 79 83 A G E -CD 69 88A 2 -10,-0.9 -10,-2.6 9,-0.3 -1,-0.4 -0.977 53.5-126.5 168.9-178.5 65.8 -24.8 103.5 80 84 A Y E -CD 68 87A 1 7,-2.5 7,-2.7 -2,-0.3 2,-0.4 -0.981 6.1-136.4-153.9 158.2 67.6 -22.1 105.4 81 85 A R E -CD 67 86A 80 -14,-2.3 -14,-2.8 -2,-0.3 2,-0.4 -0.976 12.7-179.1-116.1 141.0 70.5 -21.3 107.7 82 86 A A E > - D 0 85A 8 3,-2.7 3,-2.0 -2,-0.4 -16,-0.1 -0.944 64.9 -59.8-133.1 106.5 70.5 -19.0 110.7 83 87 A G T 3 S- 0 0 41 -2,-0.4 -1,-0.1 -18,-0.3 65,-0.0 -0.295 123.0 -5.1 60.6-125.2 73.9 -18.8 112.4 84 88 A N T 3 S+ 0 0 78 23,-0.1 25,-1.8 -3,-0.1 2,-0.4 0.232 123.2 71.3 -90.6 18.5 74.9 -22.3 113.5 85 89 A S E < -De 82 109A 9 -3,-2.0 -3,-2.7 23,-0.2 2,-0.3 -0.963 55.2-170.4-134.1 142.3 71.6 -24.2 112.6 86 90 A A E -De 81 110A 0 23,-2.4 25,-2.3 -2,-0.4 2,-0.4 -0.990 4.8-163.5-126.4 145.1 70.2 -25.1 109.2 87 91 A Y E -De 80 111A 14 -7,-2.7 -7,-2.5 -2,-0.3 2,-0.4 -0.994 3.4-166.6-134.8 137.1 66.8 -26.5 108.5 88 92 A F E -De 79 112A 2 23,-2.1 25,-3.0 -2,-0.4 -9,-0.3 -0.923 25.0-113.3-124.1 135.9 65.5 -28.3 105.4 89 93 A F - 0 0 16 -11,-2.2 27,-0.3 -2,-0.4 25,-0.1 -0.383 53.6 -83.1 -56.3 151.6 62.1 -29.1 104.1 90 94 A H - 0 0 100 25,-2.6 27,-0.3 1,-0.1 -1,-0.1 -0.373 54.6-117.3 -57.4 124.2 61.4 -32.8 104.0 91 95 A P - 0 0 26 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 -0.372 7.4-141.0 -70.9 151.4 62.8 -34.1 100.7 92 96 A D S S- 0 0 143 -2,-0.1 2,-0.3 1,-0.1 -2,-0.1 0.710 80.3 -3.0 -78.0 -23.0 60.5 -35.6 98.0 93 97 A N S > S- 0 0 75 1,-0.1 4,-2.1 0, 0.0 5,-0.1 -0.922 79.4 -89.9-165.0 170.0 63.0 -38.2 97.0 94 98 A Q H > S+ 0 0 163 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.859 119.2 54.8 -65.0 -36.4 66.5 -39.7 97.6 95 99 A E H > S+ 0 0 155 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.930 110.0 46.8 -65.9 -38.0 68.2 -37.6 95.0 96 100 A D H > S+ 0 0 21 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.879 109.9 53.9 -70.7 -33.9 66.9 -34.4 96.6 97 101 A A H X S+ 0 0 30 -4,-2.1 4,-0.6 1,-0.2 -1,-0.2 0.915 112.0 45.0 -64.0 -39.2 67.9 -35.6 100.1 98 102 A E H >< S+ 0 0 101 -4,-2.3 3,-1.1 2,-0.2 4,-0.3 0.925 109.4 56.2 -69.1 -38.0 71.4 -36.2 98.8 99 103 A A H >< S+ 0 0 2 -4,-2.4 3,-2.1 1,-0.3 -2,-0.2 0.933 101.0 55.9 -62.4 -37.3 71.5 -32.9 97.0 100 104 A I H >< S+ 0 0 16 -4,-2.0 3,-1.8 1,-0.3 -1,-0.3 0.740 89.9 75.2 -74.0 -10.8 70.7 -30.9 100.2 101 105 A T T << S+ 0 0 76 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.711 89.1 62.5 -68.3 -11.1 73.7 -32.4 101.9 102 106 A H T < S+ 0 0 67 -3,-2.1 2,-0.4 -4,-0.3 3,-0.3 0.481 89.3 88.2 -92.5 1.7 75.7 -30.0 99.7 103 107 A L S < S- 0 0 1 -3,-1.8 -34,-0.0 1,-0.2 -3,-0.0 -0.795 100.4 -5.6-102.4 140.9 74.1 -27.0 101.3 104 108 A F S > S+ 0 0 21 -2,-0.4 3,-1.6 1,-0.1 -1,-0.2 0.915 77.5 175.0 52.8 48.5 75.4 -25.2 104.4 105 109 A T T 3 + 0 0 93 -3,-0.3 -1,-0.1 1,-0.3 -2,-0.1 0.713 67.6 47.9 -70.9 -21.4 78.0 -27.9 104.8 106 110 A D T 3 S+ 0 0 129 3,-0.0 -1,-0.3 0, 0.0 2,-0.1 0.303 79.3 122.2 -97.9 7.7 79.9 -26.4 107.8 107 111 A V < - 0 0 15 -3,-1.6 3,-0.1 1,-0.1 -23,-0.1 -0.445 59.3-140.5 -67.8 141.4 76.9 -25.6 109.9 108 112 A Q S S+ 0 0 151 1,-0.2 2,-0.5 -2,-0.1 -23,-0.2 0.874 85.6 40.4 -73.3 -32.0 77.1 -27.3 113.2 109 113 A N E -e 85 0A 65 -25,-1.8 -23,-2.4 2,-0.0 2,-0.4 -0.940 67.7-177.6-122.5 119.9 73.4 -28.3 113.6 110 114 A R E +e 86 0A 92 -2,-0.5 2,-0.4 -25,-0.2 -23,-0.2 -0.926 4.9 179.9-118.1 132.9 71.5 -29.6 110.6 111 115 A Y E -e 87 0A 106 -25,-2.3 -23,-2.1 -2,-0.4 2,-0.5 -0.989 19.1-154.3-133.2 143.5 67.9 -30.5 110.7 112 116 A T E -e 88 0A 81 -2,-0.4 -23,-0.2 -25,-0.2 2,-0.1 -0.978 23.8-133.5-111.5 122.4 65.4 -31.9 108.3 113 117 A F - 0 0 15 -25,-3.0 -26,-0.0 -2,-0.5 -2,-0.0 -0.387 11.1-132.0 -63.2 151.2 61.8 -31.0 109.0 114 118 A A S S+ 0 0 95 -24,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.755 88.7 68.2 -83.7 -1.6 59.4 -33.8 108.7 115 119 A F S S- 0 0 29 1,-0.1 -25,-2.6 2,-0.0 -2,-0.2 -0.688 79.3-127.1-112.7 153.6 57.1 -31.7 106.6 116 120 A G - 0 0 19 -27,-0.3 -1,-0.1 -2,-0.3 -2,-0.1 -0.242 23.2-111.3 -87.9-177.7 57.6 -30.3 103.1 117 121 A G + 0 0 10 -27,-0.3 -40,-0.1 -2,-0.1 2,-0.1 0.260 68.1 125.4-105.7 10.1 57.4 -26.8 101.9 118 122 A A > - 0 0 60 1,-0.1 4,-2.7 4,-0.0 3,-0.3 -0.368 68.8-118.1 -69.8 148.9 54.3 -26.9 99.8 119 123 A Y H > S+ 0 0 18 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.830 109.7 60.0 -62.3 -32.3 51.6 -24.4 100.6 120 124 A D H > S+ 0 0 126 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.942 113.1 40.9 -62.3 -45.1 48.9 -26.9 101.6 121 125 A R H > S+ 0 0 113 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.936 115.7 47.7 -61.6 -49.8 51.2 -28.2 104.2 122 126 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.877 109.8 52.7 -67.3 -34.9 52.5 -24.9 105.4 123 127 A E H X>S+ 0 0 17 -4,-3.1 4,-1.4 1,-0.2 5,-1.2 0.877 108.1 51.6 -66.5 -39.7 49.0 -23.4 105.6 124 128 A Q H <5S+ 0 0 116 -4,-1.8 3,-0.4 -5,-0.3 -1,-0.2 0.926 114.6 44.4 -56.7 -54.0 47.8 -26.3 107.8 125 129 A L H <5S+ 0 0 29 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.833 114.8 47.6 -57.2 -43.0 50.9 -25.7 110.1 126 130 A A H <5S- 0 0 7 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.681 102.4-131.4 -70.7 -24.9 50.3 -21.9 110.1 127 131 A G T <5S+ 0 0 59 -4,-1.4 2,-0.3 -3,-0.4 -3,-0.2 0.693 78.5 82.0 76.8 18.6 46.6 -22.2 110.9 128 132 A N S - 0 0 83 -2,-0.3 3,-2.4 1,-0.1 4,-0.1 -0.467 37.1-105.4 -71.9 156.3 45.6 -19.8 104.3 130 134 A R G > S+ 0 0 9 1,-0.3 3,-2.0 2,-0.2 -1,-0.1 0.874 119.9 67.3 -48.3 -36.8 47.7 -17.5 102.0 131 135 A E G 3 S+ 0 0 84 1,-0.3 -1,-0.3 64,-0.1 64,-0.2 0.626 104.7 42.4 -65.6 -11.9 44.7 -15.4 101.5 132 136 A N G < S+ 0 0 102 -3,-2.4 2,-0.5 62,-0.1 -1,-0.3 0.087 94.7 89.5-117.8 18.7 44.8 -14.5 105.2 133 137 A I S < S- 0 0 0 -3,-2.0 2,-0.1 63,-0.1 61,-0.1 -0.964 74.4-131.0-120.7 115.2 48.6 -13.9 105.6 134 138 A E - 0 0 87 -2,-0.5 2,-0.3 61,-0.2 61,-0.3 -0.385 19.3-159.6 -67.8 142.3 49.8 -10.4 104.8 135 139 A L B +H 194 0D 0 59,-2.2 59,-2.2 -2,-0.1 2,-0.3 -0.899 38.0 90.5-116.1 155.3 52.7 -9.7 102.5 136 140 A G S > S- 0 0 0 -2,-0.3 4,-2.1 57,-0.2 5,-0.2 -0.908 87.7 -58.3 148.1-173.0 54.9 -6.6 102.3 137 141 A N H > S+ 0 0 28 55,-0.4 4,-2.7 -2,-0.3 5,-0.2 0.899 130.9 52.4 -72.5 -33.6 58.1 -5.3 103.8 138 142 A G H > S+ 0 0 21 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.965 110.0 48.1 -69.9 -47.0 56.8 -5.4 107.3 139 143 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.890 113.8 48.5 -52.4 -45.0 55.8 -9.2 107.0 140 144 A L H X S+ 0 0 2 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.918 109.1 50.9 -67.8 -39.8 59.1 -10.0 105.5 141 145 A E H X S+ 0 0 36 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.927 115.2 45.5 -56.1 -47.9 61.1 -8.1 108.2 142 146 A E H X S+ 0 0 101 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.863 110.0 53.0 -65.0 -38.8 59.1 -10.1 110.7 143 147 A A H X S+ 0 0 1 -4,-2.4 4,-2.5 -5,-0.2 5,-0.2 0.894 105.9 54.1 -69.4 -36.8 59.5 -13.3 108.9 144 148 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.940 110.4 46.4 -60.9 -48.3 63.3 -12.9 108.8 145 149 A S H X S+ 0 0 26 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.904 110.7 53.1 -63.0 -41.0 63.4 -12.5 112.6 146 150 A A H X S+ 0 0 10 -4,-2.4 4,-0.7 1,-0.2 -2,-0.2 0.912 110.7 46.2 -61.8 -40.9 61.1 -15.4 113.1 147 151 A L H >< S+ 0 0 0 -4,-2.5 3,-0.8 1,-0.2 4,-0.4 0.917 111.1 53.8 -64.0 -37.5 63.3 -17.7 111.1 148 152 A Y H 3< S+ 0 0 88 -4,-2.3 3,-0.4 -5,-0.2 -2,-0.2 0.887 111.3 43.9 -67.8 -37.3 66.3 -16.4 112.9 149 153 A Y H >X>S+ 0 0 106 -4,-2.2 5,-1.4 1,-0.2 3,-1.2 0.423 86.3 96.2 -90.3 4.5 64.9 -17.1 116.5 150 154 A Y G X<5S+ 0 0 61 -3,-0.8 3,-1.6 -4,-0.7 5,-0.2 0.913 79.5 53.3 -60.2 -42.4 63.6 -20.6 115.6 151 155 A S G 345S+ 0 0 56 -4,-0.4 -1,-0.3 -3,-0.4 -2,-0.1 0.662 108.2 51.8 -70.6 -17.5 66.5 -22.5 116.9 152 156 A T G <45S- 0 0 108 -3,-1.2 -1,-0.3 -4,-0.1 -2,-0.2 0.414 117.4-104.4 -99.9 7.0 66.3 -20.8 120.3 153 157 A G T <<5S+ 0 0 52 -3,-1.6 -3,-0.2 -4,-0.5 -2,-0.1 0.432 89.4 113.6 91.9 -0.9 62.7 -21.5 121.0 154 158 A G < + 0 0 57 -5,-1.4 2,-0.5 1,-0.1 -4,-0.2 0.615 64.5 67.4 -83.8 -11.7 61.3 -18.0 120.3 155 159 A T S S- 0 0 12 -6,-0.5 -2,-0.1 -5,-0.2 -1,-0.1 -0.916 72.6-144.4-116.4 120.0 59.3 -19.0 117.3 156 160 A Q >> - 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