==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-JUL-11 3SRP . COMPND 2 MOLECULE: RICIN A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RICINUS COMMUNIS; . AUTHOR P.M.LEGLER,C.B.MILLARD . 262 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12158.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 69.1 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 . 33 12.6 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 . 18 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 78 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 1 0 1 1 0 0 1 0 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 6 A Y 0 0 77 0, 0.0 52,-0.2 0, 0.0 49,-0.1 0.000 360.0 360.0 360.0 142.9 12.6 43.2 44.7 2 7 A P - 0 0 41 0, 0.0 52,-3.6 0, 0.0 2,-0.4 -0.289 360.0-147.9 -59.1 141.4 16.1 42.1 46.0 3 8 A I E -a 54 0A 94 50,-0.2 2,-0.5 52,-0.1 52,-0.2 -0.953 11.2-165.7-117.1 131.5 18.4 40.9 43.2 4 9 A I E -a 55 0A 11 50,-3.2 52,-2.4 -2,-0.4 2,-0.4 -0.976 15.3-149.2-112.2 129.3 21.1 38.2 43.6 5 10 A N E +a 56 0A 106 -2,-0.5 2,-0.3 50,-0.2 52,-0.2 -0.815 21.0 167.5-102.1 134.7 23.6 38.0 40.8 6 11 A F E -a 57 0A 11 50,-2.5 52,-2.9 -2,-0.4 2,-0.4 -0.992 15.9-162.4-143.2 139.0 25.4 34.8 39.7 7 12 A T E -a 58 0A 56 -2,-0.3 52,-0.2 50,-0.2 133,-0.1 -0.982 12.7-160.8-118.0 134.1 27.5 33.9 36.7 8 13 A T > + 0 0 0 50,-2.4 3,-2.1 -2,-0.4 2,-0.3 0.722 69.3 103.8 -75.5 -25.8 28.2 30.4 35.6 9 14 A A T 3 S- 0 0 32 49,-0.3 -2,-0.1 1,-0.3 49,-0.0 -0.457 105.8 -10.5 -61.2 117.2 31.1 31.8 33.6 10 15 A G T 3 S+ 0 0 76 -2,-0.3 -1,-0.3 1,-0.2 5,-0.1 0.726 94.5 175.0 59.8 25.4 34.2 30.9 35.6 11 16 A A < - 0 0 14 -3,-2.1 2,-0.2 4,-0.1 -1,-0.2 -0.335 8.0-171.1 -60.6 139.6 32.0 29.9 38.5 12 17 A T > - 0 0 72 1,-0.1 4,-2.5 -2,-0.0 5,-0.3 -0.754 41.6 -99.5-122.2 172.1 33.9 28.4 41.5 13 18 A V H > S+ 0 0 21 -2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.919 125.8 50.1 -57.8 -40.3 32.7 26.7 44.6 14 19 A Q H > S+ 0 0 100 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.935 110.9 45.0 -64.1 -50.9 33.3 30.0 46.4 15 20 A S H > S+ 0 0 41 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.883 118.0 45.5 -64.6 -36.5 31.3 32.2 43.9 16 21 A Y H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 -2,-0.2 0.909 112.9 49.9 -68.9 -44.7 28.5 29.6 43.9 17 22 A T H X S+ 0 0 1 -4,-3.0 4,-2.7 -5,-0.3 5,-0.2 0.920 111.0 49.8 -58.4 -46.4 28.6 29.3 47.7 18 23 A N H X S+ 0 0 84 -4,-3.2 4,-1.9 2,-0.2 -1,-0.2 0.883 112.0 49.8 -57.2 -41.5 28.4 33.1 47.9 19 24 A F H X S+ 0 0 5 -4,-1.7 4,-2.5 -5,-0.2 -2,-0.2 0.949 112.6 44.0 -63.8 -52.8 25.5 33.0 45.5 20 25 A I H X S+ 0 0 0 -4,-3.0 4,-3.3 1,-0.2 5,-0.2 0.901 113.4 51.6 -62.7 -41.6 23.5 30.3 47.4 21 26 A R H X S+ 0 0 148 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.875 110.8 49.1 -61.9 -39.1 24.2 32.0 50.7 22 27 A A H X S+ 0 0 40 -4,-1.9 4,-2.5 -5,-0.2 -2,-0.2 0.934 114.0 44.8 -64.6 -47.1 22.9 35.3 49.3 23 28 A V H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.964 116.5 45.9 -59.7 -53.8 19.8 33.7 47.9 24 29 A R H X S+ 0 0 34 -4,-3.3 4,-0.8 1,-0.2 -2,-0.2 0.882 111.4 54.7 -54.8 -42.9 19.3 31.8 51.2 25 30 A G H >< S+ 0 0 41 -4,-2.6 3,-0.6 -5,-0.2 -1,-0.2 0.901 108.7 45.8 -57.8 -46.7 20.0 35.0 53.0 26 31 A R H 3< S+ 0 0 136 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.813 112.8 52.5 -66.6 -30.9 17.3 36.9 51.1 27 32 A L H 3< S+ 0 0 0 -4,-2.0 2,-0.9 -5,-0.2 -1,-0.2 0.608 94.0 83.9 -77.0 -15.4 15.0 33.9 51.8 28 33 A T << + 0 0 49 -4,-0.8 12,-0.1 -3,-0.6 -1,-0.1 -0.814 51.4 176.8 -96.4 103.6 15.7 34.1 55.5 29 34 A T - 0 0 71 -2,-0.9 -1,-0.2 10,-0.4 11,-0.1 0.759 35.4-135.8 -73.6 -26.3 13.5 36.7 57.1 30 35 A G S S+ 0 0 57 2,-0.2 3,-0.2 9,-0.2 -1,-0.1 0.398 83.0 101.0 80.5 -1.8 14.8 35.9 60.6 31 36 A A S S+ 0 0 91 1,-0.2 2,-0.4 8,-0.2 9,-0.1 0.721 81.8 37.5 -83.5 -23.8 11.2 36.0 61.8 32 37 A D + 0 0 24 7,-0.3 7,-3.8 2,-0.0 2,-0.5 -0.891 60.0 161.6-142.2 103.0 10.8 32.2 62.0 33 38 A V E -F 38 0B 79 -2,-0.4 2,-0.6 5,-0.3 3,-0.1 -0.991 13.9-170.3-125.6 122.1 13.5 29.7 63.0 34 39 A R E > S-F 37 0B 15 3,-2.9 3,-1.4 -2,-0.5 180,-0.1 -0.955 75.7 -19.9-118.1 110.3 12.4 26.2 64.0 35 40 A H T 3 S- 0 0 72 -2,-0.6 -1,-0.2 1,-0.3 179,-0.0 0.914 127.9 -51.5 55.1 47.8 15.1 24.1 65.6 36 41 A E T 3 S+ 0 0 150 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.412 118.9 112.8 73.2 -0.3 17.9 26.3 64.1 37 42 A I E < -F 34 0B 2 -3,-1.4 -3,-2.9 212,-0.0 -1,-0.2 -0.917 69.0-125.6-107.9 118.0 16.3 26.0 60.7 38 43 A P E -F 33 0B 25 0, 0.0 212,-1.8 0, 0.0 2,-0.4 -0.290 19.0-143.5 -57.4 140.0 14.8 29.1 59.1 39 44 A V B -g 250 0C 2 -7,-3.8 -10,-0.4 210,-0.2 -7,-0.3 -0.915 18.8-119.2-105.4 135.6 11.2 28.9 58.0 40 45 A L - 0 0 0 210,-3.8 32,-0.2 -2,-0.4 212,-0.1 -0.374 46.7 -81.8 -67.9 151.4 10.2 30.7 54.9 41 46 A P - 0 0 17 0, 0.0 211,-0.3 0, 0.0 -1,-0.1 -0.247 48.9-103.4 -59.4 142.5 7.5 33.3 55.4 42 47 A N - 0 0 51 1,-0.1 4,-0.1 2,-0.1 211,-0.1 -0.428 23.1-135.7 -60.3 136.3 3.9 32.1 55.5 43 48 A R S > S+ 0 0 90 209,-0.2 3,-1.5 29,-0.1 2,-0.3 0.859 81.9 87.5 -64.2 -37.1 2.0 32.9 52.2 44 49 A V T 3 S+ 0 0 110 1,-0.3 -2,-0.1 3,-0.0 0, 0.0 -0.496 106.6 1.8 -72.9 125.2 -1.1 34.2 54.0 45 50 A G T 3 S+ 0 0 76 -2,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.472 90.8 146.8 78.7 3.0 -0.9 37.9 54.8 46 51 A L < - 0 0 28 -3,-1.5 -1,-0.3 -4,-0.1 5,-0.1 -0.625 51.3-122.6 -75.4 115.1 2.5 38.1 53.1 47 52 A P > - 0 0 56 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.253 12.6-123.6 -59.7 143.1 2.7 41.6 51.5 48 53 A I G > S+ 0 0 44 1,-0.3 3,-1.1 2,-0.2 4,-0.4 0.784 112.6 61.1 -56.4 -29.5 3.4 41.6 47.8 49 54 A N G 3 S+ 0 0 133 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.682 109.0 41.4 -68.5 -22.6 6.5 43.8 48.5 50 55 A Q G < S+ 0 0 121 -3,-1.8 -1,-0.2 1,-0.1 -2,-0.2 0.097 97.4 87.7-109.3 17.7 8.0 41.0 50.6 51 56 A R S < S+ 0 0 13 -3,-1.1 20,-3.2 20,-0.1 21,-0.4 0.793 80.8 39.4 -94.7 -33.0 6.9 38.2 48.2 52 57 A F E - B 0 70A 3 -4,-0.4 2,-0.3 18,-0.2 18,-0.2 -0.875 47.8-165.3-127.6 152.3 9.7 37.8 45.6 53 58 A I E - B 0 69A 3 16,-2.3 16,-3.4 -2,-0.3 2,-0.4 -0.945 22.7-132.3-124.5 155.5 13.4 37.8 45.2 54 59 A L E -aB 3 68A 19 -52,-3.6 -50,-3.2 -2,-0.3 2,-0.6 -0.904 10.9-164.2-112.9 133.2 15.3 38.0 41.9 55 60 A V E -aB 4 67A 0 12,-3.5 12,-3.2 -2,-0.4 2,-0.6 -0.921 9.7-159.7-117.1 101.6 18.1 35.8 40.8 56 61 A E E -aB 5 66A 59 -52,-2.4 -50,-2.5 -2,-0.6 2,-0.5 -0.744 10.8-163.4 -83.8 118.1 20.0 37.3 37.8 57 62 A L E -aB 6 65A 0 8,-3.9 8,-2.5 -2,-0.6 2,-0.3 -0.914 9.4-178.7-108.3 126.7 21.9 34.6 36.0 58 63 A S E -aB 7 64A 42 -52,-2.9 -50,-2.4 -2,-0.5 -49,-0.3 -0.868 6.9-166.5-117.0 156.5 24.7 35.3 33.6 59 64 A N > - 0 0 2 4,-1.4 3,-1.8 -2,-0.3 81,-0.0 -0.804 39.8 -93.3-136.3 177.9 26.7 32.9 31.6 60 65 A H T 3 S+ 0 0 140 1,-0.3 -1,-0.0 -2,-0.2 80,-0.0 0.766 120.1 64.9 -63.5 -27.8 29.8 32.4 29.5 61 66 A A T 3 S- 0 0 47 79,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.377 117.6-115.7 -74.3 5.0 27.8 33.1 26.4 62 67 A E S < S+ 0 0 173 -3,-1.8 2,-0.3 1,-0.3 -2,-0.2 0.736 71.5 139.0 64.8 26.6 27.3 36.6 27.9 63 68 A L - 0 0 19 -4,-0.0 -4,-1.4 2,-0.0 2,-0.4 -0.778 36.6-158.3-103.1 146.5 23.6 36.0 28.2 64 69 A S E +B 58 0A 35 -2,-0.3 18,-0.4 -6,-0.2 2,-0.3 -0.984 13.6 175.3-129.8 133.2 21.5 37.0 31.2 65 70 A V E -B 57 0A 0 -8,-2.5 -8,-3.9 -2,-0.4 2,-0.6 -0.966 20.9-143.1-125.3 148.9 18.1 35.7 32.5 66 71 A T E -BC 56 80A 2 14,-2.8 14,-2.7 -2,-0.3 2,-0.3 -0.926 13.6-156.7-116.4 108.8 16.5 36.9 35.8 67 72 A L E -BC 55 79A 0 -12,-3.2 -12,-3.5 -2,-0.6 2,-0.5 -0.607 8.4-142.4 -79.3 139.0 14.7 34.2 37.7 68 73 A A E -BC 54 78A 0 10,-3.2 9,-2.7 -2,-0.3 10,-0.9 -0.921 17.7-161.3-100.3 124.6 11.9 35.3 40.1 69 74 A L E -BC 53 76A 0 -16,-3.4 -16,-2.3 -2,-0.5 2,-0.5 -0.899 17.1-125.5-109.3 137.9 11.8 33.2 43.3 70 75 A D E >> -B 52 0A 4 5,-2.9 4,-2.5 -2,-0.4 3,-1.1 -0.689 10.4-145.8 -81.1 123.6 8.9 33.0 45.6 71 76 A M T 34 S+ 0 0 11 -20,-3.2 -1,-0.1 -2,-0.5 -19,-0.1 0.779 95.7 61.7 -54.2 -30.9 9.8 33.9 49.2 72 77 A T T 34 S+ 0 0 8 -21,-0.4 180,-0.5 1,-0.2 -1,-0.2 0.686 128.7 2.8 -76.3 -21.3 7.3 31.3 50.5 73 78 A N T <4 S- 0 0 44 -3,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.337 89.9-117.7-146.7 3.5 8.9 28.3 49.0 74 79 A A < + 0 0 0 -4,-2.5 -3,-0.2 1,-0.2 2,-0.1 0.558 66.1 151.2 61.7 10.5 12.1 29.5 47.2 75 80 A A - 0 0 22 -5,-0.4 -5,-2.9 -6,-0.1 2,-0.5 -0.412 54.8-115.2 -76.6 144.5 10.5 28.3 44.0 76 81 A V E +C 69 0A 6 -7,-0.2 -7,-0.2 40,-0.2 3,-0.1 -0.687 32.2 178.6 -73.5 121.9 11.1 29.7 40.6 77 82 A V E - 0 0 19 -9,-2.7 11,-2.2 -2,-0.5 2,-0.3 0.491 61.3 -51.9-102.4 -7.8 7.8 31.2 39.5 78 83 A G E -CD 68 87A 0 -10,-0.9 -10,-3.2 9,-0.3 -1,-0.4 -0.946 55.2-119.5 156.4-176.2 9.2 32.5 36.3 79 84 A Y E -CD 67 86A 0 7,-2.6 7,-3.0 -2,-0.3 2,-0.4 -0.987 10.0-124.7-155.4 158.9 11.9 34.6 34.7 80 85 A R E +CD 66 85A 68 -14,-2.7 -14,-2.8 -2,-0.3 2,-0.4 -0.907 18.8 179.7-108.1 136.8 12.8 37.6 32.6 81 86 A A E > - D 0 84A 1 3,-2.9 3,-1.3 -2,-0.4 2,-0.3 -0.905 64.8 -54.5-134.8 107.5 14.9 37.5 29.4 82 87 A G T 3 S- 0 0 49 -18,-0.4 -16,-0.0 -2,-0.4 65,-0.0 -0.473 123.5 -12.1 64.3-120.2 15.4 40.9 27.8 83 88 A N T 3 S+ 0 0 79 -2,-0.3 25,-2.6 23,-0.1 24,-0.8 0.104 123.3 83.7 -99.6 20.5 12.0 42.5 27.2 84 89 A S E < -De 81 108A 3 -3,-1.3 -3,-2.9 23,-0.2 2,-0.4 -0.961 55.8-162.4-126.9 142.4 10.0 39.3 27.9 85 90 A A E -De 80 109A 0 23,-2.7 25,-2.7 -2,-0.4 2,-0.4 -0.973 5.4-164.5-122.7 140.6 8.8 37.7 31.1 86 91 A Y E -De 79 110A 9 -7,-3.0 -7,-2.6 -2,-0.4 2,-0.4 -0.990 7.2-170.5-128.7 127.6 7.7 34.1 31.4 87 92 A F E -De 78 111A 0 23,-2.6 25,-3.4 -2,-0.4 -9,-0.3 -0.956 23.7-118.3-124.7 138.2 5.7 32.7 34.4 88 93 A F - 0 0 11 -11,-2.2 27,-0.2 -2,-0.4 25,-0.1 -0.374 53.5 -81.9 -63.5 148.3 4.7 29.2 35.4 89 94 A H - 0 0 98 25,-3.0 27,-0.3 1,-0.1 -1,-0.1 -0.365 54.5-116.5 -54.8 119.4 1.0 28.5 35.6 90 95 A P - 0 0 24 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.353 9.2-142.4 -63.6 138.2 -0.1 29.9 39.0 91 96 A D S S+ 0 0 131 1,-0.1 2,-0.3 -3,-0.1 -2,-0.1 0.559 82.3 5.4 -75.5 -11.4 -1.5 27.3 41.4 92 97 A N S > S- 0 0 51 1,-0.1 4,-1.9 0, 0.0 5,-0.1 -0.970 80.5 -97.3-164.0 169.4 -4.1 29.9 42.6 93 98 A Q H > S+ 0 0 139 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.816 118.2 58.5 -67.3 -32.5 -5.6 33.3 41.9 94 99 A E H > S+ 0 0 120 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.920 109.2 43.7 -63.0 -45.1 -3.5 34.9 44.7 95 100 A D H > S+ 0 0 18 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.864 109.9 57.3 -67.7 -37.5 -0.3 33.7 43.0 96 101 A A H < S+ 0 0 25 -4,-1.9 4,-0.5 1,-0.2 -2,-0.2 0.894 112.0 41.6 -58.0 -43.2 -1.6 34.9 39.6 97 102 A E H >< S+ 0 0 93 -4,-2.1 3,-1.2 1,-0.2 4,-0.3 0.909 110.8 58.3 -68.7 -43.6 -2.1 38.3 41.1 98 103 A A H >< S+ 0 0 2 -4,-2.4 3,-1.7 1,-0.3 -2,-0.2 0.886 100.8 54.6 -54.4 -45.2 1.3 38.2 42.8 99 104 A I G >< S+ 0 0 11 -4,-2.3 3,-1.7 1,-0.3 -1,-0.3 0.664 90.0 74.5 -69.7 -16.9 3.3 37.6 39.6 100 105 A T G < S+ 0 0 72 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.643 90.5 61.2 -67.1 -14.4 1.8 40.7 38.0 101 106 A H G < S+ 0 0 69 -3,-1.7 2,-0.4 -4,-0.3 3,-0.3 0.384 89.2 92.2 -90.9 1.7 4.2 42.6 40.3 102 107 A L S < S- 0 0 0 -3,-1.7 -23,-0.1 1,-0.2 -17,-0.0 -0.830 101.5 -10.6-101.0 136.3 7.2 40.9 38.7 103 108 A F S > S+ 0 0 21 -2,-0.4 3,-1.5 1,-0.2 -1,-0.2 0.896 74.3 172.8 47.0 53.4 9.1 42.4 35.8 104 109 A T T 3 + 0 0 87 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.461 67.9 60.7 -74.6 -0.5 6.4 45.1 35.4 105 110 A D T 3 S+ 0 0 162 3,-0.1 -1,-0.3 0, 0.0 2,-0.1 0.417 76.4 111.6-107.9 -2.6 8.5 46.9 32.8 106 111 A V < - 0 0 19 -3,-1.5 -22,-0.2 1,-0.1 -23,-0.1 -0.443 63.1-141.4 -71.7 146.2 8.8 44.1 30.2 107 112 A Q S S+ 0 0 149 -24,-0.8 2,-0.5 1,-0.2 -23,-0.2 0.894 88.1 47.7 -69.5 -42.2 7.0 44.6 26.8 108 113 A N E -e 84 0A 42 -25,-2.6 -23,-2.7 2,-0.0 2,-0.4 -0.894 63.2-177.0-113.8 126.1 6.0 40.9 26.7 109 114 A R E -e 85 0A 92 -2,-0.5 2,-0.4 -25,-0.2 -23,-0.2 -0.985 7.4-179.8-121.7 126.8 4.4 38.9 29.5 110 115 A Y E -e 86 0A 108 -25,-2.7 -23,-2.6 -2,-0.4 2,-0.5 -0.984 16.3-158.9-127.9 136.8 3.7 35.2 29.1 111 116 A T E -e 87 0A 76 -2,-0.4 -23,-0.2 -25,-0.2 -22,-0.1 -0.976 24.5-131.3-110.3 121.5 2.2 32.7 31.5 112 117 A F - 0 0 12 -25,-3.4 -26,-0.0 -2,-0.5 -2,-0.0 -0.355 9.6-132.7 -63.2 149.0 2.9 29.1 30.7 113 118 A A S S+ 0 0 99 -24,-0.1 2,-0.3 -25,-0.1 -1,-0.1 0.550 89.7 70.3 -78.8 -9.1 -0.0 26.7 30.6 114 119 A F S S- 0 0 25 1,-0.1 -25,-3.0 7,-0.0 -2,-0.1 -0.784 83.0-120.0-109.6 153.0 2.1 24.3 32.7 115 120 A G - 0 0 8 -2,-0.3 -2,-0.1 -27,-0.2 -1,-0.1 -0.314 23.2-115.3 -81.7 170.9 3.3 24.6 36.4 116 121 A G S S+ 0 0 25 -27,-0.3 2,-0.2 4,-0.1 -40,-0.2 0.019 72.4 122.7 -97.4 26.0 6.8 24.7 37.6 117 122 A N S > S- 0 0 79 1,-0.1 4,-2.5 4,-0.0 5,-0.2 -0.546 71.9-117.1 -84.0 154.5 6.7 21.5 39.5 118 123 A Y H > S+ 0 0 28 2,-0.2 4,-3.7 1,-0.2 5,-0.3 0.897 110.2 57.0 -58.2 -46.9 9.1 18.6 38.7 119 124 A D H > S+ 0 0 101 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.938 113.8 38.7 -51.5 -54.8 6.4 16.2 37.5 120 125 A R H > S+ 0 0 81 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.927 118.3 49.3 -61.9 -47.0 5.1 18.5 34.9 121 126 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 6,-0.2 0.869 110.6 50.4 -61.2 -40.7 8.7 19.8 34.0 122 127 A E H X>S+ 0 0 13 -4,-3.7 5,-1.5 2,-0.2 4,-1.3 0.889 111.1 47.8 -65.2 -43.2 10.0 16.2 33.7 123 128 A Q H <5S+ 0 0 116 -4,-2.0 3,-0.2 -5,-0.3 -2,-0.2 0.930 115.3 45.7 -62.3 -47.0 7.2 15.1 31.4 124 129 A L H <5S+ 0 0 36 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.902 114.2 48.3 -62.7 -43.1 7.7 18.2 29.2 125 130 A A H <5S- 0 0 11 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.715 104.8-130.7 -69.1 -22.9 11.5 17.7 29.2 126 131 A G T <5S+ 0 0 58 -4,-1.3 2,-0.3 -3,-0.2 -3,-0.2 0.644 79.2 84.8 75.9 16.6 11.0 14.0 28.3 127 132 A N S - 0 0 87 -2,-0.3 3,-1.4 1,-0.1 4,-0.1 -0.441 37.6-106.9 -75.0 157.1 13.3 12.6 34.9 129 134 A R G > S+ 0 0 18 1,-0.3 3,-2.3 2,-0.2 -1,-0.1 0.878 119.7 63.6 -49.1 -42.9 15.6 14.7 37.2 130 135 A E G 3 S+ 0 0 70 1,-0.3 -1,-0.3 64,-0.2 64,-0.2 0.813 106.5 43.5 -54.3 -32.2 17.7 11.5 37.7 131 136 A N G < S+ 0 0 101 -3,-1.4 2,-0.6 63,-0.1 -1,-0.3 0.202 96.2 89.5-103.2 13.8 18.5 11.5 34.0 132 137 A I S < S- 0 0 0 -3,-2.3 61,-0.1 -4,-0.1 -1,-0.0 -0.947 77.6-130.8-114.3 112.1 19.2 15.3 33.8 133 138 A E - 0 0 87 -2,-0.6 61,-0.3 61,-0.2 2,-0.3 -0.289 20.5-157.3 -64.8 140.4 22.8 16.2 34.5 134 139 A L B +H 193 0D 0 59,-2.4 59,-2.3 4,-0.1 2,-0.3 -0.832 38.5 88.6-116.3 158.7 23.5 19.0 37.0 135 140 A G S > S- 0 0 0 -2,-0.3 4,-2.1 57,-0.2 5,-0.2 -0.821 88.7 -59.9 140.8 179.4 26.6 21.2 37.4 136 141 A N H > S+ 0 0 26 55,-0.3 4,-2.9 -2,-0.3 5,-0.2 0.853 130.2 54.9 -64.9 -36.8 27.9 24.5 36.1 137 142 A G H > S+ 0 0 20 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.976 109.4 45.7 -58.1 -60.7 27.8 23.2 32.5 138 143 A P H > S+ 0 0 2 0, 0.0 4,-2.2 0, 0.0 -2,-0.2 0.870 116.0 47.2 -47.4 -43.7 24.1 22.3 32.6 139 144 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.896 109.4 53.0 -69.0 -41.5 23.4 25.7 34.3 140 145 A E H X S+ 0 0 33 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.937 115.2 42.0 -52.4 -50.0 25.5 27.6 31.7 141 146 A E H X S+ 0 0 99 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.819 110.0 58.0 -67.9 -35.9 23.4 25.8 29.1 142 147 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.891 105.4 50.2 -62.1 -41.8 20.2 26.3 31.0 143 148 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.922 111.5 47.1 -64.0 -47.7 20.7 30.1 31.0 144 149 A S H X S+ 0 0 24 -4,-1.6 4,-3.0 2,-0.2 -2,-0.2 0.932 113.6 48.9 -57.7 -47.7 21.3 30.2 27.3 145 150 A A H X S+ 0 0 12 -4,-2.4 4,-1.0 2,-0.2 -2,-0.2 0.885 111.6 48.5 -62.6 -42.9 18.2 28.1 26.7 146 151 A L H X S+ 0 0 0 -4,-2.6 4,-0.6 1,-0.2 3,-0.3 0.911 114.4 47.5 -61.7 -42.1 16.1 30.2 28.9 147 152 A Y H >< S+ 0 0 65 -4,-2.6 3,-1.1 1,-0.2 4,-0.5 0.922 110.0 50.6 -65.0 -45.7 17.4 33.3 27.1 148 153 A Y H 3<>S+ 0 0 106 -4,-3.0 5,-3.7 1,-0.3 6,-0.6 0.633 94.5 72.4 -73.5 -12.9 16.8 32.0 23.6 149 154 A Y H ><5S+ 0 0 55 -4,-1.0 3,-0.8 -3,-0.3 -1,-0.3 0.847 94.3 55.6 -65.3 -33.4 13.2 31.0 24.4 150 155 A S T <<5S+ 0 0 29 -3,-1.1 -1,-0.2 -4,-0.6 -2,-0.2 0.765 111.9 42.2 -67.2 -28.2 12.5 34.7 24.3 151 156 A T T 3 5S- 0 0 90 -4,-0.5 -1,-0.2 -3,-0.2 -2,-0.2 0.271 121.3-108.1-100.5 7.1 14.0 34.9 20.8 152 157 A G T < 5S+ 0 0 69 -3,-0.8 -3,-0.2 -4,-0.1 -2,-0.1 0.688 88.3 115.5 77.4 20.9 12.2 31.6 19.8 153 158 A G < + 0 0 60 -5,-3.7 2,-0.5 -8,-0.1 -4,-0.3 0.374 56.8 77.4-102.4 2.8 15.4 29.5 19.7 154 159 A T - 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