==== 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 HYDROLASE 18-SEP-07 2VC4 . COMPND 2 MOLECULE: RICIN A CHAIN; . 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) . 12950.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 177 67.3 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 . 34 12.9 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 . 14 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 30.4 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 0 2 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 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 5 A Q 0 0 237 0, 0.0 3,-0.1 0, 0.0 49,-0.0 0.000 360.0 360.0 360.0 -15.1 80.4 -21.5 96.9 2 6 A Y - 0 0 29 1,-0.1 52,-0.2 52,-0.1 49,-0.1 -0.468 360.0 -84.9 -64.0 150.6 76.9 -21.5 95.5 3 7 A P - 0 0 39 0, 0.0 52,-3.0 0, 0.0 2,-0.4 -0.302 45.4-149.9 -60.7 142.9 75.9 -18.0 94.3 4 8 A I E -a 55 0A 87 50,-0.2 2,-0.4 -3,-0.1 52,-0.2 -0.961 10.9-168.4-118.3 133.8 74.6 -15.6 97.0 5 9 A I E -a 56 0A 14 50,-2.6 52,-2.5 -2,-0.4 2,-0.4 -0.986 15.1-148.7-118.0 131.2 72.1 -12.8 96.4 6 10 A N E +a 57 0A 99 -2,-0.4 2,-0.3 50,-0.2 52,-0.2 -0.787 20.2 168.5-101.8 141.3 71.6 -10.3 99.2 7 11 A F E -a 58 0A 12 50,-2.3 52,-2.4 -2,-0.4 2,-0.4 -0.986 11.7-164.3-144.7 143.0 68.4 -8.4 100.1 8 12 A T E -a 59 0A 53 -2,-0.3 52,-0.2 50,-0.2 133,-0.1 -0.984 20.4-153.8-125.8 141.7 67.5 -6.3 103.2 9 13 A T S > S+ 0 0 1 50,-2.1 3,-1.8 -2,-0.4 2,-0.5 0.646 70.3 107.9 -75.6 -17.2 64.1 -5.1 104.3 10 14 A A T 3 S- 0 0 36 1,-0.3 -2,-0.1 49,-0.3 49,-0.0 -0.508 104.2 -13.4 -67.7 114.9 65.9 -2.3 106.1 11 15 A G T 3 S+ 0 0 75 -2,-0.5 -1,-0.3 1,-0.2 5,-0.1 0.752 94.1 179.5 64.4 25.3 65.0 0.9 104.0 12 16 A A < - 0 0 17 -3,-1.8 2,-0.3 4,-0.1 -1,-0.2 -0.294 4.6-175.5 -61.3 143.9 63.7 -1.3 101.1 13 17 A T > - 0 0 72 1,-0.1 4,-2.6 0, 0.0 5,-0.3 -0.824 43.2 -99.0-129.8 169.8 62.4 0.5 98.1 14 18 A V H > S+ 0 0 21 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.938 124.6 49.1 -53.8 -45.4 60.8 -0.5 94.9 15 19 A Q H > S+ 0 0 117 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.912 109.8 48.3 -67.0 -41.8 64.2 -0.3 93.2 16 20 A S H > S+ 0 0 42 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.904 114.8 46.6 -68.7 -34.0 66.1 -2.3 95.7 17 21 A Y H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.928 112.1 50.7 -68.5 -42.1 63.5 -5.0 95.7 18 22 A T H X S+ 0 0 23 -4,-2.7 4,-2.6 -5,-0.3 5,-0.2 0.909 109.2 51.2 -59.4 -45.3 63.4 -5.0 91.9 19 23 A N H X S+ 0 0 89 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.904 110.9 50.0 -57.8 -43.7 67.2 -5.3 91.8 20 24 A F H X S+ 0 0 5 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.949 111.7 44.8 -60.8 -53.2 67.0 -8.2 94.1 21 25 A I H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.913 112.9 51.8 -62.2 -38.7 64.4 -10.1 92.1 22 26 A R H X S+ 0 0 155 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.923 111.0 48.5 -62.8 -40.5 66.2 -9.5 88.8 23 27 A A H X S+ 0 0 21 -4,-2.2 4,-1.5 -5,-0.2 -1,-0.2 0.899 109.5 51.9 -67.2 -40.5 69.4 -10.8 90.4 24 28 A V H >X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 3,-0.6 0.960 110.5 48.4 -58.5 -48.8 67.6 -13.9 91.7 25 29 A R H 3X S+ 0 0 43 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.898 108.2 55.3 -58.0 -39.9 66.2 -14.6 88.2 26 30 A G H 3< S+ 0 0 39 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.784 112.3 42.6 -66.7 -28.7 69.7 -14.1 86.7 27 31 A R H << S+ 0 0 148 -4,-1.5 -1,-0.2 -3,-0.6 -2,-0.2 0.704 112.3 54.0 -86.9 -22.0 71.1 -16.8 89.0 28 32 A L H < S+ 0 0 3 -4,-1.8 2,-0.3 -5,-0.2 -2,-0.2 0.916 115.5 31.0 -73.8 -42.6 68.2 -19.2 88.6 29 33 A T < - 0 0 21 -4,-2.0 -1,-0.2 -5,-0.1 12,-0.1 -0.906 60.2-154.0-124.6 147.0 68.3 -19.4 84.7 30 34 A T - 0 0 117 -2,-0.3 -1,-0.1 10,-0.3 11,-0.1 0.676 43.2-111.0 -89.8 -25.7 71.1 -19.1 82.2 31 35 A G S S+ 0 0 55 9,-0.3 3,-0.1 2,-0.2 10,-0.1 0.373 88.2 113.6 98.6 -5.0 69.4 -17.9 79.1 32 36 A A S S+ 0 0 92 1,-0.2 2,-0.5 8,-0.1 -3,-0.0 0.788 75.3 45.4 -65.1 -26.5 70.0 -21.2 77.3 33 37 A D + 0 0 32 7,-0.3 7,-2.8 2,-0.0 2,-0.4 -0.923 60.0 156.0-137.6 108.2 66.3 -21.9 77.2 34 38 A V E -F 39 0B 76 -2,-0.5 2,-0.5 5,-0.3 216,-0.0 -0.993 14.9-172.0-131.0 133.1 63.5 -19.6 76.2 35 39 A R E > S-F 38 0B 16 3,-2.4 3,-2.1 -2,-0.4 180,-0.0 -0.994 79.8 -14.1-123.9 120.7 60.1 -20.7 74.8 36 40 A H T 3 S- 0 0 79 -2,-0.5 -1,-0.1 1,-0.3 179,-0.0 0.875 128.8 -53.4 53.6 40.8 57.9 -17.8 73.5 37 41 A E T 3 S+ 0 0 151 1,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.312 116.8 116.1 78.7 -4.2 60.1 -15.1 75.2 38 42 A I E < -F 35 0B 2 -3,-2.1 -3,-2.4 212,-0.0 -1,-0.2 -0.846 63.7-129.9-106.3 118.4 59.8 -16.9 78.5 39 43 A P E -F 34 0B 38 0, 0.0 212,-1.7 0, 0.0 2,-0.4 -0.279 15.4-144.5 -62.3 147.5 62.8 -18.3 80.2 40 44 A V B -g 251 0C 6 -7,-2.8 -7,-0.3 210,-0.2 -9,-0.3 -0.900 16.7-120.8-112.3 138.5 62.9 -21.9 81.4 41 45 A L - 0 0 0 210,-3.2 -12,-0.1 -2,-0.4 32,-0.1 -0.307 49.2 -77.2 -67.0 160.3 64.8 -23.1 84.5 42 46 A P - 0 0 31 0, 0.0 211,-0.3 0, 0.0 2,-0.3 -0.318 49.8-105.2 -61.9 145.1 67.5 -25.7 84.1 43 47 A N - 0 0 57 1,-0.1 4,-0.1 2,-0.1 30,-0.1 -0.512 20.1-142.3 -64.5 130.5 66.3 -29.3 83.6 44 48 A R S > S+ 0 0 79 -2,-0.3 3,-1.9 209,-0.2 2,-0.3 0.841 76.8 98.0 -61.6 -31.7 66.9 -31.3 86.8 45 49 A V T 3 S- 0 0 116 1,-0.3 -2,-0.1 3,-0.0 0, 0.0 -0.423 104.6 -5.1 -69.6 119.8 68.0 -34.3 84.7 46 50 A G T 3 S+ 0 0 75 -2,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.452 91.2 151.6 80.8 0.5 71.8 -34.5 84.5 47 51 A L < - 0 0 33 -3,-1.9 -1,-0.2 -4,-0.1 5,-0.1 -0.500 47.9-121.8 -71.7 120.9 72.2 -31.1 86.4 48 52 A P > - 0 0 61 0, 0.0 3,-2.3 0, 0.0 4,-0.1 -0.315 14.7-123.0 -63.4 146.0 75.5 -31.2 88.2 49 53 A I G > S+ 0 0 56 1,-0.3 3,-1.6 2,-0.2 4,-0.4 0.806 109.4 64.2 -60.1 -31.1 75.3 -30.7 92.0 50 54 A N G 3 S+ 0 0 106 1,-0.3 -1,-0.3 2,-0.1 3,-0.0 0.585 108.6 41.9 -67.9 -9.0 77.6 -27.6 91.8 51 55 A Q G < S+ 0 0 109 -3,-2.3 -1,-0.3 1,-0.1 -2,-0.2 0.187 91.8 92.2-116.0 14.0 74.9 -25.9 89.8 52 56 A R S < S+ 0 0 19 -3,-1.6 20,-2.7 -4,-0.1 21,-0.4 0.758 81.4 35.3 -89.0 -26.7 71.9 -27.0 91.7 53 57 A F E - B 0 71A 3 -4,-0.4 2,-0.3 18,-0.2 18,-0.2 -0.870 50.3-162.2-130.2 157.7 71.3 -24.2 94.3 54 58 A I E - B 0 70A 3 16,-2.2 16,-2.9 -2,-0.3 2,-0.4 -0.928 21.1-132.7-129.5 160.9 71.5 -20.5 94.9 55 59 A L E -aB 4 69A 20 -52,-3.0 -50,-2.6 -2,-0.3 2,-0.6 -0.918 8.8-161.2-118.6 135.4 71.5 -18.7 98.3 56 60 A V E -aB 5 68A 0 12,-2.8 12,-3.0 -2,-0.4 2,-0.8 -0.968 9.7-158.0-116.3 108.9 69.4 -15.7 99.3 57 61 A E E -aB 6 67A 55 -52,-2.5 -50,-2.3 -2,-0.6 2,-0.5 -0.837 12.4-165.3 -92.4 112.5 70.8 -13.9 102.3 58 62 A L E +aB 7 66A 0 8,-3.0 8,-2.2 -2,-0.8 2,-0.3 -0.875 9.0 179.3-101.7 129.8 68.0 -11.9 103.9 59 63 A S E -aB 8 65A 30 -52,-2.4 -50,-2.1 -2,-0.5 2,-0.3 -0.829 6.8-160.7-121.4 163.9 68.7 -9.1 106.4 60 64 A N > - 0 0 4 4,-1.5 3,-2.0 -2,-0.3 4,-0.1 -0.841 39.0 -95.7-138.4 174.5 66.4 -6.8 108.3 61 65 A H T 3 S+ 0 0 145 1,-0.3 -1,-0.0 -2,-0.3 80,-0.0 0.791 118.8 67.4 -63.0 -27.3 66.3 -3.6 110.2 62 66 A A T 3 S- 0 0 51 79,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.387 116.8-114.6 -70.4 2.5 66.6 -5.6 113.5 63 67 A E S < S+ 0 0 170 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.763 73.3 133.6 65.7 31.1 70.2 -6.5 112.2 64 68 A L - 0 0 16 -4,-0.1 -4,-1.5 2,-0.0 2,-0.4 -0.808 36.0-164.3-106.4 152.0 69.3 -10.2 111.8 65 69 A S E +B 59 0A 40 -2,-0.3 2,-0.3 -6,-0.2 18,-0.3 -0.993 11.1 177.7-135.0 144.0 70.1 -12.3 108.8 66 70 A V E -B 58 0A 1 -8,-2.2 -8,-3.0 -2,-0.4 2,-0.5 -0.956 20.7-138.4-133.9 156.4 69.0 -15.7 107.5 67 71 A T E -BC 57 81A 7 14,-2.6 14,-2.3 -2,-0.3 2,-0.3 -0.968 12.9-159.4-118.5 119.1 70.0 -17.5 104.3 68 72 A L E -BC 56 80A 0 -12,-3.0 -12,-2.8 -2,-0.5 2,-0.5 -0.746 9.9-142.8 -90.0 145.4 67.5 -19.3 102.2 69 73 A A E -BC 55 79A 0 10,-2.6 9,-2.6 -2,-0.3 10,-0.9 -0.941 16.1-163.9-106.1 129.1 68.5 -22.0 99.8 70 74 A L E -BC 54 77A 0 -16,-2.9 -16,-2.2 -2,-0.5 2,-0.5 -0.939 18.5-130.9-113.7 137.0 66.6 -22.2 96.5 71 75 A D E >>> -BC 53 76A 4 5,-2.4 4,-2.2 -2,-0.4 3,-1.1 -0.738 14.2-146.8 -80.1 123.9 66.7 -25.1 94.1 72 76 A V T 345S+ 0 0 6 -20,-2.7 -1,-0.1 -2,-0.5 -19,-0.1 0.714 91.8 67.2 -69.0 -17.2 67.4 -23.7 90.6 73 77 A T T 345S+ 0 0 8 -21,-0.4 180,-0.5 1,-0.2 -1,-0.2 0.742 127.0 1.7 -75.9 -21.3 65.2 -26.4 89.0 74 78 A N T <45S- 0 0 23 -3,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.385 91.2-115.2-143.7 2.5 62.0 -25.0 90.5 75 79 A A T <5 + 0 0 0 -4,-2.2 2,-0.2 1,-0.2 -3,-0.2 0.642 62.5 157.8 62.2 17.7 62.9 -21.9 92.5 76 80 A Y E < -C 71 0A 116 -5,-0.5 -5,-2.4 1,-0.1 2,-0.6 -0.522 47.8-126.2 -71.6 138.1 61.7 -23.9 95.6 77 81 A V E +C 70 0A 11 -7,-0.2 -7,-0.2 -2,-0.2 3,-0.1 -0.735 31.8 179.4 -73.7 118.3 63.0 -22.8 99.0 78 82 A V E - 0 0 23 -9,-2.6 11,-2.0 -2,-0.6 2,-0.3 0.582 54.7 -39.1 -99.2 -14.7 64.5 -26.0 100.3 79 83 A G E -CD 69 88A 2 -10,-0.9 -10,-2.6 9,-0.3 2,-0.3 -0.975 53.8-128.1 173.6-178.5 65.8 -24.9 103.6 80 84 A Y E -CD 68 87A 1 7,-2.5 7,-2.7 -2,-0.3 2,-0.4 -0.984 5.7-138.5-153.1 160.6 67.5 -22.1 105.5 81 85 A R E +CD 67 86A 75 -14,-2.3 -14,-2.6 -2,-0.3 2,-0.4 -0.974 13.0 179.4-121.3 139.6 70.4 -21.3 107.8 82 86 A A E > - D 0 85A 6 3,-2.8 3,-2.0 -2,-0.4 -16,-0.1 -0.952 65.5 -57.1-135.5 112.1 70.4 -19.0 110.8 83 87 A G T 3 S- 0 0 42 -2,-0.4 -1,-0.0 -18,-0.3 65,-0.0 -0.285 123.5 -6.9 56.6-121.8 73.7 -18.7 112.6 84 88 A N T 3 S+ 0 0 76 23,-0.1 25,-1.7 -3,-0.1 2,-0.4 0.200 123.0 73.6 -95.0 18.4 74.8 -22.2 113.7 85 89 A S E < -De 82 109A 9 -3,-2.0 -3,-2.8 23,-0.2 2,-0.4 -0.983 53.9-171.3-130.9 142.9 71.6 -24.1 112.7 86 90 A A E -De 81 110A 0 23,-2.5 25,-2.4 -2,-0.4 2,-0.4 -0.979 4.8-163.3-130.2 145.3 70.1 -25.1 109.4 87 91 A Y E -De 80 111A 15 -7,-2.7 -7,-2.5 -2,-0.4 2,-0.4 -0.993 3.5-167.6-131.6 133.1 66.7 -26.5 108.6 88 92 A F E -De 79 112A 2 23,-2.1 25,-3.1 -2,-0.4 -9,-0.3 -0.952 24.3-115.6-121.5 139.8 65.5 -28.3 105.5 89 93 A F - 0 0 14 -11,-2.0 27,-0.2 -2,-0.4 25,-0.1 -0.335 53.1 -79.2 -63.2 154.6 62.1 -29.2 104.3 90 94 A H - 0 0 102 25,-2.6 27,-0.2 1,-0.1 -1,-0.1 -0.381 55.2-120.5 -57.0 119.2 61.3 -32.9 104.0 91 95 A P - 0 0 27 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.358 6.6-140.3 -67.7 148.3 62.8 -34.1 100.8 92 96 A D S S- 0 0 126 1,-0.1 2,-0.3 -2,-0.0 -2,-0.1 0.711 79.6 -0.9 -75.6 -24.6 60.5 -35.6 98.1 93 97 A N S > S- 0 0 68 1,-0.1 4,-2.1 0, 0.0 5,-0.2 -0.945 79.8 -91.5-161.1 170.7 63.0 -38.3 97.1 94 98 A Q H > S+ 0 0 162 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.872 119.0 55.9 -65.1 -36.3 66.5 -39.8 97.8 95 99 A E H > S+ 0 0 144 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.922 109.8 46.5 -64.4 -40.3 68.2 -37.7 95.1 96 100 A D H > S+ 0 0 17 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.896 109.1 54.6 -69.0 -37.1 66.9 -34.5 96.7 97 101 A A H X S+ 0 0 31 -4,-2.1 4,-0.6 1,-0.2 -2,-0.2 0.904 112.1 44.4 -61.5 -38.3 67.9 -35.7 100.2 98 102 A E H >< S+ 0 0 102 -4,-2.3 3,-1.1 1,-0.2 4,-0.3 0.917 109.0 57.4 -70.3 -40.3 71.4 -36.2 98.9 99 103 A A H >< S+ 0 0 2 -4,-2.4 3,-2.0 1,-0.3 -2,-0.2 0.910 101.1 55.7 -58.9 -40.6 71.5 -32.9 97.1 100 104 A I H >< S+ 0 0 17 -4,-2.0 3,-1.7 1,-0.3 -1,-0.3 0.697 89.2 74.7 -73.5 -13.3 70.7 -30.9 100.3 101 105 A T T << S+ 0 0 77 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.668 88.7 63.6 -67.7 -10.7 73.7 -32.4 102.0 102 106 A H T < S+ 0 0 68 -3,-2.0 2,-0.4 -4,-0.3 3,-0.3 0.448 89.6 88.7 -90.7 -1.1 75.7 -30.0 99.8 103 107 A L S < S- 0 0 1 -3,-1.7 -34,-0.0 1,-0.2 -3,-0.0 -0.799 100.5 -6.6-102.1 140.7 74.1 -27.0 101.4 104 108 A F S > S+ 0 0 20 -2,-0.4 3,-1.5 1,-0.1 -1,-0.2 0.899 76.2 174.2 49.9 50.2 75.4 -25.2 104.6 105 109 A T T 3 + 0 0 103 -3,-0.3 -1,-0.1 1,-0.3 -2,-0.1 0.710 69.1 49.1 -69.6 -22.3 78.0 -27.9 105.0 106 110 A D T 3 S+ 0 0 138 3,-0.0 -1,-0.3 0, 0.0 2,-0.1 0.430 79.4 122.2 -95.0 0.9 79.9 -26.3 107.9 107 111 A V < - 0 0 13 -3,-1.5 3,-0.1 1,-0.1 -23,-0.1 -0.379 58.2-143.8 -65.4 137.7 76.8 -25.6 110.0 108 112 A Q S S+ 0 0 151 1,-0.2 2,-0.5 -24,-0.1 -23,-0.2 0.854 84.8 41.8 -75.0 -31.4 77.1 -27.3 113.4 109 113 A N E -e 85 0A 64 -25,-1.7 -23,-2.5 2,-0.0 2,-0.4 -0.962 67.8-178.6-122.4 114.1 73.4 -28.2 113.7 110 114 A R E +e 86 0A 94 -2,-0.5 2,-0.4 -25,-0.2 -23,-0.2 -0.946 4.5 179.7-113.6 131.1 71.5 -29.6 110.7 111 115 A Y E -e 87 0A 108 -25,-2.4 -23,-2.1 -2,-0.4 2,-0.5 -0.982 18.3-154.5-129.6 144.3 67.8 -30.6 110.9 112 116 A T E -e 88 0A 80 -2,-0.4 -23,-0.2 -25,-0.2 -22,-0.1 -0.979 22.6-134.0-113.2 122.8 65.4 -31.9 108.4 113 117 A F - 0 0 17 -25,-3.1 -26,-0.0 -2,-0.5 -2,-0.0 -0.407 10.2-133.5 -64.8 149.9 61.7 -31.1 109.1 114 118 A A S S+ 0 0 91 -24,-0.1 2,-0.3 -25,-0.1 -1,-0.1 0.664 87.5 71.3 -77.0 -14.1 59.2 -34.0 108.7 115 119 A F S S- 0 0 33 1,-0.1 -25,-2.6 6,-0.0 -2,-0.1 -0.681 82.3-119.3-106.4 152.8 57.0 -31.8 106.7 116 120 A G - 0 0 14 -2,-0.3 -1,-0.1 -27,-0.2 -2,-0.1 -0.317 20.2-120.7 -81.9 169.5 57.4 -30.4 103.2 117 121 A G + 0 0 23 -27,-0.2 -40,-0.2 -40,-0.1 2,-0.1 0.087 66.6 127.2-100.3 22.0 57.5 -26.7 102.2 118 122 A N S > S- 0 0 83 1,-0.1 4,-2.7 -42,-0.1 5,-0.2 -0.446 71.3-112.6 -78.8 155.8 54.5 -26.7 100.0 119 123 A Y H > S+ 0 0 39 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.866 113.3 55.2 -53.3 -45.7 51.7 -24.2 100.5 120 124 A D H > S+ 0 0 113 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.946 112.8 41.5 -58.3 -49.1 49.1 -26.7 101.5 121 125 A R H > S+ 0 0 101 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.928 114.9 50.2 -64.5 -44.9 51.3 -28.1 104.3 122 126 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 6,-0.2 0.879 109.0 51.8 -67.0 -35.7 52.5 -24.7 105.5 123 127 A E H X>S+ 0 0 18 -4,-2.9 4,-1.5 -5,-0.2 5,-1.2 0.899 108.7 51.1 -62.7 -41.9 49.0 -23.3 105.6 124 128 A Q H <5S+ 0 0 112 -4,-1.9 3,-0.4 -5,-0.2 -2,-0.2 0.947 114.3 44.1 -59.9 -46.7 47.9 -26.2 107.8 125 129 A L H <5S+ 0 0 34 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.846 114.6 49.0 -64.3 -37.2 50.8 -25.6 110.1 126 130 A A H <5S- 0 0 11 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.692 101.8-132.7 -74.1 -22.5 50.3 -21.9 110.2 127 131 A G T <5S+ 0 0 60 -4,-1.5 2,-0.3 -3,-0.4 -3,-0.2 0.712 77.8 84.8 70.6 21.1 46.6 -22.2 110.9 128 132 A N S - 0 0 88 -2,-0.3 3,-2.1 1,-0.1 4,-0.1 -0.449 35.8-106.6 -77.2 157.4 45.5 -19.7 104.4 130 134 A R G > S+ 0 0 6 1,-0.3 3,-1.9 2,-0.2 -1,-0.1 0.856 118.6 66.6 -50.2 -35.5 47.6 -17.5 102.1 131 135 A E G 3 S+ 0 0 82 1,-0.3 -1,-0.3 64,-0.1 64,-0.2 0.645 105.8 41.8 -67.7 -11.0 44.5 -15.3 101.6 132 136 A N G < S+ 0 0 104 -3,-2.1 2,-0.5 62,-0.1 -1,-0.3 0.106 94.6 91.0-118.3 16.8 44.7 -14.3 105.2 133 137 A I S < S- 0 0 0 -3,-1.9 61,-0.1 63,-0.1 2,-0.1 -0.959 74.7-131.6-118.0 114.5 48.5 -13.8 105.6 134 138 A E - 0 0 81 -2,-0.5 2,-0.3 61,-0.2 61,-0.3 -0.377 20.0-159.0 -69.0 141.0 49.6 -10.3 104.9 135 139 A L B +H 194 0D 0 59,-2.2 59,-2.0 57,-0.1 2,-0.3 -0.849 37.1 88.2-114.5 158.8 52.6 -9.7 102.5 136 140 A G S > S- 0 0 0 -2,-0.3 4,-2.0 57,-0.2 5,-0.2 -0.886 87.8 -56.8 143.2-176.4 54.8 -6.7 102.2 137 141 A N H > S+ 0 0 22 -2,-0.3 4,-2.7 2,-0.2 5,-0.2 0.894 130.3 52.1 -66.4 -38.6 58.1 -5.3 103.6 138 142 A G H > S+ 0 0 17 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.954 110.0 48.2 -63.9 -51.9 56.8 -5.4 107.2 139 143 A P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.903 113.4 48.4 -51.9 -40.9 55.7 -9.0 107.0 140 144 A L H X S+ 0 0 1 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.925 109.0 52.6 -70.7 -39.7 59.1 -9.9 105.4 141 145 A E H X S+ 0 0 37 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.933 114.3 43.8 -53.8 -49.6 61.0 -8.0 108.2 142 146 A E H X S+ 0 0 100 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.871 110.3 55.1 -65.7 -39.1 59.0 -10.0 110.8 143 147 A A H X S+ 0 0 1 -4,-2.5 4,-2.6 -5,-0.2 5,-0.2 0.896 105.3 52.8 -64.4 -39.5 59.5 -13.3 108.9 144 148 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.955 110.1 47.8 -61.8 -47.7 63.2 -12.9 108.9 145 149 A S H X S+ 0 0 26 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.914 111.0 51.7 -57.0 -43.9 63.2 -12.3 112.7 146 150 A A H X S+ 0 0 10 -4,-2.4 4,-0.7 1,-0.2 -2,-0.2 0.919 111.1 46.5 -61.7 -45.4 60.9 -15.4 113.2 147 151 A L H >< S+ 0 0 0 -4,-2.6 3,-0.8 1,-0.2 4,-0.4 0.915 111.2 53.8 -59.9 -40.6 63.2 -17.6 111.2 148 152 A Y H 3< S+ 0 0 87 -4,-2.4 3,-0.4 1,-0.2 -2,-0.2 0.879 111.3 43.6 -63.6 -40.7 66.2 -16.3 113.0 149 153 A Y H ><>S+ 0 0 105 -4,-2.2 5,-1.6 1,-0.2 3,-1.0 0.452 86.0 95.6 -89.2 1.7 64.8 -17.1 116.5 150 154 A Y G X<5S+ 0 0 59 -3,-0.8 3,-1.8 -4,-0.7 5,-0.3 0.924 79.6 54.0 -58.1 -44.5 63.5 -20.6 115.7 151 155 A S G 3 5S+ 0 0 55 -4,-0.4 -1,-0.2 -3,-0.4 -2,-0.1 0.695 108.2 50.9 -69.2 -18.1 66.5 -22.5 117.0 152 156 A T G < 5S- 0 0 110 -3,-1.0 -1,-0.3 -4,-0.1 -2,-0.2 0.381 118.5-104.8-102.5 6.7 66.4 -20.8 120.4 153 157 A G T < 5S+ 0 0 66 -3,-1.8 -3,-0.2 -4,-0.4 -2,-0.1 0.430 88.8 115.1 91.4 1.4 62.7 -21.4 121.1 154 158 A G < + 0 0 62 -5,-1.6 2,-0.5 1,-0.1 -4,-0.2 0.597 64.2 66.5 -79.1 -13.1 61.4 -17.9 120.4 155 159 A T S S- 0 0 14 -6,-0.5 -2,-0.1 -5,-0.3 -1,-0.1 -0.940 73.7-143.1-119.2 118.1 59.3 -18.9 117.4 156 160 A Q > - 0 0 145 -2,-0.5 4,-2.3 1,-0.1 3,-0.4 -0.370 30.6-109.2 -73.1 154.7 56.2 -21.1 117.6 157 161 A L H > S+ 0 0 62 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.887 116.9 53.9 -57.7 -44.5 55.6 -23.5 114.7 158 162 A P H > S+ 0 0 62 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.911 110.6 48.1 -58.9 -36.0 52.6 -21.7 113.3 159 163 A T H > S+ 0 0 60 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.877 110.8 51.1 -69.0 -37.1 54.6 -18.4 113.2 160 164 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.954 111.9 46.8 -63.2 -45.5 57.5 -20.3 111.5 161 165 A A H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.912 112.0 49.8 -63.8 -43.1 55.2 -21.7 108.9 162 166 A R H X S+ 0 0 77 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.906 109.8 52.6 -59.0 -40.5 53.5 -18.3 108.3 163 167 A S H X S+ 0 0 6 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.893 107.8 50.0 -67.7 -41.3 57.0 -16.8 107.9 164 168 A F H X S+ 0 0 4 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.921 107.9 54.8 -60.4 -42.3 58.0 -19.4 105.3 165 169 A I H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.901 109.7 46.6 -58.9 -41.6 54.7 -18.6 103.4 166 170 A I H X S+ 0 0 5 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.957 114.5 46.6 -65.1 -49.1 55.7 -14.9 103.3 167 171 A C H X>S+ 0 0 1 -4,-2.5 4,-1.5 1,-0.2 5,-0.6 0.908 110.7 51.7 -60.9 -44.6 59.3 -15.6 102.2 168 172 A I H X>S+ 0 0 13 -4,-3.0 5,-2.3 1,-0.2 4,-0.7 0.928 114.0 42.4 -62.4 -44.4 58.3 -18.1 99.5 169 173 A Q H <>S+ 0 0 0 -4,-1.9 5,-1.2 -5,-0.3 -1,-0.2 0.917 116.2 47.4 -69.8 -39.7 55.8 -15.7 97.9 170 174 A M H <5S+ 0 0 1 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.656 130.0 19.9 -78.5 -12.8 57.9 -12.6 98.1 171 175 A I H X5S+ 0 0 0 -4,-1.5 4,-2.0 -3,-0.2 -3,-0.2 0.735 131.5 32.0-118.3 -66.0 61.0 -14.4 96.7 172 176 A S H X S+ 0 0 62 -2,-0.4 4,-2.6 69,-0.3 70,-0.2 0.854 100.7 60.7 -55.8 -31.9 56.6 -10.4 87.1 179 183 A Y H > S+ 0 0 56 68,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.913 106.3 43.3 -62.6 -42.8 53.0 -9.9 88.1 180 184 A I H > S+ 0 0 0 -3,-0.4 4,-2.1 67,-0.4 -6,-0.2 0.918 111.6 53.8 -71.9 -40.2 53.6 -11.1 91.6 181 185 A E H X S+ 0 0 13 -4,-2.6 4,-2.7 -7,-0.5 -2,-0.2 0.924 108.7 51.6 -52.8 -45.7 56.9 -9.0 91.7 182 186 A G H X S+ 0 0 27 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.908 106.6 52.3 -61.7 -40.8 54.7 -6.0 90.7 183 187 A E H X S+ 0 0 14 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.859 111.9 45.9 -64.0 -34.2 52.2 -6.7 93.5 184 188 A M H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.886 108.4 56.0 -76.0 -36.6 55.1 -6.8 96.0 185 189 A R H X S+ 0 0 79 -4,-2.7 4,-3.1 -5,-0.2 -2,-0.2 0.918 106.7 51.6 -56.5 -44.2 56.6 -3.6 94.5 186 190 A T H X S+ 0 0 68 -4,-2.4 4,-1.9 1,-0.2 6,-0.2 0.930 108.9 49.6 -59.6 -45.6 53.2 -1.9 95.1 187 191 A R H X>S+ 0 0 15 -4,-1.6 5,-1.8 1,-0.2 4,-0.8 0.905 115.1 44.6 -61.4 -38.9 53.2 -3.0 98.8 188 192 A I H ><5S+ 0 0 11 -4,-2.3 3,-0.6 3,-0.2 -2,-0.2 0.930 108.1 56.9 -72.2 -41.5 56.7 -1.7 99.2 189 193 A R H 3<5S+ 0 0 117 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.880 120.7 29.1 -57.9 -40.4 56.1 1.6 97.4 190 194 A Y H 3<5S- 0 0 150 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.502 102.1-128.2 -99.0 -0.5 53.2 2.5 99.8 191 195 A N T <<5 + 0 0 118 -4,-0.8 2,-0.5 -3,-0.6 -3,-0.2 0.901 63.4 140.0 47.2 47.6 54.6 0.6 102.8 192 196 A R < - 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0 0 2 -4,-2.5 -71,-0.3 -71,-0.3 -1,-0.2 -0.899 50.3-178.3-109.6 128.4 55.2 -15.2 84.0 249 253 A A + 0 0 7 -73,-2.6 2,-0.3 -2,-0.5 -72,-0.2 0.684 68.0 10.6-101.0 -26.0 59.0 -14.6 84.1 250 254 A L - 0 0 2 -74,-1.7 2,-0.3 -212,-0.1 -1,-0.3 -0.991 61.4-150.9-153.7 156.8 60.2 -18.2 84.3 251 255 A M B -g 40 0C 0 -212,-1.7 -210,-3.2 -2,-0.3 2,-0.2 -0.938 24.7-112.6-124.7 150.2 59.0 -21.8 84.0 252 256 A V - 0 0 16 -2,-0.3 2,-0.3 -45,-0.2 -178,-0.1 -0.553 49.1 -99.5 -72.5 142.9 59.9 -25.1 85.4 253 257 A Y + 0 0 58 -180,-0.5 -209,-0.2 -211,-0.3 3,-0.1 -0.509 53.3 160.5 -67.9 127.4 61.3 -27.4 82.7 254 258 A R - 0 0 111 1,-0.5 2,-0.3 -2,-0.3 -1,-0.2 0.626 61.5 -11.6-122.7 -28.4 58.5 -29.8 81.5 255 259 A C S S- 0 0 31 3,-0.0 -1,-0.5 0, 0.0 -212,-0.0 -0.955 77.8 -85.1-161.5 164.2 59.6 -31.1 78.1 256 260 A A - 0 0 63 -2,-0.3 0, 0.0 -3,-0.1 0, 0.0 -0.499 56.5-100.7 -69.5 146.4 62.3 -30.4 75.4 257 261 A P - 0 0 68 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.459 41.5-112.8 -66.6 141.2 61.2 -27.6 73.0 258 262 A P - 0 0 91 0, 0.0 -3,-0.0 0, 0.0 -42,-0.0 -0.287 50.3 -70.8 -67.6 163.6 59.9 -29.1 69.8 259 263 A P - 0 0 104 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.170 50.9-106.3 -49.4 151.0 62.0 -28.5 66.6 260 264 A S - 0 0 106 -3,-0.1 0, 0.0 1,-0.1 0, 0.0 0.873 46.8-178.8 -49.7 -45.7 61.9 -24.8 65.4 261 265 A S + 0 0 98 1,-0.1 2,-0.2 2,-0.1 -1,-0.1 0.854 9.1 177.3 43.2 52.0 59.6 -25.9 62.5 262 266 A Q 0 0 167 1,-0.1 -1,-0.1 0, 0.0 -2,-0.0 -0.501 360.0 360.0 -76.3 150.3 59.4 -22.4 61.0 263 267 A F 0 0 277 -2,-0.2 -1,-0.1 0, 0.0 -2,-0.1 0.915 360.0 360.0 -64.4 360.0 57.4 -22.0 57.7