==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE INHIBITOR 19-AUG-10 3OIH . COMPND 2 MOLECULE: HAEMENTHIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SCADOXUS MULTIFLORUS; . AUTHOR M.KUMAR,S.KUMAR,M.SINHA,P.KAUR,S.SHARMA,T.P.SINGH . 272 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11493.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 18.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 21 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 25.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.9 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 1 1 2 2 0 0 1 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 1 2 1 3 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 . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 1 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 1 A A 0 0 102 0, 0.0 3,-0.2 0, 0.0 267,-0.0 0.000 360.0 360.0 360.0 -2.1 13.5 -7.5 -2.2 2 2 A N - 0 0 158 1,-0.2 2,-0.4 266,-0.1 266,-0.0 0.880 360.0-171.6 41.2 51.5 11.4 -8.8 0.6 3 3 A L - 0 0 22 264,-0.1 2,-0.4 265,-0.1 -1,-0.2 -0.540 18.7-153.8 -82.2 131.2 12.9 -6.0 2.6 4 4 A D - 0 0 80 244,-0.4 246,-1.8 -2,-0.4 2,-0.4 -0.809 14.1-163.8 -93.0 133.9 12.2 -5.8 6.3 5 5 A I E -a 250 0A 0 -2,-0.4 23,-2.5 21,-0.2 24,-1.5 -0.977 8.2-162.2-123.6 131.0 12.4 -2.3 7.7 6 6 A A E -ab 251 29A 0 244,-2.4 246,-2.3 -2,-0.4 2,-0.4 -0.874 16.0-172.3-105.7 142.5 12.7 -1.3 11.4 7 7 A V E -ab 252 30A 0 22,-1.8 24,-3.4 -2,-0.4 2,-0.4 -0.997 21.9-128.6-140.9 143.3 11.9 2.2 12.4 8 8 A Y E - b 0 31A 0 244,-1.3 247,-3.1 -2,-0.4 246,-0.4 -0.716 29.4-175.3 -87.9 139.6 12.2 4.4 15.5 9 9 A W E + b 0 32A 3 22,-2.6 24,-2.4 -2,-0.4 8,-0.1 -0.925 51.9 56.5-131.7 154.9 9.0 6.2 16.6 10 10 A G + 0 0 0 -2,-0.3 41,-0.2 22,-0.2 -1,-0.1 0.517 63.4 118.3 103.0 9.0 8.4 8.7 19.4 11 11 A Q S S+ 0 0 37 1,-0.2 2,-0.3 -3,-0.1 38,-0.1 0.484 72.3 41.6 -84.7 -6.4 10.9 11.4 18.5 12 12 A N > - 0 0 28 36,-0.1 3,-2.1 1,-0.1 -2,-0.2 -0.946 62.6-144.2-149.8 127.4 8.5 14.2 17.9 13 13 A F T 3 S+ 0 0 129 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.859 108.0 45.4 -50.5 -39.6 5.3 15.4 19.5 14 14 A D T 3 S+ 0 0 126 -3,-0.1 -1,-0.3 37,-0.0 3,-0.1 0.251 88.3 123.0 -91.4 10.1 4.0 16.3 16.1 15 15 A E S < S- 0 0 14 -3,-2.1 3,-0.1 1,-0.1 241,-0.1 -0.321 76.7 -77.2 -72.7 160.1 4.9 13.1 14.3 16 16 A R - 0 0 56 239,-0.1 -1,-0.1 240,-0.1 -4,-0.1 -0.217 66.3 -96.4 -47.5 133.9 2.6 10.8 12.4 17 17 A S > - 0 0 45 1,-0.1 4,-2.1 -3,-0.1 5,-0.2 -0.068 26.2-112.5 -57.8 160.4 0.8 8.7 15.0 18 18 A L H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.919 117.9 48.4 -60.9 -45.2 2.0 5.2 16.0 19 19 A E H > S+ 0 0 85 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.894 111.5 49.0 -64.1 -39.4 -1.1 3.5 14.5 20 20 A A H > S+ 0 0 35 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.849 108.7 55.1 -69.1 -33.0 -0.7 5.5 11.2 21 21 A T H >< S+ 0 0 0 -4,-2.1 3,-0.8 1,-0.2 5,-0.4 0.929 111.7 43.6 -64.0 -43.1 3.1 4.5 11.1 22 22 A a H >< S+ 0 0 4 -4,-2.1 3,-1.5 1,-0.2 5,-0.2 0.868 105.7 62.8 -71.0 -34.7 2.1 0.9 11.4 23 23 A D H 3< S+ 0 0 74 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.657 85.4 77.5 -65.4 -11.5 -0.7 1.3 8.8 24 24 A T T << S- 0 0 27 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.817 90.7-142.4 -68.1 -27.9 1.9 2.3 6.2 25 25 A G S < S+ 0 0 54 -3,-1.5 -1,-0.1 -4,-0.3 -2,-0.1 0.544 72.6 110.0 76.3 5.1 2.8 -1.3 5.8 26 26 A N + 0 0 11 -5,-0.4 2,-0.4 -22,-0.0 -21,-0.2 0.663 63.3 67.6 -85.5 -18.4 6.4 -0.2 5.4 27 27 A Y - 0 0 14 -6,-0.3 -21,-0.2 -5,-0.2 3,-0.1 -0.866 43.1-176.1-117.7 142.3 7.7 -1.6 8.7 28 28 A A S S+ 0 0 24 -23,-2.5 41,-2.5 -2,-0.4 2,-0.4 0.711 89.5 27.6 -92.9 -29.1 8.3 -5.0 10.2 29 29 A Y E -bc 6 69A 40 -24,-1.5 -22,-1.8 39,-0.2 2,-0.5 -0.994 61.6-166.6-134.1 139.9 9.4 -3.4 13.5 30 30 A V E -bc 7 70A 0 39,-2.5 41,-2.0 -2,-0.4 2,-0.7 -0.989 15.1-156.4-124.5 121.9 8.5 -0.1 15.1 31 31 A I E -bc 8 71A 0 -24,-3.4 -22,-2.6 -2,-0.5 2,-0.5 -0.846 5.6-147.3-106.9 109.4 10.8 0.8 18.0 32 32 A I E -bc 9 72A 0 39,-2.5 41,-2.8 -2,-0.7 2,-0.4 -0.635 27.4-126.2 -77.3 120.4 9.3 3.2 20.5 33 33 A G E + c 0 73A 1 -24,-2.4 41,-0.1 -2,-0.5 43,-0.1 -0.968 52.9 24.2-121.8 137.8 12.0 5.5 22.0 34 34 A F E + 0 0 15 39,-0.6 13,-2.8 -2,-0.4 2,-1.4 0.510 12.9 160.2-150.8 151.5 12.9 6.1 24.7 35 35 A L E +Dc 46 74A 0 38,-2.5 40,-2.9 11,-0.2 11,-0.2 -0.769 41.3 162.9 -81.4 89.2 13.1 4.9 28.4 36 36 A N E + 0 0 14 -2,-1.4 2,-0.4 9,-0.6 -1,-0.2 0.295 44.7 68.5-101.9 6.9 15.9 7.4 28.8 37 37 A T E +D 45 0A 19 8,-1.2 8,-1.8 42,-0.1 2,-0.3 -0.981 59.7 111.1-131.2 119.2 15.9 7.7 32.6 38 38 A F E +k 81 0B 5 42,-0.9 44,-1.5 -2,-0.4 5,-0.1 -0.943 47.6 37.8-170.3 164.2 17.0 4.9 34.8 39 39 A G E > S+D 42 0A 9 3,-0.6 3,-2.0 -2,-0.3 44,-0.1 0.022 74.1 74.7 80.2 172.3 19.9 4.1 37.2 40 40 A G T 3 S- 0 0 56 1,-0.3 3,-0.1 41,-0.0 -1,-0.1 0.841 128.7 -50.2 53.8 40.0 21.7 6.3 39.6 41 41 A G T 3 S+ 0 0 86 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.320 108.9 129.4 83.8 -6.9 19.1 6.6 42.2 42 42 A Q E < -D 39 0A 80 -3,-2.0 -3,-0.6 38,-0.1 -1,-0.3 -0.455 59.4-128.4 -81.3 148.1 16.5 7.5 39.6 43 43 A T E - 0 0 107 -2,-0.2 -1,-0.0 -5,-0.1 2,-0.0 -0.708 45.4 -93.9 -86.6 146.6 13.2 6.0 39.1 44 44 A P E + 0 0 34 0, 0.0 2,-0.3 0, 0.0 -6,-0.2 -0.328 50.3 177.6 -65.5 145.9 12.6 5.0 35.4 45 45 A A E -D 37 0A 40 -8,-1.8 -8,-1.2 -3,-0.0 -9,-0.6 -0.994 22.8-128.3-145.2 153.7 11.0 7.4 33.1 46 46 A L E -D 35 0A 43 -2,-0.3 2,-0.4 -11,-0.2 -11,-0.2 -0.738 8.3-167.5 -99.0 147.2 10.0 7.7 29.4 47 47 A D + 0 0 63 -13,-2.8 -2,-0.0 -2,-0.3 0, 0.0 -0.834 25.0 153.9-132.1 89.5 10.8 10.5 27.1 48 48 A I S > S- 0 0 7 -2,-0.4 3,-2.1 3,-0.2 -14,-0.1 -0.356 72.3 -92.7-113.5 48.0 8.6 9.9 24.1 49 49 A S T 3 S- 0 0 35 1,-0.3 3,-0.1 -38,-0.1 -2,-0.1 0.789 81.6 -52.8 47.9 41.5 8.4 13.5 23.0 50 50 A G T 3 S+ 0 0 59 1,-0.3 -1,-0.3 -38,-0.0 2,-0.1 0.474 94.4 145.1 80.8 -0.1 5.2 14.4 24.9 51 51 A H < - 0 0 28 -3,-2.1 -1,-0.3 -41,-0.2 -3,-0.2 -0.463 59.7-105.0 -70.0 144.5 3.1 11.5 23.5 52 52 A S > - 0 0 72 1,-0.2 4,-0.9 -2,-0.1 -1,-0.1 -0.604 24.6-154.3 -72.1 120.2 0.6 10.1 26.0 53 53 A P T >4 S+ 0 0 47 0, 0.0 3,-1.3 0, 0.0 4,-0.5 0.949 96.6 43.9 -61.8 -46.7 1.9 6.7 27.3 54 54 A S T >4 S+ 0 0 75 1,-0.3 3,-1.5 2,-0.2 60,-0.1 0.865 107.2 62.4 -62.3 -36.6 -1.5 5.4 28.2 55 55 A G T 3> S+ 0 0 33 1,-0.3 4,-0.5 2,-0.1 -1,-0.3 0.704 94.8 62.7 -60.7 -27.4 -2.7 6.8 24.9 56 56 A L H S+ 0 0 42 -3,-1.5 4,-1.9 -4,-0.5 -1,-0.2 0.890 93.2 36.1 -42.5 -59.5 -2.1 1.3 24.5 58 58 A P H > S+ 0 0 78 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.865 116.2 56.1 -68.2 -34.0 -4.6 0.8 21.7 59 59 A Q H X S+ 0 0 33 -4,-0.5 4,-2.4 2,-0.2 -2,-0.2 0.891 106.8 48.7 -62.7 -44.0 -2.1 2.0 19.1 60 60 A I H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.954 111.8 49.2 -62.4 -46.9 0.4 -0.6 20.1 61 61 A K H X S+ 0 0 96 -4,-1.9 4,-2.3 -5,-0.3 -2,-0.2 0.891 110.2 51.7 -59.9 -39.1 -2.3 -3.3 20.0 62 62 A H H X S+ 0 0 61 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.943 108.7 51.0 -63.0 -46.3 -3.4 -2.1 16.6 63 63 A a H ><>S+ 0 0 0 -4,-2.4 5,-2.1 1,-0.2 3,-0.9 0.939 111.9 46.5 -55.0 -49.9 0.2 -2.3 15.3 64 64 A Q H ><5S+ 0 0 48 -4,-2.4 3,-1.9 1,-0.3 -1,-0.2 0.854 104.8 60.5 -63.9 -34.5 0.5 -5.9 16.6 65 65 A S H 3<5S+ 0 0 84 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.777 104.6 50.5 -64.7 -24.4 -2.8 -6.9 15.1 66 66 A K T <<5S- 0 0 116 -4,-1.2 -1,-0.3 -3,-0.9 -2,-0.2 0.047 126.2-105.2 -99.8 25.1 -1.3 -5.9 11.7 67 67 A N T < 5S+ 0 0 147 -3,-1.9 2,-0.5 1,-0.2 -3,-0.2 0.749 73.4 142.0 58.6 32.3 1.7 -8.1 12.5 68 68 A V < - 0 0 7 -5,-2.1 2,-0.4 -6,-0.2 -1,-0.2 -0.894 50.3-128.7-102.0 127.0 4.1 -5.2 13.2 69 69 A K E -c 29 0A 97 -41,-2.5 -39,-2.5 -2,-0.5 2,-0.6 -0.654 20.0-154.7 -78.0 128.8 6.5 -5.9 16.1 70 70 A V E -c 30 0A 0 -2,-0.4 48,-3.0 -41,-0.2 49,-0.6 -0.923 15.5-179.9-111.6 116.8 6.5 -3.2 18.7 71 71 A L E -ce 31 119A 0 -41,-2.0 -39,-2.5 -2,-0.6 2,-0.5 -0.776 23.8-132.5-111.3 157.2 9.6 -2.8 20.9 72 72 A L E -ce 32 120A 0 47,-2.0 49,-3.2 -2,-0.3 2,-0.5 -0.941 21.0-145.4-106.8 130.1 10.6 -0.4 23.7 73 73 A S E -ce 33 121A 0 -41,-2.8 -38,-2.5 -2,-0.5 -39,-0.6 -0.849 8.6-154.5 -98.7 128.8 14.0 1.2 23.4 74 74 A I E +ce 35 122A 0 47,-3.1 49,-2.2 -2,-0.5 2,-0.7 -0.794 64.7 5.8-101.6 144.2 16.0 1.9 26.5 75 75 A G E S- e 0 123A 0 -40,-2.9 3,-0.2 -2,-0.4 49,-0.2 -0.830 75.8-171.3 96.1-115.3 18.6 4.6 26.7 76 76 A G E - e 0 124A 0 47,-2.8 49,-0.5 -2,-0.7 5,-0.1 -0.489 45.3 -52.5 110.5 179.1 18.7 6.7 23.6 77 77 A P S S+ 0 0 58 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.864 121.1 6.0 -60.4 -37.8 20.9 9.4 22.1 78 78 A K S S+ 0 0 143 -3,-0.2 -3,-0.0 2,-0.0 48,-0.0 -0.962 80.1 106.4-144.7 156.7 20.7 11.5 25.2 79 79 A G - 0 0 25 -2,-0.3 2,-1.9 2,-0.1 -42,-0.1 -0.683 69.6 -82.3 144.3 153.7 19.3 11.2 28.7 80 80 A P S S+ 0 0 66 0, 0.0 -42,-0.9 0, 0.0 2,-0.4 -0.496 74.7 137.5 -84.1 67.9 20.2 10.7 32.4 81 81 A Y B +k 38 0B 4 -2,-1.9 2,-0.3 -44,-0.2 -42,-0.2 -0.950 18.2 153.0-118.9 139.1 20.5 6.9 32.2 82 82 A S - 0 0 37 -44,-1.5 45,-0.1 -2,-0.4 3,-0.0 -0.960 24.5-168.3-153.7 161.1 23.2 4.7 33.8 83 83 A L + 0 0 1 -2,-0.3 48,-1.7 -44,-0.1 52,-0.1 -0.248 34.1 138.7-151.6 56.5 23.5 1.1 34.9 84 84 A D + 0 0 107 46,-0.2 2,-0.3 47,-0.1 -1,-0.0 0.673 58.1 67.4 -81.2 -18.7 26.7 0.8 36.9 85 85 A S S > S- 0 0 46 1,-0.1 4,-1.6 -3,-0.0 46,-0.1 -0.749 76.3-131.7-105.9 153.8 25.4 -1.5 39.7 86 86 A R H > S+ 0 0 164 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.844 112.5 56.6 -65.9 -33.2 24.2 -5.0 39.6 87 87 A S H > S+ 0 0 68 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.886 102.1 55.7 -64.7 -39.0 21.2 -3.9 41.6 88 88 A D H > S+ 0 0 31 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.927 108.5 48.1 -57.4 -46.4 20.4 -1.4 38.8 89 89 A A H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.910 112.4 47.4 -61.5 -46.1 20.4 -4.2 36.3 90 90 A N H X S+ 0 0 79 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.926 113.1 49.6 -62.7 -44.8 18.1 -6.4 38.4 91 91 A D H X S+ 0 0 85 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.931 113.2 44.6 -61.0 -48.4 15.7 -3.5 39.0 92 92 A L H X S+ 0 0 6 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.887 112.5 52.8 -65.6 -39.0 15.5 -2.4 35.4 93 93 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.962 113.0 42.5 -62.4 -48.1 15.0 -6.0 34.2 94 94 A V H X S+ 0 0 52 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.898 114.5 52.2 -64.8 -40.3 12.2 -6.7 36.6 95 95 A Y H X S+ 0 0 49 -4,-2.3 4,-2.1 -5,-0.2 5,-0.3 0.944 112.5 44.1 -60.5 -50.2 10.6 -3.3 35.9 96 96 A L H X>S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 5,-1.4 0.907 115.7 48.6 -62.3 -42.2 10.7 -3.9 32.1 97 97 A F H X>S+ 0 0 25 -4,-2.3 5,-0.6 -5,-0.2 4,-0.5 0.943 115.2 41.5 -64.4 -49.3 9.4 -7.4 32.4 98 98 A N H <5S+ 0 0 60 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.877 124.7 35.7 -66.0 -39.9 6.5 -6.7 34.8 99 99 A N H <5S+ 0 0 17 -4,-2.1 13,-0.3 -5,-0.3 -2,-0.2 0.742 132.7 13.2 -92.5 -30.4 5.4 -3.6 33.0 100 100 A F H <5S+ 0 0 0 -4,-2.2 17,-2.7 -5,-0.3 -3,-0.2 0.677 124.2 45.4-119.7 -30.2 6.0 -4.1 29.4 101 101 A L T < - 0 0 23 -2,-0.3 3,-2.5 1,-0.1 5,-0.1 -0.932 14.3-139.1-152.1 123.7 2.0 0.1 33.5 111 111 A P T 3 S+ 0 0 25 0, 0.0 -55,-0.2 0, 0.0 -54,-0.2 0.859 108.7 39.1 -46.8 -46.2 3.0 3.1 31.4 112 112 A F T > S- 0 0 1 1,-0.3 3,-1.3 -13,-0.3 -52,-0.1 0.059 110.8-128.1 -95.2 24.2 1.4 1.7 28.2 113 113 A G T < - 0 0 15 -3,-2.5 -1,-0.3 1,-0.2 -58,-0.0 -0.340 68.7 -20.5 66.9-143.4 -1.5 0.3 30.0 114 114 A N T 3 S+ 0 0 83 -3,-0.1 -1,-0.2 -60,-0.1 2,-0.1 0.263 101.2 122.2 -86.4 13.5 -2.4 -3.4 29.5 115 115 A A < - 0 0 2 -3,-1.3 2,-0.5 -5,-0.1 -13,-0.2 -0.428 53.6-144.7 -75.4 149.1 -0.5 -3.6 26.2 116 116 A V - 0 0 47 -59,-0.1 -15,-0.2 -15,-0.1 -46,-0.1 -0.969 14.5-138.9-120.4 117.0 2.3 -6.2 26.0 117 117 A L - 0 0 6 -17,-2.7 -46,-0.2 -2,-0.5 3,-0.1 -0.199 10.2-131.6 -71.6 158.2 5.3 -5.2 24.0 118 118 A D S S- 0 0 47 -48,-3.0 32,-2.6 1,-0.2 2,-0.3 0.397 73.1 -42.5 -89.9 -3.7 7.2 -7.6 21.6 119 119 A G E -ef 71 150A 0 -49,-0.6 -47,-2.0 30,-0.2 2,-0.4 -0.968 54.7 -83.7 167.3-176.8 10.6 -6.8 23.0 120 120 A I E -ef 72 151A 0 30,-2.4 32,-2.5 -2,-0.3 2,-0.5 -0.981 26.1-154.0-125.7 134.2 13.3 -4.5 24.3 121 121 A D E -ef 73 152A 0 -49,-3.2 -47,-3.1 -2,-0.4 2,-1.0 -0.914 10.6-144.2-108.6 125.5 15.8 -2.5 22.2 122 122 A F E +ef 74 153A 0 30,-3.0 32,-2.7 -2,-0.5 2,-0.4 -0.771 26.9 166.8 -90.0 99.3 19.2 -1.6 23.8 123 123 A H E +e 75 0A 2 -49,-2.2 -47,-2.8 -2,-1.0 2,-0.8 -0.456 13.9 167.5-108.6 57.5 20.1 1.9 22.4 124 124 A I E +e 76 0A 3 -2,-0.4 39,-0.2 -49,-0.2 40,-0.1 -0.641 9.7 168.8 -79.5 110.5 22.9 2.5 24.9 125 125 A E + 0 0 36 -2,-0.8 2,-0.3 -49,-0.5 -1,-0.2 0.537 59.4 19.3 -99.6 -10.8 24.9 5.5 23.7 126 126 A H S S+ 0 0 68 2,-0.1 -1,-0.1 -50,-0.1 -50,-0.0 -0.978 86.9 58.5-155.3 166.5 27.0 6.1 26.8 127 127 A G S S- 0 0 54 -2,-0.3 3,-0.4 -45,-0.1 -44,-0.1 0.264 86.6-106.5 97.1 -8.6 28.5 4.7 30.0 128 128 A G - 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j 0 253A 0 0, 0.0 11,-0.4 0, 0.0 37,-0.2 -0.580 23.2-143.4 -78.0 144.2 19.0 8.4 8.4 218 218 A A S S+ 0 0 0 35,-2.0 45,-0.2 -2,-0.2 36,-0.1 0.575 82.5 17.6 -85.7 -8.2 15.7 8.9 6.6 219 219 A H S > S- 0 0 40 34,-0.4 3,-1.4 1,-0.1 4,-0.5 -0.986 80.3-110.4-157.1 154.4 16.5 12.5 5.7 220 220 A P G > S+ 0 0 69 0, 0.0 3,-0.5 0, 0.0 7,-0.2 0.797 120.7 50.2 -59.2 -32.6 19.6 14.7 5.5 221 221 A D G 3 S+ 0 0 120 1,-0.2 36,-0.0 36,-0.1 4,-0.0 0.609 93.2 77.5 -78.2 -16.0 18.3 16.7 8.6 222 222 A A G < S+ 0 0 14 -3,-1.4 2,-0.3 35,-0.0 -1,-0.2 0.708 104.2 21.3 -68.3 -22.4 17.7 13.5 10.6 223 223 A A S < S- 0 0 18 -3,-0.5 4,-0.1 -4,-0.5 3,-0.1 -0.956 75.4-116.8-143.8 161.5 21.4 13.0 11.4 224 224 A G S S- 0 0 73 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.835 95.6 -19.2 -66.5 -32.2 24.6 15.1 11.6 225 225 A S S S+ 0 0 43 -3,-0.0 -43,-2.1 -36,-0.0 -1,-0.2 -0.973 100.9 71.3-165.3 168.5 26.1 13.0 8.8 226 226 A G + 0 0 7 -38,-0.3 -38,-0.5 -2,-0.3 -37,-0.1 0.324 50.7 155.6 97.9 -2.4 25.8 9.7 6.9 227 227 A Y - 0 0 65 -7,-0.2 -1,-0.3 -4,-0.1 -9,-0.1 -0.333 18.5-173.8 -59.8 131.7 22.7 10.3 5.0 228 228 A M - 0 0 0 -11,-0.4 5,-0.1 -39,-0.0 -1,-0.0 -0.990 26.6-115.8-129.6 122.8 22.6 8.1 1.8 229 229 A P > - 0 0 24 0, 0.0 4,-2.0 0, 0.0 3,-0.4 -0.180 25.9-116.8 -61.4 150.2 19.9 8.5 -0.7 230 230 A P H > S+ 0 0 5 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.814 112.8 53.5 -60.6 -38.9 17.6 5.5 -1.2 231 231 A E H > S+ 0 0 114 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.892 109.6 50.5 -63.1 -38.8 18.5 4.8 -4.7 232 232 A K H >>S+ 0 0 80 -3,-0.4 4,-2.7 2,-0.2 5,-0.7 0.891 109.1 51.5 -64.3 -41.4 22.2 4.8 -3.7 233 233 A V H X>S+ 0 0 0 -4,-2.0 5,-1.7 3,-0.2 4,-1.6 0.961 112.6 45.2 -62.0 -46.1 21.4 2.3 -0.9 234 234 A K H <5S+ 0 0 95 -4,-2.4 -2,-0.2 3,-0.2 -1,-0.2 0.936 122.3 36.5 -63.0 -46.6 19.6 0.0 -3.2 235 235 A F H <5S+ 0 0 170 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.900 131.1 25.2 -69.2 -45.6 22.2 0.2 -6.0 236 236 A H H <5S+ 0 0 69 -4,-2.7 4,-0.3 -5,-0.2 -3,-0.2 0.741 128.5 33.8 -95.0 -36.5 25.3 0.3 -4.0 237 237 A V T X4 S+ 0 0 51 -4,-0.3 3,-1.2 1,-0.2 -2,-0.2 0.915 119.3 49.3 -67.8 -43.7 26.8 -6.8 -1.4 241 241 A A H >< S+ 0 0 0 -4,-2.2 3,-2.2 1,-0.3 6,-0.3 0.908 102.2 60.6 -64.9 -39.8 24.7 -6.9 1.8 242 242 A K T 3< S+ 0 0 105 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.649 91.2 70.9 -63.1 -16.5 22.3 -9.4 0.5 243 243 A K T < S+ 0 0 187 -3,-1.2 2,-0.4 -4,-0.4 -1,-0.3 0.550 83.8 90.0 -78.2 -4.8 25.2 -11.9 0.0 244 244 A S S X S- 0 0 20 -3,-2.2 3,-1.3 -4,-0.2 -39,-0.0 -0.789 72.5-146.5 -95.8 137.0 25.4 -12.1 3.8 245 245 A Y T 3 S+ 0 0 181 -2,-0.4 -1,-0.1 1,-0.3 -3,-0.1 0.626 101.9 56.3 -71.3 -14.7 23.4 -14.8 5.6 246 246 A K T 3 S+ 0 0 14 -5,-0.1 -34,-3.4 -42,-0.1 2,-0.3 0.437 72.3 125.6 -95.3 -4.4 23.0 -12.3 8.4 247 247 A F E < + j 0 212A 37 -3,-1.3 -34,-0.2 -6,-0.3 3,-0.1 -0.420 27.8 170.9 -59.4 117.0 21.4 -9.5 6.3 248 248 A G E - 0 0 9 -36,-2.7 -244,-0.4 1,-0.4 2,-0.3 0.705 46.5-102.4-101.1 -23.9 18.2 -8.6 8.1 249 249 A G E - j 0 213A 0 -37,-0.7 -35,-2.2 -246,-0.1 -1,-0.4 -0.986 51.8 -50.0 136.8-147.0 17.2 -5.5 6.2 250 250 A I E -aj 5 214A 0 -246,-1.8 -244,-2.4 -2,-0.3 2,-0.4 -0.905 30.6-147.3-129.3 158.1 17.5 -1.8 7.2 251 251 A M E -aj 6 215A 0 -37,-2.3 -35,-2.4 -2,-0.3 2,-0.4 -0.928 19.0-152.3-116.1 143.4 16.6 0.4 10.1 252 252 A L E -aj 7 216A 0 -246,-2.3 -244,-1.3 -2,-0.4 2,-0.8 -0.965 17.4-118.2-116.7 137.5 15.7 4.1 9.5 253 253 A W E S- j 0 217A 35 -37,-2.9 -35,-2.0 -2,-0.4 -34,-0.4 -0.810 78.9 -11.0-104.8 106.2 16.1 7.0 11.8 254 254 A D > - 0 0 4 -2,-0.8 4,-2.6 -246,-0.4 5,-0.2 0.709 37.1-137.8-153.5-173.1 13.2 7.8 12.2 255 255 A S H > S+ 0 0 0 -247,-3.1 4,-2.2 1,-0.2 5,-0.2 0.892 106.8 57.7 -58.6 -41.0 9.5 7.8 11.6 256 256 A Y H > S+ 0 0 75 -248,-0.3 4,-0.9 1,-0.2 -1,-0.2 0.934 115.4 36.7 -58.4 -48.3 9.1 11.6 11.9 257 257 A W H > S+ 0 0 60 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.828 112.2 57.8 -69.5 -40.4 11.7 12.1 9.1 258 258 A D H X S+ 0 0 2 -4,-2.6 4,-2.2 1,-0.2 5,-0.3 0.864 101.4 57.7 -60.5 -36.0 10.6 9.1 7.0 259 259 A T H < S+ 0 0 52 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.930 113.5 39.6 -59.9 -44.6 7.1 10.6 6.8 260 260 A V H < S+ 0 0 88 -4,-0.9 -2,-0.2 -5,-0.2 -1,-0.2 0.927 123.2 38.4 -67.8 -50.4 8.6 13.7 5.3 261 261 A S H < S- 0 0 19 -4,-2.7 -2,-0.2 1,-0.0 -3,-0.2 0.661 87.6-141.5 -76.7 -26.6 11.2 12.1 3.0 262 262 A N X + 0 0 74 -4,-2.2 4,-2.4 -5,-0.2 5,-0.2 0.784 48.5 150.4 61.0 31.0 9.2 9.1 1.8 263 263 A F H > + 0 0 1 -5,-0.3 4,-2.1 -45,-0.2 5,-0.2 0.929 68.4 45.1 -60.4 -46.0 12.5 7.2 2.2 264 264 A S H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 6,-0.4 0.878 110.3 54.5 -65.5 -39.1 11.0 3.9 3.0 265 265 A S H >>S+ 0 0 23 -7,-0.2 5,-2.8 1,-0.2 4,-1.1 0.940 111.9 46.0 -61.2 -43.0 8.4 4.3 0.2 266 266 A K H <5S+ 0 0 118 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.842 111.5 50.7 -64.4 -41.1 11.3 4.9 -2.3 267 267 A I H <5S+ 0 0 10 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.877 116.4 41.6 -64.7 -39.3 13.3 1.9 -1.0 268 268 A L H <5S- 0 0 59 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.621 118.1-101.9 -88.8 -8.9 10.3 -0.4 -1.3 269 269 A G T <5S- 0 0 61 -4,-1.1 -3,-0.2 -5,-0.1 -4,-0.1 0.527 85.5 -53.7 92.9 6.5 8.9 0.8 -4.6 270 270 A E S