==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTITUMOR PROTEIN 13-OCT-11 3U6T . COMPND 2 MOLECULE: RIBOSOME INACTIVATING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MOMORDICA BALSAMINA; . AUTHOR S.YAMINI,S.PANDEY,G.S.KUSHWAHA,M.SINHA,A.BHUSHAN,P.KAUR,S.SH . 246 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11399.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 177 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 14.6 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 . 2 0.8 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 . 19 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 70 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.8 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 1 0 1 1 0 1 0 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 2 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 PARALLEL BRIDGES PER LADDER . 2 0 1 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 . 2 0 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 1 A D 0 0 131 0, 0.0 2,-0.3 0, 0.0 49,-0.2 0.000 360.0 360.0 360.0 150.7 -3.7 27.4 -1.6 2 2 A V E -a 50 0A 10 47,-1.9 49,-3.1 2,-0.0 2,-0.3 -0.892 360.0-158.8-118.4 154.5 -0.3 26.5 -0.2 3 3 A S E -a 51 0A 43 -2,-0.3 2,-0.3 47,-0.2 49,-0.2 -0.959 13.8-175.5-136.6 150.3 1.9 23.5 -1.1 4 4 A F E -a 52 0A 7 47,-2.4 49,-2.4 -2,-0.3 2,-0.5 -0.966 9.0-159.8-145.8 131.6 4.7 21.3 0.3 5 5 A R E -a 53 0A 144 -2,-0.3 49,-0.2 47,-0.2 50,-0.1 -0.943 8.6-163.1-113.5 122.8 6.5 18.4 -1.3 6 6 A L > + 0 0 15 47,-2.7 3,-1.6 -2,-0.5 2,-0.7 0.765 69.9 94.8 -73.4 -25.6 8.4 15.9 0.8 7 7 A S T 3 S- 0 0 70 47,-0.4 -2,-0.1 1,-0.3 49,-0.0 -0.577 108.1 -1.4 -69.9 112.0 10.4 14.7 -2.3 8 8 A G T 3 S+ 0 0 71 -2,-0.7 -1,-0.3 1,-0.2 5,-0.2 0.512 97.0 160.2 84.2 7.4 13.6 16.7 -2.3 9 9 A A < + 0 0 14 -3,-1.6 -1,-0.2 4,-0.1 -3,-0.1 -0.271 9.0 165.9 -63.8 143.9 12.6 18.6 0.9 10 10 A D > - 0 0 59 119,-0.0 4,-2.4 166,-0.0 5,-0.3 -0.884 55.9 -82.6-145.6 174.9 15.2 20.3 3.0 11 11 A P H > S+ 0 0 45 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.844 128.1 52.3 -52.1 -32.5 15.3 22.9 5.8 12 12 A S H > S+ 0 0 73 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.944 110.2 43.3 -68.5 -52.0 15.0 25.6 3.1 13 13 A S H > S+ 0 0 28 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.843 114.7 51.0 -66.6 -33.9 12.0 24.3 1.2 14 14 A Y H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.908 108.7 51.9 -65.8 -42.6 10.2 23.5 4.5 15 15 A G H X S+ 0 0 12 -4,-1.8 4,-2.1 -5,-0.3 -2,-0.2 0.878 108.0 52.2 -58.7 -40.5 11.0 27.1 5.6 16 16 A M H X S+ 0 0 110 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.893 109.1 50.2 -61.9 -42.5 9.4 28.4 2.3 17 17 A F H X S+ 0 0 4 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.898 110.2 48.3 -63.0 -44.3 6.3 26.3 3.0 18 18 A I H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.880 111.1 51.5 -67.3 -37.6 5.8 27.6 6.5 19 19 A K H X S+ 0 0 129 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.934 111.1 48.0 -58.6 -49.0 6.3 31.2 5.2 20 20 A D H X S+ 0 0 75 -4,-2.3 4,-1.3 2,-0.2 -2,-0.2 0.884 110.1 52.6 -58.4 -43.5 3.6 30.5 2.6 21 21 A L H < S+ 0 0 1 -4,-2.5 4,-0.4 2,-0.2 3,-0.4 0.932 112.0 44.6 -59.5 -49.5 1.3 29.1 5.3 22 22 A R H >< S+ 0 0 35 -4,-2.4 3,-1.4 1,-0.2 -2,-0.2 0.912 112.4 52.4 -59.2 -45.8 1.7 32.2 7.5 23 23 A N H 3< S+ 0 0 121 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.703 101.7 60.9 -67.2 -21.9 1.3 34.5 4.5 24 24 A A T 3< S+ 0 0 40 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.569 85.4 90.7 -80.9 -11.0 -2.0 32.8 3.4 25 25 A L S < S- 0 0 6 -3,-1.4 2,-0.1 -4,-0.4 42,-0.1 -0.787 80.1-128.3 -90.4 121.1 -3.6 33.7 6.8 26 26 A P + 0 0 50 0, 0.0 12,-0.8 0, 0.0 2,-0.3 -0.387 33.6 165.8 -73.3 144.1 -5.4 37.0 6.5 27 27 A H E -F 37 0B 78 10,-0.2 10,-0.1 -2,-0.1 3,-0.1 -0.979 26.9-171.5-148.7 151.7 -4.9 39.9 9.0 28 28 A T E S+ 0 0 125 8,-0.5 2,-0.3 -2,-0.3 9,-0.1 0.555 77.9 37.7-115.0 -18.9 -5.8 43.6 9.1 29 29 A E E - 0 0 108 7,-0.5 7,-2.4 2,-0.0 2,-0.4 -0.902 62.6-147.9-124.3 158.2 -3.8 44.6 12.2 30 30 A K E -F 35 0B 116 -2,-0.3 2,-0.5 5,-0.2 3,-0.1 -0.976 12.5-153.6-115.5 140.5 -0.5 43.7 13.8 31 31 A V E > S-F 34 0B 5 3,-2.9 3,-1.5 -2,-0.4 169,-0.1 -0.978 84.2 -13.0-114.9 120.6 -0.2 43.7 17.6 32 32 A Y T 3 S- 0 0 88 -2,-0.5 -1,-0.2 1,-0.3 168,-0.0 0.886 131.9 -56.3 49.0 43.4 3.3 44.3 18.8 33 33 A N T 3 S+ 0 0 132 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.555 115.1 118.8 69.7 13.5 4.3 43.7 15.2 34 34 A I E < S-F 31 0B 8 -3,-1.5 -3,-2.9 205,-0.0 -1,-0.2 -0.941 73.3-107.4-111.2 125.9 2.7 40.2 15.2 35 35 A P E -F 30 0B 26 0, 0.0 205,-1.9 0, 0.0 2,-0.6 -0.230 30.1-140.5 -51.7 130.8 -0.1 39.5 12.7 36 36 A L E -g 240 0C 9 -7,-2.4 -8,-0.5 203,-0.2 -7,-0.5 -0.881 15.8-129.1 -99.4 116.2 -3.5 39.4 14.4 37 37 A L E -F 27 0B 1 203,-2.4 -10,-0.2 -2,-0.6 30,-0.1 -0.306 34.1 -97.5 -63.6 147.2 -5.8 36.6 13.1 38 38 A L - 0 0 36 -12,-0.8 204,-0.3 28,-0.3 3,-0.1 -0.270 17.0-129.1 -69.5 149.1 -9.3 37.8 12.2 39 39 A P S S- 0 0 46 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.905 86.8 -11.7 -59.7 -42.1 -12.3 37.4 14.5 40 40 A S - 0 0 79 26,-0.0 2,-0.3 2,-0.0 205,-0.0 -0.992 50.6-161.2-158.5 152.5 -14.3 35.7 11.7 41 41 A V - 0 0 31 -2,-0.3 2,-0.3 -3,-0.1 5,-0.1 -0.990 25.2-135.6-134.1 139.0 -14.4 35.0 7.9 42 42 A S > - 0 0 119 -2,-0.3 3,-0.6 3,-0.1 2,-0.1 -0.770 57.1 -8.6-103.1 142.2 -17.7 34.0 6.2 43 43 A G G > S- 0 0 28 -2,-0.3 3,-1.1 1,-0.2 51,-0.1 -0.434 117.4 -26.1 82.5-152.9 -18.2 31.3 3.6 44 44 A A G > S+ 0 0 58 1,-0.2 3,-1.7 2,-0.1 -1,-0.2 0.662 121.7 79.6 -72.4 -18.5 -15.6 29.2 1.9 45 45 A G G < S+ 0 0 55 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.595 77.1 74.6 -65.6 -11.9 -13.0 31.9 2.4 46 46 A R G < S+ 0 0 44 -3,-1.1 20,-3.3 -5,-0.1 2,-0.5 0.684 88.8 70.6 -70.9 -19.8 -12.6 30.8 6.0 47 47 A Y E < - B 0 65A 18 -3,-1.7 2,-0.4 18,-0.2 18,-0.2 -0.892 63.0-158.4-117.1 122.4 -10.6 27.7 4.9 48 48 A L E - B 0 64A 13 16,-3.0 16,-2.8 -2,-0.5 2,-0.6 -0.755 16.7-140.3 -88.4 138.8 -7.1 27.4 3.5 49 49 A L E - B 0 63A 42 -2,-0.4 -47,-1.9 14,-0.2 2,-0.6 -0.907 12.2-162.2-102.4 120.5 -6.2 24.3 1.5 50 50 A M E -aB 2 62A 1 12,-2.8 12,-2.8 -2,-0.6 2,-0.7 -0.911 6.4-153.0 -99.6 122.5 -2.8 22.9 2.1 51 51 A H E -aB 3 61A 43 -49,-3.1 -47,-2.4 -2,-0.6 2,-0.5 -0.864 17.7-175.1 -96.8 111.1 -1.6 20.5 -0.6 52 52 A L E -aB 4 60A 0 8,-2.6 8,-2.1 -2,-0.7 2,-0.5 -0.913 7.6-163.6-112.3 132.8 0.9 18.0 0.9 53 53 A F E -aB 5 59A 42 -49,-2.4 -47,-2.7 -2,-0.5 -46,-0.2 -0.959 11.7-140.4-118.1 125.2 2.8 15.5 -1.1 54 54 A N > - 0 0 4 4,-2.5 3,-2.5 -2,-0.5 -47,-0.4 -0.208 42.6 -88.0 -70.7 172.1 4.6 12.5 0.4 55 55 A Y T 3 S+ 0 0 140 1,-0.3 -1,-0.1 -49,-0.2 78,-0.0 0.822 130.1 53.0 -52.2 -36.7 8.0 11.3 -1.0 56 56 A D T 3 S- 0 0 127 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.452 121.2-106.9 -81.6 -1.7 6.3 9.1 -3.6 57 57 A G S < S+ 0 0 42 -3,-2.5 -2,-0.1 1,-0.3 2,-0.1 0.474 71.7 142.3 90.3 2.2 4.2 12.1 -4.8 58 58 A N - 0 0 83 -5,-0.0 -4,-2.5 1,-0.0 2,-0.3 -0.468 37.9-144.9 -69.8 150.3 0.9 10.9 -3.4 59 59 A T E -B 53 0A 53 -6,-0.2 18,-0.6 -2,-0.1 2,-0.3 -0.909 26.6-175.0-131.7 146.3 -1.2 13.8 -2.0 60 60 A I E -BC 52 76A 0 -8,-2.1 -8,-2.6 -2,-0.3 2,-0.5 -0.967 20.1-142.8-124.0 149.1 -3.7 14.9 0.7 61 61 A T E -BC 51 75A 19 14,-1.9 14,-2.7 -2,-0.3 2,-0.5 -0.970 17.9-157.5-109.7 124.0 -5.4 18.3 0.8 62 62 A V E -BC 50 74A 0 -12,-2.8 -12,-2.8 -2,-0.5 2,-0.5 -0.875 7.2-142.0-107.2 129.7 -5.8 19.6 4.3 63 63 A A E -BC 49 73A 0 10,-2.8 9,-2.1 -2,-0.5 10,-1.0 -0.804 20.2-172.3 -93.8 124.7 -8.4 22.2 5.3 64 64 A V E -BC 48 71A 1 -16,-2.8 -16,-3.0 -2,-0.5 2,-0.5 -0.968 26.2-126.6-122.1 127.0 -7.3 24.8 7.8 65 65 A D E >> -B 47 0A 5 5,-3.6 4,-2.1 -2,-0.4 3,-1.2 -0.619 20.0-150.5 -70.3 118.1 -9.5 27.4 9.5 66 66 A V T 34 S+ 0 0 5 -20,-3.3 -28,-0.3 -2,-0.5 -1,-0.1 0.595 89.1 61.5 -73.1 -10.9 -7.7 30.7 8.7 67 67 A T T 34 S+ 0 0 0 -21,-0.3 175,-0.5 -30,-0.1 -1,-0.2 0.661 126.8 8.7 -85.9 -18.0 -8.9 32.4 11.9 68 68 A N T <4 S- 0 0 17 -3,-1.2 -2,-0.2 2,-0.1 3,-0.1 0.397 94.7-115.8-143.3 -1.0 -7.2 30.0 14.3 69 69 A V < + 0 0 0 -4,-2.1 -3,-0.1 1,-0.2 90,-0.1 0.229 61.3 155.0 77.3 -3.7 -5.0 27.7 12.2 70 70 A Y - 0 0 100 -5,-0.3 -5,-3.6 -6,-0.2 2,-0.6 -0.233 42.0-138.4 -69.3 127.1 -7.1 24.8 13.2 71 71 A I E +C 64 0A 10 -7,-0.3 -7,-0.3 1,-0.2 -1,-0.1 -0.732 22.9 179.1 -81.8 117.8 -7.1 21.9 10.7 72 72 A M E - 0 0 4 -9,-2.1 11,-2.3 -2,-0.6 2,-0.3 0.799 55.9 -37.1 -91.2 -33.1 -10.7 20.7 10.4 73 73 A G E -CD 63 82A 0 -10,-1.0 -10,-2.8 9,-0.2 2,-0.3 -0.953 51.9-133.2-173.8-175.4 -10.3 17.8 7.9 74 74 A Y E -CD 62 81A 2 7,-2.2 7,-2.6 -2,-0.3 2,-0.5 -0.978 13.5-123.8-156.1 161.1 -8.6 16.6 4.8 75 75 A L E -CD 61 80A 36 -14,-2.7 -14,-1.9 -2,-0.3 2,-0.5 -0.959 18.7-175.7-114.7 128.8 -9.1 14.9 1.4 76 76 A A E > -CD 60 79A 3 3,-2.9 3,-2.3 -2,-0.5 2,-0.6 -0.975 66.9 -51.9-126.4 115.9 -7.4 11.7 0.4 77 77 A L T 3 S- 0 0 151 -18,-0.6 63,-0.0 -2,-0.5 -2,-0.0 -0.455 123.5 -21.0 50.1-103.1 -8.1 10.6 -3.2 78 78 A T T 3 S+ 0 0 57 -2,-0.6 22,-1.7 21,-0.1 23,-1.3 0.271 120.8 88.2-115.9 8.3 -12.0 10.7 -3.3 79 79 A T E < -De 76 101A 11 -3,-2.3 -3,-2.9 20,-0.2 2,-0.3 -0.932 59.2-154.6-113.5 130.7 -12.7 10.4 0.5 80 80 A S E -De 75 102A 3 21,-2.4 23,-3.2 -2,-0.5 2,-0.4 -0.767 7.0-162.2 -98.4 149.2 -13.0 13.4 2.8 81 81 A Y E -De 74 103A 4 -7,-2.6 -7,-2.2 -2,-0.3 2,-0.3 -0.999 9.0-179.7-132.8 131.7 -12.3 13.1 6.6 82 82 A F E -De 73 104A 4 21,-1.9 23,-2.9 -2,-0.4 -9,-0.2 -0.967 31.6-104.3-131.6 149.2 -13.4 15.6 9.3 83 83 A F - 0 0 4 -11,-2.3 2,-1.8 -2,-0.3 25,-0.3 -0.295 38.7-108.4 -63.3 152.0 -13.0 15.8 13.0 84 84 A N S S+ 0 0 103 23,-2.9 -1,-0.1 21,-0.1 24,-0.1 -0.591 83.7 100.7 -84.9 77.0 -16.0 14.9 15.2 85 85 A E S >> S- 0 0 47 -2,-1.8 4,-2.0 23,-0.1 3,-0.6 -0.986 82.3-109.2-158.0 150.3 -16.7 18.5 16.3 86 86 A P H 3> S+ 0 0 118 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.887 115.4 54.8 -55.5 -39.4 -19.2 21.3 15.3 87 87 A A H 3> S+ 0 0 46 1,-0.2 4,-1.7 2,-0.2 -15,-0.1 0.839 110.2 47.2 -62.2 -35.6 -16.5 23.5 13.7 88 88 A A H <> S+ 0 0 0 -3,-0.6 4,-1.9 2,-0.2 -1,-0.2 0.852 109.0 52.5 -75.1 -38.0 -15.4 20.6 11.4 89 89 A D H < S+ 0 0 95 -4,-2.0 4,-0.4 2,-0.2 -2,-0.2 0.901 110.1 50.3 -62.4 -40.2 -19.0 19.7 10.4 90 90 A L H >< S+ 0 0 74 -4,-2.3 3,-1.4 -5,-0.2 4,-0.3 0.907 108.1 52.7 -60.3 -43.6 -19.4 23.4 9.5 91 91 A A H >X S+ 0 0 0 -4,-1.7 3,-2.1 1,-0.3 4,-2.0 0.861 98.1 65.4 -58.7 -37.1 -16.2 23.1 7.5 92 92 A S T 3< S+ 0 0 10 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.635 91.8 64.9 -63.7 -13.6 -17.6 20.1 5.7 93 93 A Q T <4 S+ 0 0 108 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.671 114.4 27.7 -78.9 -17.4 -20.2 22.4 4.2 94 94 A Y T <4 S+ 0 0 103 -3,-2.1 2,-0.3 -4,-0.3 3,-0.2 0.699 112.2 57.4-118.5 -29.5 -17.6 24.3 2.2 95 95 A V S < S+ 0 0 12 -4,-2.0 -1,-0.1 1,-0.2 -21,-0.1 -0.828 105.5 5.7-115.7 150.0 -14.6 22.1 1.4 96 96 A F S > S+ 0 0 23 -2,-0.3 3,-1.7 1,-0.1 -1,-0.2 0.779 71.0 151.4 56.1 33.2 -14.1 18.8 -0.4 97 97 A R T 3 + 0 0 181 1,-0.3 -1,-0.1 -3,-0.2 -2,-0.1 0.742 65.8 60.8 -66.1 -23.8 -17.8 18.8 -1.5 98 98 A S T 3 S+ 0 0 120 3,-0.0 -1,-0.3 2,-0.0 2,-0.1 0.364 76.8 121.6 -86.4 4.9 -16.9 16.8 -4.6 99 99 A A < - 0 0 21 -3,-1.7 -20,-0.2 1,-0.1 -21,-0.1 -0.446 67.1-133.1 -65.4 140.5 -15.6 13.9 -2.5 100 100 A R S S+ 0 0 210 -22,-1.7 2,-0.3 1,-0.2 -21,-0.2 0.841 86.3 9.7 -67.2 -35.2 -17.4 10.6 -3.2 101 101 A R E -e 79 0A 137 -23,-1.3 -21,-2.4 2,-0.0 2,-0.5 -0.982 66.2-143.0-142.1 156.5 -17.8 9.9 0.5 102 102 A K E -e 80 0A 100 -2,-0.3 2,-0.5 -23,-0.2 -21,-0.2 -0.983 12.0-164.6-122.4 124.0 -17.3 11.7 3.8 103 103 A I E -e 81 0A 29 -23,-3.2 -21,-1.9 -2,-0.5 2,-0.6 -0.924 11.4-147.0-106.6 126.8 -16.0 10.0 6.9 104 104 A T E -e 82 0A 70 -2,-0.5 -21,-0.2 -23,-0.2 -20,-0.1 -0.858 25.4-126.5 -88.2 120.4 -16.3 11.6 10.3 105 105 A L - 0 0 1 -23,-2.9 2,-0.8 -2,-0.6 -21,-0.1 -0.365 19.5-116.9 -62.2 145.3 -13.3 10.6 12.4 106 106 A P S S+ 0 0 80 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.116 91.9 48.9 -83.7 40.3 -14.2 9.1 15.8 107 107 A Y S S- 0 0 17 -2,-0.8 -23,-2.9 -22,-0.0 -2,-0.1 -0.958 81.6-111.2-162.6 157.5 -12.5 12.0 17.7 108 108 A S - 0 0 27 -2,-0.3 -23,-0.1 -25,-0.3 5,-0.1 -0.273 40.5-103.3 -79.1 178.9 -12.4 15.7 17.8 109 109 A G S S+ 0 0 19 -2,-0.1 -38,-0.1 4,-0.1 2,-0.1 0.438 83.1 115.3 -88.8 0.3 -9.2 17.6 16.8 110 110 A N >> - 0 0 68 1,-0.1 4,-2.9 2,-0.1 3,-1.5 -0.324 69.9-132.9 -64.8 140.0 -8.2 18.3 20.4 111 111 A Y H 3>>S+ 0 0 34 1,-0.3 4,-2.5 2,-0.2 5,-0.5 0.961 108.3 66.9 -57.5 -47.3 -5.0 16.8 21.9 112 112 A E H 345S+ 0 0 114 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.543 116.9 29.1 -51.8 -2.7 -7.0 15.8 24.9 113 113 A R H <>5S+ 0 0 120 -3,-1.5 4,-2.1 3,-0.1 -2,-0.2 0.639 115.9 54.6-126.2 -39.4 -8.7 13.5 22.4 114 114 A L H X5S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 6,-0.2 0.878 107.7 52.3 -65.9 -39.9 -6.1 12.7 19.7 115 115 A Q H X>S+ 0 0 44 -4,-2.5 5,-1.3 -5,-0.2 4,-1.2 0.864 109.7 49.8 -65.4 -37.2 -3.6 11.5 22.3 116 116 A I H 4 - 0 0 49 0, 0.0 3,-1.8 0, 0.0 4,-0.2 -0.437 38.2-114.2 -73.0 157.3 1.0 11.5 24.5 122 122 A R G > S+ 0 0 9 1,-0.3 3,-0.6 2,-0.2 64,-0.0 0.592 109.9 78.8 -76.9 -5.2 2.9 13.5 21.9 123 123 A E G 3 S+ 0 0 96 1,-0.2 -1,-0.3 57,-0.1 57,-0.1 0.737 101.7 42.0 -60.2 -24.5 5.9 13.7 24.2 124 124 A K G < S+ 0 0 132 -3,-1.8 -1,-0.2 56,-0.1 -2,-0.2 0.373 94.7 91.6-107.6 0.9 6.5 10.2 22.9 125 125 A I S < S- 0 0 16 -3,-0.6 54,-0.1 -4,-0.2 2,-0.0 -0.883 73.6-133.6-101.8 113.1 5.7 10.7 19.2 126 126 A P - 0 0 60 0, 0.0 54,-0.3 0, 0.0 2,-0.3 -0.363 25.4-166.7 -61.7 139.2 8.7 11.6 17.1 127 127 A I B +H 179 0D 0 52,-2.2 52,-2.3 50,-0.1 2,-0.3 -0.841 29.3 100.6-125.3 165.8 8.2 14.5 14.7 128 128 A G S > S- 0 0 0 -2,-0.3 4,-1.7 50,-0.2 47,-0.2 -0.897 83.2 -59.3 147.5-175.9 10.1 15.9 11.7 129 129 A L H > S+ 0 0 4 45,-2.0 4,-2.3 42,-0.5 5,-0.2 0.908 132.0 51.0 -69.5 -42.0 10.0 15.8 8.0 130 130 A P H > S+ 0 0 42 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.921 110.4 50.9 -59.2 -40.5 10.3 12.0 7.8 131 131 A A H > S+ 0 0 7 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.853 108.7 51.7 -62.2 -36.8 7.4 11.7 10.3 132 132 A L H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.900 106.8 52.6 -66.5 -42.7 5.4 14.1 8.1 133 133 A D H X S+ 0 0 41 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.922 112.5 46.4 -54.1 -46.3 6.0 11.9 5.0 134 134 A T H X S+ 0 0 81 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.889 109.7 53.6 -61.9 -44.3 4.7 9.0 7.1 135 135 A A H X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.927 108.1 49.5 -59.2 -48.3 1.7 10.9 8.3 136 136 A I H X S+ 0 0 0 -4,-2.6 4,-0.9 1,-0.2 -1,-0.2 0.940 112.2 48.3 -55.7 -50.0 0.7 11.8 4.8 137 137 A S H >< S+ 0 0 43 -4,-2.0 3,-0.6 1,-0.2 4,-0.5 0.895 111.2 50.6 -58.0 -44.6 1.0 8.1 3.7 138 138 A T H >< S+ 0 0 44 -4,-2.7 3,-1.3 1,-0.2 -1,-0.2 0.912 107.0 53.1 -59.6 -46.1 -1.0 7.0 6.8 139 139 A L H 3< S+ 0 0 2 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.670 93.6 73.5 -68.7 -15.8 -3.9 9.4 6.1 140 140 A L T << S+ 0 0 27 -4,-0.9 2,-0.5 -3,-0.6 -1,-0.3 0.777 102.8 40.5 -67.5 -28.4 -4.2 8.2 2.5 141 141 A H S < S- 0 0 147 -3,-1.3 -1,-0.2 -4,-0.5 6,-0.1 -0.960 100.3-109.4-129.2 116.6 -5.8 4.9 3.7 142 142 A Y + 0 0 97 -2,-0.5 2,-0.2 -3,-0.1 -3,-0.1 -0.072 53.8 142.8 -52.1 128.3 -8.3 5.1 6.5 143 143 A D > - 0 0 87 -4,-0.0 4,-3.1 1,-0.0 5,-0.2 -0.667 32.9-158.2-165.2 99.7 -7.2 3.7 9.9 144 144 A S H > S+ 0 0 33 1,-0.2 4,-1.5 2,-0.2 -1,-0.0 0.833 90.1 47.5 -63.2 -38.5 -8.6 5.8 12.8 145 145 A T H > S+ 0 0 87 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.948 118.0 41.7 -64.2 -49.8 -6.0 4.8 15.4 146 146 A A H > S+ 0 0 36 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.879 111.2 57.9 -64.3 -39.3 -3.1 5.3 13.1 147 147 A A H X S+ 0 0 1 -4,-3.1 4,-2.9 1,-0.2 -1,-0.2 0.834 98.4 59.6 -60.7 -36.6 -4.7 8.5 11.8 148 148 A A H X S+ 0 0 0 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.928 109.8 42.0 -58.2 -47.3 -4.7 10.0 15.3 149 149 A G H X S+ 0 0 18 -4,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.885 114.3 52.5 -65.6 -40.8 -0.9 9.7 15.6 150 150 A A H X S+ 0 0 6 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.896 109.2 49.6 -61.0 -41.8 -0.5 10.9 12.0 151 151 A L H X S+ 0 0 0 -4,-2.9 4,-3.0 2,-0.2 5,-0.2 0.865 105.6 56.0 -69.4 -36.5 -2.7 14.0 12.8 152 152 A L H X S+ 0 0 0 -4,-1.9 4,-1.5 2,-0.2 -1,-0.2 0.909 112.4 44.0 -57.6 -41.8 -0.7 14.8 15.9 153 153 A V H X S+ 0 0 9 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.916 114.6 49.2 -66.1 -45.9 2.4 14.9 13.6 154 154 A L H X S+ 0 0 0 -4,-2.6 4,-1.1 1,-0.2 5,-0.3 0.933 110.2 49.5 -61.3 -50.0 0.6 16.9 10.9 155 155 A I H <>S+ 0 0 23 -4,-3.0 5,-2.2 1,-0.2 3,-0.4 0.903 114.9 44.2 -56.4 -46.6 -0.7 19.5 13.3 156 156 A Q H <>S+ 0 0 0 -4,-1.5 5,-0.7 -5,-0.2 -1,-0.2 0.838 114.0 48.4 -71.0 -36.1 2.7 20.1 14.9 157 157 A T H <5S+ 0 0 0 -4,-2.2 -1,-0.2 3,-0.2 -2,-0.2 0.550 128.1 21.3 -84.8 -9.4 4.7 20.2 11.7 158 158 A T T X5S+ 0 0 0 -4,-1.1 4,-2.1 -3,-0.4 5,-0.2 0.605 131.0 27.4-115.5 -80.9 2.3 22.6 9.9 159 159 A A H >5S+ 0 0 5 -5,-0.3 4,-1.8 -4,-0.2 -3,-0.2 0.894 123.9 46.3 -52.5 -52.5 0.1 24.7 12.2 160 160 A E H > S+ 0 0 83 71,-2.6 4,-2.3 -2,-0.5 5,-0.2 0.871 100.1 58.3 -58.5 -39.2 9.5 30.3 14.8 166 166 A Y H > S+ 0 0 42 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.882 105.9 48.0 -57.6 -42.0 11.1 28.0 17.5 167 167 A I H > S+ 0 0 0 -3,-0.3 4,-2.1 -7,-0.3 -6,-0.2 0.907 108.9 53.2 -69.8 -40.9 8.8 25.1 16.4 168 168 A E H X S+ 0 0 19 -4,-2.0 4,-2.2 -7,-0.5 -2,-0.2 0.923 111.3 46.9 -54.0 -47.8 9.6 25.7 12.7 169 169 A Q H X S+ 0 0 87 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.853 107.1 57.6 -63.6 -38.7 13.3 25.6 13.6 170 170 A Q H X S+ 0 0 14 -4,-2.0 4,-0.7 2,-0.2 -1,-0.2 0.904 110.3 43.8 -55.2 -45.3 12.7 22.4 15.6 171 171 A I H < S+ 0 0 0 -4,-2.1 3,-0.5 2,-0.2 -42,-0.5 0.864 108.9 56.5 -71.9 -37.8 11.3 20.7 12.5 172 172 A Q H >< S+ 0 0 51 -4,-2.2 3,-1.1 1,-0.3 -1,-0.2 0.868 105.5 52.5 -60.0 -36.9 14.1 22.1 10.3 173 173 A E H 3< S+ 0 0 146 -4,-2.1 3,-0.3 1,-0.3 -1,-0.3 0.745 108.8 52.0 -67.1 -24.8 16.5 20.3 12.7 174 174 A R T 3< S+ 0 0 4 -4,-0.7 -45,-2.0 -3,-0.5 -1,-0.3 -0.115 72.5 122.0-102.2 33.2 14.5 17.2 12.1 175 175 A A S < S+ 0 0 7 -3,-1.1 -1,-0.2 -47,-0.2 -2,-0.1 0.830 91.4 12.9 -65.1 -33.8 14.7 17.4 8.3 176 176 A Y S S+ 0 0 166 -3,-0.3 2,-0.3 1,-0.3 -1,-0.2 0.318 130.4 46.5-128.6 3.0 16.3 13.9 8.0 177 177 A R S S- 0 0 181 -4,-0.1 -1,-0.3 -50,-0.1 -48,-0.1 -0.921 74.8-134.2-150.6 121.1 15.9 12.4 11.4 178 178 A D + 0 0 53 -2,-0.3 2,-0.3 -50,-0.1 -50,-0.2 -0.407 26.8 174.1 -70.5 148.8 12.7 12.3 13.6 179 179 A E B -H 127 0D 98 -52,-2.3 -52,-2.2 -54,-0.1 3,-0.1 -0.963 38.3 -99.0-152.4 143.4 12.9 13.2 17.2 180 180 A V - 0 0 55 -2,-0.3 -57,-0.1 -54,-0.3 -56,-0.1 -0.258 56.7 -91.5 -54.4 147.0 10.2 13.7 19.9 181 181 A P - 0 0 9 0, 0.0 -1,-0.1 0, 0.0 -56,-0.0 -0.337 42.9-107.1 -64.5 146.8 9.4 17.4 20.5 182 182 A S > - 0 0 31 1,-0.1 4,-1.9 -3,-0.1 3,-0.2 -0.278 28.9-110.2 -63.7 158.1 11.3 19.3 23.1 183 183 A S H > S+ 0 0 75 1,-0.2 4,-2.5 2,-0.2 33,-0.2 0.859 122.2 57.6 -57.1 -36.7 9.5 20.2 26.4 184 184 A A H > S+ 0 0 6 33,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.889 103.2 52.4 -60.2 -43.2 9.7 23.8 25.2 185 185 A T H > S+ 0 0 0 2,-0.2 4,-2.2 -3,-0.2 -2,-0.2 0.942 111.0 45.9 -57.9 -51.4 7.8 22.8 22.0 186 186 A I H X S+ 0 0 11 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.903 111.7 53.6 -56.9 -44.9 5.0 21.2 24.0 187 187 A S H X S+ 0 0 14 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.908 109.3 47.0 -57.5 -47.6 4.9 24.2 26.3 188 188 A L H X S+ 0 0 8 -4,-2.4 4,-0.7 2,-0.2 3,-0.3 0.902 110.3 52.6 -63.6 -44.1 4.5 26.7 23.4 189 189 A E H >< S+ 0 0 10 -4,-2.2 3,-0.9 1,-0.2 4,-0.3 0.929 112.3 45.6 -55.9 -47.8 1.8 24.6 21.8 190 190 A N H 3< S+ 0 0 104 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.718 115.7 47.6 -68.2 -22.5 -0.2 24.5 25.0 191 191 A S H 3X S+ 0 0 17 -4,-1.2 4,-3.6 -3,-0.3 5,-0.3 0.396 78.3 101.4-102.6 2.0 0.3 28.2 25.6 192 192 A W H S+ 0 0 41 -4,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.917 117.5 49.7 -63.0 -44.8 -4.1 30.8 23.1 194 194 A G H > S+ 0 0 32 -4,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.935 113.7 44.5 -57.4 -51.4 -2.8 32.1 26.5 195 195 A L H X S+ 0 0 1 -4,-3.6 4,-2.4 2,-0.2 5,-0.2 0.897 111.8 53.2 -61.1 -44.4 0.1 34.0 24.9 196 196 A S H X S+ 0 0 0 -4,-2.6 4,-1.5 -5,-0.3 -1,-0.2 0.913 111.3 47.1 -56.2 -46.2 -2.2 35.4 22.1 197 197 A K H X S+ 0 0 85 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.948 113.6 46.3 -60.1 -51.9 -4.6 36.7 24.8 198 198 A Q H X S+ 0 0 14 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.809 109.0 53.8 -67.5 -33.8 -1.9 38.3 27.0 199 199 A I H < S+ 0 0 0 -4,-2.4 4,-0.5 2,-0.2 -1,-0.2 0.875 113.3 45.7 -65.2 -37.2 -0.1 40.0 24.1 200 200 A Q H >< S+ 0 0 8 -4,-1.5 3,-0.7 -5,-0.2 4,-0.3 0.843 110.5 51.3 -73.2 -36.1 -3.5 41.5 23.2 201 201 A L H >< S+ 0 0 60 -4,-2.3 3,-0.8 1,-0.2 -2,-0.2 0.760 101.7 65.4 -71.2 -22.7 -4.3 42.5 26.8 202 202 A A G ><>S+ 0 0 0 -4,-1.4 5,-2.6 1,-0.2 3,-1.6 0.718 80.7 78.0 -69.6 -24.6 -0.9 44.2 26.9 203 203 A Q G < 5S+ 0 0 104 -3,-0.7 3,-0.2 -4,-0.5 -1,-0.2 0.796 107.3 30.5 -59.2 -30.0 -1.9 46.8 24.2 204 204 A G G < 5S+ 0 0 68 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.171 115.7 63.2-109.3 16.1 -3.8 48.8 26.9 205 205 A N T X 5S- 0 0 35 -3,-1.6 3,-1.7 3,-0.1 -2,-0.2 -0.076 116.8 -96.0-132.8 31.5 -1.5 47.8 29.8 206 206 A N T 3 5S- 0 0 162 1,-0.3 -3,-0.2 -3,-0.2 3,-0.1 0.764 82.4 -57.0 58.4 30.8 1.9 49.3 28.8 207 207 A G T 3 - 0 0 57 4,-3.6 3,-1.7 -2,-0.4 -33,-0.2 -0.276 27.0 -92.5 -89.9 180.0 12.6 27.0 28.0 218 218 A S T 3 S+ 0 0 91 1,-0.3 -35,-0.1 2,-0.2 -34,-0.1 0.771 124.8 53.5 -64.1 -32.0 15.2 25.4 25.6 219 219 A K T 3 S- 0 0 181 2,-0.1 -1,-0.3 -35,-0.0 -3,-0.0 0.374 126.5-101.2 -83.6 2.7 17.5 24.3 28.4 220 220 A G S < S+ 0 0 45 -3,-1.7 2,-0.4 1,-0.3 -2,-0.2 0.565 78.7 138.6 89.5 12.7 14.4 22.6 30.0 221 221 A N - 0 0 97 -5,-0.0 -4,-3.6 1,-0.0 2,-0.4 -0.747 53.8-122.1-100.0 138.0 13.8 25.3 32.6 222 222 A R E -J 216 0F 154 -2,-0.4 2,-0.3 -6,-0.3 -6,-0.3 -0.613 37.0-178.9 -82.2 126.3 10.4 26.7 33.6 223 223 A V E -J 215 0F 56 -8,-4.2 -8,-3.2 -2,-0.4 2,-0.5 -0.916 26.1-127.5-132.2 148.5 10.0 30.4 33.1 224 224 A Q E -J 214 0F 96 -2,-0.3 2,-0.6 -10,-0.2 -10,-0.2 -0.831 14.6-155.8 -94.3 129.5 7.4 33.2 33.6 225 225 A I E +J 213 0F 8 -12,-3.1 -12,-2.4 -2,-0.5 3,-0.1 -0.940 25.7 159.2-103.7 119.5 6.5 35.5 30.7 226 226 A T E + 0 0 58 -2,-0.6 -17,-2.9 -14,-0.2 2,-0.3 0.567 55.2 19.7-119.2 -17.1 5.2 38.8 32.1 227 227 A N E > S-J 208 0F 48 -19,-0.3 3,-1.6 -17,-0.0 -19,-0.2 -0.969 78.3 -97.3-155.2 168.1 5.6 41.4 29.3 228 228 A V T 3 S+ 0 0 21 -21,-2.6 -20,-0.1 -2,-0.3 -21,-0.1 0.514 107.3 74.6 -69.6 -8.0 6.1 42.0 25.5 229 229 A T T 3 S+ 0 0 107 -22,-0.2 -1,-0.3 4,-0.1 -21,-0.1 0.561 72.0 112.8 -81.2 -8.7 9.9 42.4 25.8 230 230 A S S X> S- 0 0 26 -3,-1.6 4,-2.4 1,-0.1 3,-1.0 -0.327 79.9-120.9 -61.5 144.7 10.2 38.6 26.2 231 231 A N H 3>>S+ 0 0 122 1,-0.3 4,-2.3 2,-0.2 5,-1.6 0.780 112.1 64.4 -57.9 -29.9 11.9 36.7 23.4 232 232 A V H 34>S+ 0 0 20 3,-0.2 5,-2.8 1,-0.2 -1,-0.3 0.865 112.4 34.8 -61.6 -36.7 8.8 34.6 23.0 233 233 A V H <45S+ 0 0 5 -3,-1.0 -2,-0.2 -6,-0.2 -1,-0.2 0.887 123.1 42.2 -84.0 -44.4 6.9 37.8 21.9 234 234 A T H <5S+ 0 0 90 -4,-2.4 -3,-0.2 1,-0.1 -2,-0.2 0.789 135.5 7.2 -76.6 -28.8 9.7 39.7 20.1 235 235 A S T <5S+ 0 0 62 -4,-2.3 -3,-0.2 -5,-0.2 -70,-0.1 0.703 124.9 45.3-124.4 -34.0 11.2 36.7 18.1 236 236 A N T - 0 0 7 -175,-0.5 3,-2.2 -2,-0.4 -45,-0.1 -0.400 15.0-129.5 -61.7 134.4 -7.9 36.9 18.3 243 243 A T G > S+ 0 0 46 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.716 106.3 71.8 -61.2 -23.0 -9.3 37.4 21.8 244 244 A K G 3 S+ 0 0 158 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.782 101.5 45.6 -57.2 -29.1 -12.8 37.3 20.3 245 245 A N G < 0 0 64 -3,-2.2 -1,-0.3 -178,-0.1 -2,-0.2 0.212 360.0 360.0-100.7 12.7 -12.1 33.6 19.8 246 246 A I < 0 0 92 -3,-1.6 -2,-0.2 -5,-0.1 -3,-0.1 0.721 360.0 360.0-113.6 360.0 -10.7 33.1 23.3