==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-JAN-03 1NLI . COMPND 2 MOLECULE: RIBOSOME-INACTIVATING PROTEIN ALPHA- . SOURCE 2 ORGANISM_SCIENTIFIC: TRICHOSANTHES KIRILOWII; . AUTHOR P.C.SHAW,K.B.WONG,D.S.B.CHAN,R.L.WILLIAMS . 248 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11475.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 14.5 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 . 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 . 14 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 29.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.0 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 2 1 1 0 2 1 0 0 2 1 1 0 0 0 0 0 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 0 A M 0 0 150 0, 0.0 2,-0.1 0, 0.0 24,-0.0 0.000 360.0 360.0 360.0 129.8 16.5 47.1 8.8 2 1 A D - 0 0 92 47,-0.1 2,-0.3 49,-0.1 49,-0.2 -0.365 360.0-166.1 -81.8 154.5 16.1 47.8 5.1 3 2 A V E -a 51 0A 11 47,-2.7 49,-3.3 -2,-0.1 2,-0.3 -0.938 3.9-162.3-136.4 156.8 17.8 45.9 2.3 4 3 A S E -a 52 0A 69 -2,-0.3 2,-0.3 47,-0.2 49,-0.2 -0.972 12.6-170.8-145.5 157.2 18.3 46.7 -1.5 5 4 A F E -a 53 0A 6 47,-2.2 49,-1.8 -2,-0.3 2,-0.5 -0.970 10.5-157.3-147.2 131.2 19.0 45.2 -4.8 6 5 A R E -a 54 0A 143 -2,-0.3 49,-0.2 47,-0.2 50,-0.1 -0.967 6.5-161.0-111.9 124.9 19.8 47.0 -8.0 7 6 A L S > S+ 0 0 0 47,-3.2 3,-1.8 -2,-0.5 2,-0.4 0.801 70.4 90.5 -73.8 -27.2 19.3 45.3 -11.3 8 7 A S T 3 S+ 0 0 87 47,-0.4 -2,-0.1 46,-0.3 46,-0.0 -0.559 108.4 5.2 -73.9 120.0 21.6 47.7 -13.3 9 8 A G T 3 S+ 0 0 70 -2,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.497 97.0 162.2 83.9 4.5 25.0 46.1 -13.1 10 9 A A < + 0 0 16 -3,-1.8 2,-0.3 166,-0.1 -1,-0.2 -0.240 13.6 179.0 -63.1 145.0 23.6 42.9 -11.4 11 10 A T > - 0 0 67 1,-0.1 4,-1.8 119,-0.0 5,-0.2 -0.840 46.9-100.7-131.8 168.7 25.6 39.7 -11.3 12 11 A S H > S+ 0 0 62 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.918 125.7 51.8 -58.5 -33.1 24.9 36.3 -9.7 13 12 A S H > S+ 0 0 89 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.906 105.8 50.8 -70.1 -41.7 27.3 37.4 -6.9 14 13 A S H > S+ 0 0 39 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.838 110.4 51.7 -69.9 -27.1 25.5 40.8 -6.2 15 14 A Y H X S+ 0 0 2 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.905 107.1 52.5 -69.5 -42.8 22.2 38.8 -6.0 16 15 A G H X S+ 0 0 15 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.880 108.5 50.1 -56.0 -45.5 23.9 36.5 -3.5 17 16 A V H X S+ 0 0 85 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.949 110.4 51.1 -59.3 -44.4 24.9 39.5 -1.5 18 17 A F H X S+ 0 0 3 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.913 111.0 46.7 -59.2 -49.2 21.3 40.8 -1.6 19 18 A I H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.894 112.0 50.3 -64.9 -37.3 19.8 37.5 -0.4 20 19 A S H X S+ 0 0 50 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.862 111.5 49.9 -62.7 -43.0 22.4 37.2 2.5 21 20 A N H X S+ 0 0 63 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.883 109.0 51.1 -62.7 -42.1 21.5 40.8 3.5 22 21 A L H >< S+ 0 0 2 -4,-2.3 3,-0.9 -5,-0.2 4,-0.4 0.963 110.0 49.1 -59.3 -49.1 17.8 39.9 3.4 23 22 A R H >< S+ 0 0 41 -4,-2.5 3,-1.8 1,-0.2 -2,-0.2 0.929 109.4 53.9 -54.1 -43.8 18.4 36.9 5.7 24 23 A K H 3< S+ 0 0 147 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.690 99.0 62.9 -64.7 -24.1 20.5 39.1 8.0 25 24 A A T << S+ 0 0 9 -4,-1.2 -1,-0.3 -3,-0.9 -2,-0.2 0.541 86.4 89.4 -74.4 -11.3 17.6 41.6 8.3 26 25 A L S < S- 0 0 6 -3,-1.8 42,-0.1 -4,-0.4 40,-0.0 -0.817 79.6-128.5 -95.9 121.3 15.4 38.9 9.9 27 26 A P + 0 0 47 0, 0.0 12,-0.7 0, 0.0 2,-0.3 -0.268 32.7 167.5 -68.5 147.2 15.6 38.7 13.7 28 27 A N E -F 38 0B 62 10,-0.2 10,-0.1 1,-0.1 3,-0.1 -0.940 27.5-165.5-151.8 139.0 16.3 35.4 15.4 29 28 A E E S+ 0 0 150 8,-0.5 2,-0.3 -2,-0.3 9,-0.1 0.779 78.6 23.4 -88.3 -32.4 17.3 34.5 19.0 30 29 A R E - 0 0 124 7,-0.5 7,-2.4 5,-0.0 2,-0.4 -0.825 60.2-142.7-128.4 164.7 18.3 30.9 18.2 31 30 A K E -F 36 0B 118 -2,-0.3 2,-0.5 5,-0.3 209,-0.0 -0.939 12.9-155.4-115.7 144.6 19.6 28.5 15.5 32 31 A L E > S-F 35 0B 16 3,-2.3 3,-1.9 -2,-0.4 169,-0.1 -0.998 85.1 -12.0-120.6 126.4 18.4 24.9 15.3 33 32 A Y T 3 S- 0 0 94 -2,-0.5 -1,-0.1 1,-0.3 167,-0.0 0.825 131.5 -55.6 47.1 41.6 20.8 22.7 13.5 34 33 A D T 3 S+ 0 0 132 1,-0.2 -1,-0.3 205,-0.0 -3,-0.0 0.684 114.2 116.9 67.8 20.1 22.6 25.9 12.3 35 34 A I E < S-F 32 0B 7 -3,-1.9 -3,-2.3 205,-0.0 -1,-0.2 -0.980 71.6-110.8-116.0 125.3 19.5 27.4 10.7 36 35 A P E -F 31 0B 25 0, 0.0 205,-2.4 0, 0.0 2,-0.6 -0.316 24.0-143.8 -54.0 132.3 18.0 30.6 12.1 37 36 A L E -g 241 0C 7 -7,-2.4 -8,-0.5 203,-0.2 -7,-0.5 -0.880 20.7-131.4 -94.8 119.9 14.6 30.2 13.9 38 37 A L E -F 28 0B 1 203,-2.9 -10,-0.2 -2,-0.6 30,-0.1 -0.283 28.2 -93.8 -72.1 157.9 12.4 33.2 13.1 39 38 A R - 0 0 72 -12,-0.7 204,-0.3 28,-0.3 3,-0.1 -0.324 20.8-141.5 -70.5 148.8 10.6 35.0 15.9 40 39 A S S S+ 0 0 47 1,-0.3 2,-0.3 -3,-0.1 -1,-0.1 0.893 82.2 2.1 -76.3 -37.8 7.1 34.0 16.8 41 40 A S - 0 0 83 27,-0.0 -1,-0.3 -3,-0.0 205,-0.0 -0.995 62.3-173.1-154.7 139.8 5.9 37.5 17.4 42 41 A L - 0 0 5 -2,-0.3 5,-0.1 -3,-0.1 26,-0.1 -0.990 33.3-103.2-135.4 144.2 7.3 41.1 17.2 43 42 A P >> - 0 0 73 0, 0.0 3,-1.8 0, 0.0 4,-0.9 -0.252 43.2-106.1 -53.2 154.9 6.0 44.5 18.2 44 43 A G H >> S+ 0 0 8 1,-0.3 3,-0.8 2,-0.2 4,-0.5 0.857 119.9 56.8 -53.9 -38.8 4.8 46.6 15.3 45 44 A S H 34 S+ 0 0 110 1,-0.3 -1,-0.3 2,-0.1 0, 0.0 0.613 117.0 35.6 -73.1 -14.8 7.8 48.8 15.3 46 45 A Q H <4 S+ 0 0 113 -3,-1.8 -1,-0.3 1,-0.0 -2,-0.2 0.425 100.8 80.3-105.0 -8.8 10.2 45.8 15.0 47 46 A R H << S+ 0 0 45 -4,-0.9 20,-2.6 -3,-0.8 21,-0.4 0.652 83.0 59.2 -89.0 -15.1 8.0 43.6 12.7 48 47 A Y E < - B 0 66A 29 -4,-0.5 2,-0.3 18,-0.2 18,-0.2 -0.849 49.7-178.5-122.6 150.5 8.6 45.0 9.2 49 48 A A E - B 0 65A 4 16,-2.1 16,-2.5 -2,-0.3 2,-0.4 -0.952 21.5-130.3-137.0 154.9 11.5 45.7 6.9 50 49 A L E - B 0 64A 35 -2,-0.3 -47,-2.7 14,-0.2 2,-0.6 -0.928 7.9-158.8-107.0 136.7 11.7 47.3 3.4 51 50 A I E -aB 3 63A 1 12,-2.4 12,-2.8 -2,-0.4 2,-0.6 -0.954 14.6-152.2-109.1 118.7 13.4 45.7 0.4 52 51 A H E -aB 4 62A 50 -49,-3.3 -47,-2.2 -2,-0.6 2,-0.5 -0.862 13.9-171.2 -95.3 122.0 14.2 48.5 -2.1 53 52 A L E -aB 5 61A 0 8,-3.2 8,-2.6 -2,-0.6 2,-0.4 -0.964 7.3-172.0-119.2 132.5 14.3 47.2 -5.7 54 53 A T E -aB 6 60A 9 -49,-1.8 -47,-3.2 -2,-0.5 -46,-0.3 -0.977 14.9-145.7-122.5 125.7 15.6 49.2 -8.7 55 54 A N > - 0 0 1 4,-2.5 3,-2.1 -2,-0.4 -47,-0.4 -0.195 36.6 -87.0 -81.5 178.9 15.2 47.9 -12.3 56 55 A Y T 3 S+ 0 0 98 1,-0.3 -1,-0.1 -49,-0.2 79,-0.0 0.825 128.1 54.4 -53.8 -31.7 17.4 48.3 -15.3 57 56 A A T 3 S- 0 0 63 2,-0.1 -1,-0.3 77,-0.1 3,-0.1 0.229 120.6-106.9 -92.0 14.7 15.7 51.5 -16.2 58 57 A D S < S+ 0 0 113 -3,-2.1 2,-0.4 1,-0.2 -2,-0.1 0.779 72.2 143.1 65.3 28.7 16.4 53.0 -12.7 59 58 A E - 0 0 38 18,-0.0 -4,-2.5 2,-0.0 2,-0.4 -0.871 34.7-153.9 -98.6 134.3 12.8 52.7 -11.6 60 59 A T E -B 54 0A 56 -2,-0.4 18,-0.4 -6,-0.2 2,-0.3 -0.870 18.7-179.8-117.8 141.9 12.4 51.8 -7.9 61 60 A I E -B 53 0A 1 -8,-2.6 -8,-3.2 -2,-0.4 2,-0.4 -0.921 19.8-140.5-124.6 158.7 9.8 50.1 -5.7 62 61 A S E -BC 52 76A 22 14,-1.8 14,-2.4 -2,-0.3 2,-0.5 -0.982 14.7-157.8-117.3 131.4 9.9 49.4 -2.0 63 62 A V E -BC 51 75A 0 -12,-2.8 -12,-2.4 -2,-0.4 2,-0.4 -0.955 7.4-144.5-116.7 122.0 8.5 46.0 -0.8 64 63 A A E -BC 50 74A 0 10,-2.2 9,-2.9 -2,-0.5 10,-1.1 -0.748 19.5-175.8 -87.2 132.3 7.3 45.5 2.8 65 64 A I E -BC 49 72A 0 -16,-2.5 -16,-2.1 -2,-0.4 2,-0.6 -0.942 29.9-125.8-124.2 149.2 7.9 42.2 4.5 66 65 A D E >>> -BC 48 71A 14 5,-2.0 4,-2.1 -2,-0.4 3,-1.0 -0.841 22.4-150.1 -85.6 117.1 6.9 40.9 7.9 67 66 A V T 345S+ 0 0 3 -20,-2.6 -28,-0.3 -2,-0.6 -19,-0.1 0.567 88.5 67.4 -76.1 -7.2 10.3 39.7 9.3 68 67 A T T 345S+ 0 0 5 -21,-0.4 175,-0.5 -30,-0.1 -1,-0.2 0.745 125.9 6.3 -77.0 -24.7 8.7 36.9 11.4 69 68 A N T <45S- 0 0 25 -3,-1.0 -2,-0.2 2,-0.1 3,-0.1 0.438 93.6-118.8-139.6 5.3 7.7 35.0 8.3 70 69 A V T <5 + 0 0 0 -4,-2.1 2,-0.3 1,-0.2 -3,-0.2 0.585 58.1 157.1 63.1 14.0 9.2 36.8 5.3 71 70 A Y E < -C 66 0A 104 -5,-0.6 -5,-2.0 1,-0.1 2,-0.4 -0.536 45.5-123.3 -75.4 130.1 5.7 37.4 3.9 72 71 A I E -C 65 0A 6 -2,-0.3 -7,-0.2 -7,-0.2 3,-0.1 -0.642 26.2-177.1 -65.6 123.6 5.3 40.3 1.4 73 72 A M E - 0 0 1 -9,-2.9 11,-2.2 -2,-0.4 2,-0.3 0.719 57.2 -67.6 -90.4 -32.5 2.6 42.6 2.8 74 73 A G E -CD 64 83A 0 -10,-1.1 -10,-2.2 9,-0.2 -1,-0.4 -0.975 48.0-108.5 163.3-171.2 2.7 44.9 -0.2 75 74 A Y E -CD 63 82A 0 7,-2.2 7,-2.8 -2,-0.3 2,-0.4 -0.947 11.3-132.9-152.0 163.0 4.7 47.5 -2.0 76 75 A R E -CD 62 81A 48 -14,-2.4 -14,-1.8 -2,-0.3 2,-0.4 -0.974 13.2-177.6-120.3 140.7 5.1 51.2 -2.8 77 76 A A E > - D 0 80A 9 3,-2.6 3,-1.9 -2,-0.4 2,-0.3 -0.945 65.8 -52.8-135.6 111.5 5.7 52.9 -6.2 78 77 A G T 3 S- 0 0 51 -18,-0.4 63,-0.0 -2,-0.4 -17,-0.0 -0.438 123.1 -12.7 62.6-121.8 6.0 56.6 -6.0 79 78 A D T 3 S+ 0 0 93 -2,-0.3 23,-2.0 21,-0.1 22,-1.0 0.246 121.4 83.1 -97.1 3.8 3.0 58.1 -4.2 80 79 A T E < -De 77 102A 26 -3,-1.9 -3,-2.6 21,-0.2 2,-0.3 -0.952 57.7-159.5-116.9 136.2 0.9 54.9 -4.2 81 80 A S E -De 76 103A 4 21,-2.2 23,-3.3 -2,-0.4 2,-0.4 -0.813 3.9-159.8-107.9 147.8 0.9 51.9 -1.9 82 81 A Y E -De 75 104A 21 -7,-2.8 -7,-2.2 -2,-0.3 2,-0.4 -0.999 12.5-178.2-127.6 121.7 -0.5 48.4 -2.8 83 82 A F E -De 74 105A 6 21,-2.0 23,-2.8 -2,-0.4 -9,-0.2 -0.960 30.1-109.7-121.5 144.0 -1.4 46.0 0.0 84 83 A F - 0 0 2 -11,-2.2 2,-1.4 -2,-0.4 25,-0.3 -0.333 36.8-109.3 -57.7 149.6 -2.7 42.5 -0.2 85 84 A N S S+ 0 0 96 23,-2.7 2,-0.3 4,-0.1 -1,-0.1 -0.734 80.8 97.6 -89.6 89.3 -6.3 42.0 1.0 86 85 A E S > S- 0 0 42 -2,-1.4 4,-2.0 23,-0.1 3,-0.5 -0.949 84.2 -99.5-169.2 160.9 -5.7 40.1 4.2 87 86 A A H > S+ 0 0 88 -2,-0.3 4,-2.3 1,-0.3 5,-0.2 0.855 116.4 53.1 -56.6 -47.9 -5.4 40.8 7.9 88 87 A S H > S+ 0 0 48 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.863 111.0 46.7 -56.3 -42.1 -1.6 40.8 8.1 89 88 A A H > S+ 0 0 0 -3,-0.5 4,-2.3 2,-0.2 -1,-0.2 0.867 107.6 56.3 -76.0 -32.0 -1.3 43.4 5.4 90 89 A T H < S+ 0 0 87 -4,-2.0 4,-0.4 2,-0.2 -2,-0.2 0.912 111.0 45.2 -61.5 -45.1 -4.1 45.6 7.0 91 90 A E H >< S+ 0 0 64 -4,-2.3 3,-1.5 1,-0.2 4,-0.4 0.923 110.4 53.8 -62.6 -46.4 -2.0 45.7 10.1 92 91 A A H >X S+ 0 0 0 -4,-2.2 3,-2.5 1,-0.3 4,-2.4 0.875 97.7 66.2 -56.1 -36.7 1.2 46.4 8.2 93 92 A A T 3< S+ 0 0 20 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.703 93.0 59.9 -65.7 -16.0 -0.4 49.4 6.5 94 93 A K T <4 S+ 0 0 129 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.654 117.0 32.2 -79.8 -14.4 -0.6 51.1 9.9 95 94 A Y T <4 S+ 0 0 103 -3,-2.5 2,-0.3 -4,-0.4 3,-0.2 0.715 114.3 48.4-113.6 -31.2 3.2 50.9 10.0 96 95 A V S < S+ 0 0 16 -4,-2.4 -1,-0.2 1,-0.2 -32,-0.0 -0.876 108.5 12.3-116.6 154.6 4.7 51.1 6.6 97 96 A F S > S+ 0 0 20 -2,-0.3 3,-1.6 1,-0.1 -1,-0.2 0.785 73.1 157.2 61.9 33.7 4.2 53.5 3.6 98 97 A K T 3 + 0 0 150 1,-0.3 -2,-0.1 -3,-0.2 -1,-0.1 0.800 64.7 50.2 -66.6 -31.9 2.3 55.8 5.9 99 98 A D T 3 S+ 0 0 128 3,-0.0 -1,-0.3 2,-0.0 -2,-0.1 0.399 76.6 125.4 -92.1 7.2 2.8 59.0 3.8 100 99 A A < - 0 0 19 -3,-1.6 -20,-0.2 1,-0.1 -21,-0.1 -0.373 55.9-145.1 -57.0 135.0 1.7 57.5 0.5 101 100 A M S S+ 0 0 136 -22,-1.0 2,-0.4 1,-0.1 -21,-0.2 0.889 81.5 36.4 -72.1 -41.3 -1.0 59.6 -0.9 102 101 A R E -e 80 0A 177 -23,-2.0 -21,-2.2 2,-0.0 2,-0.5 -0.929 68.2-162.5-114.6 138.9 -3.1 56.9 -2.5 103 102 A K E -e 81 0A 125 -2,-0.4 2,-0.4 -23,-0.2 -21,-0.2 -0.987 3.7-167.2-124.9 121.3 -3.5 53.3 -1.1 104 103 A V E -e 82 0A 50 -23,-3.3 -21,-2.0 -2,-0.5 2,-0.6 -0.889 10.4-151.7-106.6 131.0 -4.7 50.5 -3.3 105 104 A T E -e 83 0A 69 -2,-0.4 -21,-0.2 -23,-0.2 -20,-0.1 -0.953 25.3-129.5 -99.3 117.0 -5.9 47.3 -1.6 106 105 A L - 0 0 0 -23,-2.8 2,-0.1 -2,-0.6 -21,-0.1 -0.275 18.7-114.6 -61.4 152.3 -5.2 44.5 -4.2 107 106 A P S S+ 0 0 99 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.007 91.4 43.3 -82.5 27.6 -8.2 42.1 -4.8 108 107 A Y S S- 0 0 19 -2,-0.1 -23,-2.7 -22,-0.0 -2,-0.1 -0.969 81.3-108.6-157.8 158.7 -6.5 39.1 -3.4 109 108 A S - 0 0 27 -2,-0.3 -23,-0.1 -25,-0.3 -26,-0.0 -0.260 43.8-102.9 -73.3 174.0 -4.4 37.9 -0.5 110 109 A G S S+ 0 0 7 -38,-0.1 2,-0.2 4,-0.1 -38,-0.1 0.126 78.6 128.7 -91.1 26.8 -0.8 37.0 -1.0 111 110 A N > - 0 0 74 1,-0.1 4,-2.6 4,-0.0 5,-0.2 -0.537 65.7-127.1 -80.6 139.1 -1.5 33.3 -1.0 112 111 A Y H > S+ 0 0 38 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.843 107.8 53.8 -59.3 -35.5 -0.1 31.3 -4.0 113 112 A E H > S+ 0 0 110 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.926 112.2 44.7 -68.4 -40.0 -3.5 29.7 -4.8 114 113 A R H > S+ 0 0 122 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.915 114.1 50.2 -62.2 -48.2 -5.2 33.2 -4.9 115 114 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 6,-0.2 0.891 110.0 48.8 -58.4 -45.1 -2.3 34.7 -7.0 116 115 A Q H X>S+ 0 0 23 -4,-2.4 4,-1.6 2,-0.2 5,-1.4 0.906 111.4 49.8 -66.4 -40.5 -2.2 31.9 -9.6 117 116 A T H <5S+ 0 0 109 -4,-1.7 3,-0.3 -5,-0.2 -2,-0.2 0.952 113.3 47.4 -56.1 -48.1 -6.0 32.2 -10.0 118 117 A A H <5S+ 0 0 49 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.808 115.2 45.0 -63.7 -35.1 -5.6 35.9 -10.4 119 118 A A H <5S- 0 0 23 -4,-2.2 -1,-0.2 2,-0.3 -2,-0.2 0.672 100.0-131.9 -83.2 -19.5 -2.7 35.5 -12.9 120 119 A G T <5S+ 0 0 67 -4,-1.6 2,-0.3 -3,-0.3 -3,-0.2 0.749 77.5 85.7 71.8 22.8 -4.4 32.8 -15.0 121 120 A K S - 0 0 82 -2,-0.3 3,-2.1 -3,-0.1 4,-0.4 -0.545 35.8-108.7 -85.5 156.5 0.7 28.3 -12.5 123 122 A R G > S+ 0 0 11 1,-0.3 3,-1.8 2,-0.2 -1,-0.1 0.839 115.2 63.8 -50.3 -42.8 4.1 29.1 -11.0 124 123 A E G 3 S+ 0 0 69 1,-0.3 -1,-0.3 57,-0.1 60,-0.0 0.688 104.4 47.9 -59.3 -18.9 5.9 26.5 -13.3 125 124 A N G < S+ 0 0 89 -3,-2.1 -1,-0.3 56,-0.1 -2,-0.2 0.418 92.2 91.0-104.7 7.2 4.9 28.6 -16.3 126 125 A I S < S- 0 0 2 -3,-1.8 54,-0.1 -4,-0.4 6,-0.0 -0.864 79.9-120.9-104.0 116.5 6.0 32.0 -15.0 127 126 A P - 0 0 54 0, 0.0 2,-0.2 0, 0.0 54,-0.2 -0.214 29.8-173.0 -57.2 141.2 9.6 32.9 -15.8 128 127 A L B +H 180 0D 0 52,-3.0 52,-2.3 29,-0.0 2,-0.2 -0.753 31.7 89.6-121.3-178.5 12.2 33.6 -13.1 129 128 A G S > S- 0 0 0 -2,-0.2 4,-1.7 50,-0.2 3,-0.5 -0.500 88.9 -61.8 108.4 166.1 15.7 34.9 -13.1 130 129 A L H > S+ 0 0 1 45,-2.7 4,-2.3 42,-0.7 3,-0.2 0.900 132.9 50.4 -56.1 -46.0 17.2 38.4 -12.9 131 130 A P H > S+ 0 0 27 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.836 108.7 54.7 -63.9 -27.7 15.6 39.7 -16.1 132 131 A A H > S+ 0 0 11 -3,-0.5 4,-2.5 46,-0.3 -2,-0.2 0.879 107.0 49.9 -69.0 -34.2 12.3 38.4 -14.9 133 132 A L H X S+ 0 0 0 -4,-1.7 4,-2.3 -3,-0.2 -1,-0.2 0.878 108.5 53.9 -70.4 -39.7 12.7 40.4 -11.6 134 133 A D H X S+ 0 0 22 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.963 111.1 44.6 -54.8 -54.3 13.5 43.4 -13.8 135 134 A S H X S+ 0 0 65 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.871 110.7 54.0 -61.2 -35.8 10.2 42.9 -15.7 136 135 A A H X S+ 0 0 5 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.900 108.2 50.9 -63.6 -41.9 8.2 42.3 -12.4 137 136 A I H X S+ 0 0 1 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.966 112.8 45.7 -59.3 -51.7 9.6 45.6 -11.0 138 137 A T H X S+ 0 0 45 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.916 111.9 51.5 -54.4 -48.7 8.5 47.5 -14.2 139 138 A T H < S+ 0 0 43 -4,-2.7 5,-0.3 1,-0.2 -1,-0.2 0.886 115.9 40.4 -59.2 -43.1 5.1 45.8 -14.2 140 139 A L H >< S+ 0 0 0 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.797 110.0 57.6 -76.8 -30.4 4.4 46.7 -10.6 141 140 A F H 3< S+ 0 0 58 -4,-2.5 2,-0.6 1,-0.3 -2,-0.2 0.889 115.9 37.6 -67.5 -38.7 5.9 50.2 -10.8 142 141 A Y T 3< S- 0 0 127 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.0 -0.668 105.2-146.3-102.9 64.0 3.4 50.9 -13.7 143 142 A Y < + 0 0 63 -3,-0.7 2,-0.4 -2,-0.6 -3,-0.2 0.006 25.0 177.2 -49.4 134.5 0.6 49.0 -12.0 144 143 A N >> - 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