==== 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/HYDROLASE INHIBITOR 29-OCT-04 1WB0 . COMPND 2 MOLECULE: CHITOTRIOSIDASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.V.RAO,D.R.HOUSTON,R.G.BOOT,J.M.F.G.AERTS,M.HODKINSON,D.J.A . 369 4 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14825.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 261 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 11.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 27 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 0 0 3 0 1 2 0 0 1 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 4 2 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 PARALLEL BRIDGES PER LADDER . 1 0 3 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 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 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 22 A A 0 0 91 0, 0.0 2,-0.3 0, 0.0 332,-0.3 0.000 360.0 360.0 360.0 154.1 -2.5 3.3 24.2 2 23 A K E -a 333 0A 61 330,-2.7 332,-2.3 29,-0.1 2,-0.5 -0.657 360.0-164.6 -90.9 147.8 -0.6 1.5 21.4 3 24 A L E -a 334 0A 6 -2,-0.3 29,-2.1 330,-0.2 28,-1.9 -0.926 16.6-168.6-128.8 101.6 2.7 -0.3 22.0 4 25 A V E -ab 335 32A 0 330,-3.1 332,-2.6 -2,-0.5 2,-0.5 -0.846 4.3-170.1 -98.5 119.1 4.0 -0.9 18.5 5 26 A a E -ab 336 33A 0 27,-3.1 29,-2.8 -2,-0.6 2,-0.4 -0.935 14.1-140.3-119.6 131.3 7.0 -3.2 18.3 6 27 A Y E - b 0 34A 0 330,-2.4 333,-2.9 -2,-0.5 332,-0.4 -0.700 9.5-164.6 -89.1 134.7 9.3 -4.0 15.4 7 28 A F E - b 0 35A 2 27,-2.9 29,-2.9 -2,-0.4 2,-0.4 -0.868 14.0-149.3-106.3 140.1 10.5 -7.6 14.7 8 29 A T E > - b 0 36A 1 -2,-0.4 3,-1.0 27,-0.2 4,-0.3 -0.962 8.9-145.2-116.6 135.5 13.5 -7.7 12.3 9 30 A N T 3 S+ 0 0 3 27,-2.6 28,-0.1 -2,-0.4 -1,-0.1 0.328 95.0 58.2 -83.6 9.9 14.0 -10.7 10.1 10 31 A W T > S+ 0 0 85 26,-0.2 3,-1.6 2,-0.1 -1,-0.2 0.412 80.8 84.1-110.4 -5.1 17.8 -10.7 10.2 11 32 A A G X S+ 0 0 0 -3,-1.0 9,-1.7 1,-0.3 3,-1.5 0.752 76.4 73.2 -67.9 -20.1 18.0 -11.1 14.0 12 33 A Q G 3 S+ 0 0 18 1,-0.3 -1,-0.3 -4,-0.3 7,-0.1 0.601 90.7 60.9 -65.8 -12.5 17.7 -14.9 13.4 13 34 A Y G < S+ 0 0 99 -3,-1.6 -1,-0.3 5,-0.1 -2,-0.2 0.445 78.6 104.6 -97.1 -3.3 21.3 -14.8 12.2 14 35 A R S < S- 0 0 29 -3,-1.5 2,-0.2 4,-0.2 260,-0.1 -0.414 73.7-105.5 -76.8 159.5 23.0 -13.6 15.3 15 36 A Q > - 0 0 111 258,-0.3 3,-1.7 3,-0.1 4,-0.2 -0.499 63.6 -28.2 -89.9 153.2 24.9 -16.0 17.4 16 37 A G G > S+ 0 0 57 1,-0.3 3,-1.7 2,-0.2 -2,-0.1 -0.124 127.8 1.0 52.5-132.7 24.2 -17.7 20.7 17 38 A E G 3 S+ 0 0 112 1,-0.3 -1,-0.3 330,-0.1 328,-0.1 0.716 127.9 65.5 -61.8 -21.0 21.9 -15.9 23.2 18 39 A A G < S+ 0 0 0 -3,-1.7 -1,-0.3 2,-0.1 -4,-0.2 0.682 72.9 111.5 -77.4 -17.6 21.5 -13.1 20.7 19 40 A R < - 0 0 98 -3,-1.7 2,-0.5 -4,-0.2 -7,-0.2 -0.372 53.4-160.6 -62.3 127.1 19.7 -15.2 18.1 20 41 A F + 0 0 0 -9,-1.7 -6,-0.1 -2,-0.1 320,-0.1 -0.947 15.7 168.5-116.7 123.3 16.1 -14.1 17.8 21 42 A L > - 0 0 51 -2,-0.5 3,-4.1 -10,-0.1 4,-0.3 -0.879 53.7 -98.9-126.9 156.8 13.3 -16.3 16.4 22 43 A P G > S+ 0 0 10 0, 0.0 3,-2.0 0, 0.0 -1,-0.0 0.758 120.6 72.3 -46.3 -23.0 9.5 -15.9 16.4 23 44 A K G 3 S+ 0 0 170 1,-0.3 -3,-0.0 3,-0.0 0, 0.0 0.706 90.5 58.2 -65.3 -19.5 9.7 -18.3 19.3 24 45 A D G < S+ 0 0 42 -3,-4.1 2,-0.3 2,-0.1 -1,-0.3 0.403 84.6 109.9 -90.4 2.0 11.1 -15.5 21.3 25 46 A L < - 0 0 14 -3,-2.0 3,-0.0 -4,-0.3 -18,-0.0 -0.634 61.2-146.6 -83.8 135.6 8.0 -13.4 20.6 26 47 A D >> - 0 0 44 -2,-0.3 3,-1.2 1,-0.1 4,-0.6 -0.912 5.2-152.0-101.0 115.6 5.6 -12.7 23.5 27 48 A P T 34 S+ 0 0 19 0, 0.0 -1,-0.1 0, 0.0 42,-0.1 0.730 93.9 39.7 -59.6 -25.8 2.0 -12.5 22.1 28 49 A S T 34 S+ 0 0 55 1,-0.1 -3,-0.0 41,-0.0 3,-0.0 0.355 91.3 87.5-109.0 6.3 0.9 -10.2 24.8 29 50 A L T <4 S+ 0 0 3 -3,-1.2 2,-0.2 2,-0.0 -1,-0.1 0.943 95.7 25.0 -68.9 -50.1 3.9 -7.9 25.1 30 51 A a < - 0 0 4 -4,-0.6 -26,-0.2 1,-0.1 3,-0.1 -0.714 63.6-139.7-114.1 164.6 2.9 -5.4 22.4 31 52 A T S S+ 0 0 54 -28,-1.9 39,-1.9 1,-0.3 2,-0.4 0.744 95.4 28.6 -91.9 -28.9 -0.5 -4.3 20.9 32 53 A H E -bc 4 70A 20 -29,-2.1 -27,-3.1 37,-0.2 2,-0.5 -0.998 68.1-162.5-135.2 129.2 0.9 -4.2 17.4 33 54 A L E -bc 5 71A 2 37,-2.3 39,-2.3 -2,-0.4 2,-0.5 -0.954 8.7-160.3-112.2 131.1 3.8 -6.2 16.0 34 55 A I E -bc 6 72A 0 -29,-2.8 -27,-2.9 -2,-0.5 2,-0.7 -0.946 11.1-139.8-116.2 128.4 5.4 -5.0 12.8 35 56 A Y E -bc 7 73A 0 37,-2.9 39,-2.8 -2,-0.5 2,-0.5 -0.750 24.4-128.4 -89.5 113.8 7.5 -7.3 10.6 36 57 A A E +bc 8 74A 0 -29,-2.9 -27,-2.6 -2,-0.7 -26,-0.2 -0.920 66.6 16.5-107.0 123.1 10.7 -5.6 9.2 37 58 A F E + 0 0 20 37,-0.6 11,-0.4 -2,-0.5 2,-0.3 0.616 42.4 157.1-142.7 161.6 11.1 -5.9 6.3 38 59 A A E - c 0 75A 0 36,-3.0 38,-2.3 -3,-0.2 9,-0.2 -0.675 24.9-167.6-103.9 164.2 9.4 -6.7 3.0 39 60 A G E -I 46 0B 2 7,-3.0 7,-2.0 -2,-0.3 2,-0.3 -0.406 18.2-102.9-129.2-153.3 10.8 -5.4 -0.3 40 61 A M E -I 45 0B 4 5,-0.3 2,-0.4 -2,-0.2 5,-0.2 -0.998 18.4-170.8-145.4 148.6 9.5 -5.2 -3.9 41 62 A T E > S-I 44 0B 73 3,-2.4 3,-1.5 -2,-0.3 -2,-0.0 -0.986 84.8 -10.3-138.3 120.9 10.0 -7.0 -7.1 42 63 A N T 3 S- 0 0 131 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.890 130.2 -56.6 55.7 40.9 8.5 -5.5 -10.3 43 64 A H T 3 S+ 0 0 58 1,-0.2 2,-0.4 54,-0.0 -1,-0.3 0.657 115.5 116.2 65.3 18.7 6.6 -3.0 -8.2 44 65 A Q E < S-I 41 0B 102 -3,-1.5 -3,-2.4 57,-0.1 -1,-0.2 -0.932 75.6 -99.4-119.3 143.2 5.0 -5.8 -6.2 45 66 A L E +I 40 0B 10 -2,-0.4 2,-0.3 53,-0.3 -5,-0.3 -0.312 53.6 168.2 -57.3 135.4 5.4 -6.6 -2.4 46 67 A S E -I 39 0B 21 -7,-2.0 -7,-3.0 59,-0.0 2,-0.1 -0.965 34.8 -95.4-149.5 165.2 7.9 -9.4 -1.8 47 68 A T - 0 0 40 -2,-0.3 -9,-0.1 -9,-0.2 3,-0.1 -0.356 18.6-161.0 -78.6 163.3 9.9 -11.1 0.8 48 69 A T S S+ 0 0 64 -11,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.536 72.0 55.2-120.9 -16.1 13.5 -10.3 1.6 49 70 A E S > S- 0 0 51 -12,-0.1 3,-2.1 1,-0.1 4,-0.3 -0.953 84.2-119.8-120.6 145.4 14.8 -13.4 3.5 50 71 A W T 3 S+ 0 0 200 -2,-0.4 3,-0.2 1,-0.3 -1,-0.1 0.721 111.6 39.6 -54.5 -27.4 14.6 -16.9 2.2 51 72 A N T >> S+ 0 0 23 1,-0.1 4,-2.2 2,-0.1 3,-0.6 0.164 77.4 116.5-108.8 18.2 12.4 -18.2 5.0 52 73 A D H <> S+ 0 0 0 -3,-2.1 4,-3.2 1,-0.2 5,-0.2 0.880 71.9 57.1 -53.3 -43.7 10.1 -15.2 5.5 53 74 A E H 3> S+ 0 0 80 -4,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.884 109.0 46.7 -58.6 -38.0 6.9 -17.1 4.5 54 75 A T H <> S+ 0 0 85 -3,-0.6 4,-1.7 1,-0.2 -1,-0.2 0.932 114.0 47.5 -68.6 -43.4 7.6 -19.6 7.3 55 76 A L H X S+ 0 0 9 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.862 106.6 58.6 -66.3 -34.2 8.3 -16.8 9.7 56 77 A Y H X S+ 0 0 1 -4,-3.2 4,-3.0 -5,-0.2 5,-0.3 0.901 104.9 50.3 -60.5 -42.1 5.1 -15.0 8.6 57 78 A Q H X S+ 0 0 134 -4,-1.5 4,-1.3 -5,-0.2 -1,-0.2 0.933 114.0 43.7 -62.3 -43.9 3.0 -18.0 9.6 58 79 A E H X S+ 0 0 85 -4,-1.7 4,-0.5 2,-0.2 -2,-0.2 0.904 115.5 50.3 -67.3 -39.2 4.6 -18.1 13.0 59 80 A F H >< S+ 0 0 0 -4,-2.9 3,-1.1 1,-0.2 4,-0.2 0.947 116.9 37.1 -64.5 -53.4 4.4 -14.4 13.4 60 81 A N H >< S+ 0 0 12 -4,-3.0 3,-1.4 1,-0.3 -1,-0.2 0.711 105.2 72.4 -76.5 -15.3 0.7 -14.0 12.5 61 82 A G H >< S+ 0 0 24 -4,-1.3 3,-1.9 -5,-0.3 4,-0.4 0.698 78.4 76.9 -70.3 -17.6 0.1 -17.3 14.3 62 83 A L G XX S+ 0 0 15 -3,-1.1 4,-1.7 -4,-0.5 3,-1.5 0.783 78.4 73.7 -62.9 -24.1 0.6 -15.4 17.6 63 84 A K G <4 S+ 0 0 36 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.629 84.3 65.2 -66.5 -11.5 -2.9 -14.0 17.1 64 85 A K G <4 S+ 0 0 189 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.790 107.0 41.8 -79.8 -23.8 -4.3 -17.4 18.0 65 86 A M T <4 S+ 0 0 146 -3,-1.5 -2,-0.2 -4,-0.4 -1,-0.2 0.805 130.6 25.8 -88.0 -33.4 -2.8 -16.8 21.5 66 87 A N >< - 0 0 35 -4,-1.7 3,-1.7 1,-0.1 -1,-0.3 -0.813 67.1-172.3-134.3 93.0 -3.8 -13.2 21.7 67 88 A P T 3 S+ 0 0 104 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.687 85.1 58.7 -57.6 -22.5 -6.9 -12.4 19.5 68 89 A K T 3 S+ 0 0 185 2,-0.1 2,-0.1 0, 0.0 -5,-0.1 0.662 81.6 109.2 -83.2 -15.7 -6.5 -8.6 20.1 69 90 A L < - 0 0 1 -3,-1.7 2,-0.4 -7,-0.1 -37,-0.2 -0.350 53.8-159.5 -63.7 135.9 -3.0 -8.5 18.7 70 91 A K E -c 32 0A 72 -39,-1.9 -37,-2.3 -2,-0.1 2,-0.3 -0.914 3.7-159.3-116.6 143.8 -2.6 -6.8 15.3 71 92 A T E -c 33 0A 0 -2,-0.4 41,-1.8 -39,-0.2 42,-0.4 -0.908 7.4-174.1-122.9 152.2 0.3 -7.3 12.9 72 93 A L E -c 34 0A 0 -39,-2.3 -37,-2.9 -2,-0.3 2,-0.5 -0.963 20.9-132.0-138.9 157.4 1.6 -5.2 10.1 73 94 A L E -cd 35 114A 0 40,-2.1 42,-2.6 -2,-0.3 2,-0.4 -0.951 21.4-144.3-110.9 126.4 4.3 -5.8 7.5 74 95 A A E -cd 36 115A 0 -39,-2.8 -36,-3.0 -2,-0.5 -37,-0.6 -0.782 8.3-154.2 -93.0 133.0 6.8 -3.0 7.0 75 96 A I E +cd 38 116A 0 40,-2.6 42,-2.5 -2,-0.4 2,-0.5 -0.907 59.9 4.1-106.8 130.0 8.2 -2.3 3.5 76 97 A G E - d 0 117A 5 -38,-2.3 4,-0.2 -2,-0.5 42,-0.2 -0.893 56.6-178.4 116.2-122.1 11.6 -0.7 3.2 77 98 A G > - 0 0 1 40,-3.2 4,-0.6 -2,-0.5 42,-0.4 -0.196 54.7 -65.4 96.3 169.0 14.0 0.2 5.9 78 99 A W T >4 S+ 0 0 18 1,-0.2 3,-1.2 2,-0.2 -1,-0.1 0.906 130.2 50.1 -60.0 -48.5 17.4 1.9 5.5 79 100 A N T 34 S+ 0 0 125 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.776 98.2 68.9 -65.5 -24.1 19.2 -0.8 3.6 80 101 A F T 34 S- 0 0 47 -3,-0.4 4,-0.4 -4,-0.2 -1,-0.3 0.780 90.8-162.1 -66.2 -27.5 16.4 -1.0 1.0 81 102 A G << - 0 0 26 -3,-1.2 38,-0.4 -4,-0.6 -1,-0.2 -0.243 26.1 -81.8 77.9-165.6 17.3 2.5 -0.3 82 103 A T S > S+ 0 0 11 42,-0.3 4,-2.9 36,-0.1 5,-0.2 0.661 99.8 84.3-115.5 -22.9 15.2 4.8 -2.3 83 104 A Q H > S+ 0 0 109 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.868 92.5 48.2 -55.7 -44.7 15.4 3.7 -6.0 84 105 A K H > S+ 0 0 103 -4,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.878 114.1 47.7 -65.3 -37.9 12.7 1.0 -5.9 85 106 A F H > S+ 0 0 1 2,-0.2 4,-2.6 -3,-0.2 5,-0.2 0.941 111.7 50.2 -66.4 -45.6 10.3 3.3 -4.1 86 107 A T H X S+ 0 0 13 -4,-2.9 4,-1.0 1,-0.2 -2,-0.2 0.933 111.7 48.2 -58.6 -44.4 11.0 6.2 -6.6 87 108 A D H < S+ 0 0 75 -4,-2.7 4,-0.3 -5,-0.2 -1,-0.2 0.857 112.7 48.7 -65.6 -32.8 10.5 3.9 -9.5 88 109 A M H >< S+ 0 0 0 -4,-1.7 3,-0.6 1,-0.2 -1,-0.2 0.878 113.7 43.6 -77.2 -38.7 7.2 2.6 -8.1 89 110 A V H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.580 91.6 89.3 -84.1 -4.9 5.7 5.9 -7.3 90 111 A A T 3< S+ 0 0 38 -4,-1.0 2,-0.3 -5,-0.2 -1,-0.2 0.799 92.9 28.4 -60.7 -31.8 6.7 7.5 -10.6 91 112 A T S <> S- 0 0 60 -3,-0.6 4,-2.4 -4,-0.3 5,-0.2 -0.952 73.1-122.7-135.5 154.9 3.6 6.5 -12.4 92 113 A A H > S+ 0 0 62 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.875 113.8 53.8 -59.6 -36.9 -0.0 5.8 -11.8 93 114 A N H > S+ 0 0 113 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.916 109.7 45.7 -65.2 -43.1 0.4 2.3 -13.3 94 115 A N H > S+ 0 0 35 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.874 112.7 50.8 -69.4 -35.4 3.3 1.3 -11.0 95 116 A R H X S+ 0 0 38 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.904 111.7 48.7 -66.4 -38.1 1.4 2.7 -8.0 96 117 A Q H X S+ 0 0 115 -4,-2.2 4,-2.6 -5,-0.2 5,-0.3 0.917 109.3 51.3 -65.8 -45.9 -1.6 0.6 -9.0 97 118 A T H X S+ 0 0 48 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.940 114.1 45.2 -55.9 -47.5 0.4 -2.5 -9.4 98 119 A F H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -53,-0.3 0.928 112.7 48.6 -64.4 -46.6 1.9 -2.0 -6.0 99 120 A V H X S+ 0 0 7 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.946 113.4 46.2 -62.0 -46.8 -1.3 -1.2 -4.2 100 121 A N H X S+ 0 0 95 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.904 113.0 50.8 -62.6 -39.8 -3.2 -4.2 -5.6 101 122 A S H X S+ 0 0 14 -4,-2.1 4,-2.6 -5,-0.3 -1,-0.2 0.861 107.1 55.3 -65.4 -35.9 -0.2 -6.5 -4.9 102 123 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.920 106.2 48.6 -65.7 -45.5 -0.1 -5.2 -1.3 103 124 A I H X S+ 0 0 27 -4,-2.0 4,-2.5 1,-0.2 5,-0.3 0.964 115.0 45.6 -58.8 -50.0 -3.8 -6.0 -0.5 104 125 A R H X S+ 0 0 208 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.908 115.3 46.5 -58.8 -44.8 -3.4 -9.5 -1.9 105 126 A F H X S+ 0 0 28 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.921 112.8 48.7 -65.2 -45.4 -0.1 -10.2 -0.1 106 127 A L H <>S+ 0 0 0 -4,-2.8 5,-2.8 1,-0.2 4,-0.4 0.919 115.2 44.6 -63.6 -44.0 -1.3 -8.9 3.2 107 128 A R H ><5S+ 0 0 64 -4,-2.5 3,-0.7 -5,-0.3 -1,-0.2 0.871 109.8 56.7 -67.4 -38.5 -4.5 -11.0 3.0 108 129 A K H 3<5S+ 0 0 145 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.927 116.3 33.8 -58.5 -45.5 -2.6 -14.0 1.9 109 130 A Y T 3<5S- 0 0 44 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.335 113.0-113.0 -96.7 9.1 -0.2 -14.1 4.9 110 131 A S T < 5 + 0 0 70 -3,-0.7 2,-0.3 -4,-0.4 -3,-0.2 0.871 58.2 156.4 63.1 42.8 -2.8 -12.8 7.4 111 132 A F < - 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