==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 20-OCT-09 3KBN . COMPND 2 MOLECULE: XYLOSE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES RUBIGINOSUS; . AUTHOR A.Y.KOVALEVSKY,L.HANSON,P.LANGAN . 388 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19832.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 269 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 33 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 1.8 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 20 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 38.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.6 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 3 1 2 0 1 1 0 2 0 1 1 0 0 0 1 0 1 0 1 0 0 0 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 4 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 M 0 0 167 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 119.0 -4.8 -7.3 -14.0 2 2 A N - 0 0 115 2,-0.1 2,-0.2 310,-0.0 306,-0.0 -0.988 360.0-157.1-137.2 153.1 -5.8 -10.5 -15.9 3 3 A Y + 0 0 20 -2,-0.3 308,-0.2 2,-0.0 309,-0.1 -0.853 25.0 165.1-128.2 47.6 -7.6 -11.1 -19.1 4 4 A Q - 0 0 140 -2,-0.2 2,-0.1 307,-0.1 43,-0.1 -0.764 29.7-135.6 -88.6 116.4 -9.1 -14.5 -18.9 5 5 A P - 0 0 20 0, 0.0 43,-0.1 0, 0.0 303,-0.0 -0.445 19.4-169.8 -75.1 154.3 -11.7 -15.3 -21.6 6 6 A T > - 0 0 50 -2,-0.1 3,-2.6 1,-0.0 5,-0.4 -0.924 41.3-101.9-129.5 157.7 -15.0 -17.0 -20.7 7 7 A P G > S+ 0 0 70 0, 0.0 3,-1.9 0, 0.0 42,-0.1 0.813 117.9 71.0 -50.1 -24.8 -17.6 -18.4 -23.1 8 8 A E G 3 S+ 0 0 150 1,-0.3 40,-0.1 2,-0.1 41,-0.0 0.770 85.0 67.3 -65.3 -21.9 -19.7 -15.3 -22.3 9 9 A D G < S- 0 0 36 -3,-2.6 -1,-0.3 38,-0.2 275,-0.2 0.573 102.2-134.6 -75.4 -8.4 -17.2 -13.2 -24.3 10 10 A R < + 0 0 61 -3,-1.9 274,-2.9 -4,-0.3 2,-0.4 0.799 39.6 168.3 63.7 33.6 -18.4 -15.0 -27.5 11 11 A F E +a 284 0A 1 -5,-0.4 38,-3.5 36,-0.3 39,-1.3 -0.673 8.5 179.3 -81.8 130.9 -15.0 -15.8 -28.9 12 12 A T E -ab 285 50A 0 272,-2.2 274,-2.6 -2,-0.4 2,-0.3 -0.898 13.5-162.5-132.7 157.3 -15.1 -18.2 -31.8 13 13 A F E -ab 286 51A 0 37,-1.3 39,-1.7 -2,-0.3 2,-0.2 -0.998 22.1-119.0-139.1 142.6 -12.6 -19.8 -34.2 14 14 A G E >> - b 0 52A 0 272,-1.1 3,-1.7 -2,-0.3 4,-0.8 -0.500 24.2-126.0 -76.9 148.9 -12.8 -21.6 -37.6 15 15 A L H 3> S+ 0 0 12 37,-2.4 4,-1.2 1,-0.3 -1,-0.1 0.852 111.3 59.8 -56.7 -32.8 -11.6 -25.1 -37.7 16 16 A W H 34 S+ 0 0 40 36,-0.2 -1,-0.3 2,-0.2 37,-0.1 0.490 96.6 63.3 -77.2 -6.6 -9.3 -24.1 -40.5 17 17 A T H X4 S+ 0 0 0 -3,-1.7 3,-2.1 2,-0.2 -2,-0.2 0.956 114.4 24.3 -82.6 -72.6 -7.5 -21.5 -38.4 18 18 A V H 3< S+ 0 0 0 -4,-0.8 -2,-0.2 1,-0.3 -3,-0.1 0.770 124.4 59.7 -61.9 -23.4 -5.8 -23.4 -35.7 19 19 A G T 3< S+ 0 0 21 -4,-1.2 15,-0.3 -5,-0.3 -1,-0.3 0.411 72.7 125.9 -83.8 1.7 -5.9 -26.4 -38.1 20 20 A W < - 0 0 55 -3,-2.1 -3,-0.1 1,-0.2 -4,-0.0 -0.439 50.6-154.4 -63.2 125.9 -3.9 -24.5 -40.8 21 21 A Q - 0 0 61 -2,-0.3 9,-2.0 9,-0.1 10,-1.9 0.563 39.8-106.0 -85.1 -6.9 -1.0 -26.9 -41.7 22 22 A G + 0 0 0 1,-0.3 2,-0.3 7,-0.3 270,-0.1 0.553 63.2 153.2 98.9 7.5 1.4 -24.2 -42.9 23 23 A R + 0 0 158 8,-0.1 -1,-0.3 6,-0.1 5,-0.2 -0.552 15.7 168.9 -69.3 126.7 1.2 -24.7 -46.7 24 24 A D B > -F 27 0B 63 3,-1.6 3,-1.4 -2,-0.3 5,-0.0 -0.737 53.0 -84.6-128.9 179.8 2.0 -21.4 -48.5 25 25 A P T 3 S+ 0 0 124 0, 0.0 -2,-0.1 0, 0.0 3,-0.1 0.703 128.7 31.4 -59.9 -17.4 2.7 -20.6 -52.1 26 26 A F T 3 S+ 0 0 202 2,-0.1 2,-0.3 1,-0.1 -3,-0.0 0.197 116.4 53.7-122.4 12.6 6.4 -21.5 -51.7 27 27 A G B < -F 24 0B 19 -3,-1.4 -3,-1.6 -5,-0.0 3,-0.1 -0.999 67.2-117.7-156.9 152.1 6.4 -24.2 -49.0 28 28 A D - 0 0 132 -2,-0.3 -4,-0.1 -5,-0.2 -2,-0.1 -0.239 55.9 -71.2 -76.8 168.1 5.1 -27.5 -47.8 29 29 A A - 0 0 35 1,-0.1 -7,-0.3 -6,-0.1 -1,-0.2 -0.385 35.9-168.3 -61.3 142.4 3.1 -28.1 -44.6 30 30 A T S S+ 0 0 64 -9,-2.0 2,-0.3 -3,-0.1 -8,-0.2 0.452 70.4 49.1-108.4 -6.3 5.0 -27.7 -41.4 31 31 A R S S- 0 0 16 -10,-1.9 -8,-0.1 264,-0.1 3,-0.1 -0.965 82.7-114.0-131.5 149.8 2.3 -29.2 -39.1 32 32 A R - 0 0 128 -2,-0.3 2,-0.1 1,-0.1 -2,-0.1 -0.303 48.1 -86.4 -71.2 161.3 0.2 -32.4 -39.2 33 33 A A - 0 0 55 1,-0.0 2,-0.5 -2,-0.0 -1,-0.1 -0.381 39.6-132.4 -66.0 147.4 -3.5 -32.2 -39.7 34 34 A L - 0 0 22 -15,-0.3 -1,-0.0 -19,-0.1 -15,-0.0 -0.879 14.8-123.3 -98.7 134.4 -5.7 -31.7 -36.6 35 35 A D >> - 0 0 55 -2,-0.5 4,-1.9 1,-0.1 3,-0.8 -0.588 23.6-127.8 -68.1 127.6 -8.7 -33.9 -36.0 36 36 A P H 3> S+ 0 0 29 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.819 109.4 58.0 -47.1 -34.3 -11.7 -31.4 -35.6 37 37 A V H 3> S+ 0 0 14 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.889 104.6 50.4 -67.5 -38.2 -12.6 -33.2 -32.4 38 38 A E H <> S+ 0 0 66 -3,-0.8 4,-2.7 1,-0.2 5,-0.2 0.922 109.9 50.3 -64.2 -42.6 -9.2 -32.4 -31.0 39 39 A S H X S+ 0 0 2 -4,-1.9 4,-2.7 1,-0.2 5,-0.3 0.916 108.9 51.4 -63.6 -40.3 -9.5 -28.7 -32.0 40 40 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.934 111.9 47.1 -64.1 -43.7 -12.9 -28.4 -30.3 41 41 A R H X S+ 0 0 100 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.926 114.6 45.5 -62.4 -45.7 -11.6 -29.8 -27.1 42 42 A R H X S+ 0 0 65 -4,-2.7 4,-1.0 1,-0.2 -1,-0.2 0.900 112.9 50.1 -67.7 -37.9 -8.4 -27.6 -27.0 43 43 A L H >X>S+ 0 0 0 -4,-2.7 5,-2.1 -5,-0.2 4,-0.7 0.915 108.0 53.2 -66.2 -40.1 -10.3 -24.4 -27.9 44 44 A A H ><5S+ 0 0 30 -4,-2.2 3,-1.0 -5,-0.3 -1,-0.2 0.916 106.2 54.1 -60.4 -38.5 -12.9 -25.1 -25.2 45 45 A E H 3<5S+ 0 0 149 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.795 104.8 54.6 -66.1 -25.8 -10.1 -25.4 -22.7 46 46 A L H <<5S- 0 0 41 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.601 125.3-100.1 -83.1 -10.2 -8.8 -22.0 -23.8 47 47 A G T <<5 + 0 0 10 -3,-1.0 -36,-0.3 -4,-0.7 -38,-0.2 0.550 67.1 154.5 104.7 9.7 -12.1 -20.4 -23.1 48 48 A A < - 0 0 4 -5,-2.1 -1,-0.2 1,-0.1 -36,-0.2 -0.373 39.3-145.5 -68.0 158.9 -13.6 -20.1 -26.5 49 49 A H - 0 0 33 -38,-3.5 36,-1.9 1,-0.2 2,-0.3 0.729 67.3 -31.7 -92.1 -33.0 -17.4 -20.0 -27.0 50 50 A G E -bc 12 85A 0 -39,-1.3 -37,-1.3 34,-0.3 2,-0.3 -0.980 51.6-112.2-172.2-178.3 -17.6 -21.9 -30.2 51 51 A V E -b 13 0A 0 34,-2.4 37,-0.5 -2,-0.3 2,-0.3 -0.876 15.6-152.3-131.4 162.6 -16.2 -23.0 -33.6 52 52 A T E -b 14 0A 0 -39,-1.7 -37,-2.4 -2,-0.3 2,-0.3 -0.866 15.9-169.5-129.9 163.1 -17.1 -22.5 -37.3 53 53 A F E -g 89 0C 0 35,-0.7 37,-2.1 -2,-0.3 2,-0.3 -1.000 25.5-130.1-152.0 152.9 -16.5 -24.6 -40.3 54 54 A H E >> -g 90 0C 15 -2,-0.3 3,-1.8 35,-0.2 4,-1.1 -0.778 42.3-111.7 -84.9 149.2 -16.5 -25.0 -44.0 55 55 A D H >> S+ 0 0 15 35,-1.2 4,-2.5 -2,-0.3 3,-0.9 0.908 119.3 50.1 -41.9 -51.4 -18.3 -28.2 -45.3 56 56 A D H 34 S+ 0 0 39 1,-0.2 5,-0.3 2,-0.2 -1,-0.3 0.556 100.4 62.9 -78.0 -6.4 -15.0 -29.6 -46.4 57 57 A D H <4 S+ 0 0 51 -3,-1.8 -1,-0.2 3,-0.1 -2,-0.2 0.772 116.4 29.7 -76.5 -31.0 -13.2 -29.0 -43.1 58 58 A L H << S+ 0 0 5 -4,-1.1 -2,-0.2 -3,-0.9 -3,-0.1 0.827 127.9 37.5 -97.4 -39.1 -15.6 -31.4 -41.3 59 59 A I S < S- 0 0 11 -4,-2.5 -1,-0.3 -5,-0.2 3,-0.1 -0.961 90.1-120.1-124.1 110.9 -16.5 -33.8 -44.1 60 60 A P > - 0 0 63 0, 0.0 3,-2.1 0, 0.0 -3,-0.1 -0.216 43.0 -91.5 -51.3 133.3 -13.7 -34.7 -46.5 61 61 A F T 3 S+ 0 0 95 -5,-0.3 -5,-0.0 1,-0.3 -6,-0.0 -0.272 112.1 18.4 -47.5 130.7 -14.5 -33.8 -50.1 62 62 A G T 3 S+ 0 0 69 1,-0.3 -1,-0.3 -3,-0.1 0, 0.0 0.332 86.7 162.1 86.4 4.3 -16.2 -36.7 -51.9 63 63 A S < - 0 0 25 -3,-2.1 -1,-0.3 -4,-0.1 2,-0.1 -0.143 41.9-112.7 -53.8 145.7 -17.2 -38.6 -48.7 64 64 A S > - 0 0 55 1,-0.1 4,-2.9 4,-0.0 5,-0.2 -0.378 29.4-109.2 -70.0 155.9 -20.0 -41.2 -49.0 65 65 A D H > S+ 0 0 114 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.864 122.0 54.4 -58.7 -31.9 -23.2 -40.4 -47.2 66 66 A S H > S+ 0 0 73 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.909 110.0 44.0 -70.6 -40.0 -22.3 -43.1 -44.7 67 67 A E H > S+ 0 0 88 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.921 109.7 58.0 -71.3 -32.5 -19.0 -41.5 -43.9 68 68 A R H X S+ 0 0 49 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.965 106.2 48.8 -53.9 -53.8 -20.6 -38.0 -43.8 69 69 A E H X S+ 0 0 152 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.906 110.1 52.1 -51.7 -46.6 -22.9 -39.2 -41.0 70 70 A E H X S+ 0 0 116 -4,-1.8 4,-2.0 1,-0.2 5,-0.2 0.907 109.6 48.3 -58.0 -47.5 -20.0 -40.7 -39.1 71 71 A H H X S+ 0 0 62 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.909 113.1 47.2 -66.0 -39.5 -18.0 -37.4 -39.2 72 72 A V H X S+ 0 0 17 -4,-2.4 4,-2.9 -5,-0.2 5,-0.2 0.935 109.6 53.1 -67.7 -42.9 -21.0 -35.3 -38.1 73 73 A K H X S+ 0 0 164 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.929 110.2 47.6 -61.3 -44.7 -21.9 -37.6 -35.2 74 74 A R H X S+ 0 0 114 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.910 113.1 48.9 -59.6 -43.7 -18.3 -37.5 -33.8 75 75 A F H X S+ 0 0 2 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.946 109.8 51.4 -62.9 -45.8 -18.2 -33.7 -34.1 76 76 A R H X S+ 0 0 95 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.888 106.8 53.8 -61.3 -36.8 -21.6 -33.4 -32.4 77 77 A Q H X S+ 0 0 106 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.917 107.1 51.2 -66.9 -37.4 -20.4 -35.5 -29.5 78 78 A A H X S+ 0 0 0 -4,-2.0 4,-1.3 1,-0.2 6,-0.3 0.899 110.5 49.6 -63.3 -37.0 -17.4 -33.2 -29.1 79 79 A L H X>S+ 0 0 12 -4,-2.2 4,-2.2 2,-0.2 5,-0.6 0.919 111.9 48.2 -64.6 -42.3 -19.7 -30.2 -29.0 80 80 A D H <5S+ 0 0 104 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.865 111.1 50.6 -64.8 -35.7 -21.9 -32.0 -26.4 81 81 A D H <5S+ 0 0 93 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.783 121.5 31.7 -73.0 -26.4 -19.0 -32.9 -24.3 82 82 A T H <5S- 0 0 44 -4,-1.3 -2,-0.2 -3,-0.2 -1,-0.2 0.607 97.6-123.0-109.2 -16.7 -17.5 -29.4 -24.2 83 83 A G T <5 + 0 0 49 -4,-2.2 -3,-0.2 1,-0.2 -4,-0.1 0.587 58.7 152.5 80.0 7.2 -20.6 -27.0 -24.4 84 84 A M < - 0 0 7 -5,-0.6 -34,-0.3 -6,-0.3 -1,-0.2 -0.420 31.6-147.1 -71.6 147.3 -19.1 -25.4 -27.5 85 85 A K B -c 50 0A 123 -36,-1.9 -34,-2.4 -3,-0.1 45,-0.1 -0.694 11.3-138.5-109.4 167.0 -21.5 -23.9 -30.0 86 86 A V + 0 0 5 43,-0.5 -34,-0.1 -2,-0.2 -36,-0.1 -0.842 29.6 164.8-124.6 85.3 -21.5 -23.5 -33.8 87 87 A P + 0 0 8 0, 0.0 45,-2.0 0, 0.0 46,-1.6 0.682 63.4 25.9 -79.2 -16.0 -22.8 -20.0 -34.6 88 88 A M E + h 0 133C 2 -37,-0.5 -35,-0.7 43,-0.2 2,-0.3 -0.992 57.7 180.0-147.0 147.9 -21.6 -19.8 -38.2 89 89 A A E -gh 53 134C 0 44,-1.5 46,-2.3 -2,-0.3 2,-0.3 -0.936 6.3-177.3-141.8 166.9 -20.9 -22.1 -41.1 90 90 A T E -gh 54 135C 6 -37,-2.1 -35,-1.2 -2,-0.3 2,-0.4 -0.907 24.2-105.7-155.7 174.1 -19.8 -21.6 -44.7 91 91 A T - 0 0 11 44,-0.6 2,-1.1 -2,-0.3 46,-0.3 -0.887 21.1-127.9-111.5 141.4 -19.0 -23.4 -47.9 92 92 A N + 0 0 11 -2,-0.4 4,-0.2 1,-0.1 44,-0.0 -0.801 43.0 153.4 -87.8 104.9 -15.7 -24.2 -49.5 93 93 A L + 0 0 16 -2,-1.1 47,-0.3 44,-0.3 -1,-0.1 -0.162 64.9 55.0-114.9 38.5 -16.1 -22.9 -53.1 94 94 A F S S+ 0 0 36 45,-0.1 -1,-0.1 9,-0.1 8,-0.1 0.607 87.6 61.9-142.2 -23.4 -12.4 -22.2 -53.6 95 95 A T S S+ 0 0 91 3,-0.0 -2,-0.1 2,-0.0 5,-0.0 0.932 82.0 79.2 -82.8 -44.9 -10.0 -25.2 -53.0 96 96 A H S > S- 0 0 69 -4,-0.2 3,-2.3 1,-0.1 4,-0.0 -0.382 84.3-122.4 -65.5 139.7 -11.1 -27.8 -55.6 97 97 A P G > S+ 0 0 92 0, 0.0 3,-2.0 0, 0.0 4,-0.2 0.733 107.3 73.0 -50.4 -27.0 -9.8 -27.3 -59.1 98 98 A V G 3 S+ 0 0 51 1,-0.3 3,-0.4 2,-0.1 -2,-0.1 0.815 95.2 52.9 -63.0 -23.4 -13.4 -27.2 -60.4 99 99 A F G X S+ 0 0 0 -3,-2.3 3,-2.1 1,-0.2 -1,-0.3 0.187 71.3 119.2 -92.7 18.2 -13.8 -23.8 -58.8 100 100 A K T < S+ 0 0 154 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.763 85.5 33.4 -60.6 -24.7 -10.7 -22.3 -60.5 101 101 A D T 3 S- 0 0 35 1,-0.5 41,-0.4 -3,-0.4 -1,-0.3 0.179 131.1 -79.9-111.2 14.9 -12.8 -19.6 -62.3 102 102 A G < - 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0 0 0 -35,-2.4 29,-0.2 -2,-0.3 2,-0.1 -0.786 27.5-168.9-123.1 80.2 -18.9 -10.3 -42.6 216 216 A P - 0 0 0 0, 0.0 29,-2.7 0, 0.0 2,-0.4 -0.412 8.7-147.3 -74.4 151.1 -15.9 -7.9 -42.9 217 217 A E B > -d 245 0A 0 -35,-0.3 4,-1.7 27,-0.2 3,-0.4 -0.981 13.7-132.7-121.5 133.5 -12.4 -9.0 -42.1 218 218 A V H > S+ 0 0 9 27,-1.8 4,-1.6 -2,-0.4 3,-0.2 0.916 105.4 42.9 -47.1 -56.8 -9.8 -6.7 -40.5 219 219 A G H > S+ 0 0 0 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.792 106.9 61.9 -69.5 -26.5 -6.9 -7.6 -42.9 220 220 A H H 4 S+ 0 0 5 -3,-0.4 3,-0.5 2,-0.2 4,-0.4 0.944 107.0 41.7 -66.8 -47.3 -9.1 -7.6 -46.1 221 221 A E H ><>S+ 0 0 6 -4,-1.7 5,-2.1 1,-0.2 3,-1.4 0.887 113.3 56.0 -66.3 -34.1 -10.1 -3.9 -45.9 222 222 A Q H ><5S+ 0 0 16 -4,-1.6 3,-1.5 -5,-0.3 -1,-0.2 0.761 93.4 68.1 -69.6 -21.1 -6.5 -3.1 -44.9 223 223 A M T 3<5S+ 0 0 6 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.617 103.7 45.5 -68.9 -14.4 -5.3 -4.8 -48.1 224 224 A A T < 5S- 0 0 46 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.220 121.1-112.2-106.0 9.1 -6.9 -1.9 -49.9 225 225 A G T < 5 + 0 0 53 -3,-1.5 -3,-0.2 1,-0.2 2,-0.1 0.683 69.9 145.5 74.5 18.5 -5.4 0.6 -47.4 226 226 A L < - 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