==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 14-JAN-03 1NNW . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR SOUTHEAST COLLABORATORY FOR STRUCTURAL GENOMICS (SECSG) . 502 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19773.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 354 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 43 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 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 . 6 1.2 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 . 31 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 148 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 0 0 0 1 3 2 1 1 0 0 2 0 2 0 0 0 0 0 0 1 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 3 3 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 PARALLEL BRIDGES PER LADDER . 0 0 0 2 2 4 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 4 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 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 2 A V 0 0 50 0, 0.0 210,-2.1 0, 0.0 211,-0.4 0.000 360.0 360.0 360.0 165.9 32.2 21.9 14.7 2 3 A Y E -aB 33 210A 54 30,-2.4 32,-1.9 208,-0.2 33,-0.7 -0.908 360.0-139.8-137.4 158.0 31.3 24.9 12.4 3 4 A V E -aB 35 209A 0 206,-1.5 206,-2.7 -2,-0.3 2,-0.6 -0.992 26.5-133.3-114.9 128.4 28.5 27.0 11.2 4 5 A A E -aB 36 208A 0 31,-2.3 33,-2.8 -2,-0.4 2,-0.5 -0.741 23.4-166.7 -82.3 121.9 28.5 27.9 7.5 5 6 A V E +aB 37 207A 0 202,-2.9 202,-2.4 -2,-0.6 2,-0.3 -0.958 10.2 174.6-116.0 122.5 27.9 31.7 7.0 6 7 A L E +a 38 0A 0 31,-2.6 33,-3.1 -2,-0.5 2,-0.3 -0.926 2.3 178.1-128.7 151.3 27.1 33.0 3.6 7 8 A A E +a 39 0A 0 198,-0.4 187,-2.8 -2,-0.3 188,-0.4 -0.993 50.5 22.4-152.4 151.6 26.0 36.5 2.3 8 9 A N + 0 0 0 31,-1.0 187,-2.2 32,-0.8 188,-0.8 0.903 47.9 161.0 60.0 51.6 25.2 38.5 -0.8 9 10 A I > - 0 0 0 32,-0.8 3,-2.3 30,-0.5 33,-0.2 0.882 22.0-173.2 -62.5 -40.8 24.2 35.8 -3.3 10 11 A A T 3 - 0 0 0 31,-3.0 36,-2.1 1,-0.3 35,-0.4 0.769 69.5 -54.7 51.0 36.2 22.5 38.7 -5.2 11 12 A G T 3 S+ 0 0 0 31,-2.2 37,-1.3 1,-0.2 2,-1.2 0.568 98.2 140.7 79.4 11.5 20.9 36.3 -7.7 12 13 A N <> + 0 0 0 -3,-2.3 4,-1.8 30,-0.2 -1,-0.2 -0.699 23.6 176.6 -91.6 90.1 24.2 34.7 -8.7 13 14 A L H > S+ 0 0 35 -2,-1.2 4,-3.1 1,-0.2 5,-0.2 0.910 74.2 51.9 -62.8 -49.9 23.3 31.0 -9.0 14 15 A P H > S+ 0 0 19 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.850 112.0 48.4 -59.0 -33.3 26.7 29.6 -10.2 15 16 A A H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.898 113.7 46.0 -72.2 -41.5 28.5 31.3 -7.3 16 17 A L H X S+ 0 0 1 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.923 112.4 51.5 -64.1 -44.5 26.0 29.9 -4.8 17 18 A T H X S+ 0 0 64 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.917 110.7 48.3 -58.3 -45.1 26.2 26.4 -6.4 18 19 A A H X S+ 0 0 19 -4,-2.0 4,-1.5 -5,-0.2 -1,-0.2 0.833 110.9 50.0 -67.5 -34.2 30.0 26.4 -6.1 19 20 A A H X S+ 0 0 0 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.922 113.1 44.9 -70.9 -44.5 30.0 27.5 -2.5 20 21 A L H X S+ 0 0 25 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.863 111.1 54.5 -67.8 -35.2 27.5 24.9 -1.4 21 22 A S H X S+ 0 0 69 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.2 0.851 107.8 50.2 -66.3 -34.6 29.3 22.2 -3.4 22 23 A R H X S+ 0 0 81 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.834 107.7 53.4 -70.6 -35.1 32.6 23.1 -1.6 23 24 A I H X S+ 0 0 0 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.938 108.8 48.9 -63.7 -47.8 30.8 22.8 1.8 24 25 A E H X S+ 0 0 78 -4,-2.2 4,-1.1 1,-0.2 -2,-0.2 0.861 111.9 50.6 -56.0 -38.7 29.6 19.3 0.8 25 26 A E H X S+ 0 0 68 -4,-1.5 4,-1.0 1,-0.2 -1,-0.2 0.845 106.9 52.4 -70.5 -36.6 33.2 18.5 -0.2 26 27 A M H <>S+ 0 0 10 -4,-2.1 5,-1.1 1,-0.2 -1,-0.2 0.801 105.8 55.3 -71.4 -27.9 34.6 19.8 3.1 27 28 A R H ><5S+ 0 0 79 -4,-1.6 3,-0.7 3,-0.2 -1,-0.2 0.802 104.0 54.2 -70.6 -31.9 32.2 17.5 4.9 28 29 A E H 3<5S+ 0 0 75 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.770 105.8 53.9 -67.6 -28.4 33.6 14.6 2.9 29 30 A E T 3<5S- 0 0 145 -4,-1.0 -1,-0.2 -5,-0.1 -2,-0.2 0.416 133.2 -89.7 -85.9 -2.4 37.1 15.7 4.2 30 31 A G T < 5S+ 0 0 68 -3,-0.7 2,-0.5 1,-0.3 -3,-0.2 0.838 74.9 146.1 97.1 40.8 35.8 15.5 7.9 31 32 A Y < - 0 0 80 -5,-1.1 2,-1.0 -8,-0.1 -1,-0.3 -0.931 44.4-136.7-104.6 128.3 34.4 18.9 8.7 32 33 A E + 0 0 122 -2,-0.5 -30,-2.4 -29,-0.0 2,-0.7 -0.775 26.0 178.7 -85.2 103.2 31.4 19.0 11.0 33 34 A I E +a 2 0A 3 -2,-1.0 -30,-0.2 -32,-0.2 3,-0.1 -0.918 6.1 170.0-105.8 106.3 29.0 21.5 9.5 34 35 A E E - 0 0 85 -32,-1.9 30,-0.5 -2,-0.7 2,-0.3 0.771 58.0 -1.5 -92.4 -28.8 25.9 21.6 11.7 35 36 A K E -a 3 0A 17 -33,-0.7 -31,-2.3 28,-0.1 2,-0.4 -0.965 59.1-126.6-155.8 172.1 23.9 24.6 10.4 36 37 A Y E -ac 4 65A 5 28,-2.5 30,-2.3 -2,-0.3 2,-0.5 -0.977 5.1-162.3-127.3 135.5 23.8 27.5 7.9 37 38 A Y E -ac 5 66A 0 -33,-2.8 -31,-2.6 -2,-0.4 2,-0.5 -0.983 14.1-169.9-108.4 128.8 23.3 31.3 8.2 38 39 A I E -ac 6 67A 2 28,-2.7 30,-2.0 -2,-0.5 2,-0.3 -0.964 3.4-169.0-123.4 116.1 22.4 33.0 4.9 39 40 A L E -ac 7 68A 2 -33,-3.1 -31,-1.0 -2,-0.5 -30,-0.5 -0.754 25.2 -75.6-104.1 147.4 22.4 36.8 4.7 40 41 A G S S+ 0 0 0 28,-0.8 -32,-0.8 -2,-0.3 -1,-0.1 -0.058 88.6 86.4 -63.4 173.5 21.0 39.0 2.0 41 42 A N + 0 0 0 2,-0.3 -31,-3.0 -34,-0.2 -32,-0.8 0.418 53.0 163.9 -71.0 133.5 21.1 40.2 -0.6 42 43 A I S S+ 0 0 1 -33,-0.2 -31,-2.2 -34,-0.2 2,-0.2 0.904 71.7 14.8 -80.4 -50.3 19.4 36.9 -1.8 43 44 A V S S+ 0 0 0 -33,-0.3 -2,-0.3 -32,-0.1 -33,-0.3 -0.667 82.5 101.3-112.3 173.6 18.3 38.4 -5.1 44 45 A G S S+ 0 0 0 2,-0.5 61,-0.2 -2,-0.2 -33,-0.1 -0.635 75.6 16.4 161.3 -96.5 19.4 41.6 -6.9 45 46 A L S S+ 0 0 3 -35,-0.4 -34,-0.2 -2,-0.2 -35,-0.1 0.831 102.5 73.3 -85.4 -34.8 21.7 42.2 -9.8 46 47 A F S S- 0 0 1 -36,-2.1 2,-0.6 -37,-0.1 -2,-0.5 -0.585 82.4-119.3 -97.9 148.7 22.2 38.8 -11.4 47 48 A P S S+ 0 0 1 0, 0.0 3,-0.1 0, 0.0 -35,-0.1 -0.004 89.4 82.8 -85.4 30.6 19.5 37.1 -13.5 48 49 A Y > + 0 0 14 -37,-1.3 4,-2.1 -2,-0.6 5,-0.2 -0.212 44.3 135.2-119.2 42.9 18.9 33.8 -11.5 49 50 A P H > S+ 0 0 0 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.897 74.0 44.3 -60.5 -47.3 16.4 35.0 -8.8 50 51 A K H > S+ 0 0 47 1,-0.2 4,-1.5 2,-0.2 -2,-0.1 0.879 114.9 48.6 -63.6 -41.2 13.9 32.1 -9.0 51 52 A E H > S+ 0 0 67 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.855 107.4 54.4 -71.0 -37.8 16.6 29.4 -9.2 52 53 A V H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.921 108.6 50.0 -59.6 -43.7 18.6 30.8 -6.2 53 54 A I H X S+ 0 0 8 -4,-1.6 4,-2.6 -5,-0.2 -2,-0.2 0.862 107.5 54.1 -66.0 -33.3 15.4 30.6 -4.1 54 55 A E H X S+ 0 0 107 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.856 108.6 48.6 -68.7 -34.7 14.8 27.0 -5.2 55 56 A V H X S+ 0 0 44 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.857 113.8 46.4 -71.5 -37.9 18.3 26.0 -4.0 56 57 A I H X S+ 0 0 2 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.914 111.2 52.3 -69.9 -42.9 17.7 27.7 -0.7 57 58 A K H X S+ 0 0 98 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.906 111.3 46.2 -59.4 -44.6 14.3 26.1 -0.3 58 59 A D H X S+ 0 0 63 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.873 112.5 51.0 -66.4 -37.9 15.6 22.6 -0.9 59 60 A L H X S+ 0 0 27 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.789 105.6 56.0 -69.1 -30.0 18.5 23.3 1.5 60 61 A T H < S+ 0 0 61 -4,-1.9 5,-0.2 1,-0.2 -1,-0.2 0.781 105.8 52.2 -74.3 -27.4 16.0 24.5 4.2 61 62 A K H < S+ 0 0 145 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.856 120.0 32.6 -70.6 -36.4 14.2 21.2 4.0 62 63 A K H < S+ 0 0 75 -4,-1.2 2,-0.2 2,-0.0 -2,-0.2 0.708 121.2 36.7 -97.8 -27.0 17.4 19.1 4.5 63 64 A E S < S- 0 0 55 -4,-2.1 2,-0.9 -5,-0.1 -28,-0.1 -0.777 86.6 -95.8-125.9 166.6 19.5 21.3 6.8 64 65 A N + 0 0 89 -30,-0.5 -28,-2.5 -2,-0.2 2,-0.4 -0.788 57.4 170.0 -83.5 105.6 19.2 23.7 9.7 65 66 A V E -c 36 0A 19 -2,-0.9 2,-0.4 -5,-0.2 -28,-0.2 -0.969 25.6-168.8-127.4 134.4 19.2 27.1 8.0 66 67 A K E -c 37 0A 51 -30,-2.3 -28,-2.7 -2,-0.4 2,-0.3 -0.995 16.7-171.9-120.0 131.2 18.4 30.6 9.1 67 68 A I E -c 38 0A 19 -2,-0.4 2,-0.3 -30,-0.2 -28,-0.2 -0.895 10.2-171.2-123.7 143.8 18.0 33.4 6.5 68 69 A I E -c 39 0A 3 -30,-2.0 -28,-0.8 -2,-0.3 54,-0.2 -0.990 23.8-120.1-131.1 151.1 17.7 37.2 6.5 69 70 A R - 0 0 10 52,-2.3 68,-0.4 -2,-0.3 2,-0.2 -0.495 23.4-150.2 -87.1 156.7 16.8 39.6 3.7 70 71 A G > - 0 0 0 -2,-0.2 4,-2.1 -31,-0.1 5,-0.2 -0.430 39.0 -75.0-112.7-173.6 19.0 42.4 2.4 71 72 A K H > S+ 0 0 41 73,-0.2 4,-1.9 1,-0.2 73,-0.1 0.863 127.7 45.4 -52.3 -49.7 18.4 45.8 0.8 72 73 A Y H > S+ 0 0 2 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.916 112.3 51.6 -67.2 -42.8 17.5 44.6 -2.6 73 74 A D H > S+ 0 0 0 -30,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.874 109.0 51.9 -57.3 -40.0 15.1 41.9 -1.2 74 75 A Q H X S+ 0 0 14 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.870 102.4 58.3 -69.1 -37.9 13.4 44.6 0.9 75 76 A I H X S+ 0 0 24 -4,-1.9 4,-0.5 2,-0.2 -1,-0.2 0.883 112.5 41.2 -58.6 -38.7 12.9 46.9 -2.1 76 77 A I H >< S+ 0 0 0 -4,-1.4 3,-0.9 2,-0.2 -2,-0.2 0.924 115.9 48.7 -72.5 -46.2 10.9 44.1 -3.8 77 78 A A H 3< S+ 0 0 9 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.847 101.5 65.0 -64.4 -35.1 9.1 43.1 -0.6 78 79 A M H 3< S+ 0 0 142 -4,-2.9 -1,-0.2 -5,-0.1 -2,-0.2 0.780 83.2 103.5 -55.9 -32.1 8.1 46.7 0.2 79 80 A S S << S- 0 0 10 -3,-0.9 -3,-0.0 -4,-0.5 4,-0.0 -0.148 89.9 -88.6 -66.4 147.2 5.9 46.9 -2.9 80 81 A D > - 0 0 99 1,-0.1 3,-1.6 2,-0.1 -1,-0.1 -0.317 41.8-126.2 -48.5 123.7 2.1 46.7 -2.9 81 82 A P T 3 S+ 0 0 62 0, 0.0 -1,-0.1 0, 0.0 34,-0.1 0.557 102.9 37.7 -63.5 -12.9 1.3 43.0 -3.2 82 83 A H T 3 S+ 0 0 160 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.233 78.4 138.3-130.9 50.5 -1.0 43.3 -6.2 83 84 A A < - 0 0 38 -3,-1.6 -4,-0.0 1,-0.1 0, 0.0 -0.596 49.3-140.4 -78.3 153.4 0.7 46.0 -8.3 84 85 A T S S+ 0 0 127 -2,-0.2 -1,-0.1 1,-0.1 0, 0.0 0.645 76.2 15.8 -95.8 -20.7 0.8 45.2 -12.0 85 86 A D S S- 0 0 86 21,-0.0 3,-0.4 0, 0.0 -1,-0.1 -0.950 75.5-110.6-146.7 164.2 4.3 46.4 -12.9 86 87 A P S > S+ 0 0 12 0, 0.0 3,-1.2 0, 0.0 4,-0.3 -0.072 71.8 126.3 -87.5 35.8 7.6 47.3 -11.1 87 88 A G G > + 0 0 30 1,-0.2 3,-1.2 2,-0.2 4,-0.3 0.743 56.6 72.5 -67.6 -25.7 7.2 51.0 -12.0 88 89 A Y G > S+ 0 0 72 -3,-0.4 3,-1.3 1,-0.2 -1,-0.2 0.791 85.8 67.7 -56.4 -33.1 7.5 52.2 -8.4 89 90 A I G X S+ 0 0 0 -3,-1.2 3,-1.5 1,-0.2 -1,-0.2 0.780 86.1 68.2 -59.6 -31.2 11.3 51.4 -8.6 90 91 A D G < S+ 0 0 88 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.737 96.0 55.2 -65.0 -22.4 11.9 54.2 -11.1 91 92 A K G < S+ 0 0 67 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.523 90.8 98.7 -84.7 -7.7 11.1 56.8 -8.3 92 93 A L S < S- 0 0 59 -3,-1.5 2,-1.7 -4,-0.2 7,-0.1 -0.373 86.7-105.4 -82.6 160.3 13.8 55.4 -5.9 93 94 A E S S+ 0 0 187 -2,-0.1 -1,-0.1 2,-0.0 -2,-0.1 -0.580 75.7 121.2 -85.4 77.2 17.3 56.7 -5.3 94 95 A L - 0 0 25 -2,-1.7 5,-0.1 -5,-0.2 -2,-0.0 -0.984 68.9 -95.4-139.3 145.6 19.2 54.0 -7.3 95 96 A P >> - 0 0 73 0, 0.0 4,-2.1 0, 0.0 3,-0.7 -0.241 42.9-108.8 -57.1 153.0 21.6 54.1 -10.3 96 97 A G H 3> S+ 0 0 48 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.870 117.6 50.4 -52.8 -48.1 19.9 53.4 -13.6 97 98 A H H 3> S+ 0 0 55 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.781 109.5 52.4 -63.3 -29.0 21.4 49.9 -14.1 98 99 A V H <> S+ 0 0 7 -3,-0.7 4,-2.3 2,-0.2 5,-0.2 0.917 105.9 53.5 -73.4 -45.2 20.2 48.9 -10.6 99 100 A K H X S+ 0 0 47 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.921 110.5 48.1 -50.4 -47.4 16.7 50.0 -11.3 100 101 A K H X S+ 0 0 128 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.888 110.1 50.3 -68.1 -39.8 16.6 47.8 -14.4 101 102 A A H X S+ 0 0 0 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.898 113.3 46.3 -61.7 -40.6 18.0 44.7 -12.6 102 103 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.860 109.3 52.9 -76.1 -35.4 15.4 45.0 -9.8 103 104 A K H X S+ 0 0 38 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.916 111.2 48.5 -61.0 -43.0 12.5 45.6 -12.2 104 105 A F H X S+ 0 0 33 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.868 112.0 48.9 -63.2 -40.4 13.5 42.4 -14.0 105 106 A T H X S+ 0 0 1 -4,-1.8 4,-1.7 -61,-0.2 -2,-0.2 0.889 107.9 54.2 -66.8 -41.0 13.8 40.5 -10.7 106 107 A W H X S+ 0 0 23 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.922 114.5 40.9 -58.5 -46.3 10.4 41.8 -9.6 107 108 A E H < S+ 0 0 107 -4,-1.9 3,-0.4 1,-0.2 -2,-0.2 0.908 113.9 51.3 -68.9 -45.7 8.8 40.4 -12.9 108 109 A K H < S+ 0 0 110 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.764 104.5 58.6 -66.5 -27.3 10.8 37.1 -12.9 109 110 A L H X S- 0 0 11 -4,-1.7 4,-1.1 -5,-0.2 -1,-0.2 0.878 90.1-160.3 -70.1 -38.0 9.9 36.2 -9.3 110 111 A G H X - 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