==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 01-JUN-99 1QP4 . COMPND 2 MOLECULE: DNA (5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.GLASFELD,A.N.KOEHLER,M.A.SCHUMACHER,R.G.BRENNAN . 338 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17091.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 244 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.2 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 . 0 0.0 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 . 20 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 36.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 3.6 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 0 0 0 1 2 1 0 0 1 3 1 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 5 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 0 PARALLEL BRIDGES PER LADDER . 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 1 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 3 A T > 0 0 92 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -33.7 17.4 -2.2 13.3 2 4 A I H > + 0 0 49 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.932 360.0 54.2 -63.0 -36.2 16.7 1.5 13.3 3 5 A K H > S+ 0 0 140 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.851 104.0 57.0 -60.3 -35.7 13.1 0.5 14.0 4 6 A D H > S+ 0 0 80 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.931 107.1 45.1 -66.0 -39.8 14.5 -1.4 16.9 5 7 A V H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 3,-0.4 0.984 112.0 51.7 -64.1 -52.4 16.1 1.6 18.4 6 8 A A H <>S+ 0 0 5 -4,-2.5 5,-1.9 1,-0.3 4,-0.4 0.891 109.0 51.3 -46.7 -50.6 13.1 3.7 17.9 7 9 A K H ><5S+ 0 0 162 -4,-2.3 3,-0.9 1,-0.2 -1,-0.3 0.875 108.2 50.5 -57.7 -44.3 10.9 1.2 19.6 8 10 A R H 3<5S+ 0 0 136 -4,-1.8 -1,-0.2 -3,-0.4 -2,-0.2 0.930 117.5 40.4 -62.1 -43.3 13.1 0.9 22.6 9 11 A A T 3<5S- 0 0 7 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.355 108.9-126.9 -86.9 5.2 13.1 4.6 23.0 10 12 A N T < 5S+ 0 0 137 -3,-0.9 2,-0.3 -4,-0.4 -3,-0.2 0.892 70.6 108.9 48.3 53.8 9.4 4.9 22.1 11 13 A V S - 0 0 55 -2,-0.3 4,-1.8 1,-0.1 5,-0.1 -0.221 35.2-120.3 -64.4 163.8 9.5 7.3 15.7 13 15 A T H > S+ 0 0 52 2,-0.2 4,-3.7 1,-0.2 -1,-0.1 0.820 114.3 68.4 -73.1 -34.4 12.5 6.1 13.8 14 16 A T H > S+ 0 0 70 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.930 102.3 46.6 -51.0 -42.9 12.4 9.5 12.1 15 17 A T H > S+ 0 0 26 2,-0.2 4,-2.5 1,-0.2 5,-0.4 0.996 108.0 52.9 -60.6 -64.2 13.3 10.8 15.5 16 18 A V H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.836 110.9 52.3 -34.9 -47.1 16.1 8.2 16.0 17 19 A S H >X S+ 0 0 44 -4,-3.7 4,-1.9 1,-0.2 3,-1.2 0.976 108.2 45.0 -55.8 -75.2 17.3 9.4 12.6 18 20 A H H 3X>S+ 0 0 32 -4,-2.2 5,-1.8 1,-0.3 4,-0.5 0.775 114.2 50.4 -40.6 -39.4 17.5 13.2 13.3 19 21 A V H ><5S+ 0 0 4 -4,-2.5 3,-0.7 2,-0.2 -1,-0.3 0.908 108.1 52.9 -70.7 -37.0 19.1 12.7 16.7 20 22 A I H <<5S+ 0 0 43 -4,-2.2 -2,-0.2 -3,-1.2 -1,-0.2 0.880 124.6 26.8 -63.5 -37.4 21.7 10.4 15.1 21 23 A N H 3<5S- 0 0 59 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.223 98.9-127.4-115.3 23.0 22.5 13.1 12.6 22 24 A K T <<5 + 0 0 158 -3,-0.7 -3,-0.2 -4,-0.5 -4,-0.1 0.883 58.8 148.0 35.1 53.5 21.6 16.2 14.5 23 25 A T < + 0 0 80 -5,-1.8 2,-0.3 1,-0.2 -1,-0.2 0.477 64.1 1.8 -99.1 2.4 19.5 17.1 11.5 24 26 A R S S- 0 0 145 -6,-0.4 -1,-0.2 2,-0.0 -2,-0.1 -0.902 97.1 -70.8-174.4 157.6 16.7 19.0 13.3 25 27 A F - 0 0 168 -2,-0.3 2,-0.4 -3,-0.1 -6,-0.1 -0.299 46.8-170.8 -66.4 144.5 16.1 19.9 17.0 26 28 A V - 0 0 16 -8,-0.1 5,-0.1 -7,-0.1 -1,-0.0 -0.975 30.3-101.9-145.2 132.3 15.2 17.3 19.6 27 29 A A > - 0 0 36 -2,-0.4 4,-3.9 3,-0.1 5,-0.2 -0.028 35.1-122.9 -41.7 136.9 14.1 17.4 23.1 28 30 A E H > S+ 0 0 132 2,-0.2 4,-3.6 1,-0.2 5,-0.2 0.969 110.9 44.0 -50.8 -65.5 17.0 16.6 25.5 29 31 A E H > S+ 0 0 149 2,-0.2 4,-3.7 1,-0.2 5,-0.2 0.901 114.6 50.1 -46.0 -50.4 15.3 13.7 27.2 30 32 A T H > S+ 0 0 41 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.969 111.9 48.3 -52.4 -56.1 14.2 12.4 23.9 31 33 A R H X S+ 0 0 79 -4,-3.9 4,-2.5 1,-0.2 -2,-0.2 0.931 112.8 49.2 -49.9 -50.6 17.7 12.7 22.6 32 34 A N H X S+ 0 0 78 -4,-3.6 4,-2.6 1,-0.2 -1,-0.2 0.945 106.9 53.7 -57.0 -51.6 18.9 10.9 25.7 33 35 A A H X S+ 0 0 37 -4,-3.7 4,-2.9 1,-0.2 -1,-0.2 0.877 110.3 47.7 -49.1 -45.2 16.5 8.1 25.4 34 36 A V H X S+ 0 0 0 -4,-2.2 4,-3.4 1,-0.2 -1,-0.2 0.915 109.5 51.8 -65.4 -45.0 17.6 7.4 21.9 35 37 A W H X S+ 0 0 89 -4,-2.5 4,-1.9 -5,-0.3 -1,-0.2 0.901 110.5 52.2 -60.2 -34.0 21.2 7.5 22.7 36 38 A A H X S+ 0 0 44 -4,-2.6 4,-2.7 2,-0.2 3,-0.3 0.976 111.6 41.6 -61.9 -59.5 20.4 5.1 25.4 37 39 A A H X S+ 0 0 1 -4,-2.9 4,-2.7 1,-0.3 5,-0.3 0.904 110.8 60.7 -53.4 -44.4 18.6 2.6 23.2 38 40 A I H <>S+ 0 0 3 -4,-3.4 5,-2.3 -5,-0.2 4,-0.4 0.902 109.2 43.2 -54.0 -40.3 21.3 3.2 20.7 39 41 A K H ><5S+ 0 0 133 -4,-1.9 3,-1.1 -3,-0.3 -2,-0.2 0.977 113.8 45.4 -74.7 -50.5 23.8 2.0 23.3 40 42 A E H 3<5S+ 0 0 104 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.967 113.4 50.0 -56.2 -53.0 22.0 -1.0 24.7 41 43 A L T 3<5S- 0 0 60 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.702 107.6-130.8 -60.3 -11.5 21.1 -2.3 21.3 42 44 A H T < 5 - 0 0 174 -3,-1.1 2,-0.4 -4,-0.4 -3,-0.2 0.998 38.7-163.0 57.6 65.3 24.7 -1.8 20.3 43 45 A Y < + 0 0 32 -5,-2.3 -1,-0.2 -6,-0.1 -2,-0.0 -0.730 28.7 174.1 -94.6 131.1 23.5 0.1 17.2 44 46 A S - 0 0 101 -2,-0.4 2,-0.3 -3,-0.1 -42,-0.0 -0.995 31.5-131.7-129.1 121.9 25.6 0.8 14.2 45 47 A P - 0 0 64 0, 0.0 2,-0.4 0, 0.0 3,-0.1 -0.571 25.7-107.8 -79.7 142.3 23.6 2.3 11.4 46 48 A S > - 0 0 54 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 -0.489 21.6-163.7 -69.9 124.3 24.0 0.9 8.0 47 49 A A H > S+ 0 0 69 -2,-0.4 4,-3.7 1,-0.2 5,-0.2 0.848 91.6 59.0 -75.7 -31.9 25.9 3.1 5.6 48 50 A V H > S+ 0 0 111 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.903 105.1 46.9 -66.6 -34.7 24.6 1.0 2.8 49 51 A A H > S+ 0 0 62 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.985 117.6 46.1 -64.5 -52.1 21.0 1.8 3.6 50 52 A R H >X S+ 0 0 125 -4,-2.2 4,-2.8 1,-0.2 3,-0.5 0.894 109.5 50.9 -54.1 -47.1 22.0 5.3 4.0 51 53 A S H 3X>S+ 0 0 27 -4,-3.7 4,-2.5 1,-0.3 5,-0.5 0.898 104.1 61.5 -58.8 -38.1 24.0 5.5 0.8 52 54 A L H 3<5S+ 0 0 149 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.839 114.8 32.9 -54.9 -40.7 21.0 4.0 -1.0 53 55 A K H <<5S+ 0 0 188 -4,-1.5 -2,-0.2 -3,-0.5 -1,-0.2 0.955 122.0 43.5 -83.2 -55.2 19.0 6.9 -0.0 54 56 A V H <5S- 0 0 55 -4,-2.8 -2,-0.2 -5,-0.1 -3,-0.2 0.600 99.3-131.6 -67.7 -16.5 21.5 9.8 0.0 55 57 A N T <5S+ 0 0 140 -4,-2.5 2,-0.3 -5,-0.3 -3,-0.1 0.815 73.3 75.4 68.9 38.9 23.2 8.8 -3.2 56 58 A H < - 0 0 71 -5,-0.5 -2,-0.1 -6,-0.1 58,-0.1 -0.868 60.3-150.3-170.6 140.9 26.9 8.9 -2.5 57 59 A T - 0 0 30 56,-0.5 3,-0.1 -2,-0.3 -6,-0.1 0.481 32.0-125.6 -99.9 -4.6 28.9 6.4 -0.5 58 60 A K S S+ 0 0 90 1,-0.2 31,-1.0 30,-0.1 2,-0.4 0.956 73.1 118.5 57.3 48.9 31.6 8.6 0.9 59 61 A S E -a 89 0A 22 29,-0.2 56,-2.4 54,-0.2 57,-0.7 -0.994 49.6-153.8-145.8 143.8 34.2 6.2 -0.6 60 62 A I E -ab 90 116A 0 29,-3.4 31,-2.7 -2,-0.4 2,-0.5 -0.942 10.4-136.4-124.7 142.8 36.8 6.7 -3.2 61 63 A G E -ab 91 117A 0 55,-2.3 57,-3.8 -2,-0.4 2,-0.8 -0.853 7.3-162.2-103.5 125.6 38.5 4.3 -5.6 62 64 A L E -ab 92 118A 0 29,-3.1 31,-3.4 -2,-0.5 2,-1.3 -0.889 4.8-167.0-107.1 104.6 42.2 4.2 -6.3 63 65 A L E +ab 93 119A 0 55,-3.2 57,-2.5 -2,-0.8 31,-0.2 -0.749 28.1 169.9 -92.6 90.0 42.8 2.3 -9.5 64 66 A A E -a 94 0A 1 29,-3.0 31,-2.7 -2,-1.3 32,-0.3 -0.401 42.9-130.3-100.8 178.4 46.5 1.7 -9.2 65 67 A T S S- 0 0 9 55,-0.5 31,-1.6 1,-0.4 2,-0.3 0.941 83.1 -23.6 -89.1 -61.7 49.2 -0.2 -10.8 66 68 A S - 0 0 18 29,-0.1 -1,-0.4 30,-0.1 29,-0.1 -0.967 48.5-156.8-148.9 151.1 51.1 -1.9 -8.0 67 69 A S S S+ 0 0 45 -2,-0.3 9,-0.1 -3,-0.1 -1,-0.0 0.505 81.0 70.0-115.3 -3.1 51.2 -0.9 -4.4 68 70 A E S S+ 0 0 157 4,-0.1 2,-0.1 5,-0.1 -1,-0.1 0.834 72.0 101.8 -82.4 -33.1 54.5 -2.5 -3.2 69 71 A A S > S- 0 0 21 1,-0.1 4,-4.3 4,-0.1 5,-0.3 -0.300 78.4-128.7 -55.9 124.6 56.8 -0.3 -5.1 70 72 A A H > S+ 0 0 26 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.818 107.9 49.8 -38.3 -49.7 58.2 2.3 -2.9 71 73 A Y H > S+ 0 0 33 2,-0.2 4,-1.9 1,-0.2 3,-0.3 0.994 117.9 40.6 -58.6 -60.3 57.3 5.2 -5.2 72 74 A F H > S+ 0 0 19 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.927 112.6 54.5 -52.0 -50.3 53.8 3.9 -5.4 73 75 A A H X S+ 0 0 34 -4,-4.3 4,-2.4 1,-0.2 -1,-0.2 0.895 105.6 51.8 -51.5 -46.1 53.5 3.0 -1.9 74 76 A E H X S+ 0 0 18 -4,-2.5 4,-1.2 -5,-0.3 -1,-0.2 0.900 110.3 48.3 -61.1 -44.6 54.4 6.4 -0.7 75 77 A I H X S+ 0 0 2 -4,-1.9 4,-2.3 1,-0.2 3,-0.5 0.945 109.9 53.2 -62.4 -49.7 51.8 8.1 -2.8 76 78 A I H X S+ 0 0 20 -4,-2.7 4,-3.0 1,-0.3 5,-0.2 0.941 103.4 53.7 -52.3 -52.6 49.1 5.8 -1.8 77 79 A E H X S+ 0 0 103 -4,-2.4 4,-2.2 1,-0.2 -1,-0.3 0.845 109.4 53.3 -51.0 -34.0 49.7 6.2 1.9 78 80 A A H X S+ 0 0 12 -4,-1.2 4,-2.1 -3,-0.5 -1,-0.2 0.974 107.4 47.2 -63.3 -58.7 49.3 9.9 1.2 79 81 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.935 110.3 54.0 -49.1 -53.2 46.0 9.7 -0.5 80 82 A E H X S+ 0 0 88 -4,-3.0 4,-2.7 1,-0.2 5,-0.3 0.913 105.0 55.2 -49.0 -47.8 44.7 7.4 2.2 81 83 A K H X S+ 0 0 140 -4,-2.2 4,-2.0 1,-0.3 -1,-0.2 0.924 109.5 46.3 -48.8 -55.1 45.7 10.1 4.7 82 84 A N H X S+ 0 0 21 -4,-2.1 4,-1.1 1,-0.2 -1,-0.3 0.830 109.8 52.6 -57.5 -43.0 43.6 12.6 2.9 83 85 A C H ><>S+ 0 0 1 -4,-2.4 5,-3.1 1,-0.2 3,-1.2 0.965 111.7 46.0 -60.8 -52.7 40.6 10.4 2.5 84 86 A F H ><5S+ 0 0 158 -4,-2.7 3,-1.6 1,-0.3 -1,-0.2 0.872 106.1 59.9 -55.0 -40.8 40.5 9.6 6.2 85 87 A Q H 3<5S+ 0 0 129 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.780 113.7 36.0 -61.1 -29.0 40.9 13.2 7.1 86 88 A K T <<5S- 0 0 91 -3,-1.2 -1,-0.3 -4,-1.1 -2,-0.2 -0.090 121.4 -98.6-115.8 30.8 37.7 14.1 5.2 87 89 A G T < 5S+ 0 0 48 -3,-1.6 2,-0.2 1,-0.2 -3,-0.2 0.605 76.6 139.0 64.7 14.2 35.7 11.0 6.0 88 90 A Y < - 0 0 27 -5,-3.1 2,-0.4 -6,-0.2 -29,-0.2 -0.632 44.8-138.7 -91.8 155.6 36.3 9.2 2.8 89 91 A T E -a 59 0A 74 -31,-1.0 -29,-3.4 -2,-0.2 2,-0.5 -0.867 17.4-128.8-109.1 141.2 37.0 5.5 2.7 90 92 A L E -a 60 0A 47 -2,-0.4 2,-0.7 -31,-0.2 -29,-0.2 -0.800 15.8-169.1-100.9 129.0 39.7 4.0 0.4 91 93 A I E -a 61 0A 58 -31,-2.7 -29,-3.1 -2,-0.5 2,-0.6 -0.947 17.0-158.6-112.1 115.8 39.1 1.2 -2.0 92 94 A L E +a 62 0A 72 -2,-0.7 2,-0.4 -31,-0.2 -29,-0.2 -0.802 15.8 172.3 -96.3 123.7 42.5 0.1 -3.2 93 95 A G E -a 63 0A 0 -31,-3.4 -29,-3.0 -2,-0.6 2,-0.6 -0.973 18.0-157.5-137.4 133.7 42.7 -1.8 -6.5 94 96 A N E -a 64 0A 28 -2,-0.4 -29,-0.2 -31,-0.2 -31,-0.1 -0.906 8.1-177.8-106.8 109.8 45.8 -2.8 -8.5 95 97 A A > - 0 0 0 -31,-2.7 3,-2.3 -2,-0.6 7,-0.3 0.434 29.1-141.8 -85.4 0.4 45.3 -3.6 -12.2 96 98 A W T 3 - 0 0 138 -31,-1.6 -31,-0.1 -32,-0.3 -30,-0.1 0.762 63.0 -66.8 46.2 33.6 48.9 -4.6 -12.9 97 99 A N T 3 S+ 0 0 58 -33,-0.2 2,-0.5 1,-0.2 -1,-0.3 0.909 103.3 136.1 59.0 37.8 48.9 -2.9 -16.2 98 100 A N X> - 0 0 69 -3,-2.3 4,-3.3 1,-0.2 3,-0.6 -0.889 49.6-152.0-126.7 107.6 46.4 -5.5 -17.4 99 101 A L H 3> S+ 0 0 51 -2,-0.5 4,-3.5 1,-0.3 5,-0.3 0.849 97.0 48.6 -36.7 -58.1 43.5 -4.3 -19.4 100 102 A E H 3> S+ 0 0 120 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.911 113.6 46.7 -55.2 -43.7 41.2 -7.2 -18.3 101 103 A K H <> S+ 0 0 91 -3,-0.6 4,-3.0 -6,-0.3 -1,-0.2 0.909 114.6 49.4 -65.7 -40.5 42.1 -6.6 -14.6 102 104 A Q H X S+ 0 0 6 -4,-3.3 4,-2.9 -7,-0.3 -2,-0.2 0.917 108.3 50.2 -69.6 -36.4 41.5 -3.0 -15.2 103 105 A R H X S+ 0 0 115 -4,-3.5 4,-3.1 -5,-0.2 5,-0.2 0.977 114.4 48.1 -61.4 -49.4 38.2 -3.4 -16.9 104 106 A A H X S+ 0 0 42 -4,-2.7 4,-2.5 -5,-0.3 5,-0.3 0.945 112.1 45.7 -51.8 -58.5 37.2 -5.6 -13.9 105 107 A Y H X S+ 0 0 75 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.953 112.6 52.6 -53.6 -48.0 38.4 -3.3 -11.2 106 108 A L H X S+ 0 0 2 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.943 109.3 48.7 -52.8 -54.3 36.7 -0.4 -13.0 107 109 A S H X S+ 0 0 39 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.878 109.2 50.5 -56.0 -42.8 33.4 -2.2 -13.2 108 110 A M H X S+ 0 0 91 -4,-2.5 4,-3.4 -5,-0.2 5,-0.3 0.945 109.0 54.5 -64.6 -38.4 33.3 -3.2 -9.6 109 111 A M H <>S+ 0 0 6 -4,-2.5 5,-1.7 -5,-0.3 4,-0.3 0.926 108.5 45.8 -58.6 -44.6 34.1 0.3 -8.6 110 112 A A H ><5S+ 0 0 17 -4,-2.3 3,-1.1 3,-0.2 -1,-0.2 0.956 114.3 51.2 -60.7 -46.8 31.1 1.7 -10.6 111 113 A Q H 3<5S+ 0 0 140 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.903 108.6 46.9 -55.6 -48.3 29.0 -0.9 -9.1 112 114 A K T 3<5S- 0 0 148 -4,-3.4 -1,-0.3 -5,-0.2 -2,-0.2 0.519 113.4-131.7 -74.8 -0.4 30.1 -0.2 -5.6 113 115 A R T < 5 - 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