==== 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 1QPZ . COMPND 2 MOLECULE: DNA (5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.GLASFELD,A.N.KOEHLER,M.A.SCHUMACHER,R.G.BRENNAN . 339 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17290.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 250 73.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 12.1 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 . 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 . 23 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 36.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 3.8 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 0 3 1 0 0 1 2 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 4 3 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 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 2 A A 0 0 85 0, 0.0 44,-0.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -57.7 19.9 -4.1 15.4 2 3 A T > - 0 0 62 1,-0.1 4,-2.2 42,-0.1 3,-0.4 -0.791 360.0-111.2-118.3 163.6 17.8 -1.8 13.2 3 4 A I H > S+ 0 0 45 -2,-0.3 4,-3.2 1,-0.3 5,-0.2 0.883 121.2 57.2 -56.7 -33.8 16.6 1.8 13.4 4 5 A K H > S+ 0 0 145 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.872 103.5 51.6 -62.2 -40.6 13.2 0.3 14.0 5 6 A D H > S+ 0 0 67 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.897 112.7 46.3 -68.2 -34.5 14.5 -1.6 17.0 6 7 A V H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.968 108.1 52.7 -69.8 -52.0 15.9 1.6 18.4 7 8 A A H X>S+ 0 0 6 -4,-3.2 5,-2.6 1,-0.2 4,-1.0 0.891 112.3 49.9 -49.4 -41.0 12.9 3.8 17.8 8 9 A K H <5S+ 0 0 166 -4,-1.9 3,-0.3 2,-0.2 -1,-0.2 0.909 108.5 47.6 -67.4 -46.6 10.9 1.2 19.7 9 10 A R H <5S+ 0 0 136 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.923 118.5 44.5 -61.3 -38.9 13.2 0.9 22.7 10 11 A A H <5S- 0 0 13 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.598 106.5-130.0 -78.9 -15.5 13.2 4.7 22.8 11 12 A N T <5S+ 0 0 144 -4,-1.0 2,-0.3 -3,-0.3 -3,-0.2 0.904 71.5 104.8 65.4 43.0 9.5 5.0 22.3 12 13 A V S - 0 0 60 -2,-0.3 4,-1.8 1,-0.1 5,-0.1 -0.411 32.7-118.0 -82.2 166.8 9.5 7.3 15.8 14 15 A T H > S+ 0 0 52 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.848 116.2 66.1 -70.4 -31.8 12.4 6.3 13.6 15 16 A T H > S+ 0 0 72 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.906 103.8 47.6 -55.4 -37.1 12.2 9.7 12.1 16 17 A T H >> S+ 0 0 24 2,-0.2 4,-2.0 1,-0.2 3,-0.6 0.974 108.6 51.3 -69.3 -49.8 13.2 10.9 15.4 17 18 A V H 3X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.3 5,-0.2 0.927 110.2 50.6 -53.3 -46.0 16.1 8.4 15.8 18 19 A S H 3X S+ 0 0 46 -4,-3.4 4,-1.7 1,-0.2 -1,-0.3 0.849 107.4 53.8 -62.7 -32.7 17.4 9.5 12.5 19 20 A H H S+ 0 0 33 -4,-1.4 5,-1.5 -3,-0.6 4,-0.9 0.862 111.6 44.0 -71.7 -35.7 17.3 13.2 13.4 20 21 A V H ><5S+ 0 0 6 -4,-2.0 3,-0.7 2,-0.2 -2,-0.2 0.932 112.6 52.4 -73.4 -43.1 19.3 12.8 16.6 21 22 A I H 3<5S+ 0 0 38 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.859 123.0 29.6 -60.7 -33.4 21.7 10.5 14.9 22 23 A N H 3<5S- 0 0 58 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.403 96.5-131.8-110.5 7.8 22.2 13.1 12.1 23 24 A K T <<5 + 0 0 161 -4,-0.9 -3,-0.2 -3,-0.7 -4,-0.1 0.890 59.8 142.7 44.3 46.8 21.5 16.4 14.1 24 25 A T < + 0 0 82 -5,-1.5 2,-0.3 1,-0.2 -1,-0.1 0.544 65.1 7.8 -95.7 -5.5 19.3 17.3 11.2 25 26 A R S S- 0 0 137 -6,-0.6 -1,-0.2 2,-0.0 2,-0.1 -0.969 94.0 -77.0-165.3 158.5 16.6 19.0 13.4 26 27 A F - 0 0 173 -2,-0.3 2,-0.4 -3,-0.1 -6,-0.1 -0.419 46.2-172.3 -66.8 137.5 16.2 20.0 17.0 27 28 A V - 0 0 13 -2,-0.1 5,-0.1 -8,-0.1 -1,-0.0 -0.997 31.8-101.4-136.3 134.7 15.3 17.3 19.5 28 29 A A > - 0 0 45 -2,-0.4 4,-3.4 1,-0.1 5,-0.2 -0.222 32.0-126.7 -52.0 134.1 14.3 17.5 23.1 29 30 A E H > S+ 0 0 126 1,-0.3 4,-3.4 2,-0.2 5,-0.2 0.942 112.4 48.8 -45.8 -61.7 17.3 16.7 25.3 30 31 A E H > S+ 0 0 162 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.859 113.2 49.5 -48.8 -39.3 15.4 14.1 27.2 31 32 A T H > S+ 0 0 43 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.981 110.2 49.4 -66.2 -52.6 14.4 12.7 23.8 32 33 A R H X S+ 0 0 80 -4,-3.4 4,-3.1 1,-0.2 -2,-0.2 0.920 109.8 52.0 -47.5 -56.1 17.9 12.7 22.5 33 34 A N H X S+ 0 0 84 -4,-3.4 4,-3.5 1,-0.2 -1,-0.2 0.916 106.5 52.3 -51.2 -49.5 19.2 10.9 25.5 34 35 A A H X S+ 0 0 39 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.924 110.7 48.4 -54.5 -47.5 16.7 8.2 25.3 35 36 A V H X S+ 0 0 0 -4,-2.2 4,-3.2 1,-0.2 -1,-0.2 0.945 111.9 49.2 -59.8 -47.4 17.6 7.6 21.8 36 37 A W H X S+ 0 0 88 -4,-3.1 4,-2.4 2,-0.2 -2,-0.2 0.946 110.7 50.7 -57.4 -46.6 21.3 7.6 22.7 37 38 A A H X S+ 0 0 49 -4,-3.5 4,-2.4 1,-0.2 5,-0.3 0.947 113.5 43.5 -53.9 -55.5 20.7 5.1 25.5 38 39 A A H X S+ 0 0 2 -4,-2.8 4,-2.7 1,-0.3 5,-0.3 0.920 109.4 57.9 -56.0 -46.4 18.7 2.8 23.3 39 40 A I H X>S+ 0 0 11 -4,-3.2 5,-2.5 -5,-0.3 4,-0.5 0.888 110.3 49.5 -52.1 -38.3 21.4 3.2 20.6 40 41 A K H <5S+ 0 0 155 -4,-2.4 3,-0.5 -5,-0.2 -2,-0.2 0.941 112.2 37.1 -72.5 -51.4 23.7 2.0 23.2 41 42 A E H <5S+ 0 0 99 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.967 116.7 55.3 -67.2 -43.1 22.3 -1.1 24.7 42 43 A L H <5S- 0 0 50 -4,-2.7 -1,-0.3 -5,-0.3 -2,-0.2 0.739 102.8-139.5 -57.5 -19.9 21.0 -2.1 21.3 43 44 A H T <5 - 0 0 169 -4,-0.5 -3,-0.2 -3,-0.5 2,-0.2 0.967 33.6-171.7 57.4 50.4 24.6 -1.7 20.2 44 45 A Y < - 0 0 39 -5,-2.5 -1,-0.2 -6,-0.2 -42,-0.1 -0.480 21.0-174.8 -78.0 147.0 23.3 -0.0 17.0 45 46 A S - 0 0 99 -44,-0.3 -42,-0.1 -2,-0.2 3,-0.0 -0.944 30.4-122.5-141.8 112.3 25.5 0.8 14.1 46 47 A P - 0 0 68 0, 0.0 2,-0.8 0, 0.0 3,-0.1 -0.273 24.9-114.5 -58.4 139.7 23.8 2.7 11.4 47 48 A S > - 0 0 57 1,-0.2 4,-2.8 2,-0.1 5,-0.2 -0.637 22.6-170.3 -84.3 114.8 23.8 1.1 8.0 48 49 A A H > S+ 0 0 67 -2,-0.8 4,-3.0 1,-0.2 5,-0.2 0.775 88.3 60.8 -67.7 -25.3 25.7 3.2 5.5 49 50 A V H > S+ 0 0 118 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.967 107.6 43.1 -65.3 -48.5 24.4 0.9 2.8 50 51 A A H >> S+ 0 0 59 1,-0.2 4,-1.6 2,-0.2 3,-0.6 0.969 116.6 48.6 -57.0 -57.2 20.9 1.8 3.6 51 52 A R H 3X S+ 0 0 119 -4,-2.8 4,-3.0 1,-0.3 5,-0.3 0.898 109.6 50.1 -53.3 -46.3 21.8 5.4 3.9 52 53 A S H 3X>S+ 0 0 24 -4,-3.0 4,-1.6 1,-0.2 5,-0.5 0.827 103.8 60.9 -65.0 -28.3 23.8 5.6 0.7 53 54 A L H <<5S+ 0 0 150 -4,-1.7 -1,-0.2 -3,-0.6 -2,-0.2 0.912 115.5 32.6 -62.5 -42.3 20.9 4.0 -1.0 54 55 A K H <5S+ 0 0 190 -4,-1.6 -2,-0.2 -3,-0.3 -3,-0.1 0.937 124.2 42.0 -77.5 -54.4 18.7 7.0 -0.0 55 56 A V H <5S- 0 0 52 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.632 99.5-131.2 -74.6 -14.0 21.2 9.9 -0.1 56 57 A N T <5S+ 0 0 134 -4,-1.6 2,-0.3 -5,-0.3 -3,-0.1 0.916 71.4 79.2 65.8 49.4 23.0 8.8 -3.2 57 58 A H < - 0 0 72 -5,-0.5 -2,-0.1 -6,-0.1 -1,-0.1 -0.854 57.2-151.8-178.1 144.3 26.7 8.9 -2.4 58 59 A T - 0 0 36 56,-0.4 3,-0.1 -2,-0.3 -6,-0.1 0.503 31.4-128.4-104.8 -9.2 28.9 6.4 -0.6 59 60 A K S S+ 0 0 86 1,-0.2 31,-1.5 30,-0.1 2,-0.4 0.930 72.3 118.5 57.1 46.7 31.5 8.6 0.9 60 61 A S E -a 90 0A 10 29,-0.2 56,-2.4 54,-0.2 57,-0.7 -1.000 49.6-155.7-146.2 142.0 34.0 6.3 -0.6 61 62 A I E -ab 91 117A 0 29,-3.1 31,-2.6 -2,-0.4 2,-0.5 -0.923 9.6-141.6-119.8 143.6 36.8 6.7 -3.2 62 63 A G E -ab 92 118A 0 55,-2.1 57,-3.0 -2,-0.4 2,-0.7 -0.887 4.1-157.2-108.8 132.6 38.4 4.2 -5.5 63 64 A L E -ab 93 119A 0 29,-2.9 31,-2.4 -2,-0.5 2,-1.4 -0.911 1.9-162.9-107.5 109.1 42.1 4.1 -6.4 64 65 A L E +ab 94 120A 0 55,-2.8 57,-3.1 -2,-0.7 31,-0.2 -0.731 30.7 170.4 -91.7 88.2 42.7 2.2 -9.7 65 66 A A E -a 95 0A 0 29,-2.3 31,-2.5 -2,-1.4 33,-0.2 -0.248 44.1-131.8 -90.2-179.8 46.5 1.7 -9.2 66 67 A T S S- 0 0 9 1,-0.6 31,-2.4 55,-0.3 2,-0.3 0.845 83.8 -34.3 -96.1 -51.2 49.1 -0.4 -11.0 67 68 A S - 0 0 14 29,-0.1 -1,-0.6 28,-0.1 29,-0.1 -0.933 47.9-143.6-162.4 167.3 50.6 -2.0 -7.9 68 69 A S S S+ 0 0 42 -2,-0.3 9,-0.1 -3,-0.1 -1,-0.0 0.449 82.2 69.0-125.1 -0.8 51.2 -0.9 -4.3 69 70 A E + 0 0 153 4,-0.1 5,-0.0 5,-0.1 -1,-0.0 0.867 69.6 101.4 -85.4 -40.0 54.4 -2.4 -3.0 70 71 A A S > S- 0 0 22 1,-0.1 4,-3.5 4,-0.1 5,-0.3 -0.221 80.4-126.6 -48.8 122.0 56.9 -0.3 -5.2 71 72 A A H > S+ 0 0 28 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.825 107.0 55.3 -40.1 -49.0 58.2 2.4 -2.9 72 73 A Y H >> S+ 0 0 35 1,-0.2 4,-1.4 2,-0.2 3,-0.6 0.979 116.2 36.4 -51.0 -63.5 57.2 5.1 -5.3 73 74 A F H 3> S+ 0 0 19 1,-0.3 4,-2.6 2,-0.2 3,-0.4 0.906 111.9 58.5 -56.3 -51.0 53.6 4.0 -5.4 74 75 A A H 3X S+ 0 0 35 -4,-3.5 4,-2.0 1,-0.2 -1,-0.3 0.844 104.2 52.7 -53.2 -33.9 53.4 3.0 -1.9 75 76 A E H X S+ 0 0 1 -4,-1.4 4,-2.7 -3,-0.4 3,-0.8 0.957 110.9 51.2 -68.8 -49.3 51.6 8.1 -2.9 77 78 A I H 3X S+ 0 0 19 -4,-2.6 4,-3.1 1,-0.3 5,-0.3 0.933 105.7 54.1 -53.9 -49.3 48.9 5.7 -1.8 78 79 A E H 3X S+ 0 0 97 -4,-2.0 4,-1.3 -5,-0.3 -1,-0.3 0.820 111.0 49.1 -58.0 -25.7 49.7 6.3 1.8 79 80 A A H <>S+ 0 0 1 -4,-2.2 5,-2.6 1,-0.2 3,-1.1 0.954 109.0 51.3 -52.9 -54.7 40.4 10.4 2.5 85 86 A F H ><5S+ 0 0 151 -4,-2.0 3,-1.6 1,-0.3 -1,-0.2 0.876 107.9 48.5 -52.8 -47.1 40.4 9.7 6.2 86 87 A Q H 3<5S+ 0 0 106 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.685 114.6 47.4 -74.0 -10.6 40.6 13.2 7.3 87 88 A K T <<5S- 0 0 90 -3,-1.1 -1,-0.3 -4,-1.1 -2,-0.2 0.097 120.8-107.7-111.1 20.1 37.8 14.1 5.0 88 89 A G T < 5S+ 0 0 52 -3,-1.6 -3,-0.2 1,-0.2 2,-0.2 0.501 73.2 136.1 68.2 7.3 35.7 11.2 6.1 89 90 A Y < - 0 0 22 -5,-2.6 2,-0.4 -6,-0.2 -29,-0.2 -0.509 48.5-134.5 -87.4 158.5 36.1 9.1 2.9 90 91 A T E -a 60 0A 85 -31,-1.5 -29,-3.1 -2,-0.2 2,-0.5 -0.870 19.7-134.0-108.8 138.5 36.8 5.4 2.7 91 92 A L E -a 61 0A 46 -2,-0.4 2,-0.7 -31,-0.2 -29,-0.2 -0.828 12.4-165.0-103.4 130.9 39.5 4.1 0.3 92 93 A I E -a 62 0A 52 -31,-2.6 -29,-2.9 -2,-0.5 2,-0.5 -0.951 16.6-152.9-112.5 115.0 39.0 1.1 -1.9 93 94 A L E +a 63 0A 70 -2,-0.7 2,-0.4 -31,-0.2 -29,-0.1 -0.766 16.7 176.3 -92.4 125.6 42.4 -0.0 -3.2 94 95 A G E -a 64 0A 0 -31,-2.4 -29,-2.3 -2,-0.5 2,-0.6 -0.917 13.7-162.8-134.4 116.3 42.6 -1.8 -6.6 95 96 A N E -a 65 0A 33 -2,-0.4 -29,-0.2 -31,-0.2 -28,-0.1 -0.837 7.7-179.9 -94.8 120.0 45.9 -2.9 -8.3 96 97 A A > - 0 0 0 -31,-2.5 3,-3.0 -2,-0.6 7,-0.3 0.422 27.2-142.7 -98.4 -2.9 45.4 -3.6 -12.0 97 98 A W T 3 - 0 0 148 -31,-2.4 -31,-0.1 1,-0.3 -30,-0.1 0.773 63.5 -66.5 45.5 37.7 49.0 -4.6 -12.8 98 99 A N T 3 S+ 0 0 53 -33,-0.2 2,-0.6 1,-0.2 -1,-0.3 0.798 100.5 140.5 57.0 30.2 48.9 -3.0 -16.1 99 100 A N <> - 0 0 59 -3,-3.0 4,-2.9 1,-0.2 -1,-0.2 -0.919 47.8-152.3-111.6 118.2 46.3 -5.6 -17.2 100 101 A L H > S+ 0 0 46 -2,-0.6 4,-3.6 1,-0.2 5,-0.2 0.903 98.3 48.7 -49.1 -51.2 43.4 -4.5 -19.4 101 102 A E H > S+ 0 0 124 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.927 113.3 47.8 -56.2 -47.7 41.1 -7.3 -18.1 102 103 A K H > S+ 0 0 90 -6,-0.3 4,-2.6 2,-0.2 5,-0.3 0.873 112.5 50.0 -61.3 -39.5 42.0 -6.4 -14.6 103 104 A Q H X S+ 0 0 5 -4,-2.9 4,-2.8 -7,-0.3 5,-0.3 0.972 109.6 49.3 -65.5 -50.8 41.4 -2.8 -15.3 104 105 A R H X S+ 0 0 119 -4,-3.6 4,-1.8 1,-0.2 -2,-0.2 0.903 113.7 49.3 -55.7 -39.3 38.1 -3.5 -16.9 105 106 A A H X S+ 0 0 45 -4,-2.6 4,-2.7 -5,-0.2 5,-0.3 0.952 113.2 41.5 -66.2 -52.0 37.1 -5.6 -13.8 106 107 A Y H X S+ 0 0 77 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.901 111.2 57.7 -63.7 -39.8 38.0 -3.2 -11.1 107 108 A L H X S+ 0 0 2 -4,-2.8 4,-2.2 -5,-0.3 -1,-0.2 0.934 111.4 43.3 -57.6 -42.9 36.6 -0.4 -13.0 108 109 A S H X S+ 0 0 35 -4,-1.8 4,-3.0 -5,-0.3 5,-0.2 0.933 110.6 51.4 -67.9 -49.1 33.3 -2.2 -13.0 109 110 A M H X S+ 0 0 88 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.885 111.9 51.8 -56.9 -35.1 33.2 -3.4 -9.5 110 111 A M H <>S+ 0 0 5 -4,-2.4 5,-1.2 -5,-0.3 4,-0.3 0.946 108.1 47.2 -64.9 -51.0 34.0 0.1 -8.6 111 112 A A H ><5S+ 0 0 13 -4,-2.2 3,-1.3 1,-0.2 -2,-0.2 0.910 113.5 51.2 -56.5 -45.6 31.1 1.7 -10.6 112 113 A Q H 3<5S+ 0 0 139 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.911 106.0 51.9 -61.0 -43.2 28.9 -0.9 -9.1 113 114 A K T 3<5S- 0 0 139 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.574 112.2-132.0 -71.3 -2.7 30.0 -0.1 -5.6 114 115 A R T < 5 - 0 0 164 -3,-1.3 -56,-0.4 -4,-0.3 -3,-0.2 0.953 27.8-164.9 52.3 60.0 29.1 3.4 -6.7 115 116 A V < - 0 0 9 -5,-1.2 -54,-0.2 1,-0.1 -1,-0.1 -0.485 24.1-127.5 -73.2 143.9 32.2 5.2 -5.5 116 117 A D S S- 0 0 24 -56,-2.4 2,-0.3 1,-0.2 -55,-0.2 0.777 83.6 -8.8 -65.7 -25.9 31.9 8.9 -5.4 117 118 A G E -b 61 0A 0 -57,-0.7 -55,-2.1 22,-0.1 2,-0.4 -0.983 64.5-121.7-165.5 163.2 35.0 9.4 -7.5 118 119 A L E -bc 62 141A 3 22,-3.1 24,-2.3 -2,-0.3 2,-0.6 -0.958 6.6-160.7-121.5 128.3 38.0 7.7 -9.0 119 120 A L E -bc 63 142A 0 -57,-3.0 -55,-2.8 -2,-0.4 2,-0.5 -0.901 24.2-156.1-100.7 120.3 41.8 8.3 -8.5 120 121 A V E +bc 64 143A 0 22,-2.6 24,-2.3 -2,-0.6 25,-0.4 -0.878 29.4 157.9-107.2 132.3 43.5 6.7 -11.5 121 122 A M + 0 0 5 -57,-3.1 -55,-0.3 -2,-0.5 3,-0.1 -0.516 16.4 144.4-150.3 71.3 47.2 5.6 -11.6 122 123 A C - 0 0 0 1,-0.1 2,-2.8 -57,-0.1 -57,-0.1 0.426 42.7-146.8 -92.5 -2.3 47.6 3.1 -14.4 123 124 A S S S+ 0 0 9 2,-0.1 67,-0.4 -25,-0.0 2,-0.4 -0.361 78.7 51.5 70.5 -70.0 51.1 3.9 -15.6 124 125 A E - 0 0 37 -2,-2.8 65,-0.1 65,-0.1 -26,-0.0 -0.836 65.1-163.8-106.1 140.8 50.5 3.0 -19.2 125 126 A Y + 0 0 29 63,-0.5 -2,-0.1 -2,-0.4 -1,-0.0 -0.565 12.0 176.7-125.8 73.4 47.5 4.4 -21.2 126 127 A P >> - 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