==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 19-FEB-99 1B97 . COMPND 2 MOLECULE: DNA (5'-D(*AP*AP*AP*GP*AP*TP*AP*TP*CP*TP*T)-3'); . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.P.THOMAS,S.E.HALFORD,R.L.BRADY . 488 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22896.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 296 60.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 72 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 18 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 109 22.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.4 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 4 0 2 0 0 3 1 0 0 0 0 2 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 7 2 6 0 1 0 1 1 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 1 0 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 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 S > 0 0 94 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 172.2 7.9 2.1 31.9 2 3 A L H > + 0 0 15 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.946 360.0 47.8 -62.0 -48.5 8.7 1.1 28.3 3 4 A R H > S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.893 112.7 46.2 -61.1 -44.6 5.2 2.1 27.2 4 5 A S H > S+ 0 0 48 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.892 114.7 47.5 -69.4 -37.3 5.2 5.5 29.0 5 6 A D H X S+ 0 0 49 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.896 111.7 52.2 -68.2 -38.7 8.7 6.4 27.7 6 7 A L H X S+ 0 0 1 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.935 111.8 43.0 -65.2 -48.8 7.8 5.4 24.2 7 8 A I H X S+ 0 0 41 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.896 112.5 54.7 -69.1 -34.2 4.7 7.5 23.9 8 9 A N H X S+ 0 0 109 -4,-2.1 4,-2.1 -5,-0.2 -2,-0.2 0.941 112.1 44.2 -58.2 -47.8 6.5 10.4 25.6 9 10 A A H X S+ 0 0 15 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.845 114.0 48.4 -65.5 -39.2 9.3 10.2 22.9 10 11 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.933 111.8 49.8 -66.7 -46.3 6.9 9.8 20.0 11 12 A Y H X S+ 0 0 123 -4,-2.6 4,-1.7 -5,-0.2 -2,-0.2 0.929 114.4 45.5 -57.4 -45.5 4.8 12.7 21.2 12 13 A D H X S+ 0 0 64 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.930 110.9 50.7 -65.8 -47.7 7.9 14.9 21.5 13 14 A E H X S+ 0 0 27 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.895 109.8 52.3 -59.7 -39.5 9.5 13.9 18.2 14 15 A N H < S+ 0 0 29 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.898 109.5 50.1 -60.6 -43.7 6.1 14.7 16.5 15 16 A Q H < S+ 0 0 115 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.835 117.9 36.8 -65.6 -36.9 6.1 18.2 18.1 16 17 A K H < S+ 0 0 121 -4,-2.0 2,-0.4 1,-0.1 -2,-0.2 0.653 110.8 53.4 -93.9 -22.5 9.7 19.1 17.1 17 18 A Y < - 0 0 66 -4,-1.9 2,-0.5 -5,-0.2 -1,-0.1 -0.971 52.6-168.3-125.0 139.3 10.2 17.7 13.6 18 19 A D - 0 0 55 -2,-0.4 252,-2.8 -3,-0.0 253,-0.2 -0.944 20.2-138.4-123.9 109.1 8.3 18.0 10.3 19 20 A V E +A 269 0A 5 -2,-0.5 250,-0.3 250,-0.3 3,-0.1 -0.405 28.0 168.5 -63.6 137.3 9.1 15.7 7.4 20 21 A C E - 0 0 1 248,-3.0 12,-0.6 1,-0.3 2,-0.3 0.450 51.2 -26.3-134.9 1.9 9.1 17.6 4.1 21 22 A G E -AB 268 31A 0 247,-1.1 247,-3.2 10,-0.2 -1,-0.3 -0.981 61.2 -81.8 171.5 178.7 10.7 15.3 1.4 22 23 A I E -AB 267 30A 0 8,-2.5 8,-2.6 -2,-0.3 2,-0.4 -0.824 41.2-151.9-103.0 145.1 13.0 12.5 0.3 23 24 A I E -AB 266 29A 0 243,-2.8 242,-2.9 -2,-0.3 243,-1.0 -0.942 2.9-140.8-124.1 147.9 16.7 13.3 -0.2 24 25 A S E > -A 264 0A 0 4,-2.0 3,-2.2 -2,-0.4 240,-0.3 -0.651 31.1-109.5 -97.3 164.8 19.3 11.7 -2.4 25 26 A A T 3 S+ 0 0 6 238,-2.5 239,-0.1 1,-0.3 -1,-0.1 0.792 120.8 57.6 -63.5 -24.8 23.0 11.0 -1.5 26 27 A E T 3 S- 0 0 96 237,-0.2 -1,-0.3 2,-0.1 238,-0.1 0.512 123.3-104.3 -80.8 -9.8 23.9 13.9 -3.9 27 28 A G S < S+ 0 0 11 -3,-2.2 125,-0.4 1,-0.3 2,-0.3 0.468 71.7 139.7 99.3 4.0 21.7 16.3 -1.9 28 29 A K - 0 0 37 123,-0.1 -4,-2.0 124,-0.1 2,-0.5 -0.645 38.9-147.5 -83.9 134.7 18.7 16.7 -4.2 29 30 A I E -BC 23 150A 0 121,-3.0 121,-2.2 -2,-0.3 -6,-0.2 -0.883 7.7-160.9-113.3 131.9 15.3 16.9 -2.4 30 31 A Y E -B 22 0A 0 -8,-2.6 -8,-2.5 -2,-0.5 119,-0.1 -0.933 23.9-123.9-109.4 121.7 12.0 15.6 -3.8 31 32 A P E -B 21 0A 0 0, 0.0 2,-0.2 0, 0.0 -10,-0.2 -0.083 29.9 -98.6 -60.6 161.3 8.8 17.0 -2.3 32 33 A L - 0 0 2 -12,-0.6 2,-0.1 127,-0.4 7,-0.0 -0.555 26.8-132.3 -87.1 150.9 6.1 14.8 -0.7 33 34 A G - 0 0 3 -2,-0.2 -1,-0.1 1,-0.1 257,-0.0 -0.375 21.6-116.4 -89.6 172.4 2.8 13.6 -2.4 34 35 A S S S+ 0 0 13 -2,-0.1 106,-0.1 4,-0.1 -1,-0.1 0.562 70.7 114.5 -91.8 -10.1 -0.6 13.8 -0.7 35 36 A D > - 0 0 59 1,-0.1 4,-1.5 4,-0.0 5,-0.1 0.020 69.1-131.7 -51.1 168.3 -1.6 10.1 -0.4 36 37 A T H > S+ 0 0 29 2,-0.2 4,-3.6 3,-0.2 5,-0.4 0.777 112.4 64.1 -87.6 -23.8 -2.1 8.2 2.8 37 38 A K H > S+ 0 0 87 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.946 107.6 40.4 -60.9 -44.8 0.2 5.7 1.0 38 39 A V H > S+ 0 0 8 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.952 119.3 43.4 -67.1 -52.3 2.9 8.3 1.1 39 40 A L H X S+ 0 0 0 -4,-1.5 4,-3.1 2,-0.2 5,-0.3 0.906 110.2 56.1 -69.3 -31.4 2.3 9.6 4.6 40 41 A S H X S+ 0 0 20 -4,-3.6 4,-1.6 1,-0.2 -1,-0.2 0.931 111.4 45.7 -60.6 -43.0 1.8 6.1 6.0 41 42 A T H X S+ 0 0 6 -4,-1.5 4,-2.1 -5,-0.4 -2,-0.2 0.925 112.8 49.3 -63.8 -47.5 5.3 5.3 4.7 42 43 A I H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.940 110.3 49.8 -60.6 -47.5 6.8 8.5 6.0 43 44 A F H X S+ 0 0 10 -4,-3.1 4,-1.3 2,-0.2 -1,-0.2 0.804 109.2 52.2 -65.4 -30.0 5.3 8.0 9.6 44 45 A E H X S+ 0 0 40 -4,-1.6 4,-1.5 -5,-0.3 3,-0.3 0.952 112.6 44.3 -66.3 -48.8 6.6 4.5 9.8 45 46 A L H < S+ 0 0 3 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.835 111.5 54.7 -64.8 -31.1 10.1 5.6 8.8 46 47 A F H < S+ 0 0 5 -4,-2.2 4,-0.4 1,-0.2 -1,-0.2 0.826 110.1 46.7 -71.5 -30.0 9.9 8.5 11.2 47 48 A S H X S+ 0 0 0 -4,-1.3 4,-2.8 -3,-0.3 3,-0.2 0.757 92.2 82.2 -82.2 -28.5 9.0 6.2 14.1 48 49 A R H X S+ 0 0 3 -4,-1.5 4,-2.4 1,-0.2 5,-0.2 0.879 93.4 41.5 -45.8 -58.7 11.7 3.6 13.6 49 50 A P H > S+ 0 0 13 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.846 115.1 52.8 -63.4 -35.7 14.7 5.3 15.3 50 51 A I H > S+ 0 0 8 -4,-0.4 4,-2.3 -3,-0.2 5,-0.2 0.943 109.7 47.3 -64.7 -49.8 12.5 6.4 18.2 51 52 A I H X S+ 0 0 1 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.958 113.4 49.3 -56.9 -50.0 11.2 2.9 18.8 52 53 A N H X S+ 0 0 26 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.891 110.2 50.3 -57.0 -45.2 14.7 1.5 18.7 53 54 A K H X S+ 0 0 130 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.932 115.3 41.8 -59.8 -48.4 16.1 4.1 21.1 54 55 A I H X S+ 0 0 4 -4,-2.3 4,-0.7 2,-0.2 3,-0.4 0.941 113.6 52.1 -68.3 -43.5 13.4 3.5 23.7 55 56 A A H ><>S+ 0 0 0 -4,-2.9 5,-2.8 -5,-0.2 3,-1.3 0.911 106.9 54.5 -56.3 -46.0 13.5 -0.3 23.3 56 57 A E H ><5S+ 0 0 129 -4,-2.3 3,-1.4 1,-0.3 -1,-0.2 0.849 101.7 58.0 -58.4 -37.1 17.3 -0.3 23.8 57 58 A K H 3<5S+ 0 0 121 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.650 108.1 46.3 -68.9 -19.5 17.0 1.6 27.1 58 59 A H T <<5S- 0 0 49 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.116 122.8-105.7-106.8 18.4 14.7 -1.1 28.5 59 60 A G T < 5S+ 0 0 46 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.664 74.3 142.2 67.3 21.8 17.1 -3.8 27.3 60 61 A Y < - 0 0 32 -5,-2.8 2,-0.3 -6,-0.2 -1,-0.2 -0.696 43.6-141.4 -94.8 141.9 14.7 -4.8 24.4 61 62 A I E -F 77 0B 74 16,-2.0 16,-1.2 -2,-0.3 2,-0.5 -0.761 15.3-136.5 -97.6 149.0 16.0 -5.9 21.0 62 63 A V E -F 76 0B 21 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.918 19.4-175.1-110.9 131.2 14.0 -4.7 17.9 63 64 A E E -F 75 0B 37 12,-1.9 12,-2.0 -2,-0.5 3,-0.1 -0.994 7.2-160.1-126.0 126.3 13.3 -7.1 15.0 64 65 A E - 0 0 34 -2,-0.4 10,-0.1 10,-0.2 9,-0.1 -0.641 47.7 -68.8 -99.3 159.5 11.6 -6.1 11.8 65 66 A P - 0 0 41 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.171 36.3-159.7 -48.8 136.6 9.9 -8.6 9.5 66 67 A K S S+ 0 0 67 1,-0.1 2,-0.3 -3,-0.1 -2,-0.0 0.817 83.4 40.5 -87.3 -34.9 12.5 -10.9 7.8 67 68 A Q S > S- 0 0 123 1,-0.1 3,-0.6 -3,-0.0 -1,-0.1 -0.814 98.7-104.1-108.0 153.0 10.0 -11.7 5.1 68 69 A L T 3 S+ 0 0 62 -2,-0.3 3,-0.1 1,-0.2 -2,-0.1 -0.330 98.5 29.5 -74.1 158.1 7.6 -9.3 3.5 69 70 A N T 3 S+ 0 0 143 1,-0.2 2,-0.5 -4,-0.1 -1,-0.2 0.794 86.8 128.3 62.3 36.7 3.9 -9.2 4.5 70 71 A H < - 0 0 39 -3,-0.6 50,-0.3 2,-0.1 -1,-0.2 -0.975 55.4-100.0-122.0 127.1 4.4 -10.4 8.0 71 72 A Y B S+j 120 0C 19 48,-2.8 50,-2.4 -2,-0.5 51,-0.2 -0.552 80.7 49.2 -80.4 150.9 3.0 -8.6 11.1 72 73 A P - 0 0 0 0, 0.0 17,-0.2 0, 0.0 3,-0.1 0.659 56.5-145.1-103.6-179.4 4.0 -6.8 13.0 73 74 A D S S+ 0 0 33 1,-0.2 2,-0.4 15,-0.2 16,-0.2 0.910 93.1 16.4 -57.0 -49.0 6.0 -3.8 12.0 74 75 A F E - G 0 88B 0 14,-2.4 14,-3.0 -10,-0.1 2,-0.5 -0.996 64.6-162.7-132.0 134.9 8.2 -4.1 15.1 75 76 A T E -FG 63 87B 0 -12,-2.0 -12,-1.9 -2,-0.4 2,-0.4 -0.973 13.5-170.1-116.9 117.9 8.8 -7.0 17.5 76 77 A L E +FG 62 86B 1 10,-3.1 10,-3.0 -2,-0.5 2,-0.3 -0.879 17.0 145.4-108.9 143.6 10.4 -6.2 20.9 77 78 A Y E -F 61 0B 40 -16,-1.2 -16,-2.0 -2,-0.4 8,-0.1 -0.912 42.3-123.2-172.7 147.0 11.6 -8.7 23.4 78 79 A K > - 0 0 55 3,-0.4 3,-2.0 -2,-0.3 6,-0.2 -0.741 29.1-126.8 -90.7 143.4 14.3 -9.4 26.1 79 80 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -19,-0.1 0.757 111.5 57.7 -59.3 -26.0 16.3 -12.5 25.5 80 81 A S T 3 S+ 0 0 97 1,-0.2 3,-0.1 2,-0.1 -3,-0.0 0.401 109.9 44.8 -84.4 -1.8 15.4 -13.6 29.1 81 82 A E X + 0 0 49 -3,-2.0 3,-1.6 1,-0.1 -3,-0.4 -0.489 63.2 159.3-141.3 66.5 11.7 -13.4 28.2 82 83 A P T 3 S+ 0 0 65 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.789 77.7 49.8 -63.6 -29.3 11.2 -15.1 24.8 83 84 A N T 3 S+ 0 0 98 1,-0.2 -6,-0.0 -3,-0.1 -3,-0.0 0.199 98.6 70.0 -97.4 17.6 7.5 -15.7 25.4 84 85 A K < + 0 0 104 -3,-1.6 -6,-0.2 -6,-0.2 -1,-0.2 -0.351 68.6 156.7-126.3 50.8 6.8 -12.1 26.4 85 86 A K E - h 0 127B 8 41,-2.7 43,-2.3 -3,-0.3 44,-1.0 -0.424 33.0-141.3 -76.9 151.7 7.3 -10.4 23.1 86 87 A I E -Gh 76 129B 8 -10,-3.0 -10,-3.1 41,-0.2 2,-0.5 -0.971 8.8-153.5-116.8 127.2 5.7 -7.1 22.3 87 88 A A E -Gh 75 130B 0 42,-2.4 44,-3.3 -2,-0.5 2,-0.4 -0.870 10.1-171.2-102.7 129.3 4.2 -6.4 18.8 88 89 A I E -Gh 74 131B 0 -14,-3.0 -14,-2.4 -2,-0.5 2,-0.4 -0.988 3.0-176.7-123.7 127.1 4.1 -2.7 17.6 89 90 A D E - h 0 132B 11 42,-2.1 44,-2.7 -2,-0.4 2,-0.5 -0.982 18.1-140.1-123.6 136.5 2.2 -1.8 14.4 90 91 A I E - h 0 133B 8 -2,-0.4 2,-0.4 42,-0.2 44,-0.2 -0.833 23.1-178.7-102.1 124.5 2.1 1.7 12.9 91 92 A K E - h 0 134B 29 42,-2.7 44,-2.6 -2,-0.5 2,-0.4 -0.966 4.8-167.2-124.2 142.3 -1.3 2.8 11.5 92 93 A T E + h 0 135B 22 -2,-0.4 2,-0.3 42,-0.2 44,-0.2 -0.981 11.1 164.6-132.0 143.1 -2.2 6.1 9.8 93 94 A T E - h 0 136B 23 42,-2.1 44,-1.3 -2,-0.4 2,-0.2 -0.888 23.8-124.1-146.5 171.8 -5.4 7.8 8.7 94 95 A Y E - h 0 137B 94 -2,-0.3 2,-0.3 42,-0.2 44,-0.2 -0.678 5.8-152.3-116.3 176.4 -6.5 11.3 7.7 95 96 A T E - h 0 138B 6 42,-1.8 44,-2.1 -2,-0.2 3,-0.1 -0.989 6.6-158.8-147.6 136.1 -9.0 14.0 8.6 96 97 A N S S+ 0 0 105 -2,-0.3 2,-0.4 1,-0.3 -1,-0.1 0.929 89.7 29.0 -81.2 -54.8 -10.5 16.6 6.2 97 98 A K S > S- 0 0 110 41,-0.1 3,-1.6 1,-0.1 -1,-0.3 -0.816 106.6 -94.1-101.7 142.5 -11.4 19.1 9.0 98 99 A E T 3 S+ 0 0 107 -2,-0.4 -1,-0.1 1,-0.3 66,-0.0 -0.349 107.6 11.0 -57.0 128.5 -9.3 19.1 12.1 99 100 A N T 3 S+ 0 0 84 1,-0.2 -1,-0.3 -2,-0.1 3,-0.1 0.605 85.5 144.7 75.5 19.9 -10.9 16.9 14.8 100 101 A E < - 0 0 75 -3,-1.6 95,-0.3 1,-0.1 -1,-0.2 -0.307 63.8 -76.4 -73.7 169.1 -13.5 15.1 12.7 101 102 A K - 0 0 112 93,-0.1 2,-0.3 91,-0.1 93,-0.2 -0.329 55.1-165.1 -65.1 150.1 -14.2 11.4 13.7 102 103 A I B -K 193 0D 6 91,-2.7 91,-1.7 -3,-0.1 2,-0.3 -0.886 11.9-170.1-133.4 167.1 -11.5 8.9 12.5 103 104 A K - 0 0 127 -2,-0.3 2,-0.3 89,-0.2 -9,-0.2 -0.982 7.4-152.9-156.7 149.2 -11.2 5.1 12.1 104 105 A F - 0 0 9 87,-0.4 86,-2.0 -2,-0.3 2,-0.5 -0.853 22.0-119.7-122.8 161.3 -8.4 2.7 11.4 105 106 A T E -L 189 0E 67 -2,-0.3 84,-0.2 84,-0.2 3,-0.1 -0.887 27.7-159.2 -95.1 125.0 -8.0 -0.7 9.8 106 107 A L E - 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0 0 0 -81,-3.1 -82,-3.8 -2,-0.3 2,-0.4 -0.510 35.3-135.3 -71.0 141.8 -10.5 -5.7 11.9 189 190 A G E -L 105 0E 4 -10,-0.4 -12,-3.0 -84,-0.2 -84,-0.2 -0.807 10.9-139.0-101.1 140.2 -12.2 -2.2 12.2 190 191 A S B -N 176 0F 13 -86,-2.0 -14,-0.3 -2,-0.4 -11,-0.2 -0.380 41.0 -75.5 -82.4 175.3 -11.4 0.2 15.0 191 192 A I - 0 0 14 -16,-2.7 2,-0.7 -14,-0.2 -87,-0.4 -0.324 43.1-125.1 -63.5 158.2 -14.0 2.3 16.8 192 193 A H + 0 0 112 -89,-0.1 2,-0.3 -3,-0.1 -89,-0.2 -0.912 65.0 107.1-109.0 96.3 -15.2 5.3 14.8 193 194 A A B -K 102 0D 10 -91,-1.7 -91,-2.7 -2,-0.7 2,-0.1 -0.919 68.8 -62.5-156.4-177.2 -14.6 8.2 17.1 194 195 A H >> - 0 0 65 -2,-0.3 3,-1.1 -93,-0.2 4,-0.9 -0.329 53.1-102.9 -77.1 160.2 -12.6 11.3 17.9 195 196 A Y H >> S+ 0 0 41 -95,-0.3 4,-1.9 1,-0.3 3,-0.8 0.838 118.7 60.8 -50.6 -43.7 -8.8 11.2 18.7 196 197 A K H 3> S+ 0 0 95 1,-0.3 4,-2.7 2,-0.2 -1,-0.3 0.858 97.9 59.0 -57.2 -34.9 -9.4 11.6 22.5 197 198 A D H <>>S+ 0 0 31 -3,-1.1 5,-2.3 1,-0.2 4,-1.0 0.850 106.0 48.5 -62.0 -34.5 -11.4 8.4 22.5 198 199 A F H <<5S+ 0 0 0 -4,-0.9 -2,-0.2 -3,-0.8 -1,-0.2 0.927 112.8 47.4 -71.9 -42.4 -8.3 6.5 21.2 199 200 A V H <5S+ 0 0 69 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.939 116.6 42.8 -62.9 -46.5 -6.0 8.1 23.8 200 201 A E H <5S- 0 0 100 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.652 110.8-121.9 -75.8 -18.1 -8.4 7.3 26.7 201 202 A G T <5 + 0 0 21 -4,-1.0 2,-1.4 -5,-0.2 -3,-0.2 0.874 47.1 165.0 80.5 42.7 -9.2 3.8 25.4 202 203 A K < + 0 0 118 -5,-2.3 -1,-0.1 -6,-0.1 -27,-0.1 -0.417 21.9 147.1 -90.4 64.5 -13.0 4.1 25.0 203 204 A G - 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0 0 4 -3,-0.7 2,-0.2 -4,-0.1 12,-0.1 -0.724 61.1-129.6 -76.7 123.8 -16.9 -13.0 12.9 219 220 A E - 0 0 62 -2,-0.4 6,-0.1 10,-0.4 -2,-0.1 -0.476 11.8-123.9 -77.3 152.8 -18.2 -14.2 9.5 220 221 A R S S+ 0 0 133 -2,-0.2 2,-0.3 4,-0.1 -1,-0.1 0.751 83.6 38.4 -67.3 -34.4 -16.8 -12.6 6.3 221 222 A T S >> S- 0 0 61 1,-0.1 4,-2.2 0, 0.0 3,-0.6 -0.823 78.1-116.2-121.9 163.9 -20.0 -11.3 4.6 222 223 A S H 3> S+ 0 0 73 -2,-0.3 4,-1.7 1,-0.2 -1,-0.1 0.836 113.6 61.6 -62.7 -34.4 -23.3 -9.7 5.6 223 224 A Q H 34 S+ 0 0 135 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.847 111.4 38.0 -61.5 -36.8 -25.1 -12.8 4.3 224 225 A L H X4 S+ 0 0 59 -3,-0.6 3,-0.7 2,-0.1 -2,-0.2 0.812 113.3 54.9 -86.3 -30.3 -23.3 -15.0 6.9 225 226 A R H >< S+ 0 0 34 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.770 92.1 75.0 -74.6 -21.7 -23.4 -12.5 9.7 226 227 A N T 3< S+ 0 0 128 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.818 102.1 39.2 -55.9 -37.1 -27.2 -12.2 9.3 227 228 A D T < S+ 0 0 136 -3,-0.7 -1,-0.3 -4,-0.3 -2,-0.2 0.271 131.6 23.6 -98.0 6.6 -27.7 -15.6 11.0 228 229 A K S < S- 0 0 41 -3,-1.5 2,-0.3 -4,-0.1 -3,-0.2 0.350 116.8 -42.5-133.4 -88.8 -24.9 -15.1 13.6 229 230 A Y + 0 0 1 -5,-0.1 -10,-0.4 1,-0.1 -2,-0.1 -0.956 32.1 177.4-160.4 141.8 -23.8 -11.6 14.7 230 231 A N S S+ 0 0 31 -2,-0.3 2,-0.3 -4,-0.1 -1,-0.1 0.422 76.1 15.9-112.3 -19.8 -23.0 -8.3 13.0 231 232 A N S > S- 0 0 53 -52,-0.1 4,-2.0 1,-0.1 5,-0.1 -0.903 87.8 -87.3-150.5 177.0 -22.2 -6.1 16.1 232 233 A I H > S+ 0 0 18 -2,-0.3 4,-2.5 2,-0.2 5,-0.2 0.872 121.2 53.6 -64.2 -38.2 -21.4 -6.3 19.8 233 234 A S H > S+ 0 0 77 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.952 112.4 44.4 -59.9 -49.3 -25.0 -6.4 21.0 234 235 A E H > S+ 0 0 74 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.848 112.4 52.8 -63.1 -36.9 -25.8 -9.4 18.7 235 236 A Y H X S+ 0 0 11 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.915 107.9 50.1 -66.2 -44.5 -22.5 -11.1 19.8 236 237 A R H X S+ 0 0 83 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.859 112.5 47.7 -65.8 -31.5 -23.4 -10.8 23.5 237 238 A N H X S+ 0 0 90 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.890 109.6 53.1 -71.4 -39.1 -26.8 -12.2 22.8 238 239 A W H <>S+ 0 0 18 -4,-2.1 5,-2.5 1,-0.2 6,-1.1 0.898 111.8 46.1 -58.9 -44.7 -25.3 -15.1 20.8 239 240 A I H ><5S+ 0 0 63 -4,-2.3 3,-1.1 3,-0.2 -1,-0.2 0.894 108.7 56.1 -63.7 -43.9 -23.0 -15.8 23.7 240 241 A Y H 3<5S+ 0 0 201 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.901 107.6 48.7 -58.2 -41.3 -26.0 -15.6 26.2 241 242 A R T 3<5S- 0 0 139 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.547 131.2 -89.0 -77.1 -10.3 -27.8 -18.3 24.2 242 243 A G T < 5S- 0 0 48 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.713 76.2 -57.4 105.3 32.2 -24.9 -20.7 24.1 243 244 A R < 0 0 114 -5,-2.5 -4,-0.2 -6,-0.1 -5,-0.1 0.967 360.0 360.0 64.2 54.1 -23.0 -19.6 20.9 244 245 A K 0 0 174 -6,-1.1 -5,-0.1 -16,-0.1 -6,-0.1 0.246 360.0 360.0-165.9 360.0 -26.1 -20.2 18.7 245 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 246 2 B S > 0 0 91 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 174.7 8.3 13.4 -28.8 247 3 B L H > + 0 0 13 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.964 360.0 47.2 -56.9 -48.9 6.7 13.6 -25.3 248 4 B R H > S+ 0 0 75 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.927 113.5 44.8 -61.2 -50.2 7.3 9.9 -24.9 249 5 B S H > S+ 0 0 48 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.882 115.2 48.4 -66.4 -34.8 10.9 9.8 -26.1 250 6 B D H X S+ 0 0 36 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.872 111.7 50.8 -72.8 -32.8 11.8 12.9 -24.0 251 7 B L H X S+ 0 0 1 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.949 110.3 47.9 -66.4 -48.0 10.2 11.4 -21.0 252 8 B I H X S+ 0 0 30 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.879 113.1 48.9 -58.7 -43.4 12.1 8.1 -21.3 253 9 B N H X S+ 0 0 91 -4,-1.8 4,-2.3 -5,-0.2 -1,-0.2 0.930 111.6 48.0 -62.4 -47.5 15.4 9.9 -21.8 254 10 B A H X S+ 0 0 22 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.917 111.9 51.0 -61.6 -40.3 14.8 12.1 -18.7 255 11 B L H X S+ 0 0 2 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.916 110.3 47.6 -64.5 -45.1 13.8 9.1 -16.6 256 12 B Y H X S+ 0 0 94 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.940 115.4 47.1 -59.5 -48.2 17.0 7.1 -17.5 257 13 B D H X S+ 0 0 91 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.914 111.7 47.2 -57.7 -52.6 19.1 10.1 -16.8 258 14 B E H X S+ 0 0 28 -4,-2.8 4,-2.3 1,-0.2 3,-0.3 0.968 113.7 49.9 -60.0 -45.9 17.6 11.1 -13.5 259 15 B N H < S+ 0 0 22 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.893 111.9 48.0 -58.4 -43.7 17.8 7.4 -12.4 260 16 B Q H < S+ 0 0 164 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.850 116.4 44.4 -65.8 -33.9 21.5 7.2 -13.5 261 17 B K H < S+ 0 0 98 -4,-2.1 2,-0.4 -3,-0.3 -2,-0.2 0.811 110.3 43.2 -81.9 -42.0 22.4 10.5 -11.7 262 18 B Y < - 0 0 55 -4,-2.3 2,-0.5 -5,-0.1 -1,-0.1 -0.925 53.5-160.0-119.3 147.8 20.7 10.4 -8.2 263 19 B D - 0 0 59 -2,-0.4 -238,-2.5 -3,-0.0 -237,-0.2 -0.949 20.8-137.5-122.5 110.3 20.3 7.8 -5.5 264 20 B V E +A 24 0A 5 -2,-0.5 -240,-0.3 -240,-0.3 3,-0.1 -0.440 30.6 166.4 -67.0 133.9 17.4 8.4 -2.9 265 21 B C E - 0 0 0 -242,-2.9 12,-0.5 1,-0.3 2,-0.3 0.401 49.3 -21.3-133.3 4.5 18.7 7.6 0.6 266 22 B G E -AD 23 276A 0 -243,-1.0 -243,-2.8 10,-0.2 2,-0.3 -0.983 60.7 -84.0 171.6 176.9 16.2 8.9 3.1 267 23 B I E -AD 22 275A 0 8,-2.9 8,-2.3 -2,-0.3 2,-0.4 -0.839 41.0-154.1-104.8 142.6 13.4 11.2 4.3 268 24 B I E -AD 21 274A 0 -247,-3.2 -248,-3.0 -2,-0.3 -247,-1.1 -0.975 3.7-143.0-124.1 141.9 14.3 14.7 5.5 269 25 B S E > -A 19 0A 0 4,-2.2 3,-2.4 -2,-0.4 -250,-0.3 -0.600 31.3-109.9 -93.6 163.2 12.6 17.1 7.9 270 26 B A T 3 S+ 0 0 12 -252,-2.8 -114,-0.1 1,-0.3 -251,-0.1 0.742 120.3 59.4 -61.1 -24.4 12.5 20.9 7.6 271 27 B E T 3 S- 0 0 90 -253,-0.2 -1,-0.3 2,-0.1 -252,-0.1 0.433 122.4-106.4 -81.4 -5.8 14.9 21.0 10.6 272 28 B G S < S+ 0 0 12 -3,-2.4 125,-0.5 1,-0.3 2,-0.4 0.537 71.8 138.7 91.9 8.4 17.5 19.0 8.6 273 29 B K - 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0 0 34 -2,-1.4 -28,-0.1 2,-0.2 -26,-0.1 -0.076 52.2-121.9 -94.8-163.9 4.4 -9.4 -25.1 449 205 B I S S+ 0 0 61 -28,-0.8 2,-0.3 -30,-0.1 -27,-0.1 0.528 78.4 93.0-120.8 -17.2 1.8 -12.0 -26.0 450 206 B F - 0 0 15 -29,-0.4 -2,-0.2 -32,-0.3 3,-0.1 -0.626 62.2-149.0 -82.3 147.1 -1.2 -10.0 -27.1 451 207 B D S S- 0 0 129 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.604 77.0 -1.8 -86.4 -16.1 -1.5 -9.2 -30.8 452 208 B S > - 0 0 40 -34,-0.1 4,-2.1 1,-0.1 -1,-0.2 -0.976 68.2-107.6-164.9 163.5 -3.3 -5.9 -30.2 453 209 B E H > S+ 0 0 74 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.842 120.3 58.4 -67.5 -34.8 -4.6 -3.5 -27.6 454 210 B D H > S+ 0 0 128 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.941 107.6 46.0 -57.8 -48.0 -8.1 -4.6 -28.7 455 211 B E H > S+ 0 0 22 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.879 111.8 51.6 -63.6 -43.2 -7.2 -8.2 -27.9 456 212 B F H X S+ 0 0 8 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.908 112.4 45.1 -58.7 -47.5 -5.7 -7.2 -24.5 457 213 B L H X S+ 0 0 25 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.925 114.7 47.5 -65.1 -45.1 -8.8 -5.2 -23.5 458 214 B D H X S+ 0 0 28 -4,-2.5 4,-1.1 -5,-0.2 -2,-0.2 0.921 110.5 53.3 -63.3 -42.4 -11.2 -8.0 -24.6 459 215 B Y H >< S+ 0 0 0 -4,-2.6 3,-0.6 1,-0.2 -1,-0.2 0.939 116.2 37.4 -54.3 -56.2 -9.2 -10.6 -22.8 460 216 B W H 3< S+ 0 0 0 -4,-2.1 3,-0.4 1,-0.2 -1,-0.2 0.706 110.1 60.9 -76.6 -18.4 -9.2 -8.8 -19.5 461 217 B R H 3< S+ 0 0 100 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.703 115.6 33.8 -77.8 -19.5 -12.8 -7.5 -19.8 462 218 B N S << S+ 0 0 39 -4,-1.1 2,-0.4 -3,-0.6 -1,-0.2 0.138 85.3 124.5-118.2 7.0 -14.1 -11.1 -20.0 463 219 B Y - 0 0 3 -3,-0.4 2,-0.2 -109,-0.1 12,-0.1 -0.679 59.9-129.7 -69.3 126.0 -11.6 -12.9 -17.7 464 220 B E - 0 0 52 10,-0.4 6,-0.1 -2,-0.4 -2,-0.1 -0.529 11.9-125.7 -80.0 150.9 -13.5 -14.7 -14.9 465 221 B R S S+ 0 0 126 -2,-0.2 2,-0.3 4,-0.0 -34,-0.1 0.694 83.6 40.9 -73.1 -20.3 -12.4 -14.0 -11.3 466 222 B T S > S- 0 0 69 1,-0.1 4,-2.6 0, 0.0 5,-0.2 -0.883 78.0-117.2-127.4 166.1 -11.9 -17.7 -10.2 467 223 B S H > S+ 0 0 73 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.907 113.7 58.0 -60.1 -44.1 -10.4 -20.9 -11.5 468 224 B Q H 4 S+ 0 0 152 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.915 113.2 37.2 -51.8 -53.7 -13.9 -22.6 -11.2 469 225 B L H >4 S+ 0 0 76 1,-0.2 3,-0.9 2,-0.2 -1,-0.2 0.866 116.1 54.2 -71.2 -35.1 -15.5 -20.0 -13.5 470 226 B R H >< S+ 0 0 33 -4,-2.6 3,-2.0 1,-0.2 4,-0.4 0.817 94.4 68.1 -71.3 -28.3 -12.4 -19.8 -15.8 471 227 B N T 3< S+ 0 0 114 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.666 100.9 49.5 -68.4 -13.9 -12.3 -23.6 -16.5 472 228 B D T < S+ 0 0 141 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.2 0.284 129.7 16.5 -99.0 2.7 -15.5 -23.3 -18.4 473 229 B K S < S- 0 0 39 -3,-2.0 2,-0.3 16,-0.0 -2,-0.1 0.367 119.6 -38.4-137.0 -82.9 -14.3 -20.4 -20.5 474 230 B Y - 0 0 2 -4,-0.4 -10,-0.4 -5,-0.1 -2,-0.1 -0.957 30.1-180.0-161.1 144.5 -10.6 -19.6 -20.7 475 231 B N S S+ 0 0 31 -2,-0.3 2,-0.3 1,-0.1 -4,-0.1 0.375 77.7 16.0-118.1 -11.3 -7.5 -19.5 -18.4 476 232 B N S > S- 0 0 49 1,-0.1 4,-2.2 -52,-0.1 5,-0.2 -0.931 89.9 -83.7-155.1 177.1 -4.9 -18.3 -20.9 477 233 B I H > S+ 0 0 17 -2,-0.3 4,-2.2 2,-0.2 5,-0.2 0.889 122.7 49.8 -62.2 -40.8 -4.4 -16.7 -24.3 478 234 B S H > S+ 0 0 84 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.952 112.8 47.1 -64.3 -43.5 -4.8 -20.0 -26.3 479 235 B E H > S+ 0 0 78 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.871 110.5 53.3 -66.7 -33.2 -8.0 -20.9 -24.5 480 236 B Y H X S+ 0 0 10 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.917 107.6 49.9 -65.1 -43.4 -9.3 -17.3 -25.1 481 237 B R H X S+ 0 0 87 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.883 111.6 48.9 -66.2 -33.4 -8.6 -17.5 -28.8 482 238 B N H X S+ 0 0 84 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.935 107.6 55.7 -67.8 -40.3 -10.5 -20.8 -28.8 483 239 B W H X>S+ 0 0 10 -4,-2.7 5,-2.3 1,-0.2 6,-0.8 0.880 107.0 50.1 -57.1 -39.0 -13.3 -19.1 -26.9 484 240 B I H ><5S+ 0 0 66 -4,-2.1 3,-1.6 3,-0.2 -1,-0.2 0.968 109.1 51.3 -64.6 -47.3 -13.5 -16.5 -29.7 485 241 B Y H 3<5S+ 0 0 195 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.889 104.8 56.5 -57.8 -41.5 -13.7 -19.3 -32.3 486 242 B R H 3<5S- 0 0 92 -4,-2.5 -1,-0.3 3,-0.1 -2,-0.2 0.662 128.1 -96.3 -65.5 -17.0 -16.6 -21.0 -30.4 487 243 B G T <<5 - 0 0 45 -3,-1.6 -3,-0.2 -4,-0.6 -2,-0.2 0.698 69.6 -60.1 106.4 30.8 -18.6 -17.7 -30.7 488 244 B R < 0 0 114 -5,-2.3 -4,-0.2 1,-0.3 -5,-0.1 0.957 360.0 360.0 61.0 51.0 -17.8 -16.1 -27.3 489 245 B K 0 0 182 -6,-0.8 -1,-0.3 -16,-0.1 -3,-0.1 -0.932 360.0 360.0-169.1 360.0 -19.3 -19.1 -25.4