==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-NOV-07 3BHY . COMPND 2 MOLECULE: DEATH-ASSOCIATED PROTEIN KINASE 3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.FILIPPAKOPOULOS,P.RELLOS,J.ESWARAN,O.FEDOROV,G.BERRIDGE,F. . 268 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13889.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 177 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 15.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 2 0.7 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 . 17 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 30.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 0 1 0 3 1 0 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 1 0 1 1 2 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 1 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 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 8 A M >> 0 0 89 0, 0.0 3,-1.3 0, 0.0 4,-0.8 0.000 360.0 360.0 360.0 149.7 12.6 43.3 27.3 2 9 A V H >> + 0 0 13 1,-0.3 4,-1.9 2,-0.2 3,-1.1 0.882 360.0 59.2 -57.8 -38.8 13.4 39.9 25.9 3 10 A E H 34 S+ 0 0 68 1,-0.3 -1,-0.3 2,-0.2 5,-0.1 0.694 94.0 66.1 -73.4 -15.1 10.4 39.8 23.6 4 11 A D H <4 S+ 0 0 96 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.849 117.5 25.5 -63.2 -36.4 11.7 43.0 21.9 5 12 A H H << S+ 0 0 103 -3,-1.1 21,-2.6 -4,-0.8 22,-0.5 0.621 124.4 47.3-105.8 -15.8 14.7 40.9 20.6 6 13 A Y E < S-A 25 0A 4 -4,-1.9 2,-0.6 19,-0.3 19,-0.2 -0.990 70.5-142.6-133.0 122.3 13.4 37.4 20.5 7 14 A E E -A 24 0A 108 17,-2.7 17,-1.8 -2,-0.4 2,-0.2 -0.733 27.5-134.9 -85.1 117.0 10.1 36.4 19.0 8 15 A M E +A 23 0A 24 -2,-0.6 15,-0.2 15,-0.2 2,-0.1 -0.516 30.9 169.2 -79.5 141.2 8.7 33.6 21.3 9 16 A G E - 0 0 33 13,-3.2 -1,-0.1 1,-0.3 14,-0.1 -0.129 40.1 -7.0-124.2-141.7 7.2 30.6 19.7 10 17 A E E - 0 0 70 11,-0.1 12,-2.8 1,-0.1 2,-0.4 -0.167 65.6-108.9 -68.5 151.3 6.0 27.2 20.9 11 18 A E E -A 21 0A 116 10,-0.2 10,-0.3 1,-0.2 -1,-0.1 -0.637 31.4-178.2 -77.2 124.2 6.5 25.8 24.3 12 19 A L E - 0 0 94 8,-2.8 2,-0.3 -2,-0.4 9,-0.2 0.648 60.4 -20.7 -96.2 -22.8 9.0 23.0 24.3 13 20 A G E -A 20 0A 29 7,-1.4 7,-2.6 2,-0.0 2,-0.3 -0.979 53.2-154.6-176.9 169.0 8.9 21.9 27.9 14 21 A S E +A 19 0A 92 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.993 7.3 178.9-157.2 148.5 8.0 22.8 31.4 15 22 A G - 0 0 51 3,-2.9 3,-0.4 -2,-0.3 -2,-0.0 -0.666 55.4 -71.1-134.9-165.7 8.8 22.1 35.0 16 23 A Q S S+ 0 0 169 1,-0.2 3,-0.0 -2,-0.2 32,-0.0 0.884 129.0 9.7 -58.7 -42.6 7.6 23.3 38.4 17 24 A F S S+ 0 0 60 31,-0.1 21,-2.5 30,-0.0 2,-0.3 0.007 122.0 64.8-128.8 25.9 9.2 26.8 38.1 18 25 A A E - B 0 37A 24 -3,-0.4 -3,-2.9 19,-0.2 2,-0.4 -0.997 48.1-170.7-149.5 148.1 10.4 26.9 34.5 19 26 A I E -AB 14 36A 72 17,-1.8 17,-3.1 -2,-0.3 2,-0.4 -0.992 12.8-152.8-132.0 142.5 9.0 27.0 31.0 20 27 A V E -AB 13 35A 37 -7,-2.6 -8,-2.8 -2,-0.4 -7,-1.4 -0.975 14.5-177.1-118.6 129.2 11.1 26.6 27.9 21 28 A R E -AB 11 34A 88 13,-2.5 13,-3.3 -2,-0.4 -10,-0.2 -0.954 29.1-118.5-120.9 142.0 9.9 28.2 24.5 22 29 A K E + B 0 33A 72 -12,-2.8 -13,-3.2 -2,-0.4 2,-0.3 -0.529 43.7 179.8 -66.2 145.7 11.5 28.1 21.1 23 30 A C E -AB 8 32A 4 9,-2.4 9,-2.2 -15,-0.2 2,-0.4 -0.965 25.9-134.2-147.9 167.0 12.3 31.6 20.0 24 31 A R E -AB 7 31A 85 -17,-1.8 -17,-2.7 -2,-0.3 2,-0.5 -0.991 20.7-129.3-125.9 125.8 13.8 33.5 17.1 25 32 A Q E >> -A 6 0A 30 5,-3.1 4,-2.7 -2,-0.4 3,-0.7 -0.604 19.2-148.8 -72.8 119.6 16.4 36.2 17.4 26 33 A K T 34 S+ 0 0 101 -21,-2.6 -1,-0.2 -2,-0.5 -20,-0.1 0.830 89.9 54.9 -66.2 -30.4 14.9 39.0 15.4 27 34 A G T 34 S+ 0 0 76 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.792 127.4 14.0 -72.8 -26.9 18.2 40.5 14.3 28 35 A T T <4 S- 0 0 97 -3,-0.7 -2,-0.2 2,-0.2 -1,-0.2 0.548 91.0-121.9-123.3 -21.4 19.6 37.3 12.8 29 36 A G < + 0 0 38 -4,-2.7 2,-0.2 1,-0.3 -3,-0.1 0.416 61.0 147.2 84.1 -5.5 16.8 34.8 12.4 30 37 A K - 0 0 125 -5,-0.2 -5,-3.1 -6,-0.1 2,-0.3 -0.467 43.6-131.4 -68.6 138.3 18.7 32.3 14.6 31 38 A E E +B 24 0A 89 -7,-0.2 57,-0.6 -2,-0.2 2,-0.3 -0.682 31.2 167.8 -94.6 142.2 16.6 30.1 16.7 32 39 A Y E -BC 23 87A 14 -9,-2.2 -9,-2.4 -2,-0.3 2,-0.5 -0.823 37.2-107.5-136.8 171.5 17.2 29.5 20.4 33 40 A A E -BC 22 86A 9 53,-3.0 53,-3.1 -2,-0.3 2,-0.7 -0.967 28.1-154.5-105.9 121.6 15.5 28.0 23.5 34 41 A A E -BC 21 85A 0 -13,-3.3 -13,-2.5 -2,-0.5 2,-0.7 -0.871 5.8-161.3 -99.8 115.4 14.3 30.6 25.9 35 42 A K E -BC 20 84A 17 49,-2.8 49,-2.6 -2,-0.7 2,-0.7 -0.872 3.1-158.1 -98.6 111.4 14.1 29.2 29.5 36 43 A F E -BC 19 83A 38 -17,-3.1 -17,-1.8 -2,-0.7 2,-0.6 -0.838 8.5-166.5 -91.8 112.0 11.9 31.3 31.7 37 44 A I E -BC 18 82A 5 45,-3.1 45,-2.2 -2,-0.7 2,-0.5 -0.895 18.6-129.7-104.9 121.5 12.8 30.7 35.4 38 45 A K E - C 0 81A 72 -21,-2.5 11,-3.1 -2,-0.6 43,-0.2 -0.577 23.4-140.5 -75.7 120.6 10.3 32.0 37.9 39 46 A K B -e 49 0B 42 41,-2.6 2,-0.2 -2,-0.5 11,-0.2 -0.428 20.5-103.1 -76.0 152.3 11.9 34.1 40.6 40 47 A R - 0 0 83 9,-1.2 8,-0.2 1,-0.1 -1,-0.1 -0.519 22.5-138.6 -63.3 140.7 11.1 34.0 44.3 41 48 A R S S+ 0 0 203 6,-0.5 2,-0.3 -2,-0.2 -1,-0.1 0.886 91.4 27.0 -69.9 -41.0 9.0 37.0 45.3 42 49 A L S > S- 0 0 127 1,-0.0 3,-1.8 -3,-0.0 -1,-0.1 -0.839 96.6-103.7-120.7 158.8 11.0 37.3 48.5 43 50 A S T 3 S+ 0 0 111 -2,-0.3 8,-0.3 1,-0.3 -3,-0.1 0.819 120.6 26.5 -55.7 -39.7 14.5 36.2 49.1 44 51 A S T 3 S+ 0 0 105 6,-0.1 -1,-0.3 -4,-0.0 6,-0.1 0.130 87.8 149.4-112.1 24.2 13.6 33.1 51.1 45 52 A S < - 0 0 28 -3,-1.8 -5,-0.1 1,-0.1 5,-0.0 -0.182 50.5-132.3 -52.6 142.9 10.1 32.5 49.5 46 53 A R S S+ 0 0 131 3,-0.0 2,-0.3 -6,-0.0 -1,-0.1 0.878 90.0 60.9 -62.2 -40.5 9.0 28.9 49.4 47 54 A R S S+ 0 0 64 2,-0.1 -6,-0.5 -8,-0.0 2,-0.1 -0.729 90.2 32.9 -99.6 139.6 7.9 29.2 45.8 48 55 A G S S- 0 0 5 -2,-0.3 2,-0.4 -8,-0.2 -9,-0.2 -0.298 92.6 -63.2 105.8 167.8 10.2 30.1 42.9 49 56 A V B -e 39 0B 16 -11,-3.1 -9,-1.2 -32,-0.2 -4,-0.1 -0.727 55.7-108.7 -93.3 133.8 13.8 29.5 42.2 50 57 A S > - 0 0 24 -2,-0.4 4,-2.1 -11,-0.2 3,-0.2 -0.298 18.3-127.1 -56.9 141.9 16.3 30.9 44.5 51 58 A R H > S+ 0 0 115 -8,-0.3 4,-2.7 1,-0.2 5,-0.2 0.866 112.5 59.1 -59.1 -33.0 18.2 33.8 43.0 52 59 A E H > S+ 0 0 58 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.887 102.5 50.1 -58.8 -47.3 21.3 31.7 44.1 53 60 A E H > S+ 0 0 61 -3,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.938 113.6 48.2 -55.4 -44.1 20.3 28.7 42.0 54 61 A I H X S+ 0 0 1 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.947 114.2 41.8 -68.2 -51.7 19.9 31.2 39.0 55 62 A E H X S+ 0 0 55 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.895 114.7 51.7 -61.6 -41.2 23.2 33.1 39.3 56 63 A R H X S+ 0 0 68 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.928 112.1 47.0 -60.7 -45.5 25.2 29.9 40.0 57 64 A E H X S+ 0 0 5 -4,-2.2 4,-2.7 -5,-0.2 -2,-0.2 0.916 113.5 47.8 -60.3 -48.9 23.6 28.2 36.9 58 65 A V H X S+ 0 0 14 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.939 112.4 49.3 -59.8 -46.3 24.3 31.3 34.7 59 66 A N H X S+ 0 0 55 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.881 111.5 48.4 -65.7 -39.2 27.9 31.6 35.9 60 67 A I H >X S+ 0 0 5 -4,-2.3 4,-1.0 -5,-0.2 3,-0.6 0.941 112.5 48.3 -62.9 -49.3 28.6 27.9 35.3 61 68 A L H 3< S+ 0 0 5 -4,-2.7 3,-0.5 1,-0.2 11,-0.4 0.874 108.4 54.8 -62.2 -35.4 27.2 27.9 31.8 62 69 A R H 3< S+ 0 0 166 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.779 108.8 49.0 -69.0 -25.8 29.1 31.1 30.9 63 70 A E H << S+ 0 0 89 -4,-1.0 2,-0.4 -3,-0.6 -1,-0.2 0.613 94.8 88.4 -87.3 -13.3 32.4 29.4 31.9 64 71 A I < + 0 0 13 -4,-1.0 2,-0.4 -3,-0.5 59,-0.0 -0.737 43.7 174.5 -93.4 133.1 31.9 26.2 30.0 65 72 A R + 0 0 77 -2,-0.4 5,-0.1 6,-0.1 6,-0.1 -0.869 30.8 128.3-131.6 94.2 33.0 25.8 26.3 66 73 A H > - 0 0 38 3,-0.4 3,-1.9 -2,-0.4 -2,-0.0 -0.972 60.1-128.5-149.4 138.5 32.4 22.1 25.2 67 74 A P T 3 S+ 0 0 92 0, 0.0 4,-0.1 0, 0.0 52,-0.0 0.667 109.4 51.2 -60.8 -19.3 30.6 20.5 22.3 68 75 A N T 3 S+ 0 0 18 83,-0.1 84,-2.5 47,-0.1 2,-0.4 0.164 99.9 74.3-104.0 18.6 28.6 18.2 24.6 69 76 A I B < S-f 152 0C 1 -3,-1.9 -3,-0.4 82,-0.3 84,-0.1 -0.995 87.2-109.1-132.6 135.1 27.3 21.0 26.9 70 77 A I - 0 0 8 82,-2.3 2,-0.3 -2,-0.4 -6,-0.1 -0.280 32.9-131.1 -59.9 143.0 24.6 23.5 26.0 71 78 A T - 0 0 65 -4,-0.1 16,-2.5 -6,-0.1 2,-0.6 -0.683 5.0-135.4 -96.8 149.1 25.7 27.1 25.5 72 79 A L E +D 86 0A 31 -11,-0.4 14,-0.2 -2,-0.3 3,-0.1 -0.929 20.4 179.5-101.9 122.3 24.2 30.2 27.0 73 80 A H E - 0 0 86 12,-3.0 2,-0.3 -2,-0.6 13,-0.2 0.849 60.1 -23.3 -92.5 -43.5 23.7 33.0 24.5 74 81 A D E -D 85 0A 67 11,-1.4 11,-2.8 2,-0.0 2,-0.3 -0.973 51.2-133.4-162.4 172.7 22.1 35.8 26.6 75 82 A I E -D 84 0A 60 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.999 15.6-177.7-139.4 135.1 20.2 36.6 29.8 76 83 A F E -D 83 0A 42 7,-2.4 7,-3.2 -2,-0.3 2,-0.4 -0.906 6.2-171.4-128.6 157.1 17.2 38.9 30.4 77 84 A E E +D 82 0A 101 -2,-0.3 5,-0.2 5,-0.3 2,-0.2 -0.988 10.1 170.1-150.9 134.4 15.4 39.6 33.6 78 85 A N - 0 0 87 3,-2.4 -2,-0.0 -2,-0.4 5,-0.0 -0.591 59.2 -71.8-124.5-162.1 12.3 41.4 34.6 79 86 A K S S+ 0 0 190 -2,-0.2 3,-0.1 1,-0.2 -40,-0.0 0.865 127.9 24.5 -60.7 -35.3 10.5 41.6 38.0 80 87 A T S S+ 0 0 48 1,-0.1 -41,-2.6 -42,-0.1 2,-0.4 0.669 118.9 35.5-105.6 -24.7 9.2 38.0 37.8 81 88 A D E -C 38 0A 24 -43,-0.2 -3,-2.4 2,-0.0 2,-0.5 -0.965 52.2-146.0-134.4 150.7 11.5 35.9 35.6 82 89 A V E -CD 37 77A 5 -45,-2.2 -45,-3.1 -2,-0.4 2,-0.6 -0.978 27.1-155.3-106.5 129.5 15.0 35.4 34.6 83 90 A V E -CD 36 76A 1 -7,-3.2 -7,-2.4 -2,-0.5 2,-0.5 -0.944 4.1-160.4-113.6 115.9 15.1 34.3 30.9 84 91 A L E -CD 35 75A 0 -49,-2.6 -49,-2.8 -2,-0.6 2,-0.8 -0.848 9.4-148.3 -94.4 125.7 18.1 32.3 29.7 85 92 A I E +CD 34 74A 0 -11,-2.8 -12,-3.0 -2,-0.5 -11,-1.4 -0.859 32.0 179.7 -94.4 106.7 18.6 32.3 25.9 86 93 A L E -CD 33 72A 19 -53,-3.1 -53,-3.0 -2,-0.8 -14,-0.2 -0.752 36.7 -83.3-112.4 155.8 20.1 28.9 25.4 87 94 A E E -C 32 0A 49 -16,-2.5 2,-0.4 -2,-0.3 -55,-0.2 -0.305 51.0-117.9 -50.5 133.2 21.3 27.0 22.4 88 95 A L - 0 0 34 -57,-0.6 2,-0.4 -65,-0.1 -1,-0.1 -0.658 29.8-174.3 -82.4 131.2 18.4 25.3 20.7 89 96 A V + 0 0 15 -2,-0.4 3,-0.3 1,-0.1 52,-0.1 -0.994 3.6 179.7-126.1 117.1 18.6 21.5 20.7 90 97 A S + 0 0 86 51,-0.5 51,-0.2 -2,-0.4 53,-0.1 0.382 57.2 84.2-108.3 0.4 15.7 20.0 18.7 91 98 A G S S- 0 0 6 49,-2.3 50,-0.2 1,-0.2 -1,-0.2 0.360 91.3-122.4 -92.0 8.0 16.1 16.2 18.7 92 99 A G - 0 0 26 -3,-0.3 48,-3.2 48,-0.3 -1,-0.2 -0.049 42.7 -40.5 79.7 178.0 14.4 15.8 22.1 93 100 A E B > -G 139 0C 63 46,-0.2 4,-2.0 1,-0.1 3,-0.5 -0.456 43.4-124.7 -77.1 149.7 15.5 14.2 25.3 94 101 A L H > S+ 0 0 0 44,-3.1 4,-3.0 41,-0.8 5,-0.3 0.871 113.8 65.9 -57.2 -35.1 17.6 11.0 25.5 95 102 A F H > S+ 0 0 93 40,-1.4 4,-1.6 43,-0.4 -1,-0.2 0.921 104.2 41.7 -50.3 -47.6 14.7 9.9 27.8 96 103 A D H > S+ 0 0 87 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.871 112.2 54.3 -73.5 -36.3 12.3 10.1 24.8 97 104 A F H X S+ 0 0 30 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.952 111.2 45.8 -58.5 -48.5 14.7 8.5 22.4 98 105 A L H X S+ 0 0 15 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.849 106.0 60.3 -65.6 -35.2 15.2 5.5 24.8 99 106 A A H < S+ 0 0 66 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.934 110.0 41.6 -58.0 -44.0 11.5 5.3 25.3 100 107 A E H < S+ 0 0 109 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.841 120.2 42.1 -73.3 -35.6 11.1 4.6 21.5 101 108 A K H < S- 0 0 85 -4,-2.0 2,-2.1 -5,-0.2 -1,-0.2 0.635 89.5-153.9 -83.5 -19.8 14.1 2.3 21.3 102 109 A E S < S+ 0 0 155 -4,-2.1 2,-0.3 -5,-0.2 -1,-0.1 -0.336 70.4 0.7 72.3 -58.1 13.3 0.5 24.5 103 110 A S S S- 0 0 57 -2,-2.1 2,-0.3 96,-0.1 94,-0.2 -0.965 75.6-125.5-153.7 156.2 16.9 -0.5 25.1 104 111 A L - 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0 0 39 -2,-0.2 4,-1.9 1,-0.1 5,-0.1 -0.215 16.2-121.5 -67.6 152.5 29.0 -8.6 28.0 232 246 A E H > S+ 0 0 125 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.862 114.2 59.3 -65.1 -29.8 31.1 -9.0 31.1 233 247 A L H > S+ 0 0 69 2,-0.2 4,-2.1 1,-0.2 27,-0.3 0.916 104.1 48.8 -60.3 -43.6 32.8 -5.7 30.2 234 248 A A H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.910 112.2 48.5 -64.1 -43.3 29.5 -3.8 30.3 235 249 A K H X S+ 0 0 22 -4,-1.9 4,-3.0 1,-0.2 -1,-0.2 0.881 108.9 53.4 -64.8 -38.4 28.7 -5.3 33.7 236 250 A D H X S+ 0 0 53 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.895 108.0 51.7 -61.4 -41.3 32.2 -4.4 34.9 237 251 A F H < S+ 0 0 0 -4,-2.1 4,-0.4 2,-0.2 -2,-0.2 0.951 114.9 40.5 -59.6 -52.2 31.7 -0.8 33.9 238 252 A I H >X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 3,-1.5 0.925 113.0 54.3 -64.3 -45.8 28.4 -0.5 35.7 239 253 A R H 3< S+ 0 0 111 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.813 105.5 53.8 -60.3 -33.0 29.5 -2.4 38.8 240 254 A R T 3< S+ 0 0 104 -4,-1.8 10,-2.2 -5,-0.2 -1,-0.3 0.543 113.9 42.7 -79.8 -6.5 32.5 -0.1 39.2 241 255 A L T <4 S+ 0 0 0 -3,-1.5 2,-1.8 -4,-0.4 -2,-0.2 0.761 101.7 66.3-100.5 -41.0 30.2 2.9 39.2 242 256 A L S < S+ 0 0 5 -4,-2.5 2,-0.4 -5,-0.1 -1,-0.1 -0.428 73.7 132.1 -85.6 63.6 27.4 1.6 41.4 243 257 A V - 0 0 13 -2,-1.8 6,-0.1 -3,-0.2 -25,-0.1 -0.944 55.8-140.6-118.9 134.7 29.5 1.4 44.5 244 258 A K S S+ 0 0 87 -2,-0.4 -71,-0.2 -72,-0.1 -1,-0.1 0.925 87.3 69.9 -65.6 -45.1 28.4 2.8 47.9 245 259 A D S >> S- 0 0 66 1,-0.2 3,-1.7 -73,-0.1 4,-0.7 -0.610 73.2-152.7 -76.9 115.6 31.8 4.2 49.0 246 260 A P G >4 S+ 0 0 26 0, 0.0 3,-0.8 0, 0.0 -1,-0.2 0.825 93.2 63.1 -60.2 -27.6 32.4 7.2 46.7 247 261 A K G 34 S+ 0 0 182 1,-0.2 4,-0.1 -3,-0.0 -2,-0.1 0.719 104.0 47.9 -67.6 -22.6 36.2 6.8 47.2 248 262 A R G <4 S+ 0 0 181 -3,-1.7 -1,-0.2 2,-0.1 2,-0.1 0.531 89.6 104.1 -92.9 -11.6 36.0 3.4 45.5 249 263 A R S << S- 0 0 8 -3,-0.8 -8,-0.2 -4,-0.7 -9,-0.1 -0.402 83.7 -97.0 -74.6 145.6 33.9 4.5 42.6 250 264 A M - 0 0 4 -10,-2.2 -1,-0.1 -13,-0.2 2,-0.1 -0.381 39.3-131.4 -57.4 140.4 35.6 4.9 39.2 251 265 A T > - 0 0 68 1,-0.1 4,-2.4 -4,-0.1 5,-0.2 -0.356 28.2 -99.9 -82.0 169.4 36.6 8.5 38.4 252 266 A I H > S+ 0 0 15 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.913 124.5 51.3 -62.1 -40.1 35.7 10.2 35.2 253 267 A A H > S+ 0 0 42 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.912 111.2 48.4 -62.0 -44.5 39.2 9.6 33.8 254 268 A Q H > S+ 0 0 92 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.894 108.6 53.7 -62.5 -37.3 39.0 5.9 34.7 255 269 A S H >< S+ 0 0 0 -4,-2.4 3,-0.7 1,-0.2 6,-0.3 0.893 107.6 50.3 -66.4 -35.3 35.6 5.6 33.1 256 270 A L H 3< S+ 0 0 26 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.785 111.3 49.7 -71.8 -23.8 36.9 7.0 29.8 257 271 A E H 3< S+ 0 0 136 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.523 84.8 121.7 -90.2 -9.3 39.9 4.5 30.0 258 272 A H XX - 0 0 10 -3,-0.7 4,-2.0 -4,-0.6 3,-0.6 -0.282 69.6-127.9 -66.0 139.5 37.6 1.6 30.6 259 273 A S H 3> S+ 0 0 49 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.770 106.5 59.3 -58.3 -29.6 37.8 -1.2 28.1 260 274 A W H 3> S+ 0 0 5 -27,-0.3 4,-0.5 2,-0.2 -1,-0.2 0.929 108.0 44.4 -66.0 -42.0 34.0 -1.2 27.5 261 275 A I H <4 S+ 0 0 12 -3,-0.6 3,-0.4 -6,-0.3 4,-0.4 0.901 118.3 44.9 -69.0 -37.8 34.0 2.4 26.4 262 276 A K H >X S+ 0 0 59 -4,-2.0 4,-1.9 1,-0.2 3,-0.7 0.674 89.8 89.1 -78.3 -15.7 37.0 1.7 24.2 263 277 A A H 3X S+ 0 0 37 -4,-1.4 4,-1.7 1,-0.3 -1,-0.2 0.871 86.9 48.8 -55.3 -44.6 35.7 -1.6 22.7 264 278 A I H 3< S+ 0 0 52 -4,-0.5 -1,-0.3 -3,-0.4 -2,-0.1 0.850 113.9 47.0 -66.1 -34.7 33.9 0.0 19.8 265 279 A R H <4 S+ 0 0 85 -3,-0.7 -1,-0.2 -4,-0.4 -2,-0.2 0.806 111.0 53.1 -71.5 -31.2 37.0 2.1 18.9 266 280 A R H < S+ 0 0 149 -4,-1.9 -2,-0.2 -3,-0.0 -1,-0.2 0.821 100.5 67.6 -78.9 -31.9 39.4 -0.8 19.2 267 281 A R < - 0 0 53 -4,-1.7 0, 0.0 -5,-0.2 0, 0.0 -0.402 59.1-155.5 -88.3 160.1 37.6 -3.3 16.9 268 282 A N 0 0 169 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.853 360.0 360.0 -90.1 -59.8 37.1 -3.2 13.1 269 283 A V 0 0 182 0, 0.0 -1,-0.3 0, 0.0 0, 0.0 -0.568 360.0 360.0-116.2 360.0 33.9 -5.3 12.7