==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-SEP-08 3EHA . COMPND 2 MOLECULE: DEATH-ASSOCIATED PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.K.MCNAMARA,D.M.WATTERSON,J.S.BRUNZELLE . 279 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14149.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 15.4 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 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 75 26.9 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 2 0 1 1 1 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 . 3 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 . 2 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 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 2 A T 0 0 112 0, 0.0 2,-0.4 0, 0.0 60,-0.0 0.000 360.0 360.0 360.0 136.1 15.3 -1.9 -9.9 2 3 A V - 0 0 117 81,-0.0 2,-0.1 1,-0.0 3,-0.1 -0.835 360.0-152.1-105.8 141.9 18.6 -3.7 -10.2 3 4 A F - 0 0 16 -2,-0.4 79,-0.2 1,-0.1 2,-0.1 -0.453 38.4 -63.7-105.5 169.3 21.8 -2.5 -8.4 4 5 A R B -a 82 0A 91 77,-1.2 79,-2.5 -2,-0.1 -1,-0.1 -0.349 42.6-166.5 -54.4 123.2 25.5 -2.8 -9.0 5 6 A Q + 0 0 133 77,-0.2 -1,-0.1 -2,-0.1 77,-0.1 0.290 46.3 115.2-105.5 13.1 26.5 -6.5 -8.9 6 7 A E S S- 0 0 89 1,-0.1 2,-0.3 78,-0.1 77,-0.2 -0.376 83.8 -84.5 -70.8 157.3 30.3 -6.2 -8.7 7 8 A N > - 0 0 87 1,-0.2 3,-1.8 -2,-0.1 4,-0.4 -0.513 31.9-144.8 -66.5 123.6 31.9 -7.4 -5.5 8 9 A V G >> S+ 0 0 9 -2,-0.3 4,-2.0 1,-0.3 3,-1.8 0.850 97.5 65.5 -59.1 -32.7 31.8 -4.6 -3.0 9 10 A D G 34 S+ 0 0 84 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.657 91.0 63.9 -66.5 -14.0 35.2 -5.7 -1.7 10 11 A D G <4 S+ 0 0 99 -3,-1.8 -1,-0.3 1,-0.1 -2,-0.2 0.688 116.9 27.2 -77.2 -18.0 36.8 -4.7 -5.0 11 12 A Y T <4 S+ 0 0 72 -3,-1.8 21,-2.7 -4,-0.4 22,-0.5 0.582 124.7 37.2-118.7 -19.2 35.8 -1.0 -4.4 12 13 A Y E < -B 31 0A 1 -4,-2.0 2,-0.4 19,-0.3 19,-0.2 -0.961 59.2-144.9-133.8 150.0 35.7 -0.7 -0.5 13 14 A D E -B 30 0A 82 17,-2.3 17,-2.2 -2,-0.3 2,-0.2 -0.973 26.6-141.5-108.0 134.6 37.6 -2.0 2.5 14 15 A T E +B 29 0A 66 -2,-0.4 15,-0.3 15,-0.2 2,-0.1 -0.634 24.6 168.5 -94.3 154.7 35.5 -2.7 5.5 15 16 A G E + 0 0 45 13,-3.0 -1,-0.1 1,-0.4 14,-0.0 -0.136 44.9 4.6-130.2-131.4 36.4 -2.0 9.1 16 17 A E E S- 0 0 120 11,-0.1 12,-3.1 1,-0.1 -1,-0.4 -0.195 71.3-108.3 -63.7 149.1 34.7 -1.9 12.5 17 18 A E E -B 27 0A 106 10,-0.2 10,-0.3 1,-0.1 -1,-0.1 -0.635 27.9-170.5 -73.2 132.9 31.1 -2.8 13.0 18 19 A L E - 0 0 61 8,-3.1 2,-0.3 1,-0.4 9,-0.2 0.697 56.9 -50.6 -98.9 -27.1 28.9 0.2 13.6 19 20 A G E -B 26 0A 26 7,-1.6 7,-3.1 2,-0.0 -1,-0.4 -0.956 45.5-127.5 170.2 178.3 25.7 -1.5 14.6 20 21 A S E -B 25 0A 80 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.971 16.2-177.3-147.2 156.7 23.1 -4.0 13.7 21 22 A G - 0 0 57 3,-3.1 -2,-0.0 -2,-0.3 5,-0.0 -0.651 49.9 -83.1-133.3-161.8 19.4 -4.2 13.4 22 23 A Q S S+ 0 0 129 -2,-0.2 32,-0.2 1,-0.1 3,-0.1 0.580 129.4 29.7 -82.2 -13.9 16.7 -6.7 12.7 23 24 A F S S+ 0 0 71 1,-0.2 21,-1.6 20,-0.0 2,-0.3 0.620 123.0 19.6-112.9 -17.9 17.3 -6.3 8.9 24 25 A A E - C 0 43A 15 19,-0.2 -3,-3.1 30,-0.1 2,-0.4 -0.919 50.2-134.4-156.7 153.7 21.0 -5.4 8.7 25 26 A V E -BC 20 42A 40 17,-1.6 17,-3.1 -2,-0.3 2,-0.5 -0.983 28.1-152.2-118.1 140.3 24.6 -5.2 9.9 26 27 A V E -BC 19 41A 30 -7,-3.1 -8,-3.1 -2,-0.4 -7,-1.6 -0.965 14.5-178.1-119.3 127.2 26.4 -1.9 9.4 27 28 A K E -BC 17 40A 59 13,-2.5 13,-3.4 -2,-0.5 -10,-0.2 -0.962 30.7-113.0-125.7 139.7 30.1 -1.6 9.0 28 29 A K E - C 0 39A 59 -12,-3.1 -13,-3.0 -2,-0.4 2,-0.3 -0.374 44.8-179.8 -59.8 142.8 32.5 1.3 8.6 29 30 A C E -BC 14 38A 4 9,-2.4 9,-2.1 -15,-0.3 2,-0.4 -0.972 24.5-142.9-146.4 165.8 34.1 1.2 5.2 30 31 A R E -BC 13 37A 117 -17,-2.2 -17,-2.3 -2,-0.3 2,-0.4 -0.996 20.5-129.7-132.0 126.0 36.6 3.1 3.0 31 32 A E E >> -B 12 0A 20 5,-2.9 4,-2.7 -2,-0.4 3,-0.8 -0.617 13.4-146.7 -76.3 128.5 36.2 3.7 -0.7 32 33 A K T 34 S+ 0 0 97 -21,-2.7 -1,-0.1 -2,-0.4 -20,-0.1 0.854 93.7 53.0 -63.8 -36.6 39.5 2.7 -2.5 33 34 A S T 34 S+ 0 0 95 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.638 127.1 17.4 -77.2 -16.9 39.2 5.3 -5.2 34 35 A T T <4 S- 0 0 75 -3,-0.8 -2,-0.2 2,-0.2 -1,-0.2 0.563 88.0-127.6-129.3 -18.3 38.7 8.3 -2.9 35 36 A G < + 0 0 25 -4,-2.7 2,-0.2 1,-0.3 -3,-0.1 0.448 62.6 141.9 73.4 2.7 39.8 7.3 0.6 36 37 A L - 0 0 95 -5,-0.2 -5,-2.9 -6,-0.1 2,-0.3 -0.480 46.6-129.4 -80.7 147.3 36.4 8.5 1.9 37 38 A Q E +C 30 0A 102 -7,-0.2 57,-0.6 -2,-0.2 -7,-0.2 -0.770 30.2 166.2-104.0 145.1 34.6 6.7 4.6 38 39 A Y E -CD 29 93A 30 -9,-2.1 -9,-2.4 -2,-0.3 2,-0.6 -0.778 39.2-106.5-140.2 174.0 31.0 5.5 4.6 39 40 A A E -CD 28 92A 8 53,-2.9 53,-3.3 -2,-0.2 2,-0.7 -0.976 30.2-151.2-110.4 117.8 28.7 3.2 6.6 40 41 A A E -CD 27 91A 1 -13,-3.4 -13,-2.5 -2,-0.6 2,-0.7 -0.816 7.5-160.9 -92.5 115.0 28.0 -0.0 4.6 41 42 A K E -CD 26 90A 16 49,-3.1 49,-2.9 -2,-0.7 2,-0.8 -0.878 2.5-159.8 -99.0 109.0 24.6 -1.4 5.5 42 43 A F E -CD 25 89A 33 -17,-3.1 -17,-1.6 -2,-0.7 2,-0.6 -0.820 7.6-167.2 -91.1 110.3 24.3 -5.0 4.5 43 44 A I E -CD 24 88A 0 45,-3.3 45,-2.3 -2,-0.8 2,-0.3 -0.874 19.1-129.6-102.8 121.7 20.6 -6.0 4.3 44 45 A K E - D 0 87A 73 -21,-1.6 11,-2.3 -2,-0.6 43,-0.2 -0.518 24.7-136.4 -72.0 128.6 19.9 -9.7 4.1 45 46 A K B -f 55 0B 33 41,-3.2 2,-0.2 -2,-0.3 11,-0.2 -0.466 24.4 -95.1 -79.8 155.5 17.5 -10.6 1.2 46 47 A R - 0 0 103 9,-1.4 8,-0.2 -2,-0.1 -1,-0.1 -0.530 27.2-154.1 -66.0 135.5 14.6 -13.0 1.4 47 48 A R S S+ 0 0 168 6,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.637 71.1 26.7 -87.7 -20.1 15.6 -16.4 0.1 48 49 A T S > S- 0 0 81 5,-0.2 3,-0.6 1,-0.0 -2,-0.0 -0.856 81.6-105.0-137.8 174.4 12.1 -17.6 -1.0 49 50 A K T 3 S+ 0 0 213 -2,-0.3 -3,-0.0 1,-0.2 -1,-0.0 0.715 119.5 28.8 -71.7 -20.6 8.7 -16.3 -2.2 50 51 A S T 3 S+ 0 0 107 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.075 89.4 129.6-130.5 22.8 7.0 -16.9 1.1 51 52 A S < - 0 0 11 -3,-0.6 -5,-0.1 1,-0.1 5,-0.1 -0.374 45.4-157.1 -81.5 157.6 9.8 -16.6 3.8 52 53 A R S S+ 0 0 197 -2,-0.1 2,-0.2 3,-0.0 -1,-0.1 0.514 72.5 90.2-104.3 -15.1 9.7 -14.5 7.0 53 54 A R S S+ 0 0 160 2,-0.1 -6,-0.3 -8,-0.0 -5,-0.2 -0.552 85.3 9.2 -80.1 148.0 13.5 -14.3 7.2 54 55 A G S S- 0 0 22 -32,-0.2 2,-0.4 -2,-0.2 -9,-0.2 -0.038 96.4 -64.6 74.1 179.1 15.3 -11.4 5.4 55 56 A V B -f 45 0B 13 -11,-2.3 -9,-1.4 -32,-0.2 -2,-0.1 -0.898 48.5-115.5-109.0 133.9 13.8 -8.3 3.8 56 57 A S > - 0 0 20 -2,-0.4 4,-2.2 -11,-0.2 5,-0.2 -0.242 24.6-118.1 -62.3 152.2 11.5 -8.4 0.8 57 58 A R H > S+ 0 0 86 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.902 115.3 57.4 -61.0 -38.5 12.7 -6.8 -2.4 58 59 A E H > S+ 0 0 115 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.914 108.4 46.3 -54.1 -46.5 9.8 -4.4 -2.3 59 60 A D H > S+ 0 0 60 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.879 112.8 48.9 -68.7 -37.5 10.9 -3.2 1.2 60 61 A I H X S+ 0 0 3 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.940 111.4 49.7 -66.5 -45.0 14.5 -2.9 0.2 61 62 A E H X S+ 0 0 59 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.842 107.9 54.3 -63.7 -35.2 13.7 -0.9 -2.9 62 63 A R H X S+ 0 0 54 -4,-1.8 4,-2.6 -5,-0.2 -1,-0.2 0.951 109.7 46.2 -62.4 -49.0 11.4 1.4 -0.9 63 64 A E H X S+ 0 0 11 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.919 115.3 47.3 -60.4 -44.2 14.3 2.3 1.5 64 65 A V H X S+ 0 0 5 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.926 111.3 50.5 -62.8 -44.5 16.7 2.8 -1.4 65 66 A S H X S+ 0 0 64 -4,-2.7 4,-1.1 2,-0.2 -2,-0.2 0.950 113.2 45.9 -59.2 -48.7 14.2 5.0 -3.3 66 67 A I H >X S+ 0 0 3 -4,-2.6 3,-0.9 1,-0.2 4,-0.8 0.940 113.0 49.4 -60.7 -48.1 13.6 7.2 -0.3 67 68 A L H >< S+ 0 0 2 -4,-2.7 3,-0.7 1,-0.3 11,-0.6 0.859 105.2 58.6 -60.4 -35.9 17.3 7.5 0.6 68 69 A K H 3< S+ 0 0 131 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.815 104.4 52.2 -63.9 -27.5 18.1 8.4 -3.0 69 70 A E H << S+ 0 0 72 -4,-1.1 2,-0.2 -3,-0.9 -1,-0.2 0.703 91.6 98.4 -78.3 -21.8 15.7 11.4 -2.8 70 71 A I << + 0 0 7 -4,-0.8 8,-0.3 -3,-0.7 2,-0.2 -0.484 30.5 151.6 -82.9 132.2 17.3 12.8 0.4 71 72 A Q + 0 0 140 -2,-0.2 5,-0.1 6,-0.1 6,-0.1 -0.692 28.9 119.0-153.2 101.7 19.8 15.6 0.6 72 73 A H > - 0 0 39 3,-0.4 3,-1.8 -2,-0.2 53,-0.0 -0.961 66.8-114.6-161.1 143.0 19.7 17.7 3.8 73 74 A P T 3 S+ 0 0 91 0, 0.0 52,-0.1 0, 0.0 -1,-0.0 0.719 113.5 50.4 -56.6 -23.8 22.3 18.3 6.7 74 75 A N T 3 S+ 0 0 16 83,-0.1 84,-2.5 50,-0.1 2,-0.3 0.229 105.0 61.1-103.7 12.9 20.1 16.5 9.3 75 76 A V B < S-g 158 0C 0 -3,-1.8 -3,-0.4 82,-0.3 84,-0.2 -0.957 84.8-109.6-129.5 153.2 19.5 13.3 7.3 76 77 A I - 0 0 6 82,-1.8 2,-0.3 -2,-0.3 -6,-0.1 -0.479 32.8-142.9 -74.6 156.0 21.9 10.6 6.0 77 78 A T - 0 0 24 -2,-0.1 16,-2.6 -6,-0.1 2,-0.5 -0.761 11.3-116.3-118.6 164.4 22.4 10.3 2.3 78 79 A L E + E 0 92A 29 -11,-0.6 14,-0.2 -8,-0.3 3,-0.1 -0.890 25.4 178.0-104.2 127.6 23.0 7.4 0.0 79 80 A H E - 0 0 77 12,-3.3 2,-0.3 -2,-0.5 13,-0.2 0.891 63.5 -21.7 -93.2 -46.9 26.3 7.2 -1.8 80 81 A E E - E 0 91A 37 11,-1.3 11,-3.2 2,-0.0 2,-0.4 -0.977 52.0-138.5-158.8 157.6 26.0 3.9 -3.8 81 82 A V E + E 0 90A 14 -2,-0.3 -77,-1.2 9,-0.2 2,-0.3 -0.998 19.2 176.9-129.0 133.2 24.1 0.6 -3.8 82 83 A Y E -aE 4 89A 1 7,-2.7 7,-2.9 -2,-0.4 2,-0.3 -0.829 5.8-171.0-117.6 163.8 25.5 -2.9 -4.5 83 84 A E E + E 0 88A 5 -79,-2.5 2,-0.3 -2,-0.3 5,-0.2 -0.994 11.4 171.5-150.7 154.4 23.8 -6.3 -4.4 84 85 A N - 0 0 74 3,-2.4 -78,-0.1 -2,-0.3 -81,-0.1 -0.811 58.0 -73.8-140.6-169.9 24.6 -9.9 -4.6 85 86 A K S S+ 0 0 198 -2,-0.3 3,-0.1 1,-0.2 -40,-0.1 0.823 128.4 31.7 -58.5 -30.6 22.6 -13.1 -4.1 86 87 A T S S+ 0 0 86 1,-0.2 -41,-3.2 -42,-0.1 2,-0.3 0.852 120.5 24.1 -98.0 -36.1 22.5 -12.7 -0.3 87 88 A D E -D 44 0A 34 -43,-0.2 -3,-2.4 2,-0.0 2,-0.5 -0.887 51.7-139.9-131.9 153.6 22.5 -9.0 0.4 88 89 A V E -DE 43 83A 0 -45,-2.3 -45,-3.3 -2,-0.3 2,-0.6 -0.970 31.0-153.3-103.5 135.8 21.7 -5.5 -0.8 89 90 A I E -DE 42 82A 2 -7,-2.9 -7,-2.7 -2,-0.5 2,-0.6 -0.940 6.2-162.4-116.2 113.3 24.6 -3.3 0.4 90 91 A L E -DE 41 81A 0 -49,-2.9 -49,-3.1 -2,-0.6 2,-1.0 -0.841 9.9-149.1 -96.5 122.9 23.8 0.4 0.9 91 92 A I E -DE 40 80A 0 -11,-3.2 -12,-3.3 -2,-0.6 -11,-1.3 -0.830 31.0-176.8 -93.4 105.3 26.8 2.6 1.1 92 93 A L E -DE 39 78A 13 -53,-3.3 -53,-2.9 -2,-1.0 -14,-0.2 -0.648 35.6 -86.2-103.9 157.0 25.5 5.4 3.4 93 94 A E E -D 38 0A 49 -16,-2.6 2,-0.3 -2,-0.2 -55,-0.2 -0.393 53.5-116.7 -52.7 131.1 26.9 8.6 4.7 94 95 A L - 0 0 28 -57,-0.6 2,-0.6 -2,-0.1 -1,-0.1 -0.601 25.1-167.9 -77.7 130.6 29.0 7.8 7.8 95 96 A V + 0 0 8 -2,-0.3 3,-0.5 1,-0.1 52,-0.1 -0.954 11.4 177.2-117.9 108.0 27.8 9.2 11.1 96 97 A A + 0 0 71 -2,-0.6 51,-0.2 51,-0.4 53,-0.1 0.440 57.5 79.5 -99.1 -3.2 30.8 8.5 13.4 97 98 A G S S- 0 0 9 49,-2.1 -1,-0.2 1,-0.2 50,-0.2 0.278 94.0-118.5 -92.7 10.0 29.7 10.1 16.7 98 99 A G - 0 0 23 -3,-0.5 48,-2.9 48,-0.2 -1,-0.2 0.011 44.0 -44.2 80.1 174.4 27.4 7.3 17.9 99 100 A E B > -H 145 0C 47 46,-0.2 4,-1.9 1,-0.1 3,-0.4 -0.398 39.9-126.3 -77.4 151.2 23.7 7.3 18.7 100 101 A L H > S+ 0 0 0 44,-3.7 4,-2.5 41,-0.9 42,-0.2 0.844 114.6 64.0 -60.2 -33.1 21.8 9.9 20.6 101 102 A F H > S+ 0 0 103 40,-1.2 4,-1.4 43,-0.4 -1,-0.2 0.871 103.9 43.9 -53.3 -44.7 20.7 6.9 22.7 102 103 A D H > S+ 0 0 72 -3,-0.4 4,-1.8 2,-0.2 -2,-0.2 0.886 112.2 53.1 -70.0 -41.2 24.4 6.3 23.8 103 104 A F H X S+ 0 0 26 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.893 109.7 48.0 -61.5 -43.7 25.0 10.0 24.4 104 105 A L H < S+ 0 0 29 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.842 108.0 55.6 -65.4 -37.1 22.0 10.2 26.7 105 106 A A H < S+ 0 0 79 -4,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.875 105.7 52.3 -62.6 -38.8 23.1 7.0 28.6 106 107 A E H < 0 0 129 -4,-1.8 -2,-0.2 1,-0.1 -1,-0.2 0.884 360.0 360.0 -67.4 -43.3 26.5 8.7 29.3 107 108 A K < 0 0 100 -4,-1.6 -2,-0.2 -5,-0.1 -3,-0.2 0.545 360.0 360.0-115.0 360.0 24.9 11.8 30.8 108 ! 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 0.0 109 110 A S 0 0 76 0, 0.0 2,-0.3 0, 0.0 101,-0.2 0.000 360.0 360.0 360.0 140.2 19.1 14.1 31.4 110 111 A L - 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0 0 30 -2,-0.3 3,-0.3 1,-0.1 -9,-0.1 -0.833 15.2-144.5-101.2 127.6 10.1 7.1 29.1 215 216 A P S S+ 0 0 14 0, 0.0 19,-0.3 0, 0.0 -1,-0.1 0.758 91.8 21.2 -66.8 -30.4 6.5 8.3 29.2 216 217 A F S S+ 0 0 2 -35,-0.2 11,-0.2 17,-0.1 12,-0.2 0.396 83.6 137.2-115.7 -3.2 4.6 5.1 28.3 217 218 A L + 0 0 95 -3,-0.3 2,-0.2 -36,-0.1 4,-0.1 -0.274 26.3 177.3 -62.6 123.7 7.1 2.4 29.1 218 219 A G - 0 0 18 2,-0.4 6,-0.1 -2,-0.1 -2,-0.1 -0.448 46.3 -93.5-108.8-171.7 5.5 -0.6 30.9 219 220 A D S S+ 0 0 159 -2,-0.2 2,-0.3 2,-0.0 3,-0.1 0.657 108.6 31.3 -83.5 -15.2 7.1 -3.9 32.0 220 221 A T S > S- 0 0 36 1,-0.1 4,-2.2 61,-0.0 -2,-0.4 -0.940 86.2-111.5-134.4 162.7 6.1 -5.7 28.8 221 222 A K H > S+ 0 0 62 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.916 118.2 52.3 -58.2 -44.8 5.6 -4.6 25.2 222 223 A Q H > S+ 0 0 109 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.875 108.5 50.7 -61.6 -36.7 1.9 -5.1 25.4 223 224 A E H > S+ 0 0 83 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.907 109.8 50.0 -66.6 -42.0 1.6 -3.0 28.5 224 225 A T H X S+ 0 0 3 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.934 112.2 48.3 -57.9 -46.5 3.6 -0.2 26.8 225 226 A L H X S+ 0 0 21 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.897 110.5 50.3 -64.8 -40.2 1.2 -0.4 23.8 226 227 A A H X S+ 0 0 58 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.911 110.9 50.0 -61.7 -41.0 -1.8 -0.3 26.1 227 228 A N H <>S+ 0 0 40 -4,-2.4 5,-2.9 -11,-0.2 4,-0.5 0.907 110.2 50.5 -64.4 -42.8 -0.4 2.8 27.8 228 229 A V H ><5S+ 0 0 0 -4,-2.6 3,-1.4 1,-0.2 -2,-0.2 0.940 109.7 49.3 -60.0 -50.5 0.2 4.4 24.4 229 230 A S H 3<5S+ 0 0 23 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.855 115.4 44.3 -58.8 -37.1 -3.3 3.8 23.2 230 231 A A T 3<5S- 0 0 69 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.442 108.6-123.5 -84.8 -1.6 -4.8 5.2 26.4 231 232 A V T < 5 + 0 0 41 -3,-1.4 2,-1.5 -4,-0.5 -3,-0.2 0.925 45.8 175.3 51.3 47.3 -2.4 8.2 26.4 232 233 A N < + 0 0 95 -5,-2.9 2,-0.3 -6,-0.1 -1,-0.2 -0.630 27.5 112.2 -87.4 76.3 -1.3 7.0 29.9 233 234 A Y - 0 0 46 -2,-1.5 2,-0.3 -3,-0.2 -17,-0.1 -0.976 36.2-179.7-138.4 160.0 1.5 9.4 30.7 234 235 A E - 0 0 119 -2,-0.3 2,-1.2 -19,-0.3 -2,-0.0 -0.981 37.7-104.3-149.5 161.0 2.1 12.2 33.2 235 236 A F - 0 0 28 -2,-0.3 2,-0.1 5,-0.0 5,-0.1 -0.717 39.3-142.1 -87.7 98.5 4.9 14.6 34.0 236 237 A E >> - 0 0 78 -2,-1.2 4,-2.5 1,-0.2 3,-1.1 -0.343 5.6-138.8 -63.1 129.4 6.4 13.2 37.2 237 238 A D H 3> S+ 0 0 114 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.867 100.9 64.1 -57.3 -34.7 7.3 16.0 39.6 238 239 A E H 34 S+ 0 0 170 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.842 117.2 28.1 -57.9 -34.1 10.6 14.3 40.5 239 240 A Y H <4 S+ 0 0 109 -3,-1.1 -1,-0.2 1,-0.1 -2,-0.2 0.750 132.9 31.6 -94.9 -30.3 11.7 14.7 36.9 240 241 A F H >< S+ 0 0 1 -4,-2.5 3,-1.6 1,-0.1 -3,-0.2 0.325 77.2 107.7-119.0 4.5 9.9 17.8 35.8 241 242 A S T 3< S+ 0 0 83 -4,-2.2 -1,-0.1 1,-0.3 -3,-0.1 0.776 95.0 34.0 -60.9 -27.6 9.5 20.1 38.8 242 243 A N T 3 S+ 0 0 161 -5,-0.2 2,-0.3 -3,-0.2 -1,-0.3 0.195 94.8 110.8-110.1 13.8 12.1 22.6 37.5 243 244 A T S < S- 0 0 24 -3,-1.6 -3,-0.1 1,-0.1 5,-0.1 -0.706 79.0-100.1 -85.4 139.3 11.3 22.1 33.8 244 245 A S > - 0 0 38 -2,-0.3 4,-1.7 1,-0.1 3,-0.3 -0.219 18.3-129.1 -62.3 148.6 9.7 25.0 32.1 245 246 A A H > S+ 0 0 77 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.838 109.5 58.9 -66.4 -31.0 5.9 25.0 31.6 246 247 A L H > S+ 0 0 72 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.854 102.6 53.2 -63.9 -37.2 6.4 25.9 27.9 247 248 A A H > S+ 0 0 0 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.928 110.1 46.6 -61.9 -46.7 8.5 22.7 27.5 248 249 A K H X S+ 0 0 37 -4,-1.7 4,-3.1 2,-0.2 -2,-0.2 0.888 109.7 55.4 -61.4 -37.7 5.6 20.7 29.0 249 250 A D H X S+ 0 0 37 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.934 105.8 51.6 -60.4 -46.7 3.2 22.6 26.7 250 251 A F H < S+ 0 0 0 -4,-2.3 4,-0.5 1,-0.2 3,-0.3 0.938 113.6 43.5 -54.7 -50.5 5.2 21.5 23.6 251 252 A I H >X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 3,-1.6 0.922 109.7 56.4 -64.6 -44.5 5.1 17.9 24.7 252 253 A R H 3< S+ 0 0 121 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.819 104.7 53.4 -55.1 -33.8 1.4 18.0 25.6 253 254 A R T 3< S+ 0 0 129 -4,-1.7 10,-2.1 -3,-0.3 -1,-0.3 0.560 113.3 43.0 -83.4 -6.6 0.6 19.2 22.1 254 255 A L T <4 S+ 0 0 0 -3,-1.6 2,-1.9 -4,-0.5 -2,-0.2 0.729 100.3 67.8-100.9 -37.3 2.4 16.3 20.5 255 256 A L S < S+ 0 0 5 -4,-2.5 2,-0.4 -52,-0.1 -1,-0.1 -0.401 73.4 133.4 -86.6 64.3 1.2 13.5 22.8 256 257 A V - 0 0 36 -2,-1.9 6,-0.2 -3,-0.2 -25,-0.1 -0.948 53.9-144.2-119.1 127.8 -2.4 13.8 21.5 257 258 A K S S+ 0 0 99 -2,-0.4 -71,-0.2 -72,-0.1 -1,-0.1 0.917 85.8 70.4 -61.0 -47.0 -4.4 10.7 20.5 258 259 A D S >> S- 0 0 46 1,-0.2 3,-1.6 -73,-0.1 4,-0.8 -0.609 73.6-152.9 -76.3 112.5 -6.3 12.2 17.6 259 260 A P G >4 S+ 0 0 32 0, 0.0 3,-0.6 0, 0.0 -1,-0.2 0.834 93.4 60.4 -58.4 -27.7 -3.7 12.7 14.9 260 261 A K G 34 S+ 0 0 163 1,-0.2 4,-0.1 -3,-0.0 -2,-0.1 0.752 106.4 46.3 -69.2 -22.9 -5.7 15.6 13.4 261 262 A K G <4 S+ 0 0 159 -3,-1.6 -1,-0.2 2,-0.1 2,-0.1 0.553 92.5 100.6 -95.3 -11.1 -5.4 17.6 16.7 262 263 A R S << S- 0 0 8 -4,-0.8 -8,-0.2 -3,-0.6 -9,-0.1 -0.415 86.1 -95.9 -73.0 146.6 -1.6 16.9 17.1 263 264 A M - 0 0 18 -10,-2.1 2,-0.1 -13,-0.2 -1,-0.1 -0.401 38.4-134.2 -59.4 140.5 0.8 19.7 16.2 264 265 A T > - 0 0 66 -4,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.389 30.0 -98.9 -83.1 171.7 2.2 19.4 12.7 265 266 A I H > S+ 0 0 12 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.921 127.5 50.7 -60.2 -39.6 5.9 19.8 12.0 266 267 A Q H > S+ 0 0 115 1,-0.2 4,-1.0 2,-0.2 3,-0.2 0.925 109.4 50.7 -63.1 -43.3 5.3 23.4 10.9 267 268 A D H >> S+ 0 0 80 1,-0.2 4,-0.9 2,-0.2 3,-0.6 0.891 106.7 55.1 -55.9 -43.1 3.3 24.0 14.1 268 269 A S H 3< S+ 0 0 0 -4,-2.4 3,-0.3 1,-0.3 6,-0.2 0.850 105.5 51.6 -64.5 -32.9 6.2 22.6 16.2 269 270 A L H 3< S+ 0 0 30 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.732 112.5 46.2 -75.7 -20.9 8.7 25.1 14.6 270 271 A Q H << S+ 0 0 114 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.505 84.5 118.9 -96.7 -8.9 6.4 28.0 15.4 271 272 A H S >X S- 0 0 10 -4,-0.9 4,-2.9 -3,-0.3 3,-1.8 -0.332 75.7-120.7 -59.7 137.0 5.7 26.9 19.0 272 273 A P T 34 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 -26,-0.1 0.732 111.6 58.9 -57.4 -20.8 6.9 29.5 21.5 273 274 A W T 34 S+ 0 0 30 -27,-0.2 -26,-0.1 1,-0.1 -4,-0.1 0.821 121.0 26.0 -72.0 -29.3 9.3 27.0 23.1 274 275 A I T <4 S+ 0 0 6 -3,-1.8 -1,-0.1 -6,-0.2 -5,-0.1 0.834 95.6 98.5-100.7 -44.5 11.1 26.5 19.7 275 276 A K < 0 0 105 -4,-2.9 -5,-0.1 -7,-0.2 -6,-0.0 -0.270 360.0 360.0 -59.1 128.1 10.6 29.7 17.7 276 277 A P 0 0 154 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.731 360.0 360.0 -60.6 360.0 13.6 32.2 17.9 277 ! 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 0.0 278 291 A P 0 0 94 0, 0.0 -256,-0.0 0, 0.0 -100,-0.0 0.000 360.0 360.0 360.0 -36.0 8.5 -6.3 16.1 279 292 A Q + 0 0 18 -100,-0.1 2,-0.3 -99,-0.1 -54,-0.1 0.502 360.0 83.6-104.6 -8.7 5.6 -5.4 18.4 280 293 A F 0 0 146 -59,-0.1 0, 0.0 -58,-0.0 0, 0.0 -0.773 360.0 360.0-103.3 140.1 5.2 -9.0 19.9 281 294 A E 0 0 158 -2,-0.3 -2,-0.1 -3,-0.0 -61,-0.0 -0.624 360.0 360.0 -81.7 360.0 7.1 -10.6 22.7