==== 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 3EH9 . COMPND 2 MOLECULE: DEATH-ASSOCIATED PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.K.MCNAMARA,D.M.WATTERSON,J.S.BRUNZELLE . 278 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14093.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 64.0 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 . 44 15.8 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 . 18 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 27.7 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 0 0 2 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 0 3 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 0 120 0, 0.0 2,-0.3 0, 0.0 60,-0.0 0.000 360.0 360.0 360.0 146.2 -15.2 -1.9 10.0 2 3 A V - 0 0 111 81,-0.0 2,-0.2 59,-0.0 3,-0.0 -0.782 360.0-149.6-110.3 156.7 -18.7 -3.6 10.0 3 4 A F - 0 0 17 -2,-0.3 79,-0.2 1,-0.1 2,-0.2 -0.622 41.2 -62.8-118.6 170.7 -21.8 -2.4 8.2 4 5 A R B -a 82 0A 82 77,-1.3 79,-2.6 -2,-0.2 -1,-0.1 -0.342 42.9-167.6 -57.6 124.2 -25.6 -2.8 8.9 5 6 A Q + 0 0 126 77,-0.2 -1,-0.1 -2,-0.2 3,-0.1 0.362 45.5 116.0-105.8 8.6 -26.5 -6.5 8.7 6 7 A E S S- 0 0 81 1,-0.1 2,-0.3 2,-0.1 77,-0.2 -0.368 85.2 -84.4 -62.9 153.1 -30.3 -6.2 8.6 7 8 A N > - 0 0 86 1,-0.2 3,-1.8 2,-0.1 4,-0.4 -0.466 34.5-144.3 -62.2 122.3 -31.9 -7.5 5.4 8 9 A V G >> S+ 0 0 9 -2,-0.3 3,-1.9 1,-0.3 4,-1.9 0.855 97.6 65.5 -59.6 -32.7 -31.7 -4.6 3.0 9 10 A D G 34 S+ 0 0 81 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.622 89.6 66.1 -67.1 -12.7 -35.2 -5.7 1.6 10 11 A D G <4 S+ 0 0 98 -3,-1.8 -1,-0.3 1,-0.1 -2,-0.2 0.717 116.3 26.4 -73.7 -21.2 -36.7 -4.8 5.0 11 12 A Y T <4 S+ 0 0 86 -3,-1.9 21,-2.7 -4,-0.4 22,-0.5 0.567 124.3 39.6-120.8 -18.8 -35.8 -1.1 4.3 12 13 A Y E < -B 31 0A 1 -4,-1.9 2,-0.4 19,-0.3 19,-0.2 -0.967 59.5-144.7-134.4 150.1 -35.8 -0.8 0.6 13 14 A D E -B 30 0A 84 17,-2.3 17,-2.0 -2,-0.3 2,-0.2 -0.966 25.3-142.6-109.1 134.1 -37.7 -2.1 -2.5 14 15 A T E +B 29 0A 62 -2,-0.4 15,-0.3 15,-0.2 2,-0.1 -0.668 24.1 167.3 -97.7 152.3 -35.6 -2.7 -5.6 15 16 A G E + 0 0 49 13,-3.1 -1,-0.1 1,-0.4 14,-0.0 -0.104 45.6 5.8-129.2-132.2 -36.6 -2.1 -9.2 16 17 A E E S- 0 0 118 11,-0.1 12,-3.1 1,-0.1 2,-0.4 -0.176 70.3-109.9 -62.7 149.8 -34.8 -2.0 -12.6 17 18 A E E -B 27 0A 107 10,-0.2 10,-0.3 1,-0.1 -1,-0.1 -0.672 29.5-173.5 -78.1 129.4 -31.2 -2.9 -13.1 18 19 A L E - 0 0 69 8,-3.0 2,-0.3 -2,-0.4 9,-0.2 0.684 57.9 -30.6 -97.5 -26.2 -29.1 0.2 -13.8 19 20 A G E -B 26 0A 26 7,-1.6 7,-3.1 2,-0.0 -1,-0.3 -0.975 49.5-134.7 176.6 172.3 -25.8 -1.4 -14.6 20 21 A S E +B 25 0A 88 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.869 21.2 160.8-137.6 162.0 -23.3 -4.2 -14.1 21 22 A G E > -B 24 0A 50 3,-2.3 3,-0.7 -2,-0.3 2,-0.5 -0.936 52.8 -43.3-157.3-178.5 -19.6 -4.7 -13.6 22 23 A Q T 3 S- 0 0 142 -2,-0.3 3,-0.0 1,-0.2 0, 0.0 -0.566 127.4 -16.4 -45.9 106.6 -16.8 -6.8 -12.5 23 24 A F T 3 S+ 0 0 83 -2,-0.5 21,-2.7 1,-0.1 2,-0.3 0.515 123.8 87.5 54.8 22.5 -18.3 -8.2 -9.3 24 25 A A E < -BC 21 43A 18 -3,-0.7 -3,-2.3 19,-0.2 2,-0.4 -0.997 48.4-168.7-143.4 147.1 -21.1 -5.7 -8.9 25 26 A V E -BC 20 42A 35 17,-1.5 17,-3.1 -2,-0.3 2,-0.5 -0.991 14.9-151.6-129.7 140.3 -24.7 -5.1 -10.0 26 27 A V E -BC 19 41A 33 -7,-3.1 -8,-3.0 -2,-0.4 -7,-1.6 -0.967 16.1-179.0-117.7 124.2 -26.5 -1.8 -9.6 27 28 A K E -BC 17 40A 66 13,-2.5 13,-3.3 -2,-0.5 -10,-0.2 -0.956 30.6-113.2-123.8 139.3 -30.3 -1.7 -9.1 28 29 A K E + C 0 39A 52 -12,-3.1 -13,-3.1 -2,-0.4 2,-0.3 -0.398 45.1 176.0 -60.9 143.8 -32.7 1.2 -8.7 29 30 A C E -BC 14 38A 4 9,-2.4 9,-2.2 -15,-0.3 2,-0.4 -0.955 25.9-141.8-147.3 171.5 -34.3 1.2 -5.3 30 31 A R E -BC 13 37A 117 -17,-2.0 -17,-2.3 -2,-0.3 2,-0.4 -0.994 21.2-127.9-140.4 124.2 -36.6 3.1 -3.0 31 32 A E E >> -B 12 0A 20 5,-2.8 4,-2.5 -2,-0.4 3,-0.6 -0.596 14.9-146.1 -74.9 128.7 -36.3 3.6 0.8 32 33 A K T 34 S+ 0 0 99 -21,-2.7 -1,-0.1 -2,-0.4 -20,-0.1 0.843 93.8 52.3 -62.9 -38.1 -39.5 2.6 2.5 33 34 A S T 34 S+ 0 0 97 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.681 127.2 18.4 -75.2 -21.8 -39.3 5.2 5.3 34 35 A T T <4 S- 0 0 77 -3,-0.6 -2,-0.2 2,-0.2 -1,-0.2 0.555 88.6-129.8-122.9 -19.3 -38.8 8.3 3.0 35 36 A G < + 0 0 25 -4,-2.5 2,-0.2 1,-0.3 -3,-0.1 0.498 60.7 143.2 71.7 6.6 -39.9 7.2 -0.5 36 37 A L - 0 0 97 -5,-0.2 -5,-2.8 -6,-0.1 2,-0.3 -0.515 46.6-126.9 -82.9 149.9 -36.6 8.5 -1.8 37 38 A Q E +C 30 0A 107 -7,-0.2 57,-0.6 -2,-0.2 -7,-0.3 -0.723 31.9 165.1-103.7 145.8 -34.9 6.7 -4.6 38 39 A Y E -CD 29 93A 29 -9,-2.2 -9,-2.4 -2,-0.3 2,-0.5 -0.794 38.6-107.2-141.0 175.3 -31.3 5.5 -4.7 39 40 A A E -CD 28 92A 9 53,-2.8 53,-3.4 -2,-0.2 2,-0.7 -0.980 29.3-151.6-113.0 118.8 -29.0 3.2 -6.6 40 41 A A E -CD 27 91A 2 -13,-3.3 -13,-2.5 -2,-0.5 2,-0.7 -0.821 6.8-161.5 -94.0 116.2 -28.1 0.0 -4.7 41 42 A K E -CD 26 90A 24 49,-3.1 49,-2.8 -2,-0.7 2,-0.8 -0.895 3.2-159.3-101.2 109.9 -24.7 -1.3 -5.7 42 43 A F E -CD 25 89A 28 -17,-3.1 -17,-1.5 -2,-0.7 2,-0.6 -0.818 7.9-166.2 -92.1 109.9 -24.3 -5.0 -4.7 43 44 A I E -CD 24 88A 4 45,-3.2 45,-2.2 -2,-0.8 2,-0.3 -0.855 19.0-128.1-101.6 121.8 -20.6 -5.9 -4.5 44 45 A K E - D 0 87A 68 -21,-2.7 11,-2.7 -2,-0.6 43,-0.2 -0.534 24.7-137.5 -70.8 127.6 -19.8 -9.6 -4.3 45 46 A K B -f 55 0B 33 41,-2.9 11,-0.2 -2,-0.3 2,-0.1 -0.423 26.9 -90.7 -78.0 155.8 -17.5 -10.5 -1.4 46 47 A R - 0 0 113 9,-1.3 8,-0.2 8,-0.2 -1,-0.1 -0.451 27.3-154.2 -59.7 135.1 -14.5 -12.9 -1.5 47 48 A R S S+ 0 0 181 6,-0.4 2,-0.3 -2,-0.1 -1,-0.1 0.725 76.8 11.1 -85.2 -26.8 -15.5 -16.5 -0.6 48 49 A T S S- 0 0 85 1,-0.1 -1,-0.1 0, 0.0 0, 0.0 -0.922 87.0 -95.6-141.7 169.8 -12.0 -17.4 0.6 49 50 A K S S+ 0 0 188 -2,-0.3 -1,-0.1 1,-0.1 -3,-0.0 0.942 120.4 22.0 -48.9 -58.5 -8.7 -15.7 1.5 50 51 A S 0 0 105 -3,-0.1 -1,-0.1 -4,-0.0 -4,-0.0 0.970 360.0 360.0 -80.8 -58.0 -7.1 -16.3 -1.9 51 52 A S 0 0 68 -5,-0.0 -4,-0.0 -4,-0.0 -2,-0.0 0.927 360.0 360.0 42.5 360.0 -10.0 -16.9 -4.3 52 ! 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 53 54 A R 0 0 224 0, 0.0 -6,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 142.5 -13.7 -14.0 -7.6 54 55 A G - 0 0 11 -8,-0.2 2,-0.4 -7,-0.1 -9,-0.3 -0.054 360.0 -67.4 79.5 175.6 -15.3 -11.1 -5.6 55 56 A V B -f 45 0B 29 -11,-2.7 -9,-1.3 -32,-0.2 -12,-0.0 -0.879 46.8-114.0-111.1 135.6 -13.8 -8.1 -4.0 56 57 A S > - 0 0 12 -2,-0.4 4,-2.2 -11,-0.2 5,-0.2 -0.273 24.2-120.4 -63.0 151.2 -11.4 -8.3 -0.9 57 58 A R H > S+ 0 0 88 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.888 114.6 55.9 -61.9 -36.5 -12.7 -6.8 2.3 58 59 A E H > S+ 0 0 122 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.920 108.3 48.5 -60.1 -43.6 -9.8 -4.4 2.4 59 60 A D H > S+ 0 0 69 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.909 112.5 47.4 -64.0 -43.1 -10.8 -3.1 -1.1 60 61 A I H X S+ 0 0 2 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.917 111.1 51.3 -65.8 -42.5 -14.5 -2.7 -0.2 61 62 A E H X S+ 0 0 61 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.859 108.8 51.3 -63.9 -35.8 -13.6 -0.9 3.1 62 63 A R H X S+ 0 0 49 -4,-1.9 4,-2.6 -5,-0.2 5,-0.2 0.942 110.4 48.5 -65.2 -46.1 -11.4 1.5 1.2 63 64 A E H X S+ 0 0 10 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.919 114.3 46.3 -59.1 -45.2 -14.2 2.3 -1.4 64 65 A V H X S+ 0 0 4 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.927 110.9 51.9 -64.7 -44.2 -16.6 2.9 1.5 65 66 A S H X S+ 0 0 66 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.944 113.1 44.9 -57.0 -50.0 -14.2 5.1 3.4 66 67 A I H >X S+ 0 0 1 -4,-2.6 3,-1.1 1,-0.2 4,-0.8 0.930 112.2 51.5 -61.0 -46.4 -13.6 7.3 0.4 67 68 A L H >< S+ 0 0 4 -4,-2.6 3,-0.9 1,-0.3 11,-0.6 0.878 104.4 58.0 -61.2 -36.1 -17.3 7.5 -0.5 68 69 A K H 3< S+ 0 0 137 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.778 103.4 53.0 -66.2 -22.5 -18.1 8.6 3.1 69 70 A E H << S+ 0 0 71 -3,-1.1 -1,-0.2 -4,-0.9 2,-0.2 0.716 91.6 100.6 -81.0 -20.0 -15.8 11.6 2.8 70 71 A I << + 0 0 7 -3,-0.9 8,-0.4 -4,-0.8 2,-0.2 -0.474 29.2 146.9 -85.8 134.1 -17.4 12.9 -0.4 71 72 A Q + 0 0 140 -2,-0.2 5,-0.1 6,-0.1 6,-0.1 -0.674 26.9 120.4-159.8 104.3 -19.9 15.7 -0.8 72 73 A H > - 0 0 40 3,-0.4 3,-1.8 -2,-0.2 53,-0.0 -0.964 66.6-113.1-162.4 144.1 -19.8 17.8 -3.9 73 74 A P T 3 S+ 0 0 94 0, 0.0 52,-0.1 0, 0.0 -1,-0.0 0.744 115.0 48.4 -55.4 -26.2 -22.3 18.5 -6.7 74 75 A N T 3 S+ 0 0 16 83,-0.1 84,-2.7 2,-0.1 2,-0.3 0.220 103.6 69.0-103.0 12.5 -20.2 16.7 -9.3 75 76 A V B < S-g 158 0C 0 -3,-1.8 -3,-0.4 82,-0.3 84,-0.2 -0.956 84.5-108.9-127.3 147.2 -19.5 13.5 -7.3 76 77 A I - 0 0 4 82,-2.2 2,-0.3 -2,-0.3 -6,-0.1 -0.386 34.3-142.0 -63.1 151.5 -21.8 10.7 -6.2 77 78 A T - 0 0 23 -6,-0.1 16,-2.6 -2,-0.1 2,-0.5 -0.855 7.0-125.4-118.3 158.6 -22.7 10.4 -2.5 78 79 A L E + E 0 92A 30 -11,-0.6 14,-0.2 -8,-0.4 3,-0.1 -0.887 22.3 178.9-105.5 125.9 -23.1 7.5 -0.3 79 80 A H E - 0 0 78 12,-3.0 2,-0.3 -2,-0.5 13,-0.2 0.899 63.2 -21.3 -89.8 -47.2 -26.4 7.2 1.6 80 81 A E E - E 0 91A 37 11,-1.2 11,-2.9 2,-0.0 2,-0.4 -0.970 52.3-137.3-157.7 160.9 -26.0 4.0 3.6 81 82 A V E + E 0 90A 13 -2,-0.3 -77,-1.3 9,-0.2 2,-0.3 -0.999 20.2 175.8-130.4 131.5 -24.1 0.7 3.7 82 83 A Y E -aE 4 89A 1 7,-2.5 7,-3.3 -2,-0.4 2,-0.3 -0.831 6.6-172.3-118.7 163.6 -25.5 -2.8 4.3 83 84 A E E + E 0 88A 6 -79,-2.6 2,-0.3 -2,-0.3 5,-0.2 -0.994 11.5 172.6-152.3 156.4 -23.8 -6.2 4.2 84 85 A N - 0 0 70 3,-2.6 -78,-0.1 -2,-0.3 -81,-0.0 -0.795 57.1 -73.8-142.7-169.2 -24.6 -9.9 4.4 85 86 A K S S+ 0 0 186 -2,-0.3 3,-0.1 1,-0.2 -40,-0.1 0.803 128.8 32.0 -63.3 -28.3 -22.5 -13.0 3.9 86 87 A T S S+ 0 0 56 1,-0.2 -41,-2.9 -42,-0.1 2,-0.3 0.826 121.3 24.2 -98.9 -33.2 -22.5 -12.7 0.1 87 88 A D E -D 44 0A 32 -43,-0.2 -3,-2.6 2,-0.0 2,-0.4 -0.931 51.7-140.5-133.2 151.5 -22.5 -8.9 -0.6 88 89 A V E -DE 43 83A 1 -45,-2.2 -45,-3.2 -2,-0.3 2,-0.6 -0.943 32.6-151.8-100.0 139.6 -21.7 -5.4 0.6 89 90 A I E -DE 42 82A 2 -7,-3.3 -7,-2.5 -2,-0.4 2,-0.6 -0.943 7.4-162.1-120.4 110.6 -24.6 -3.2 -0.5 90 91 A L E -DE 41 81A 0 -49,-2.8 -49,-3.1 -2,-0.6 2,-1.0 -0.837 9.0-151.0 -93.1 122.8 -23.9 0.5 -1.1 91 92 A I E -DE 40 80A 0 -11,-2.9 -12,-3.0 -2,-0.6 -11,-1.2 -0.839 31.0-177.5 -91.6 104.2 -26.9 2.7 -1.2 92 93 A L E -DE 39 78A 21 -53,-3.4 -53,-2.8 -2,-1.0 -14,-0.2 -0.648 35.6 -85.8-104.6 157.7 -25.7 5.4 -3.5 93 94 A E E -D 38 0A 48 -16,-2.6 2,-0.4 -2,-0.2 -55,-0.2 -0.390 52.0-117.3 -51.7 132.4 -27.2 8.7 -4.8 94 95 A L - 0 0 32 -57,-0.6 2,-0.6 -65,-0.1 -1,-0.1 -0.662 24.4-165.9 -79.3 128.7 -29.3 7.8 -7.9 95 96 A V - 0 0 10 -2,-0.4 3,-0.5 1,-0.1 51,-0.1 -0.957 8.7-177.3-115.4 112.6 -28.1 9.4 -11.2 96 97 A A + 0 0 77 -2,-0.6 51,-0.2 51,-0.4 53,-0.1 0.443 60.5 75.9 -98.2 -3.5 -31.0 8.9 -13.6 97 98 A G S S- 0 0 6 49,-2.4 -1,-0.2 1,-0.2 50,-0.2 0.263 93.7-121.0 -97.7 9.9 -29.7 10.4 -16.9 98 99 A G - 0 0 14 -3,-0.5 48,-3.1 48,-0.2 -1,-0.2 0.027 44.0 -39.7 79.8 174.7 -27.5 7.5 -17.9 99 100 A E B > -H 145 0C 39 46,-0.2 4,-2.1 1,-0.1 3,-0.4 -0.437 40.5-128.6 -73.4 144.3 -23.7 7.3 -18.7 100 101 A L H > S+ 0 0 0 44,-3.1 4,-2.6 41,-0.7 42,-0.2 0.854 112.6 64.9 -52.3 -36.8 -21.9 10.0 -20.6 101 102 A F H > S+ 0 0 118 40,-1.3 4,-1.4 43,-0.2 -1,-0.2 0.907 105.4 40.3 -51.2 -48.0 -20.7 6.9 -22.6 102 103 A D H > S+ 0 0 60 -3,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.847 112.4 55.6 -77.7 -31.1 -24.3 6.2 -23.9 103 104 A F H X S+ 0 0 18 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.913 108.1 49.5 -61.9 -43.5 -25.0 9.9 -24.4 104 105 A L H < S+ 0 0 28 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.848 109.5 50.8 -66.2 -36.6 -22.0 10.1 -26.7 105 106 A A H < S+ 0 0 79 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.823 111.4 50.7 -66.2 -31.3 -23.1 7.1 -28.6 106 107 A E H < 0 0 112 -4,-1.5 -2,-0.2 -5,-0.1 -1,-0.2 0.924 360.0 360.0 -77.3 -49.0 -26.6 8.7 -29.0 107 108 A K < 0 0 112 -4,-2.3 -1,-0.0 -5,-0.1 -4,-0.0 -0.566 360.0 360.0 -67.3 360.0 -25.5 12.1 -30.3 108 ! 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 78 0, 0.0 2,-0.2 0, 0.0 101,-0.2 0.000 360.0 360.0 360.0 137.9 -19.1 13.8 -31.4 110 111 A L - 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0 0 30 -2,-0.3 3,-0.4 1,-0.1 -9,-0.1 -0.782 19.3-147.0 -91.6 124.1 -10.2 6.8 -28.9 215 216 A P S S+ 0 0 15 0, 0.0 19,-0.2 0, 0.0 -1,-0.1 0.740 90.7 24.5 -70.7 -26.2 -6.6 8.2 -29.2 216 217 A F S S+ 0 0 2 -35,-0.3 11,-0.3 17,-0.1 12,-0.2 0.378 84.1 138.1-113.7 -2.8 -4.6 5.0 -28.2 217 218 A L + 0 0 96 -3,-0.4 2,-0.2 -36,-0.1 4,-0.1 -0.292 26.3 179.1 -61.4 123.6 -7.0 2.2 -29.0 218 219 A G - 0 0 18 2,-0.4 6,-0.1 -2,-0.1 -2,-0.1 -0.416 45.1 -95.2-104.2-174.3 -5.4 -0.8 -30.7 219 220 A D S S+ 0 0 156 -2,-0.2 2,-0.3 2,-0.0 -2,-0.1 0.670 109.1 31.2 -80.4 -16.4 -7.0 -4.1 -31.9 220 221 A T S > S- 0 0 44 1,-0.1 4,-2.1 61,-0.0 -2,-0.4 -0.922 86.5-112.6-133.7 162.4 -6.1 -5.8 -28.6 221 222 A K H > S+ 0 0 74 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.903 118.7 53.0 -60.2 -41.8 -5.7 -4.7 -25.0 222 223 A Q H > S+ 0 0 122 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.905 107.4 50.4 -62.0 -40.9 -2.0 -5.3 -25.1 223 224 A E H > S+ 0 0 80 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.881 109.5 51.9 -64.5 -38.8 -1.6 -3.2 -28.3 224 225 A T H X S+ 0 0 3 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.941 109.5 49.7 -58.4 -48.4 -3.6 -0.3 -26.6 225 226 A L H X S+ 0 0 21 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.897 110.2 50.2 -60.2 -41.4 -1.3 -0.5 -23.6 226 227 A A H X S+ 0 0 46 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.902 110.1 50.1 -62.4 -41.6 1.8 -0.4 -25.8 227 228 A N H X>S+ 0 0 41 -4,-2.1 5,-3.0 -11,-0.3 4,-0.6 0.905 110.7 50.3 -61.8 -44.1 0.4 2.7 -27.6 228 229 A V H ><5S+ 0 0 0 -4,-2.6 3,-1.4 3,-0.2 -2,-0.2 0.949 109.5 49.8 -59.7 -50.9 -0.3 4.4 -24.3 229 230 A S H 3<5S+ 0 0 30 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.867 115.3 43.7 -59.5 -35.9 3.3 3.7 -23.0 230 231 A A H 3<5S- 0 0 72 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.489 109.3-123.1 -85.4 -2.4 4.8 5.1 -26.3 231 232 A V T <<5 + 0 0 40 -3,-1.4 2,-1.6 -4,-0.6 -3,-0.2 0.927 45.9 175.6 54.8 46.8 2.3 8.1 -26.3 232 233 A N < + 0 0 97 -5,-3.0 2,-0.3 -6,-0.1 -1,-0.2 -0.627 27.9 110.9 -87.8 76.2 1.3 6.9 -29.7 233 234 A Y - 0 0 45 -2,-1.6 2,-0.3 -3,-0.2 -17,-0.1 -0.966 36.9-179.1-139.1 160.5 -1.6 9.3 -30.6 234 235 A E - 0 0 120 -2,-0.3 2,-1.2 -19,-0.2 -2,-0.0 -0.978 37.4-102.3-150.1 162.8 -2.1 12.1 -33.0 235 236 A F - 0 0 29 -2,-0.3 5,-0.1 5,-0.0 13,-0.0 -0.706 39.0-142.1 -88.9 95.2 -4.8 14.6 -34.0 236 237 A E >> - 0 0 80 -2,-1.2 4,-2.8 1,-0.2 3,-1.1 -0.291 5.7-139.5 -58.3 125.7 -6.4 13.2 -37.2 237 238 A D H 3> S+ 0 0 121 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.865 101.2 62.9 -53.5 -39.0 -7.2 16.0 -39.6 238 239 A E H 34 S+ 0 0 173 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.854 117.2 27.9 -56.7 -35.7 -10.5 14.3 -40.5 239 240 A Y H <4 S+ 0 0 108 -3,-1.1 -1,-0.2 1,-0.1 -2,-0.2 0.785 133.9 30.4 -94.6 -31.8 -11.7 14.7 -36.9 240 241 A F H >< S+ 0 0 1 -4,-2.8 3,-2.4 1,-0.1 -3,-0.2 0.434 77.8 108.5-115.2 -1.0 -9.8 17.8 -35.8 241 242 A S T 3< S+ 0 0 78 -4,-2.6 -1,-0.1 1,-0.3 -3,-0.1 0.742 95.4 33.2 -55.7 -27.9 -9.3 20.0 -38.8 242 243 A N T 3 S+ 0 0 155 -5,-0.2 2,-0.3 -3,-0.2 -1,-0.3 0.152 93.9 109.9-114.6 19.2 -11.9 22.5 -37.5 243 244 A T S < S- 0 0 25 -3,-2.4 -3,-0.1 1,-0.1 -132,-0.0 -0.728 78.9 -99.7 -88.3 143.0 -11.2 22.1 -33.8 244 245 A S > - 0 0 39 -2,-0.3 4,-1.7 1,-0.1 3,-0.3 -0.246 19.2-125.6 -68.9 151.5 -9.5 25.1 -32.2 245 246 A A H > S+ 0 0 74 1,-0.2 4,-2.3 2,-0.2 -1,-0.1 0.833 110.7 58.4 -65.6 -30.5 -5.8 25.0 -31.6 246 247 A L H > S+ 0 0 73 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.855 102.6 53.2 -65.5 -36.0 -6.4 25.8 -27.8 247 248 A A H > S+ 0 0 0 -3,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.940 111.3 45.8 -62.4 -46.0 -8.5 22.6 -27.5 248 249 A K H X S+ 0 0 45 -4,-1.7 4,-2.8 1,-0.2 -2,-0.2 0.881 110.0 55.2 -62.1 -40.0 -5.6 20.7 -29.0 249 250 A D H X S+ 0 0 32 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.927 105.7 52.0 -58.4 -44.2 -3.2 22.5 -26.7 250 251 A F H X S+ 0 0 0 -4,-2.4 4,-0.6 1,-0.2 -2,-0.2 0.942 112.8 44.6 -58.1 -49.3 -5.2 21.5 -23.6 251 252 A I H >X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 3,-1.5 0.929 109.6 55.3 -63.1 -45.9 -5.1 17.8 -24.7 252 253 A R H 3< S+ 0 0 109 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.884 105.4 53.0 -55.0 -38.8 -1.4 17.9 -25.5 253 254 A R H 3< S+ 0 0 130 -4,-2.1 10,-2.2 1,-0.2 -1,-0.3 0.568 113.7 42.8 -78.0 -8.7 -0.5 19.2 -22.0 254 255 A L H << S+ 0 0 0 -3,-1.5 2,-1.8 -4,-0.6 -2,-0.2 0.736 101.5 67.3-100.2 -35.8 -2.4 16.3 -20.4 255 256 A L S < S+ 0 0 5 -4,-2.5 2,-0.4 -5,-0.1 -1,-0.1 -0.428 73.0 131.3 -86.6 63.0 -1.2 13.5 -22.7 256 257 A V - 0 0 39 -2,-1.8 6,-0.1 -3,-0.2 -25,-0.1 -0.957 54.7-143.5-119.4 128.8 2.4 13.7 -21.4 257 258 A K S S+ 0 0 85 -2,-0.4 -71,-0.2 -72,-0.1 -1,-0.1 0.921 85.7 70.8 -63.7 -45.4 4.3 10.6 -20.3 258 259 A D S >> S- 0 0 68 1,-0.2 3,-1.7 -73,-0.1 4,-0.8 -0.616 72.3-154.7 -75.4 114.0 6.2 12.2 -17.4 259 260 A P G >4 S+ 0 0 31 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.817 92.5 61.8 -63.9 -25.0 3.6 12.8 -14.7 260 261 A K G 34 S+ 0 0 186 1,-0.2 4,-0.1 -3,-0.1 -2,-0.1 0.749 107.6 44.4 -67.4 -22.0 5.8 15.6 -13.3 261 262 A K G <4 S+ 0 0 160 -3,-1.7 -1,-0.2 2,-0.1 2,-0.1 0.561 93.7 100.3 -98.6 -10.1 5.5 17.5 -16.6 262 263 A R S << S- 0 0 9 -4,-0.8 -8,-0.2 -3,-0.5 -9,-0.1 -0.430 85.5 -93.2 -77.1 146.4 1.7 16.9 -17.0 263 264 A M - 0 0 19 -10,-2.2 2,-0.1 -13,-0.2 -1,-0.1 -0.330 38.3-133.8 -56.7 138.9 -0.8 19.6 -16.1 264 265 A T > - 0 0 68 1,-0.1 4,-2.6 -3,-0.1 5,-0.2 -0.396 28.7-101.7 -80.2 168.2 -2.2 19.5 -12.6 265 266 A I H > S+ 0 0 12 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.926 126.8 49.9 -58.5 -42.8 -5.9 19.9 -11.9 266 267 A Q H > S+ 0 0 112 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.919 109.6 51.8 -61.9 -41.4 -5.3 23.5 -10.8 267 268 A D H >> S+ 0 0 84 1,-0.2 4,-0.9 2,-0.2 3,-0.7 0.911 107.1 53.8 -56.9 -45.0 -3.3 24.1 -14.0 268 269 A S H 3< S+ 0 0 0 -4,-2.6 3,-0.3 1,-0.3 6,-0.2 0.851 105.5 52.5 -65.3 -33.2 -6.2 22.7 -16.1 269 270 A L H 3< S+ 0 0 29 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.748 112.1 45.3 -72.5 -23.9 -8.7 25.1 -14.6 270 271 A Q H << S+ 0 0 116 -4,-1.1 -1,-0.2 -3,-0.7 -2,-0.2 0.483 84.9 119.9 -94.3 -4.9 -6.4 28.1 -15.4 271 272 A H S >X S- 0 0 10 -4,-0.9 4,-3.1 -3,-0.3 3,-1.9 -0.358 74.7-121.5 -62.4 136.0 -5.7 26.9 -19.0 272 273 A P T 34 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -26,-0.1 0.739 110.7 58.4 -54.7 -25.4 -7.0 29.5 -21.5 273 274 A W T 34 S+ 0 0 27 -27,-0.2 -26,-0.1 1,-0.1 -2,-0.1 0.815 121.0 27.7 -71.2 -26.7 -9.4 27.0 -23.2 274 275 A I T <4 S+ 0 0 5 -3,-1.9 -1,-0.1 -6,-0.2 -5,-0.1 0.836 96.3 94.3-102.2 -44.6 -11.1 26.5 -19.8 275 276 A K < 0 0 105 -4,-3.1 -5,-0.1 -7,-0.1 -6,-0.0 -0.340 360.0 360.0 -59.0 125.6 -10.6 29.7 -17.9 276 277 A P 0 0 153 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.267 360.0 360.0 -75.9 360.0 -13.6 32.1 -18.4 277 ! 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 76 0, 0.0 -100,-0.1 0, 0.0 -256,-0.0 0.000 360.0 360.0 360.0 -31.7 -9.0 -6.0 -16.7 279 292 A Q + 0 0 20 -100,-0.1 2,-0.2 -102,-0.1 -54,-0.1 0.554 360.0 89.3 -90.5 -11.9 -5.9 -5.3 -18.8 280 293 A F 0 0 142 -59,-0.1 0, 0.0 -58,-0.0 0, 0.0 -0.608 360.0 360.0 -94.5 147.9 -5.4 -8.8 -20.1 281 294 A E 0 0 162 -2,-0.2 -2,-0.1 -61,-0.0 -61,-0.0 -0.626 360.0 360.0 -89.8 360.0 -6.8 -10.6 -23.2