==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 21-OCT-10 2XUU . COMPND 2 MOLECULE: DEATH-ASSOCIATED PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR I.DE DIEGO,J.KUPER,F.LEHMANN,M.WILMANNS . 301 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15305.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 200 66.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 14.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 21 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 28.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 1 1 0 1 2 1 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 0 100 0, 0.0 2,-0.5 0, 0.0 60,-0.0 0.000 360.0 360.0 360.0 123.3 13.6 0.2 1.0 2 3 A V - 0 0 131 81,-0.0 2,-0.2 3,-0.0 3,-0.0 -0.734 360.0-176.0 -62.7 118.7 17.1 1.4 1.7 3 4 A F - 0 0 13 -2,-0.5 79,-0.2 1,-0.1 2,-0.2 -0.549 48.7 -56.6-101.3 174.8 19.2 -1.1 -0.3 4 5 A R B -a 82 0A 80 77,-2.4 79,-2.3 -2,-0.2 4,-0.1 -0.363 45.2-164.6 -68.2 127.9 23.1 -0.8 -0.0 5 6 A Q + 0 0 116 77,-0.2 -1,-0.1 -2,-0.2 77,-0.1 0.469 54.5 104.1 -93.4 -0.4 24.4 2.6 -0.9 6 7 A E S S- 0 0 83 1,-0.1 2,-0.4 2,-0.0 77,-0.3 -0.320 86.6 -91.2 -68.0 166.3 28.1 1.7 -1.3 7 8 A N > - 0 0 83 1,-0.1 3,-1.5 75,-0.1 4,-0.4 -0.674 28.5-139.0 -75.7 128.9 29.7 1.3 -4.8 8 9 A V G >> S+ 0 0 7 -2,-0.4 4,-1.8 1,-0.3 3,-1.7 0.836 100.4 66.0 -57.7 -31.5 29.3 -2.3 -5.9 9 10 A D G 34 S+ 0 0 75 1,-0.3 -1,-0.3 2,-0.2 -2,-0.0 0.647 89.8 63.6 -70.7 -10.7 32.9 -2.1 -7.3 10 11 A D G <4 S+ 0 0 101 -3,-1.5 -1,-0.3 1,-0.1 -2,-0.2 0.738 117.2 28.4 -77.3 -22.7 34.3 -1.7 -3.8 11 12 A Y T <4 S+ 0 0 85 -3,-1.7 21,-2.6 -4,-0.4 22,-0.4 0.633 123.0 37.7-111.7 -18.9 33.0 -5.2 -3.1 12 13 A Y E < -B 31 0A 1 -4,-1.8 2,-0.6 19,-0.2 19,-0.2 -0.963 59.4-141.2-137.3 146.6 33.0 -7.1 -6.4 13 14 A D E -B 30 0A 91 17,-2.2 17,-1.8 -2,-0.3 2,-0.2 -0.962 31.5-143.9-101.9 121.9 35.1 -7.4 -9.5 14 15 A T E +B 29 0A 57 -2,-0.6 15,-0.3 15,-0.2 2,-0.1 -0.551 25.7 166.0 -89.1 153.2 32.8 -7.6 -12.5 15 16 A G E + 0 0 43 13,-3.0 -1,-0.1 1,-0.3 14,-0.0 -0.163 38.6 4.9-133.0-132.3 33.5 -9.8 -15.6 16 17 A E E S- 0 0 123 11,-0.2 12,-3.1 1,-0.1 -1,-0.3 -0.156 70.4-104.0 -70.2 148.0 31.9 -11.3 -18.7 17 18 A E E -B 27 0A 118 10,-0.2 10,-0.3 1,-0.1 -1,-0.1 -0.506 29.7-175.3 -68.2 133.6 28.3 -10.5 -19.7 18 19 A L E - 0 0 73 8,-3.5 2,-0.3 1,-0.4 9,-0.2 0.696 58.7 -47.1 -98.7 -31.0 25.8 -13.4 -19.0 19 20 A G E -B 26 0A 31 7,-1.6 7,-3.1 2,-0.0 -1,-0.4 -0.976 49.3-119.4 174.1 173.5 22.7 -12.0 -20.6 20 21 A S E -B 25 0A 94 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.988 10.4-165.5-146.2 153.1 20.4 -9.0 -21.1 21 22 A G E > -B 24 0A 43 3,-2.8 3,-0.6 -2,-0.3 5,-0.0 -0.534 51.7 -82.7-119.2-175.0 16.8 -7.9 -20.5 22 23 A Q T 3 S+ 0 0 171 1,-0.2 32,-0.0 -2,-0.2 3,-0.0 0.942 128.2 7.2 -63.2 -46.9 14.9 -4.9 -21.8 23 24 A F T 3 S+ 0 0 61 30,-0.1 21,-2.8 21,-0.0 2,-0.3 -0.238 124.2 77.4-121.8 33.7 16.3 -2.5 -19.1 24 25 A A E < -BC 21 43A 17 -3,-0.6 -3,-2.8 19,-0.2 2,-0.4 -0.997 51.2-166.9-147.1 145.2 18.8 -5.0 -17.5 25 26 A V E -BC 20 42A 42 17,-1.5 17,-2.5 -2,-0.3 2,-0.5 -0.995 14.8-150.5-132.3 137.7 22.2 -6.4 -18.1 26 27 A V E +BC 19 41A 29 -7,-3.1 -8,-3.5 -2,-0.4 -7,-1.6 -0.943 17.1 179.7-116.0 124.7 23.6 -9.4 -16.2 27 28 A K E -BC 17 40A 71 13,-2.6 13,-3.3 -2,-0.5 -10,-0.2 -0.919 30.7-115.2-121.7 146.6 27.4 -9.8 -15.6 28 29 A K E + C 0 39A 37 -12,-3.1 -13,-3.0 -2,-0.3 2,-0.3 -0.445 41.9 179.3 -70.1 152.4 29.4 -12.4 -13.8 29 30 A C E -BC 14 38A 3 9,-2.2 9,-2.3 -15,-0.3 2,-0.4 -0.977 24.6-136.5-151.6 165.2 31.3 -11.0 -10.8 30 31 A R E -BC 13 37A 118 -17,-1.8 -17,-2.2 -2,-0.3 2,-0.3 -0.995 21.9-128.9-127.8 125.6 33.6 -12.2 -8.0 31 32 A E E > -B 12 0A 17 5,-3.2 4,-2.1 -2,-0.4 3,-0.4 -0.606 14.1-147.9 -76.3 128.5 33.1 -11.1 -4.4 32 33 A K T 4 S+ 0 0 94 -21,-2.6 -1,-0.1 -2,-0.3 -20,-0.1 0.839 92.3 54.3 -69.5 -38.1 36.4 -9.8 -3.1 33 34 A S T 4 S+ 0 0 102 -22,-0.4 -1,-0.2 1,-0.2 -21,-0.1 0.764 127.3 18.2 -68.4 -25.1 35.9 -10.9 0.6 34 35 A T T 4 S- 0 0 71 -3,-0.4 -2,-0.2 2,-0.2 -1,-0.2 0.493 89.5-127.7-121.8 -14.8 35.3 -14.6 -0.3 35 36 A G < + 0 0 26 -4,-2.1 2,-0.3 1,-0.2 -3,-0.1 0.601 63.4 141.0 68.3 9.3 36.5 -15.1 -3.9 36 37 A L - 0 0 100 -5,-0.3 -5,-3.2 -6,-0.0 2,-0.3 -0.646 49.2-123.1 -87.8 146.0 33.1 -16.6 -4.7 37 38 A Q E +C 30 0A 97 -2,-0.3 57,-0.6 -7,-0.2 2,-0.3 -0.669 33.6 165.4 -93.7 141.1 31.2 -15.9 -8.0 38 39 A Y E -CD 29 93A 39 -9,-2.3 -9,-2.2 -2,-0.3 2,-0.5 -0.762 36.3-108.9-137.9 175.2 27.8 -14.4 -8.4 39 40 A A E -CD 28 92A 8 53,-2.5 53,-3.4 -2,-0.3 2,-0.6 -0.976 25.7-151.1-110.8 127.2 25.7 -12.9 -11.1 40 41 A A E -CD 27 91A 1 -13,-3.3 -13,-2.6 -2,-0.5 2,-0.7 -0.849 5.4-163.6-103.7 119.1 25.1 -9.1 -11.0 41 42 A K E -CD 26 90A 23 49,-2.8 49,-3.0 -2,-0.6 2,-0.7 -0.899 5.6-162.7-102.8 109.9 21.8 -7.9 -12.5 42 43 A F E -CD 25 89A 31 -17,-2.5 -17,-1.5 -2,-0.7 2,-0.6 -0.825 7.4-166.1 -97.7 111.1 22.0 -4.2 -13.1 43 44 A I E -CD 24 88A 3 45,-3.2 45,-2.1 -2,-0.7 2,-0.4 -0.922 19.1-126.3-105.7 126.8 18.5 -2.8 -13.6 44 45 A K E - D 0 87A 119 -21,-2.8 11,-2.7 -2,-0.6 43,-0.2 -0.530 23.8-131.9 -70.5 121.0 18.1 0.7 -15.0 45 46 A K B -f 55 0B 51 41,-2.9 11,-0.2 -2,-0.4 3,-0.1 -0.420 17.5-120.5 -70.6 147.5 15.9 2.9 -12.8 46 47 A R - 0 0 81 9,-1.4 2,-0.9 1,-0.2 7,-0.3 0.902 28.9-155.3 -62.3 -43.2 13.1 4.8 -14.6 47 48 A R S S+ 0 0 93 8,-0.2 2,-0.4 4,-0.1 -1,-0.2 -0.494 70.1 36.7 102.6 -63.0 14.3 8.4 -13.6 48 49 A T S > S- 0 0 74 -2,-0.9 3,-2.5 5,-0.2 5,-0.1 -0.983 71.6-135.3-116.4 140.7 10.9 10.4 -13.9 49 50 A K T 3 S+ 0 0 185 -2,-0.4 -1,-0.1 1,-0.3 7,-0.0 0.814 116.7 55.7 -49.8 -26.2 7.5 9.0 -12.9 50 51 A S T 3 S+ 0 0 105 -3,-0.0 -1,-0.3 2,-0.0 -3,-0.0 0.686 91.7 98.3 -77.2 -23.8 6.8 10.7 -16.2 51 52 A S < - 0 0 12 -3,-2.5 -4,-0.1 1,-0.1 -5,-0.1 -0.187 58.6-152.1 -74.4 162.1 9.4 8.7 -18.2 52 53 A R S S+ 0 0 224 -6,-0.1 2,-0.3 3,-0.0 -1,-0.1 0.521 73.1 78.6-105.7 -16.7 9.0 5.6 -20.5 53 54 A R S S+ 0 0 159 -7,-0.3 -5,-0.2 -5,-0.1 -2,-0.1 -0.715 81.1 25.8 -95.0 147.2 12.5 4.0 -20.1 54 55 A G S S- 0 0 10 -2,-0.3 2,-0.4 -7,-0.1 -9,-0.2 -0.038 87.8 -69.1 93.3 167.6 13.6 2.0 -17.0 55 56 A V B -f 45 0B 33 -11,-2.7 -9,-1.4 -32,-0.2 -8,-0.2 -0.820 49.4-115.5-104.7 136.7 11.9 -0.1 -14.4 56 57 A S > - 0 0 11 -2,-0.4 4,-2.0 -11,-0.2 5,-0.2 -0.267 22.2-115.2 -68.2 157.5 9.6 1.5 -11.8 57 58 A R H > S+ 0 0 91 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.848 117.0 55.1 -55.0 -42.2 10.5 1.5 -8.1 58 59 A E H > S+ 0 0 135 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.910 108.5 46.7 -57.0 -47.8 7.4 -0.7 -7.5 59 60 A D H > S+ 0 0 73 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.831 113.2 48.3 -70.7 -33.5 8.4 -3.3 -10.1 60 61 A I H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.925 112.3 50.1 -74.0 -40.2 12.1 -3.5 -8.7 61 62 A E H X S+ 0 0 43 -4,-2.6 4,-2.8 -5,-0.2 -2,-0.2 0.864 107.1 53.1 -62.2 -39.2 10.8 -3.8 -5.2 62 63 A R H X S+ 0 0 65 -4,-1.8 4,-2.3 2,-0.2 5,-0.2 0.936 111.1 47.0 -61.0 -45.8 8.4 -6.6 -6.1 63 64 A E H X S+ 0 0 16 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.923 116.2 44.5 -65.5 -42.2 11.3 -8.6 -7.7 64 65 A V H X S+ 0 0 3 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.931 111.9 51.9 -64.9 -46.1 13.6 -8.0 -4.8 65 66 A S H X S+ 0 0 75 -4,-2.8 4,-1.1 -5,-0.2 -2,-0.2 0.832 112.4 46.6 -61.3 -39.5 10.9 -8.8 -2.2 66 67 A I H X S+ 0 0 6 -4,-2.3 4,-1.2 2,-0.2 3,-0.3 0.940 113.0 47.0 -68.1 -48.6 10.1 -12.1 -3.9 67 68 A L H < S+ 0 0 1 -4,-2.2 11,-0.6 1,-0.2 -2,-0.2 0.864 107.6 57.7 -62.6 -35.0 13.7 -13.3 -4.3 68 69 A K H < S+ 0 0 124 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.863 107.1 49.0 -61.1 -39.4 14.5 -12.4 -0.7 69 70 A E H < S+ 0 0 65 -4,-1.1 2,-0.3 -3,-0.3 -1,-0.2 0.793 94.9 89.9 -74.3 -27.5 11.7 -14.7 0.5 70 71 A I < + 0 0 3 -4,-1.2 8,-0.3 -3,-0.2 2,-0.3 -0.524 40.0 164.7 -86.9 135.5 12.7 -17.7 -1.5 71 72 A Q + 0 0 150 -2,-0.3 5,-0.1 6,-0.1 6,-0.1 -0.796 27.2 123.7-143.3 97.8 15.1 -20.3 -0.3 72 73 A H > - 0 0 48 3,-0.5 3,-1.8 -2,-0.3 53,-0.0 -0.970 62.9-119.9-156.4 148.0 15.1 -23.5 -2.4 73 74 A P T 3 S+ 0 0 89 0, 0.0 4,-0.1 0, 0.0 52,-0.1 0.662 110.7 50.3 -65.6 -18.3 17.7 -25.6 -4.3 74 75 A N T 3 S+ 0 0 14 83,-0.1 84,-2.6 2,-0.1 2,-0.4 0.249 104.3 65.2-107.5 13.5 15.9 -25.2 -7.7 75 76 A V B < S-g 158 0C 0 -3,-1.8 -3,-0.5 82,-0.3 84,-0.2 -0.996 89.0-106.5-130.3 143.2 15.5 -21.5 -7.6 76 77 A I - 0 0 8 82,-2.1 2,-0.3 -2,-0.4 -6,-0.1 -0.266 33.8-137.6 -62.7 143.5 18.1 -18.7 -7.6 77 78 A T - 0 0 54 -6,-0.1 16,-2.2 -4,-0.1 2,-0.6 -0.749 11.4-121.5 -98.9 156.3 18.8 -16.9 -4.3 78 79 A L E - E 0 92A 29 -11,-0.6 14,-0.2 -8,-0.3 3,-0.1 -0.862 26.7-179.0 -93.9 124.5 19.3 -13.2 -3.8 79 80 A H E - 0 0 68 12,-3.2 2,-0.3 -2,-0.6 13,-0.2 0.911 59.8 -24.7 -88.2 -48.0 22.7 -12.5 -2.2 80 81 A E E - E 0 91A 39 11,-1.3 11,-3.0 2,-0.0 2,-0.4 -0.974 51.8-137.9-157.7 161.0 22.8 -8.7 -1.8 81 82 A V E - E 0 90A 11 -2,-0.3 -77,-2.4 9,-0.2 2,-0.3 -0.996 17.4-176.9-131.0 134.1 21.3 -5.5 -3.3 82 83 A Y E -aE 4 89A 1 7,-2.3 7,-2.9 -2,-0.4 2,-0.3 -0.829 5.1-163.1-119.7 162.8 23.0 -2.2 -4.1 83 84 A E E + E 0 88A 20 -79,-2.3 2,-0.2 -77,-0.3 5,-0.2 -0.995 11.7 169.2-148.3 138.3 21.7 1.1 -5.5 84 85 A N - 0 0 69 3,-2.2 -78,-0.0 -2,-0.3 -77,-0.0 -0.686 57.8 -75.8-127.8-170.7 23.2 4.2 -7.1 85 86 A K S S+ 0 0 199 -2,-0.2 -38,-0.1 1,-0.2 3,-0.1 0.830 127.8 23.8 -58.7 -32.9 21.6 7.2 -8.9 86 87 A T S S+ 0 0 87 1,-0.1 -41,-2.9 -42,-0.0 2,-0.3 0.671 120.2 37.2-107.3 -27.5 20.9 5.3 -12.1 87 88 A D E -D 44 0A 22 -43,-0.2 -3,-2.2 2,-0.0 2,-0.4 -0.903 51.1-146.9-133.3 150.7 20.7 1.5 -11.3 88 89 A V E -DE 43 83A 0 -45,-2.1 -45,-3.2 -2,-0.3 2,-0.6 -0.989 29.0-155.6-107.8 132.1 19.6 -1.1 -8.7 89 90 A I E -DE 42 82A 2 -7,-2.9 -7,-2.3 -2,-0.4 2,-0.6 -0.947 4.8-160.3-117.5 118.3 22.1 -4.0 -8.8 90 91 A L E -DE 41 81A 0 -49,-3.0 -49,-2.8 -2,-0.6 2,-0.7 -0.852 8.4-150.1 -98.8 125.4 20.9 -7.4 -7.6 91 92 A I E -DE 40 80A 0 -11,-3.0 -12,-3.2 -2,-0.6 -11,-1.3 -0.809 29.0-177.7 -95.7 113.1 23.7 -9.8 -6.7 92 93 A L E -DE 39 78A 13 -53,-3.4 -53,-2.5 -2,-0.7 -14,-0.2 -0.681 37.8 -85.7-110.5 160.7 22.1 -13.2 -7.5 93 94 A E E -D 38 0A 36 -16,-2.2 2,-0.4 -2,-0.2 -55,-0.2 -0.465 55.3-115.4 -59.1 136.7 23.3 -16.8 -7.2 94 95 A L - 0 0 17 -57,-0.6 2,-0.7 -2,-0.1 -1,-0.1 -0.657 20.8-158.7 -79.9 131.5 25.3 -17.5 -10.4 95 96 A V + 0 0 13 -2,-0.4 3,-0.4 1,-0.1 52,-0.2 -0.930 19.5 173.0-106.9 102.0 23.9 -20.2 -12.7 96 97 A A + 0 0 53 51,-1.3 51,-0.2 -2,-0.7 52,-0.2 0.523 55.9 74.8 -94.9 -6.9 27.0 -21.1 -14.7 97 98 A G S S- 0 0 4 49,-2.7 -1,-0.2 1,-0.3 50,-0.2 0.263 88.9-132.1 -94.9 10.5 25.9 -24.1 -16.8 98 99 A G - 0 0 31 -3,-0.4 48,-2.4 48,-0.2 -1,-0.3 -0.141 53.6 -18.3 70.6-163.9 23.8 -22.3 -19.4 99 100 A E B > -H 145 0C 70 46,-0.2 4,-1.6 1,-0.1 46,-0.3 -0.398 54.4-129.6 -77.4 141.0 20.2 -23.3 -20.5 100 101 A L H > S+ 0 0 4 44,-2.5 4,-2.8 41,-0.4 5,-0.2 0.917 107.3 55.2 -52.2 -47.4 18.9 -26.8 -19.9 101 102 A F H > S+ 0 0 7 43,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.861 105.0 52.7 -63.2 -36.2 17.8 -27.3 -23.6 102 103 A D H 4 S+ 0 0 67 2,-0.2 4,-0.3 1,-0.2 -1,-0.2 0.878 110.3 48.0 -63.9 -38.7 21.3 -26.6 -24.8 103 104 A F H >< S+ 0 0 32 -4,-1.6 3,-1.7 -3,-0.2 4,-0.2 0.956 112.9 47.5 -64.3 -50.9 22.8 -29.2 -22.5 104 105 A L H >< S+ 0 0 0 -4,-2.8 3,-1.9 1,-0.3 -2,-0.2 0.870 104.1 62.5 -58.3 -37.9 20.3 -31.8 -23.5 105 106 A A T 3< S+ 0 0 19 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.598 92.1 66.0 -60.7 -13.0 20.9 -31.0 -27.2 106 107 A E T < S+ 0 0 124 -3,-1.7 -1,-0.3 -4,-0.3 2,-0.2 0.503 87.1 97.4 -90.5 -3.7 24.5 -32.1 -26.8 107 108 A K S < S- 0 0 51 -3,-1.9 3,-0.1 -4,-0.2 189,-0.1 -0.497 71.8-139.8 -86.0 151.9 23.3 -35.7 -26.2 108 109 A E S S- 0 0 151 1,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.851 86.4 -12.8 -66.1 -48.0 23.0 -38.6 -28.7 109 110 A S - 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0 0 49 1,-0.1 3,-2.4 -2,-0.0 4,-0.7 -0.858 47.3-132.9-101.2 124.0 6.4 -14.7 -24.9 180 181 A P G >4 S+ 0 0 34 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.818 103.2 54.6 -44.5 -47.6 3.2 -15.6 -27.0 181 182 A A G 34 S+ 0 0 10 1,-0.2 35,-0.3 37,-0.1 36,-0.1 0.692 115.4 39.8 -60.2 -22.6 4.2 -19.3 -27.7 182 183 A F G <4 S+ 0 0 24 -3,-2.4 2,-0.3 34,-0.1 -1,-0.2 0.339 94.1 97.2-112.6 0.6 4.7 -20.0 -23.9 183 184 A V S << S- 0 0 10 -3,-1.0 15,-0.1 -4,-0.7 -5,-0.0 -0.719 71.3-112.6 -99.6 152.7 1.7 -18.1 -22.3 184 185 A A >> - 0 0 0 -2,-0.3 4,-2.1 13,-0.1 3,-1.1 -0.220 31.4-104.7 -74.8 161.4 -1.6 -19.5 -21.2 185 186 A P H 3> S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.856 119.4 62.3 -58.2 -38.0 -5.0 -18.6 -22.8 186 187 A E H 34>S+ 0 0 2 71,-0.2 5,-2.7 2,-0.2 4,-0.2 0.845 107.1 45.0 -59.8 -29.3 -5.9 -16.4 -19.9 187 188 A I H X45S+ 0 0 13 -3,-1.1 3,-1.3 3,-0.2 -1,-0.2 0.937 112.3 50.7 -71.1 -48.4 -2.9 -14.2 -20.7 188 189 A V H 3<5S+ 0 0 33 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.870 118.3 39.7 -53.6 -35.9 -3.7 -14.3 -24.4 189 190 A N T 3<5S- 0 0 60 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.311 107.8-118.3-100.5 7.5 -7.3 -13.2 -23.5 190 191 A Y T < 5 + 0 0 120 -3,-1.3 -3,-0.2 -4,-0.2 -4,-0.1 0.933 63.6 145.3 50.3 49.2 -6.7 -10.7 -20.7 191 192 A E < - 0 0 91 -5,-2.7 -16,-0.3 -6,-0.1 -1,-0.2 -0.648 60.0 -62.0-108.3 170.8 -8.6 -12.7 -18.1 192 193 A P - 0 0 58 0, 0.0 2,-0.3 0, 0.0 -18,-0.2 -0.289 57.0-146.4 -61.9 137.1 -7.8 -13.0 -14.4 193 194 A L + 0 0 18 -20,-2.4 -20,-0.4 -3,-0.1 2,-0.2 -0.709 28.5 145.0-104.8 155.4 -4.4 -14.6 -13.7 194 195 A G > - 0 0 7 -2,-0.3 3,-0.9 -22,-0.1 4,-0.4 -0.801 66.9 -52.4-159.0-157.8 -3.2 -17.0 -10.9 195 196 A L T >> S+ 0 0 35 -2,-0.2 4,-0.8 1,-0.2 3,-0.6 0.658 117.3 76.7 -66.8 -16.2 -0.9 -19.9 -10.2 196 197 A E H >> S+ 0 0 74 1,-0.2 4,-1.8 2,-0.2 3,-0.6 0.850 80.2 66.0 -71.2 -29.3 -2.5 -21.9 -13.1 197 198 A A H <> S+ 0 0 1 -3,-0.9 4,-2.0 1,-0.3 -1,-0.2 0.866 97.0 55.8 -58.8 -42.4 -0.7 -20.0 -15.9 198 199 A D H <> S+ 0 0 0 -3,-0.6 4,-2.1 -4,-0.4 -1,-0.3 0.864 105.1 54.6 -52.6 -40.8 2.7 -21.5 -14.7 199 200 A M H S- 0 0 75 1,-0.1 4,-2.0 0, 0.0 -2,-0.3 -0.918 87.5-111.5-132.7 164.7 2.8 -14.6 -37.1 221 222 A K H > S+ 0 0 137 -2,-0.3 4,-3.2 1,-0.2 5,-0.2 0.932 117.9 55.5 -63.4 -43.8 2.1 -13.5 -33.5 222 223 A Q H > S+ 0 0 129 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.914 107.7 48.3 -53.5 -48.2 -1.6 -13.1 -34.1 223 224 A E H > S+ 0 0 93 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.882 111.5 51.2 -62.7 -36.5 -1.7 -16.8 -35.4 224 225 A T H X S+ 0 0 4 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.949 110.6 47.6 -65.1 -45.7 0.2 -17.9 -32.3 225 226 A L H X S+ 0 0 39 -4,-3.2 4,-2.4 1,-0.2 -2,-0.2 0.908 113.4 49.4 -56.0 -45.2 -2.2 -16.0 -30.0 226 227 A A H X S+ 0 0 50 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.896 110.2 49.7 -66.1 -42.1 -5.2 -17.6 -31.9 227 228 A N H <>S+ 0 0 38 -4,-2.7 5,-2.6 -11,-0.3 4,-0.5 0.907 112.1 48.7 -59.8 -45.2 -3.7 -21.2 -31.6 228 229 A V H ><5S+ 0 0 0 -4,-2.6 3,-1.3 -12,-0.2 -2,-0.2 0.958 111.7 48.6 -59.8 -49.3 -3.1 -20.7 -27.8 229 230 A S H 3<5S+ 0 0 29 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.884 116.5 42.5 -59.4 -37.8 -6.7 -19.4 -27.3 230 231 A A T 3<5S- 0 0 72 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.470 105.7-128.0 -84.5 -4.3 -8.2 -22.3 -29.3 231 232 A V T < 5 + 0 0 31 -3,-1.3 2,-1.4 -4,-0.5 -3,-0.2 0.919 45.3 173.9 48.5 48.2 -5.9 -24.9 -27.7 232 233 A N < + 0 0 90 -5,-2.6 2,-0.3 -6,-0.2 -1,-0.2 -0.664 21.8 113.0 -92.6 90.3 -5.0 -25.9 -31.2 233 234 A Y - 0 0 39 -2,-1.4 2,-0.3 -3,-0.2 -17,-0.1 -0.957 37.5-167.9-142.5 169.1 -2.3 -28.4 -31.0 234 235 A E - 0 0 115 -2,-0.3 2,-0.9 -19,-0.2 -2,-0.0 -0.974 31.7-115.7-148.7 169.0 -1.7 -32.1 -31.8 235 236 A F - 0 0 25 -2,-0.3 2,-0.1 5,-0.0 5,-0.0 -0.763 41.4-161.2 -99.3 83.1 0.8 -34.9 -31.2 236 237 A E >> - 0 0 72 -2,-0.9 4,-2.1 1,-0.1 3,-1.4 -0.420 21.1-124.9 -77.2 142.2 1.7 -35.5 -34.9 237 238 A D H 3> S+ 0 0 125 1,-0.3 4,-0.9 2,-0.2 -1,-0.1 0.785 106.7 63.7 -55.7 -39.2 3.3 -38.9 -35.6 238 239 A E H 34 S+ 0 0 117 1,-0.2 -1,-0.3 2,-0.2 3,-0.2 0.891 117.5 30.2 -50.4 -40.2 6.4 -37.5 -37.2 239 240 A Y H <4 S+ 0 0 51 -3,-1.4 -2,-0.2 1,-0.1 3,-0.2 0.820 128.3 34.5 -92.2 -32.1 7.2 -35.9 -33.8 240 241 A F H >< S+ 0 0 3 -4,-2.1 3,-1.6 1,-0.2 -3,-0.2 0.019 71.2 120.6-118.5 29.2 5.8 -38.2 -31.2 241 242 A S T 3< S+ 0 0 76 -4,-0.9 -1,-0.2 1,-0.3 -3,-0.1 0.784 86.6 38.3 -71.9 -24.7 6.2 -41.8 -32.6 242 243 A N T 3 S+ 0 0 115 -3,-0.2 47,-1.5 47,-0.2 2,-0.4 0.100 91.1 117.5-106.8 20.6 8.3 -42.9 -29.7 243 244 A T < - 0 0 17 -3,-1.6 42,-0.1 45,-0.2 47,-0.1 -0.760 63.5-120.9 -91.2 132.0 6.4 -41.0 -26.9 244 245 A S > - 0 0 8 -2,-0.4 4,-1.7 1,-0.1 5,-0.1 -0.225 16.3-122.2 -66.9 160.0 4.6 -42.9 -24.1 245 246 A A H > S+ 0 0 82 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.863 114.2 58.9 -67.8 -36.0 0.9 -42.6 -23.5 246 247 A L H > S+ 0 0 26 2,-0.2 4,-2.4 1,-0.2 27,-0.3 0.879 104.0 51.6 -58.2 -42.3 1.7 -41.5 -19.9 247 248 A A H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.925 110.7 46.7 -65.0 -39.8 3.7 -38.5 -21.4 248 249 A K H X S+ 0 0 57 -4,-1.7 4,-2.7 1,-0.2 -1,-0.2 0.864 111.8 52.2 -66.5 -37.0 0.8 -37.4 -23.6 249 250 A D H X S+ 0 0 59 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.893 108.4 50.1 -65.8 -43.1 -1.6 -37.7 -20.7 250 251 A F H X S+ 0 0 0 -4,-2.4 4,-0.8 2,-0.2 3,-0.2 0.948 114.5 44.7 -59.0 -49.1 0.6 -35.5 -18.5 251 252 A I H >X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 3,-1.2 0.933 110.8 53.2 -61.8 -44.3 0.8 -32.9 -21.3 252 253 A R H 3< S+ 0 0 134 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.801 104.8 56.0 -62.5 -31.6 -3.0 -33.0 -22.0 253 254 A R H 3< S+ 0 0 131 -4,-1.7 10,-2.7 -3,-0.2 -1,-0.3 0.661 114.0 40.5 -74.9 -17.7 -3.7 -32.4 -18.3 254 255 A L H << S+ 0 0 0 -3,-1.2 2,-1.7 -4,-0.8 -2,-0.2 0.764 101.5 67.9 -94.8 -38.6 -1.7 -29.2 -18.5 255 256 A L S < S+ 0 0 8 -4,-2.6 2,-0.4 -5,-0.1 -1,-0.2 -0.500 72.5 135.0 -86.5 71.3 -2.7 -27.9 -21.8 256 257 A V - 0 0 36 -2,-1.7 6,-0.1 -3,-0.2 -25,-0.1 -0.968 52.2-144.3-123.6 126.8 -6.4 -27.1 -20.7 257 258 A K S S+ 0 0 93 -2,-0.4 -71,-0.2 1,-0.1 -1,-0.1 0.926 84.6 70.1 -61.6 -51.6 -8.1 -23.9 -21.5 258 259 A D S >> S- 0 0 78 1,-0.2 3,-2.1 3,-0.1 4,-0.6 -0.609 72.8-151.6 -75.6 113.2 -10.1 -23.5 -18.3 259 260 A P G >4 S+ 0 0 32 0, 0.0 3,-0.9 0, 0.0 -1,-0.2 0.809 95.4 58.8 -54.1 -35.8 -7.6 -22.7 -15.4 260 261 A K G 34 S+ 0 0 80 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.735 108.8 44.1 -65.1 -18.7 -9.9 -24.3 -12.9 261 262 A K G <4 S+ 0 0 158 -3,-2.1 -1,-0.2 2,-0.1 2,-0.1 0.469 92.1 104.7-104.0 -3.5 -9.7 -27.6 -14.8 262 263 A R S << S- 0 0 12 -3,-0.9 -8,-0.2 -4,-0.6 -9,-0.1 -0.490 82.7 -94.6 -80.0 152.8 -6.0 -27.6 -15.4 263 264 A M - 0 0 20 -10,-2.7 2,-0.1 -2,-0.1 -1,-0.1 -0.357 40.5-135.8 -65.6 140.2 -3.6 -29.8 -13.4 264 265 A T > - 0 0 51 1,-0.1 4,-2.1 -3,-0.1 5,-0.1 -0.425 24.3-103.9 -89.7 170.5 -2.1 -28.1 -10.3 265 266 A I H > S+ 0 0 4 1,-0.2 4,-1.4 2,-0.2 -138,-0.1 0.891 120.1 53.9 -60.3 -37.5 1.6 -28.4 -9.3 266 267 A Q H > S+ 0 0 98 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.908 111.3 44.5 -68.8 -37.8 0.7 -30.8 -6.5 267 268 A D H >> S+ 0 0 91 1,-0.2 3,-0.8 2,-0.2 4,-0.6 0.831 104.7 61.3 -73.6 -30.7 -1.1 -33.1 -8.8 268 269 A S H >< S+ 0 0 0 -4,-2.1 3,-0.7 1,-0.2 6,-0.3 0.858 102.5 54.3 -60.2 -38.2 1.6 -33.0 -11.5 269 270 A L H 3< S+ 0 0 17 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.684 111.3 44.3 -67.6 -21.4 4.1 -34.4 -8.9 270 271 A Q H << S+ 0 0 94 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.2 0.393 84.6 118.3 -98.4 -4.8 1.7 -37.4 -8.3 271 272 A H S XX S- 0 0 8 -3,-0.7 4,-2.4 -4,-0.6 3,-1.5 -0.440 75.4-120.9 -67.4 140.0 0.9 -38.1 -12.0 272 273 A P T 34 S+ 0 0 23 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.692 111.0 63.9 -62.2 -19.5 2.2 -41.6 -13.0 273 274 A W T 34 S+ 0 0 0 -27,-0.3 -26,-0.1 1,-0.2 -157,-0.1 0.847 115.9 31.7 -67.3 -33.0 4.5 -40.2 -15.7 274 275 A I T <4 S+ 0 0 9 -3,-1.5 -1,-0.2 1,-0.3 -5,-0.1 0.847 138.1 22.3 -87.9 -39.4 6.4 -38.5 -12.9 275 276 A K S < S- 0 0 109 -4,-2.4 -1,-0.3 -5,-0.0 -2,-0.1 -0.853 85.4-147.2-132.8 87.3 5.8 -41.1 -10.2 276 277 A P - 0 0 38 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 -0.295 3.4-153.0 -64.6 147.1 5.0 -44.4 -11.8 277 278 A K S S+ 0 0 159 1,-0.1 2,-0.3 -5,-0.0 -4,-0.0 0.577 73.8 17.2 -95.1 -15.4 2.5 -46.6 -9.8 278 279 A D S > S- 0 0 72 -6,-0.1 4,-2.0 1,-0.1 5,-0.1 -0.959 82.4-100.4-154.5 167.6 3.8 -50.0 -11.1 279 280 A T H > S+ 0 0 119 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.799 117.5 57.1 -63.5 -31.9 6.7 -51.6 -12.8 280 281 A Q H > S+ 0 0 151 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.923 107.5 46.4 -65.8 -46.8 4.9 -51.6 -16.2 281 282 A Q H > S+ 0 0 43 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.899 111.9 53.4 -60.1 -41.1 4.4 -47.8 -16.2 282 283 A A H X S+ 0 0 34 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.903 108.9 48.4 -64.8 -35.6 8.1 -47.4 -15.1 283 284 A L H X S+ 0 0 113 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.853 105.8 57.3 -75.2 -30.0 9.3 -49.5 -18.1 284 285 A S H X S+ 0 0 43 -4,-1.9 4,-1.2 2,-0.2 -1,-0.2 0.906 110.1 44.9 -64.8 -36.5 7.1 -47.6 -20.6 285 286 A R H < S+ 0 0 30 -4,-1.5 -172,-1.3 1,-0.2 -173,-0.7 0.911 112.9 51.0 -74.9 -34.3 8.9 -44.4 -19.4 286 287 A K H < S+ 0 0 117 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.854 114.3 43.1 -70.6 -34.5 12.4 -46.0 -19.6 287 288 A A H < S+ 0 0 87 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.679 97.4 87.3 -86.4 -18.8 11.8 -47.4 -23.1 288 289 A S < - 0 0 18 -4,-1.2 -176,-2.2 -5,-0.2 -175,-0.4 -0.481 62.9-164.1 -82.4 154.2 10.3 -44.3 -24.6 289 290 A A B -J 111 0D 31 -47,-1.5 -178,-0.3 -178,-0.3 -47,-0.2 -0.958 20.9-103.1-143.7 155.6 12.6 -41.6 -26.0 290 291 A V - 0 0 13 -180,-2.7 2,-2.0 -2,-0.3 -180,-0.3 -0.432 39.9-108.8 -71.9 148.2 12.7 -37.9 -27.1 291 292 A N > + 0 0 36 -81,-2.4 4,-2.5 -52,-0.2 3,-0.4 -0.539 47.3 177.4 -74.8 78.3 12.6 -37.0 -30.8 292 293 A M H > + 0 0 18 -2,-2.0 4,-2.5 1,-0.2 5,-0.2 0.782 67.9 58.1 -61.4 -33.1 16.3 -36.0 -30.6 293 294 A E H > S+ 0 0 132 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.935 115.2 36.3 -68.6 -42.9 16.8 -35.1 -34.3 294 295 A K H > S+ 0 0 47 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.853 113.3 59.6 -75.0 -35.7 14.0 -32.5 -34.2 295 296 A F H X S+ 0 0 2 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.887 103.1 51.9 -58.7 -44.8 14.9 -31.4 -30.6 296 297 A K H X S+ 0 0 82 -4,-2.5 4,-1.1 1,-0.2 -1,-0.2 0.896 108.6 50.9 -58.8 -42.9 18.5 -30.5 -31.8 297 298 A K H < S+ 0 0 126 -4,-1.2 3,-0.3 1,-0.2 -1,-0.2 0.879 109.5 50.9 -58.3 -43.6 17.0 -28.3 -34.6 298 299 A F H >< S+ 0 0 56 -4,-2.1 3,-1.3 1,-0.2 -1,-0.2 0.908 107.8 52.0 -63.8 -41.2 14.8 -26.6 -32.1 299 300 A A H 3< S+ 0 0 23 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.723 105.4 56.5 -73.6 -15.2 17.6 -25.8 -29.8 300 301 A A T 3< 0 0 90 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.146 360.0 360.0 -92.3 15.9 19.7 -24.2 -32.6 301 302 A R < 0 0 126 -3,-1.3 -3,-0.0 0, 0.0 -4,-0.0 -0.597 360.0 360.0-103.0 360.0 17.0 -21.6 -33.5