==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 27-NOV-08 2W4K . 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) . 14950.0 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 . 28 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 29.9 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 3 1 1 0 0 2 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 0 111 0, 0.0 2,-0.5 0, 0.0 60,-0.0 0.000 360.0 360.0 360.0 128.9 -17.9 33.5 -16.0 2 3 A V - 0 0 123 81,-0.0 2,-0.1 0, 0.0 3,-0.1 -0.939 360.0-157.8-104.8 128.8 -14.3 34.0 -17.0 3 4 A F - 0 0 13 -2,-0.5 79,-0.2 1,-0.2 80,-0.1 -0.311 47.8 -49.5 -89.9 178.8 -11.7 31.5 -15.9 4 5 A R B -a 82 0A 73 77,-2.2 79,-2.6 1,-0.1 -1,-0.2 -0.284 47.6-160.4 -58.6 132.9 -7.9 32.0 -15.6 5 6 A Q + 0 0 119 77,-0.2 -1,-0.1 -3,-0.1 77,-0.1 0.491 54.2 102.9 -96.8 -7.6 -6.5 33.6 -18.7 6 7 A E S S- 0 0 79 1,-0.1 2,-0.5 2,-0.1 77,-0.3 -0.313 88.0 -88.3 -73.0 161.4 -2.8 32.7 -18.3 7 8 A N >> - 0 0 84 1,-0.2 3,-2.1 75,-0.1 4,-0.5 -0.612 31.2-143.0 -65.6 117.3 -1.1 29.9 -20.2 8 9 A V H >> S+ 0 0 7 -2,-0.5 4,-2.0 1,-0.3 3,-1.7 0.842 99.6 68.3 -52.8 -31.8 -1.6 26.9 -18.0 9 10 A D H 34 S+ 0 0 77 1,-0.3 -1,-0.3 2,-0.2 5,-0.1 0.711 88.7 64.0 -63.3 -22.6 2.0 25.9 -19.1 10 11 A D H <4 S+ 0 0 96 -3,-2.1 -1,-0.3 1,-0.1 -2,-0.2 0.775 116.0 28.3 -66.8 -26.6 3.3 28.9 -17.1 11 12 A Y H << S+ 0 0 91 -3,-1.7 21,-3.2 -4,-0.5 22,-0.5 0.641 122.2 41.7-110.4 -18.0 2.0 27.2 -13.9 12 13 A Y E < -B 31 0A 3 -4,-2.0 2,-0.5 19,-0.2 19,-0.2 -0.960 61.0-139.7-133.4 146.4 2.1 23.5 -14.6 13 14 A D E -B 30 0A 84 17,-2.4 17,-2.6 -2,-0.3 2,-0.3 -0.922 32.6-140.9 -95.9 131.6 4.3 20.9 -16.3 14 15 A T E +B 29 0A 63 -2,-0.5 15,-0.3 15,-0.2 2,-0.1 -0.743 23.8 176.1-100.3 143.3 2.1 18.5 -18.2 15 16 A G E - 0 0 39 13,-3.8 3,-0.1 -2,-0.3 -1,-0.1 -0.135 37.7 -20.7-119.3-146.6 2.7 14.8 -18.4 16 17 A E E - 0 0 112 11,-0.1 12,-3.0 1,-0.1 -1,-0.3 -0.197 68.6 -93.6 -71.7 155.7 1.2 11.6 -19.7 17 18 A E E -B 27 0A 116 10,-0.2 10,-0.3 1,-0.2 -1,-0.1 -0.486 31.4-174.7 -64.2 128.1 -2.4 11.1 -20.7 18 19 A L E - 0 0 69 8,-3.5 2,-0.3 1,-0.4 9,-0.2 0.692 63.0 -47.3 -93.3 -27.8 -4.5 9.6 -18.0 19 20 A G E -B 26 0A 26 7,-1.6 7,-2.9 2,-0.0 -1,-0.4 -0.978 51.9-131.1 174.7-177.4 -7.7 9.2 -20.1 20 21 A S E -B 25 0A 88 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.978 6.5-162.9-156.3 162.1 -10.0 10.8 -22.6 21 22 A G E > -B 24 0A 46 3,-3.0 3,-0.7 -2,-0.3 -2,-0.0 -0.744 51.9 -75.7-134.5-174.6 -13.6 11.5 -23.4 22 23 A Q T 3 S+ 0 0 170 1,-0.2 3,-0.0 -2,-0.2 -1,-0.0 0.912 130.5 9.5 -53.1 -46.6 -15.5 12.5 -26.5 23 24 A F T 3 S+ 0 0 61 31,-0.0 21,-2.9 -3,-0.0 2,-0.3 0.025 122.5 72.9-124.4 26.3 -14.4 16.1 -26.3 24 25 A A E < -BC 21 43A 19 -3,-0.7 -3,-3.0 19,-0.2 2,-0.4 -0.992 49.7-163.9-147.0 144.5 -11.8 15.9 -23.5 25 26 A V E -BC 20 42A 38 17,-1.7 17,-3.2 -2,-0.3 2,-0.5 -0.990 15.2-153.2-125.0 140.2 -8.3 14.7 -22.8 26 27 A V E -BC 19 41A 31 -7,-2.9 -8,-3.5 -2,-0.4 -7,-1.6 -0.968 16.9-179.1-116.1 125.6 -7.0 14.3 -19.2 27 28 A K E -BC 17 40A 67 13,-2.5 13,-3.6 -2,-0.5 -10,-0.2 -0.937 31.1-112.1-126.0 146.8 -3.3 14.6 -18.5 28 29 A K E - C 0 39A 41 -12,-3.0 -13,-3.8 -2,-0.3 2,-0.3 -0.469 43.7-179.4 -67.7 144.8 -1.1 14.3 -15.4 29 30 A C E -BC 14 38A 2 9,-2.0 9,-2.7 -15,-0.3 2,-0.5 -0.986 24.4-139.6-150.3 158.5 0.4 17.6 -14.4 30 31 A R E -BC 13 37A 96 -17,-2.6 -17,-2.4 -2,-0.3 2,-0.4 -0.981 21.2-130.2-125.2 121.1 2.7 19.1 -11.7 31 32 A E E > -B 12 0A 17 5,-3.1 4,-2.6 -2,-0.5 3,-0.5 -0.608 15.6-148.6 -70.8 122.9 2.0 22.4 -10.2 32 33 A K T 4 S+ 0 0 86 -21,-3.2 -1,-0.1 -2,-0.4 -20,-0.1 0.867 91.1 52.8 -65.7 -38.1 5.2 24.4 -10.4 33 34 A S T 4 S+ 0 0 101 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.792 127.6 18.6 -69.3 -27.7 4.7 26.5 -7.2 34 35 A T T 4 S- 0 0 73 -3,-0.5 -2,-0.2 2,-0.2 -1,-0.2 0.568 90.4-129.6-117.8 -18.5 4.1 23.5 -4.9 35 36 A G < + 0 0 31 -4,-2.6 2,-0.2 1,-0.3 -3,-0.1 0.534 61.5 141.7 70.7 8.8 5.4 20.5 -6.8 36 37 A L - 0 0 93 -5,-0.3 -5,-3.1 -6,-0.1 2,-0.3 -0.568 49.6-121.1 -86.2 149.4 2.1 18.8 -6.2 37 38 A Q E +C 30 0A 108 -7,-0.2 57,-0.6 -2,-0.2 -7,-0.2 -0.669 34.5 165.1 -96.1 141.9 0.4 16.6 -8.8 38 39 A Y E -CD 29 93A 38 -9,-2.7 -9,-2.0 -2,-0.3 2,-0.5 -0.738 37.2-109.2-137.6 177.5 -3.0 17.1 -10.3 39 40 A A E -CD 28 92A 8 53,-3.0 53,-3.5 -2,-0.2 2,-0.6 -0.993 26.5-151.3-116.0 123.3 -5.1 15.9 -13.3 40 41 A A E -CD 27 91A 0 -13,-3.6 -13,-2.5 -2,-0.5 2,-0.7 -0.842 6.5-161.8 -96.8 117.9 -5.6 18.5 -16.1 41 42 A K E -CD 26 90A 26 49,-3.3 49,-2.9 -2,-0.6 2,-0.7 -0.889 4.0-159.9-104.4 111.6 -8.9 17.9 -18.0 42 43 A F E -CD 25 89A 22 -17,-3.2 -17,-1.7 -2,-0.7 2,-0.5 -0.825 8.3-167.7 -94.2 112.4 -8.8 19.8 -21.3 43 44 A I E -CD 24 88A 5 45,-3.1 45,-2.6 -2,-0.7 2,-0.4 -0.909 19.6-127.6-106.8 123.9 -12.3 20.2 -22.6 44 45 A K E - D 0 87A 87 -21,-2.9 11,-3.3 -2,-0.5 43,-0.2 -0.571 19.0-135.3 -72.3 123.8 -12.8 21.4 -26.2 45 46 A K B -f 55 0B 33 41,-2.8 11,-0.2 -2,-0.4 3,-0.1 -0.548 6.2-139.8 -71.9 138.2 -15.0 24.5 -26.6 46 47 A R - 0 0 82 9,-2.2 2,-1.7 -2,-0.2 7,-0.2 0.914 27.6-170.3 -67.4 -36.4 -17.5 24.1 -29.5 47 48 A R + 0 0 163 8,-0.3 2,-0.4 2,-0.1 -1,-0.2 -0.228 64.6 52.0 81.5 -47.3 -16.8 27.8 -30.3 48 49 A T S > S- 0 0 81 -2,-1.7 3,-2.0 -3,-0.1 0, 0.0 -0.981 83.2-131.8-119.3 136.7 -19.6 28.1 -32.8 49 50 A K T 3 S+ 0 0 177 -2,-0.4 -1,-0.1 1,-0.3 -2,-0.1 0.760 106.4 54.4 -57.2 -28.9 -23.1 27.1 -31.8 50 51 A S T 3 S+ 0 0 111 -4,-0.1 2,-0.3 2,-0.0 -1,-0.3 0.482 88.5 98.6 -84.4 -6.8 -23.6 25.1 -35.0 51 52 A S < - 0 0 13 -3,-2.0 3,-0.2 1,-0.1 -5,-0.1 -0.663 51.4-168.5 -84.3 138.8 -20.4 23.0 -34.5 52 53 A R + 0 0 217 -2,-0.3 -1,-0.1 1,-0.1 -3,-0.1 0.259 67.6 94.7 -98.9 8.3 -20.8 19.5 -33.0 53 54 A R S S+ 0 0 197 -7,-0.2 2,-0.3 2,-0.1 -1,-0.1 0.073 89.1 13.5 -94.5 28.4 -17.0 19.3 -32.4 54 55 A G S S- 0 0 9 -3,-0.2 2,-0.3 -11,-0.0 -9,-0.2 -0.950 88.1 -70.0-176.0-172.4 -16.8 20.5 -28.7 55 56 A V B -f 45 0B 33 -11,-3.3 -9,-2.2 -2,-0.3 -8,-0.3 -0.790 45.7-112.5-105.6 141.0 -18.8 21.2 -25.6 56 57 A S > - 0 0 13 -2,-0.3 4,-1.8 -11,-0.2 5,-0.2 -0.316 25.2-120.2 -64.7 152.2 -21.2 24.1 -25.2 57 58 A R H > S+ 0 0 86 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.894 113.5 59.0 -63.0 -37.1 -20.2 26.8 -22.7 58 59 A E H > S+ 0 0 137 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.908 107.6 45.6 -55.5 -46.4 -23.3 26.2 -20.7 59 60 A D H > S+ 0 0 66 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.836 114.4 47.8 -69.1 -35.1 -22.3 22.5 -20.2 60 61 A I H X S+ 0 0 1 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.950 111.9 49.5 -67.8 -50.5 -18.7 23.4 -19.3 61 62 A E H X S+ 0 0 40 -4,-3.4 4,-2.8 1,-0.2 -2,-0.2 0.864 109.9 52.8 -54.5 -41.9 -19.8 26.1 -16.8 62 63 A R H X S+ 0 0 61 -4,-2.0 4,-2.4 -5,-0.2 5,-0.2 0.951 110.1 46.2 -59.7 -51.8 -22.2 23.6 -15.2 63 64 A E H X S+ 0 0 14 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.929 115.8 47.0 -55.8 -48.5 -19.5 21.0 -14.6 64 65 A V H X S+ 0 0 1 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.911 110.3 51.8 -59.4 -44.6 -17.2 23.6 -13.3 65 66 A S H X S+ 0 0 79 -4,-2.8 4,-1.2 -5,-0.2 -2,-0.2 0.889 113.0 45.2 -65.5 -38.0 -19.9 25.1 -11.0 66 67 A I H X S+ 0 0 7 -4,-2.4 4,-1.3 2,-0.2 3,-0.4 0.945 113.3 49.1 -68.0 -47.4 -20.7 21.7 -9.5 67 68 A L H < S+ 0 0 2 -4,-2.6 11,-0.9 -5,-0.2 -2,-0.2 0.853 106.0 58.3 -62.4 -34.4 -17.0 20.8 -9.0 68 69 A K H < S+ 0 0 113 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.867 107.4 47.5 -61.3 -39.0 -16.3 24.1 -7.3 69 70 A E H < S+ 0 0 79 -4,-1.2 2,-0.3 -3,-0.4 -1,-0.2 0.770 91.8 97.0 -74.8 -26.8 -18.9 23.4 -4.6 70 71 A I < + 0 0 0 -4,-1.3 8,-0.4 -3,-0.2 2,-0.3 -0.481 34.3 158.7 -85.9 133.3 -17.8 19.9 -3.8 71 72 A Q + 0 0 126 -2,-0.3 5,-0.1 6,-0.1 6,-0.1 -0.809 27.1 120.6-144.4 96.1 -15.5 19.0 -0.9 72 73 A H > - 0 0 48 3,-0.5 3,-1.7 -2,-0.3 53,-0.0 -0.967 65.2-117.0-159.5 144.3 -15.7 15.4 0.4 73 74 A P T 3 S+ 0 0 68 0, 0.0 52,-0.1 0, 0.0 4,-0.1 0.729 112.5 50.0 -56.2 -28.3 -13.2 12.6 0.7 74 75 A N T 3 S+ 0 0 12 83,-0.1 84,-2.4 47,-0.1 2,-0.3 0.278 105.2 60.6-100.2 10.9 -15.1 10.4 -1.8 75 76 A V B < S-g 158 0C 0 -3,-1.7 -3,-0.5 82,-0.3 84,-0.2 -0.978 87.0-107.3-131.5 146.8 -15.5 12.9 -4.7 76 77 A I - 0 0 6 82,-1.9 2,-0.3 -2,-0.3 -6,-0.1 -0.354 33.1-140.9 -66.2 152.3 -12.8 14.7 -6.7 77 78 A T - 0 0 32 -6,-0.1 16,-2.5 -4,-0.1 2,-0.5 -0.826 11.8-118.2-115.0 157.0 -12.3 18.4 -6.1 78 79 A L E + E 0 92A 22 -11,-0.9 14,-0.2 -8,-0.4 3,-0.1 -0.810 26.0 179.4 -92.5 131.0 -11.6 21.3 -8.5 79 80 A H E - 0 0 67 12,-3.4 2,-0.3 -2,-0.5 13,-0.2 0.882 62.7 -22.2 -96.2 -52.7 -8.2 23.0 -7.9 80 81 A E E - E 0 91A 39 11,-1.3 11,-3.2 2,-0.0 -1,-0.4 -0.970 51.6-139.0-151.6 163.3 -8.2 25.7 -10.7 81 82 A V E + E 0 90A 11 -2,-0.3 -77,-2.2 9,-0.2 2,-0.3 -0.999 20.0 178.6-130.2 133.0 -9.7 26.5 -14.0 82 83 A Y E -aE 4 89A 1 7,-2.6 7,-3.4 -2,-0.4 2,-0.3 -0.873 6.1-164.5-122.0 160.3 -7.9 28.0 -17.1 83 84 A E E + E 0 88A 16 -79,-2.6 5,-0.2 -2,-0.3 2,-0.2 -0.999 10.5 170.8-146.4 146.1 -9.1 28.8 -20.6 84 85 A N - 0 0 71 3,-2.5 -78,-0.0 -2,-0.3 -77,-0.0 -0.657 57.6 -69.2-129.8-165.3 -7.6 29.6 -23.9 85 86 A K S S+ 0 0 161 -2,-0.2 3,-0.1 1,-0.2 -40,-0.0 0.839 129.4 19.2 -58.3 -37.3 -8.9 30.0 -27.5 86 87 A T S S+ 0 0 52 1,-0.1 -41,-2.8 -42,-0.1 2,-0.3 0.716 120.0 46.1-105.4 -26.4 -9.8 26.4 -27.9 87 88 A D E -D 44 0A 16 -43,-0.2 -3,-2.5 2,-0.0 2,-0.5 -0.899 51.2-148.6-129.6 146.4 -10.0 24.8 -24.4 88 89 A V E -DE 43 83A 0 -45,-2.6 -45,-3.1 -2,-0.3 2,-0.6 -0.971 31.1-154.6-103.8 131.4 -11.3 25.1 -20.9 89 90 A I E -DE 42 82A 3 -7,-3.4 -7,-2.6 -2,-0.5 2,-0.6 -0.918 7.1-161.9-117.6 113.9 -8.8 23.4 -18.7 90 91 A L E -DE 41 81A 0 -49,-2.9 -49,-3.3 -2,-0.6 2,-0.8 -0.819 8.8-151.0 -96.9 118.4 -9.9 22.0 -15.3 91 92 A I E -DE 40 80A 0 -11,-3.2 -12,-3.4 -2,-0.6 -11,-1.3 -0.842 30.7-176.7 -89.4 110.9 -7.1 21.3 -12.8 92 93 A L E -DE 39 78A 14 -53,-3.5 -53,-3.0 -2,-0.8 -14,-0.2 -0.729 35.7 -86.3-109.8 153.8 -8.6 18.4 -10.8 93 94 A E E -D 38 0A 38 -16,-2.5 2,-0.4 -2,-0.3 -55,-0.2 -0.362 54.9-114.8 -49.5 127.7 -7.6 16.4 -7.8 94 95 A L - 0 0 21 -57,-0.6 2,-0.6 -65,-0.1 -1,-0.1 -0.604 26.4-166.0 -75.7 128.1 -5.4 13.6 -9.2 95 96 A V + 0 0 26 -2,-0.4 3,-0.3 1,-0.1 52,-0.2 -0.954 15.6 169.1-111.7 109.7 -6.8 10.1 -8.7 96 97 A A + 0 0 58 51,-1.8 51,-0.2 -2,-0.6 52,-0.2 0.509 52.4 79.1-105.0 -6.9 -4.0 7.7 -9.4 97 98 A G S S- 0 0 2 49,-2.5 -1,-0.2 1,-0.2 50,-0.2 0.245 87.2-131.0 -93.2 12.8 -5.1 4.2 -8.4 98 99 A G - 0 0 28 -3,-0.3 48,-2.1 48,-0.2 -1,-0.2 -0.137 52.0 -19.9 72.3-165.9 -7.2 3.4 -11.5 99 100 A E B > -H 145 0C 60 46,-0.2 4,-1.4 1,-0.1 46,-0.3 -0.517 56.2-127.2 -80.4 142.9 -10.8 2.0 -11.5 100 101 A L H > S+ 0 0 1 44,-2.8 4,-2.6 41,-0.4 3,-0.4 0.899 107.8 53.5 -48.7 -51.4 -12.2 0.2 -8.4 101 102 A F H > S+ 0 0 6 43,-0.3 4,-2.6 40,-0.3 -1,-0.2 0.872 104.9 54.0 -60.1 -39.0 -13.2 -2.9 -10.3 102 103 A D H 4 S+ 0 0 60 -3,-0.2 4,-0.3 1,-0.2 -1,-0.2 0.856 111.6 46.1 -63.3 -35.2 -9.7 -3.4 -11.8 103 104 A F H >< S+ 0 0 27 -4,-1.4 3,-0.9 -3,-0.4 -2,-0.2 0.899 113.8 47.6 -72.0 -44.0 -8.2 -3.3 -8.3 104 105 A L H >< S+ 0 0 0 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.848 104.3 61.2 -65.3 -36.5 -10.9 -5.7 -6.9 105 106 A A T 3< S+ 0 0 15 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.613 95.7 62.8 -68.2 -13.5 -10.4 -8.1 -9.9 106 107 A E T < S+ 0 0 126 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.2 0.481 86.2 94.9 -86.0 -5.1 -6.7 -8.6 -8.7 107 108 A K S < S- 0 0 63 -3,-1.7 3,-0.1 -4,-0.1 -3,-0.0 -0.457 75.5-134.2 -84.7 161.2 -7.8 -10.1 -5.4 108 109 A E S S- 0 0 173 1,-0.3 2,-0.3 -2,-0.1 -1,-0.1 0.849 84.8 -10.0 -80.0 -36.1 -8.1 -13.8 -4.9 109 110 A S - 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0 0 21 -2,-0.3 3,-0.2 1,-0.1 -9,-0.1 -0.814 18.6-144.8 -94.0 124.4 -24.5 -6.7 -16.2 215 216 A P S S+ 0 0 13 0, 0.0 19,-0.3 0, 0.0 -1,-0.1 0.851 90.5 20.1 -63.3 -35.1 -28.2 -6.9 -15.2 216 217 A F S S+ 0 0 1 -35,-0.3 2,-0.3 17,-0.1 11,-0.3 0.426 83.1 130.0-114.5 -2.5 -29.7 -5.2 -18.3 217 218 A L + 0 0 85 -3,-0.2 2,-0.1 -36,-0.1 -3,-0.1 -0.406 34.2 179.5 -62.6 116.1 -27.0 -5.5 -21.1 218 219 A G - 0 0 16 2,-0.4 6,-0.1 -2,-0.3 -2,-0.1 -0.302 45.1 -89.0-101.3-165.9 -28.7 -7.0 -24.2 219 220 A D S S+ 0 0 152 -2,-0.1 2,-0.3 2,-0.0 3,-0.1 0.534 108.8 24.9 -88.4 -7.1 -27.3 -7.8 -27.7 220 221 A T S > S- 0 0 75 1,-0.1 4,-2.6 0, 0.0 -2,-0.4 -0.957 84.1-108.9-143.3 164.3 -28.0 -4.3 -29.0 221 222 A K H > S+ 0 0 133 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.952 121.2 52.2 -52.0 -53.5 -28.4 -0.8 -27.6 222 223 A Q H > S+ 0 0 135 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.849 110.4 48.1 -54.1 -38.5 -32.1 -0.9 -28.4 223 224 A E H > S+ 0 0 87 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.910 108.9 52.5 -72.7 -41.4 -32.4 -4.2 -26.5 224 225 A T H X S+ 0 0 6 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.949 110.4 49.2 -55.9 -47.4 -30.4 -2.9 -23.5 225 226 A L H X S+ 0 0 46 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.847 109.5 51.0 -63.0 -36.8 -32.8 0.1 -23.3 226 227 A A H X S+ 0 0 55 -4,-1.6 4,-2.4 -5,-0.2 -1,-0.2 0.880 109.0 51.7 -67.4 -39.4 -35.8 -2.2 -23.5 227 228 A N H X>S+ 0 0 29 -4,-2.4 5,-3.0 -11,-0.3 4,-0.6 0.935 112.0 46.4 -60.6 -46.1 -34.5 -4.3 -20.7 228 229 A V H ><5S+ 0 0 0 -4,-2.4 3,-1.4 -12,-0.2 -2,-0.2 0.966 113.5 48.0 -58.2 -54.4 -33.9 -1.2 -18.5 229 230 A S H 3<5S+ 0 0 27 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.868 117.0 42.1 -57.1 -39.4 -37.4 0.2 -19.3 230 231 A A H 3<5S- 0 0 74 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.497 107.4-126.2 -83.7 -4.4 -39.1 -3.2 -18.6 231 232 A V T <<5 + 0 0 36 -3,-1.4 2,-1.1 -4,-0.6 -3,-0.2 0.917 47.0 173.7 50.1 46.6 -36.8 -3.7 -15.5 232 233 A N < + 0 0 82 -5,-3.0 2,-0.3 -6,-0.2 -1,-0.2 -0.726 18.7 122.1 -89.2 92.7 -36.0 -7.0 -17.1 233 234 A Y - 0 0 33 -2,-1.1 2,-0.3 -3,-0.2 -17,-0.1 -0.967 37.2-160.4-144.4 161.9 -33.3 -8.6 -15.0 234 235 A E - 0 0 117 -2,-0.3 2,-1.2 -19,-0.3 -2,-0.0 -0.959 29.9-122.1-138.5 155.6 -32.8 -11.8 -13.1 235 236 A F - 0 0 31 -2,-0.3 2,-0.1 5,-0.0 5,-0.1 -0.710 42.6-153.4 -92.6 78.1 -30.5 -13.1 -10.3 236 237 A E >> - 0 0 98 -2,-1.2 4,-2.7 1,-0.1 3,-2.3 -0.325 12.9-136.5 -56.0 125.5 -29.2 -16.0 -12.6 237 238 A D H 3> S+ 0 0 123 1,-0.3 4,-1.2 2,-0.2 -1,-0.1 0.803 102.3 68.0 -55.8 -30.3 -28.1 -18.9 -10.4 238 239 A E H 34 S+ 0 0 121 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.750 118.9 21.1 -55.1 -26.4 -25.0 -19.3 -12.6 239 240 A Y H <4 S+ 0 0 60 -3,-2.3 3,-0.3 55,-0.0 -2,-0.2 0.694 129.1 43.2-115.0 -31.0 -23.8 -15.9 -11.2 240 241 A F H >< S+ 0 0 2 -4,-2.7 3,-1.8 1,-0.2 -3,-0.2 0.227 70.2 112.6-111.6 12.7 -25.7 -15.4 -7.9 241 242 A S T 3< S+ 0 0 65 -4,-1.2 -1,-0.2 1,-0.3 -3,-0.1 0.799 87.9 39.6 -56.8 -31.6 -25.6 -18.8 -6.2 242 243 A N T 3 S+ 0 0 110 -3,-0.3 47,-1.4 47,-0.1 2,-0.4 0.049 90.6 114.5-108.5 25.9 -23.4 -17.5 -3.4 243 244 A T < - 0 0 13 -3,-1.8 47,-0.1 45,-0.2 42,-0.1 -0.831 66.6-118.6-101.9 131.9 -25.1 -14.1 -3.0 244 245 A S > - 0 0 9 -2,-0.4 4,-1.8 1,-0.1 5,-0.1 -0.181 15.9-121.3 -66.4 159.8 -26.9 -13.4 0.3 245 246 A A H > S+ 0 0 79 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.865 114.5 56.4 -67.4 -37.1 -30.6 -12.7 0.5 246 247 A L H > S+ 0 0 28 2,-0.2 4,-2.2 1,-0.2 27,-0.3 0.876 105.8 50.2 -61.5 -41.1 -29.8 -9.3 2.0 247 248 A A H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.920 111.4 48.1 -63.4 -43.7 -27.6 -8.3 -0.9 248 249 A K H X S+ 0 0 53 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.886 111.9 50.1 -65.0 -38.1 -30.4 -9.3 -3.4 249 250 A D H X S+ 0 0 43 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.889 107.5 53.7 -66.2 -42.3 -32.9 -7.3 -1.4 250 251 A F H X S+ 0 0 0 -4,-2.2 4,-0.6 1,-0.2 -2,-0.2 0.956 114.2 42.2 -52.8 -51.4 -30.5 -4.3 -1.4 251 252 A I H >X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 3,-1.1 0.907 110.4 56.0 -61.1 -46.6 -30.4 -4.5 -5.2 252 253 A R H 3< S+ 0 0 121 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.848 105.0 53.0 -58.5 -36.6 -34.1 -5.2 -5.6 253 254 A R H 3< S+ 0 0 128 -4,-2.1 10,-2.5 1,-0.2 -1,-0.3 0.669 114.1 43.4 -75.7 -15.8 -35.0 -2.0 -3.7 254 255 A L H << S+ 0 0 0 -3,-1.1 2,-1.9 -4,-0.6 -2,-0.2 0.803 101.6 65.3 -93.6 -38.2 -32.7 -0.0 -6.1 255 256 A L S < S+ 0 0 6 -4,-2.8 2,-0.4 -52,-0.1 -1,-0.2 -0.485 75.1 136.1 -85.7 67.3 -33.7 -1.6 -9.4 256 257 A V - 0 0 36 -2,-1.9 6,-0.1 -3,-0.2 -25,-0.1 -0.967 52.1-145.1-120.1 127.8 -37.3 -0.2 -9.1 257 258 A K S S+ 0 0 94 -2,-0.4 -71,-0.2 -27,-0.1 -1,-0.1 0.931 84.6 70.2 -60.7 -50.5 -39.0 1.4 -12.1 258 259 A D S >> S- 0 0 65 1,-0.2 3,-1.6 -73,-0.1 4,-0.8 -0.603 74.0-151.3 -72.6 116.2 -41.0 4.1 -10.2 259 260 A P G >4 S+ 0 0 28 0, 0.0 3,-0.7 0, 0.0 -1,-0.2 0.857 94.4 58.8 -57.0 -33.5 -38.4 6.7 -9.0 260 261 A K G 34 S+ 0 0 178 1,-0.2 4,-0.1 -3,-0.0 -2,-0.1 0.642 108.3 44.0 -70.8 -18.6 -40.6 7.5 -6.0 261 262 A K G <4 S+ 0 0 159 -3,-1.6 -1,-0.2 2,-0.1 2,-0.1 0.452 92.1 104.5-102.3 -9.5 -40.6 3.9 -4.8 262 263 A R S << S- 0 0 10 -4,-0.8 -8,-0.2 -3,-0.7 2,-0.1 -0.406 85.6 -93.5 -70.6 148.2 -36.8 3.4 -5.3 263 264 A M - 0 0 20 -10,-2.5 2,-0.1 -13,-0.1 -1,-0.1 -0.421 40.3-134.9 -60.8 137.7 -34.5 3.4 -2.2 264 265 A T > - 0 0 50 -2,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.435 24.7-105.1 -84.0 166.1 -33.0 6.8 -1.5 265 266 A I H > S+ 0 0 3 2,-0.2 4,-1.6 1,-0.2 -138,-0.1 0.930 121.3 52.8 -57.6 -44.5 -29.4 7.3 -0.6 266 267 A Q H > S+ 0 0 100 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.911 111.5 45.8 -62.7 -39.3 -30.2 7.9 3.1 267 268 A D H >> S+ 0 0 89 1,-0.2 4,-0.9 2,-0.2 3,-0.5 0.851 105.8 59.6 -70.4 -32.3 -32.2 4.6 3.2 268 269 A S H 3< S+ 0 0 0 -4,-2.2 3,-0.4 1,-0.2 6,-0.2 0.857 102.1 54.9 -62.6 -34.3 -29.5 2.7 1.4 269 270 A L H 3< S+ 0 0 25 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.759 111.3 44.1 -71.1 -23.1 -27.1 3.6 4.2 270 271 A Q H << S+ 0 0 100 -4,-0.7 -1,-0.2 -3,-0.5 -2,-0.2 0.530 84.4 120.9 -97.7 -7.3 -29.5 2.1 6.8 271 272 A H S >X S- 0 0 9 -4,-0.9 4,-3.0 -3,-0.4 3,-1.5 -0.322 73.3-122.2 -58.2 137.6 -30.3 -1.0 4.7 272 273 A P T 34 S+ 0 0 21 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 0.686 111.1 61.1 -59.7 -19.8 -29.3 -4.2 6.7 273 274 A W T 34 S+ 0 0 0 -27,-0.3 -26,-0.1 2,-0.1 -157,-0.1 0.840 117.0 32.3 -71.4 -32.9 -26.9 -5.3 4.0 274 275 A I T <4 S+ 0 0 9 -3,-1.5 -1,-0.1 -6,-0.2 -5,-0.1 0.859 137.7 22.5 -85.7 -41.7 -25.0 -2.1 4.6 275 276 A K S < S- 0 0 117 -4,-3.0 -1,-0.2 -5,-0.1 -2,-0.1 -0.788 86.5-145.4-130.5 81.5 -25.7 -1.7 8.4 276 277 A P - 0 0 34 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 -0.188 2.9-152.3 -54.1 139.1 -26.6 -5.2 9.8 277 278 A K S S+ 0 0 151 -5,-0.1 2,-0.3 1,-0.0 -4,-0.0 0.610 72.8 6.8 -90.3 -14.9 -29.2 -5.1 12.6 278 279 A D S > S- 0 0 74 -6,-0.1 4,-1.7 1,-0.1 5,-0.1 -0.893 84.1 -89.1-152.5-177.0 -28.0 -8.3 14.4 279 280 A T H > S+ 0 0 99 -2,-0.3 4,-2.1 2,-0.2 5,-0.1 0.853 119.0 56.2 -66.9 -41.5 -25.3 -11.0 14.5 280 281 A Q H > S+ 0 0 128 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.890 108.0 48.3 -62.0 -43.5 -27.1 -13.3 12.0 281 282 A Q H > S+ 0 0 40 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.918 111.5 49.4 -62.1 -45.9 -27.2 -10.5 9.4 282 283 A A H X S+ 0 0 33 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.844 110.5 52.8 -61.7 -34.0 -23.5 -9.8 9.9 283 284 A L H X S+ 0 0 108 -4,-2.1 4,-3.1 2,-0.2 -2,-0.2 0.919 106.4 50.1 -69.8 -47.3 -22.8 -13.5 9.6 284 285 A S H X S+ 0 0 52 -4,-2.3 4,-2.4 2,-0.2 -172,-0.2 0.943 112.0 49.1 -50.7 -52.7 -24.6 -14.0 6.2 285 286 A R H < S+ 0 0 21 -4,-2.0 -172,-1.0 1,-0.2 -173,-0.9 0.928 114.4 44.2 -56.6 -47.8 -22.7 -11.0 4.8 286 287 A K H < S+ 0 0 118 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.911 114.6 50.4 -63.8 -42.8 -19.4 -12.3 6.0 287 288 A A H < S+ 0 0 88 -4,-3.1 -1,-0.2 -5,-0.1 -2,-0.2 0.784 98.6 80.5 -66.7 -31.7 -20.2 -15.9 4.8 288 289 A S < - 0 0 18 -4,-2.4 -176,-2.1 -5,-0.2 -175,-0.4 -0.459 65.7-160.2 -80.8 154.2 -21.3 -14.7 1.3 289 290 A A B -J 111 0D 36 -47,-1.4 -178,-0.3 -178,-0.3 2,-0.1 -0.918 22.3-105.4-133.4 153.6 -18.7 -14.0 -1.4 290 291 A V - 0 0 12 -180,-3.3 2,-1.6 -2,-0.3 -180,-0.3 -0.451 43.1-109.0 -64.3 148.2 -18.4 -12.2 -4.7 291 292 A N > + 0 0 29 -81,-2.3 4,-3.3 1,-0.2 5,-0.2 -0.649 46.9 178.1 -79.6 85.6 -18.4 -14.4 -7.8 292 293 A M H > S+ 0 0 18 -2,-1.6 4,-3.2 2,-0.2 5,-0.2 0.841 71.2 54.4 -68.3 -39.1 -14.7 -13.8 -8.4 293 294 A E H > S+ 0 0 92 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.954 118.5 36.6 -57.4 -50.4 -14.2 -16.1 -11.4 294 295 A K H > S+ 0 0 32 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.898 116.0 54.4 -68.8 -41.9 -17.1 -14.3 -13.2 295 296 A F H X S+ 0 0 1 -4,-3.3 4,-2.2 1,-0.2 5,-0.2 0.942 104.5 53.6 -58.7 -49.8 -16.1 -10.9 -11.8 296 297 A K H X S+ 0 0 83 -4,-3.2 4,-1.1 1,-0.2 -1,-0.2 0.850 107.0 54.5 -51.7 -36.1 -12.5 -11.2 -13.1 297 298 A K H X S+ 0 0 138 -4,-1.1 4,-0.9 -5,-0.2 3,-0.3 0.917 106.6 50.1 -66.7 -42.3 -14.1 -11.9 -16.5 298 299 A F H >< S+ 0 0 22 -4,-1.9 3,-0.8 1,-0.2 -2,-0.2 0.907 107.4 52.6 -59.0 -44.8 -16.1 -8.6 -16.3 299 300 A A H 3< S+ 0 0 25 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.782 105.2 57.0 -67.6 -25.1 -13.2 -6.5 -15.4 300 301 A A H 3< 0 0 84 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.742 360.0 360.0 -73.9 -26.7 -11.3 -7.9 -18.4 301 302 A R << 0 0 157 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.784 360.0 360.0 -54.7 360.0 -14.0 -6.8 -20.8