==== 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 2W4J . COMPND 2 MOLECULE: DEATH-ASSOCIATED PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR I.DE DIEGO,J.KUPER,F.LEHMANN,M.WILMANNS . 276 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14128.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 63.4 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 15.9 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 6.2 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 . 76 27.5 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 1 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 0 120 0, 0.0 2,-0.3 0, 0.0 60,-0.1 0.000 360.0 360.0 360.0 157.8 31.5 33.1 -10.1 2 3 A V - 0 0 104 81,-0.0 2,-0.2 0, 0.0 3,-0.0 -0.812 360.0-146.9-111.9 159.6 28.2 35.0 -10.0 3 4 A F - 0 0 20 -2,-0.3 2,-0.2 1,-0.1 79,-0.2 -0.608 39.3 -59.2-119.4 177.5 25.0 33.9 -8.2 4 5 A R B -a 82 0A 86 77,-1.8 79,-2.7 -2,-0.2 4,-0.1 -0.366 43.5-170.0 -65.5 126.0 21.2 34.2 -8.8 5 6 A Q + 0 0 133 -2,-0.2 -1,-0.1 77,-0.2 77,-0.1 0.459 47.2 109.9-109.7 8.9 20.3 37.9 -8.8 6 7 A E S S- 0 0 88 1,-0.1 2,-0.4 2,-0.1 77,-0.3 -0.372 90.0 -84.0 -66.9 157.7 16.5 37.7 -8.8 7 8 A N > - 0 0 89 1,-0.2 3,-2.2 75,-0.1 4,-0.4 -0.548 32.0-143.4 -71.8 121.8 15.1 38.9 -5.5 8 9 A V G >> S+ 0 0 11 -2,-0.4 4,-1.9 1,-0.3 3,-1.7 0.825 98.8 68.0 -56.1 -29.6 15.2 35.9 -3.1 9 10 A D G 34 S+ 0 0 86 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.681 89.0 63.3 -67.9 -13.5 11.9 37.2 -1.7 10 11 A D G <4 S+ 0 0 96 -3,-2.2 -1,-0.3 1,-0.1 -2,-0.2 0.746 117.3 28.1 -75.0 -19.5 10.2 36.3 -5.0 11 12 A Y T <4 S+ 0 0 75 -3,-1.7 21,-2.7 -4,-0.4 22,-0.5 0.601 123.0 38.0-117.1 -19.8 11.0 32.6 -4.3 12 13 A Y E < -B 31 0A 3 -4,-1.9 2,-0.4 19,-0.3 19,-0.2 -0.946 57.7-145.6-136.2 150.2 11.2 32.3 -0.5 13 14 A D E -B 30 0A 83 17,-2.1 17,-2.4 -2,-0.3 2,-0.2 -0.971 24.1-144.5-110.1 137.5 9.4 33.5 2.6 14 15 A T E +B 29 0A 72 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.680 25.8 157.9-101.2 156.8 11.5 34.1 5.8 15 16 A G E + 0 0 50 13,-2.7 -1,-0.1 1,-0.4 14,-0.1 -0.112 46.4 21.9-137.4-124.8 10.6 33.5 9.4 16 17 A E E S- 0 0 128 11,-0.1 12,-3.2 1,-0.1 2,-0.5 -0.173 71.1-117.0 -57.1 142.5 12.4 32.9 12.7 17 18 A E E -B 27 0A 96 10,-0.2 10,-0.3 1,-0.2 -1,-0.1 -0.744 27.1-171.1 -80.3 122.8 16.0 34.0 13.0 18 19 A L E - 0 0 58 8,-2.4 2,-0.3 -2,-0.5 9,-0.2 0.705 55.4 -49.6 -90.7 -28.7 18.0 30.9 13.6 19 20 A G E -B 26 0A 22 7,-1.4 7,-3.2 2,-0.0 -1,-0.3 -0.960 49.9-150.5 174.5-178.3 21.4 32.5 14.5 20 21 A S E -B 25 0A 87 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.971 3.5-163.4-162.2 169.2 24.0 35.0 13.5 21 22 A G E > -B 24 0A 48 3,-2.5 3,-0.6 -2,-0.3 -2,-0.0 -0.786 54.2 -68.1-144.3-167.0 27.6 36.0 13.6 22 23 A Q T 3 S+ 0 0 172 1,-0.2 32,-0.1 -2,-0.2 3,-0.0 0.870 131.2 14.2 -60.0 -38.8 29.7 39.1 13.1 23 24 A F T 3 S+ 0 0 59 30,-0.1 21,-2.7 31,-0.0 2,-0.3 0.150 121.2 64.1-122.7 17.7 29.0 39.3 9.3 24 25 A A E < -BC 21 43A 22 -3,-0.6 -3,-2.5 19,-0.2 2,-0.4 -0.990 48.9-167.7-142.5 150.3 26.1 36.9 8.9 25 26 A V E -BC 20 42A 38 17,-1.9 17,-3.2 -2,-0.3 2,-0.5 -0.996 14.3-152.4-136.8 140.2 22.5 36.4 9.9 26 27 A V E -BC 19 41A 29 -7,-3.2 -8,-2.4 -2,-0.4 -7,-1.4 -0.962 13.5-175.2-119.9 124.9 20.6 33.1 9.3 27 28 A K E -BC 17 40A 54 13,-2.5 13,-3.2 -2,-0.5 -10,-0.2 -0.949 28.9-117.4-120.3 137.2 16.8 33.0 8.9 28 29 A K E - C 0 39A 56 -12,-3.2 -13,-2.7 -2,-0.4 2,-0.3 -0.502 44.6-179.0 -64.1 142.6 14.5 30.1 8.6 29 30 A C E -BC 14 38A 4 9,-2.5 9,-2.3 -15,-0.3 2,-0.4 -0.954 25.3-142.5-146.6 162.4 12.8 30.2 5.2 30 31 A R E -BC 13 37A 115 -17,-2.4 -17,-2.1 -2,-0.3 2,-0.5 -0.993 21.0-129.7-129.9 126.4 10.3 28.3 3.0 31 32 A E E >> -B 12 0A 21 5,-3.0 4,-2.6 -2,-0.4 3,-0.9 -0.644 14.6-146.0 -76.7 127.0 10.5 27.9 -0.7 32 33 A K T 34 S+ 0 0 98 -21,-2.7 -1,-0.2 -2,-0.5 -20,-0.1 0.839 93.7 53.9 -61.5 -36.6 7.3 28.9 -2.3 33 34 A S T 34 S+ 0 0 95 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.646 126.3 16.7 -76.1 -19.1 7.4 26.3 -5.1 34 35 A T T <4 S- 0 0 76 -3,-0.9 -2,-0.2 2,-0.2 -1,-0.2 0.537 88.0-125.9-127.6 -18.0 7.8 23.3 -2.8 35 36 A G < + 0 0 27 -4,-2.6 2,-0.2 1,-0.3 -3,-0.1 0.454 63.5 142.3 75.4 -0.1 6.9 24.2 0.8 36 37 A L - 0 0 95 -5,-0.3 -5,-3.0 -6,-0.1 2,-0.3 -0.490 45.2-130.2 -78.1 149.0 10.3 22.9 1.8 37 38 A Q E +C 30 0A 105 -7,-0.2 57,-0.6 -2,-0.2 2,-0.2 -0.745 29.2 165.6-107.0 145.9 12.2 24.7 4.5 38 39 A Y E -CD 29 93A 30 -9,-2.3 -9,-2.5 -2,-0.3 2,-0.5 -0.802 39.1-106.3-141.6 173.7 15.8 25.8 4.6 39 40 A A E -CD 28 92A 9 53,-2.8 53,-3.1 -2,-0.2 2,-0.7 -0.977 30.0-152.6-113.0 114.0 18.2 28.1 6.5 40 41 A A E -CD 27 91A 2 -13,-3.2 -13,-2.5 -2,-0.5 2,-0.7 -0.814 7.4-161.7 -90.4 110.6 19.0 31.3 4.6 41 42 A K E -CD 26 90A 21 49,-3.1 49,-2.8 -2,-0.7 2,-0.6 -0.858 2.9-160.7 -97.8 109.1 22.4 32.5 5.6 42 43 A F E -CD 25 89A 36 -17,-3.2 -17,-1.9 -2,-0.7 2,-0.5 -0.847 6.8-165.5 -92.0 116.3 22.8 36.2 4.6 43 44 A I E -CD 24 88A 5 45,-3.1 45,-2.3 -2,-0.6 2,-0.3 -0.921 20.2-124.0-108.6 124.6 26.5 37.2 4.4 44 45 A K E - D 0 87A 84 -21,-2.7 11,-2.8 -2,-0.5 43,-0.2 -0.460 25.1-136.2 -72.4 125.0 27.4 40.8 4.3 45 46 A K B -f 55 0B 40 41,-2.8 2,-0.2 -2,-0.3 11,-0.2 -0.462 21.6-104.0 -75.2 151.8 29.5 41.8 1.3 46 47 A R - 0 0 86 9,-1.3 8,-0.1 -2,-0.2 -1,-0.1 -0.582 20.9-152.2 -67.6 137.9 32.5 44.2 1.5 47 48 A R S S+ 0 0 96 6,-0.2 2,-0.2 -2,-0.2 -1,-0.1 0.581 77.3 11.1 -90.8 -19.0 31.7 47.7 0.2 48 49 A T S S- 0 0 83 5,-0.2 -2,-0.0 1,-0.1 5,-0.0 -0.828 79.7-107.5-141.4 176.3 35.4 48.5 -0.9 49 50 A K S S+ 0 0 207 -2,-0.2 -1,-0.1 1,-0.1 7,-0.0 0.890 116.3 46.0 -72.3 -41.2 38.7 46.5 -1.3 50 51 A S S S+ 0 0 107 -3,-0.0 -1,-0.1 2,-0.0 -4,-0.0 0.493 88.7 116.1 -85.7 -2.1 40.4 47.9 1.7 51 52 A S - 0 0 12 1,-0.1 -5,-0.1 2,-0.1 5,-0.1 -0.283 50.1-162.1 -68.9 149.7 37.4 47.6 4.0 52 53 A R + 0 0 171 3,-0.0 2,-0.3 4,-0.0 -1,-0.1 0.376 69.5 93.2-101.0 -6.6 37.5 45.3 7.1 53 54 A R S S+ 0 0 169 2,-0.1 -6,-0.2 -8,-0.0 -5,-0.2 -0.650 84.4 8.2 -88.7 145.8 33.7 45.4 7.3 54 55 A G S S- 0 0 3 -2,-0.3 2,-0.4 -8,-0.1 -9,-0.2 -0.076 96.1 -67.9 75.3-177.6 31.8 42.5 5.5 55 56 A V B -f 45 0B 29 -11,-2.8 -9,-1.3 -32,-0.2 -2,-0.1 -0.918 48.9-111.1-114.4 134.1 33.3 39.4 4.0 56 57 A S > - 0 0 23 -2,-0.4 4,-2.3 -11,-0.2 5,-0.2 -0.238 23.4-120.6 -58.2 151.6 35.5 39.4 0.8 57 58 A R H > S+ 0 0 97 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.897 114.6 56.6 -63.0 -37.7 34.1 38.0 -2.3 58 59 A E H > S+ 0 0 123 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.907 108.9 46.6 -56.6 -46.0 37.0 35.5 -2.3 59 60 A D H > S+ 0 0 60 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.865 112.1 49.6 -69.4 -37.2 36.0 34.3 1.1 60 61 A I H X S+ 0 0 2 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.942 111.4 49.1 -63.4 -45.6 32.3 34.0 0.3 61 62 A E H X S+ 0 0 41 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.826 106.0 56.4 -67.1 -30.3 33.0 32.1 -2.8 62 63 A R H X S+ 0 0 46 -4,-1.7 4,-2.5 2,-0.2 5,-0.2 0.940 108.9 47.4 -64.4 -45.0 35.4 29.7 -1.0 63 64 A E H X S+ 0 0 13 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.926 113.9 47.5 -58.2 -48.3 32.5 28.8 1.5 64 65 A V H X S+ 0 0 4 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.928 111.3 50.8 -59.1 -46.1 30.1 28.4 -1.4 65 66 A S H X S+ 0 0 66 -4,-2.6 4,-1.0 2,-0.2 -2,-0.2 0.892 112.6 45.7 -61.5 -43.5 32.6 26.2 -3.4 66 67 A I H >X S+ 0 0 3 -4,-2.5 4,-0.9 1,-0.2 3,-0.9 0.951 112.1 51.4 -66.4 -45.7 33.2 23.9 -0.4 67 68 A L H >< S+ 0 0 2 -4,-2.5 3,-0.8 1,-0.3 11,-0.5 0.899 104.7 56.5 -57.7 -42.4 29.5 23.6 0.4 68 69 A K H 3< S+ 0 0 129 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.802 105.2 54.4 -60.9 -27.6 28.7 22.7 -3.2 69 70 A E H << S+ 0 0 70 -4,-1.0 2,-0.3 -3,-0.9 -1,-0.2 0.754 93.9 87.9 -73.7 -25.0 31.2 19.7 -2.9 70 71 A I << + 0 0 4 -4,-0.9 8,-0.3 -3,-0.8 2,-0.2 -0.529 34.3 155.0-101.0 138.7 29.7 18.1 0.2 71 72 A Q + 0 0 143 -2,-0.3 5,-0.1 6,-0.1 6,-0.1 -0.746 27.6 124.5-154.5 105.6 27.0 15.5 0.7 72 73 A H > - 0 0 43 3,-0.4 3,-1.7 -2,-0.2 53,-0.0 -0.957 65.8-111.6-159.6 147.3 27.1 13.4 3.9 73 74 A P T 3 S+ 0 0 93 0, 0.0 52,-0.1 0, 0.0 48,-0.0 0.738 115.4 50.8 -57.6 -25.6 24.5 12.8 6.7 74 75 A N T 3 S+ 0 0 19 83,-0.1 84,-2.7 47,-0.1 2,-0.3 0.199 105.3 60.3-104.4 18.9 26.7 14.7 9.2 75 76 A V B < S-g 158 0C 0 -3,-1.7 -3,-0.4 82,-0.3 84,-0.2 -0.973 83.3-113.2-135.2 149.5 27.3 17.9 7.2 76 77 A I - 0 0 4 82,-1.8 2,-0.2 -2,-0.3 -6,-0.1 -0.461 29.7-141.6 -74.3 153.7 24.8 20.4 5.8 77 78 A T - 0 0 20 -2,-0.1 16,-2.6 -6,-0.1 2,-0.5 -0.664 11.9-115.3-111.4 166.5 24.3 20.8 2.1 78 79 A L E + E 0 92A 30 -11,-0.5 14,-0.2 -8,-0.3 3,-0.1 -0.937 24.3 178.8-103.2 129.0 23.8 23.8 -0.1 79 80 A H E - 0 0 77 12,-3.0 2,-0.3 -2,-0.5 13,-0.2 0.894 63.9 -24.8 -91.3 -51.3 20.5 24.2 -2.0 80 81 A E E - E 0 91A 36 11,-1.2 11,-3.1 2,-0.0 2,-0.4 -0.968 50.8-138.5-158.1 162.5 20.9 27.5 -3.8 81 82 A V E + E 0 90A 12 -2,-0.3 -77,-1.8 9,-0.2 2,-0.3 -0.995 18.9 177.1-133.1 135.1 22.7 30.8 -3.7 82 83 A Y E -aE 4 89A 1 7,-2.6 7,-3.4 -2,-0.4 2,-0.3 -0.809 7.0-168.7-119.8 166.6 21.3 34.3 -4.4 83 84 A E E + E 0 88A 7 -79,-2.7 2,-0.3 -2,-0.3 5,-0.2 -0.996 12.6 175.7-154.2 156.6 23.0 37.7 -4.2 84 85 A N - 0 0 71 3,-2.5 -78,-0.0 -2,-0.3 -81,-0.0 -0.816 56.5 -76.6-141.8-172.1 22.3 41.3 -4.3 85 86 A K S S+ 0 0 195 -2,-0.3 3,-0.1 1,-0.2 -40,-0.0 0.790 127.7 33.3 -64.8 -25.9 24.4 44.4 -3.8 86 87 A T S S+ 0 0 82 1,-0.2 -41,-2.8 -42,-0.1 2,-0.3 0.811 121.1 22.2 -98.4 -29.7 24.6 44.1 -0.0 87 88 A D E -D 44 0A 16 -43,-0.2 -3,-2.5 2,-0.0 2,-0.4 -0.942 53.6-137.6-137.9 151.7 24.5 40.3 0.7 88 89 A V E -DE 43 83A 0 -45,-2.3 -45,-3.1 -2,-0.3 2,-0.6 -0.946 30.0-151.7 -99.2 138.9 25.2 36.8 -0.7 89 90 A I E -DE 42 82A 2 -7,-3.4 -7,-2.6 -2,-0.4 2,-0.6 -0.924 7.4-164.2-122.3 107.9 22.3 34.6 0.5 90 91 A L E -DE 41 81A 0 -49,-2.8 -49,-3.1 -2,-0.6 2,-1.0 -0.819 10.8-149.2 -94.5 121.1 23.2 30.9 0.9 91 92 A I E -DE 40 80A 0 -11,-3.1 -12,-3.0 -2,-0.6 -11,-1.2 -0.816 30.8-176.7 -91.8 104.3 20.1 28.6 1.0 92 93 A L E -DE 39 78A 13 -53,-3.1 -53,-2.8 -2,-1.0 -14,-0.2 -0.663 36.0 -86.1-103.3 155.0 21.3 25.8 3.3 93 94 A E E -D 38 0A 58 -16,-2.6 2,-0.3 -2,-0.2 -55,-0.2 -0.370 53.1-118.1 -52.3 130.9 19.8 22.6 4.6 94 95 A L - 0 0 36 -57,-0.6 2,-0.5 -65,-0.1 -1,-0.1 -0.576 23.4-166.2 -77.0 133.4 17.8 23.5 7.7 95 96 A V - 0 0 10 -2,-0.3 3,-0.5 1,-0.1 51,-0.1 -0.979 10.4-174.5-119.7 109.4 19.0 21.9 11.0 96 97 A A + 0 0 71 -2,-0.5 51,-0.2 51,-0.4 53,-0.1 0.391 60.4 76.2 -96.9 0.7 16.0 22.5 13.3 97 98 A G S S- 0 0 9 49,-2.4 -1,-0.2 1,-0.3 50,-0.2 0.225 94.5-115.4-102.9 13.9 17.1 21.3 16.7 98 99 A G - 0 0 31 -3,-0.5 48,-3.1 48,-0.2 -1,-0.3 -0.007 45.6 -42.9 79.4 172.4 19.4 24.1 17.7 99 100 A E B > -H 145 0C 42 46,-0.2 4,-2.1 1,-0.1 3,-0.3 -0.425 41.1-126.7 -73.5 148.8 23.1 24.3 18.4 100 101 A L H > S+ 0 0 0 44,-3.1 4,-2.6 41,-0.8 5,-0.2 0.878 112.9 63.3 -54.6 -40.2 25.0 21.7 20.4 101 102 A F H > S+ 0 0 114 40,-1.3 4,-1.5 43,-0.4 -1,-0.2 0.894 106.2 42.1 -50.2 -49.7 26.2 24.7 22.5 102 103 A D H > S+ 0 0 64 -3,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.870 111.9 54.6 -72.9 -35.2 22.6 25.4 23.6 103 104 A F H X S+ 0 0 7 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.917 109.5 47.0 -59.2 -48.6 21.8 21.7 24.2 104 105 A L H < S+ 0 0 42 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.856 110.8 52.7 -68.0 -31.8 24.8 21.3 26.5 105 106 A A H < S+ 0 0 76 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.843 115.6 40.1 -64.1 -38.5 23.8 24.5 28.4 106 107 A E H < S+ 0 0 123 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.808 107.2 71.8 -85.4 -35.3 20.3 23.3 29.0 107 108 A K S < S- 0 0 62 -4,-2.3 3,-0.1 -5,-0.2 0, 0.0 -0.421 83.9-105.5 -86.5 155.6 20.9 19.7 29.7 108 109 A E - 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0 0 18 -2,-0.3 -40,-0.1 1,-0.2 5,-0.0 0.197 51.2 -26.3 -96.9-134.1 39.0 31.2 15.0 179 180 A T >> - 0 0 39 1,-0.1 3,-2.2 2,-0.0 4,-1.2 -0.725 54.5-131.3 -90.2 126.4 37.9 31.2 18.6 180 181 A P T 34 S+ 0 0 22 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.810 102.6 56.1 -46.9 -44.6 40.7 31.1 21.2 181 182 A E T 34 S+ 0 0 53 1,-0.2 35,-0.3 37,-0.0 36,-0.1 0.746 117.9 33.9 -65.4 -18.9 39.3 28.2 23.3 182 183 A F T <4 S+ 0 0 21 -3,-2.2 -1,-0.2 2,-0.1 2,-0.2 0.498 91.6 104.7-111.2 -14.9 39.1 25.9 20.3 183 184 A V < - 0 0 5 -4,-1.2 15,-0.1 -3,-0.5 -45,-0.0 -0.518 67.2-119.1 -79.4 145.5 42.1 26.8 18.1 184 185 A A >> - 0 0 0 -2,-0.2 4,-2.0 1,-0.1 3,-1.1 -0.311 29.9-104.4 -72.7 161.4 45.2 24.6 17.8 185 186 A P H 3> S+ 0 0 1 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.856 120.3 60.8 -55.7 -36.1 48.7 25.8 18.8 186 187 A E H 34>S+ 0 0 5 1,-0.2 5,-2.9 2,-0.2 4,-0.1 0.840 105.2 48.4 -63.1 -33.2 49.6 26.2 15.2 187 188 A I H X45S+ 0 0 5 -3,-1.1 3,-1.5 3,-0.2 -1,-0.2 0.939 111.4 49.6 -66.4 -48.0 46.8 28.7 14.7 188 189 A V H 3<5S+ 0 0 21 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.866 114.6 45.4 -56.7 -38.1 47.9 30.6 17.8 189 190 A N T 3<5S- 0 0 69 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.356 111.1-120.3 -93.0 4.9 51.5 30.7 16.5 190 191 A Y T < 5 + 0 0 164 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.880 60.7 148.8 60.0 39.4 50.5 31.7 13.0 191 192 A E < - 0 0 99 -5,-2.9 -1,-0.2 -6,-0.1 -19,-0.1 -0.588 58.3 -73.9 -95.4 163.0 52.0 28.6 11.4 192 193 A P - 0 0 66 0, 0.0 2,-0.4 0, 0.0 -19,-0.2 -0.337 57.0-144.1 -54.4 140.7 50.9 26.8 8.2 193 194 A L B +K 172 0E 5 -21,-2.5 -21,-2.5 -3,-0.1 2,-0.2 -0.887 25.3 162.5-116.3 147.1 47.8 24.8 8.9 194 195 A G > - 0 0 1 -2,-0.4 3,-1.5 -23,-0.2 4,-0.4 -0.621 58.7 -60.3-140.5-159.1 46.4 21.5 7.8 195 196 A L T >> S+ 0 0 31 1,-0.3 4,-0.8 -25,-0.3 3,-0.8 0.735 117.8 74.4 -61.6 -24.5 43.9 18.9 8.7 196 197 A E H >> S+ 0 0 68 1,-0.2 4,-1.6 2,-0.2 3,-0.5 0.809 81.6 67.6 -62.2 -28.4 45.5 18.3 12.0 197 198 A A H <> S+ 0 0 2 -3,-1.5 4,-1.9 1,-0.3 -1,-0.2 0.900 97.3 53.8 -61.4 -35.0 44.1 21.6 13.5 198 199 A D H <> S+ 0 0 0 -3,-0.8 4,-2.1 -4,-0.4 -1,-0.3 0.843 102.8 57.5 -65.5 -34.0 40.6 20.1 13.3 199 200 A M H - 0 0 28 -2,-0.3 3,-0.5 1,-0.1 -9,-0.1 -0.860 18.5-143.3-101.0 125.8 36.7 24.1 28.7 215 216 A P T 3 S+ 0 0 16 0, 0.0 19,-0.3 0, 0.0 -1,-0.1 0.760 92.0 25.1 -65.7 -32.2 40.3 22.8 29.0 216 217 A F T 3 S+ 0 0 1 -35,-0.3 11,-0.2 17,-0.1 12,-0.2 0.440 83.6 134.4-112.0 -2.6 42.3 26.0 28.0 217 218 A L < + 0 0 94 -3,-0.5 2,-0.2 -36,-0.1 4,-0.1 -0.308 29.3 179.9 -63.5 123.9 39.8 28.8 28.9 218 219 A G - 0 0 15 2,-0.4 -1,-0.1 -2,-0.1 6,-0.1 -0.438 45.7 -92.3-108.1-173.6 41.4 31.6 30.8 219 220 A D S S+ 0 0 150 -2,-0.2 2,-0.3 2,-0.0 -2,-0.1 0.693 110.0 25.6 -75.7 -18.1 40.0 34.9 32.1 220 221 A T S > S- 0 0 50 1,-0.1 4,-2.3 0, 0.0 -2,-0.4 -0.938 87.1-108.1-137.3 163.4 40.9 36.7 28.9 221 222 A K H > S+ 0 0 156 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.874 119.0 55.1 -62.7 -36.2 41.4 35.7 25.3 222 223 A Q H > S+ 0 0 137 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.890 107.4 49.6 -65.6 -37.1 45.2 36.3 25.7 223 224 A E H > S+ 0 0 86 -3,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.919 110.2 50.7 -64.8 -45.7 45.3 33.9 28.6 224 225 A T H X S+ 0 0 3 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.943 111.8 47.8 -54.8 -46.5 43.3 31.3 26.7 225 226 A L H X S+ 0 0 37 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.899 110.8 50.0 -65.4 -41.3 45.7 31.6 23.8 226 227 A A H X S+ 0 0 60 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.902 110.7 51.0 -61.3 -40.3 48.8 31.4 26.0 227 228 A N H <>S+ 0 0 37 -4,-2.6 5,-2.8 -11,-0.2 4,-0.3 0.893 109.5 49.8 -62.9 -43.3 47.3 28.3 27.6 228 229 A V H ><5S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.946 110.8 49.1 -58.8 -49.6 46.7 26.7 24.2 229 230 A S H 3<5S+ 0 0 21 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.865 115.8 42.7 -64.0 -35.9 50.2 27.3 23.0 230 231 A A T 3<5S- 0 0 70 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.397 108.5-123.0 -83.1 -4.2 51.8 25.9 26.2 231 232 A V T < 5 + 0 0 40 -3,-1.5 2,-1.4 -4,-0.3 -3,-0.2 0.908 46.4 174.4 53.5 48.5 49.3 22.9 26.2 232 233 A N < + 0 0 95 -5,-2.8 2,-0.3 -6,-0.1 -1,-0.2 -0.668 26.0 111.8 -88.8 86.0 48.3 24.1 29.7 233 234 A Y - 0 0 47 -2,-1.4 2,-0.3 -3,-0.2 -17,-0.1 -0.976 35.9-177.8-148.7 160.6 45.4 21.8 30.6 234 235 A E - 0 0 116 -2,-0.3 2,-0.9 -19,-0.3 -2,-0.0 -0.970 35.8-105.2-151.8 161.9 44.7 19.0 33.0 235 236 A F - 0 0 34 -2,-0.3 2,-0.2 5,-0.0 5,-0.0 -0.795 37.8-142.2 -90.8 106.7 41.9 16.6 33.9 236 237 A E >> - 0 0 81 -2,-0.9 4,-2.4 1,-0.2 3,-1.3 -0.455 5.7-139.8 -72.2 129.9 40.3 17.9 37.1 237 238 A D H 3> S+ 0 0 121 1,-0.3 4,-1.9 -2,-0.2 -1,-0.2 0.865 100.1 63.2 -57.5 -37.2 39.3 15.0 39.4 238 239 A E H 34 S+ 0 0 168 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.826 116.8 29.0 -56.4 -32.8 36.1 16.9 40.4 239 240 A Y H <4 S+ 0 0 118 -3,-1.3 -2,-0.2 1,-0.1 -1,-0.2 0.719 129.1 36.6 -99.5 -25.1 35.0 16.6 36.8 240 241 A F H >< S+ 0 0 0 -4,-2.4 3,-2.1 1,-0.1 -3,-0.2 0.358 77.6 108.5-113.0 3.9 36.6 13.5 35.5 241 242 A S T 3< S+ 0 0 80 -4,-1.9 -1,-0.1 1,-0.3 -3,-0.1 0.786 90.6 36.7 -58.3 -31.0 36.5 11.1 38.5 242 243 A N T 3 S+ 0 0 158 -3,-0.2 2,-0.4 -5,-0.1 -1,-0.3 0.140 96.7 102.9-109.3 24.9 33.8 8.9 36.9 243 244 A T S < S- 0 0 23 -3,-2.1 -3,-0.1 1,-0.1 -132,-0.0 -0.800 78.4-107.6 -99.1 140.7 35.2 9.2 33.4 244 245 A S > - 0 0 42 -2,-0.4 4,-1.7 1,-0.1 3,-0.3 -0.283 14.8-123.7 -68.5 155.4 37.2 6.2 32.0 245 246 A A H > S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 -1,-0.1 0.841 111.8 58.9 -62.8 -35.2 40.9 6.3 31.5 246 247 A L H > S+ 0 0 71 1,-0.2 4,-2.3 2,-0.2 27,-0.2 0.872 102.3 52.7 -65.3 -35.6 40.4 5.4 27.9 247 248 A A H > S+ 0 0 0 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.913 110.7 47.5 -62.7 -45.8 38.3 8.5 27.3 248 249 A K H X S+ 0 0 44 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.895 109.3 54.6 -61.9 -38.7 41.2 10.6 28.9 249 250 A D H X S+ 0 0 29 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.939 105.5 53.0 -60.0 -43.0 43.7 8.7 26.6 250 251 A F H X S+ 0 0 0 -4,-2.3 4,-0.6 1,-0.2 3,-0.2 0.936 113.0 43.2 -55.7 -50.9 41.6 9.7 23.6 251 252 A I H >X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 3,-1.6 0.936 110.3 56.3 -61.1 -45.7 41.8 13.4 24.6 252 253 A R H 3< S+ 0 0 116 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.828 104.5 52.4 -58.8 -32.5 45.4 13.2 25.5 253 254 A R H 3< S+ 0 0 128 -4,-1.8 10,-2.2 -3,-0.2 -1,-0.3 0.590 113.5 44.1 -85.0 -4.6 46.4 11.9 22.0 254 255 A L H << S+ 0 0 0 -3,-1.6 2,-1.8 -4,-0.6 -2,-0.2 0.741 100.3 67.2-100.1 -39.3 44.5 14.9 20.3 255 256 A L S < S+ 0 0 5 -4,-2.4 2,-0.4 -52,-0.1 -1,-0.1 -0.446 73.8 132.6 -85.7 61.9 45.7 17.7 22.6 256 257 A V - 0 0 36 -2,-1.8 6,-0.1 -3,-0.2 -56,-0.1 -0.968 53.8-145.5-118.1 125.8 49.3 17.4 21.3 257 258 A K S S+ 0 0 102 -2,-0.4 -71,-0.2 -72,-0.1 -1,-0.1 0.910 84.5 72.4 -62.6 -46.0 51.3 20.4 20.2 258 259 A D S >> S- 0 0 67 1,-0.2 3,-1.5 2,-0.1 4,-0.8 -0.609 72.8-153.9 -75.8 111.5 53.2 18.8 17.4 259 260 A P G >4 S+ 0 0 35 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.808 92.2 61.8 -58.7 -26.9 50.6 18.3 14.6 260 261 A K G 34 S+ 0 0 182 1,-0.2 4,-0.1 -3,-0.1 -2,-0.1 0.751 107.0 43.8 -68.6 -23.2 52.7 15.3 13.3 261 262 A K G <4 S+ 0 0 164 -3,-1.5 -1,-0.2 2,-0.1 2,-0.1 0.522 93.3 102.2 -98.2 -8.8 52.3 13.4 16.6 262 263 A R S << S- 0 0 8 -4,-0.8 -8,-0.2 -3,-0.5 -9,-0.1 -0.430 84.5 -94.9 -73.8 147.5 48.6 14.2 17.0 263 264 A M - 0 0 16 -10,-2.2 -1,-0.1 -13,-0.2 2,-0.1 -0.380 37.7-137.9 -59.8 139.1 46.0 11.5 16.1 264 265 A T > - 0 0 68 -4,-0.1 4,-2.2 -3,-0.1 5,-0.2 -0.354 30.8 -98.3 -81.8 171.6 44.6 11.8 12.6 265 266 A I H > S+ 0 0 12 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.928 127.2 51.5 -61.3 -39.8 40.9 11.3 11.9 266 267 A Q H > S+ 0 0 114 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.925 108.7 50.7 -60.3 -43.6 41.6 7.7 10.9 267 268 A D H > S+ 0 0 80 1,-0.2 4,-1.1 2,-0.2 3,-0.3 0.889 107.0 55.3 -58.8 -42.0 43.4 7.1 14.2 268 269 A S H < S+ 0 0 0 -4,-2.2 3,-0.3 1,-0.2 -1,-0.2 0.878 106.7 49.4 -62.5 -36.6 40.5 8.6 16.1 269 270 A L H < S+ 0 0 32 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.754 114.5 45.0 -75.5 -24.2 38.1 6.1 14.5 270 271 A Q H < S+ 0 0 108 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.516 83.9 118.8 -95.6 -5.3 40.4 3.1 15.4 271 272 A H S >X S- 0 0 10 -4,-1.1 4,-3.0 -3,-0.3 3,-1.8 -0.324 76.3-118.5 -62.8 142.6 41.1 4.3 18.9 272 273 A P T 34 S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -26,-0.1 0.739 111.8 59.8 -62.1 -21.6 39.9 1.7 21.4 273 274 A W T 34 S+ 0 0 30 -27,-0.2 -26,-0.1 1,-0.1 -2,-0.1 0.805 121.1 25.7 -69.1 -27.6 37.5 4.1 23.1 274 275 A I T <4 S+ 0 0 9 -3,-1.8 -1,-0.1 -6,-0.2 -5,-0.1 0.793 99.2 93.5-103.7 -42.6 35.7 4.5 19.7 275 276 A K < 0 0 109 -4,-3.0 -5,-0.1 -7,-0.1 -6,-0.0 -0.362 360.0 360.0 -63.8 133.4 36.3 1.3 17.7 276 277 A P 0 0 166 0, 0.0 -1,-0.1 0, 0.0 -6,-0.0 0.889 360.0 360.0 -73.9 360.0 33.7 -1.4 18.0