==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-NOV-09 3KK9 . COMPND 2 MOLECULE: CALCIUM/CALMODULIN DEPENDENT PROTEIN KINASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS; . AUTHOR J.KURIYAN,L.H.CHAO,P.PELLICENA,S.DEINDL,L.A.BARCLAY,H.SCHULM . 276 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14477.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 17.0 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 . 3 1.1 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 . 1 0.4 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 . 26 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 28.6 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 4 0 0 0 1 0 2 0 0 0 0 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 1 1 0 0 1 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 0 2 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 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 7 A T 0 0 126 0, 0.0 4,-0.1 0, 0.0 74,-0.1 0.000 360.0 360.0 360.0-116.5 -22.8 -12.6 -48.5 2 8 A K >> - 0 0 124 72,-0.2 3,-3.8 1,-0.1 4,-0.7 0.923 360.0-171.1 48.3 56.9 -25.4 -15.4 -48.7 3 9 A F H >> S+ 0 0 2 1,-0.3 4,-2.1 2,-0.2 3,-1.2 0.827 85.3 69.1 -33.5 -40.8 -24.3 -17.4 -45.7 4 10 A S H 34 S+ 0 0 59 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.747 93.1 57.6 -56.4 -25.6 -26.8 -19.9 -47.1 5 11 A D H <4 S+ 0 0 83 -3,-3.8 -1,-0.3 1,-0.2 -2,-0.2 0.766 119.4 26.1 -79.1 -28.4 -24.5 -20.4 -50.1 6 12 A N H << S+ 0 0 65 -3,-1.2 21,-1.9 -4,-0.7 2,-0.5 0.463 117.1 64.7-113.4 -6.5 -21.5 -21.5 -48.0 7 13 A Y E < -A 26 0A 14 -4,-2.1 2,-0.6 19,-0.2 19,-0.2 -0.961 58.4-157.3-130.3 119.3 -23.3 -22.9 -45.0 8 14 A D E -A 25 0A 68 17,-3.4 17,-3.3 -2,-0.5 2,-0.4 -0.822 27.7-139.3 -83.9 123.0 -25.7 -25.9 -44.6 9 15 A V E +A 24 0A 66 -2,-0.6 15,-0.3 15,-0.2 2,-0.1 -0.700 26.6 173.9 -88.9 135.5 -27.7 -25.2 -41.4 10 16 A K E - 0 0 83 13,-4.0 -1,-0.1 -2,-0.4 14,-0.1 0.021 40.6 -23.4-112.4-137.2 -28.4 -28.1 -39.1 11 17 A E E - 0 0 95 11,-0.1 12,-3.4 1,-0.1 2,-0.4 -0.176 65.9 -94.5 -81.7 168.4 -30.1 -28.4 -35.7 12 18 A E E -A 22 0A 88 10,-0.3 10,-0.3 1,-0.1 -1,-0.1 -0.672 27.4-174.9 -84.7 128.1 -30.6 -25.8 -32.9 13 19 A L E - 0 0 73 8,-2.9 2,-0.3 -2,-0.4 9,-0.2 0.486 63.9 -58.1 -97.6 -6.3 -27.9 -25.7 -30.1 14 20 A G E -A 21 0A 27 7,-1.2 7,-2.8 2,-0.0 -1,-0.4 -0.871 51.7-122.2 148.5 178.8 -29.8 -23.1 -28.1 15 21 A K E -A 20 0A 165 5,-0.3 5,-0.3 -2,-0.3 2,-0.2 -0.986 15.5-179.8-154.7 157.8 -31.1 -19.6 -28.1 16 22 A G E > -A 19 0A 46 3,-3.0 3,-1.6 -2,-0.3 2,-0.1 -0.727 55.8 -39.1-140.0-168.1 -31.1 -16.1 -26.5 17 23 A A T 3 S- 0 0 66 1,-0.3 -1,-0.1 -2,-0.2 3,-0.0 -0.376 126.8 -12.4 -59.8 136.7 -32.7 -12.8 -27.0 18 24 A F T 3 S+ 0 0 89 20,-0.1 21,-2.2 1,-0.1 2,-0.3 0.704 128.1 85.9 40.8 28.6 -33.2 -12.0 -30.7 19 25 A S E < -AB 16 38A 24 -3,-1.6 -3,-3.0 19,-0.2 2,-0.4 -0.996 51.9-170.3-157.3 147.2 -30.8 -14.9 -31.4 20 26 A V E -AB 15 37A 35 17,-2.1 17,-2.7 -2,-0.3 2,-0.6 -0.999 16.5-144.9-135.6 137.5 -30.5 -18.6 -32.0 21 27 A V E +AB 14 36A 42 -7,-2.8 -8,-2.9 -2,-0.4 -7,-1.2 -0.907 26.4 173.9-100.8 125.6 -27.4 -20.7 -32.2 22 28 A R E -AB 12 35A 81 13,-1.9 13,-2.8 -2,-0.6 -10,-0.3 -0.932 35.0-106.7-127.5 154.0 -27.6 -23.6 -34.6 23 29 A R E + B 0 34A 51 -12,-3.4 -13,-4.0 -2,-0.3 2,-0.3 -0.567 44.4 178.2 -75.9 141.7 -25.1 -26.2 -35.9 24 30 A C E -AB 9 33A 0 9,-2.7 9,-2.9 -15,-0.3 2,-0.4 -0.996 19.9-145.8-149.0 151.9 -24.0 -25.6 -39.4 25 31 A V E -AB 8 32A 27 -17,-3.3 -17,-3.4 -2,-0.3 2,-0.3 -0.892 22.0-119.8-118.6 144.8 -21.6 -27.0 -42.0 26 32 A H E -A 7 0A 37 5,-2.5 -19,-0.2 -2,-0.4 -20,-0.1 -0.618 21.8-141.1 -79.8 146.4 -19.5 -25.4 -44.7 27 33 A K S S+ 0 0 97 -21,-1.9 -1,-0.1 -2,-0.3 -21,-0.1 0.971 89.2 34.0 -75.8 -58.4 -20.3 -26.5 -48.2 28 34 A T S S+ 0 0 118 -22,-0.2 -1,-0.1 1,-0.1 -21,-0.0 0.879 134.2 25.0 -73.0 -39.0 -17.1 -26.7 -50.1 29 35 A T S S- 0 0 89 2,-0.1 -2,-0.1 0, 0.0 -1,-0.1 0.900 93.1-135.6 -88.9 -50.9 -14.8 -27.9 -47.3 30 36 A G + 0 0 41 1,-0.2 -3,-0.1 -4,-0.0 -2,-0.0 0.569 43.6 160.7 101.9 14.7 -17.4 -29.5 -45.0 31 37 A L - 0 0 103 -6,-0.1 -5,-2.5 1,-0.1 2,-0.4 -0.212 36.3-119.1 -66.8 160.9 -16.1 -28.0 -41.8 32 38 A E E +B 25 0A 90 -7,-0.2 53,-0.6 53,-0.1 2,-0.3 -0.877 34.7 170.6-113.5 133.2 -18.3 -27.8 -38.7 33 39 A F E -BC 24 84A 22 -9,-2.9 -9,-2.7 -2,-0.4 2,-0.7 -0.987 37.1-130.1-143.6 147.3 -19.4 -24.6 -36.9 34 40 A A E -BC 23 83A 12 49,-2.4 49,-2.5 -2,-0.3 2,-0.7 -0.881 36.8-157.5 -89.4 115.7 -21.7 -23.3 -34.2 35 41 A A E -BC 22 82A 1 -13,-2.8 -13,-1.9 -2,-0.7 2,-0.8 -0.863 9.4-153.5-109.9 111.2 -23.4 -20.4 -36.0 36 42 A K E -BC 21 81A 62 45,-2.2 45,-1.7 -2,-0.7 2,-0.5 -0.696 14.7-165.4 -81.3 110.7 -25.0 -17.6 -33.9 37 43 A I E -BC 20 80A 25 -17,-2.7 -17,-2.1 -2,-0.8 2,-0.3 -0.858 8.7-174.1-103.0 126.5 -27.8 -16.0 -36.0 38 44 A I E -BC 19 79A 5 41,-1.8 41,-2.2 -2,-0.5 2,-1.1 -0.903 31.1-117.0-125.5 148.5 -29.1 -12.7 -34.9 39 45 A N E - C 0 78A 29 -21,-2.2 3,-0.3 -2,-0.3 39,-0.2 -0.706 26.4-176.6 -81.7 98.6 -32.0 -10.3 -35.8 40 46 A T S > S+ 0 0 29 37,-1.5 3,-1.2 -2,-1.1 -1,-0.2 0.843 82.7 57.5 -63.7 -34.3 -30.2 -7.2 -37.1 41 47 A K T 3 S+ 0 0 134 36,-1.2 -1,-0.2 1,-0.2 37,-0.1 0.843 108.0 46.0 -64.4 -34.9 -33.6 -5.5 -37.5 42 48 A K T 3 S+ 0 0 157 -3,-0.3 2,-0.3 35,-0.3 -1,-0.2 0.148 88.6 117.6 -99.2 19.1 -34.6 -6.0 -33.9 43 49 A L < - 0 0 31 -3,-1.2 2,-0.2 -5,-0.1 -3,-0.0 -0.616 56.0-137.9 -87.8 145.9 -31.3 -4.9 -32.4 44 50 A S > - 0 0 55 -2,-0.3 4,-3.1 1,-0.1 5,-0.2 -0.671 29.0-107.3 -95.6 158.3 -30.9 -1.9 -30.1 45 51 A A H > S+ 0 0 89 1,-0.3 4,-2.7 -2,-0.2 5,-0.1 0.866 121.5 45.0 -53.2 -43.3 -28.0 0.6 -30.5 46 52 A R H > S+ 0 0 190 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.849 113.1 51.1 -70.9 -35.5 -26.3 -0.7 -27.3 47 53 A D H > S+ 0 0 51 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.914 111.9 47.6 -64.5 -43.1 -26.9 -4.3 -28.4 48 54 A F H X S+ 0 0 75 -4,-3.1 4,-2.9 2,-0.2 5,-0.3 0.948 108.5 53.4 -64.5 -50.2 -25.4 -3.5 -31.8 49 55 A Q H X S+ 0 0 116 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.916 110.1 48.8 -47.3 -51.9 -22.4 -1.7 -30.3 50 56 A K H >X S+ 0 0 97 -4,-2.1 4,-2.3 2,-0.2 3,-1.1 0.969 109.0 53.7 -48.9 -58.0 -21.7 -4.8 -28.2 51 57 A L H 3X S+ 0 0 20 -4,-2.6 4,-2.3 1,-0.3 -2,-0.2 0.904 110.0 45.8 -46.6 -51.8 -22.1 -7.0 -31.3 52 58 A E H 3X S+ 0 0 122 -4,-2.9 4,-1.6 2,-0.2 -1,-0.3 0.748 113.9 53.1 -65.7 -23.4 -19.4 -4.9 -33.1 53 59 A R H X S+ 0 0 0 -4,-2.3 3,-1.8 2,-0.2 4,-1.5 0.988 110.4 47.9 -62.7 -63.5 -12.0 -8.5 -30.7 58 64 A C H 3< S+ 0 0 3 -4,-2.5 11,-0.5 1,-0.3 -1,-0.2 0.830 105.7 63.2 -48.3 -35.1 -12.6 -12.3 -31.1 59 65 A R H 3< S+ 0 0 110 -4,-2.0 -1,-0.3 -5,-0.4 -2,-0.2 0.878 103.7 47.3 -56.9 -40.5 -11.6 -11.8 -34.7 60 66 A K H << S+ 0 0 109 -3,-1.8 2,-0.3 -4,-1.1 -1,-0.2 0.901 100.2 81.7 -65.3 -42.0 -8.2 -10.7 -33.5 61 67 A L < + 0 0 0 -4,-1.5 2,-0.4 62,-0.0 8,-0.4 -0.506 50.5 176.3 -84.4 128.5 -7.8 -13.6 -31.1 62 68 A Q + 0 0 125 -2,-0.3 5,-0.1 6,-0.1 3,-0.1 -0.985 22.8 131.9-127.2 120.5 -6.6 -17.1 -32.2 63 69 A H B > -E 66 0B 43 3,-0.6 3,-1.4 -2,-0.4 5,-0.1 -0.981 61.2-119.3-164.8 151.1 -6.1 -19.8 -29.5 64 70 A P T 3 S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.814 118.3 46.0 -59.6 -33.2 -6.8 -23.4 -28.6 65 71 A N T 3 S+ 0 0 8 47,-0.1 83,-2.5 1,-0.1 2,-0.4 -0.011 100.8 80.0-102.5 26.8 -8.6 -22.2 -25.5 66 72 A I B < S-Ef 63 148B 1 -3,-1.4 -3,-0.6 81,-0.3 83,-0.1 -0.875 85.3-120.4-139.3 104.7 -10.6 -19.4 -27.2 67 73 A V - 0 0 14 81,-1.1 2,-0.3 -2,-0.4 -2,-0.1 -0.187 41.6-130.9 -39.8 104.8 -13.8 -20.1 -29.2 68 74 A R - 0 0 23 -5,-0.1 16,-1.4 -4,-0.1 2,-0.8 -0.494 7.2-142.8 -72.2 125.1 -12.6 -18.8 -32.5 69 75 A L E +D 83 0A 2 -11,-0.5 14,-0.2 -8,-0.4 3,-0.1 -0.809 25.6 177.1 -81.7 111.6 -14.8 -16.4 -34.4 70 76 A H E - 0 0 64 12,-3.4 2,-0.3 -2,-0.8 -1,-0.2 0.825 54.4 -3.1 -90.1 -33.3 -14.2 -17.5 -37.9 71 77 A D E -D 82 0A 64 11,-0.9 11,-1.7 2,-0.0 2,-0.3 -0.952 47.4-150.3-154.9 169.6 -16.6 -15.3 -39.9 72 78 A S E -D 81 0A 44 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.811 20.6-178.2-151.4 102.0 -19.2 -12.6 -39.8 73 79 A I E -D 80 0A 14 7,-1.4 7,-3.0 -2,-0.3 2,-0.5 -0.806 14.9-154.2-108.3 145.7 -21.9 -12.4 -42.5 74 80 A Q E -D 79 0A 66 -2,-0.3 2,-0.7 5,-0.2 5,-0.2 -0.939 11.3-177.9-119.6 109.5 -24.7 -9.9 -42.9 75 81 A E E > -D 78 0A 35 3,-2.9 3,-2.3 -2,-0.5 2,-1.8 -0.808 54.9 -83.5-109.8 91.2 -27.8 -11.1 -44.7 76 82 A E T 3 S+ 0 0 154 -2,-0.7 3,-0.0 1,-0.3 -1,-0.0 -0.267 120.2 6.8 56.8 -82.3 -30.4 -8.3 -45.1 77 83 A S T 3 S+ 0 0 34 -2,-1.8 -37,-1.5 -37,-0.1 -36,-1.2 0.394 123.9 63.8-115.2 -1.2 -32.1 -8.7 -41.7 78 84 A F E < -CD 39 75A 83 -3,-2.3 -3,-2.9 -39,-0.2 2,-0.6 -0.989 61.7-151.6-129.5 135.5 -29.9 -11.3 -39.9 79 85 A H E -CD 38 74A 30 -41,-2.2 -41,-1.8 -2,-0.4 2,-0.3 -0.919 14.9-154.7-107.9 123.8 -26.3 -11.2 -38.9 80 86 A Y E -CD 37 73A 21 -7,-3.0 -7,-1.4 -2,-0.6 2,-0.5 -0.726 7.4-166.5 -98.2 139.3 -24.4 -14.4 -38.7 81 87 A L E -CD 36 72A 1 -45,-1.7 -45,-2.2 -2,-0.3 2,-0.7 -0.941 15.0-145.0-127.4 110.2 -21.4 -15.1 -36.5 82 88 A V E +CD 35 71A 0 -11,-1.7 -12,-3.4 -2,-0.5 -11,-0.9 -0.621 26.5 179.3 -82.8 113.0 -19.4 -18.3 -37.3 83 89 A F E -CD 34 69A 27 -49,-2.5 -49,-2.4 -2,-0.7 -14,-0.2 -0.804 37.4 -88.6-114.9 152.0 -18.0 -19.9 -34.2 84 90 A D E -C 33 0A 23 -16,-1.4 2,-0.6 -2,-0.3 -51,-0.2 -0.202 53.0-111.1 -39.3 139.3 -15.9 -23.0 -33.3 85 91 A L - 0 0 35 -53,-0.6 2,-0.3 -52,-0.1 -1,-0.1 -0.765 41.2-177.1 -83.9 122.9 -18.3 -25.9 -32.8 86 92 A V + 0 0 22 -2,-0.6 53,-0.2 1,-0.1 52,-0.2 -0.910 18.2 169.7-119.6 149.4 -18.4 -26.9 -29.1 87 93 A T + 0 0 62 51,-2.1 52,-0.3 50,-0.6 53,-0.2 0.284 60.8 81.2-143.4 8.2 -20.4 -29.7 -27.6 88 94 A G S S- 0 0 19 49,-1.9 50,-0.2 51,-0.3 51,-0.1 0.578 84.3-141.3 -93.6 -11.8 -19.2 -30.2 -24.0 89 95 A G - 0 0 37 48,-0.3 48,-3.0 49,-0.1 -1,-0.2 -0.251 44.5 -27.2 78.6-171.6 -21.4 -27.4 -22.7 90 96 A E B > -G 136 0B 73 46,-0.2 4,-0.5 1,-0.1 46,-0.3 -0.328 49.9-126.1 -72.1 156.8 -20.3 -25.0 -20.0 91 97 A L H > S+ 0 0 0 44,-2.9 4,-2.4 41,-0.8 42,-0.2 0.670 110.5 67.7 -70.2 -18.5 -17.7 -25.9 -17.3 92 98 A F H > S+ 0 0 77 40,-1.5 4,-2.6 43,-0.4 5,-0.2 0.986 98.1 45.6 -63.0 -60.0 -20.5 -24.8 -15.0 93 99 A E H > S+ 0 0 118 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.652 114.8 51.7 -60.0 -16.9 -22.8 -27.7 -15.8 94 100 A D H X S+ 0 0 28 -4,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.864 107.7 48.9 -85.6 -43.8 -19.8 -30.0 -15.5 95 101 A I H X S+ 0 0 10 -4,-2.4 4,-1.2 1,-0.2 -2,-0.2 0.964 111.9 50.1 -57.5 -51.9 -18.7 -28.7 -12.1 96 102 A V H < S+ 0 0 65 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.887 109.5 52.4 -53.7 -42.6 -22.3 -29.1 -10.8 97 103 A A H < S+ 0 0 72 -4,-0.8 -1,-0.2 1,-0.2 -2,-0.2 0.926 122.6 28.0 -61.3 -49.9 -22.4 -32.7 -12.1 98 104 A R H < S- 0 0 79 -4,-2.2 2,-3.4 1,-0.1 -1,-0.2 0.384 98.9-141.9 -91.6 0.5 -19.2 -33.8 -10.4 99 105 A E S < S- 0 0 141 -4,-1.2 2,-0.3 -5,-0.2 -1,-0.1 -0.256 70.1 -5.3 68.5 -56.2 -19.8 -31.2 -7.7 100 106 A F S S- 0 0 108 -2,-3.4 2,-0.2 -6,-0.1 100,-0.2 -0.957 71.8-108.3-159.0 178.9 -16.1 -30.6 -7.6 101 107 A Y - 0 0 18 98,-2.8 -6,-0.0 -2,-0.3 101,-0.0 -0.649 23.6-112.2-114.1 161.8 -12.6 -31.5 -8.9 102 108 A S > - 0 0 53 -2,-0.2 4,-0.8 1,-0.1 -1,-0.2 -0.107 41.4-106.6 -68.8-177.1 -9.5 -33.2 -7.7 103 109 A E H > S+ 0 0 48 2,-0.2 4,-2.9 3,-0.1 5,-0.2 0.857 120.8 50.7 -80.7 -40.5 -6.4 -31.0 -7.4 104 110 A A H > S+ 0 0 74 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.960 112.5 45.7 -59.3 -53.3 -4.8 -32.6 -10.5 105 111 A D H > S+ 0 0 73 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.839 113.4 52.2 -57.5 -36.1 -8.0 -32.0 -12.6 106 112 A A H X S+ 0 0 0 -4,-0.8 4,-3.4 2,-0.2 5,-0.3 0.959 108.5 47.8 -67.2 -52.1 -8.2 -28.5 -11.1 107 113 A S H X S+ 0 0 11 -4,-2.9 4,-3.5 2,-0.2 5,-0.2 0.922 113.8 47.4 -54.9 -50.0 -4.6 -27.5 -12.1 108 114 A H H X S+ 0 0 91 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.986 115.7 44.4 -53.2 -63.2 -4.9 -28.8 -15.6 109 115 A C H X S+ 0 0 5 -4,-2.0 4,-1.9 1,-0.2 3,-0.3 0.915 117.9 44.2 -46.7 -54.8 -8.3 -27.1 -16.1 110 116 A I H X S+ 0 0 0 -4,-3.4 4,-3.4 1,-0.2 5,-0.3 0.927 107.2 59.1 -60.0 -47.4 -7.1 -23.8 -14.6 111 117 A Q H X S+ 0 0 58 -4,-3.5 4,-1.5 -5,-0.3 -1,-0.2 0.871 106.2 50.5 -49.4 -41.7 -3.8 -23.9 -16.4 112 118 A Q H >X S+ 0 0 18 -4,-2.1 4,-2.3 -3,-0.3 3,-0.6 0.963 111.9 45.4 -59.8 -54.5 -5.8 -23.9 -19.6 113 119 A I H 3X S+ 0 0 1 -4,-1.9 4,-2.1 1,-0.3 -2,-0.2 0.858 109.3 56.8 -58.0 -38.8 -7.9 -20.9 -18.5 114 120 A L H 3X S+ 0 0 0 -4,-3.4 4,-3.0 2,-0.2 -1,-0.3 0.852 108.6 48.1 -60.2 -34.6 -4.7 -19.2 -17.4 115 121 A E H X S+ 0 0 53 -4,-2.1 3,-1.0 2,-0.2 4,-0.7 0.972 107.9 43.7 -67.2 -58.0 -3.1 -14.6 -24.2 120 126 A C H ><>S+ 0 0 0 -4,-2.1 5,-2.9 1,-0.3 3,-1.8 0.932 113.5 55.1 -49.6 -46.5 -5.9 -12.0 -24.2 121 127 A H H ><5S+ 0 0 16 -4,-3.1 3,-0.7 1,-0.3 -1,-0.3 0.759 104.0 53.4 -59.8 -27.9 -3.8 -10.1 -21.7 122 128 A S H <<5S+ 0 0 79 -4,-1.0 -1,-0.3 -3,-1.0 -2,-0.2 0.532 108.5 51.7 -85.3 -7.0 -0.9 -10.2 -24.2 123 129 A N T <<5S- 0 0 76 -3,-1.8 -1,-0.2 -4,-0.7 -2,-0.2 -0.142 121.2-103.2-117.1 36.2 -3.1 -8.7 -26.8 124 130 A G T < 5S+ 0 0 19 -3,-0.7 33,-2.6 1,-0.2 2,-0.6 0.637 81.8 135.3 54.7 14.5 -4.3 -5.7 -24.7 125 131 A I E < -I 156 0C 1 -5,-2.9 2,-0.4 -6,-0.2 -2,-0.2 -0.853 34.0-175.9-101.5 121.0 -7.6 -7.6 -24.2 126 132 A V E -I 155 0C 0 29,-2.5 29,-2.9 -2,-0.6 59,-0.1 -0.931 12.6-157.8-107.9 138.9 -9.2 -7.9 -20.8 127 133 A H - 0 0 0 -2,-0.4 2,-1.1 27,-0.3 26,-0.2 0.912 10.9-175.6 -85.0 -47.0 -12.4 -10.1 -20.6 128 134 A R S S+ 0 0 42 57,-0.1 41,-0.3 1,-0.1 -1,-0.1 -0.068 71.2 67.7 79.3 -38.6 -14.0 -8.6 -17.5 129 135 A N + 0 0 17 -2,-1.1 2,-0.3 21,-0.2 -1,-0.1 -0.259 66.5 159.6-109.5 48.0 -16.8 -11.2 -17.4 130 136 A L + 0 0 2 42,-0.1 39,-0.2 2,-0.0 20,-0.0 -0.519 15.7 126.1 -72.9 130.0 -14.8 -14.3 -16.5 131 137 A K > - 0 0 33 -2,-0.3 3,-2.0 63,-0.0 4,-0.2 -0.957 69.4 -96.3-176.1 162.2 -16.9 -17.1 -15.1 132 138 A P T 3 S+ 0 0 2 0, 0.0 -40,-1.5 0, 0.0 -41,-0.8 0.639 118.5 61.7 -68.0 -16.3 -17.8 -20.9 -15.5 133 139 A E T 3 S+ 0 0 56 1,-0.2 -3,-0.0 -42,-0.2 -43,-0.0 0.567 108.5 46.6 -79.8 -8.7 -21.0 -20.1 -17.4 134 140 A N S < S+ 0 0 16 -3,-2.0 15,-1.5 15,-0.1 2,-0.5 0.353 94.8 86.6-112.0 1.2 -18.6 -18.5 -19.9 135 141 A L E - H 0 148B 0 -3,-0.3 -44,-2.9 -4,-0.2 -43,-0.4 -0.921 64.0-164.1-104.8 124.6 -16.1 -21.4 -20.0 136 142 A L E -GH 90 147B 39 11,-2.7 11,-4.3 -2,-0.5 2,-0.7 -0.852 17.6-131.7-118.1 144.0 -17.0 -24.1 -22.6 137 143 A L E - H 0 146B 22 -48,-3.0 -49,-1.9 -2,-0.3 -50,-0.6 -0.821 18.5-135.0 -97.5 112.0 -15.8 -27.6 -23.0 138 144 A A S S- 0 0 29 7,-2.4 -51,-2.1 -2,-0.7 2,-0.3 0.767 81.2 -22.3 -27.9 -50.7 -14.8 -28.5 -26.6 139 145 A S S S- 0 0 40 2,-0.3 -51,-0.3 -52,-0.3 5,-0.1 -0.892 71.2 -91.2-152.6-179.4 -16.7 -31.8 -26.3 140 146 A K S S+ 0 0 164 -2,-0.3 3,-0.1 -53,-0.2 4,-0.1 0.766 89.9 111.3 -70.6 -25.6 -18.0 -34.3 -23.8 141 147 A A S > S- 0 0 60 1,-0.1 3,-1.2 2,-0.1 -2,-0.3 -0.124 80.4-104.2 -48.4 142.1 -14.7 -36.1 -24.2 142 148 A K T 3 S+ 0 0 154 1,-0.2 -1,-0.1 2,-0.0 3,-0.1 -0.491 107.3 25.7 -73.3 142.0 -12.5 -36.0 -21.1 143 149 A G T 3 S+ 0 0 57 1,-0.3 -1,-0.2 -2,-0.2 3,-0.1 0.166 86.7 158.4 87.5 -16.9 -9.5 -33.7 -21.3 144 150 A A < - 0 0 20 -3,-1.2 -1,-0.3 1,-0.1 -2,-0.0 -0.086 50.0 -97.8 -42.0 131.6 -11.6 -31.7 -23.8 145 151 A A - 0 0 31 -8,-0.1 -7,-2.4 -3,-0.1 2,-0.6 -0.069 26.9-126.3 -56.0 152.5 -10.2 -28.2 -23.9 146 152 A V E - H 0 137B 4 -9,-0.2 2,-0.5 -37,-0.1 -9,-0.2 -0.919 28.8-159.8 -99.7 123.7 -11.8 -25.4 -22.0 147 153 A K E - H 0 136B 29 -11,-4.3 -11,-2.7 -2,-0.6 -81,-0.3 -0.920 11.6-129.8-117.0 128.9 -12.7 -22.5 -24.3 148 154 A L E +fH 66 135B 0 -83,-2.5 -81,-1.1 -2,-0.5 2,-0.2 -0.418 37.2 163.5 -75.1 141.7 -13.3 -18.9 -23.2 149 155 A A + 0 0 16 -15,-1.5 -15,-0.1 1,-0.2 -1,-0.0 -0.770 33.5 62.0-146.3-171.4 -16.4 -17.1 -24.5 150 156 A D + 0 0 56 -2,-0.2 3,-0.4 1,-0.1 -1,-0.2 0.965 43.4 173.7 46.0 74.2 -18.9 -14.2 -24.3 151 157 A F + 0 0 2 1,-0.2 3,-0.3 2,-0.1 -1,-0.1 0.214 38.3 122.6 -91.2 16.0 -16.5 -11.3 -24.9 152 158 A G S S+ 0 0 6 1,-0.3 -1,-0.2 -99,-0.1 -98,-0.1 0.679 85.9 33.6 -51.2 -18.8 -19.5 -8.9 -24.9 153 159 A L S S+ 0 0 32 -3,-0.4 -1,-0.3 -26,-0.2 -2,-0.1 0.634 88.6 122.9-110.1 -24.8 -17.7 -7.1 -22.1 154 160 A A - 0 0 0 -3,-0.3 2,-0.3 -4,-0.2 -27,-0.3 -0.019 44.1-165.0 -40.0 140.0 -14.1 -7.6 -23.1 155 161 A I E -I 126 0C 12 -29,-2.9 -29,-2.5 -98,-0.0 2,-0.5 -0.882 19.8-119.9-132.9 162.7 -12.2 -4.4 -23.6 156 162 A E E +I 125 0C 83 -2,-0.3 2,-0.3 -31,-0.2 -31,-0.2 -0.906 35.9 174.1-107.1 129.6 -8.9 -3.1 -25.1 157 163 A V - 0 0 20 -33,-2.6 4,-0.1 -2,-0.5 2,-0.1 -0.882 20.6-144.7-130.9 159.8 -6.4 -1.4 -22.9 158 164 A N - 0 0 112 2,-0.4 -1,-0.1 -2,-0.3 -34,-0.0 0.074 55.7 -64.2 -97.8-144.0 -2.9 -0.1 -23.1 159 165 A D S S+ 0 0 153 2,-0.1 2,-0.3 -2,-0.1 25,-0.0 0.481 108.7 74.7 -88.9 -2.8 -0.1 -0.1 -20.5 160 166 A S S S- 0 0 69 23,-0.0 -2,-0.4 24,-0.0 2,-0.2 -0.846 76.4-119.5-118.7 149.5 -2.0 2.1 -18.0 161 167 A E + 0 0 61 -2,-0.3 2,-0.3 21,-0.1 23,-0.2 -0.570 39.4 153.8 -83.9 145.2 -4.9 1.6 -15.6 162 168 A A B -J 183 0D 46 21,-1.3 21,-1.4 -2,-0.2 2,-0.3 -0.978 49.6 -81.6-162.9 160.6 -8.1 3.6 -15.8 163 169 A W + 0 0 107 -2,-0.3 3,-0.1 19,-0.3 14,-0.0 -0.529 36.5 178.8 -71.3 128.4 -11.8 3.4 -14.9 164 170 A H - 0 0 59 1,-0.5 -1,-0.1 -2,-0.3 2,-0.0 0.015 51.2 -94.1-118.6 26.1 -13.7 1.4 -17.6 165 171 A G - 0 0 27 1,-0.1 2,-0.7 15,-0.1 -1,-0.5 -0.150 51.5 -65.7 84.2 175.0 -17.1 1.6 -16.0 166 172 A F S S+ 0 0 97 -3,-0.1 2,-0.3 -2,-0.0 -1,-0.1 -0.889 71.2 132.5-108.9 109.3 -18.8 -0.9 -13.7 167 173 A A + 0 0 30 -2,-0.7 2,-0.3 -39,-0.1 -3,-0.1 -0.991 20.2 80.1-154.1 150.8 -19.6 -4.3 -15.3 168 174 A G S S- 0 0 27 -2,-0.3 -39,-0.2 -39,-0.1 3,-0.1 -0.989 74.6 -54.9 153.2-155.0 -19.2 -8.0 -14.5 169 175 A T >> - 0 0 24 -41,-0.3 3,-2.6 -2,-0.3 4,-1.1 -0.994 46.5-119.6-127.5 129.8 -20.9 -10.7 -12.5 170 176 A P G >4 S+ 0 0 57 0, 0.0 3,-1.9 0, 0.0 -1,-0.2 0.774 106.6 44.2 -30.6 -76.7 -21.5 -10.3 -8.7 171 177 A G G 34 S+ 0 0 22 1,-0.3 35,-0.3 -3,-0.1 -3,-0.0 0.531 119.2 43.5 -55.1 -9.9 -19.6 -13.3 -7.3 172 178 A Y G <4 S+ 0 0 37 -3,-2.6 -1,-0.3 2,-0.1 22,-0.1 0.527 80.2 121.5-115.7 -9.9 -16.5 -12.7 -9.5 173 179 A L << - 0 0 10 -3,-1.9 -5,-0.1 -4,-1.1 3,-0.1 -0.083 58.4-122.8 -55.8 156.5 -16.1 -8.9 -9.4 174 180 A S > - 0 0 3 1,-0.1 4,-1.6 45,-0.0 5,-0.2 -0.534 15.5-115.2 -97.2 164.2 -12.7 -7.6 -8.1 175 181 A P H >> S+ 0 0 0 0, 0.0 4,-3.1 0, 0.0 3,-0.7 0.997 113.8 56.5 -56.5 -60.8 -12.0 -5.2 -5.3 176 182 A E H 34>S+ 0 0 2 71,-0.4 5,-2.7 1,-0.3 -3,-0.0 0.703 108.4 47.6 -46.5 -30.5 -10.6 -2.5 -7.6 177 183 A V H >45S+ 0 0 5 3,-0.2 3,-0.8 2,-0.2 -1,-0.3 0.901 114.2 44.3 -79.7 -42.5 -13.9 -2.4 -9.6 178 184 A L H <<5S+ 0 0 17 -4,-1.6 -2,-0.2 -3,-0.7 -1,-0.1 0.876 111.9 53.5 -67.0 -38.3 -16.2 -2.3 -6.6 179 185 A K T 3<5S- 0 0 93 -4,-3.1 -1,-0.3 -5,-0.2 -2,-0.2 0.561 112.1-129.8 -68.5 -8.5 -13.9 0.3 -5.1 180 186 A K T < 5 + 0 0 148 -3,-0.8 -3,-0.2 -5,-0.4 -2,-0.1 0.830 56.4 150.8 56.8 33.5 -14.4 2.1 -8.4 181 187 A D < - 0 0 68 -5,-2.7 2,-0.3 -6,-0.2 -1,-0.2 -0.425 60.7 -80.1 -82.6 165.3 -10.7 2.4 -8.7 182 188 A P - 0 0 66 0, 0.0 2,-0.3 0, 0.0 -19,-0.3 -0.567 63.8-170.1 -64.7 127.1 -8.8 2.6 -12.1 183 189 A Y B +J 162 0D 3 -21,-1.4 -21,-1.3 -2,-0.3 2,-0.2 -0.794 21.0 157.5-128.7 165.8 -8.5 -1.1 -13.2 184 190 A S > - 0 0 12 -2,-0.3 3,-1.9 -23,-0.2 4,-0.3 -0.584 59.4 -21.7-152.6-145.2 -6.9 -3.4 -15.7 185 191 A K T >> S+ 0 0 61 1,-0.3 3,-1.7 -2,-0.2 4,-0.8 0.765 115.3 67.0 -52.8 -39.1 -5.8 -6.9 -16.5 186 192 A P H 3> S+ 0 0 26 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 0.667 81.5 80.6 -63.1 -13.5 -5.6 -8.3 -13.0 187 193 A V H <> S+ 0 0 10 -3,-1.9 4,-0.9 1,-0.2 -2,-0.2 0.876 95.1 46.0 -57.8 -37.2 -9.4 -7.9 -12.7 188 194 A D H X> S+ 0 0 2 -3,-1.7 4,-1.7 -4,-0.3 3,-0.7 0.903 105.8 58.1 -70.8 -44.2 -9.7 -11.2 -14.6 189 195 A I H 3X S+ 0 0 1 -4,-0.8 4,-2.0 1,-0.3 -2,-0.2 0.852 101.0 58.3 -53.5 -36.4 -7.0 -12.9 -12.5 190 196 A W H 3X S+ 0 0 0 -4,-1.9 4,-1.5 1,-0.2 -1,-0.3 0.877 104.9 49.0 -62.7 -37.6 -9.2 -12.1 -9.5 191 197 A A H X S+ 0 0 17 -4,-2.4 4,-4.4 1,-0.2 3,-0.9 0.940 108.9 51.4 -56.1 -52.5 -14.9 -23.2 -6.8 199 205 A L H 3< S+ 0 0 0 -4,-3.5 -98,-2.8 1,-0.2 -1,-0.2 0.885 109.4 52.4 -51.7 -41.2 -13.2 -26.0 -8.7 200 206 A L H 3< S+ 0 0 7 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.731 134.4 2.4 -72.5 -23.3 -11.6 -27.2 -5.5 201 207 A V H << S- 0 0 20 -4,-1.2 -2,-0.2 -3,-0.9 -3,-0.2 0.518 90.5-115.7-142.4 -15.0 -14.8 -27.4 -3.5 202 208 A G S < S+ 0 0 36 -4,-4.4 -4,-0.2 -5,-0.4 -3,-0.1 0.579 86.0 84.2 86.1 9.3 -17.8 -26.5 -5.6 203 209 A Y S S- 0 0 72 -6,-0.3 -1,-0.2 -5,-0.2 -2,-0.2 -0.981 80.7 -98.1-142.7 155.8 -18.8 -23.5 -3.7 204 210 A P - 0 0 51 0, 0.0 3,-0.1 0, 0.0 -9,-0.1 -0.249 12.4-135.3 -78.6 157.4 -17.7 -19.8 -3.8 205 211 A P S S+ 0 0 13 0, 0.0 2,-0.4 0, 0.0 19,-0.2 0.882 99.9 33.9 -70.6 -40.7 -15.1 -18.0 -1.6 206 212 A F S S+ 0 0 3 -35,-0.3 2,-0.3 17,-0.1 17,-0.1 -0.921 74.7 138.8-116.0 141.4 -17.5 -15.1 -1.3 207 213 A W + 0 0 165 -2,-0.4 2,-0.2 -3,-0.1 10,-0.1 -0.947 5.6 148.1-169.2 165.5 -21.3 -15.4 -1.3 208 214 A D - 0 0 35 -2,-0.3 7,-0.0 1,-0.0 6,-0.0 -0.676 48.2-123.5 161.8 140.9 -24.3 -13.8 0.5 209 215 A E S S+ 0 0 179 -2,-0.2 2,-0.6 1,-0.1 -1,-0.0 0.488 100.0 77.3 -82.8 -2.6 -27.8 -13.0 -0.5 210 216 A D > - 0 0 71 1,-0.1 4,-3.3 2,-0.0 5,-0.1 -0.950 68.8-161.2-106.0 119.5 -27.0 -9.4 0.5 211 217 A Q H > S+ 0 0 110 -2,-0.6 4,-4.2 2,-0.2 5,-0.3 0.898 89.4 55.1 -67.5 -44.6 -25.0 -7.7 -2.2 212 218 A H H > S+ 0 0 158 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.974 115.9 38.0 -48.7 -62.6 -23.7 -4.9 0.1 213 219 A R H > S+ 0 0 150 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.940 115.0 55.0 -54.8 -52.5 -22.3 -7.5 2.5 214 220 A L H X S+ 0 0 14 -4,-3.3 4,-2.0 1,-0.2 -2,-0.2 0.948 114.3 40.8 -41.4 -57.0 -21.3 -9.7 -0.4 215 221 A Y H X S+ 0 0 36 -4,-4.2 4,-2.7 1,-0.2 5,-0.3 0.849 110.4 57.0 -66.5 -38.2 -19.3 -6.7 -1.8 216 222 A A H X S+ 0 0 53 -4,-3.2 4,-2.3 -5,-0.3 -1,-0.2 0.944 109.8 46.8 -54.6 -48.5 -18.0 -5.7 1.6 217 223 A Q H X>S+ 0 0 37 -4,-3.1 5,-3.5 2,-0.2 4,-2.3 0.889 111.3 50.7 -61.4 -44.3 -16.5 -9.2 1.9 218 224 A I H <5S+ 0 0 0 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.969 114.2 42.6 -59.3 -56.5 -15.0 -9.2 -1.5 219 225 A K H <5S+ 0 0 80 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.841 114.8 52.6 -59.0 -34.7 -13.3 -5.8 -1.0 220 226 A A H <5S- 0 0 73 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.881 111.1-123.6 -65.8 -36.8 -12.3 -7.0 2.4 221 227 A G T <5 + 0 0 21 -4,-2.3 2,-1.3 -3,-0.2 -3,-0.2 0.713 49.3 171.9 92.0 32.9 -10.8 -10.1 1.0 222 228 A A < + 0 0 49 -5,-3.5 2,-0.3 -6,-0.1 -1,-0.2 -0.611 23.3 100.7 -92.5 87.6 -13.0 -12.1 3.3 223 229 A Y + 0 0 49 -2,-1.3 2,-0.2 -3,-0.1 -17,-0.1 -0.857 38.4 179.6-143.9 179.7 -12.9 -15.8 2.5 224 230 A D - 0 0 98 -2,-0.3 -2,-0.0 -19,-0.2 0, 0.0 -0.848 38.5 -89.3-160.8-163.4 -11.2 -18.8 4.1 225 231 A Y - 0 0 49 -2,-0.2 13,-0.0 4,-0.0 -2,-0.0 -0.709 43.5-159.6-129.1 80.2 -10.7 -22.5 4.0 226 232 A P > - 0 0 42 0, 0.0 4,-1.6 0, 0.0 5,-0.1 -0.226 28.1 -80.4 -60.0 141.7 -13.4 -24.2 6.1 227 233 A S T 4 S+ 0 0 81 2,-0.2 2,-0.1 1,-0.2 0, 0.0 -0.553 93.8 17.5 -86.3 157.8 -13.0 -27.7 7.4 228 234 A P T >4 S+ 0 0 88 0, 0.0 3,-3.8 0, 0.0 4,-0.5 -0.925 121.3 48.4 -89.0 -29.5 -13.2 -30.5 6.7 229 235 A E G >4 S+ 0 0 78 1,-0.3 3,-1.4 2,-0.2 4,-0.3 0.841 114.2 47.8 -29.1 -69.3 -13.2 -30.2 2.9 230 236 A W G 3< S+ 0 0 0 -4,-1.6 -1,-0.3 1,-0.3 -3,-0.2 0.372 93.7 84.4 -61.9 8.2 -10.2 -27.8 2.8 231 237 A D G < S+ 0 0 90 -3,-3.8 -1,-0.3 1,-0.2 -2,-0.2 0.857 92.0 40.3 -81.8 -36.9 -8.3 -30.2 5.2 232 238 A T S < S+ 0 0 139 -3,-1.4 2,-0.4 -4,-0.5 -1,-0.2 0.410 93.3 108.0 -92.8 1.3 -6.9 -32.6 2.6 233 239 A V S S- 0 0 21 -4,-0.3 5,-0.0 1,-0.1 -33,-0.0 -0.650 73.8-118.1 -80.0 133.4 -6.2 -29.7 0.2 234 240 A T > - 0 0 43 -2,-0.4 4,-0.9 1,-0.1 -1,-0.1 -0.054 13.7-121.7 -62.5 168.3 -2.5 -28.9 -0.2 235 241 A P H > S+ 0 0 84 0, 0.0 4,-3.5 0, 0.0 5,-0.3 0.854 110.1 63.8 -78.2 -37.1 -1.0 -25.5 0.7 236 242 A E H > S+ 0 0 110 1,-0.2 4,-0.7 2,-0.2 27,-0.1 0.695 104.6 48.5 -61.3 -20.1 0.3 -24.9 -2.8 237 243 A A H > S+ 0 0 0 2,-0.1 4,-1.5 3,-0.1 -1,-0.2 0.836 116.3 41.2 -85.7 -39.0 -3.3 -24.9 -3.9 238 244 A K H X S+ 0 0 50 -4,-0.9 4,-2.3 2,-0.2 3,-0.3 0.971 111.7 53.8 -70.8 -57.5 -4.4 -22.5 -1.2 239 245 A S H X S+ 0 0 73 -4,-3.5 4,-2.2 1,-0.3 -3,-0.2 0.876 109.5 51.1 -41.8 -47.1 -1.4 -20.2 -1.4 240 246 A L H X S+ 0 0 3 -4,-0.7 4,-1.8 -5,-0.3 5,-0.3 0.919 105.3 53.7 -59.3 -47.4 -2.1 -19.9 -5.2 241 247 A I H X S+ 0 0 0 -4,-1.5 4,-3.0 -3,-0.3 -1,-0.2 0.869 108.9 53.4 -55.7 -35.9 -5.8 -19.0 -4.5 242 248 A D H < S+ 0 0 61 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.972 104.6 50.8 -61.0 -57.7 -4.3 -16.3 -2.3 243 249 A S H < S+ 0 0 35 -4,-2.2 10,-2.1 1,-0.2 3,-0.4 0.768 117.2 41.4 -57.1 -28.9 -2.0 -14.7 -4.9 244 250 A M H < S+ 0 0 0 -4,-1.8 2,-2.0 1,-0.2 -1,-0.2 0.905 112.1 55.1 -79.8 -50.0 -4.9 -14.5 -7.3 245 251 A L S < S+ 0 0 8 -4,-3.0 2,-0.5 -5,-0.3 -1,-0.2 -0.433 78.9 140.9 -80.3 60.9 -7.3 -13.4 -4.6 246 252 A T - 0 0 34 -2,-2.0 6,-0.2 -3,-0.4 -25,-0.1 -0.947 45.4-152.0-106.0 121.4 -5.0 -10.5 -3.7 247 253 A V S S+ 0 0 39 -2,-0.5 -71,-0.4 1,-0.1 -1,-0.1 0.887 84.6 69.8 -64.6 -42.7 -6.9 -7.3 -2.9 248 254 A N S >> S- 0 0 72 1,-0.2 3,-1.6 -73,-0.1 4,-0.9 -0.698 73.3-160.3 -76.2 103.9 -4.2 -5.0 -4.0 249 255 A P T 34 S+ 0 0 20 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.781 89.2 62.2 -57.7 -30.3 -4.3 -5.5 -7.8 250 256 A K T 34 S+ 0 0 154 1,-0.2 -2,-0.1 -3,-0.1 -3,-0.0 0.828 111.4 38.0 -63.5 -32.2 -0.7 -4.1 -8.0 251 257 A K T <4 S+ 0 0 164 -3,-1.6 -1,-0.2 2,-0.1 2,-0.1 0.481 94.0 109.1 -99.1 -5.7 0.4 -7.0 -5.8 252 258 A R S < S- 0 0 9 -4,-0.9 -8,-0.2 -3,-0.2 -9,-0.1 -0.452 76.4-106.1 -70.0 144.3 -1.9 -9.6 -7.4 253 259 A I - 0 0 24 -10,-2.1 2,-0.2 -2,-0.1 -1,-0.1 -0.273 29.6-123.4 -71.1 156.0 -0.2 -12.2 -9.5 254 260 A T > - 0 0 60 1,-0.1 4,-2.9 -65,-0.0 5,-0.2 -0.591 19.8-115.3 -94.9 161.8 -0.3 -12.2 -13.3 255 261 A A H > S+ 0 0 2 2,-0.2 4,-1.7 -2,-0.2 5,-0.1 0.921 118.1 50.3 -59.5 -46.0 -1.6 -15.1 -15.5 256 262 A D H 4 S+ 0 0 88 2,-0.2 -1,-0.2 1,-0.2 3,-0.1 0.900 112.8 46.3 -61.1 -43.7 1.9 -15.5 -17.0 257 263 A Q H >4 S+ 0 0 81 1,-0.2 3,-1.9 2,-0.2 -2,-0.2 0.942 111.2 52.6 -59.9 -49.3 3.4 -15.6 -13.6 258 264 A A H >< S+ 0 0 0 -4,-2.9 3,-1.4 1,-0.3 -2,-0.2 0.760 98.8 63.7 -61.4 -27.5 0.8 -18.1 -12.4 259 265 A L T 3< S+ 0 0 38 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.313 97.8 59.8 -80.5 10.2 1.5 -20.4 -15.3 260 266 A K T < S+ 0 0 75 -3,-1.9 11,-0.4 -5,-0.1 -1,-0.3 0.252 76.4 113.0-118.3 6.5 5.0 -20.8 -13.8 261 267 A V X> - 0 0 38 -3,-1.4 3,-2.3 1,-0.1 4,-2.1 -0.695 69.4-133.3 -83.6 132.0 3.8 -22.2 -10.5 262 268 A P H 3> S+ 0 0 68 0, 0.0 4,-2.7 0, 0.0 -1,-0.1 0.751 105.6 66.7 -57.7 -29.7 4.9 -25.9 -9.9 263 269 A W H 34 S+ 0 0 33 1,-0.2 -156,-0.1 2,-0.2 -26,-0.0 0.744 113.5 35.5 -62.2 -21.5 1.3 -26.8 -8.8 264 270 A I H <4 S+ 0 0 6 -3,-2.3 -1,-0.2 -6,-0.1 -5,-0.1 0.809 129.6 33.7 -92.3 -43.0 0.6 -26.0 -12.4 265 271 A C H < 0 0 64 -4,-2.1 -2,-0.2 -154,-0.0 -4,-0.0 0.945 360.0 360.0 -82.0 -51.7 3.8 -27.3 -13.9 266 272 A N < 0 0 169 -4,-2.7 -3,-0.1 -5,-0.1 -5,-0.0 0.629 360.0 360.0 -96.9 360.0 4.6 -30.2 -11.7 267 ! 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 0.0 268 279 A A 0 0 149 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-159.0 13.3 -24.5 -3.9 269 280 A I - 0 0 167 2,-0.0 2,-0.3 1,-0.0 0, 0.0 -0.610 360.0-175.6 -86.0 149.0 14.3 -22.6 -7.0 270 281 A H - 0 0 129 -2,-0.2 2,-0.7 -9,-0.0 -9,-0.1 -0.851 34.7 -83.9-138.5 173.3 11.6 -21.1 -9.3 271 282 A R - 0 0 184 -11,-0.4 2,-0.4 -2,-0.3 -11,-0.1 -0.731 43.4-159.9 -87.4 112.7 11.3 -19.2 -12.6 272 283 A Q - 0 0 146 -2,-0.7 2,-0.3 1,-0.0 -15,-0.0 -0.774 15.3-126.8 -95.5 135.5 11.9 -15.5 -12.1 273 284 A D - 0 0 64 -2,-0.4 2,-0.1 1,-0.1 -16,-0.0 -0.590 31.1-113.4 -76.3 136.5 10.7 -12.9 -14.6 274 285 A X - 0 0 209 -2,-0.3 2,-0.5 1,-0.0 -1,-0.1 -0.379 25.7-141.4 -68.9 150.4 13.4 -10.6 -15.9 275 286 A V + 0 0 124 -2,-0.1 2,-0.4 2,-0.0 -1,-0.0 -0.959 21.0 176.8-122.4 117.9 13.2 -6.9 -15.0 276 287 A D 0 0 154 -2,-0.5 -2,-0.0 1,-0.0 0, 0.0 -0.945 360.0 360.0-119.1 138.5 14.0 -4.1 -17.4 277 288 A C 0 0 159 -2,-0.4 -1,-0.0 0, 0.0 -2,-0.0 -0.293 360.0 360.0-123.2 360.0 13.8 -0.4 -16.8