==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 08-DEC-08 3FGW . COMPND 2 MOLECULE: PUTATIVE PHOSPHOLIPASE B-LIKE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR K.LAKOMEK,A.DICKMANNS,R.FICNER . 529 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20073.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 337 63.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 99 18.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 0.2 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 . 41 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 119 22.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 1 1 3 1 2 1 1 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 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 PARALLEL BRIDGES PER LADDER . 5 0 4 3 1 5 1 1 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 . 0 1 0 0 1 0 0 0 0 1 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 61 A P 0 0 51 0, 0.0 2,-0.1 0, 0.0 70,-0.1 0.000 360.0 360.0 360.0 173.9 66.4 -8.0 15.2 2 62 A P - 0 0 53 0, 0.0 34,-0.6 0, 0.0 3,-0.2 -0.321 360.0 -99.5 -76.6 175.9 66.0 -10.2 18.4 3 63 A V S S+ 0 0 116 1,-0.3 33,-2.0 32,-0.1 2,-0.3 0.959 109.2 2.6 -58.2 -51.6 63.1 -12.5 18.8 4 64 A S E -A 35 0A 62 31,-0.2 2,-0.3 2,-0.0 -1,-0.3 -0.999 69.9-179.3-138.8 142.1 61.4 -9.9 20.9 5 65 A R E -A 34 0A 40 29,-1.5 29,-2.0 -2,-0.3 2,-0.4 -0.998 6.6-164.1-142.2 134.6 62.6 -6.3 21.9 6 66 A T E +A 33 0A 38 -2,-0.3 17,-2.3 27,-0.2 2,-0.3 -0.978 9.5 177.0-126.3 130.6 60.9 -3.7 24.1 7 67 A R E -AB 32 22A 43 25,-2.2 25,-1.9 -2,-0.4 2,-0.3 -0.933 8.4-164.4-129.1 152.7 61.7 0.0 24.3 8 68 A S E -AB 31 21A 0 13,-1.4 13,-2.2 -2,-0.3 2,-0.5 -0.984 11.3-145.7-134.7 146.9 60.2 3.0 26.2 9 69 A L E -AB 30 20A 0 21,-3.0 20,-2.8 -2,-0.3 21,-1.1 -0.954 21.6-171.6-116.7 117.0 60.6 6.7 25.8 10 70 A L E - B 0 19A 39 9,-1.9 9,-1.5 -2,-0.5 2,-1.2 -0.804 29.8-129.5-109.0 144.6 60.5 8.8 29.0 11 71 A L E - B 0 18A 70 16,-0.4 2,-0.7 -2,-0.3 7,-0.2 -0.799 35.0-148.2 -86.2 94.5 60.4 12.5 29.6 12 72 A D E >>> - B 0 17A 72 5,-2.1 4,-2.9 -2,-1.2 3,-1.5 -0.569 14.4-166.2 -75.0 109.7 63.3 12.6 32.0 13 73 A A T 345S+ 0 0 102 -2,-0.7 -1,-0.2 1,-0.3 -2,-0.0 0.604 82.2 73.8 -73.4 -12.3 62.7 15.4 34.5 14 74 A A T 345S+ 0 0 93 1,-0.1 -1,-0.3 3,-0.1 -2,-0.1 0.557 124.9 4.2 -73.4 -9.3 66.3 15.3 35.7 15 75 A S T <45S- 0 0 70 -3,-1.5 -2,-0.2 2,-0.2 -1,-0.1 0.416 93.4-119.4-148.5 -17.0 67.2 17.0 32.4 16 76 A G T <5S+ 0 0 52 -4,-2.9 2,-0.2 1,-0.3 -3,-0.2 0.698 76.9 121.1 71.3 21.0 64.0 17.8 30.6 17 77 A Q E < -B 12 0A 121 -5,-1.0 -5,-2.1 129,-0.0 2,-0.5 -0.617 67.1-112.6-109.1 166.6 65.2 15.6 27.7 18 78 A L E +B 11 0A 19 -7,-0.2 2,-0.3 -2,-0.2 127,-0.2 -0.882 38.5 173.7 -96.8 132.9 63.8 12.4 26.0 19 79 A R E -B 10 0A 129 -9,-1.5 -9,-1.9 -2,-0.5 2,-0.2 -0.998 26.4-119.0-140.7 149.5 65.8 9.2 26.5 20 80 A L E -B 9 0A 30 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.548 27.0-177.1 -86.7 145.8 65.3 5.5 25.6 21 81 A E E -B 8 0A 66 -13,-2.2 -13,-1.4 -2,-0.2 2,-0.5 -0.799 27.1-109.6-129.4 172.9 65.0 2.6 28.0 22 82 A D E S+B 7 0A 114 -2,-0.3 -15,-0.3 -15,-0.2 2,-0.1 -0.938 76.6 8.9-111.3 128.3 64.6 -1.2 27.7 23 83 A G S S- 0 0 24 -17,-2.3 2,-0.2 -2,-0.5 -2,-0.1 -0.249 101.4 -38.7 97.6 172.4 61.3 -2.9 28.6 24 84 A F - 0 0 119 -2,-0.1 -16,-0.1 7,-0.1 -2,-0.1 -0.509 51.2-178.8 -71.7 135.7 57.9 -1.6 29.5 25 85 A H > - 0 0 60 -2,-0.2 3,-1.4 -18,-0.1 -16,-0.1 -0.962 19.9-147.6-138.7 121.3 57.6 1.5 31.7 26 86 A P T 3 S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 0.805 93.9 45.7 -61.0 -39.8 54.2 2.8 32.7 27 87 A D T 3 S+ 0 0 101 24,-0.0 -16,-0.4 3,-0.0 2,-0.1 0.171 85.2 124.3 -94.8 17.8 54.8 6.5 32.8 28 88 A A < - 0 0 0 -3,-1.4 -18,-0.3 -18,-0.1 3,-0.1 -0.411 68.9-127.3 -71.9 152.0 56.7 6.6 29.5 29 89 A V S S- 0 0 0 -20,-2.8 22,-3.4 1,-0.3 2,-0.3 0.897 90.6 -9.1 -64.6 -42.3 55.5 9.0 26.7 30 90 A A E -AC 9 50A 0 -21,-1.1 -21,-3.0 20,-0.3 2,-0.3 -0.986 62.5-165.3-153.1 155.6 55.4 5.9 24.4 31 91 A W E -AC 8 49A 45 18,-2.5 18,-2.5 -2,-0.3 2,-0.3 -0.995 5.8-165.7-146.0 142.4 56.5 2.3 24.3 32 92 A A E -AC 7 48A 0 -25,-1.9 -25,-2.2 -2,-0.3 2,-0.4 -0.917 7.4-162.6-129.6 153.5 57.0 -0.3 21.5 33 93 A N E -AC 6 47A 46 14,-1.4 14,-2.0 -2,-0.3 2,-0.6 -0.928 7.1-169.2-139.2 109.7 57.4 -4.1 21.2 34 94 A L E -AC 5 46A 2 -29,-2.0 -29,-1.5 -2,-0.4 2,-0.6 -0.896 1.1-170.8-104.4 118.6 58.7 -5.8 18.1 35 95 A T E -AC 4 45A 18 10,-3.1 10,-2.9 -2,-0.6 2,-0.6 -0.937 13.6-150.3-104.6 116.2 58.5 -9.5 17.7 36 96 A N E + C 0 44A 30 -33,-2.0 8,-0.2 -34,-0.6 178,-0.1 -0.779 35.8 148.4 -89.4 122.5 60.4 -10.9 14.7 37 97 A A E >> + C 0 43A 3 6,-1.1 4,-3.2 -2,-0.6 5,-1.3 -0.110 27.3 125.5-139.5 35.5 59.0 -14.1 13.2 38 98 A I T 45S+ 0 0 5 4,-0.3 6,-0.1 3,-0.2 -2,-0.0 0.802 75.5 53.7 -66.7 -29.1 60.0 -13.5 9.5 39 99 A R T 45S+ 0 0 194 2,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.826 121.0 28.7 -73.9 -34.3 61.8 -16.8 9.5 40 100 A E T 45S+ 0 0 111 -3,-0.2 -2,-0.2 3,-0.2 -1,-0.1 0.838 142.3 8.5 -95.8 -40.6 58.8 -18.8 10.7 41 101 A T T <5S- 0 0 20 -4,-3.2 450,-0.6 2,-0.3 -3,-0.2 0.584 91.4-116.4-120.3 -19.7 55.7 -16.9 9.5 42 102 A G S - 0 0 18 -22,-3.4 3,-1.2 -2,-0.3 170,-0.1 -0.709 16.0-151.8 -86.7 123.8 50.6 7.9 27.0 52 112 A G T 3 S+ 0 0 37 -2,-0.5 -1,-0.1 1,-0.2 4,-0.1 0.141 86.0 74.2 -83.5 20.1 47.5 10.1 27.1 53 113 A R T 3 S+ 0 0 187 2,-0.1 2,-0.3 -24,-0.1 -1,-0.2 0.426 90.0 68.0-107.4 -5.1 48.8 12.4 29.8 54 114 A Y S < S- 0 0 48 -3,-1.2 2,-0.1 -25,-0.1 -4,-0.0 -0.710 98.7 -89.0-103.8 161.8 51.2 14.1 27.5 55 115 A N > - 0 0 83 -2,-0.3 4,-2.6 1,-0.1 3,-0.4 -0.343 35.8-112.1 -69.1 154.4 50.2 16.3 24.6 56 116 A D H > S+ 0 0 3 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.824 114.3 59.0 -55.7 -39.7 49.6 14.8 21.1 57 117 A S H > S+ 0 0 22 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.903 111.5 39.7 -59.5 -45.9 52.7 16.4 19.6 58 118 A L H > S+ 0 0 8 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.901 115.1 53.4 -70.2 -43.8 55.0 14.7 22.1 59 119 A Q H X S+ 0 0 2 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.938 112.5 45.1 -51.4 -52.2 53.0 11.5 21.9 60 120 A A H X S+ 0 0 0 -4,-3.4 4,-1.3 2,-0.2 -2,-0.2 0.929 112.9 48.1 -60.9 -51.7 53.4 11.5 18.1 61 121 A Y H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.864 114.3 48.9 -58.1 -37.5 57.1 12.4 18.1 62 122 A A H X S+ 0 0 1 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.885 101.6 61.8 -69.1 -41.5 57.6 9.6 20.7 63 123 A A H X S+ 0 0 0 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.794 107.3 46.2 -55.8 -32.2 55.6 7.1 18.6 64 124 A G H X S+ 0 0 0 -4,-1.3 4,-2.0 -3,-0.2 -1,-0.2 0.874 111.8 51.7 -74.8 -40.4 58.2 7.5 15.9 65 125 A V H X S+ 0 0 0 -4,-1.4 4,-1.8 2,-0.2 -2,-0.2 0.949 110.9 44.4 -62.6 -54.2 61.1 7.2 18.3 66 126 A V H X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.852 112.7 52.9 -62.3 -37.5 60.1 3.9 20.1 67 127 A E H X S+ 0 0 0 -4,-1.0 4,-1.4 -5,-0.3 -1,-0.2 0.934 109.4 48.2 -62.0 -48.8 59.2 2.3 16.7 68 128 A A H < S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.854 110.1 53.0 -60.8 -37.8 62.6 3.1 15.2 69 129 A S H >< S+ 0 0 2 -4,-1.8 3,-0.5 1,-0.2 -1,-0.2 0.867 111.6 43.4 -69.1 -39.7 64.4 1.7 18.3 70 130 A V H 3< S+ 0 0 0 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.722 123.8 37.9 -76.0 -21.5 62.7 -1.6 18.4 71 131 A S T 3X S+ 0 0 0 -4,-1.4 4,-2.4 -5,-0.2 5,-0.2 0.044 73.0 129.1-122.0 26.0 63.1 -2.0 14.6 72 132 A E H <> S+ 0 0 77 -3,-0.5 4,-2.3 1,-0.2 -1,-0.1 0.890 76.9 42.7 -45.8 -58.5 66.5 -0.6 13.8 73 133 A E H > S+ 0 0 57 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.871 113.3 51.6 -63.4 -42.7 68.0 -3.5 11.8 74 134 A L H > S+ 0 0 2 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.902 109.6 50.3 -62.0 -43.6 64.8 -4.1 9.8 75 135 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.928 112.3 48.5 -57.7 -46.7 64.7 -0.4 8.8 76 136 A Y H X S+ 0 0 100 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.932 115.2 43.2 -58.5 -49.7 68.3 -0.7 7.7 77 137 A M H X S+ 0 0 44 -4,-2.9 4,-1.5 2,-0.2 437,-0.3 0.924 115.0 48.5 -64.0 -47.0 67.7 -3.8 5.7 78 138 A H H X S+ 0 0 3 -4,-3.2 4,-2.1 1,-0.2 5,-0.3 0.893 112.5 49.3 -61.0 -43.2 64.5 -2.5 4.1 79 139 A W H < S+ 0 0 54 -4,-2.6 4,-0.4 -5,-0.2 5,-0.4 0.906 111.3 50.0 -58.0 -44.8 66.2 0.7 3.3 80 140 A M H < S+ 0 0 44 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.720 115.6 42.9 -69.1 -24.1 69.1 -1.2 1.7 81 141 A N H < S+ 0 0 7 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.779 126.1 24.1 -90.4 -31.9 66.7 -3.4 -0.4 82 142 A T S < S+ 0 0 37 -4,-2.1 3,-0.2 -5,-0.2 -3,-0.2 0.916 130.7 5.8-102.7 -69.1 64.2 -0.7 -1.6 83 143 A V S S+ 0 0 16 -4,-0.4 -3,-0.1 -5,-0.3 -4,-0.1 -0.163 80.6 118.3-122.5 39.0 65.4 2.9 -1.8 84 144 A V S S+ 0 0 54 -5,-0.4 -1,-0.1 1,-0.2 -4,-0.1 0.899 89.3 27.9 -72.3 -41.7 69.1 3.0 -1.0 85 145 A N S > S+ 0 0 106 -3,-0.2 3,-1.4 -5,-0.1 2,-0.5 0.271 83.6 130.8-106.8 9.8 70.3 4.3 -4.4 86 146 A Y T 3 S- 0 0 45 1,-0.3 75,-0.1 -3,-0.1 -3,-0.1 -0.545 94.2 -12.7 -67.5 118.3 67.2 6.3 -5.3 87 147 A a T 3 S+ 0 0 14 -2,-0.5 -1,-0.3 1,-0.1 -2,-0.0 0.932 98.5 167.5 46.1 54.7 68.6 9.8 -6.4 88 148 A G X - 0 0 27 -3,-1.4 3,-1.0 1,-0.1 -3,-0.1 -0.087 60.0 -76.1 -77.3-172.8 72.0 9.0 -4.9 89 149 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.334 134.1 45.1 -70.3 14.4 75.1 11.1 -5.5 90 150 A F T 3 S+ 0 0 165 -5,-0.2 4,-0.1 3,-0.0 -5,-0.0 0.503 70.3 153.0-132.2 -15.2 75.1 9.4 -8.9 91 151 A E < - 0 0 52 -3,-1.0 3,-0.2 1,-0.1 -5,-0.1 0.117 39.1-144.9 -35.1 126.4 71.6 9.4 -10.4 92 152 A Y S S+ 0 0 202 1,-0.2 2,-1.9 2,-0.1 3,-0.2 0.909 95.4 63.0 -58.0 -44.7 71.8 9.3 -14.2 93 153 A E > + 0 0 22 1,-0.2 4,-1.9 2,-0.1 -1,-0.2 -0.529 62.6 162.4 -85.1 72.1 68.7 11.4 -14.4 94 154 A V H > S+ 0 0 116 -2,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.702 71.4 59.8 -67.8 -20.3 70.2 14.5 -12.7 95 155 A G H > S+ 0 0 46 -3,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.936 107.0 44.2 -69.2 -49.3 67.5 16.6 -14.1 96 156 A Y H > S+ 0 0 7 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.915 110.2 53.1 -62.2 -48.7 64.7 14.6 -12.4 97 157 A a H X S+ 0 0 20 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.816 108.8 50.3 -63.2 -33.8 66.4 14.3 -9.0 98 158 A E H X S+ 0 0 111 -4,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.917 111.6 48.8 -64.5 -45.6 66.9 18.1 -8.8 99 159 A K H X S+ 0 0 118 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.844 112.8 47.9 -63.7 -36.0 63.2 18.6 -9.7 100 160 A L H X S+ 0 0 2 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.858 109.9 51.7 -72.8 -38.1 62.1 16.1 -7.0 101 161 A K H X S+ 0 0 73 -4,-2.0 4,-1.8 -5,-0.2 -2,-0.2 0.888 114.2 44.6 -63.5 -40.9 64.4 17.7 -4.4 102 162 A N H X S+ 0 0 77 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.897 112.5 51.3 -68.9 -44.2 62.8 21.1 -5.2 103 163 A F H X S+ 0 0 18 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.919 113.7 43.1 -59.0 -48.5 59.2 19.7 -5.3 104 164 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.879 114.4 48.9 -71.2 -40.3 59.5 18.0 -1.9 105 165 A E H X S+ 0 0 88 -4,-1.8 4,-2.0 -5,-0.2 -1,-0.2 0.905 114.6 46.1 -62.9 -43.7 61.3 20.9 -0.1 106 166 A A H X S+ 0 0 27 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.863 115.4 48.1 -65.5 -37.7 58.7 23.3 -1.5 107 167 A N H X S+ 0 0 1 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.925 111.9 46.6 -68.2 -49.2 55.9 20.9 -0.5 108 168 A L H X S+ 0 0 12 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.886 113.8 50.1 -61.6 -40.4 57.2 20.3 3.1 109 169 A E H X S+ 0 0 127 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.881 106.3 55.3 -64.9 -40.9 57.7 24.0 3.5 110 170 A W H X S+ 0 0 28 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.894 108.5 48.8 -58.6 -41.7 54.1 24.7 2.3 111 171 A M H X S+ 0 0 1 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.902 108.6 53.8 -63.1 -42.9 52.8 22.4 5.0 112 172 A Q H X S+ 0 0 13 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.878 109.0 48.4 -59.4 -42.1 54.9 24.1 7.7 113 173 A R H X S+ 0 0 158 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.902 108.6 53.6 -65.2 -43.2 53.5 27.5 6.7 114 174 A E H X S+ 0 0 43 -4,-1.9 4,-0.9 1,-0.2 -2,-0.2 0.883 109.9 48.1 -59.8 -41.3 49.9 26.2 6.8 115 175 A M H < S+ 0 0 16 -4,-2.1 3,-0.4 1,-0.2 -1,-0.2 0.902 111.7 50.4 -62.0 -42.9 50.5 24.9 10.3 116 176 A E H < S+ 0 0 107 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.774 115.0 42.8 -68.7 -28.5 52.0 28.2 11.3 117 177 A L H < S+ 0 0 105 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.526 118.7 44.5 -94.8 -9.2 49.0 30.1 9.9 118 178 A N >< + 0 0 62 -4,-0.9 3,-1.1 -3,-0.4 -1,-0.2 -0.484 57.9 153.0-135.4 65.8 46.4 27.7 11.3 119 179 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.655 78.8 48.0 -71.9 -15.2 47.2 26.9 15.0 120 180 A D T 3 S+ 0 0 100 -3,-0.1 107,-0.2 106,-0.1 -5,-0.0 0.427 85.4 109.3-102.9 -1.9 43.6 26.2 15.9 121 181 A S <> - 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0 0 13 2,-0.4 -49,-0.2 -2,-0.3 -181,-0.1 -0.644 68.0 -57.5-150.2-157.4 42.0 -4.4 -9.5 368 432 A N S S+ 0 0 28 -2,-0.2 -185,-0.1 2,-0.1 -182,-0.1 0.390 105.8 88.1 -80.8 6.0 44.1 -1.9 -11.5 369 433 A I S S- 0 0 3 25,-0.1 -2,-0.4 24,-0.1 -102,-0.1 -0.925 77.8-123.4-116.3 121.0 41.1 -0.5 -13.3 370 434 A P - 0 0 1 0, 0.0 -2,-0.1 0, 0.0 -27,-0.1 -0.244 10.7-149.3 -59.7 142.0 38.9 2.4 -12.0 371 435 A Y S S+ 0 0 62 4,-0.0 23,-0.1 5,-0.0 5,-0.0 0.960 70.3 87.5 -75.9 -57.6 35.2 1.8 -11.6 372 436 A F S > S- 0 0 23 1,-0.1 4,-2.2 -22,-0.1 5,-0.2 -0.244 72.8-140.4 -57.0 122.2 33.7 5.2 -12.2 373 437 A E H > S+ 0 0 143 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.824 101.0 52.7 -51.4 -39.8 33.0 5.8 -15.9 374 438 A T H > S+ 0 0 84 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.968 108.9 46.9 -61.0 -57.2 34.3 9.4 -15.7 375 439 A V H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.861 110.0 55.4 -54.1 -42.5 37.6 8.6 -14.0 376 440 A F H <>S+ 0 0 15 -4,-2.2 5,-2.0 2,-0.2 6,-0.3 0.928 114.7 38.2 -56.4 -51.6 38.2 5.8 -16.6 377 441 A N H ><5S+ 0 0 79 -4,-1.9 3,-1.6 3,-0.2 5,-0.3 0.936 116.2 51.8 -64.8 -49.5 37.8 8.2 -19.5 378 442 A A H 3<5S+ 0 0 33 -4,-3.3 -2,-0.2 1,-0.3 -1,-0.2 0.844 105.9 54.0 -60.2 -38.3 39.6 11.1 -17.8 379 443 A S T 3<5S- 0 0 1 -4,-2.6 -109,-1.7 -5,-0.2 -1,-0.3 0.469 117.9-113.7 -78.1 -2.0 42.7 9.0 -16.9 380 444 A G T < 5S+ 0 0 22 -3,-1.6 4,-0.4 -4,-0.2 -3,-0.2 0.855 71.4 137.1 78.0 39.9 42.9 8.1 -20.6 381 445 A L >< + 0 0 14 -5,-2.0 4,-1.7 1,-0.2 -4,-0.2 0.610 57.8 74.7 -91.0 -13.8 42.2 4.4 -20.5 382 446 A Q H > S+ 0 0 88 -6,-0.3 4,-2.2 -5,-0.3 -1,-0.2 0.861 94.5 52.3 -64.7 -37.5 39.9 4.4 -23.6 383 447 A A H > S+ 0 0 65 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.831 109.4 49.9 -66.5 -34.0 42.9 4.8 -25.9 384 448 A L H > S+ 0 0 29 -4,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.802 109.5 50.3 -76.2 -31.8 44.6 1.7 -24.2 385 449 A V H X S+ 0 0 32 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.926 112.7 47.4 -66.2 -46.6 41.4 -0.4 -24.6 386 450 A A H < S+ 0 0 90 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.759 120.2 39.6 -64.9 -26.3 41.3 0.6 -28.3 387 451 A Q H < S+ 0 0 120 -4,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.784 133.3 17.8 -94.8 -32.6 45.0 -0.2 -28.7 388 452 A Y H >< S- 0 0 90 -4,-2.4 3,-0.6 1,-0.3 -3,-0.2 0.341 97.0-134.7-126.3 4.0 45.3 -3.4 -26.6 389 453 A G G >< - 0 0 32 -4,-2.3 3,-1.6 1,-0.2 4,-0.3 -0.318 63.1 -11.1 77.7-155.5 41.8 -4.7 -26.1 390 454 A D G 3 S+ 0 0 71 1,-0.3 6,-0.2 2,-0.2 -1,-0.2 0.412 108.0 87.0 -71.2 0.3 40.1 -6.0 -23.0 391 455 A W G < S+ 0 0 43 -3,-0.6 -1,-0.3 1,-0.2 8,-0.1 0.763 102.0 36.2 -66.2 -24.7 43.2 -6.1 -20.8 392 456 A F S < S+ 0 0 21 -3,-1.6 -1,-0.2 -8,-0.2 -2,-0.2 0.473 95.7 109.9-104.8 -7.9 42.4 -2.5 -20.0 393 457 A S > - 0 0 17 -4,-0.3 4,-0.7 -9,-0.1 7,-0.2 -0.340 70.0-133.1 -63.1 149.2 38.6 -2.9 -20.0 394 458 A Y T 4 S+ 0 0 48 1,-0.2 -25,-0.1 2,-0.1 -1,-0.1 0.897 101.0 25.2 -74.0 -41.0 37.0 -2.6 -16.6 395 459 A T T 4 S+ 0 0 73 1,-0.1 -1,-0.2 5,-0.1 9,-0.1 0.395 124.2 49.9-104.4 0.7 34.7 -5.7 -16.9 396 460 A K T 4 S+ 0 0 105 -6,-0.2 -2,-0.1 4,-0.1 -1,-0.1 0.392 75.8 113.8-125.8 0.5 36.7 -7.8 -19.4 397 461 A N S X S- 0 0 4 -4,-0.7 4,-2.0 -6,-0.1 3,-0.4 -0.409 82.1-100.8 -70.1 151.8 40.3 -7.8 -18.1 398 462 A P H > S+ 0 0 20 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.828 121.9 44.6 -38.8 -50.5 41.8 -11.2 -16.9 399 463 A R H > S+ 0 0 10 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.870 108.8 55.3 -68.8 -40.0 41.2 -10.4 -13.2 400 464 A A H > S+ 0 0 2 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.890 110.9 46.9 -58.5 -41.0 37.7 -9.1 -13.6 401 465 A K H X S+ 0 0 72 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.871 108.4 53.9 -68.8 -41.0 36.7 -12.3 -15.3 402 466 A I H X S+ 0 0 0 -4,-1.8 4,-1.2 -5,-0.2 3,-0.3 0.917 112.3 44.5 -62.6 -44.1 38.3 -14.6 -12.7 403 467 A F H >X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 3,-0.8 0.948 107.9 60.6 -59.8 -48.6 36.4 -12.8 -9.9 404 468 A Q H 3< S+ 0 0 100 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.785 117.2 28.6 -49.7 -36.5 33.2 -13.0 -12.1 405 469 A R H 3< S+ 0 0 108 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.506 130.1 35.3-107.5 -5.5 33.3 -16.8 -12.2 406 470 A D H X< S+ 0 0 27 -4,-1.2 3,-1.3 -3,-0.8 4,-0.4 0.564 88.3 87.3-123.1 -12.9 35.0 -17.6 -8.9 407 471 A Q G >< S+ 0 0 20 -4,-2.7 3,-0.8 1,-0.3 -3,-0.1 0.724 80.1 65.1 -65.8 -25.6 33.9 -15.1 -6.2 408 472 A S G 3 S+ 0 0 79 -5,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.724 90.6 68.1 -70.0 -20.4 30.7 -17.0 -5.2 409 473 A L G < S+ 0 0 117 -3,-1.3 2,-0.8 6,-0.1 -1,-0.2 0.747 71.4 97.7 -73.7 -27.2 32.9 -19.8 -3.8 410 474 A V < + 0 0 2 -3,-0.8 3,-0.1 -4,-0.4 6,-0.0 -0.550 38.1 150.0 -67.5 106.1 34.3 -17.7 -1.0 411 475 A E + 0 0 133 -2,-0.8 2,-0.2 1,-0.1 -1,-0.2 0.486 64.7 6.0-115.7 -16.7 32.1 -18.8 1.9 412 476 A D S > S- 0 0 73 -3,-0.1 4,-1.7 1,-0.1 -1,-0.1 -0.865 92.0 -75.6-153.5-173.8 34.5 -18.3 4.7 413 477 A M H > S+ 0 0 33 -2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.918 125.7 46.5 -59.1 -50.8 38.0 -17.0 5.6 414 478 A D H > S+ 0 0 116 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.875 110.5 53.4 -62.8 -40.2 40.0 -20.0 4.2 415 479 A A H > S+ 0 0 23 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.846 109.3 50.7 -61.9 -35.2 37.9 -19.8 1.0 416 480 A M H X S+ 0 0 0 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.921 109.2 49.0 -68.3 -47.2 38.8 -16.1 0.7 417 481 A V H X S+ 0 0 13 -4,-2.3 4,-2.0 1,-0.2 5,-0.2 0.935 108.6 54.3 -56.8 -48.9 42.6 -16.7 1.2 418 482 A R H < S+ 0 0 185 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.843 113.2 42.3 -56.4 -38.4 42.5 -19.5 -1.5 419 483 A L H >< S+ 0 0 15 -4,-1.3 3,-1.1 2,-0.2 -1,-0.2 0.929 113.9 49.3 -72.9 -48.1 40.9 -17.1 -4.0 420 484 A M H 3< S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.720 117.4 43.3 -66.5 -21.3 43.1 -14.1 -3.1 421 485 A R T 3< S+ 0 0 4 -4,-2.0 75,-0.3 -5,-0.2 -1,-0.3 0.485 88.9 130.7 -95.3 -7.3 46.1 -16.3 -3.5 422 486 A Y < + 0 0 33 -3,-1.1 25,-1.9 -4,-0.3 24,-0.8 -0.226 17.8 148.5 -61.4 129.6 44.9 -18.0 -6.6 423 487 A N + 0 0 1 23,-0.2 75,-0.3 22,-0.2 74,-0.3 -0.728 7.1 147.7-161.6 108.8 47.2 -18.3 -9.6 424 488 A D >> + 0 0 31 -2,-0.2 4,-1.7 73,-0.1 3,-1.3 -0.430 14.6 158.0-137.7 57.5 47.1 -21.1 -12.2 425 489 A F T 34 + 0 0 15 1,-0.3 16,-0.2 2,-0.2 6,-0.2 0.737 68.1 57.9 -62.9 -28.5 48.2 -19.3 -15.3 426 490 A L T 34 S+ 0 0 113 1,-0.2 -1,-0.3 14,-0.1 16,-0.0 0.780 121.1 24.9 -70.0 -28.9 49.4 -22.4 -17.2 427 491 A H T <4 S+ 0 0 142 -3,-1.3 -2,-0.2 1,-0.0 -1,-0.2 0.454 99.0 92.0-121.3 -5.9 46.0 -24.2 -17.0 428 492 A D >< - 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