==== 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/RNA 06-JUL-09 3I5Y . COMPND 2 MOLECULE: ATP-DEPENDENT RNA HELICASE MSS116; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR M.DEL CAMPO,A.M.LAMBOWITZ . 509 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21918.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 369 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 80 15.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 0 0.0 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 . 36 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 177 34.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 1 2 1 3 1 1 1 3 0 1 1 3 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 6 5 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 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 1 1 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 88 A S 0 0 110 0, 0.0 2,-0.3 0, 0.0 236,-0.1 0.000 360.0 360.0 360.0 178.8 96.6 34.4 25.5 2 89 A K E -a 237 0A 136 234,-1.5 236,-1.4 1,-0.1 2,-0.6 -0.468 360.0-160.3 -76.2 129.3 94.5 35.7 28.3 3 90 A L E -a 238 0A 50 -2,-0.3 2,-0.8 234,-0.2 236,-0.2 -0.928 3.4-158.5-112.6 110.8 90.9 34.4 28.6 4 91 A I E -a 239 0A 50 234,-2.2 236,-2.8 -2,-0.6 2,-0.3 -0.797 11.4-145.2 -94.2 108.0 88.5 36.6 30.6 5 92 A H E -a 240 0A 99 -2,-0.8 236,-0.1 234,-0.2 234,-0.1 -0.537 17.5-177.9 -69.2 131.4 85.4 34.7 31.9 6 93 A V E -a 241 0A 51 234,-2.1 236,-1.9 -2,-0.3 3,-0.1 -0.759 20.5-168.8-126.7 83.7 82.2 36.6 32.0 7 94 A P - 0 0 89 0, 0.0 2,-0.2 0, 0.0 238,-0.1 -0.060 33.5 -65.8 -73.9 174.9 79.7 34.1 33.5 8 95 A K - 0 0 94 236,-0.3 2,-0.4 2,-0.0 235,-0.1 -0.383 45.0-163.7 -68.6 126.0 75.9 34.2 33.7 9 96 A E - 0 0 60 -2,-0.2 3,-0.0 -3,-0.1 -1,-0.0 -0.921 8.1-166.0-108.0 138.3 74.5 36.9 36.0 10 97 A D S S+ 0 0 109 -2,-0.4 -1,-0.1 1,-0.1 -2,-0.0 0.320 84.0 42.7-107.4 4.9 70.8 36.6 37.1 11 98 A N S S+ 0 0 104 2,-0.1 -1,-0.1 0, 0.0 3,-0.1 0.289 80.9 125.0-131.3 7.1 70.2 40.2 38.5 12 99 A S - 0 0 88 1,-0.1 2,-0.3 -3,-0.0 3,-0.0 -0.221 69.8 -84.9 -73.6 162.8 72.0 42.5 36.0 13 100 A K - 0 0 95 1,-0.1 2,-0.4 0, 0.0 -1,-0.1 -0.495 43.6-110.4 -79.6 131.1 70.2 45.4 34.2 14 101 A E - 0 0 136 -2,-0.3 2,-0.2 -3,-0.1 -1,-0.1 -0.405 30.8-147.8 -64.4 112.3 68.2 44.6 31.0 15 102 A V - 0 0 41 -2,-0.4 27,-0.4 29,-0.1 2,-0.3 -0.516 22.5-177.5 -77.2 149.3 69.9 46.1 28.0 16 103 A T > - 0 0 39 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.928 42.2-107.1-145.2 165.0 67.6 47.3 25.1 17 104 A L H > S+ 0 0 26 -2,-0.3 4,-2.0 2,-0.2 9,-0.2 0.940 120.1 49.4 -58.5 -50.3 67.7 48.8 21.6 18 105 A D H > S+ 0 0 114 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.945 112.0 47.5 -54.4 -52.5 66.5 52.1 23.0 19 106 A S H > S+ 0 0 46 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.914 110.7 51.3 -60.7 -43.3 69.2 52.2 25.8 20 107 A L H X>S+ 0 0 3 -4,-2.5 6,-1.7 2,-0.2 5,-1.3 0.838 110.1 51.5 -62.6 -32.9 71.9 51.3 23.3 21 108 A L H ><5S+ 0 0 61 -4,-2.0 3,-1.1 -3,-0.3 -2,-0.2 0.972 113.9 40.5 -65.6 -55.7 70.8 54.1 21.0 22 109 A E H 3<5S+ 0 0 119 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.803 111.2 59.8 -64.6 -30.8 70.8 56.9 23.6 23 110 A E H 3<5S- 0 0 97 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.663 114.5-114.7 -72.7 -19.6 74.1 55.4 25.1 24 111 A G T <<5S+ 0 0 64 -3,-1.1 -3,-0.2 -4,-0.7 -2,-0.1 0.380 90.0 102.9 102.1 -2.5 76.0 55.9 21.8 25 112 A V S > - 0 0 62 -2,-0.4 4,-2.0 1,-0.1 3,-0.6 -0.494 28.3-108.4 -84.3 158.0 73.3 54.4 15.4 28 115 A K H 3> S+ 0 0 51 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.853 114.9 56.6 -54.9 -39.0 69.7 55.5 14.6 29 116 A E H 3> S+ 0 0 80 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.822 110.2 41.4 -70.2 -32.7 69.7 53.5 11.3 30 117 A I H <> S+ 0 0 0 -3,-0.6 4,-1.6 2,-0.2 5,-0.2 0.862 113.3 53.9 -82.1 -36.6 70.5 50.1 12.8 31 118 A H H X S+ 0 0 24 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.851 108.2 52.6 -56.3 -38.2 68.1 50.7 15.7 32 119 A K H X S+ 0 0 97 -4,-1.7 4,-1.6 -5,-0.2 -1,-0.2 0.886 107.2 50.5 -67.1 -41.3 65.4 51.5 13.1 33 120 A A H < S+ 0 0 0 -4,-1.1 4,-0.2 1,-0.2 -1,-0.2 0.828 115.9 39.8 -69.6 -35.4 65.9 48.2 11.3 34 121 A I H >< S+ 0 0 4 -4,-1.6 3,-0.8 2,-0.2 5,-0.5 0.788 110.5 57.0 -86.6 -34.1 65.7 46.0 14.3 35 122 A T H >< S+ 0 0 64 -4,-1.9 3,-2.0 1,-0.2 -2,-0.2 0.911 100.4 60.5 -61.7 -41.1 62.9 47.8 16.1 36 123 A R T 3< S+ 0 0 129 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.667 91.4 67.5 -62.5 -18.4 60.7 47.3 13.0 37 124 A M T < S- 0 0 36 -3,-0.8 -1,-0.3 -4,-0.2 -2,-0.2 0.639 100.8-137.8 -74.3 -16.3 61.0 43.5 13.4 38 125 A E < + 0 0 104 -3,-2.0 -3,-0.1 -4,-0.3 -2,-0.1 0.898 35.2 170.8 61.2 49.5 58.9 43.9 16.6 39 126 A F - 0 0 102 -5,-0.5 -1,-0.2 1,-0.1 -2,-0.1 -0.743 44.0-120.7 -85.8 138.0 60.8 41.6 19.0 40 127 A P S S- 0 0 147 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.860 82.0 -46.5 -43.1 -47.4 59.7 41.8 22.6 41 128 A G S S- 0 0 31 -25,-0.1 2,-0.3 -24,-0.0 -25,-0.1 -0.864 78.7 -59.1-160.6-164.1 63.2 42.8 23.5 42 129 A L - 0 0 11 -27,-0.4 -27,-0.1 -2,-0.2 28,-0.1 -0.755 58.6-112.2 -89.0 143.0 66.8 41.7 22.8 43 130 A T > - 0 0 36 -2,-0.3 4,-3.0 27,-0.1 5,-0.2 -0.194 30.4-101.6 -69.4 165.2 67.7 38.1 23.8 44 131 A P H > S+ 0 0 88 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.914 124.5 44.9 -55.7 -45.5 70.2 37.4 26.6 45 132 A V H > S+ 0 0 0 24,-0.3 4,-1.8 2,-0.2 5,-0.2 0.901 113.2 51.7 -65.6 -40.8 73.1 36.7 24.2 46 133 A Q H > S+ 0 0 8 23,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.922 111.6 46.6 -59.3 -46.5 72.2 39.8 22.2 47 134 A Q H < S+ 0 0 41 -4,-3.0 4,-0.4 1,-0.2 -2,-0.2 0.894 116.1 46.0 -61.2 -40.5 72.2 42.0 25.3 48 135 A K H < S+ 0 0 48 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.745 119.1 35.7 -78.5 -26.0 75.5 40.5 26.5 49 136 A T H X S+ 0 0 0 -4,-1.8 4,-2.9 -5,-0.1 5,-0.3 0.765 94.0 76.3-103.7 -28.6 77.5 40.6 23.3 50 137 A I H X S+ 0 0 0 -4,-1.7 4,-1.5 -5,-0.2 -3,-0.1 0.898 101.4 39.3 -61.2 -47.6 76.6 43.8 21.2 51 138 A K H > S+ 0 0 108 -4,-0.4 4,-1.4 2,-0.2 -1,-0.2 0.956 117.6 48.2 -69.3 -50.9 78.5 46.4 23.3 52 139 A P H >4 S+ 0 0 29 0, 0.0 3,-0.6 0, 0.0 -2,-0.2 0.927 109.0 53.4 -53.1 -47.3 81.6 44.2 23.9 53 140 A I H 3< S+ 0 0 3 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.905 116.2 40.5 -55.0 -39.8 81.9 43.2 20.3 54 141 A L H 3< S+ 0 0 28 -4,-1.5 -1,-0.2 -5,-0.3 -3,-0.1 0.619 88.7 121.1 -84.3 -13.4 81.9 46.9 19.3 55 142 A S << - 0 0 28 -4,-1.4 4,-0.3 -3,-0.6 -4,-0.0 -0.240 67.7-133.1 -56.0 135.7 84.1 48.0 22.3 56 143 A S S S+ 0 0 122 2,-0.1 2,-0.2 0, 0.0 -1,-0.2 0.413 73.3 116.6 -74.5 0.6 87.3 49.7 21.1 57 144 A E S S- 0 0 110 -5,-0.1 2,-1.8 1,-0.1 0, 0.0 -0.504 80.5-113.8 -62.7 141.7 89.2 47.4 23.6 58 145 A D + 0 0 87 -2,-0.2 179,-0.8 180,-0.0 178,-0.5 -0.545 69.9 122.9 -88.9 76.3 91.5 45.2 21.6 59 146 A H E -b 237 0A 3 -2,-1.8 179,-0.2 -4,-0.3 2,-0.2 -0.950 55.5-129.6-138.3 153.5 89.9 41.8 22.2 60 147 A D E -b 238 0A 0 177,-2.2 179,-2.5 -2,-0.3 2,-0.4 -0.531 29.5-134.5 -88.7 167.4 88.4 38.8 20.5 61 148 A V E -bc 239 215A 1 153,-2.4 155,-2.6 177,-0.2 2,-0.4 -0.991 18.3-173.7-131.8 129.2 85.0 37.4 21.6 62 149 A I E -bc 240 216A 0 177,-3.1 179,-3.5 -2,-0.4 2,-0.4 -0.963 15.8-175.4-111.8 141.9 83.7 33.9 22.4 63 150 A A E -bc 241 217A 0 153,-2.1 155,-1.6 -2,-0.4 2,-0.5 -0.986 12.9-167.7-143.7 127.4 80.0 33.6 23.1 64 151 A R E +bc 242 218A 14 177,-1.6 179,-2.3 -2,-0.4 180,-0.4 -0.969 20.6 153.2-115.4 124.2 77.9 30.6 24.1 65 152 A A - 0 0 0 153,-1.1 3,-0.1 -2,-0.5 5,-0.1 -0.978 42.9 -92.2-145.8 158.2 74.1 30.7 24.0 66 153 A K > - 0 0 16 -2,-0.3 3,-1.5 1,-0.2 5,-0.3 -0.100 52.4 -77.6 -73.2 161.5 71.5 28.1 23.6 67 154 A T T 3 S+ 0 0 4 183,-0.3 -1,-0.2 1,-0.2 316,-0.1 -0.334 114.9 16.2 -53.6 128.2 69.8 26.9 20.4 68 155 A G T 3 S+ 0 0 12 314,-0.1 315,-1.7 -3,-0.1 -1,-0.2 0.495 86.8 114.6 93.5 9.2 67.2 29.4 19.2 69 156 A T S < S- 0 0 30 -3,-1.5 -23,-0.4 313,-0.1 -24,-0.3 0.121 89.6 -95.6-108.9 22.7 68.1 32.4 21.2 70 157 A G > + 0 0 24 -25,-0.1 4,-1.5 -26,-0.1 3,-0.3 0.734 63.0 154.4 84.0 27.4 69.2 34.7 18.3 71 158 A K H > + 0 0 19 -5,-0.3 4,-0.8 1,-0.2 5,-0.2 0.820 69.8 68.9 -51.2 -33.8 73.0 34.4 18.2 72 159 A T H >> S+ 0 0 28 1,-0.2 4,-2.2 2,-0.2 3,-1.7 0.959 105.8 35.8 -54.0 -59.0 72.8 35.4 14.5 73 160 A F H 3> S+ 0 0 13 -3,-0.3 4,-1.8 1,-0.3 -1,-0.2 0.733 102.5 76.6 -70.0 -21.2 71.7 39.1 15.2 74 161 A A H 3< S+ 0 0 0 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.780 113.9 22.7 -53.8 -28.2 74.0 38.9 18.2 75 162 A F H S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.847 112.5 56.4 -63.2 -32.3 77.4 44.9 15.8 79 166 A I H X S+ 0 0 2 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.951 106.8 48.4 -63.9 -48.8 78.8 44.2 12.4 80 167 A F H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.914 109.2 54.2 -56.0 -44.0 76.4 46.7 10.8 81 168 A Q H X S+ 0 0 6 -4,-1.9 4,-3.3 1,-0.2 -1,-0.2 0.892 106.5 51.2 -58.0 -41.8 77.3 49.3 13.4 82 169 A H H X S+ 0 0 29 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.870 107.9 52.5 -65.1 -36.2 81.0 48.9 12.6 83 170 A L H < S+ 0 0 2 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.848 112.9 45.2 -66.1 -33.4 80.2 49.5 8.9 84 171 A I H >< S+ 0 0 15 -4,-1.9 3,-2.1 2,-0.2 -2,-0.2 0.970 109.8 54.1 -72.8 -53.8 78.3 52.7 9.9 85 172 A N H 3< S+ 0 0 101 -4,-3.3 -2,-0.2 1,-0.3 3,-0.2 0.804 122.2 30.6 -43.0 -40.4 81.1 53.8 12.2 86 173 A T T >< S+ 0 0 30 -4,-1.7 3,-1.3 -5,-0.2 -1,-0.3 -0.106 79.2 134.6-115.6 33.8 83.6 53.5 9.4 87 174 A K T < S+ 0 0 76 -3,-2.1 -1,-0.1 1,-0.3 -2,-0.1 0.780 72.5 47.2 -60.1 -32.5 81.4 54.3 6.4 88 175 A F T 3 S+ 0 0 166 -4,-0.2 2,-0.5 -3,-0.2 3,-0.3 0.582 97.1 85.2 -86.3 -10.5 83.8 56.7 4.5 89 176 A D S < S- 0 0 100 -3,-1.3 4,-0.2 1,-0.2 -3,-0.1 -0.832 113.0 -21.9 -99.0 123.3 86.8 54.4 4.9 90 177 A S S > S+ 0 0 45 -2,-0.5 3,-2.1 1,-0.1 -1,-0.2 0.854 76.8 174.3 54.4 43.6 87.5 51.6 2.3 91 178 A Q T 3 S+ 0 0 89 -3,-0.3 -1,-0.1 1,-0.3 -2,-0.1 0.643 71.8 51.7 -65.1 -17.5 83.8 51.7 1.4 92 179 A Y T 3 S+ 0 0 141 2,-0.1 2,-0.3 58,-0.1 -1,-0.3 0.138 97.3 96.5 -99.1 19.6 84.1 49.2 -1.5 93 180 A M S < S- 0 0 40 -3,-2.1 2,-0.5 -4,-0.2 78,-0.1 -0.856 81.7-107.4-119.6 146.0 85.9 46.7 0.6 94 181 A V + 0 0 0 76,-1.9 79,-0.4 -2,-0.3 56,-0.2 -0.544 38.9 168.4 -66.4 117.2 84.9 43.5 2.6 95 182 A K + 0 0 6 55,-2.1 80,-2.4 -2,-0.5 81,-1.8 0.574 63.3 41.2-105.0 -18.0 85.1 44.5 6.3 96 183 A A E -de 151 176A 2 54,-1.6 56,-2.6 79,-0.2 2,-0.5 -0.993 60.5-168.7-137.0 127.8 83.3 41.5 7.8 97 184 A V E -de 152 177A 0 79,-2.3 81,-2.7 -2,-0.4 2,-0.5 -0.960 5.5-168.2-120.3 112.9 83.7 37.8 6.8 98 185 A I E -de 153 178A 0 54,-2.9 56,-2.9 -2,-0.5 2,-0.4 -0.884 6.7-167.4-101.2 123.8 81.2 35.3 8.3 99 186 A V E -de 154 179A 2 79,-3.3 81,-2.2 -2,-0.5 56,-0.2 -0.881 6.2-178.7-111.6 143.2 82.1 31.6 7.9 100 187 A A - 0 0 0 54,-2.1 81,-0.1 -2,-0.4 6,-0.1 -0.973 34.3-122.2-140.4 157.6 79.7 28.7 8.5 101 188 A P S S+ 0 0 15 0, 0.0 2,-0.3 0, 0.0 54,-0.1 0.642 93.7 38.7 -76.2 -19.1 80.0 24.8 8.3 102 189 A T S > S- 0 0 23 1,-0.1 4,-1.6 52,-0.1 3,-0.3 -0.950 74.9-128.3-131.1 156.3 77.2 24.3 5.7 103 190 A R H > S+ 0 0 77 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.909 108.6 55.9 -65.9 -46.3 76.1 26.2 2.6 104 191 A D H > S+ 0 0 4 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.745 107.0 50.0 -61.6 -27.5 72.5 26.4 3.7 105 192 A L H > S+ 0 0 1 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.847 110.2 50.6 -79.0 -34.3 73.5 28.1 7.0 106 193 A A H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.931 112.4 47.3 -61.6 -45.3 75.7 30.6 5.0 107 194 A L H X S+ 0 0 36 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.815 109.8 53.8 -69.1 -28.5 72.6 31.2 2.8 108 195 A Q H X S+ 0 0 6 -4,-1.2 4,-1.6 -5,-0.2 -1,-0.2 0.881 107.9 49.2 -69.2 -39.3 70.4 31.6 5.9 109 196 A I H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 3,-0.3 0.950 109.6 51.0 -69.1 -46.2 72.7 34.2 7.4 110 197 A E H X S+ 0 0 20 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.911 107.7 55.6 -49.2 -44.8 72.8 36.2 4.2 111 198 A A H X S+ 0 0 38 -4,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.874 106.5 48.8 -60.5 -40.1 69.0 36.0 4.3 112 199 A E H X S+ 0 0 19 -4,-1.6 4,-1.9 -3,-0.3 -1,-0.2 0.904 108.7 52.9 -67.0 -43.9 68.9 37.6 7.7 113 200 A V H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.896 108.4 51.4 -55.0 -40.5 71.2 40.3 6.5 114 201 A K H X S+ 0 0 98 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.849 105.2 56.1 -67.0 -32.2 68.7 40.9 3.7 115 202 A K H X S+ 0 0 102 -4,-1.7 4,-1.0 2,-0.2 -1,-0.2 0.855 105.8 50.6 -64.2 -37.5 65.9 41.1 6.3 116 203 A I H < S+ 0 0 0 -4,-1.9 3,-0.4 1,-0.2 4,-0.4 0.921 110.4 51.5 -63.4 -42.9 67.9 43.9 8.0 117 204 A H H >< S+ 0 0 17 -4,-2.0 3,-1.1 1,-0.2 7,-0.3 0.879 107.4 50.9 -58.3 -42.7 68.1 45.6 4.6 118 205 A D H 3< S+ 0 0 90 -4,-2.0 3,-0.3 1,-0.3 -1,-0.2 0.691 105.5 55.7 -77.2 -19.1 64.3 45.4 3.9 119 206 A M T 3< S+ 0 0 67 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.445 125.8 20.5 -86.0 -5.6 63.4 46.9 7.3 120 207 A N X - 0 0 12 -3,-1.1 3,-2.6 -4,-0.4 4,-0.4 -0.519 61.7-165.2-163.0 94.8 65.6 49.9 6.4 121 208 A Y G > S+ 0 0 168 1,-0.3 3,-0.8 -3,-0.3 4,-0.3 0.678 88.1 73.2 -56.4 -17.2 66.5 50.7 2.7 122 209 A G G > S+ 0 0 39 1,-0.2 3,-0.6 2,-0.1 -1,-0.3 0.764 91.1 55.1 -65.0 -28.1 69.2 53.0 4.1 123 210 A L G X S+ 0 0 1 -3,-2.6 3,-1.7 -6,-0.3 -1,-0.2 0.527 80.8 90.7 -85.4 -7.2 71.3 50.1 5.2 124 211 A K G < S+ 0 0 104 -3,-0.8 -1,-0.2 -4,-0.4 -2,-0.1 0.780 71.5 71.9 -58.5 -29.9 71.4 48.5 1.6 125 212 A K G < S+ 0 0 126 -3,-0.6 2,-1.5 -4,-0.3 -1,-0.3 0.769 84.4 72.9 -55.9 -27.9 74.6 50.5 0.9 126 213 A Y S < S- 0 0 13 -3,-1.7 -1,-0.2 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443 530 A V H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.886 112.7 54.9 -68.0 -39.4 73.4 -1.0 5.4 444 531 A I H X S+ 0 0 35 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.933 104.8 52.8 -59.8 -45.0 77.1 -0.9 4.4 445 532 A S H X S+ 0 0 23 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.872 109.4 51.4 -57.4 -35.6 77.0 2.9 4.6 446 533 A L H X S+ 0 0 0 -4,-1.4 4,-2.9 2,-0.2 5,-0.2 0.851 105.3 53.7 -69.7 -37.5 75.6 2.5 8.2 447 534 A I H X S+ 0 0 13 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.965 112.0 45.6 -60.0 -50.7 78.4 0.1 9.2 448 535 A S H X S+ 0 0 72 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.921 113.5 50.1 -55.0 -48.5 80.9 2.7 8.2 449 536 A S H X S+ 0 0 32 -4,-2.2 4,-0.8 1,-0.2 3,-0.3 0.946 115.1 41.5 -57.4 -53.2 79.0 5.4 9.9 450 537 A Y H < S+ 0 0 0 -4,-2.9 3,-0.3 1,-0.2 4,-0.3 0.789 109.1 61.0 -68.0 -27.8 78.7 3.5 13.2 451 538 A R H >< S+ 0 0 84 -4,-2.5 3,-0.9 -5,-0.2 4,-0.3 0.882 99.5 57.1 -63.6 -38.7 82.3 2.3 12.9 452 539 A S H 3< S+ 0 0 100 -4,-1.8 4,-0.3 -3,-0.3 3,-0.2 0.807 110.2 41.7 -61.5 -33.6 83.6 5.9 13.0 453 540 A C T 3X S+ 0 0 4 -4,-0.8 4,-2.6 -3,-0.3 -1,-0.2 0.234 79.7 103.7-107.7 14.9 82.0 6.8 16.3 454 541 A I T <4>S+ 0 0 21 -3,-0.9 5,-2.4 -4,-0.3 4,-0.4 0.937 88.9 40.6 -59.8 -50.7 82.7 3.6 18.4 455 542 A K T >45S+ 0 0 145 -4,-0.3 3,-0.7 -3,-0.2 -1,-0.2 0.918 117.0 49.6 -63.9 -44.5 85.5 5.2 20.4 456 543 A E T 345S+ 0 0 80 -4,-0.3 -2,-0.2 1,-0.2 -1,-0.2 0.877 120.7 34.4 -64.1 -40.1 83.6 8.5 20.8 457 544 A Y T 3<5S- 0 0 0 -4,-2.6 -1,-0.2 -55,-0.0 -54,-0.2 0.288 108.0-120.6-100.5 10.2 80.4 6.8 22.0 458 545 A R T < 5 + 0 0 117 -3,-0.7 -3,-0.2 -4,-0.4 2,-0.2 0.908 50.9 172.4 51.6 49.8 82.1 4.0 23.9 459 546 A F < - 0 0 16 -5,-2.4 2,-0.8 -6,-0.2 -1,-0.2 -0.511 40.3-117.6 -84.7 156.4 80.4 1.2 21.8 460 547 A S >> - 0 0 31 -64,-0.3 4,-3.2 -2,-0.2 3,-1.0 -0.871 22.0-157.3 -89.0 109.7 81.2 -2.5 21.9 461 548 A E H 3> S+ 0 0 75 -2,-0.8 4,-1.4 1,-0.2 -1,-0.2 0.868 91.2 55.2 -55.5 -40.2 82.4 -3.2 18.4 462 549 A R H 34 S+ 0 0 174 1,-0.1 -1,-0.2 2,-0.1 -2,-0.0 0.707 119.6 31.2 -69.9 -21.4 81.5 -6.9 18.7 463 550 A R H <> S+ 0 0 129 -3,-1.0 4,-1.4 3,-0.1 -2,-0.2 0.854 119.9 47.2 -98.6 -50.6 77.9 -6.0 19.6 464 551 A I H X S+ 0 0 0 -4,-3.2 4,-1.9 1,-0.2 -3,-0.2 0.880 109.7 49.4 -62.8 -44.7 77.1 -2.8 17.8 465 552 A L H X S+ 0 0 0 -4,-1.4 4,-2.2 -5,-0.3 -1,-0.2 0.873 110.3 47.9 -73.2 -40.2 78.5 -3.7 14.3 466 553 A P H > S+ 0 0 30 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.847 110.7 54.7 -64.5 -32.9 76.7 -7.1 13.9 467 554 A E H < S+ 0 0 19 -4,-1.4 4,-0.4 2,-0.2 -201,-0.3 0.904 109.6 45.6 -65.1 -42.1 73.5 -5.4 15.0 468 555 A I H >< S+ 0 0 0 -4,-1.9 3,-1.4 1,-0.2 4,-0.3 0.935 113.5 50.0 -65.0 -44.5 73.8 -2.7 12.3 469 556 A A H >< S+ 0 0 4 -4,-2.2 3,-1.5 1,-0.3 4,-0.4 0.800 99.8 64.6 -65.1 -30.4 74.6 -5.3 9.7 470 557 A S T 3X S+ 0 0 28 -4,-1.8 4,-1.8 1,-0.3 -1,-0.3 0.581 81.3 81.7 -70.8 -12.3 71.6 -7.5 10.7 471 558 A T H <> S+ 0 0 1 -3,-1.4 4,-2.3 -4,-0.4 -1,-0.3 0.830 83.8 61.8 -54.1 -36.4 69.5 -4.6 9.5 472 559 A Y H <> S+ 0 0 12 -3,-1.5 4,-1.5 -4,-0.3 -1,-0.2 0.922 105.6 44.5 -57.4 -47.1 70.0 -6.1 6.0 473 560 A G H 4>S+ 0 0 0 -4,-0.4 5,-2.7 8,-0.2 4,-0.5 0.874 111.4 52.8 -65.7 -39.9 68.3 -9.4 7.0 474 561 A V H ><5S+ 0 0 11 -4,-1.8 3,-0.6 3,-0.2 -2,-0.2 0.914 109.2 48.9 -65.0 -42.9 65.4 -7.6 8.8 475 562 A L H 3<5S+ 0 0 15 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.828 114.7 43.8 -68.6 -34.6 64.6 -5.5 5.7 476 563 A L T 3<5S- 0 0 63 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.474 115.5-121.6 -84.1 -3.9 64.7 -8.5 3.4 477 564 A N T < 5S+ 0 0 107 -3,-0.6 -3,-0.2 -4,-0.5 -2,-0.1 0.753 83.5 106.1 69.2 29.6 62.7 -10.3 6.1 478 565 A D > < - 0 0 73 -5,-2.7 3,-2.2 -6,-0.2 -2,-0.1 -0.750 50.1-169.2-135.3 87.2 65.2 -13.2 6.6 479 566 A P T 3 S+ 0 0 100 0, 0.0 -6,-0.2 0, 0.0 -5,-0.2 0.706 83.5 48.3 -52.8 -31.8 67.0 -12.5 9.9 480 567 A Q T 3 S+ 0 0 175 -7,-0.1 2,-0.3 2,-0.1 -6,-0.0 0.435 86.3 105.8 -93.5 -0.2 69.7 -15.2 9.5 481 568 A L < - 0 0 65 -3,-2.2 2,-0.3 -11,-0.1 -8,-0.2 -0.606 59.5-152.4 -76.0 138.9 70.6 -14.1 6.0 482 569 A K - 0 0 72 -2,-0.3 23,-0.2 -10,-0.1 22,-0.1 -0.747 26.5 -85.5-115.3 163.6 73.9 -12.1 5.8 483 570 A I E -n 505 0C 0 21,-1.4 23,-2.3 -2,-0.3 2,-0.4 -0.505 43.2-125.8 -74.1 120.4 75.2 -9.5 3.5 484 571 A P E +n 506 0C 56 0, 0.0 2,-0.3 0, 0.0 23,-0.2 -0.541 46.5 151.4 -69.0 123.7 76.9 -11.0 0.4 485 572 A V E -n 507 0C 13 21,-2.5 23,-1.7 -2,-0.4 24,-0.2 -0.867 40.0-107.0-141.3 173.2 80.5 -9.6 -0.1 486 573 A S > - 0 0 58 -2,-0.3 4,-1.9 21,-0.2 5,-0.1 -0.654 26.3-119.2-100.8 161.5 83.9 -10.6 -1.5 487 574 A R H > S+ 0 0 65 -2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.865 116.7 56.6 -64.8 -37.6 87.1 -11.6 0.3 488 575 A R H > S+ 0 0 76 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.843 108.3 47.1 -61.7 -35.8 88.8 -8.6 -1.3 489 576 A F H > S+ 0 0 75 2,-0.2 4,-1.3 1,-0.2 3,-0.3 0.870 109.2 53.4 -72.2 -39.3 86.1 -6.3 0.2 490 577 A L H X>S+ 0 0 18 -4,-1.9 5,-1.8 1,-0.2 4,-0.6 0.812 105.8 54.8 -63.5 -32.7 86.5 -7.9 3.6 491 578 A D H <5S+ 0 0 93 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.758 102.1 56.5 -73.8 -27.7 90.2 -7.2 3.5 492 579 A K H <5S+ 0 0 106 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.875 106.6 50.6 -67.0 -38.1 89.6 -3.5 2.9 493 580 A L H <5S- 0 0 34 -4,-1.3 -2,-0.2 1,-0.0 -1,-0.2 0.683 110.2-127.3 -72.1 -19.7 87.5 -3.4 6.1 494 581 A G T <5S+ 0 0 61 -4,-0.6 -3,-0.2 -5,-0.1 -2,-0.1 0.823 80.7 108.3 75.1 33.6 90.4 -5.1 8.0 495 582 A L > < + 0 0 9 -5,-1.8 3,-1.5 1,-0.1 6,-0.3 0.144 28.8 112.6-126.2 16.2 88.1 -7.9 9.3 496 583 A S T 3 S+ 0 0 65 -6,-0.4 -5,-0.1 1,-0.3 -1,-0.1 0.785 93.6 34.4 -64.1 -25.5 89.2 -11.0 7.3 497 584 A R T 3 S+ 0 0 239 -3,-0.1 -1,-0.3 -6,-0.1 -2,-0.1 0.207 100.6 105.8-107.9 10.8 90.6 -12.5 10.6 498 585 A S <> - 0 0 30 -3,-1.5 4,-1.0 1,-0.1 3,-0.1 -0.764 61.4-151.0 -97.2 134.5 87.9 -11.0 12.8 499 586 A P H > S+ 0 0 106 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.796 101.7 63.3 -68.3 -26.8 85.0 -13.0 14.3 500 587 A I H > S+ 0 0 26 1,-0.2 4,-1.1 2,-0.2 -5,-0.1 0.878 102.0 50.4 -60.6 -38.9 82.9 -9.8 14.1 501 588 A G H > S+ 0 0 2 -6,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.800 104.7 56.2 -70.3 -31.5 83.4 -10.0 10.3 502 589 A K H < S+ 0 0 110 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.860 108.4 49.2 -66.5 -35.0 82.2 -13.6 10.2 503 590 A A H < S+ 0 0 57 -4,-1.5 -2,-0.2 1,-0.1 -1,-0.2 0.776 115.3 42.2 -73.9 -28.5 79.0 -12.5 11.9 504 591 A M H < S+ 0 0 4 -4,-1.1 -21,-1.4 -5,-0.1 2,-0.3 0.869 113.5 37.6 -88.1 -41.0 78.2 -9.6 9.6 505 592 A F E < -n 483 0C 11 -4,-1.8 2,-0.4 -23,-0.2 -1,-0.1 -0.802 54.6-151.2-121.8 152.8 79.0 -10.9 6.1 506 593 A E E -n 484 0C 85 -23,-2.3 -21,-2.5 -2,-0.3 2,-0.9 -0.984 28.7-124.9-115.9 135.5 78.7 -14.0 3.9 507 594 A I E +n 485 0C 90 -2,-0.4 -21,-0.2 -23,-0.2 -20,-0.0 -0.713 35.3 168.0 -81.8 106.4 81.3 -14.5 1.2 508 595 A R 0 0 131 -23,-1.7 -22,-0.1 -2,-0.9 -1,-0.1 -0.275 360.0 360.0-111.4 43.6 79.3 -14.9 -2.1 509 596 A D 0 0 110 -24,-0.2 -23,-0.1 0, 0.0 -1,-0.1 0.917 360.0 360.0 -94.1 360.0 82.3 -14.6 -4.4