==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA/RNA 10-JUL-07 2QKB . COMPND 2 MOLECULE: RIBONUCLEASE H1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.NOWOTNY,S.A.GAIDAMAKOV,R.GHIRLANDO,S.M.CERRITELLI, . 302 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16442.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 214 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 11.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 25 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 30.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.6 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 0 1 0 2 0 1 1 0 1 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 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 PARALLEL BRIDGES PER LADDER . 2 2 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 1 133 A G 0 0 82 0, 0.0 2,-0.3 0, 0.0 32,-0.1 0.000 360.0 360.0 360.0 125.2 27.1 -1.8 7.1 2 134 A S - 0 0 73 30,-0.6 7,-2.2 7,-0.4 2,-0.3 -0.905 360.0-179.1-124.0 147.5 27.3 1.4 9.2 3 135 A H E -A 8 0A 141 -2,-0.3 2,-0.4 5,-0.3 5,-0.2 -0.976 23.7-158.2-145.9 158.1 25.0 3.6 11.1 4 136 A X E > S-A 7 0A 86 3,-3.3 3,-2.0 -2,-0.3 2,-0.4 -0.896 78.5 -51.9-129.9 98.5 24.6 6.8 13.2 5 137 A G T 3 S- 0 0 65 -2,-0.4 0, 0.0 1,-0.3 0, 0.0 -0.578 123.5 -21.0 68.9-123.6 21.5 6.6 15.3 6 138 A D T 3 S+ 0 0 112 -2,-0.4 2,-0.5 -3,-0.1 -1,-0.3 0.355 120.7 95.4 -99.7 8.2 18.8 5.8 12.7 7 139 A F E < -A 4 0A 27 -3,-2.0 -3,-3.3 66,-0.1 2,-0.4 -0.860 68.4-140.6-103.3 127.8 20.7 7.0 9.7 8 140 A V E -Ab 3 73A 32 64,-1.5 66,-1.9 -2,-0.5 2,-0.3 -0.690 24.6-127.3 -84.1 135.2 22.8 4.6 7.7 9 141 A V E + b 0 74A 11 -7,-2.2 -7,-0.4 -2,-0.4 2,-0.3 -0.665 30.2 178.8 -85.6 133.7 26.1 6.1 6.6 10 142 A V E - b 0 75A 0 64,-2.9 66,-3.2 -2,-0.3 2,-0.4 -0.989 16.2-150.2-137.0 147.6 27.2 6.1 3.0 11 143 A Y E +Cb 31 76A 48 20,-2.5 20,-2.6 -2,-0.3 2,-0.3 -0.934 16.8 178.6-115.3 137.3 30.2 7.5 1.1 12 144 A T E +C 30 0A 0 64,-2.3 66,-0.5 -2,-0.4 2,-0.3 -0.930 3.2 168.6-132.6 158.8 30.2 8.7 -2.5 13 145 A D E -C 29 0A 2 16,-1.9 16,-1.6 -2,-0.3 2,-0.3 -0.958 16.6-153.8-166.5 148.4 32.8 10.1 -4.8 14 146 A G E -C 28 0A 3 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.847 14.0-178.1-121.3 164.5 33.3 10.9 -8.4 15 147 A C E -C 27 0A 11 12,-2.0 12,-2.2 -2,-0.3 2,-0.2 -0.951 10.0-166.4-150.5 171.6 36.5 11.2 -10.3 16 148 A C E > -C 26 0A 20 -2,-0.3 3,-0.9 10,-0.3 10,-0.3 -0.732 14.5-144.1-168.2 107.2 37.6 12.0 -13.8 17 149 A S E 3 S+C 25 0A 51 8,-2.2 8,-2.0 1,-0.3 3,-0.1 -0.527 91.6 15.1 -72.5 142.2 41.0 11.4 -15.4 18 150 A S T > S- 0 0 53 1,-0.2 3,-2.2 6,-0.2 2,-0.3 0.866 84.2-169.8 62.1 40.3 42.0 14.2 -17.8 19 151 A N T < S+ 0 0 75 -3,-0.9 -1,-0.2 1,-0.3 30,-0.1 -0.457 76.0 6.7 -64.1 119.6 39.4 16.6 -16.4 20 152 A G T 3 S+ 0 0 78 28,-0.4 -1,-0.3 -2,-0.3 2,-0.1 0.689 115.3 101.5 80.9 17.1 39.3 19.5 -18.7 21 153 A R S < S- 0 0 187 -3,-2.2 -1,-0.2 -4,-0.1 -4,-0.0 -0.207 90.1 -81.0-111.2-154.8 41.7 17.8 -21.2 22 154 A R S S+ 0 0 219 1,-0.2 -3,-0.1 -2,-0.1 -4,-0.0 0.784 116.2 32.5 -89.3 -28.9 41.2 16.0 -24.5 23 155 A R S S- 0 0 194 -5,-0.1 -1,-0.2 2,-0.0 2,-0.1 -0.577 75.2-172.4-129.7 76.9 40.0 12.6 -23.4 24 156 A P - 0 0 42 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.389 6.4-170.4 -70.9 141.0 38.1 12.8 -20.1 25 157 A R E -C 17 0A 87 -8,-2.0 -8,-2.2 -2,-0.1 2,-0.4 -0.966 10.7-171.5-129.9 112.1 37.1 9.6 -18.3 26 158 A A E -C 16 0A 0 -2,-0.4 18,-2.4 18,-0.3 2,-0.3 -0.871 4.1-178.5-110.5 140.8 34.6 10.1 -15.4 27 159 A G E -CD 15 43A 0 -12,-2.2 -12,-2.0 -2,-0.4 2,-0.3 -0.936 16.5-141.9-135.9 158.2 33.5 7.6 -12.9 28 160 A I E -CD 14 42A 9 14,-2.8 14,-1.2 -2,-0.3 2,-0.3 -0.843 16.8-174.7-114.1 153.7 31.2 7.2 -9.9 29 161 A G E -CD 13 41A 0 -16,-1.6 -16,-1.9 -2,-0.3 2,-0.4 -0.962 9.3-175.6-153.3 131.8 31.7 5.3 -6.6 30 162 A V E -CD 12 40A 0 10,-2.2 10,-2.2 -2,-0.3 2,-0.5 -0.998 6.5-167.6-131.7 131.5 29.6 4.5 -3.6 31 163 A Y E +C 11 0A 20 -20,-2.6 -20,-2.5 -2,-0.4 110,-0.1 -0.987 16.4 168.6-121.5 123.2 30.9 2.7 -0.6 32 164 A W - 0 0 7 -2,-0.5 -30,-0.6 1,-0.5 -23,-0.1 0.568 67.9 -52.8-106.8 -19.6 28.6 1.4 2.1 33 165 A G S > S- 0 0 6 -32,-0.1 3,-1.7 3,-0.1 -1,-0.5 -0.912 79.8 -41.9 161.7 175.4 31.1 -0.8 3.9 34 166 A P T 3 S- 0 0 107 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 -0.474 126.2 -7.5 -64.7 127.2 33.8 -3.5 3.5 35 167 A G T 3 S+ 0 0 77 -2,-0.2 0, 0.0 1,-0.2 0, 0.0 0.729 92.0 170.0 59.6 21.0 32.4 -6.2 1.1 36 168 A H X - 0 0 45 -3,-1.7 3,-1.5 1,-0.2 -1,-0.2 -0.429 40.1-134.5 -67.4 136.5 29.1 -4.5 1.2 37 169 A P T 3 S+ 0 0 119 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.832 103.9 55.9 -60.0 -28.8 26.7 -5.9 -1.5 38 170 A L T 3 S+ 0 0 28 2,-0.0 2,-0.1 23,-0.0 -8,-0.1 0.463 74.7 117.8 -82.3 -4.1 25.8 -2.3 -2.4 39 171 A N < - 0 0 35 -3,-1.5 2,-0.3 -6,-0.1 -8,-0.2 -0.425 42.8-179.8 -66.6 135.6 29.3 -0.9 -3.2 40 172 A V E -D 30 0A 30 -10,-2.2 -10,-2.2 -2,-0.1 2,-0.3 -0.982 26.0-177.6-140.5 152.9 29.6 0.2 -6.8 41 173 A G E +D 29 0A 14 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.815 28.5 154.4-147.2 101.6 32.1 1.7 -9.1 42 174 A I E -D 28 0A 63 -14,-1.2 -14,-2.8 -2,-0.3 2,-0.3 -0.823 45.6 -89.5-130.9 168.7 30.9 2.4 -12.6 43 175 A R E -D 27 0A 51 -2,-0.3 -16,-0.2 -16,-0.2 106,-0.1 -0.574 42.3-120.2 -77.7 133.6 31.5 4.6 -15.6 44 176 A L - 0 0 2 -18,-2.4 -18,-0.3 -2,-0.3 9,-0.1 -0.632 24.8-138.6 -76.7 117.0 29.6 7.9 -15.7 45 177 A P + 0 0 102 0, 0.0 2,-0.2 0, 0.0 -1,-0.0 -0.425 64.9 16.5 -73.1 152.7 27.3 8.1 -18.8 46 178 A G S S+ 0 0 58 -2,-0.1 2,-0.2 2,-0.1 -2,-0.0 -0.510 111.7 12.6 93.7-159.2 27.2 11.5 -20.5 47 179 A R S S- 0 0 127 -2,-0.2 2,-0.9 1,-0.1 5,-0.1 -0.380 76.5-129.3 -58.0 123.9 29.4 14.6 -20.4 48 180 A Q + 0 0 34 -2,-0.2 -28,-0.4 -24,-0.1 2,-0.3 -0.683 52.0 126.2 -86.7 105.1 32.6 13.6 -18.7 49 181 A T > - 0 0 22 -2,-0.9 4,-1.9 1,-0.1 5,-0.2 -0.986 65.8-115.5-150.4 159.2 33.6 16.0 -15.8 50 182 A N H > S+ 0 0 58 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.952 112.4 57.8 -59.4 -48.6 34.5 15.9 -12.2 51 183 A Q H > S+ 0 0 54 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.894 108.9 43.5 -50.7 -50.0 31.3 17.9 -11.2 52 184 A R H > S+ 0 0 34 1,-0.2 4,-3.8 2,-0.2 5,-0.3 0.901 112.1 52.7 -66.5 -38.1 28.9 15.5 -12.8 53 185 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 5,-0.2 0.920 110.9 48.3 -64.1 -38.1 30.6 12.4 -11.4 54 186 A E H X S+ 0 0 19 -4,-2.7 4,-1.2 2,-0.2 -1,-0.2 0.935 117.1 41.1 -68.2 -44.6 30.4 14.0 -8.0 55 187 A I H X S+ 0 0 0 -4,-2.4 4,-1.9 -5,-0.2 3,-0.3 0.956 118.6 46.5 -67.3 -48.9 26.7 14.8 -8.3 56 188 A H H X S+ 0 0 41 -4,-3.8 4,-2.2 1,-0.2 -2,-0.2 0.765 105.9 56.9 -67.4 -24.7 25.9 11.5 -10.1 57 189 A A H X S+ 0 0 0 -4,-2.3 4,-1.7 -5,-0.3 -1,-0.2 0.872 109.1 49.0 -71.7 -33.4 27.7 9.4 -7.6 58 190 A A H X S+ 0 0 0 -4,-1.2 4,-1.6 -3,-0.3 -2,-0.2 0.879 108.2 53.6 -72.5 -34.0 25.5 11.0 -5.0 59 191 A C H X S+ 0 0 4 -4,-1.9 4,-2.4 1,-0.2 3,-0.4 0.970 106.2 52.9 -61.3 -50.9 22.4 10.3 -7.0 60 192 A K H X S+ 0 0 62 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.888 105.6 53.3 -49.9 -48.3 23.3 6.6 -7.3 61 193 A A H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.876 109.7 48.7 -57.4 -41.4 23.7 6.2 -3.6 62 194 A I H X S+ 0 0 0 -4,-1.6 4,-2.5 -3,-0.4 5,-0.2 0.918 110.2 50.4 -66.8 -44.4 20.2 7.6 -3.0 63 195 A E H X S+ 0 0 86 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.966 111.1 49.5 -56.1 -53.6 18.6 5.4 -5.6 64 196 A Q H X S+ 0 0 20 -4,-2.8 4,-0.7 1,-0.2 -1,-0.2 0.895 109.9 53.0 -49.5 -45.8 20.2 2.4 -4.0 65 197 A A H ><>S+ 0 0 0 -4,-2.0 5,-2.1 2,-0.2 3,-1.7 0.918 106.0 49.4 -58.2 -52.0 18.9 3.6 -0.7 66 198 A K H ><5S+ 0 0 80 -4,-2.5 3,-2.6 1,-0.3 -1,-0.2 0.920 105.4 62.0 -54.1 -41.8 15.3 3.9 -1.8 67 199 A T H 3<5S+ 0 0 103 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.741 107.4 43.0 -53.2 -28.1 15.9 0.4 -3.1 68 200 A Q T <<5S- 0 0 104 -3,-1.7 -1,-0.3 -4,-0.7 -2,-0.2 0.133 118.9-111.0-104.8 15.1 16.6 -0.7 0.5 69 201 A N T < 5 + 0 0 155 -3,-2.6 2,-0.4 1,-0.2 -3,-0.2 0.920 65.7 154.9 56.1 43.0 13.7 1.3 1.9 70 202 A I < + 0 0 34 -5,-2.1 -1,-0.2 -8,-0.2 -2,-0.1 -0.887 17.7 164.8-103.0 136.7 16.1 3.6 3.6 71 203 A N + 0 0 83 -2,-0.4 52,-3.0 1,-0.2 2,-0.5 0.480 61.2 65.3-125.6 -13.7 14.8 7.1 4.3 72 204 A K E + e 0 123A 73 -66,-0.2 -64,-1.5 50,-0.2 2,-0.3 -0.966 66.3 165.1-116.4 128.0 17.4 8.4 6.8 73 205 A L E -be 8 124A 0 50,-2.4 52,-3.1 -2,-0.5 2,-0.7 -0.994 36.8-153.5-150.5 136.3 20.9 8.8 5.5 74 206 A V E -be 9 125A 0 -66,-1.9 -64,-2.9 -2,-0.3 2,-0.6 -0.931 26.8-165.0-110.0 107.0 24.2 10.5 6.3 75 207 A L E -be 10 126A 0 50,-1.4 52,-2.3 -2,-0.7 2,-0.6 -0.848 1.7-161.9 -99.2 115.6 25.9 11.0 2.9 76 208 A Y E +be 11 127A 55 -66,-3.2 -64,-2.3 -2,-0.6 2,-0.3 -0.863 21.3 155.2 -99.7 122.0 29.6 11.8 3.0 77 209 A T E - e 0 128A 0 50,-1.8 52,-2.1 -2,-0.6 -64,-0.1 -0.985 44.4-138.4-141.9 152.2 31.2 13.3 -0.1 78 210 A N S S+ 0 0 33 -66,-0.5 2,-0.9 -2,-0.3 53,-0.2 0.305 76.0 105.1 -92.6 13.1 34.3 15.5 -0.6 79 211 A S > + 0 0 8 1,-0.2 4,-2.3 -25,-0.1 3,-0.1 -0.784 41.4 177.7-101.1 96.1 32.3 17.7 -3.1 80 212 A X H > S+ 0 0 93 -2,-0.9 4,-3.4 1,-0.2 5,-0.4 0.846 85.1 61.0 -60.1 -33.9 31.3 21.1 -1.6 81 213 A F H > S+ 0 0 46 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.930 106.5 43.6 -59.1 -49.1 29.9 21.9 -5.0 82 214 A T H > S+ 0 0 0 2,-0.2 4,-2.8 3,-0.2 5,-0.2 0.962 118.6 44.9 -60.8 -51.1 27.4 19.0 -4.8 83 215 A I H X S+ 0 0 11 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.971 115.6 43.8 -57.7 -62.4 26.6 19.8 -1.2 84 216 A N H X>S+ 0 0 44 -4,-3.4 4,-2.0 1,-0.2 5,-0.9 0.897 114.4 54.3 -50.4 -45.2 26.2 23.6 -1.6 85 217 A G H <>S+ 0 0 0 -4,-2.3 5,-2.2 -5,-0.4 3,-0.3 0.984 115.3 35.1 -57.0 -56.5 24.3 22.9 -4.7 86 218 A I H <5S+ 0 0 16 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.844 125.1 39.7 -74.1 -27.1 21.7 20.6 -3.3 87 219 A T H <5S+ 0 0 57 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.581 135.6 0.9 -98.4 -8.3 21.4 22.2 0.2 88 220 A N T >X5S+ 0 0 77 -4,-2.0 3,-2.1 -3,-0.3 4,-0.6 0.337 120.9 50.7-131.9 -85.9 21.5 26.0 -0.8 89 221 A W H 3> S+ 0 0 119 -3,-2.1 4,-0.6 -6,-0.3 3,-0.5 0.962 112.7 35.8 -61.0 -52.8 16.5 26.8 -3.9 92 224 A G H >< S+ 0 0 34 -4,-0.6 3,-1.1 1,-0.2 -2,-0.2 0.865 111.3 61.2 -70.1 -37.5 17.5 30.1 -5.4 93 225 A W H ><>S+ 0 0 33 -4,-2.8 5,-3.0 1,-0.3 3,-0.7 0.783 100.8 55.8 -61.0 -23.8 18.1 28.7 -8.8 94 226 A K H 3<5S+ 0 0 108 -4,-1.2 3,-0.3 -3,-0.5 -1,-0.3 0.716 105.4 51.7 -80.3 -22.5 14.5 27.7 -9.0 95 227 A K T <<5S+ 0 0 172 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.1 -0.375 114.9 40.5-108.0 48.7 13.3 31.2 -8.3 96 228 A N T < 5S- 0 0 79 -3,-0.7 -1,-0.2 -2,-0.1 -2,-0.1 0.258 117.3 -90.2-179.3 22.0 15.4 32.8 -11.1 97 229 A G T 5S- 0 0 49 -3,-0.3 -3,-0.2 1,-0.2 -4,-0.1 0.845 79.7 -66.1 62.6 35.2 15.3 30.7 -14.2 98 230 A W S - 0 0 52 4,-4.1 3,-0.8 -2,-0.5 6,-0.0 -0.020 36.7-102.4 -60.1 170.2 24.3 31.9 -12.1 101 233 A S T 3 S+ 0 0 131 1,-0.3 -1,-0.1 2,-0.1 4,-0.1 0.591 124.4 62.8 -73.3 -7.1 25.4 34.9 -10.0 102 234 A A T 3 S- 0 0 66 2,-0.2 2,-0.3 0, 0.0 -1,-0.3 -0.292 121.7-106.4-109.4 43.3 26.9 36.1 -13.2 103 235 A G S < S+ 0 0 64 -3,-0.8 -2,-0.1 -4,-0.2 2,-0.1 0.366 88.1 108.9 50.8 -5.0 23.5 36.3 -15.0 104 236 A K S S- 0 0 136 -2,-0.3 -4,-4.1 1,-0.1 2,-0.5 -0.333 76.8 -76.6 -93.5 180.0 24.3 33.2 -17.1 105 237 A E B -F 99 0B 128 -6,-0.3 -6,-0.2 -2,-0.1 -7,-0.1 -0.654 40.6-110.9 -91.5 129.1 22.9 29.7 -16.9 106 238 A V > - 0 0 18 -8,-1.4 3,-1.1 -2,-0.5 -1,-0.1 -0.262 28.2-148.3 -49.4 114.9 23.8 27.1 -14.3 107 239 A I T 3 S+ 0 0 131 1,-0.2 3,-0.3 2,-0.1 -1,-0.2 0.779 89.1 45.5 -63.0 -33.4 25.7 24.5 -16.2 108 240 A N T >> + 0 0 14 1,-0.2 4,-2.6 2,-0.1 3,-1.4 0.118 69.7 128.9-103.0 28.0 24.7 21.4 -14.2 109 241 A K H <> S+ 0 0 95 -3,-1.1 4,-3.0 1,-0.3 5,-0.3 0.883 75.5 49.3 -47.2 -47.7 20.9 22.1 -14.0 110 242 A E H 3> S+ 0 0 162 -3,-0.3 4,-1.5 1,-0.2 -1,-0.3 0.785 111.4 50.1 -64.5 -27.1 20.0 18.7 -15.3 111 243 A D H <> S+ 0 0 5 -3,-1.4 4,-1.5 2,-0.2 -1,-0.2 0.868 115.7 41.5 -77.6 -39.3 22.4 17.1 -12.8 112 244 A F H X S+ 0 0 0 -4,-2.6 4,-3.5 2,-0.2 -2,-0.2 0.829 113.1 53.1 -78.1 -30.1 20.9 19.0 -9.9 113 245 A V H X S+ 0 0 65 -4,-3.0 4,-2.4 -5,-0.3 -2,-0.2 0.911 110.9 47.8 -68.2 -41.7 17.3 18.6 -11.1 114 246 A A H X S+ 0 0 28 -4,-1.5 4,-1.8 -5,-0.3 -2,-0.2 0.882 114.8 47.8 -63.9 -37.9 17.9 14.8 -11.3 115 247 A L H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.983 110.1 48.3 -70.3 -54.8 19.4 15.0 -7.8 116 248 A E H X S+ 0 0 44 -4,-3.5 4,-0.6 1,-0.2 -2,-0.2 0.906 107.4 58.0 -53.6 -40.1 16.8 17.1 -6.2 117 249 A R H >< S+ 0 0 183 -4,-2.4 3,-1.9 1,-0.2 -1,-0.2 0.964 106.1 49.1 -55.5 -48.4 14.2 14.7 -7.7 118 250 A L H 3< S+ 0 0 26 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.895 101.3 64.4 -55.2 -43.0 15.9 11.8 -5.9 119 251 A T H >< S+ 0 0 27 -4,-2.1 3,-1.3 2,-0.1 -1,-0.3 0.606 72.6 113.3 -60.7 -9.7 15.9 13.7 -2.5 120 252 A Q T << S+ 0 0 114 -3,-1.9 3,-0.1 -4,-0.6 -3,-0.0 -0.470 87.3 15.0 -63.8 130.0 12.1 13.7 -2.4 121 253 A G T 3 S+ 0 0 70 -2,-0.2 2,-0.4 1,-0.2 -1,-0.3 0.822 104.3 113.6 76.4 31.5 11.1 11.6 0.6 122 254 A X < - 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