==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE/DNA 08-DEC-03 1RRJ . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.E.CHRENCIK,B.L.STAKER,A.B.BURGIN,L.STEWART,M.R.REDINBO . 565 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33386.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 374 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 8.3 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 32 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 217 38.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 0 0 0 2 3 0 0 2 1 0 0 3 1 0 0 0 0 0 0 0 0 1 0 1 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 3 5 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 3 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 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 1 201 A Q 0 0 250 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 144.0 -23.7 -11.0 0.4 2 202 A K - 0 0 196 2,-0.0 2,-0.6 0, 0.0 0, 0.0 -0.934 360.0-149.2-138.1 104.6 -22.3 -7.8 1.9 3 203 A W - 0 0 65 -2,-0.4 2,-1.4 1,-0.1 3,-0.1 -0.711 0.7-156.8 -80.8 118.0 -22.5 -7.5 5.7 4 204 A K > + 0 0 84 -2,-0.6 3,-1.3 1,-0.2 4,-0.2 -0.695 20.8 169.9 -94.1 80.5 -22.9 -3.9 6.8 5 205 A W G > + 0 0 10 -2,-1.4 3,-1.1 1,-0.2 -1,-0.2 0.707 69.1 70.1 -64.7 -22.7 -21.6 -4.3 10.3 6 206 A W G 3 S+ 0 0 29 1,-0.2 -1,-0.2 -3,-0.1 4,-0.1 0.640 92.4 57.2 -70.2 -16.3 -21.5 -0.5 10.7 7 207 A E G < S+ 0 0 139 -3,-1.3 -1,-0.2 2,-0.1 -2,-0.2 0.431 92.2 94.9 -93.5 -3.8 -25.3 -0.3 10.7 8 208 A E S < S- 0 0 113 -3,-1.1 2,-0.3 -4,-0.2 3,-0.1 -0.370 93.3 -85.0 -85.0 166.4 -25.5 -2.7 13.7 9 209 A E - 0 0 187 1,-0.1 -1,-0.1 -2,-0.1 -2,-0.1 -0.575 62.8 -95.0 -71.5 127.9 -25.7 -1.8 17.4 10 210 A R - 0 0 149 -2,-0.3 -1,-0.1 1,-0.1 -4,-0.0 -0.127 44.5 -98.0 -48.6 139.0 -22.2 -1.2 18.6 11 211 A Y - 0 0 42 1,-0.1 -1,-0.1 -3,-0.1 5,-0.0 -0.425 44.4-111.5 -65.0 128.2 -20.4 -4.2 20.3 12 212 A P - 0 0 96 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.056 34.3 -92.9 -56.9 161.6 -20.6 -4.1 24.2 13 213 A E S S+ 0 0 196 1,-0.1 2,-1.1 3,-0.0 3,-0.0 -0.491 98.5 13.8 -78.4 144.7 -17.6 -3.6 26.5 14 214 A G S S+ 0 0 23 -2,-0.2 2,-0.2 195,-0.1 -1,-0.1 -0.716 105.5 75.9 97.9 -85.6 -15.6 -6.6 27.8 15 215 A I - 0 0 66 -2,-1.1 194,-0.2 1,-0.1 3,-0.1 -0.426 52.2-173.4 -66.6 129.0 -16.8 -9.6 25.7 16 216 A K - 0 0 64 192,-2.9 2,-0.3 1,-0.3 -1,-0.1 0.696 68.4 -2.3 -94.1 -27.5 -15.3 -9.6 22.2 17 217 A W - 0 0 6 191,-0.7 -1,-0.3 1,-0.1 3,-0.1 -0.981 40.6-156.0-159.4 162.6 -17.4 -12.6 20.8 18 218 A K S S+ 0 0 139 1,-0.4 2,-0.3 -2,-0.3 -1,-0.1 0.689 89.7 30.0-109.9 -36.8 -20.0 -15.2 21.8 19 219 A F + 0 0 54 168,-0.1 125,-1.1 169,-0.1 -1,-0.4 -0.943 62.1 172.4-127.2 145.1 -19.1 -17.7 19.1 20 220 A L E +A 143 0A 0 -2,-0.3 167,-2.0 123,-0.2 2,-0.4 -0.828 3.8 165.1-158.0 117.6 -15.8 -18.6 17.4 21 221 A E E +A 142 0A 61 121,-2.2 121,-3.0 -2,-0.3 2,-0.3 -0.989 7.7 152.3-139.2 128.6 -14.9 -21.4 15.0 22 222 A H - 0 0 8 -2,-0.4 119,-0.1 169,-0.3 116,-0.1 -0.952 48.1-121.3-148.0 163.7 -11.9 -21.9 12.7 23 223 A K - 0 0 115 117,-0.5 171,-0.1 -2,-0.3 118,-0.1 0.345 58.2-122.6 -90.3 6.2 -9.8 -24.7 11.1 24 224 A G - 0 0 3 114,-0.1 -1,-0.3 169,-0.1 2,-0.1 -0.234 46.1 -33.8 82.4-172.9 -6.6 -23.5 12.8 25 225 A P - 0 0 7 0, 0.0 2,-0.6 0, 0.0 129,-0.2 -0.368 49.1-123.6 -85.2 160.5 -3.3 -22.4 11.2 26 226 A V B -c 154 0B 21 127,-2.5 129,-2.4 -2,-0.1 2,-0.2 -0.910 30.5-138.0 -98.9 123.7 -1.6 -23.8 8.0 27 227 A F - 0 0 46 -2,-0.6 129,-0.1 127,-0.2 151,-0.1 -0.594 24.2-100.2 -84.7 146.5 1.9 -25.0 8.8 28 228 A A - 0 0 23 -2,-0.2 -1,-0.1 149,-0.2 3,-0.1 -0.330 50.7 -92.2 -62.1 142.6 4.8 -24.3 6.5 29 229 A P - 0 0 101 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.255 52.6 -91.8 -57.6 145.8 5.7 -27.3 4.2 30 230 A P - 0 0 106 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.100 47.5 -89.0 -58.1 156.7 8.4 -29.6 5.6 31 231 A Y - 0 0 52 -3,-0.1 24,-0.0 1,-0.0 -3,-0.0 -0.548 36.0-148.7 -69.5 130.3 12.1 -29.1 4.8 32 232 A E - 0 0 165 -2,-0.3 -1,-0.0 -3,-0.1 0, 0.0 -0.919 21.4-125.7-101.8 113.3 13.2 -30.9 1.6 33 233 A P - 0 0 78 0, 0.0 22,-0.0 0, 0.0 -1,-0.0 -0.231 30.6 -94.0 -60.4 149.7 16.9 -32.1 1.9 34 234 A L - 0 0 22 1,-0.1 71,-0.0 4,-0.1 20,-0.0 -0.282 44.0-108.8 -62.1 144.2 19.4 -31.1 -0.8 35 235 A P > - 0 0 52 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 -0.122 35.9 -93.2 -69.4 177.1 20.0 -33.5 -3.7 36 236 A E T 3 S+ 0 0 177 1,-0.2 -2,-0.1 3,-0.0 0, 0.0 0.899 119.1 53.1 -57.6 -46.3 23.2 -35.6 -4.1 37 237 A N T 3 S+ 0 0 125 1,-0.1 2,-1.0 2,-0.1 -1,-0.2 0.510 87.2 86.7 -72.7 -10.1 25.1 -33.1 -6.4 38 238 A V < - 0 0 16 -3,-0.9 2,-0.2 67,-0.0 -1,-0.1 -0.791 70.0-168.4 -96.7 96.0 24.7 -30.1 -4.1 39 239 A K - 0 0 78 -2,-1.0 2,-0.4 9,-0.1 65,-0.3 -0.575 20.3-148.7 -93.5 145.9 27.7 -30.4 -1.8 40 240 A F - 0 0 10 7,-0.5 7,-1.9 -2,-0.2 2,-0.4 -0.876 19.1-155.9-105.9 142.4 28.7 -28.7 1.4 41 241 A Y E -DE 46 101C 59 60,-1.4 60,-2.6 -2,-0.4 2,-0.4 -0.976 14.8-176.1-127.4 135.0 32.4 -28.3 2.2 42 242 A Y E > S-DE 45 100C 17 3,-2.4 3,-2.1 -2,-0.4 58,-0.2 -0.999 81.7 -10.4-126.9 126.5 34.3 -27.8 5.4 43 243 A D T 3 S- 0 0 82 56,-2.0 57,-0.1 -2,-0.4 -1,-0.1 0.834 128.7 -59.1 54.1 35.0 38.1 -27.2 5.3 44 244 A G T 3 S+ 0 0 69 55,-0.4 2,-0.4 1,-0.2 -1,-0.3 0.336 116.1 111.3 79.6 -5.7 38.0 -28.1 1.6 45 245 A K E < S-D 42 0C 141 -3,-2.1 -3,-2.4 1,-0.1 -1,-0.2 -0.831 74.2-102.0-107.7 142.7 36.6 -31.6 2.2 46 246 A V E +D 41 0C 89 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.234 41.4 177.1 -58.4 137.9 33.2 -33.0 1.4 47 247 A M - 0 0 28 -7,-1.9 2,-0.5 2,-0.0 -7,-0.5 -0.924 22.1-147.4-151.7 122.0 30.7 -33.3 4.3 48 248 A K - 0 0 196 -2,-0.3 2,-0.3 -9,-0.1 -9,-0.1 -0.787 22.4-146.1 -92.4 121.3 27.1 -34.4 4.4 49 249 A L - 0 0 14 -2,-0.5 37,-0.0 1,-0.1 -2,-0.0 -0.660 18.5-108.4 -89.4 147.7 25.0 -32.6 7.0 50 250 A S >> - 0 0 30 -2,-0.3 4,-3.1 1,-0.1 3,-0.6 -0.369 40.9-104.9 -66.0 148.3 22.1 -34.0 9.1 51 251 A P H 3> S+ 0 0 82 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.868 120.6 53.1 -45.0 -42.1 18.7 -32.6 8.0 52 252 A K H 3> S+ 0 0 135 1,-0.2 4,-1.1 2,-0.2 34,-0.1 0.872 116.9 36.7 -63.4 -41.5 18.5 -30.4 11.1 53 253 A A H <> S+ 0 0 0 -3,-0.6 4,-1.8 32,-0.2 -1,-0.2 0.829 113.7 57.5 -80.4 -33.9 21.9 -28.8 10.5 54 254 A E H X S+ 0 0 28 -4,-3.1 4,-1.8 2,-0.2 -2,-0.2 0.891 103.7 54.0 -63.9 -38.9 21.6 -28.8 6.7 55 255 A E H X S+ 0 0 32 -4,-2.3 4,-1.3 -5,-0.2 3,-0.3 0.934 107.7 48.0 -61.7 -48.9 18.4 -26.7 6.9 56 256 A V H X S+ 0 0 3 -4,-1.1 4,-1.1 1,-0.2 3,-0.3 0.888 110.4 54.4 -63.3 -32.0 20.1 -24.0 9.0 57 257 A A H X S+ 0 0 0 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.844 102.2 56.6 -69.5 -35.5 23.0 -24.0 6.5 58 258 A T H X S+ 0 0 3 -4,-1.8 4,-2.1 -3,-0.3 -1,-0.2 0.830 101.4 58.0 -65.3 -32.5 20.6 -23.3 3.6 59 259 A F H < S+ 0 0 29 -4,-1.3 4,-0.5 -3,-0.3 -1,-0.2 0.904 109.2 43.0 -65.5 -41.5 19.3 -20.2 5.3 60 260 A F H >< S+ 0 0 5 -4,-1.1 3,-0.9 1,-0.2 4,-0.3 0.885 112.0 55.6 -70.3 -40.9 22.8 -18.6 5.4 61 261 A A H >< S+ 0 0 0 -4,-2.0 3,-1.0 1,-0.3 -2,-0.2 0.850 103.9 53.5 -60.4 -39.5 23.4 -19.8 1.8 62 262 A K T 3< S+ 0 0 127 -4,-2.1 -1,-0.3 1,-0.2 3,-0.2 0.630 111.3 47.0 -70.4 -18.7 20.3 -18.0 0.5 63 263 A M T X S+ 0 0 32 -3,-0.9 3,-1.5 -4,-0.5 6,-0.3 0.323 77.7 109.5-105.1 5.9 21.6 -14.8 2.1 64 264 A L T < S+ 0 0 54 -3,-1.0 -1,-0.1 -4,-0.3 -2,-0.1 0.678 72.1 59.4 -57.0 -24.0 25.2 -15.0 0.8 65 265 A D T 3 S+ 0 0 123 -3,-0.2 -1,-0.3 -4,-0.2 2,-0.1 0.739 89.9 88.9 -78.2 -24.7 24.7 -12.1 -1.6 66 266 A H S X S- 0 0 100 -3,-1.5 3,-0.8 1,-0.1 4,-0.1 -0.411 77.4-133.1 -75.6 150.9 23.8 -9.6 1.2 67 267 A E G > S+ 0 0 165 1,-0.2 3,-1.9 2,-0.1 4,-0.3 0.760 96.8 75.3 -74.7 -24.8 26.5 -7.6 3.0 68 268 A Y G > S+ 0 0 36 1,-0.3 3,-0.9 2,-0.2 6,-0.2 0.675 80.6 69.6 -63.3 -19.2 25.0 -8.4 6.4 69 269 A T G < S+ 0 0 6 -3,-0.8 -1,-0.3 -6,-0.3 -2,-0.1 0.574 94.9 56.8 -74.7 -8.3 26.4 -12.0 6.3 70 270 A T G < S+ 0 0 100 -3,-1.9 -1,-0.2 -4,-0.1 2,-0.2 0.534 85.1 111.5 -95.9 -9.2 29.9 -10.5 6.7 71 271 A K S <> S- 0 0 87 -3,-0.9 4,-2.5 -4,-0.3 5,-0.2 -0.460 70.5-132.6 -73.4 136.9 28.9 -8.7 9.9 72 272 A E H > S+ 0 0 156 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.867 106.1 46.6 -49.8 -48.9 30.5 -9.8 13.3 73 273 A I H > S+ 0 0 56 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.931 112.4 49.5 -65.2 -44.5 27.1 -9.9 15.1 74 274 A F H > S+ 0 0 0 -6,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.916 115.6 43.3 -60.1 -47.9 25.3 -11.8 12.3 75 275 A R H X S+ 0 0 73 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.873 113.5 50.5 -67.6 -39.7 28.1 -14.4 12.2 76 276 A K H X S+ 0 0 113 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.950 115.6 41.9 -63.0 -54.2 28.5 -14.8 16.0 77 277 A N H X S+ 0 0 19 -4,-2.5 4,-1.9 93,-0.4 96,-0.3 0.888 115.4 50.4 -62.0 -44.0 24.7 -15.3 16.6 78 278 A F H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 -2,-0.2 0.953 111.0 46.9 -59.7 -55.3 24.2 -17.6 13.5 79 279 A F H X S+ 0 0 34 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.859 110.3 53.2 -57.3 -39.7 27.1 -19.9 14.4 80 280 A K H X S+ 0 0 129 -4,-1.9 4,-0.9 1,-0.2 -1,-0.2 0.914 114.5 42.3 -61.4 -42.9 26.0 -20.2 18.1 81 281 A D H X S+ 0 0 17 -4,-1.9 4,-0.6 1,-0.2 -2,-0.2 0.832 111.1 54.4 -75.1 -31.3 22.5 -21.2 16.9 82 282 A W H >X S+ 0 0 0 -4,-2.6 3,-0.9 1,-0.2 4,-0.7 0.880 102.3 60.0 -69.1 -35.5 23.8 -23.5 14.1 83 283 A R H >< S+ 0 0 82 -4,-2.0 3,-0.6 1,-0.3 -1,-0.2 0.833 99.5 55.7 -58.9 -40.4 25.9 -25.4 16.8 84 284 A K H 3< S+ 0 0 119 -4,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.727 107.3 50.4 -65.6 -26.2 22.7 -26.3 18.8 85 285 A E H << S+ 0 0 46 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.583 94.6 93.5 -88.8 -14.0 21.3 -28.0 15.6 86 286 A M S << S- 0 0 13 -4,-0.7 2,-0.1 -3,-0.6 -37,-0.0 -0.406 76.6-118.4 -80.2 155.0 24.3 -30.1 14.9 87 287 A T > - 0 0 51 -2,-0.1 4,-1.9 1,-0.1 5,-0.1 -0.329 34.7-103.4 -80.7 171.6 24.9 -33.7 16.1 88 288 A N H > S+ 0 0 103 2,-0.2 4,-1.2 1,-0.2 -1,-0.1 0.859 124.3 53.6 -67.5 -30.9 27.9 -34.4 18.4 89 289 A E H 4 S+ 0 0 133 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.842 111.8 45.6 -70.7 -33.9 29.8 -35.9 15.4 90 290 A E H > S+ 0 0 11 1,-0.2 4,-2.3 2,-0.2 3,-0.4 0.804 107.4 57.9 -79.2 -31.8 29.2 -32.6 13.5 91 291 A K H < S+ 0 0 68 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.766 101.8 55.5 -69.4 -28.2 30.1 -30.4 16.5 92 292 A N T < S+ 0 0 133 -4,-1.2 -1,-0.2 -5,-0.1 -2,-0.2 0.713 116.1 36.7 -76.9 -23.9 33.6 -32.0 16.7 93 293 A I T 4 S+ 0 0 86 -4,-0.5 2,-1.5 -3,-0.4 3,-0.2 0.903 107.2 62.6 -92.3 -56.5 34.4 -31.1 13.0 94 294 A I < + 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 3,-0.1 -0.566 54.8 154.2 -78.8 88.2 32.7 -27.7 12.5 95 295 A T + 0 0 90 -2,-1.5 2,-0.3 1,-0.2 -1,-0.2 0.731 65.9 16.0 -84.6 -28.7 34.6 -25.5 15.0 96 296 A N - 0 0 45 -3,-0.2 3,-0.3 1,-0.1 -1,-0.2 -0.977 62.8-129.3-146.0 160.7 34.0 -22.2 13.1 97 297 A L S > S+ 0 0 11 -2,-0.3 3,-1.6 1,-0.2 -1,-0.1 0.803 99.4 67.4 -76.8 -35.4 31.9 -20.7 10.4 98 298 A S T 3 S+ 0 0 91 1,-0.3 -1,-0.2 3,-0.0 0, 0.0 0.673 93.9 56.6 -64.2 -20.5 34.7 -19.2 8.3 99 299 A K T 3 S+ 0 0 98 -3,-0.3 -56,-2.0 -56,-0.0 -55,-0.4 0.431 91.0 100.8 -89.9 -2.7 36.1 -22.6 7.2 100 300 A C E < -E 42 0C 17 -3,-1.6 2,-0.5 -58,-0.2 -58,-0.2 -0.619 60.0-152.8 -87.4 147.0 32.7 -23.5 5.7 101 301 A D E +E 41 0C 60 -60,-2.6 -60,-1.4 -2,-0.3 3,-0.2 -0.956 22.5 165.9-125.6 111.9 31.8 -23.3 2.0 102 302 A F > + 0 0 10 -2,-0.5 4,-2.4 -62,-0.1 5,-0.2 0.291 45.3 110.7-104.3 6.5 28.2 -22.6 1.1 103 303 A T H > S+ 0 0 57 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.832 78.0 45.4 -53.6 -44.0 28.9 -21.7 -2.6 104 304 A Q H > S+ 0 0 60 -65,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.890 113.9 51.3 -69.3 -35.3 27.4 -24.8 -4.3 105 305 A M H > S+ 0 0 0 -66,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.896 110.0 49.6 -66.9 -38.6 24.3 -24.4 -2.0 106 306 A S H X S+ 0 0 10 -4,-2.4 4,-1.3 1,-0.2 -2,-0.2 0.905 110.4 49.6 -67.2 -41.3 24.0 -20.7 -3.0 107 307 A Q H X S+ 0 0 127 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.849 107.3 55.7 -66.4 -36.7 24.2 -21.6 -6.8 108 308 A Y H X S+ 0 0 65 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.910 106.1 49.1 -62.8 -49.3 21.5 -24.3 -6.5 109 309 A F H X S+ 0 0 40 -4,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.820 110.8 51.0 -64.3 -26.6 18.9 -22.0 -5.0 110 310 A K H X S+ 0 0 95 -4,-1.3 4,-1.3 2,-0.2 -1,-0.2 0.846 109.5 51.1 -76.4 -34.0 19.6 -19.4 -7.7 111 311 A A H X S+ 0 0 52 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.821 109.0 51.0 -71.3 -33.0 19.2 -22.2 -10.3 112 312 A Q H X S+ 0 0 82 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.871 106.8 53.0 -71.7 -37.6 15.8 -23.2 -8.7 113 313 A T H X S+ 0 0 69 -4,-1.6 4,-0.9 1,-0.2 -2,-0.2 0.845 113.3 45.1 -66.5 -33.1 14.6 -19.5 -8.8 114 314 A E H < S+ 0 0 109 -4,-1.3 -2,-0.2 2,-0.2 -1,-0.2 0.856 111.1 51.8 -78.3 -34.8 15.5 -19.6 -12.6 115 315 A A H < S+ 0 0 56 -4,-2.0 3,-0.3 1,-0.2 -2,-0.2 0.711 107.0 55.9 -73.8 -21.5 13.8 -23.0 -13.1 116 316 A R H >< S+ 0 0 142 -4,-1.4 3,-0.9 1,-0.2 -1,-0.2 0.783 102.8 52.0 -81.0 -31.0 10.7 -21.7 -11.5 117 317 A K T 3< S+ 0 0 139 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.386 106.2 57.9 -85.5 3.6 10.2 -18.7 -13.8 118 318 A Q T 3 S+ 0 0 144 -3,-0.3 -1,-0.2 -4,-0.1 -2,-0.1 0.010 81.3 132.2-116.7 20.7 10.5 -21.2 -16.7 119 319 A M < - 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