Browse entries in the PDBbind-CN Database
HEADER 5XP7_COMPLEX COMPND 5XP7_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 155 LYS ASP ALA TRP GLU ILE PRO ARG GLU SER LEU ARG LEU SEQRES 2 A 155 GLU VAL LYS LEU GLY GLN GLY CYS PHE GLY GLU VAL TRP SEQRES 3 A 155 MET GLY THR TRP ASN GLY THR THR ARG VAL ALA ILE LYS SEQRES 4 A 155 THR LEU LYS PRO GLY THR MET SER PRO GLU ALA PHE LEU SEQRES 5 A 155 GLN GLU ALA GLN VAL MET LYS LYS LEU ARG HIS GLU LYS SEQRES 6 A 155 LEU VAL GLN LEU TYR ALA VAL VAL SER GLU GLU PRO ILE SEQRES 7 A 155 TYR ILE VAL THR GLU TYR MET SER LYS GLY SER LEU LEU SEQRES 8 A 155 ASP PHE LEU LYS GLY GLU MET GLY LYS TYR LEU ARG LEU SEQRES 9 A 155 PRO GLN LEU VAL ASP MET ALA ALA GLN ILE ALA SER GLY SEQRES 10 A 155 MET ALA TYR VAL GLU ARG MET ASN TYR VAL HIS ARG ASP SEQRES 11 A 155 LEU ARG ALA ALA ASN ILE LEU VAL GLY GLU ASN LEU VAL SEQRES 12 A 155 CYS LYS VAL ALA ASP PHE GLY LEU ALA ARG LEU ILE SEQRES 1 A 110 PHE PRO ILE LYS TRP THR ALA PRO GLU ALA ALA LEU TYR SEQRES 2 A 110 GLY ARG PHE THR ILE LYS SER ASP VAL TRP SER PHE GLY SEQRES 3 A 110 ILE LEU LEU THR GLU LEU THR THR LYS GLY ARG VAL PRO SEQRES 4 A 110 TYR PRO GLY MET VAL ASN ARG GLU VAL LEU ASP GLN VAL SEQRES 5 A 110 GLU ARG GLY TYR ARG MET PRO CYS PRO PRO GLU CYS PRO SEQRES 6 A 110 GLU SER LEU HIS ASP LEU MET CYS GLN CYS TRP ARG LYS SEQRES 7 A 110 ASP PRO GLU GLU ARG PRO THR PHE GLU TYR LEU GLN ALA SEQRES 8 A 110 PHE LEU GLU ASP TYR PHE THR SER THR GLU PRO GLN TYR SEQRES 9 A 110 GLN PRO GLY GLU ASN LEU HET MG A 1 1 HET MOL A 442 41 ATOM 1 N LYS A 257 0.207 4.650 63.436 1.00 94.65 N ATOM 2 CA LYS A 257 0.726 4.691 62.069 1.00 91.56 C ATOM 3 C LYS A 257 1.609 3.481 61.755 1.00 89.74 C ATOM 4 O LYS A 257 2.132 2.838 62.665 1.00 92.17 O ATOM 5 CB LYS A 257 1.480 5.995 61.827 1.00 93.24 C ATOM 6 CG LYS A 257 0.559 7.174 61.485 1.00 97.34 C ATOM 7 CD LYS A 257 -0.826 6.712 60.999 1.00100.73 C ATOM 8 CE LYS A 257 -0.854 6.456 59.492 1.00 98.29 C ATOM 9 NZ LYS A 257 -2.076 5.707 59.085 1.00100.73 N ATOM 10 HZ1 LYS A 257 -2.098 4.790 59.575 1.00 0.00 H ATOM 11 HZ2 LYS A 257 -2.920 6.258 59.341 1.00 0.00 H ATOM 12 HZ3 LYS A 257 -2.060 5.552 58.057 1.00 0.00 H ATOM 13 HN3 LYS A 257 1.001 4.644 64.107 1.00 0.00 H ATOM 14 HN2 LYS A 257 -0.363 3.789 63.564 1.00 0.00 H ATOM 15 HN1 LYS A 257 -0.385 5.488 63.606 1.00 0.00 H ATOM 16 N ASP A 258 1.793 3.190 60.465 1.00 83.63 N ATOM 17 CA ASP A 258 2.519 1.991 60.046 1.00 80.03 C ATOM 18 C ASP A 258 4.028 2.154 59.903 1.00 77.40 C ATOM 19 O ASP A 258 4.586 3.209 60.202 1.00 70.46 O ATOM 20 CB ASP A 258 1.952 1.475 58.713 1.00 78.11 C ATOM 21 CG ASP A 258 1.982 2.530 57.608 1.00 82.15 C ATOM 22 OD1 ASP A 258 2.728 3.528 57.731 1.00 83.68 O ATOM 23 OD2 ASP A 258 1.255 2.359 56.604 1.00 81.88 O ATOM 24 H ASP A 258 1.411 3.831 59.741 1.00 0.00 H ATOM 25 N ALA A 259 4.670 1.084 59.431 1.00 77.50 N ATOM 26 CA ALA A 259 6.126 1.000 59.346 1.00 74.54 C ATOM 27 C ALA A 259 6.712 1.819 58.205 1.00 65.63 C ATOM 28 O ALA A 259 7.931 1.850 58.033 1.00 60.57 O ATOM 29 CB ALA A 259 6.557 -0.451 59.208 1.00 78.02 C ATOM 30 H ALA A 259 4.107 0.271 59.108 1.00 0.00 H ATOM 31 N TRP A 260 5.852 2.467 57.424 1.00 64.12 N ATOM 32 CA TRP A 260 6.302 3.319 56.318 1.00 60.98 C ATOM 33 C TRP A 260 6.732 4.708 56.818 1.00 59.75 C ATOM 34 O TRP A 260 7.395 5.457 56.100 1.00 55.64 O ATOM 35 CB TRP A 260 5.201 3.461 55.267 1.00 58.68 C ATOM 36 CG TRP A 260 4.941 2.211 54.467 1.00 61.15 C ATOM 37 CD1 TRP A 260 3.923 1.328 54.662 1.00 63.79 C ATOM 38 CD2 TRP A 260 5.690 1.715 53.340 1.00 56.70 C ATOM 39 NE1 TRP A 260 3.994 0.310 53.745 1.00 65.56 N ATOM 40 CE2 TRP A 260 5.064 0.527 52.917 1.00 59.77 C ATOM 41 CE3 TRP A 260 6.825 2.161 52.655 1.00 54.87 C ATOM 42 CZ2 TRP A 260 5.533 -0.228 51.837 1.00 60.64 C ATOM 43 CZ3 TRP A 260 7.290 1.414 51.577 1.00 55.62 C ATOM 44 CH2 TRP A 260 6.645 0.230 51.182 1.00 58.37 C ATOM 45 HE1 TRP A 260 3.340 -0.497 53.688 1.00 0.00 H ATOM 46 H TRP A 260 4.832 2.367 57.602 1.00 0.00 H ATOM 47 N GLU A 261 6.342 5.058 58.044 1.00 67.57 N ATOM 48 CA GLU A 261 6.615 6.393 58.583 1.00 64.05 C ATOM 49 C GLU A 261 8.091 6.606 58.903 1.00 62.99 C ATOM 50 O GLU A 261 8.752 5.724 59.437 1.00 66.69 O ATOM 51 CB GLU A 261 5.781 6.648 59.847 1.00 70.36 C ATOM 52 CG GLU A 261 4.417 7.264 59.576 1.00 76.33 C ATOM 53 CD GLU A 261 4.472 8.773 59.392 1.00 81.98 C ATOM 54 OE1 GLU A 261 5.516 9.392 59.709 1.00 81.23 O ATOM 55 OE2 GLU A 261 3.470 9.344 58.916 1.00 84.72 O ATOM 56 H GLU A 261 5.832 4.368 58.631 1.00 0.00 H ATOM 57 N ILE A 262 8.606 7.787 58.584 1.00 62.38 N ATOM 58 CA ILE A 262 9.968 8.139 58.975 1.00 61.33 C ATOM 59 C ILE A 262 10.020 9.492 59.705 1.00 61.82 C ATOM 60 O ILE A 262 9.105 10.309 59.583 1.00 62.36 O ATOM 61 CB ILE A 262 10.906 8.178 57.765 1.00 56.82 C ATOM 62 CG1 ILE A 262 10.327 9.083 56.679 1.00 52.15 C ATOM 63 CG2 ILE A 262 11.151 6.772 57.245 1.00 55.73 C ATOM 64 CD1 ILE A 262 11.340 9.485 55.630 1.00 55.11 C ATOM 65 H ILE A 262 8.032 8.470 58.049 1.00 0.00 H ATOM 66 N PRO A 263 11.092 9.720 60.484 1.00 56.47 N ATOM 67 CA PRO A 263 11.247 11.029 61.129 1.00 58.56 C ATOM 68 C PRO A 263 11.583 12.107 60.110 1.00 55.59 C ATOM 69 O PRO A 263 12.316 11.826 59.165 1.00 53.95 O ATOM 70 CB PRO A 263 12.416 10.812 62.104 1.00 58.94 C ATOM 71 CG PRO A 263 12.503 9.334 62.290 1.00 60.05 C ATOM 72 CD PRO A 263 12.064 8.733 60.993 1.00 58.04 C ATOM 73 N ARG A 264 11.097 13.327 60.326 1.00 54.85 N ATOM 74 CA ARG A 264 11.297 14.406 59.371 1.00 59.19 C ATOM 75 C ARG A 264 12.763 14.833 59.247 1.00 61.05 C ATOM 76 O ARG A 264 13.175 15.305 58.186 1.00 60.12 O ATOM 77 CB ARG A 264 10.452 15.629 59.762 1.00 63.48 C ATOM 78 CG ARG A 264 8.948 15.438 59.670 1.00 61.43 C ATOM 79 CD ARG A 264 8.196 16.665 60.196 1.00 58.16 C ATOM 80 NE ARG A 264 6.754 16.461 60.116 1.00 57.30 N ATOM 81 CZ ARG A 264 6.010 16.772 59.058 1.00 58.12 C ATOM 82 NH1 ARG A 264 6.569 17.315 57.982 1.00 54.75 N ATOM 83 NH2 ARG A 264 4.704 16.539 59.071 1.00 57.16 N ATOM 84 HE ARG A 264 6.276 16.045 60.941 1.00 0.00 H ATOM 85 HH12 ARG A 264 5.983 17.556 57.157 1.00 0.00 H ATOM 86 HH11 ARG A 264 7.592 17.499 57.964 1.00 0.00 H ATOM 87 HH22 ARG A 264 4.124 16.783 58.243 1.00 0.00 H ATOM 88 HH21 ARG A 264 4.260 16.113 59.909 1.00 0.00 H ATOM 89 H ARG A 264 10.562 13.513 61.198 1.00 0.00 H ATOM 90 N GLU A 265 13.558 14.661 60.301 1.00 55.16 N ATOM 91 CA GLU A 265 14.955 15.084 60.231 1.00 57.32 C ATOM 92 C GLU A 265 15.846 14.085 59.462 1.00 57.81 C ATOM 93 O GLU A 265 17.001 14.396 59.178 1.00 60.47 O ATOM 94 CB GLU A 265 15.534 15.337 61.641 1.00 58.98 C ATOM 95 CG GLU A 265 15.714 14.089 62.471 1.00 60.24 C ATOM 96 CD GLU A 265 14.473 13.760 63.268 1.00 71.27 C ATOM 97 OE1 GLU A 265 13.454 14.468 63.088 1.00 64.78 O ATOM 98 OE2 GLU A 265 14.514 12.798 64.071 1.00 81.43 O ATOM 99 H GLU A 265 13.186 14.228 61.170 1.00 0.00 H ATOM 100 N SER A 266 15.328 12.898 59.131 1.00 57.11 N ATOM 101 CA SER A 266 16.097 11.925 58.342 1.00 59.78 C ATOM 102 C SER A 266 16.014 12.231 56.851 1.00 59.70 C ATOM 103 O SER A 266 16.657 11.574 56.023 1.00 59.73 O ATOM 104 CB SER A 266 15.592 10.499 58.570 1.00 62.07 C ATOM 105 OG SER A 266 14.249 10.374 58.133 1.00 62.00 O ATOM 106 HG SER A 266 13.678 11.004 58.641 1.00 0.00 H ATOM 107 H SER A 266 14.363 12.659 59.437 1.00 0.00 H ATOM 108 N LEU A 267 15.216 13.231 56.504 1.00 57.47 N ATOM 109 CA LEU A 267 15.010 13.566 55.105 1.00 57.22 C ATOM 110 C LEU A 267 15.656 14.906 54.782 1.00 61.20 C ATOM 111 O LEU A 267 15.444 15.894 55.488 1.00 57.44 O ATOM 112 CB LEU A 267 13.516 13.603 54.807 1.00 56.29 C ATOM 113 CG LEU A 267 13.040 13.294 53.406 1.00 64.08 C ATOM 114 CD1 LEU A 267 13.588 11.931 52.956 1.00 61.72 C ATOM 115 CD2 LEU A 267 11.517 13.332 53.387 1.00 63.85 C ATOM 116 H LEU A 267 14.732 13.782 57.241 1.00 0.00 H ATOM 117 N ARG A 268 16.424 14.951 53.701 1.00 54.29 N ATOM 118 CA ARG A 268 17.035 16.204 53.268 1.00 55.84 C ATOM 119 C ARG A 268 16.715 16.509 51.800 1.00 54.33 C ATOM 120 O ARG A 268 17.041 15.735 50.901 1.00 48.46 O ATOM 121 CB ARG A 268 18.549 16.134 53.495 1.00 71.27 C ATOM 122 CG ARG A 268 19.362 17.271 52.898 1.00 82.80 C ATOM 123 CD ARG A 268 20.856 17.125 53.247 1.00 93.28 C ATOM 124 NE ARG A 268 21.524 16.121 52.408 1.00100.16 N ATOM 125 CZ ARG A 268 22.464 15.281 52.839 1.00103.99 C ATOM 126 NH1 ARG A 268 22.864 15.318 54.105 1.00107.82 N ATOM 127 NH2 ARG A 268 23.011 14.406 52.001 1.00102.71 N ATOM 128 HE ARG A 268 21.244 16.062 51.408 1.00 0.00 H ATOM 129 HH12 ARG A 268 23.598 14.661 54.438 1.00 0.00 H ATOM 130 HH11 ARG A 268 22.443 16.004 54.763 1.00 0.00 H ATOM 131 HH22 ARG A 268 23.745 13.751 52.339 1.00 0.00 H ATOM 132 HH21 ARG A 268 22.705 14.376 51.007 1.00 0.00 H ATOM 133 H ARG A 268 16.593 14.082 53.155 1.00 0.00 H ATOM 134 N LEU A 269 16.064 17.639 51.566 1.00 52.22 N ATOM 135 CA LEU A 269 15.691 18.023 50.219 1.00 52.12 C ATOM 136 C LEU A 269 16.804 18.896 49.663 1.00 56.58 C ATOM 137 O LEU A 269 17.092 19.961 50.211 1.00 56.34 O ATOM 138 CB LEU A 269 14.354 18.768 50.225 1.00 49.84 C ATOM 139 CG LEU A 269 13.038 18.035 50.516 1.00 50.38 C ATOM 140 CD1 LEU A 269 12.951 17.590 51.969 1.00 57.49 C ATOM 141 CD2 LEU A 269 11.886 18.994 50.234 1.00 49.80 C ATOM 142 H LEU A 269 15.817 18.261 52.362 1.00 0.00 H ATOM 143 N GLU A 270 17.388 18.473 48.548 1.00 52.37 N ATOM 144 CA GLU A 270 18.595 19.106 48.029 1.00 58.29 C ATOM 145 C GLU A 270 18.293 19.930 46.789 1.00 58.51 C ATOM 146 O GLU A 270 18.432 21.152 46.786 1.00 65.24 O ATOM 147 CB GLU A 270 19.660 18.054 47.734 1.00 59.74 C ATOM 148 CG GLU A 270 20.020 17.205 48.944 1.00 63.28 C ATOM 149 CD GLU A 270 20.948 16.051 48.604 1.00 68.69 C ATOM 150 OE1 GLU A 270 21.296 15.282 49.521 1.00 74.07 O ATOM 151 OE2 GLU A 270 21.332 15.906 47.425 1.00 68.39 O ATOM 152 H GLU A 270 16.974 17.670 48.032 1.00 0.00 H ATOM 153 N VAL A 271 17.936 19.251 45.715 1.00 57.50 N ATOM 154 CA VAL A 271 17.653 19.908 44.452 1.00 55.43 C ATOM 155 C VAL A 271 16.179 19.738 44.064 1.00 53.81 C ATOM 156 O VAL A 271 15.627 18.638 44.133 1.00 49.90 O ATOM 157 CB VAL A 271 18.567 19.336 43.344 1.00 59.83 C ATOM 158 CG1 VAL A 271 18.224 19.924 41.986 1.00 57.65 C ATOM 159 CG2 VAL A 271 20.041 19.568 43.705 1.00 60.00 C ATOM 160 H VAL A 271 17.855 18.216 45.775 1.00 0.00 H ATOM 161 N LYS A 272 15.532 20.830 43.680 1.00 49.19 N ATOM 162 CA LYS A 272 14.134 20.758 43.267 1.00 51.29 C ATOM 163 C LYS A 272 14.035 20.328 41.809 1.00 54.27 C ATOM 164 O LYS A 272 14.749 20.844 40.953 1.00 55.07 O ATOM 165 CB LYS A 272 13.451 22.086 43.501 1.00 54.94 C ATOM 166 CG LYS A 272 12.047 22.161 43.007 1.00 57.57 C ATOM 167 CD LYS A 272 11.642 23.603 43.086 1.00 67.71 C ATOM 168 CE LYS A 272 10.150 23.773 43.212 1.00 74.47 C ATOM 169 NZ LYS A 272 9.825 25.232 43.173 1.00 79.79 N ATOM 170 HZ1 LYS A 272 10.303 25.713 43.961 1.00 0.00 H ATOM 171 HZ2 LYS A 272 10.151 25.634 42.271 1.00 0.00 H ATOM 172 HZ3 LYS A 272 8.796 25.359 43.259 1.00 0.00 H ATOM 173 H LYS A 272 16.025 21.746 43.673 1.00 0.00 H ATOM 174 N LEU A 273 13.145 19.380 41.540 1.00 56.72 N ATOM 175 CA LEU A 273 13.087 18.710 40.244 1.00 54.56 C ATOM 176 C LEU A 273 11.917 19.192 39.420 1.00 60.10 C ATOM 177 O LEU A 273 11.985 19.254 38.198 1.00 65.12 O ATOM 178 CB LEU A 273 12.995 17.204 40.449 1.00 51.27 C ATOM 179 CG LEU A 273 14.244 16.621 41.117 1.00 50.50 C ATOM 180 CD1 LEU A 273 14.133 15.116 41.315 1.00 45.90 C ATOM 181 CD2 LEU A 273 15.511 16.991 40.345 1.00 49.93 C ATOM 182 H LEU A 273 12.466 19.105 42.278 1.00 0.00 H ATOM 183 N GLY A 274 10.833 19.548 40.092 1.00 63.72 N ATOM 184 CA GLY A 274 9.640 19.947 39.381 1.00 65.83 C ATOM 185 C GLY A 274 8.676 20.702 40.258 1.00 71.97 C ATOM 186 O GLY A 274 8.857 20.801 41.477 1.00 70.48 O ATOM 187 H GLY A 274 10.840 19.540 41.132 1.00 0.00 H ATOM 188 N GLN A 275 7.634 21.219 39.623 1.00 82.61 N ATOM 189 CA GLN A 275 6.666 22.058 40.293 1.00 87.45 C ATOM 190 C GLN A 275 5.249 21.638 39.953 1.00 91.03 C ATOM 191 O GLN A 275 5.020 20.744 39.133 1.00 94.41 O ATOM 192 CB GLN A 275 6.877 23.525 39.883 1.00 92.24 C ATOM 193 CG GLN A 275 7.411 24.508 40.945 1.00 95.49 C ATOM 194 CD GLN A 275 6.501 24.681 42.156 1.00 99.46 C ATOM 195 OE1 GLN A 275 5.425 24.087 42.241 1.00102.38 O ATOM 196 NE2 GLN A 275 6.918 25.537 43.084 1.00101.50 N ATOM 197 HE22 GLN A 275 7.834 26.018 42.974 1.00 0.00 H ATOM 198 HE21 GLN A 275 6.329 25.726 43.920 1.00 0.00 H ATOM 199 H GLN A 275 7.509 21.015 38.611 1.00 0.00 H ATOM 200 N GLY A 276 4.304 22.297 40.611 1.00 93.05 N ATOM 201 CA GLY A 276 2.893 22.148 40.330 1.00 96.78 C ATOM 202 C GLY A 276 2.104 23.071 41.236 1.00107.08 C ATOM 203 O GLY A 276 2.678 23.824 42.024 1.00105.13 O ATOM 204 H GLY A 276 4.592 22.952 41.365 1.00 0.00 H ATOM 205 N CYS A 277 0.783 23.018 41.122 1.00135.07 N ATOM 206 CA CYS A 277 -0.086 23.846 41.944 1.00140.28 C ATOM 207 C CYS A 277 -0.355 23.106 43.251 1.00141.73 C ATOM 208 O CYS A 277 -0.820 23.694 44.231 1.00147.58 O ATOM 209 CB CYS A 277 -1.387 24.181 41.198 1.00145.68 C ATOM 210 SG CYS A 277 -2.719 24.918 42.187 1.00195.04 S ATOM 211 H CYS A 277 0.359 22.369 40.429 1.00 0.00 H ATOM 212 N PHE A 278 -0.021 21.817 43.272 1.00127.59 N ATOM 213 CA PHE A 278 -0.389 20.963 44.395 1.00117.42 C ATOM 214 C PHE A 278 0.808 20.456 45.189 1.00102.42 C ATOM 215 O PHE A 278 0.649 19.853 46.250 1.00105.45 O ATOM 216 CB PHE A 278 -1.200 19.761 43.890 1.00115.17 C ATOM 217 CG PHE A 278 -2.522 20.134 43.272 1.00119.17 C ATOM 218 CD1 PHE A 278 -3.631 20.364 44.072 1.00121.23 C ATOM 219 CD2 PHE A 278 -2.662 20.237 41.895 1.00119.20 C ATOM 220 CE1 PHE A 278 -4.850 20.707 43.518 1.00123.24 C ATOM 221 CE2 PHE A 278 -3.881 20.579 41.333 1.00120.83 C ATOM 222 CZ PHE A 278 -4.975 20.814 42.146 1.00123.84 C ATOM 223 H PHE A 278 0.511 21.413 42.475 1.00 0.00 H ATOM 224 N GLY A 279 2.007 20.701 44.681 1.00 82.30 N ATOM 225 CA GLY A 279 3.194 20.257 45.374 1.00 76.29 C ATOM 226 C GLY A 279 4.472 20.471 44.596 1.00 66.65 C ATOM 227 O GLY A 279 4.471 21.054 43.516 1.00 62.04 O ATOM 228 H GLY A 279 2.094 21.214 43.781 1.00 0.00 H ATOM 229 N GLU A 280 5.571 20.009 45.179 1.00 62.35 N ATOM 230 CA GLU A 280 6.887 20.033 44.557 1.00 56.83 C ATOM 231 C GLU A 280 7.473 18.620 44.498 1.00 49.82 C ATOM 232 O GLU A 280 7.012 17.702 45.183 1.00 50.28 O ATOM 233 CB GLU A 280 7.834 20.950 45.334 1.00 63.21 C ATOM 234 CG GLU A 280 7.165 22.126 46.006 1.00 72.36 C ATOM 235 CD GLU A 280 8.156 23.159 46.514 1.00 81.97 C ATOM 236 OE1 GLU A 280 9.308 22.785 46.832 1.00 82.23 O ATOM 237 OE2 GLU A 280 7.786 24.349 46.586 1.00 89.49 O ATOM 238 H GLU A 280 5.487 19.607 46.134 1.00 0.00 H ATOM 239 N VAL A 281 8.481 18.444 43.658 1.00 42.61 N ATOM 240 CA VAL A 281 9.230 17.207 43.628 1.00 36.92 C ATOM 241 C VAL A 281 10.706 17.543 43.781 1.00 40.35 C ATOM 242 O VAL A 281 11.232 18.369 43.046 1.00 45.51 O ATOM 243 CB VAL A 281 9.005 16.419 42.330 1.00 45.17 C ATOM 244 CG1 VAL A 281 9.935 15.217 42.286 1.00 46.38 C ATOM 245 CG2 VAL A 281 7.550 15.981 42.218 1.00 48.20 C ATOM 246 H VAL A 281 8.740 19.212 43.006 1.00 0.00 H ATOM 247 N TRP A 282 11.370 16.906 44.736 1.00 43.07 N ATOM 248 CA TRP A 282 12.775 17.184 45.023 1.00 45.35 C ATOM 249 C TRP A 282 13.665 15.955 44.946 1.00 46.37 C ATOM 250 O TRP A 282 13.237 14.866 45.288 1.00 51.46 O ATOM 251 CB TRP A 282 12.928 17.782 46.419 1.00 42.14 C ATOM 252 CG TRP A 282 12.383 19.183 46.591 1.00 43.75 C ATOM 253 CD1 TRP A 282 11.078 19.570 46.556 1.00 43.24 C ATOM 254 CD2 TRP A 282 13.147 20.372 46.833 1.00 44.84 C ATOM 255 NE1 TRP A 282 10.979 20.927 46.760 1.00 42.10 N ATOM 256 CE2 TRP A 282 12.235 21.442 46.931 1.00 45.81 C ATOM 257 CE3 TRP A 282 14.514 20.634 46.974 1.00 48.12 C ATOM 258 CZ2 TRP A 282 12.644 22.753 47.173 1.00 51.47 C ATOM 259 CZ3 TRP A 282 14.919 21.937 47.212 1.00 53.10 C ATOM 260 CH2 TRP A 282 13.987 22.980 47.307 1.00 51.66 C ATOM 261 HE1 TRP A 282 10.094 21.472 46.781 1.00 0.00 H ATOM 262 H TRP A 282 10.874 16.185 45.299 1.00 0.00 H ATOM 263 N MET A 283 14.906 16.131 44.506 1.00 47.36 N ATOM 264 CA MET A 283 15.929 15.107 44.715 1.00 44.27 C ATOM 265 C MET A 283 16.495 15.308 46.118 1.00 49.20 C ATOM 266 O MET A 283 16.765 16.434 46.519 1.00 46.93 O ATOM 267 CB MET A 283 17.048 15.202 43.676 1.00 45.86 C ATOM 268 CG MET A 283 18.291 14.415 44.046 1.00 50.74 C ATOM 269 SD MET A 283 19.533 14.366 42.738 1.00 97.22 S ATOM 270 CE MET A 283 19.986 16.101 42.626 1.00 81.18 C ATOM 271 H MET A 283 15.153 17.009 44.006 1.00 0.00 H ATOM 272 N GLY A 284 16.691 14.229 46.863 1.00 50.24 N ATOM 273 CA GLY A 284 17.176 14.365 48.216 1.00 50.15 C ATOM 274 C GLY A 284 17.929 13.171 48.751 1.00 50.90 C ATOM 275 O GLY A 284 18.318 12.255 48.015 1.00 47.33 O ATOM 276 H GLY A 284 16.495 13.285 46.473 1.00 0.00 H ATOM 277 N THR A 285 18.151 13.211 50.053 1.00 44.68 N ATOM 278 CA THR A 285 18.821 12.138 50.775 1.00 56.66 C ATOM 279 C THR A 285 17.981 11.677 51.962 1.00 53.50 C ATOM 280 O THR A 285 17.397 12.487 52.675 1.00 56.98 O ATOM 281 CB THR A 285 20.213 12.576 51.289 1.00 63.59 C ATOM 282 OG1 THR A 285 20.992 13.087 50.202 1.00 67.62 O ATOM 283 CG2 THR A 285 20.946 11.404 51.910 1.00 65.93 C ATOM 284 HG1 THR A 285 20.529 13.866 49.804 1.00 0.00 H ATOM 285 H THR A 285 17.833 14.046 50.586 1.00 0.00 H ATOM 286 N TRP A 286 17.899 10.366 52.135 1.00 53.03 N ATOM 287 CA TRP A 286 17.183 9.728 53.233 1.00 51.61 C ATOM 288 C TRP A 286 18.162 9.005 54.171 1.00 61.99 C ATOM 289 O TRP A 286 18.960 8.190 53.712 1.00 61.60 O ATOM 290 CB TRP A 286 16.166 8.738 52.687 1.00 47.24 C ATOM 291 CG TRP A 286 15.381 7.985 53.716 1.00 48.76 C ATOM 292 CD1 TRP A 286 15.041 8.400 54.973 1.00 49.89 C ATOM 293 CD2 TRP A 286 14.892 6.641 53.589 1.00 53.19 C ATOM 294 NE1 TRP A 286 14.333 7.410 55.617 1.00 53.65 N ATOM 295 CE2 TRP A 286 14.235 6.320 54.788 1.00 55.74 C ATOM 296 CE3 TRP A 286 14.936 5.686 52.562 1.00 52.57 C ATOM 297 CZ2 TRP A 286 13.624 5.078 54.996 1.00 57.74 C ATOM 298 CZ3 TRP A 286 14.327 4.459 52.770 1.00 55.49 C ATOM 299 CH2 TRP A 286 13.680 4.170 53.976 1.00 59.07 C ATOM 300 HE1 TRP A 286 13.937 7.477 56.576 1.00 0.00 H ATOM 301 H TRP A 286 18.376 9.753 51.443 1.00 0.00 H ATOM 302 N ASN A 287 18.096 9.298 55.469 1.00 62.59 N ATOM 303 CA ASN A 287 19.026 8.743 56.457 1.00 67.39 C ATOM 304 C ASN A 287 20.489 9.074 56.147 1.00 70.82 C ATOM 305 O ASN A 287 21.388 8.327 56.527 1.00 74.59 O ATOM 306 CB ASN A 287 18.862 7.222 56.581 1.00 67.79 C ATOM 307 CG ASN A 287 17.509 6.821 57.137 1.00 68.54 C ATOM 308 OD1 ASN A 287 16.981 7.463 58.039 1.00 69.21 O ATOM 309 ND2 ASN A 287 16.941 5.748 56.595 1.00 69.10 N ATOM 310 HD22 ASN A 287 17.425 5.233 55.832 1.00 0.00 H ATOM 311 HD21 ASN A 287 16.013 5.423 56.934 1.00 0.00 H ATOM 312 H ASN A 287 17.353 9.948 55.795 1.00 0.00 H ATOM 313 N GLY A 288 20.719 10.176 55.436 1.00 70.19 N ATOM 314 CA GLY A 288 22.064 10.642 55.133 1.00 76.17 C ATOM 315 C GLY A 288 22.884 9.767 54.198 1.00 83.10 C ATOM 316 O GLY A 288 24.048 10.072 53.930 1.00 88.43 O ATOM 317 H GLY A 288 19.908 10.724 55.084 1.00 0.00 H ATOM 318 N THR A 289 22.288 8.683 53.703 1.00 80.34 N ATOM 319 CA THR A 289 23.011 7.720 52.871 1.00 79.99 C ATOM 320 C THR A 289 22.289 7.348 51.569 1.00 76.47 C ATOM 321 O THR A 289 22.942 6.976 50.595 1.00 81.34 O ATOM 322 CB THR A 289 23.301 6.406 53.641 1.00 83.89 C ATOM 323 OG1 THR A 289 22.068 5.789 54.028 1.00 84.99 O ATOM 324 CG2 THR A 289 24.138 6.672 54.886 1.00 88.57 C ATOM 325 HG1 THR A 289 21.535 5.585 53.219 1.00 0.00 H ATOM 326 H THR A 289 21.283 8.517 53.913 1.00 0.00 H ATOM 327 N THR A 290 20.957 7.447 51.549 1.00 68.29 N ATOM 328 CA THR A 290 20.171 6.978 50.398 1.00 67.36 C ATOM 329 C THR A 290 19.605 8.099 49.526 1.00 61.42 C ATOM 330 O THR A 290 18.805 8.913 49.991 1.00 52.45 O ATOM 331 CB THR A 290 18.978 6.104 50.858 1.00 63.34 C ATOM 332 OG1 THR A 290 19.430 5.111 51.785 1.00 65.32 O ATOM 333 CG2 THR A 290 18.317 5.431 49.663 1.00 54.65 C ATOM 334 HG1 THR A 290 18.662 4.557 52.074 1.00 0.00 H ATOM 335 H THR A 290 20.465 7.865 52.365 1.00 0.00 H ATOM 336 N ARG A 291 19.993 8.117 48.252 1.00 55.88 N ATOM 337 CA ARG A 291 19.448 9.098 47.321 1.00 57.48 C ATOM 338 C ARG A 291 18.017 8.769 46.940 1.00 54.87 C ATOM 339 O ARG A 291 17.693 7.639 46.566 1.00 53.51 O ATOM 340 CB ARG A 291 20.333 9.247 46.085 1.00 60.08 C ATOM 341 CG ARG A 291 19.750 10.204 45.061 1.00 62.12 C ATOM 342 CD ARG A 291 20.828 10.853 44.232 1.00 69.62 C ATOM 343 NE ARG A 291 21.580 11.775 45.075 1.00 81.58 N ATOM 344 CZ ARG A 291 22.625 12.491 44.675 1.00 89.58 C ATOM 345 NH1 ARG A 291 23.077 12.386 43.429 1.00 90.83 N ATOM 346 NH2 ARG A 291 23.221 13.312 45.531 1.00 92.58 N ATOM 347 HE ARG A 291 21.275 11.880 46.064 1.00 0.00 H ATOM 348 HH12 ARG A 291 23.896 12.950 43.124 1.00 0.00 H ATOM 349 HH11 ARG A 291 22.612 11.740 42.760 1.00 0.00 H ATOM 350 HH22 ARG A 291 24.040 13.876 45.226 1.00 0.00 H ATOM 351 HH21 ARG A 291 22.869 13.391 46.507 1.00 0.00 H ATOM 352 H ARG A 291 20.692 7.424 47.918 1.00 0.00 H ATOM 353 N VAL A 292 17.153 9.767 47.072 1.00 48.00 N ATOM 354 CA VAL A 292 15.727 9.560 46.908 1.00 40.84 C ATOM 355 C VAL A 292 15.039 10.684 46.166 1.00 40.54 C ATOM 356 O VAL A 292 15.590 11.773 46.000 1.00 43.89 O ATOM 357 CB VAL A 292 15.041 9.413 48.271 1.00 40.97 C ATOM 358 CG1 VAL A 292 15.497 8.148 48.962 1.00 42.32 C ATOM 359 CG2 VAL A 292 15.339 10.658 49.147 1.00 41.90 C ATOM 360 H VAL A 292 17.506 10.719 47.298 1.00 0.00 H ATOM 361 N ALA A 293 13.815 10.402 45.741 1.00 44.01 N ATOM 362 CA ALA A 293 12.906 11.403 45.214 1.00 41.47 C ATOM 363 C ALA A 293 11.901 11.692 46.309 1.00 42.36 C ATOM 364 O ALA A 293 11.408 10.780 46.981 1.00 41.65 O ATOM 365 CB ALA A 293 12.201 10.912 43.947 1.00 40.32 C ATOM 366 H ALA A 293 13.491 9.415 45.788 1.00 0.00 H ATOM 367 N ILE A 294 11.625 12.971 46.500 1.00 40.10 N ATOM 368 CA ILE A 294 10.728 13.423 47.545 1.00 43.31 C ATOM 369 C ILE A 294 9.594 14.254 46.952 1.00 44.87 C ATOM 370 O ILE A 294 9.836 15.262 46.283 1.00 44.96 O ATOM 371 CB ILE A 294 11.487 14.243 48.592 1.00 47.56 C ATOM 372 CG1 ILE A 294 12.694 13.455 49.108 1.00 44.90 C ATOM 373 CG2 ILE A 294 10.572 14.638 49.739 1.00 49.51 C ATOM 374 CD1 ILE A 294 13.746 14.347 49.786 1.00 42.84 C ATOM 375 H ILE A 294 12.067 13.678 45.878 1.00 0.00 H ATOM 376 N LYS A 295 8.364 13.801 47.158 1.00 45.00 N ATOM 377 CA LYS A 295 7.189 14.529 46.698 1.00 48.86 C ATOM 378 C LYS A 295 6.498 15.232 47.881 1.00 48.58 C ATOM 379 O LYS A 295 6.181 14.589 48.891 1.00 46.63 O ATOM 380 CB LYS A 295 6.227 13.578 45.980 1.00 49.82 C ATOM 381 CG LYS A 295 4.969 14.243 45.436 1.00 58.54 C ATOM 382 CD LYS A 295 4.135 13.223 44.622 1.00 66.82 C ATOM 383 CE LYS A 295 2.869 13.851 44.010 1.00 73.32 C ATOM 384 NZ LYS A 295 2.542 13.365 42.626 1.00 74.49 N ATOM 385 HZ1 LYS A 295 3.331 13.587 41.986 1.00 0.00 H ATOM 386 HZ2 LYS A 295 2.391 12.336 42.648 1.00 0.00 H ATOM 387 HZ3 LYS A 295 1.678 13.836 42.289 1.00 0.00 H ATOM 388 H LYS A 295 8.235 12.901 47.662 1.00 0.00 H ATOM 389 N THR A 296 6.269 16.541 47.766 1.00 43.23 N ATOM 390 CA THR A 296 5.582 17.277 48.823 1.00 47.10 C ATOM 391 C THR A 296 4.155 17.659 48.438 1.00 52.31 C ATOM 392 O THR A 296 3.800 17.704 47.251 1.00 43.95 O ATOM 393 CB THR A 296 6.332 18.578 49.186 1.00 43.87 C ATOM 394 OG1 THR A 296 6.161 19.537 48.131 1.00 47.31 O ATOM 395 CG2 THR A 296 7.815 18.314 49.385 1.00 44.99 C ATOM 396 HG1 THR A 296 5.197 19.731 48.016 1.00 0.00 H ATOM 397 H THR A 296 6.584 17.044 46.912 1.00 0.00 H ATOM 398 N LEU A 297 3.339 17.949 49.448 1.00 50.34 N ATOM 399 CA LEU A 297 2.008 18.475 49.198 1.00 55.61 C ATOM 400 C LEU A 297 1.922 19.853 49.820 1.00 62.95 C ATOM 401 O LEU A 297 2.348 20.050 50.961 1.00 71.91 O ATOM 402 CB LEU A 297 0.922 17.552 49.755 1.00 57.64 C ATOM 403 CG LEU A 297 -0.416 18.226 50.080 1.00 66.39 C ATOM 404 CD1 LEU A 297 -1.135 18.627 48.784 1.00 64.44 C ATOM 405 CD2 LEU A 297 -1.312 17.334 50.940 1.00 69.82 C ATOM 406 H LEU A 297 3.657 17.798 50.426 1.00 0.00 H ATOM 407 N LYS A 298 1.381 20.812 49.083 1.00 72.99 N ATOM 408 CA LYS A 298 1.292 22.146 49.626 1.00 80.57 C ATOM 409 C LYS A 298 0.008 22.235 50.433 1.00 86.99 C ATOM 410 O LYS A 298 -1.053 21.841 49.955 1.00 91.79 O ATOM 411 CB LYS A 298 1.315 23.189 48.513 1.00 81.71 C ATOM 412 CG LYS A 298 0.985 24.584 48.988 1.00 83.01 C ATOM 413 CD LYS A 298 2.235 25.433 49.125 1.00 80.72 C ATOM 414 CE LYS A 298 1.913 26.737 49.830 1.00 77.88 C ATOM 415 NZ LYS A 298 0.679 27.342 49.260 1.00 76.84 N ATOM 416 HZ1 LYS A 298 0.822 27.530 48.247 1.00 0.00 H ATOM 417 HZ2 LYS A 298 -0.117 26.684 49.383 1.00 0.00 H ATOM 418 HZ3 LYS A 298 0.472 28.234 49.753 1.00 0.00 H ATOM 419 H LYS A 298 1.026 20.606 48.127 1.00 0.00 H ATOM 420 N PRO A 299 0.113 22.731 51.673 1.00 82.37 N ATOM 421 CA PRO A 299 -0.979 22.898 52.637 1.00 85.96 C ATOM 422 C PRO A 299 -2.252 23.494 52.031 1.00 83.94 C ATOM 423 O PRO A 299 -2.188 24.525 51.355 1.00 82.95 O ATOM 424 CB PRO A 299 -0.380 23.846 53.676 1.00 89.08 C ATOM 425 CG PRO A 299 1.113 23.657 53.571 1.00 85.55 C ATOM 426 CD PRO A 299 1.429 22.914 52.306 1.00 83.08 C ATOM 427 N GLY A 300 -3.383 22.841 52.282 1.00 88.16 N ATOM 428 CA GLY A 300 -4.698 23.360 51.939 1.00 91.62 C ATOM 429 C GLY A 300 -4.935 23.750 50.490 1.00 94.21 C ATOM 430 O GLY A 300 -5.746 24.625 50.202 1.00 95.66 O ATOM 431 H GLY A 300 -3.324 21.913 52.747 1.00 0.00 H ATOM 432 N THR A 301 -4.236 23.094 49.572 1.00 95.88 N ATOM 433 CA THR A 301 -4.444 23.318 48.147 1.00 97.65 C ATOM 434 C THR A 301 -5.117 22.076 47.585 1.00 99.48 C ATOM 435 O THR A 301 -5.743 22.109 46.522 1.00105.09 O ATOM 436 CB THR A 301 -3.133 23.606 47.389 1.00 96.24 C ATOM 437 OG1 THR A 301 -2.242 22.489 47.510 1.00 95.15 O ATOM 438 CG2 THR A 301 -2.463 24.856 47.941 1.00 95.84 C ATOM 439 HG1 THR A 301 -2.039 22.333 48.466 1.00 0.00 H ATOM 440 H THR A 301 -3.522 22.403 49.877 1.00 0.00 H ATOM 441 N MET A 302 -4.988 20.981 48.329 1.00 94.78 N ATOM 442 CA MET A 302 -5.688 19.741 48.029 1.00 88.50 C ATOM 443 C MET A 302 -5.831 18.931 49.309 1.00 88.25 C ATOM 444 O MET A 302 -5.047 19.089 50.243 1.00 86.97 O ATOM 445 CB MET A 302 -4.920 18.939 46.966 1.00 81.33 C ATOM 446 CG MET A 302 -5.384 17.495 46.757 1.00 82.41 C ATOM 447 SD MET A 302 -4.555 16.652 45.386 1.00 92.52 S ATOM 448 CE MET A 302 -2.839 16.872 45.834 1.00 71.92 C ATOM 449 H MET A 302 -4.362 21.012 49.159 1.00 0.00 H ATOM 450 N SER A 303 -6.854 18.083 49.347 1.00 89.08 N ATOM 451 CA SER A 303 -7.170 17.281 50.518 1.00 90.49 C ATOM 452 C SER A 303 -6.023 16.313 50.808 1.00 89.11 C ATOM 453 O SER A 303 -5.520 15.653 49.896 1.00 86.32 O ATOM 454 CB SER A 303 -8.486 16.528 50.305 1.00 90.27 C ATOM 455 OG SER A 303 -8.720 15.589 51.336 1.00 88.69 O ATOM 456 HG SER A 303 -9.576 15.122 51.167 1.00 0.00 H ATOM 457 H SER A 303 -7.454 17.989 48.503 1.00 0.00 H ATOM 458 N PRO A 304 -5.580 16.253 52.073 1.00 84.84 N ATOM 459 CA PRO A 304 -4.489 15.362 52.480 1.00 84.23 C ATOM 460 C PRO A 304 -4.750 13.891 52.154 1.00 86.85 C ATOM 461 O PRO A 304 -3.813 13.154 51.845 1.00 83.60 O ATOM 462 CB PRO A 304 -4.420 15.568 53.997 1.00 83.21 C ATOM 463 CG PRO A 304 -4.953 16.943 54.212 1.00 84.33 C ATOM 464 CD PRO A 304 -6.040 17.105 53.185 1.00 85.93 C ATOM 465 N GLU A 305 -6.008 13.472 52.183 1.00 99.18 N ATOM 466 CA GLU A 305 -6.317 12.077 51.912 1.00102.77 C ATOM 467 C GLU A 305 -6.423 11.843 50.412 1.00 96.94 C ATOM 468 O GLU A 305 -6.244 10.722 49.942 1.00 98.84 O ATOM 469 CB GLU A 305 -7.610 11.651 52.623 1.00113.13 C ATOM 470 CG GLU A 305 -8.717 12.712 52.648 1.00120.36 C ATOM 471 CD GLU A 305 -8.580 13.708 53.800 1.00125.44 C ATOM 472 OE1 GLU A 305 -7.462 13.866 54.340 1.00125.41 O ATOM 473 OE2 GLU A 305 -9.591 14.355 54.150 1.00127.64 O ATOM 474 H GLU A 305 -6.774 14.141 52.400 1.00 0.00 H ATOM 475 N ALA A 306 -6.660 12.910 49.657 1.00 90.33 N ATOM 476 CA ALA A 306 -6.607 12.813 48.207 1.00 82.91 C ATOM 477 C ALA A 306 -5.161 12.764 47.720 1.00 82.71 C ATOM 478 O ALA A 306 -4.861 12.136 46.703 1.00 81.53 O ATOM 479 CB ALA A 306 -7.348 13.983 47.566 1.00 80.16 C ATOM 480 H ALA A 306 -6.885 13.821 50.106 1.00 0.00 H ATOM 481 N PHE A 307 -4.258 13.399 48.459 1.00 78.94 N ATOM 482 CA PHE A 307 -2.843 13.361 48.106 1.00 78.27 C ATOM 483 C PHE A 307 -2.187 12.036 48.488 1.00 80.58 C ATOM 484 O PHE A 307 -1.300 11.544 47.788 1.00 81.58 O ATOM 485 CB PHE A 307 -2.105 14.516 48.787 1.00 77.33 C ATOM 486 CG PHE A 307 -0.636 14.573 48.473 1.00 75.51 C ATOM 487 CD1 PHE A 307 0.296 14.095 49.379 1.00 75.07 C ATOM 488 CD2 PHE A 307 -0.189 15.087 47.265 1.00 73.90 C ATOM 489 CE1 PHE A 307 1.647 14.139 49.092 1.00 75.38 C ATOM 490 CE2 PHE A 307 1.162 15.139 46.971 1.00 71.87 C ATOM 491 CZ PHE A 307 2.082 14.663 47.884 1.00 75.10 C ATOM 492 H PHE A 307 -4.564 13.930 49.300 1.00 0.00 H ATOM 493 N LEU A 308 -2.662 11.446 49.577 1.00 78.69 N ATOM 494 CA LEU A 308 -2.128 10.190 50.089 1.00 81.95 C ATOM 495 C LEU A 308 -2.636 8.981 49.311 1.00 89.54 C ATOM 496 O LEU A 308 -2.165 7.862 49.513 1.00 92.78 O ATOM 497 CB LEU A 308 -2.470 10.035 51.565 1.00 83.66 C ATOM 498 CG LEU A 308 -1.537 10.758 52.537 1.00 80.67 C ATOM 499 CD1 LEU A 308 -2.138 10.730 53.930 1.00 77.53 C ATOM 500 CD2 LEU A 308 -0.142 10.151 52.531 1.00 78.11 C ATOM 501 H LEU A 308 -3.448 11.898 50.087 1.00 0.00 H ATOM 502 N GLN A 309 -3.624 9.208 48.452 1.00 93.71 N ATOM 503 CA GLN A 309 -4.223 8.143 47.653 1.00 99.54 C ATOM 504 C GLN A 309 -3.201 7.352 46.835 1.00 89.47 C ATOM 505 O GLN A 309 -3.284 6.123 46.748 1.00 84.95 O ATOM 506 CB GLN A 309 -5.275 8.743 46.719 1.00109.12 C ATOM 507 CG GLN A 309 -6.505 7.882 46.504 1.00119.20 C ATOM 508 CD GLN A 309 -7.580 8.612 45.721 1.00126.51 C ATOM 509 OE1 GLN A 309 -7.315 9.640 45.096 1.00128.55 O ATOM 510 NE2 GLN A 309 -8.802 8.091 45.760 1.00129.56 N ATOM 511 HE22 GLN A 309 -8.979 7.221 46.301 1.00 0.00 H ATOM 512 HE21 GLN A 309 -9.581 8.554 45.249 1.00 0.00 H ATOM 513 H GLN A 309 -3.983 10.178 48.345 1.00 0.00 H ATOM 514 N GLU A 310 -2.238 8.053 46.243 1.00 84.31 N ATOM 515 CA GLU A 310 -1.218 7.387 45.443 1.00 76.23 C ATOM 516 C GLU A 310 -0.324 6.504 46.308 1.00 70.54 C ATOM 517 O GLU A 310 0.015 5.385 45.933 1.00 69.29 O ATOM 518 CB GLU A 310 -0.340 8.394 44.691 1.00 74.87 C ATOM 519 CG GLU A 310 0.780 7.696 43.901 1.00 80.96 C ATOM 520 CD GLU A 310 1.626 8.628 43.042 1.00 83.46 C ATOM 521 OE1 GLU A 310 1.458 9.863 43.139 1.00 85.55 O ATOM 522 OE2 GLU A 310 2.454 8.109 42.257 1.00 78.89 O ATOM 523 H GLU A 310 -2.213 9.087 46.352 1.00 0.00 H ATOM 524 N ALA A 311 0.036 7.008 47.483 1.00 60.12 N ATOM 525 CA ALA A 311 0.897 6.269 48.406 1.00 55.85 C ATOM 526 C ALA A 311 0.273 4.952 48.852 1.00 55.27 C ATOM 527 O ALA A 311 0.980 3.952 49.007 1.00 51.70 O ATOM 528 CB ALA A 311 1.231 7.126 49.625 1.00 53.57 C ATOM 529 H ALA A 311 -0.303 7.953 47.754 1.00 0.00 H ATOM 530 N GLN A 312 -1.044 4.963 49.058 1.00 57.04 N ATOM 531 CA GLN A 312 -1.755 3.800 49.567 1.00 58.39 C ATOM 532 C GLN A 312 -1.688 2.649 48.553 1.00 60.93 C ATOM 533 O GLN A 312 -1.506 1.488 48.922 1.00 63.46 O ATOM 534 CB GLN A 312 -3.211 4.159 49.850 1.00 62.59 C ATOM 535 CG GLN A 312 -3.417 5.190 50.966 1.00 70.65 C ATOM 536 CD GLN A 312 -2.786 4.817 52.298 1.00 78.24 C ATOM 537 OE1 GLN A 312 -2.819 3.661 52.726 1.00 79.15 O ATOM 538 NE2 GLN A 312 -2.202 5.806 52.961 1.00 81.04 N ATOM 539 HE22 GLN A 312 -2.197 6.767 52.563 1.00 0.00 H ATOM 540 HE21 GLN A 312 -1.749 5.621 53.879 1.00 0.00 H ATOM 541 H GLN A 312 -1.580 5.829 48.848 1.00 0.00 H ATOM 542 N VAL A 313 -1.799 2.981 47.269 1.00 65.23 N ATOM 543 CA VAL A 313 -1.692 1.977 46.209 1.00 62.62 C ATOM 544 C VAL A 313 -0.265 1.440 46.130 1.00 63.64 C ATOM 545 O VAL A 313 -0.052 0.237 46.012 1.00 61.84 O ATOM 546 CB VAL A 313 -2.126 2.544 44.833 1.00 70.48 C ATOM 547 CG1 VAL A 313 -1.746 1.592 43.701 1.00 66.08 C ATOM 548 CG2 VAL A 313 -3.624 2.804 44.824 1.00 73.27 C ATOM 549 H VAL A 313 -1.965 3.975 47.013 1.00 0.00 H ATOM 550 N MET A 314 0.706 2.341 46.229 1.00 59.29 N ATOM 551 CA MET A 314 2.116 1.986 46.130 1.00 56.94 C ATOM 552 C MET A 314 2.569 1.092 47.297 1.00 57.10 C ATOM 553 O MET A 314 3.579 0.388 47.205 1.00 59.26 O ATOM 554 CB MET A 314 2.965 3.256 46.076 1.00 55.08 C ATOM 555 CG MET A 314 2.727 4.111 44.839 1.00 53.99 C ATOM 556 SD MET A 314 3.851 5.529 44.777 1.00 58.05 S ATOM 557 CE MET A 314 5.412 4.699 44.472 1.00 47.03 C ATOM 558 H MET A 314 0.450 3.337 46.383 1.00 0.00 H ATOM 559 N LYS A 315 1.818 1.113 48.393 1.00 56.59 N ATOM 560 CA LYS A 315 2.118 0.228 49.508 1.00 58.36 C ATOM 561 C LYS A 315 1.847 -1.218 49.084 1.00 63.30 C ATOM 562 O LYS A 315 2.540 -2.139 49.519 1.00 67.35 O ATOM 563 CB LYS A 315 1.297 0.592 50.750 1.00 61.74 C ATOM 564 CG LYS A 315 1.701 1.894 51.426 1.00 59.98 C ATOM 565 CD LYS A 315 0.714 2.232 52.537 1.00 64.46 C ATOM 566 CE LYS A 315 1.086 3.488 53.288 1.00 61.67 C ATOM 567 NZ LYS A 315 0.040 3.808 54.293 1.00 64.59 N ATOM 568 HZ1 LYS A 315 -0.870 3.954 53.810 1.00 0.00 H ATOM 569 HZ2 LYS A 315 -0.046 3.019 54.966 1.00 0.00 H ATOM 570 HZ3 LYS A 315 0.306 4.674 54.804 1.00 0.00 H ATOM 571 H LYS A 315 1.011 1.766 48.454 1.00 0.00 H ATOM 572 N LYS A 316 0.829 -1.410 48.247 1.00 58.88 N ATOM 573 CA LYS A 316 0.420 -2.751 47.834 1.00 58.26 C ATOM 574 C LYS A 316 1.156 -3.331 46.616 1.00 61.10 C ATOM 575 O LYS A 316 1.120 -4.537 46.396 1.00 67.63 O ATOM 576 CB LYS A 316 -1.088 -2.765 47.566 1.00 60.01 C ATOM 577 CG LYS A 316 -1.924 -2.362 48.778 1.00 68.80 C ATOM 578 CD LYS A 316 -3.397 -2.697 48.584 1.00 73.74 C ATOM 579 CE LYS A 316 -4.137 -2.700 49.916 1.00 77.00 C ATOM 580 NZ LYS A 316 -3.945 -1.402 50.612 1.00 80.45 N ATOM 581 HZ1 LYS A 316 -2.931 -1.250 50.785 1.00 0.00 H ATOM 582 HZ2 LYS A 316 -4.316 -0.633 50.018 1.00 0.00 H ATOM 583 HZ3 LYS A 316 -4.455 -1.417 51.518 1.00 0.00 H ATOM 584 H LYS A 316 0.313 -0.586 47.878 1.00 0.00 H ATOM 585 N LEU A 317 1.809 -2.484 45.828 1.00 53.02 N ATOM 586 CA LEU A 317 2.490 -2.929 44.618 1.00 51.69 C ATOM 587 C LEU A 317 4.010 -2.911 44.810 1.00 55.94 C ATOM 588 O LEU A 317 4.567 -1.945 45.337 1.00 57.11 O ATOM 589 CB LEU A 317 2.088 -2.051 43.428 1.00 44.17 C ATOM 590 CG LEU A 317 0.584 -2.044 43.123 1.00 49.24 C ATOM 591 CD1 LEU A 317 0.260 -1.149 41.941 1.00 50.46 C ATOM 592 CD2 LEU A 317 0.032 -3.451 42.888 1.00 48.20 C ATOM 593 H LEU A 317 1.835 -1.476 46.081 1.00 0.00 H ATOM 594 N ARG A 318 4.663 -4.012 44.449 1.00 48.56 N ATOM 595 CA ARG A 318 6.124 -4.101 44.485 1.00 47.21 C ATOM 596 C ARG A 318 6.618 -4.907 43.295 1.00 47.10 C ATOM 597 O ARG A 318 6.320 -6.092 43.165 1.00 49.39 O ATOM 598 CB ARG A 318 6.642 -4.714 45.791 1.00 50.86 C ATOM 599 CG ARG A 318 8.156 -4.973 45.774 1.00 54.47 C ATOM 600 CD ARG A 318 8.728 -5.388 47.117 1.00 63.49 C ATOM 601 NE ARG A 318 8.839 -4.268 48.057 1.00 69.98 N ATOM 602 CZ ARG A 318 7.998 -4.025 49.053 1.00 76.46 C ATOM 603 NH1 ARG A 318 6.940 -4.804 49.247 1.00 81.52 N ATOM 604 NH2 ARG A 318 8.210 -2.984 49.844 1.00 75.99 N ATOM 605 HE ARG A 318 9.638 -3.614 47.933 1.00 0.00 H ATOM 606 HH12 ARG A 318 6.285 -4.606 50.031 1.00 0.00 H ATOM 607 HH11 ARG A 318 6.766 -5.612 48.615 1.00 0.00 H ATOM 608 HH22 ARG A 318 7.556 -2.785 50.628 1.00 0.00 H ATOM 609 HH21 ARG A 318 9.030 -2.366 49.681 1.00 0.00 H ATOM 610 H ARG A 318 4.117 -4.838 44.130 1.00 0.00 H ATOM 611 N HIS A 319 7.364 -4.251 42.420 1.00 40.29 N ATOM 612 CA HIS A 319 7.870 -4.897 41.217 1.00 39.32 C ATOM 613 C HIS A 319 9.048 -4.101 40.685 1.00 41.41 C ATOM 614 O HIS A 319 9.106 -2.873 40.855 1.00 37.11 O ATOM 615 CB HIS A 319 6.773 -5.008 40.163 1.00 38.46 C ATOM 616 CG HIS A 319 7.150 -5.825 38.966 1.00 37.73 C ATOM 617 ND1 HIS A 319 7.677 -5.273 37.815 1.00 38.03 N ATOM 618 CD2 HIS A 319 7.070 -7.157 38.740 1.00 38.72 C ATOM 619 CE1 HIS A 319 7.892 -6.232 36.927 1.00 37.13 C ATOM 620 NE2 HIS A 319 7.535 -7.384 37.466 1.00 37.42 N ATOM 621 H HIS A 319 7.594 -3.252 42.596 1.00 0.00 H ATOM 622 N GLU A 320 9.985 -4.792 40.040 1.00 38.91 N ATOM 623 CA GLU A 320 11.214 -4.146 39.612 1.00 45.69 C ATOM 624 C GLU A 320 10.953 -3.072 38.565 1.00 36.53 C ATOM 625 O GLU A 320 11.776 -2.174 38.402 1.00 36.32 O ATOM 626 CB GLU A 320 12.216 -5.167 39.066 1.00 56.83 C ATOM 627 CG GLU A 320 11.771 -5.834 37.790 1.00 70.79 C ATOM 628 CD GLU A 320 12.768 -6.859 37.276 1.00 84.46 C ATOM 629 OE1 GLU A 320 13.919 -6.862 37.764 1.00 89.80 O ATOM 630 OE2 GLU A 320 12.404 -7.646 36.369 1.00 84.57 O ATOM 631 H GLU A 320 9.836 -5.802 39.841 1.00 0.00 H ATOM 632 N LYS A 321 9.818 -3.141 37.868 1.00 34.16 N ATOM 633 CA LYS A 321 9.527 -2.146 36.834 1.00 32.54 C ATOM 634 C LYS A 321 8.435 -1.139 37.229 1.00 32.41 C ATOM 635 O LYS A 321 7.881 -0.453 36.360 1.00 31.38 O ATOM 636 CB LYS A 321 9.140 -2.838 35.522 1.00 31.81 C ATOM 637 CG LYS A 321 10.256 -3.735 34.960 1.00 32.84 C ATOM 638 CD LYS A 321 11.574 -2.953 34.769 1.00 35.09 C ATOM 639 CE LYS A 321 12.707 -3.883 34.278 1.00 42.54 C ATOM 640 NZ LYS A 321 13.958 -3.095 34.023 1.00 33.96 N ATOM 641 HZ1 LYS A 321 13.771 -2.376 33.296 1.00 0.00 H ATOM 642 HZ2 LYS A 321 14.259 -2.630 34.903 1.00 0.00 H ATOM 643 HZ3 LYS A 321 14.709 -3.735 33.694 1.00 0.00 H ATOM 644 H LYS A 321 9.138 -3.904 38.060 1.00 0.00 H ATOM 645 N LEU A 322 8.131 -1.053 38.527 1.00 34.09 N ATOM 646 CA LEU A 322 7.307 0.033 39.060 1.00 35.08 C ATOM 647 C LEU A 322 8.134 0.873 40.032 1.00 34.03 C ATOM 648 O LEU A 322 8.868 0.315 40.840 1.00 35.03 O ATOM 649 CB LEU A 322 6.076 -0.485 39.806 1.00 37.89 C ATOM 650 CG LEU A 322 5.130 -1.526 39.207 1.00 43.93 C ATOM 651 CD1 LEU A 322 3.793 -1.528 39.952 1.00 43.12 C ATOM 652 CD2 LEU A 322 4.938 -1.424 37.692 1.00 38.91 C ATOM 653 H LEU A 322 8.491 -1.780 39.178 1.00 0.00 H ATOM 654 N VAL A 323 8.006 2.195 39.976 1.00 33.39 N ATOM 655 CA VAL A 323 8.745 3.046 40.931 1.00 33.85 C ATOM 656 C VAL A 323 8.356 2.666 42.354 1.00 35.47 C ATOM 657 O VAL A 323 7.172 2.575 42.679 1.00 36.08 O ATOM 658 CB VAL A 323 8.488 4.544 40.695 1.00 33.15 C ATOM 659 CG1 VAL A 323 9.269 5.389 41.702 1.00 33.93 C ATOM 660 CG2 VAL A 323 8.906 4.905 39.280 1.00 31.78 C ATOM 661 H VAL A 323 7.387 2.629 39.262 1.00 0.00 H ATOM 662 N GLN A 324 9.368 2.409 43.179 1.00 36.37 N ATOM 663 CA GLN A 324 9.163 1.861 44.508 1.00 38.14 C ATOM 664 C GLN A 324 8.999 2.959 45.584 1.00 43.25 C ATOM 665 O GLN A 324 9.778 3.916 45.641 1.00 38.38 O ATOM 666 CB GLN A 324 10.331 0.942 44.861 1.00 44.31 C ATOM 667 CG GLN A 324 10.217 0.293 46.239 1.00 50.19 C ATOM 668 CD GLN A 324 9.017 -0.635 46.327 1.00 56.27 C ATOM 669 OE1 GLN A 324 8.772 -1.445 45.420 1.00 66.19 O ATOM 670 NE2 GLN A 324 8.243 -0.504 47.401 1.00 52.92 N ATOM 671 HE22 GLN A 324 8.488 0.189 48.137 1.00 0.00 H ATOM 672 HE21 GLN A 324 7.393 -1.095 47.505 1.00 0.00 H ATOM 673 H GLN A 324 10.338 2.607 42.861 1.00 0.00 H ATOM 674 N LEU A 325 7.962 2.821 46.407 1.00 35.60 N ATOM 675 CA LEU A 325 7.779 3.658 47.589 1.00 40.85 C ATOM 676 C LEU A 325 8.799 3.256 48.634 1.00 42.51 C ATOM 677 O LEU A 325 9.001 2.065 48.860 1.00 44.51 O ATOM 678 CB LEU A 325 6.370 3.499 48.161 1.00 40.99 C ATOM 679 CG LEU A 325 6.029 4.265 49.444 1.00 43.29 C ATOM 680 CD1 LEU A 325 5.935 5.770 49.191 1.00 36.40 C ATOM 681 CD2 LEU A 325 4.749 3.707 50.081 1.00 47.37 C ATOM 682 H LEU A 325 7.254 2.088 46.200 1.00 0.00 H ATOM 683 N TYR A 326 9.439 4.240 49.259 1.00 44.53 N ATOM 684 CA TYR A 326 10.413 4.003 50.328 1.00 47.88 C ATOM 685 C TYR A 326 9.867 4.386 51.704 1.00 51.38 C ATOM 686 O TYR A 326 10.045 3.659 52.687 1.00 52.35 O ATOM 687 CB TYR A 326 11.696 4.796 50.083 1.00 50.38 C ATOM 688 CG TYR A 326 12.625 4.232 49.039 1.00 51.21 C ATOM 689 CD1 TYR A 326 12.378 3.012 48.429 1.00 50.57 C ATOM 690 CD2 TYR A 326 13.770 4.923 48.681 1.00 53.90 C ATOM 691 CE1 TYR A 326 13.244 2.507 47.473 1.00 48.37 C ATOM 692 CE2 TYR A 326 14.639 4.427 47.743 1.00 54.08 C ATOM 693 CZ TYR A 326 14.374 3.225 47.139 1.00 51.85 C ATOM 694 OH TYR A 326 15.253 2.758 46.196 1.00 54.24 O ATOM 695 HH TYR A 326 14.933 1.887 45.851 1.00 0.00 H ATOM 696 H TYR A 326 9.240 5.221 48.977 1.00 0.00 H ATOM 697 N ALA A 327 9.261 5.567 51.788 1.00 46.26 N ATOM 698 CA ALA A 327 8.784 6.059 53.072 1.00 50.00 C ATOM 699 C ALA A 327 7.750 7.151 52.905 1.00 47.25 C ATOM 700 O ALA A 327 7.541 7.684 51.804 1.00 43.05 O ATOM 701 CB ALA A 327 9.946 6.561 53.911 1.00 51.45 C ATOM 702 H ALA A 327 9.127 6.142 50.932 1.00 0.00 H ATOM 703 N VAL A 328 7.116 7.483 54.022 1.00 50.11 N ATOM 704 CA VAL A 328 6.067 8.483 54.044 1.00 56.80 C ATOM 705 C VAL A 328 6.081 9.291 55.351 1.00 53.19 C ATOM 706 O VAL A 328 6.370 8.769 56.437 1.00 49.86 O ATOM 707 CB VAL A 328 4.679 7.824 53.852 1.00 63.20 C ATOM 708 CG1 VAL A 328 4.365 6.921 55.025 1.00 63.91 C ATOM 709 CG2 VAL A 328 3.586 8.871 53.685 1.00 69.82 C ATOM 710 H VAL A 328 7.380 7.011 54.910 1.00 0.00 H ATOM 711 N VAL A 329 5.837 10.586 55.232 1.00 47.13 N ATOM 712 CA VAL A 329 5.504 11.391 56.399 1.00 49.98 C ATOM 713 C VAL A 329 4.049 11.785 56.204 1.00 52.24 C ATOM 714 O VAL A 329 3.759 12.616 55.342 1.00 50.72 O ATOM 715 CB VAL A 329 6.408 12.629 56.553 1.00 49.21 C ATOM 716 CG1 VAL A 329 5.985 13.442 57.775 1.00 47.84 C ATOM 717 CG2 VAL A 329 7.866 12.208 56.666 1.00 48.18 C ATOM 718 H VAL A 329 5.884 11.034 54.295 1.00 0.00 H ATOM 719 N SER A 330 3.139 11.143 56.940 1.00 60.57 N ATOM 720 CA SER A 330 1.715 11.209 56.608 1.00 67.08 C ATOM 721 C SER A 330 0.881 12.322 57.266 1.00 69.59 C ATOM 722 O SER A 330 -0.297 12.461 56.950 1.00 72.99 O ATOM 723 CB SER A 330 1.061 9.855 56.891 1.00 72.91 C ATOM 724 OG SER A 330 1.254 9.449 58.225 1.00 80.87 O ATOM 725 HG SER A 330 2.224 9.370 58.408 1.00 0.00 H ATOM 726 H SER A 330 3.447 10.587 57.763 1.00 0.00 H ATOM 727 N GLU A 331 1.455 13.112 58.166 1.00 69.78 N ATOM 728 CA GLU A 331 0.706 14.248 58.706 1.00 75.48 C ATOM 729 C GLU A 331 1.259 15.526 58.075 1.00 73.77 C ATOM 730 O GLU A 331 2.421 15.562 57.683 1.00 70.27 O ATOM 731 CB GLU A 331 0.776 14.327 60.240 1.00 83.09 C ATOM 732 CG GLU A 331 2.051 14.924 60.827 1.00 92.91 C ATOM 733 CD GLU A 331 3.295 14.075 60.634 1.00102.44 C ATOM 734 OE1 GLU A 331 3.164 12.851 60.423 1.00107.02 O ATOM 735 OE2 GLU A 331 4.410 14.641 60.704 1.00101.62 O ATOM 736 H GLU A 331 2.427 12.925 58.484 1.00 0.00 H ATOM 737 N GLU A 332 0.426 16.551 57.920 1.00 76.17 N ATOM 738 CA GLU A 332 0.878 17.781 57.272 1.00 77.69 C ATOM 739 C GLU A 332 1.983 18.476 58.059 1.00 74.12 C ATOM 740 O GLU A 332 1.914 18.549 59.281 1.00 79.69 O ATOM 741 CB GLU A 332 -0.276 18.756 57.050 1.00 85.36 C ATOM 742 CG GLU A 332 -1.278 18.296 56.017 1.00 96.97 C ATOM 743 CD GLU A 332 -1.753 19.438 55.130 1.00104.47 C ATOM 744 OE1 GLU A 332 -1.098 19.689 54.095 1.00105.17 O ATOM 745 OE2 GLU A 332 -2.763 20.094 55.462 1.00108.76 O ATOM 746 H GLU A 332 -0.553 16.477 58.262 1.00 0.00 H ATOM 747 N PRO A 333 3.035 18.944 57.362 1.00 65.35 N ATOM 748 CA PRO A 333 3.237 18.790 55.915 1.00 61.49 C ATOM 749 C PRO A 333 3.662 17.388 55.483 1.00 56.00 C ATOM 750 O PRO A 333 4.585 16.796 56.044 1.00 54.49 O ATOM 751 CB PRO A 333 4.332 19.815 55.602 1.00 63.57 C ATOM 752 CG PRO A 333 5.041 20.031 56.891 1.00 64.84 C ATOM 753 CD PRO A 333 4.005 19.882 57.955 1.00 63.89 C ATOM 754 N ILE A 334 2.951 16.875 54.487 1.00 51.72 N ATOM 755 CA ILE A 334 3.142 15.530 53.979 1.00 52.85 C ATOM 756 C ILE A 334 4.295 15.415 52.988 1.00 52.22 C ATOM 757 O ILE A 334 4.487 16.286 52.140 1.00 54.80 O ATOM 758 CB ILE A 334 1.847 15.020 53.312 1.00 58.61 C ATOM 759 CG1 ILE A 334 0.688 15.081 54.309 1.00 64.28 C ATOM 760 CG2 ILE A 334 2.024 13.604 52.760 1.00 60.99 C ATOM 761 CD1 ILE A 334 -0.618 14.588 53.729 1.00 62.68 C ATOM 762 H ILE A 334 2.219 17.468 54.048 1.00 0.00 H ATOM 763 N TYR A 335 5.074 14.344 53.126 1.00 54.98 N ATOM 764 CA TYR A 335 6.146 14.007 52.199 1.00 46.41 C ATOM 765 C TYR A 335 6.014 12.576 51.724 1.00 48.13 C ATOM 766 O TYR A 335 5.702 11.689 52.521 1.00 50.63 O ATOM 767 CB TYR A 335 7.512 14.217 52.849 1.00 48.21 C ATOM 768 CG TYR A 335 7.808 15.650 53.177 1.00 48.93 C ATOM 769 CD1 TYR A 335 7.273 16.260 54.309 1.00 48.79 C ATOM 770 CD2 TYR A 335 8.623 16.404 52.350 1.00 43.71 C ATOM 771 CE1 TYR A 335 7.540 17.583 54.598 1.00 51.40 C ATOM 772 CE2 TYR A 335 8.899 17.720 52.636 1.00 46.06 C ATOM 773 CZ TYR A 335 8.355 18.308 53.760 1.00 46.67 C ATOM 774 OH TYR A 335 8.626 19.620 54.044 1.00 47.32 O ATOM 775 HH TYR A 335 8.160 19.879 54.878 1.00 0.00 H ATOM 776 H TYR A 335 4.909 13.715 53.938 1.00 0.00 H ATOM 777 N ILE A 336 6.266 12.345 50.433 1.00 45.87 N ATOM 778 CA ILE A 336 6.290 10.995 49.865 1.00 44.19 C ATOM 779 C ILE A 336 7.674 10.691 49.331 1.00 43.55 C ATOM 780 O ILE A 336 8.209 11.442 48.516 1.00 39.85 O ATOM 781 CB ILE A 336 5.287 10.820 48.734 1.00 46.15 C ATOM 782 CG1 ILE A 336 3.879 11.124 49.220 1.00 50.73 C ATOM 783 CG2 ILE A 336 5.353 9.396 48.186 1.00 47.50 C ATOM 784 CD1 ILE A 336 3.339 10.053 50.073 1.00 56.13 C ATOM 785 H ILE A 336 6.452 13.154 49.807 1.00 0.00 H ATOM 786 N VAL A 337 8.266 9.615 49.830 1.00 38.39 N ATOM 787 CA VAL A 337 9.632 9.264 49.472 1.00 39.65 C ATOM 788 C VAL A 337 9.674 8.020 48.582 1.00 42.86 C ATOM 789 O VAL A 337 9.208 6.948 48.986 1.00 40.49 O ATOM 790 CB VAL A 337 10.465 9.026 50.737 1.00 40.62 C ATOM 791 CG1 VAL A 337 11.923 8.781 50.391 1.00 41.53 C ATOM 792 CG2 VAL A 337 10.347 10.240 51.668 1.00 45.91 C ATOM 793 H VAL A 337 7.742 9.008 50.492 1.00 0.00 H ATOM 794 N THR A 338 10.257 8.153 47.394 1.00 39.42 N ATOM 795 CA THR A 338 10.339 7.039 46.450 1.00 38.55 C ATOM 796 C THR A 338 11.764 6.839 45.950 1.00 44.55 C ATOM 797 O THR A 338 12.659 7.629 46.264 1.00 37.35 O ATOM 798 CB THR A 338 9.430 7.244 45.231 1.00 34.34 C ATOM 799 OG1 THR A 338 9.854 8.407 44.523 1.00 41.01 O ATOM 800 CG2 THR A 338 7.987 7.422 45.642 1.00 37.11 C ATOM 801 HG1 THR A 338 9.270 8.543 43.735 1.00 0.00 H ATOM 802 H THR A 338 10.665 9.072 47.130 1.00 0.00 H ATOM 803 N GLU A 339 11.987 5.776 45.178 1.00 44.34 N ATOM 804 CA GLU A 339 13.309 5.558 44.602 1.00 40.18 C ATOM 805 C GLU A 339 13.577 6.679 43.604 1.00 35.43 C ATOM 806 O GLU A 339 12.653 7.191 42.988 1.00 36.67 O ATOM 807 CB GLU A 339 13.422 4.157 43.948 1.00 41.67 C ATOM 808 CG GLU A 339 12.796 3.994 42.606 1.00 43.11 C ATOM 809 CD GLU A 339 12.921 2.561 42.052 1.00 45.79 C ATOM 810 OE1 GLU A 339 11.906 1.828 42.053 1.00 39.59 O ATOM 811 OE2 GLU A 339 14.019 2.172 41.602 1.00 43.25 O ATOM 812 H GLU A 339 11.219 5.102 44.986 1.00 0.00 H ATOM 813 N TYR A 340 14.840 7.071 43.467 1.00 37.89 N ATOM 814 CA TYR A 340 15.211 8.171 42.580 1.00 38.59 C ATOM 815 C TYR A 340 15.526 7.677 41.174 1.00 35.25 C ATOM 816 O TYR A 340 16.350 6.772 40.988 1.00 38.05 O ATOM 817 CB TYR A 340 16.403 8.934 43.162 1.00 40.88 C ATOM 818 CG TYR A 340 16.896 10.058 42.282 1.00 42.35 C ATOM 819 CD1 TYR A 340 16.080 11.141 42.009 1.00 40.60 C ATOM 820 CD2 TYR A 340 18.190 10.059 41.764 1.00 43.21 C ATOM 821 CE1 TYR A 340 16.511 12.180 41.219 1.00 46.44 C ATOM 822 CE2 TYR A 340 18.637 11.113 40.974 1.00 45.38 C ATOM 823 CZ TYR A 340 17.784 12.171 40.709 1.00 45.73 C ATOM 824 OH TYR A 340 18.182 13.226 39.921 1.00 53.85 O ATOM 825 HH TYR A 340 18.970 13.664 40.331 1.00 0.00 H ATOM 826 H TYR A 340 15.583 6.582 44.005 1.00 0.00 H ATOM 827 N MET A 341 14.853 8.258 40.186 1.00 33.92 N ATOM 828 CA MET A 341 15.056 7.887 38.777 1.00 30.49 C ATOM 829 C MET A 341 15.827 9.013 38.080 1.00 35.89 C ATOM 830 O MET A 341 15.262 10.063 37.719 1.00 32.47 O ATOM 831 CB MET A 341 13.702 7.635 38.112 1.00 31.08 C ATOM 832 CG MET A 341 12.864 6.568 38.848 1.00 29.50 C ATOM 833 SD MET A 341 13.692 4.960 38.800 1.00 37.59 S ATOM 834 CE MET A 341 13.599 4.606 37.040 1.00 31.48 C ATOM 835 H MET A 341 14.160 8.999 40.416 1.00 0.00 H ATOM 836 N SER A 342 17.119 8.783 37.886 1.00 35.94 N ATOM 837 CA SER A 342 18.066 9.853 37.584 1.00 38.23 C ATOM 838 C SER A 342 17.810 10.628 36.290 1.00 43.69 C ATOM 839 O SER A 342 18.257 11.751 36.151 1.00 48.31 O ATOM 840 CB SER A 342 19.470 9.265 37.546 1.00 38.38 C ATOM 841 OG SER A 342 19.551 8.212 36.585 1.00 42.77 O ATOM 842 HG SER A 342 20.470 7.844 36.577 1.00 0.00 H ATOM 843 H SER A 342 17.470 7.806 37.951 1.00 0.00 H ATOM 844 N LYS A 343 17.095 10.039 35.339 1.00 33.60 N ATOM 845 CA LYS A 343 16.955 10.671 34.034 1.00 31.08 C ATOM 846 C LYS A 343 15.584 11.298 33.820 1.00 34.89 C ATOM 847 O LYS A 343 15.309 11.818 32.747 1.00 38.36 O ATOM 848 CB LYS A 343 17.223 9.636 32.911 1.00 41.32 C ATOM 849 CG LYS A 343 18.631 9.028 32.940 1.00 41.54 C ATOM 850 CD LYS A 343 19.705 10.091 32.834 1.00 47.28 C ATOM 851 CE LYS A 343 21.102 9.473 32.877 1.00 57.97 C ATOM 852 NZ LYS A 343 22.173 10.503 32.805 1.00 61.62 N ATOM 853 HZ1 LYS A 343 22.081 11.035 31.916 1.00 0.00 H ATOM 854 HZ2 LYS A 343 22.081 11.154 33.611 1.00 0.00 H ATOM 855 HZ3 LYS A 343 23.103 10.038 32.837 1.00 0.00 H ATOM 856 H LYS A 343 16.634 9.125 35.526 1.00 0.00 H ATOM 857 N GLY A 344 14.725 11.296 34.833 1.00 35.13 N ATOM 858 CA GLY A 344 13.461 12.006 34.708 1.00 36.24 C ATOM 859 C GLY A 344 12.380 11.306 33.871 1.00 34.40 C ATOM 860 O GLY A 344 12.421 10.075 33.670 1.00 31.23 O ATOM 861 H GLY A 344 14.955 10.789 35.712 1.00 0.00 H ATOM 862 N SER A 345 11.390 12.067 33.398 1.00 28.39 N ATOM 863 CA SER A 345 10.266 11.436 32.699 1.00 29.12 C ATOM 864 C SER A 345 10.700 10.937 31.320 1.00 28.85 C ATOM 865 O SER A 345 11.575 11.533 30.681 1.00 26.70 O ATOM 866 CB SER A 345 9.088 12.396 32.577 1.00 34.13 C ATOM 867 OG SER A 345 9.159 13.229 31.441 1.00 36.06 O ATOM 868 HG SER A 345 8.369 13.825 31.420 1.00 0.00 H ATOM 869 H SER A 345 11.416 13.099 33.524 1.00 0.00 H ATOM 870 N LEU A 346 10.101 9.838 30.878 1.00 26.93 N ATOM 871 CA LEU A 346 10.415 9.279 29.567 1.00 25.49 C ATOM 872 C LEU A 346 10.121 10.315 28.496 1.00 25.65 C ATOM 873 O LEU A 346 10.892 10.472 27.552 1.00 24.15 O ATOM 874 CB LEU A 346 9.601 8.015 29.316 1.00 22.51 C ATOM 875 CG LEU A 346 9.726 7.352 27.935 1.00 26.13 C ATOM 876 CD1 LEU A 346 11.184 6.973 27.668 1.00 21.92 C ATOM 877 CD2 LEU A 346 8.792 6.120 27.859 1.00 19.95 C ATOM 878 H LEU A 346 9.394 9.366 31.478 1.00 0.00 H ATOM 879 N LEU A 347 9.010 11.040 28.653 1.00 25.73 N ATOM 880 CA LEU A 347 8.651 12.090 27.683 1.00 27.82 C ATOM 881 C LEU A 347 9.771 13.103 27.518 1.00 29.31 C ATOM 882 O LEU A 347 10.229 13.356 26.395 1.00 23.66 O ATOM 883 CB LEU A 347 7.368 12.826 28.106 1.00 24.60 C ATOM 884 CG LEU A 347 6.901 13.897 27.115 1.00 24.28 C ATOM 885 CD1 LEU A 347 6.599 13.278 25.736 1.00 21.94 C ATOM 886 CD2 LEU A 347 5.692 14.647 27.674 1.00 31.68 C ATOM 887 H LEU A 347 8.391 10.861 29.469 1.00 0.00 H ATOM 888 N ASP A 348 10.232 13.675 28.631 1.00 24.37 N ATOM 889 CA ASP A 348 11.359 14.619 28.550 1.00 24.57 C ATOM 890 C ASP A 348 12.611 13.962 27.946 1.00 25.99 C ATOM 891 O ASP A 348 13.381 14.587 27.197 1.00 29.61 O ATOM 892 CB ASP A 348 11.689 15.167 29.948 1.00 27.38 C ATOM 893 CG ASP A 348 10.503 15.919 30.580 1.00 47.14 C ATOM 894 OD1 ASP A 348 9.542 16.276 29.850 1.00 53.47 O ATOM 895 OD2 ASP A 348 10.524 16.151 31.812 1.00 52.09 O ATOM 896 H ASP A 348 9.798 13.456 29.550 1.00 0.00 H ATOM 897 N PHE A 349 12.821 12.699 28.282 1.00 26.55 N ATOM 898 CA PHE A 349 14.010 11.970 27.834 1.00 23.69 C ATOM 899 C PHE A 349 14.031 11.809 26.340 1.00 26.39 C ATOM 900 O PHE A 349 15.052 12.043 25.684 1.00 26.50 O ATOM 901 CB PHE A 349 14.049 10.597 28.513 1.00 24.99 C ATOM 902 CG PHE A 349 15.331 9.839 28.294 1.00 25.87 C ATOM 903 CD1 PHE A 349 16.488 10.211 28.961 1.00 35.90 C ATOM 904 CD2 PHE A 349 15.350 8.705 27.518 1.00 31.43 C ATOM 905 CE1 PHE A 349 17.660 9.505 28.790 1.00 41.60 C ATOM 906 CE2 PHE A 349 16.504 7.980 27.354 1.00 35.75 C ATOM 907 CZ PHE A 349 17.665 8.377 27.980 1.00 37.47 C ATOM 908 H PHE A 349 12.123 12.211 28.880 1.00 0.00 H ATOM 909 N LEU A 350 12.886 11.406 25.801 1.00 21.67 N ATOM 910 CA LEU A 350 12.736 11.223 24.366 1.00 22.69 C ATOM 911 C LEU A 350 12.872 12.515 23.587 1.00 25.88 C ATOM 912 O LEU A 350 13.358 12.493 22.443 1.00 26.19 O ATOM 913 CB LEU A 350 11.356 10.608 24.050 1.00 24.67 C ATOM 914 CG LEU A 350 11.087 9.193 24.503 1.00 23.52 C ATOM 915 CD1 LEU A 350 9.576 8.932 24.432 1.00 21.47 C ATOM 916 CD2 LEU A 350 11.882 8.192 23.657 1.00 26.31 C ATOM 917 H LEU A 350 12.074 11.216 26.422 1.00 0.00 H ATOM 918 N LYS A 351 12.401 13.623 24.176 1.00 26.46 N ATOM 919 CA LYS A 351 12.389 14.932 23.501 1.00 29.13 C ATOM 920 C LYS A 351 13.768 15.619 23.571 1.00 31.27 C ATOM 921 O LYS A 351 14.105 16.444 22.711 1.00 32.83 O ATOM 922 CB LYS A 351 11.341 15.896 24.130 1.00 29.04 C ATOM 923 CG LYS A 351 9.838 15.617 23.807 1.00 36.32 C ATOM 924 CD LYS A 351 8.936 16.436 24.757 1.00 27.88 C ATOM 925 CE LYS A 351 8.973 17.957 24.540 1.00 26.81 C ATOM 926 NZ LYS A 351 8.292 18.352 23.251 1.00 23.21 N ATOM 927 HZ1 LYS A 351 8.774 17.894 22.451 1.00 0.00 H ATOM 928 HZ2 LYS A 351 7.298 18.048 23.278 1.00 0.00 H ATOM 929 HZ3 LYS A 351 8.337 19.385 23.139 1.00 0.00 H ATOM 930 H LYS A 351 12.030 13.556 25.145 1.00 0.00 H ATOM 931 N GLY A 352 14.529 15.304 24.622 1.00 27.53 N ATOM 932 CA GLY A 352 15.789 15.997 24.909 1.00 26.06 C ATOM 933 C GLY A 352 17.001 15.503 24.128 1.00 31.14 C ATOM 934 O GLY A 352 16.864 14.688 23.192 1.00 27.07 O ATOM 935 H GLY A 352 14.218 14.542 25.258 1.00 0.00 H ATOM 936 N GLU A 353 18.182 16.001 24.514 1.00 32.56 N ATOM 937 CA GLU A 353 19.468 15.670 23.882 1.00 40.30 C ATOM 938 C GLU A 353 19.677 14.178 23.683 1.00 33.36 C ATOM 939 O GLU A 353 20.291 13.776 22.712 1.00 36.28 O ATOM 940 CB GLU A 353 20.644 16.267 24.673 1.00 55.11 C ATOM 941 CG GLU A 353 20.840 15.714 26.076 1.00 70.06 C ATOM 942 CD GLU A 353 21.998 16.381 26.813 1.00 83.71 C ATOM 943 OE1 GLU A 353 23.142 16.322 26.317 1.00 87.59 O ATOM 944 OE2 GLU A 353 21.758 16.978 27.885 1.00 89.02 O ATOM 945 H GLU A 353 18.191 16.666 25.314 1.00 0.00 H ATOM 946 N MET A 354 19.181 13.351 24.591 1.00 36.97 N ATOM 947 CA MET A 354 19.433 11.906 24.488 1.00 47.80 C ATOM 948 C MET A 354 18.516 11.197 23.475 1.00 58.76 C ATOM 949 O MET A 354 18.749 10.052 23.069 1.00 66.96 O ATOM 950 CB MET A 354 19.278 11.253 25.852 1.00 47.20 C ATOM 951 CG MET A 354 19.783 9.855 25.891 1.00 57.56 C ATOM 952 SD MET A 354 21.536 9.901 25.565 1.00126.47 S ATOM 953 CE MET A 354 22.139 10.690 27.055 1.00 70.50 C ATOM 954 H MET A 354 18.613 13.724 25.378 1.00 0.00 H ATOM 955 N GLY A 355 17.526 11.920 22.990 1.00 58.26 N ATOM 956 CA GLY A 355 16.574 11.342 22.071 1.00 57.34 C ATOM 957 C GLY A 355 17.195 10.975 20.745 1.00 52.29 C ATOM 958 O GLY A 355 16.847 9.967 20.142 1.00 51.78 O ATOM 959 H GLY A 355 17.430 12.916 23.272 1.00 0.00 H ATOM 960 N LYS A 356 18.134 11.787 20.287 1.00 46.96 N ATOM 961 CA LYS A 356 18.627 11.627 18.943 1.00 45.83 C ATOM 962 C LYS A 356 19.510 10.400 18.808 1.00 42.82 C ATOM 963 O LYS A 356 19.886 10.044 17.696 1.00 50.82 O ATOM 964 CB LYS A 356 19.381 12.885 18.517 1.00 44.02 C ATOM 965 CG LYS A 356 20.761 13.004 19.097 1.00 46.40 C ATOM 966 CD LYS A 356 21.527 14.099 18.391 1.00 60.18 C ATOM 967 CE LYS A 356 20.817 15.414 18.634 1.00 70.43 C ATOM 968 NZ LYS A 356 20.688 15.713 20.096 1.00 72.27 N ATOM 969 HZ1 LYS A 356 20.143 14.956 20.557 1.00 0.00 H ATOM 970 HZ2 LYS A 356 21.635 15.768 20.522 1.00 0.00 H ATOM 971 HZ3 LYS A 356 20.197 16.621 20.221 1.00 0.00 H ATOM 972 H LYS A 356 18.515 12.539 20.896 1.00 0.00 H ATOM 973 N TYR A 357 19.855 9.743 19.913 1.00 30.32 N ATOM 974 CA TYR A 357 20.725 8.578 19.759 1.00 36.31 C ATOM 975 C TYR A 357 19.968 7.282 19.936 1.00 33.88 C ATOM 976 O TYR A 357 20.453 6.232 19.566 1.00 30.14 O ATOM 977 CB TYR A 357 21.892 8.647 20.731 1.00 44.51 C ATOM 978 CG TYR A 357 22.691 9.910 20.540 1.00 52.87 C ATOM 979 CD1 TYR A 357 23.429 10.110 19.389 1.00 56.13 C ATOM 980 CD2 TYR A 357 22.712 10.904 21.518 1.00 59.42 C ATOM 981 CE1 TYR A 357 24.161 11.267 19.200 1.00 64.55 C ATOM 982 CE2 TYR A 357 23.453 12.063 21.340 1.00 66.50 C ATOM 983 CZ TYR A 357 24.176 12.235 20.177 1.00 73.31 C ATOM 984 OH TYR A 357 24.921 13.380 19.976 1.00 89.37 O ATOM 985 HH TYR A 357 25.369 13.330 19.095 1.00 0.00 H ATOM 986 H TYR A 357 19.519 10.046 20.849 1.00 0.00 H ATOM 987 N LEU A 358 18.761 7.368 20.476 1.00 24.83 N ATOM 988 CA LEU A 358 17.912 6.198 20.647 1.00 29.08 C ATOM 989 C LEU A 358 17.455 5.636 19.278 1.00 28.35 C ATOM 990 O LEU A 358 16.972 6.353 18.405 1.00 28.36 O ATOM 991 CB LEU A 358 16.702 6.551 21.514 1.00 23.26 C ATOM 992 CG LEU A 358 17.057 6.998 22.943 1.00 27.62 C ATOM 993 CD1 LEU A 358 15.818 7.508 23.681 1.00 27.15 C ATOM 994 CD2 LEU A 358 17.744 5.871 23.755 1.00 23.06 C ATOM 995 H LEU A 358 18.411 8.297 20.786 1.00 0.00 H ATOM 996 N ARG A 359 17.665 4.350 19.081 1.00 21.69 N ATOM 997 CA ARG A 359 17.184 3.689 17.863 1.00 23.89 C ATOM 998 C ARG A 359 16.157 2.620 18.237 1.00 25.55 C ATOM 999 O ARG A 359 15.898 2.408 19.422 1.00 25.57 O ATOM 1000 CB ARG A 359 18.342 3.075 17.087 1.00 24.29 C ATOM 1001 CG ARG A 359 19.314 4.112 16.550 1.00 32.45 C ATOM 1002 CD ARG A 359 18.614 5.010 15.549 1.00 38.53 C ATOM 1003 NE ARG A 359 19.548 5.984 14.992 1.00 54.30 N ATOM 1004 CZ ARG A 359 19.690 7.229 15.430 1.00 59.15 C ATOM 1005 NH1 ARG A 359 18.929 7.683 16.422 1.00 48.89 N ATOM 1006 NH2 ARG A 359 20.582 8.024 14.855 1.00 63.97 N ATOM 1007 HE ARG A 359 20.144 5.681 14.196 1.00 0.00 H ATOM 1008 HH12 ARG A 359 19.045 8.659 16.761 1.00 0.00 H ATOM 1009 HH11 ARG A 359 18.218 7.062 16.858 1.00 0.00 H ATOM 1010 HH22 ARG A 359 20.701 9.001 15.191 1.00 0.00 H ATOM 1011 HH21 ARG A 359 21.163 7.670 14.068 1.00 0.00 H ATOM 1012 H ARG A 359 18.178 3.797 19.797 1.00 0.00 H ATOM 1013 N LEU A 360 15.592 1.929 17.248 1.00 24.38 N ATOM 1014 CA LEU A 360 14.515 0.982 17.545 1.00 28.16 C ATOM 1015 C LEU A 360 14.892 -0.093 18.602 1.00 24.94 C ATOM 1016 O LEU A 360 14.056 -0.443 19.396 1.00 24.67 O ATOM 1017 CB LEU A 360 14.025 0.297 16.268 1.00 28.54 C ATOM 1018 CG LEU A 360 12.627 -0.321 16.401 1.00 26.16 C ATOM 1019 CD1 LEU A 360 11.527 0.776 16.546 1.00 20.72 C ATOM 1020 CD2 LEU A 360 12.353 -1.298 15.230 1.00 28.83 C ATOM 1021 H LEU A 360 15.915 2.062 16.268 1.00 0.00 H ATOM 1022 N PRO A 361 16.131 -0.659 18.573 1.00 24.96 N ATOM 1023 CA PRO A 361 16.419 -1.655 19.616 1.00 24.79 C ATOM 1024 C PRO A 361 16.333 -1.095 21.040 1.00 23.65 C ATOM 1025 O PRO A 361 15.929 -1.827 21.938 1.00 28.20 O ATOM 1026 CB PRO A 361 17.851 -2.112 19.291 1.00 28.17 C ATOM 1027 CG PRO A 361 17.965 -1.930 17.833 1.00 27.21 C ATOM 1028 CD PRO A 361 17.185 -0.646 17.545 1.00 27.39 C ATOM 1029 N GLN A 362 16.742 0.147 21.264 1.00 26.15 N ATOM 1030 CA GLN A 362 16.588 0.739 22.599 1.00 27.52 C ATOM 1031 C GLN A 362 15.116 1.013 22.940 1.00 26.95 C ATOM 1032 O GLN A 362 14.671 0.722 24.041 1.00 26.28 O ATOM 1033 CB GLN A 362 17.366 2.050 22.710 1.00 29.86 C ATOM 1034 CG GLN A 362 18.871 1.905 22.733 1.00 31.42 C ATOM 1035 CD GLN A 362 19.443 1.685 21.352 1.00 38.29 C ATOM 1036 OE1 GLN A 362 19.092 2.380 20.395 1.00 37.20 O ATOM 1037 NE2 GLN A 362 20.312 0.700 21.237 1.00 39.75 N ATOM 1038 HE22 GLN A 362 20.578 0.141 22.073 1.00 0.00 H ATOM 1039 HE21 GLN A 362 20.732 0.482 20.311 1.00 0.00 H ATOM 1040 H GLN A 362 17.171 0.701 20.495 1.00 0.00 H ATOM 1041 N LEU A 363 14.376 1.565 21.980 1.00 23.16 N ATOM 1042 CA LEU A 363 12.995 1.975 22.200 1.00 28.02 C ATOM 1043 C LEU A 363 12.088 0.766 22.497 1.00 22.00 C ATOM 1044 O LEU A 363 11.205 0.831 23.351 1.00 26.16 O ATOM 1045 CB LEU A 363 12.489 2.759 20.972 1.00 24.02 C ATOM 1046 CG LEU A 363 13.237 4.090 20.745 1.00 24.70 C ATOM 1047 CD1 LEU A 363 12.893 4.708 19.369 1.00 21.87 C ATOM 1048 CD2 LEU A 363 12.880 5.075 21.879 1.00 23.07 C ATOM 1049 H LEU A 363 14.798 1.708 21.041 1.00 0.00 H ATOM 1050 N VAL A 364 12.330 -0.328 21.785 1.00 21.85 N ATOM 1051 CA VAL A 364 11.573 -1.563 21.968 1.00 23.16 C ATOM 1052 C VAL A 364 11.924 -2.217 23.300 1.00 25.51 C ATOM 1053 O VAL A 364 11.050 -2.754 23.981 1.00 22.50 O ATOM 1054 CB VAL A 364 11.811 -2.531 20.765 1.00 22.95 C ATOM 1055 CG1 VAL A 364 11.399 -3.940 21.106 1.00 23.32 C ATOM 1056 CG2 VAL A 364 11.077 -1.976 19.515 1.00 21.33 C ATOM 1057 H VAL A 364 13.086 -0.305 21.071 1.00 0.00 H ATOM 1058 N ASP A 365 13.196 -2.167 23.694 1.00 23.99 N ATOM 1059 CA ASP A 365 13.569 -2.694 25.023 1.00 25.43 C ATOM 1060 C ASP A 365 12.902 -1.875 26.149 1.00 20.88 C ATOM 1061 O ASP A 365 12.455 -2.414 27.170 1.00 24.27 O ATOM 1062 CB ASP A 365 15.087 -2.686 25.222 1.00 30.07 C ATOM 1063 CG ASP A 365 15.486 -3.129 26.630 1.00 36.66 C ATOM 1064 OD1 ASP A 365 15.663 -4.342 26.878 1.00 47.13 O ATOM 1065 OD2 ASP A 365 15.572 -2.265 27.501 1.00 34.81 O ATOM 1066 H ASP A 365 13.922 -1.760 23.070 1.00 0.00 H ATOM 1067 N MET A 366 12.837 -0.569 25.964 1.00 22.25 N ATOM 1068 CA MET A 366 12.110 0.275 26.892 1.00 23.57 C ATOM 1069 C MET A 366 10.617 -0.094 26.889 1.00 24.88 C ATOM 1070 O MET A 366 9.975 -0.140 27.931 1.00 23.34 O ATOM 1071 CB MET A 366 12.317 1.754 26.522 1.00 24.56 C ATOM 1072 CG MET A 366 13.784 2.229 26.686 1.00 31.71 C ATOM 1073 SD MET A 366 14.067 3.844 25.875 1.00 41.80 S ATOM 1074 CE MET A 366 14.048 4.873 27.324 1.00 46.98 C ATOM 1075 H MET A 366 13.312 -0.141 25.144 1.00 0.00 H ATOM 1076 N ALA A 367 10.058 -0.359 25.719 1.00 22.10 N ATOM 1077 CA ALA A 367 8.654 -0.770 25.685 1.00 22.84 C ATOM 1078 C ALA A 367 8.476 -2.118 26.403 1.00 21.94 C ATOM 1079 O ALA A 367 7.493 -2.304 27.125 1.00 24.04 O ATOM 1080 CB ALA A 367 8.125 -0.840 24.233 1.00 19.44 C ATOM 1081 H ALA A 367 10.607 -0.277 24.839 1.00 0.00 H ATOM 1082 N ALA A 368 9.435 -3.032 26.242 1.00 22.18 N ATOM 1083 CA ALA A 368 9.361 -4.346 26.894 1.00 23.85 C ATOM 1084 C ALA A 368 9.364 -4.206 28.418 1.00 24.66 C ATOM 1085 O ALA A 368 8.663 -4.940 29.119 1.00 25.10 O ATOM 1086 CB ALA A 368 10.527 -5.252 26.455 1.00 23.48 C ATOM 1087 H ALA A 368 10.254 -2.809 25.641 1.00 0.00 H ATOM 1088 N GLN A 369 10.169 -3.283 28.938 1.00 25.37 N ATOM 1089 CA GLN A 369 10.205 -3.059 30.384 1.00 24.98 C ATOM 1090 C GLN A 369 8.873 -2.527 30.913 1.00 27.12 C ATOM 1091 O GLN A 369 8.378 -2.952 31.968 1.00 26.12 O ATOM 1092 CB GLN A 369 11.333 -2.085 30.734 1.00 24.88 C ATOM 1093 CG GLN A 369 12.731 -2.590 30.440 1.00 27.12 C ATOM 1094 CD GLN A 369 13.760 -1.517 30.775 1.00 33.88 C ATOM 1095 OE1 GLN A 369 13.852 -1.067 31.927 1.00 28.87 O ATOM 1096 NE2 GLN A 369 14.501 -1.059 29.761 1.00 29.83 N ATOM 1097 HE22 GLN A 369 14.390 -1.466 28.811 1.00 0.00 H ATOM 1098 HE21 GLN A 369 15.188 -0.295 29.923 1.00 0.00 H ATOM 1099 H GLN A 369 10.777 -2.717 28.313 1.00 0.00 H ATOM 1100 N ILE A 370 8.312 -1.564 30.194 1.00 24.15 N ATOM 1101 CA ILE A 370 7.044 -0.978 30.573 1.00 25.47 C ATOM 1102 C ILE A 370 5.952 -2.052 30.529 1.00 29.40 C ATOM 1103 O ILE A 370 5.104 -2.115 31.421 1.00 28.22 O ATOM 1104 CB ILE A 370 6.706 0.214 29.650 1.00 22.56 C ATOM 1105 CG1 ILE A 370 7.746 1.319 29.852 1.00 25.42 C ATOM 1106 CG2 ILE A 370 5.328 0.765 29.936 1.00 23.22 C ATOM 1107 CD1 ILE A 370 7.702 2.441 28.807 1.00 26.19 C ATOM 1108 H ILE A 370 8.794 -1.222 29.338 1.00 0.00 H ATOM 1109 N ALA A 371 6.000 -2.918 29.509 1.00 23.43 N ATOM 1110 CA ALA A 371 5.036 -4.016 29.402 1.00 21.92 C ATOM 1111 C ALA A 371 5.213 -5.007 30.535 1.00 26.24 C ATOM 1112 O ALA A 371 4.233 -5.598 31.011 1.00 29.85 O ATOM 1113 CB ALA A 371 5.171 -4.721 28.026 1.00 25.58 C ATOM 1114 H ALA A 371 6.734 -2.809 28.780 1.00 0.00 H ATOM 1115 N SER A 372 6.452 -5.191 30.993 1.00 21.55 N ATOM 1116 CA SER A 372 6.679 -6.086 32.119 1.00 26.71 C ATOM 1117 C SER A 372 6.037 -5.512 33.404 1.00 28.17 C ATOM 1118 O SER A 372 5.386 -6.227 34.171 1.00 26.24 O ATOM 1119 CB SER A 372 8.175 -6.296 32.328 1.00 26.80 C ATOM 1120 OG SER A 372 8.386 -7.044 33.503 1.00 30.55 O ATOM 1121 HG SER A 372 9.358 -7.179 33.637 1.00 0.00 H ATOM 1122 H SER A 372 7.252 -4.698 30.548 1.00 0.00 H ATOM 1123 N GLY A 373 6.224 -4.217 33.624 1.00 28.25 N ATOM 1124 CA GLY A 373 5.616 -3.544 34.788 1.00 29.01 C ATOM 1125 C GLY A 373 4.094 -3.629 34.691 1.00 27.16 C ATOM 1126 O GLY A 373 3.429 -3.960 35.672 1.00 28.91 O ATOM 1127 H GLY A 373 6.810 -3.666 32.964 1.00 0.00 H ATOM 1128 N MET A 374 3.547 -3.419 33.492 1.00 25.24 N ATOM 1129 CA MET A 374 2.098 -3.478 33.337 1.00 27.00 C ATOM 1130 C MET A 374 1.566 -4.911 33.386 1.00 32.69 C ATOM 1131 O MET A 374 0.405 -5.136 33.736 1.00 33.31 O ATOM 1132 CB MET A 374 1.675 -2.800 32.026 1.00 25.04 C ATOM 1133 CG MET A 374 1.829 -1.274 32.030 1.00 23.58 C ATOM 1134 SD MET A 374 0.921 -0.455 33.391 1.00 31.85 S ATOM 1135 CE MET A 374 -0.774 -1.028 33.166 1.00 30.50 C ATOM 1136 H MET A 374 4.152 -3.214 32.671 1.00 0.00 H ATOM 1137 N ALA A 375 2.396 -5.888 33.043 1.00 31.18 N ATOM 1138 CA ALA A 375 1.959 -7.283 33.150 1.00 33.00 C ATOM 1139 C ALA A 375 1.820 -7.626 34.618 1.00 32.99 C ATOM 1140 O ALA A 375 0.967 -8.435 35.003 1.00 31.21 O ATOM 1141 CB ALA A 375 2.928 -8.243 32.440 1.00 28.18 C ATOM 1142 H ALA A 375 3.352 -5.665 32.700 1.00 0.00 H ATOM 1143 N TYR A 376 2.657 -7.010 35.448 1.00 29.49 N ATOM 1144 CA TYR A 376 2.520 -7.206 36.895 1.00 33.23 C ATOM 1145 C TYR A 376 1.217 -6.567 37.382 1.00 36.63 C ATOM 1146 O TYR A 376 0.487 -7.170 38.167 1.00 36.82 O ATOM 1147 CB TYR A 376 3.740 -6.635 37.657 1.00 39.75 C ATOM 1148 CG TYR A 376 3.550 -6.560 39.155 1.00 39.13 C ATOM 1149 CD1 TYR A 376 3.718 -7.679 39.964 1.00 39.11 C ATOM 1150 CD2 TYR A 376 3.205 -5.356 39.766 1.00 39.05 C ATOM 1151 CE1 TYR A 376 3.524 -7.605 41.381 1.00 43.01 C ATOM 1152 CE2 TYR A 376 3.018 -5.268 41.158 1.00 35.65 C ATOM 1153 CZ TYR A 376 3.178 -6.389 41.953 1.00 41.11 C ATOM 1154 OH TYR A 376 2.990 -6.261 43.318 1.00 41.95 O ATOM 1155 HH TYR A 376 3.137 -7.138 43.754 1.00 0.00 H ATOM 1156 H TYR A 376 3.405 -6.392 35.073 1.00 0.00 H ATOM 1157 N VAL A 377 0.928 -5.349 36.913 1.00 38.67 N ATOM 1158 CA VAL A 377 -0.327 -4.666 37.231 1.00 35.76 C ATOM 1159 C VAL A 377 -1.534 -5.519 36.804 1.00 39.61 C ATOM 1160 O VAL A 377 -2.510 -5.685 37.557 1.00 35.58 O ATOM 1161 CB VAL A 377 -0.390 -3.284 36.530 1.00 34.60 C ATOM 1162 CG1 VAL A 377 -1.769 -2.657 36.695 1.00 34.09 C ATOM 1163 CG2 VAL A 377 0.677 -2.353 37.081 1.00 31.01 C ATOM 1164 H VAL A 377 1.619 -4.870 36.301 1.00 0.00 H ATOM 1165 N GLU A 378 -1.429 -6.087 35.601 1.00 33.76 N ATOM 1166 CA GLU A 378 -2.417 -7.016 35.064 1.00 36.50 C ATOM 1167 C GLU A 378 -2.615 -8.225 35.972 1.00 41.18 C ATOM 1168 O GLU A 378 -3.761 -8.562 36.320 1.00 39.56 O ATOM 1169 CB GLU A 378 -1.960 -7.485 33.676 1.00 36.20 C ATOM 1170 CG GLU A 378 -2.918 -8.349 32.871 1.00 37.27 C ATOM 1171 CD GLU A 378 -2.339 -8.574 31.476 1.00 42.06 C ATOM 1172 OE1 GLU A 378 -1.380 -9.386 31.354 1.00 40.63 O ATOM 1173 OE2 GLU A 378 -2.783 -7.887 30.524 1.00 38.64 O ATOM 1174 H GLU A 378 -0.600 -5.855 35.017 1.00 0.00 H ATOM 1175 N ARG A 379 -1.501 -8.859 36.359 1.00 40.26 N ATOM 1176 CA ARG A 379 -1.536 -10.033 37.237 1.00 44.85 C ATOM 1177 C ARG A 379 -2.176 -9.701 38.580 1.00 47.80 C ATOM 1178 O ARG A 379 -2.735 -10.576 39.224 1.00 50.48 O ATOM 1179 CB ARG A 379 -0.135 -10.604 37.501 1.00 44.45 C ATOM 1180 CG ARG A 379 0.545 -11.264 36.322 1.00 54.97 C ATOM 1181 CD ARG A 379 1.770 -12.115 36.715 1.00 52.70 C ATOM 1182 NE ARG A 379 2.874 -11.393 37.368 1.00 47.85 N ATOM 1183 CZ ARG A 379 3.849 -10.764 36.709 1.00 44.84 C ATOM 1184 NH1 ARG A 379 3.804 -10.683 35.382 1.00 38.07 N ATOM 1185 NH2 ARG A 379 4.843 -10.166 37.367 1.00 42.00 N ATOM 1186 HE ARG A 379 2.895 -11.372 38.408 1.00 0.00 H ATOM 1187 HH12 ARG A 379 4.562 -10.194 34.865 1.00 0.00 H ATOM 1188 HH11 ARG A 379 3.011 -11.109 34.862 1.00 0.00 H ATOM 1189 HH22 ARG A 379 5.596 -9.679 36.841 1.00 0.00 H ATOM 1190 HH21 ARG A 379 4.865 -10.186 38.407 1.00 0.00 H ATOM 1191 H ARG A 379 -0.581 -8.507 36.026 1.00 0.00 H ATOM 1192 N MET A 380 -2.048 -8.451 39.023 1.00 45.64 N ATOM 1193 CA MET A 380 -2.559 -8.061 40.334 1.00 49.16 C ATOM 1194 C MET A 380 -3.999 -7.547 40.287 1.00 49.00 C ATOM 1195 O MET A 380 -4.523 -7.088 41.303 1.00 48.88 O ATOM 1196 CB MET A 380 -1.657 -6.987 40.968 1.00 46.91 C ATOM 1197 CG MET A 380 -0.228 -7.431 41.225 1.00 39.46 C ATOM 1198 SD MET A 380 -0.132 -8.561 42.613 1.00 51.82 S ATOM 1199 CE MET A 380 -0.607 -7.454 43.959 1.00 51.67 C ATOM 1200 H MET A 380 -1.577 -7.742 38.426 1.00 0.00 H ATOM 1201 N ASN A 381 -4.626 -7.622 39.113 1.00 45.28 N ATOM 1202 CA ASN A 381 -5.999 -7.140 38.917 1.00 46.78 C ATOM 1203 C ASN A 381 -6.155 -5.646 39.239 1.00 48.20 C ATOM 1204 O ASN A 381 -7.165 -5.213 39.789 1.00 48.44 O ATOM 1205 CB ASN A 381 -6.981 -7.955 39.754 1.00 50.90 C ATOM 1206 CG ASN A 381 -7.013 -9.402 39.342 1.00 62.57 C ATOM 1207 OD1 ASN A 381 -7.174 -9.717 38.157 1.00 59.84 O ATOM 1208 ND2 ASN A 381 -6.862 -10.302 40.313 1.00 65.49 N ATOM 1209 HD22 ASN A 381 -6.729 -9.989 41.296 1.00 0.00 H ATOM 1210 HD21 ASN A 381 -6.877 -11.317 40.088 1.00 0.00 H ATOM 1211 H ASN A 381 -4.123 -8.038 38.304 1.00 0.00 H ATOM 1212 N TYR A 382 -5.146 -4.866 38.886 1.00 41.33 N ATOM 1213 CA TYR A 382 -5.225 -3.414 39.001 1.00 43.11 C ATOM 1214 C TYR A 382 -5.375 -2.791 37.627 1.00 42.03 C ATOM 1215 O TYR A 382 -5.124 -3.446 36.609 1.00 39.00 O ATOM 1216 CB TYR A 382 -3.987 -2.847 39.697 1.00 38.41 C ATOM 1217 CG TYR A 382 -4.093 -2.818 41.207 1.00 48.66 C ATOM 1218 CD1 TYR A 382 -3.859 -3.958 41.964 1.00 54.56 C ATOM 1219 CD2 TYR A 382 -4.395 -1.632 41.876 1.00 49.83 C ATOM 1220 CE1 TYR A 382 -3.955 -3.935 43.350 1.00 61.00 C ATOM 1221 CE2 TYR A 382 -4.484 -1.594 43.266 1.00 58.55 C ATOM 1222 CZ TYR A 382 -4.263 -2.750 43.996 1.00 64.21 C ATOM 1223 OH TYR A 382 -4.351 -2.730 45.374 1.00 68.85 O ATOM 1224 HH TYR A 382 -4.165 -3.635 45.729 1.00 0.00 H ATOM 1225 H TYR A 382 -4.275 -5.299 38.517 1.00 0.00 H ATOM 1226 N VAL A 383 -5.794 -1.531 37.608 1.00 41.23 N ATOM 1227 CA VAL A 383 -5.824 -0.722 36.394 1.00 40.58 C ATOM 1228 C VAL A 383 -5.082 0.579 36.697 1.00 43.21 C ATOM 1229 O VAL A 383 -5.197 1.113 37.801 1.00 40.29 O ATOM 1230 CB VAL A 383 -7.270 -0.411 35.959 1.00 47.26 C ATOM 1231 CG1 VAL A 383 -7.275 0.370 34.653 1.00 47.18 C ATOM 1232 CG2 VAL A 383 -8.051 -1.691 35.791 1.00 57.18 C ATOM 1233 H VAL A 383 -6.115 -1.101 38.499 1.00 0.00 H ATOM 1234 N HIS A 384 -4.323 1.096 35.741 1.00 39.34 N ATOM 1235 CA HIS A 384 -3.526 2.291 35.979 1.00 36.89 C ATOM 1236 C HIS A 384 -4.298 3.575 35.668 1.00 36.58 C ATOM 1237 O HIS A 384 -4.326 4.500 36.481 1.00 34.70 O ATOM 1238 CB HIS A 384 -2.249 2.221 35.147 1.00 29.40 C ATOM 1239 CG HIS A 384 -1.290 3.335 35.407 1.00 32.04 C ATOM 1240 ND1 HIS A 384 -1.460 4.604 34.885 1.00 32.93 N ATOM 1241 CD2 HIS A 384 -0.144 3.379 36.128 1.00 33.58 C ATOM 1242 CE1 HIS A 384 -0.460 5.370 35.264 1.00 32.13 C ATOM 1243 NE2 HIS A 384 0.352 4.652 36.023 1.00 36.66 N ATOM 1244 H HIS A 384 -4.296 0.641 34.806 1.00 0.00 H ATOM 1245 N ARG A 385 -4.921 3.582 34.483 1.00 36.89 N ATOM 1246 CA ARG A 385 -5.790 4.643 33.949 1.00 33.41 C ATOM 1247 C ARG A 385 -5.068 5.899 33.460 1.00 33.97 C ATOM 1248 O ARG A 385 -5.717 6.806 32.951 1.00 36.63 O ATOM 1249 CB ARG A 385 -6.856 5.063 34.972 1.00 36.53 C ATOM 1250 CG ARG A 385 -7.727 3.926 35.471 1.00 46.59 C ATOM 1251 CD ARG A 385 -9.104 4.415 35.949 1.00 57.75 C ATOM 1252 NE ARG A 385 -9.037 5.298 37.108 1.00 60.66 N ATOM 1253 CZ ARG A 385 -10.026 6.104 37.494 1.00 64.72 C ATOM 1254 NH1 ARG A 385 -9.876 6.866 38.575 1.00 60.52 N ATOM 1255 NH2 ARG A 385 -11.168 6.145 36.808 1.00 64.75 N ATOM 1256 HE ARG A 385 -8.161 5.299 37.669 1.00 0.00 H ATOM 1257 HH12 ARG A 385 -10.646 7.496 38.878 1.00 0.00 H ATOM 1258 HH11 ARG A 385 -8.989 6.832 39.116 1.00 0.00 H ATOM 1259 HH22 ARG A 385 -11.936 6.776 37.114 1.00 0.00 H ATOM 1260 HH21 ARG A 385 -11.291 5.546 35.967 1.00 0.00 H ATOM 1261 H ARG A 385 -4.776 2.750 33.876 1.00 0.00 H ATOM 1262 N ASP A 386 -3.743 5.961 33.555 1.00 31.16 N ATOM 1263 CA ASP A 386 -3.051 7.156 33.066 1.00 24.12 C ATOM 1264 C ASP A 386 -1.675 6.790 32.518 1.00 27.70 C ATOM 1265 O ASP A 386 -0.698 7.478 32.782 1.00 27.39 O ATOM 1266 CB ASP A 386 -2.931 8.213 34.187 1.00 30.42 C ATOM 1267 CG ASP A 386 -2.697 9.616 33.647 1.00 43.21 C ATOM 1268 OD1 ASP A 386 -2.768 9.803 32.408 1.00 55.60 O ATOM 1269 OD2 ASP A 386 -2.428 10.525 34.459 1.00 45.41 O ATOM 1270 H ASP A 386 -3.206 5.173 33.970 1.00 0.00 H ATOM 1271 N LEU A 387 -1.601 5.672 31.799 1.00 27.80 N ATOM 1272 CA LEU A 387 -0.362 5.216 31.194 1.00 26.08 C ATOM 1273 C LEU A 387 -0.022 6.077 29.972 1.00 26.75 C ATOM 1274 O LEU A 387 -0.837 6.239 29.088 1.00 24.10 O ATOM 1275 CB LEU A 387 -0.485 3.740 30.786 1.00 24.12 C ATOM 1276 CG LEU A 387 0.782 3.060 30.258 1.00 28.63 C ATOM 1277 CD1 LEU A 387 1.869 3.054 31.368 1.00 29.10 C ATOM 1278 CD2 LEU A 387 0.459 1.630 29.748 1.00 26.05 C ATOM 1279 H LEU A 387 -2.462 5.104 31.666 1.00 0.00 H ATOM 1280 N ARG A 388 1.166 6.666 29.964 1.00 21.84 N ATOM 1281 CA ARG A 388 1.623 7.540 28.875 1.00 23.07 C ATOM 1282 C ARG A 388 3.077 7.884 29.214 1.00 21.86 C ATOM 1283 O ARG A 388 3.489 7.726 30.367 1.00 24.79 O ATOM 1284 CB ARG A 388 0.767 8.810 28.761 1.00 23.67 C ATOM 1285 CG ARG A 388 0.689 9.588 30.097 1.00 28.78 C ATOM 1286 CD ARG A 388 -0.434 10.685 30.171 1.00 39.54 C ATOM 1287 NE ARG A 388 -0.129 11.788 29.262 1.00 50.12 N ATOM 1288 CZ ARG A 388 -0.860 12.892 29.120 1.00 57.23 C ATOM 1289 NH1 ARG A 388 -0.499 13.834 28.248 1.00 42.20 N ATOM 1290 NH2 ARG A 388 -1.953 13.064 29.855 1.00 67.01 N ATOM 1291 HE ARG A 388 0.728 11.704 28.679 1.00 0.00 H ATOM 1292 HH12 ARG A 388 -1.075 14.693 28.143 1.00 0.00 H ATOM 1293 HH11 ARG A 388 0.359 13.709 27.673 1.00 0.00 H ATOM 1294 HH22 ARG A 388 -2.524 13.926 29.744 1.00 0.00 H ATOM 1295 HH21 ARG A 388 -2.238 12.336 30.541 1.00 0.00 H ATOM 1296 H ARG A 388 1.805 6.501 30.768 1.00 0.00 H ATOM 1297 N ALA A 389 3.823 8.394 28.237 1.00 21.62 N ATOM 1298 CA ALA A 389 5.252 8.613 28.406 1.00 25.58 C ATOM 1299 C ALA A 389 5.557 9.568 29.539 1.00 28.63 C ATOM 1300 O ALA A 389 6.599 9.461 30.187 1.00 28.58 O ATOM 1301 CB ALA A 389 5.873 9.140 27.077 1.00 24.98 C ATOM 1302 H ALA A 389 3.375 8.642 27.332 1.00 0.00 H ATOM 1303 N ALA A 390 4.652 10.505 29.804 1.00 30.97 N ATOM 1304 CA ALA A 390 4.894 11.465 30.893 1.00 27.48 C ATOM 1305 C ALA A 390 4.841 10.794 32.262 1.00 29.77 C ATOM 1306 O ALA A 390 5.352 11.330 33.243 1.00 29.70 O ATOM 1307 CB ALA A 390 3.891 12.600 30.835 1.00 26.92 C ATOM 1308 H ALA A 390 3.777 10.559 29.244 1.00 0.00 H ATOM 1309 N ASN A 391 4.238 9.616 32.331 1.00 29.04 N ATOM 1310 CA ASN A 391 4.120 8.917 33.602 1.00 26.41 C ATOM 1311 C ASN A 391 5.032 7.704 33.701 1.00 30.02 C ATOM 1312 O ASN A 391 4.814 6.821 34.536 1.00 31.99 O ATOM 1313 CB ASN A 391 2.653 8.530 33.827 1.00 25.82 C ATOM 1314 CG ASN A 391 1.793 9.733 34.111 1.00 33.78 C ATOM 1315 OD1 ASN A 391 2.309 10.744 34.578 1.00 37.95 O ATOM 1316 ND2 ASN A 391 0.489 9.653 33.824 1.00 28.01 N ATOM 1317 HD22 ASN A 391 0.096 8.775 33.429 1.00 0.00 H ATOM 1318 HD21 ASN A 391 -0.132 10.469 33.996 1.00 0.00 H ATOM 1319 H ASN A 391 3.845 9.187 31.469 1.00 0.00 H ATOM 1320 N ILE A 392 6.045 7.666 32.832 1.00 25.72 N ATOM 1321 CA ILE A 392 7.120 6.683 32.917 1.00 21.82 C ATOM 1322 C ILE A 392 8.400 7.411 33.340 1.00 24.52 C ATOM 1323 O ILE A 392 8.666 8.511 32.856 1.00 26.79 O ATOM 1324 CB ILE A 392 7.369 5.967 31.563 1.00 26.73 C ATOM 1325 CG1 ILE A 392 6.082 5.328 31.033 1.00 29.08 C ATOM 1326 CG2 ILE A 392 8.469 4.918 31.695 1.00 22.67 C ATOM 1327 CD1 ILE A 392 5.577 4.160 31.899 1.00 27.54 C ATOM 1328 H ILE A 392 6.069 8.366 32.063 1.00 0.00 H ATOM 1329 N LEU A 393 9.161 6.817 34.258 1.00 23.94 N ATOM 1330 CA LEU A 393 10.430 7.393 34.721 1.00 23.95 C ATOM 1331 C LEU A 393 11.622 6.571 34.228 1.00 28.55 C ATOM 1332 O LEU A 393 11.549 5.349 34.098 1.00 30.68 O ATOM 1333 CB LEU A 393 10.435 7.496 36.244 1.00 26.06 C ATOM 1334 CG LEU A 393 9.510 8.581 36.793 1.00 31.85 C ATOM 1335 CD1 LEU A 393 9.424 8.519 38.320 1.00 31.03 C ATOM 1336 CD2 LEU A 393 10.012 9.958 36.353 1.00 36.42 C ATOM 1337 H LEU A 393 8.845 5.912 34.662 1.00 0.00 H ATOM 1338 N VAL A 394 12.729 7.253 33.968 1.00 28.01 N ATOM 1339 CA VAL A 394 13.906 6.626 33.393 1.00 24.54 C ATOM 1340 C VAL A 394 15.096 6.753 34.325 1.00 29.56 C ATOM 1341 O VAL A 394 15.307 7.818 34.891 1.00 27.03 O ATOM 1342 CB VAL A 394 14.259 7.265 32.046 1.00 28.90 C ATOM 1343 CG1 VAL A 394 15.446 6.549 31.409 1.00 28.27 C ATOM 1344 CG2 VAL A 394 13.027 7.248 31.111 1.00 33.17 C ATOM 1345 H VAL A 394 12.755 8.270 34.183 1.00 0.00 H ATOM 1346 N GLY A 395 15.850 5.667 34.487 1.00 32.13 N ATOM 1347 CA GLY A 395 17.039 5.644 35.333 1.00 35.25 C ATOM 1348 C GLY A 395 18.316 5.374 34.566 1.00 32.53 C ATOM 1349 O GLY A 395 18.383 5.620 33.366 1.00 39.73 O ATOM 1350 H GLY A 395 15.579 4.796 33.988 1.00 0.00 H ATOM 1351 N GLU A 396 19.348 4.899 35.257 1.00 36.54 N ATOM 1352 CA GLU A 396 20.612 4.586 34.607 1.00 38.58 C ATOM 1353 C GLU A 396 20.432 3.359 33.704 1.00 38.46 C ATOM 1354 O GLU A 396 19.492 2.603 33.889 1.00 34.98 O ATOM 1355 CB GLU A 396 21.705 4.337 35.644 1.00 45.37 C ATOM 1356 CG GLU A 396 21.971 5.551 36.529 1.00 55.48 C ATOM 1357 CD GLU A 396 22.495 6.728 35.740 1.00 67.79 C ATOM 1358 OE1 GLU A 396 23.493 6.564 35.007 1.00 70.19 O ATOM 1359 OE2 GLU A 396 21.877 7.809 35.810 1.00 82.22 O ATOM 1360 H GLU A 396 19.250 4.748 36.281 1.00 0.00 H ATOM 1361 N ASN A 397 21.280 3.213 32.693 1.00 34.53 N ATOM 1362 CA ASN A 397 21.255 2.023 31.841 1.00 36.11 C ATOM 1363 C ASN A 397 19.918 1.816 31.126 1.00 34.91 C ATOM 1364 O ASN A 397 19.514 0.677 30.856 1.00 30.31 O ATOM 1365 CB ASN A 397 21.633 0.783 32.662 1.00 40.24 C ATOM 1366 CG ASN A 397 22.007 -0.397 31.790 1.00 51.77 C ATOM 1367 OD1 ASN A 397 22.280 -0.231 30.602 1.00 55.85 O ATOM 1368 ND2 ASN A 397 22.034 -1.595 32.374 1.00 49.96 N ATOM 1369 HD22 ASN A 397 21.795 -1.688 33.382 1.00 0.00 H ATOM 1370 HD21 ASN A 397 22.294 -2.437 31.822 1.00 0.00 H ATOM 1371 H ASN A 397 21.977 3.961 32.502 1.00 0.00 H ATOM 1372 N LEU A 398 19.245 2.926 30.830 1.00 32.70 N ATOM 1373 CA LEU A 398 17.955 2.944 30.154 1.00 29.17 C ATOM 1374 C LEU A 398 16.869 2.147 30.867 1.00 34.90 C ATOM 1375 O LEU A 398 15.983 1.609 30.212 1.00 35.03 O ATOM 1376 CB LEU A 398 18.088 2.396 28.725 1.00 33.98 C ATOM 1377 CG LEU A 398 18.789 3.236 27.671 1.00 40.06 C ATOM 1378 CD1 LEU A 398 18.659 2.583 26.300 1.00 39.35 C ATOM 1379 CD2 LEU A 398 18.149 4.601 27.659 1.00 42.31 C ATOM 1380 H LEU A 398 19.667 3.838 31.098 1.00 0.00 H ATOM 1381 N VAL A 399 16.917 2.087 32.193 1.00 35.05 N ATOM 1382 CA VAL A 399 15.862 1.430 32.946 1.00 30.12 C ATOM 1383 C VAL A 399 14.590 2.292 32.961 1.00 33.02 C ATOM 1384 O VAL A 399 14.640 3.499 33.239 1.00 36.96 O ATOM 1385 CB VAL A 399 16.336 1.136 34.373 1.00 38.16 C ATOM 1386 CG1 VAL A 399 15.168 0.696 35.253 1.00 44.12 C ATOM 1387 CG2 VAL A 399 17.421 0.077 34.339 1.00 38.24 C ATOM 1388 H VAL A 399 17.719 2.515 32.698 1.00 0.00 H ATOM 1389 N CYS A 400 13.456 1.673 32.653 1.00 26.86 N ATOM 1390 CA CYS A 400 12.174 2.368 32.604 1.00 28.12 C ATOM 1391 C CYS A 400 11.214 1.769 33.607 1.00 30.39 C ATOM 1392 O CYS A 400 11.125 0.547 33.712 1.00 30.88 O ATOM 1393 CB CYS A 400 11.550 2.293 31.199 1.00 26.30 C ATOM 1394 SG CYS A 400 12.428 3.219 29.937 1.00 35.23 S ATOM 1395 H CYS A 400 13.483 0.656 32.439 1.00 0.00 H ATOM 1396 N LYS A 401 10.521 2.621 34.356 1.00 26.38 N ATOM 1397 CA LYS A 401 9.581 2.152 35.359 1.00 29.05 C ATOM 1398 C LYS A 401 8.268 2.925 35.304 1.00 29.08 C ATOM 1399 O LYS A 401 8.246 4.141 35.087 1.00 26.70 O ATOM 1400 CB LYS A 401 10.186 2.250 36.767 1.00 29.61 C ATOM 1401 CG LYS A 401 11.481 1.455 36.943 1.00 29.04 C ATOM 1402 CD LYS A 401 11.945 1.366 38.400 1.00 30.74 C ATOM 1403 CE LYS A 401 13.269 0.607 38.480 1.00 30.74 C ATOM 1404 NZ LYS A 401 13.517 0.026 39.855 1.00 35.90 N ATOM 1405 HZ1 LYS A 401 13.543 0.795 40.555 1.00 0.00 H ATOM 1406 HZ2 LYS A 401 12.751 -0.636 40.094 1.00 0.00 H ATOM 1407 HZ3 LYS A 401 14.426 -0.479 39.858 1.00 0.00 H ATOM 1408 H LYS A 401 10.655 3.644 34.221 1.00 0.00 H ATOM 1409 N VAL A 402 7.175 2.210 35.532 1.00 24.50 N ATOM 1410 CA VAL A 402 5.856 2.819 35.561 1.00 25.65 C ATOM 1411 C VAL A 402 5.699 3.655 36.853 1.00 25.59 C ATOM 1412 O VAL A 402 6.104 3.221 37.926 1.00 29.71 O ATOM 1413 CB VAL A 402 4.763 1.731 35.492 1.00 27.15 C ATOM 1414 CG1 VAL A 402 3.379 2.343 35.569 1.00 29.12 C ATOM 1415 CG2 VAL A 402 4.915 0.897 34.211 1.00 26.36 C ATOM 1416 H VAL A 402 7.264 1.187 35.694 1.00 0.00 H ATOM 1417 N ALA A 403 5.119 4.846 36.735 1.00 37.01 N ATOM 1418 CA ALA A 403 4.925 5.734 37.887 1.00 37.39 C ATOM 1419 C ALA A 403 3.529 6.356 37.896 1.00 39.52 C ATOM 1420 O ALA A 403 2.690 6.038 37.060 1.00 39.40 O ATOM 1421 CB ALA A 403 5.987 6.832 37.892 1.00 34.40 C ATOM 1422 H ALA A 403 4.793 5.157 35.798 1.00 0.00 H ATOM 1423 N ASP A 404 3.302 7.244 38.860 1.00 39.50 N ATOM 1424 CA ASP A 404 2.064 8.004 38.995 1.00 45.25 C ATOM 1425 C ASP A 404 0.820 7.128 39.006 1.00 45.07 C ATOM 1426 O ASP A 404 0.036 7.094 38.046 1.00 41.83 O ATOM 1427 CB ASP A 404 1.991 9.051 37.888 1.00 51.29 C ATOM 1428 CG ASP A 404 3.051 10.132 38.063 1.00 72.63 C ATOM 1429 OD1 ASP A 404 3.589 10.245 39.187 1.00 81.37 O ATOM 1430 OD2 ASP A 404 3.364 10.860 37.100 1.00 78.90 O ATOM 1431 H ASP A 404 4.053 7.407 39.561 1.00 0.00 H ATOM 1432 N PHE A 405 0.659 6.426 40.123 1.00 48.71 N ATOM 1433 CA PHE A 405 -0.491 5.567 40.355 1.00 54.27 C ATOM 1434 C PHE A 405 -1.617 6.307 41.080 1.00 51.67 C ATOM 1435 O PHE A 405 -2.454 5.677 41.729 1.00 53.38 O ATOM 1436 CB PHE A 405 -0.072 4.340 41.164 1.00 56.60 C ATOM 1437 CG PHE A 405 0.747 3.363 40.384 1.00 61.34 C ATOM 1438 CD1 PHE A 405 2.123 3.485 40.314 1.00 61.95 C ATOM 1439 CD2 PHE A 405 0.130 2.328 39.694 1.00 60.58 C ATOM 1440 CE1 PHE A 405 2.869 2.581 39.580 1.00 59.38 C ATOM 1441 CE2 PHE A 405 0.870 1.424 38.955 1.00 61.34 C ATOM 1442 CZ PHE A 405 2.241 1.551 38.900 1.00 60.62 C ATOM 1443 H PHE A 405 1.387 6.494 40.863 1.00 0.00 H ATOM 1444 N GLY A 406 -1.636 7.635 40.953 1.00 47.93 N ATOM 1445 CA GLY A 406 -2.618 8.470 41.632 1.00 49.42 C ATOM 1446 C GLY A 406 -4.048 8.179 41.211 1.00 54.29 C ATOM 1447 O GLY A 406 -4.989 8.484 41.941 1.00 53.81 O ATOM 1448 H GLY A 406 -0.924 8.091 40.347 1.00 0.00 H ATOM 1449 N LEU A 407 -4.214 7.550 40.047 1.00 53.86 N ATOM 1450 CA LEU A 407 -5.544 7.194 39.563 1.00 52.91 C ATOM 1451 C LEU A 407 -5.753 5.668 39.513 1.00 52.76 C ATOM 1452 O LEU A 407 -6.829 5.192 39.148 1.00 52.93 O ATOM 1453 CB LEU A 407 -5.777 7.808 38.179 1.00 52.32 C ATOM 1454 CG LEU A 407 -5.929 9.328 38.109 1.00 56.48 C ATOM 1455 CD1 LEU A 407 -5.925 9.797 36.669 1.00 56.36 C ATOM 1456 CD2 LEU A 407 -7.208 9.763 38.816 1.00 59.30 C ATOM 1457 H LEU A 407 -3.381 7.309 39.474 1.00 0.00 H ATOM 1458 N ALA A 408 -4.726 4.910 39.893 1.00 52.69 N ATOM 1459 CA ALA A 408 -4.770 3.453 39.820 1.00 50.60 C ATOM 1460 C ALA A 408 -5.712 2.864 40.874 1.00 56.64 C ATOM 1461 O ALA A 408 -5.746 3.333 42.018 1.00 55.04 O ATOM 1462 CB ALA A 408 -3.384 2.882 39.979 1.00 47.27 C ATOM 1463 H ALA A 408 -3.866 5.371 40.253 1.00 0.00 H ATOM 1464 N ARG A 409 -6.431 1.802 40.503 1.00 51.35 N ATOM 1465 CA ARG A 409 -7.427 1.194 41.394 1.00 57.64 C ATOM 1466 C ARG A 409 -7.696 -0.261 41.033 1.00 57.85 C ATOM 1467 O ARG A 409 -7.271 -0.749 39.986 1.00 48.55 O ATOM 1468 CB ARG A 409 -8.743 1.992 41.357 1.00 64.03 C ATOM 1469 CG ARG A 409 -9.406 2.035 39.972 1.00 74.17 C ATOM 1470 CD ARG A 409 -10.728 2.820 39.952 1.00 82.11 C ATOM 1471 NE ARG A 409 -11.296 2.867 38.599 1.00 89.77 N ATOM 1472 CZ ARG A 409 -12.378 3.561 38.244 1.00 95.77 C ATOM 1473 NH1 ARG A 409 -13.038 4.286 39.140 1.00 96.45 N ATOM 1474 NH2 ARG A 409 -12.803 3.530 36.984 1.00 93.22 N ATOM 1475 HE ARG A 409 -10.817 2.315 37.859 1.00 0.00 H ATOM 1476 HH12 ARG A 409 -13.881 4.824 38.854 1.00 0.00 H ATOM 1477 HH11 ARG A 409 -12.712 4.316 40.127 1.00 0.00 H ATOM 1478 HH22 ARG A 409 -13.647 4.071 36.706 1.00 0.00 H ATOM 1479 HH21 ARG A 409 -12.292 2.965 36.276 1.00 0.00 H ATOM 1480 H ARG A 409 -6.282 1.395 39.558 1.00 0.00 H ATOM 1481 N LEU A 410 -8.341 -0.970 41.946 1.00 65.02 N ATOM 1482 CA LEU A 410 -8.839 -2.310 41.670 1.00 73.10 C ATOM 1483 C LEU A 410 -10.053 -2.309 40.748 1.00 80.23 C ATOM 1484 O LEU A 410 -10.757 -1.300 40.626 1.00 80.06 O ATOM 1485 CB LEU A 410 -9.200 -3.018 42.967 1.00 76.86 C ATOM 1486 CG LEU A 410 -7.985 -3.629 43.648 1.00 77.33 C ATOM 1487 CD1 LEU A 410 -7.591 -2.763 44.833 1.00 81.60 C ATOM 1488 CD2 LEU A 410 -8.289 -5.047 44.073 1.00 79.76 C ATOM 1489 H LEU A 410 -8.497 -0.558 42.888 1.00 0.00 H ATOM 1490 N ILE A 411 -10.284 -3.444 40.097 1.00 84.98 N ATOM 1491 CA ILE A 411 -11.496 -3.651 39.310 1.00 90.80 C ATOM 1492 C ILE A 411 -12.670 -4.026 40.211 1.00 92.99 C ATOM 1493 O ILE A 411 -13.675 -3.318 40.257 1.00 94.65 O ATOM 1494 CB ILE A 411 -11.303 -4.751 38.249 1.00 92.03 C ATOM 1495 CG1 ILE A 411 -10.632 -4.173 37.007 1.00 84.72 C ATOM 1496 CG2 ILE A 411 -12.645 -5.238 37.747 1.00 95.38 C ATOM 1497 CD1 ILE A 411 -11.389 -3.001 36.421 1.00 81.96 C ATOM 1498 H ILE A 411 -9.580 -4.208 40.150 1.00 0.00 H TER 1499 ILE A 411 ATOM 1500 N PHE A 424 -9.632 13.229 31.916 1.00 85.19 N ATOM 1501 CA PHE A 424 -8.726 12.261 31.289 1.00 84.46 C ATOM 1502 C PHE A 424 -8.309 12.696 29.886 1.00 84.15 C ATOM 1503 O PHE A 424 -9.149 13.107 29.086 1.00 85.18 O ATOM 1504 CB PHE A 424 -9.363 10.862 31.255 1.00 82.52 C ATOM 1505 CG PHE A 424 -9.226 10.099 32.555 1.00 84.29 C ATOM 1506 CD1 PHE A 424 -8.028 9.473 32.879 1.00 81.19 C ATOM 1507 CD2 PHE A 424 -10.280 10.029 33.467 1.00 84.78 C ATOM 1508 CE1 PHE A 424 -7.884 8.774 34.073 1.00 78.72 C ATOM 1509 CE2 PHE A 424 -10.140 9.334 34.673 1.00 81.84 C ATOM 1510 CZ PHE A 424 -8.940 8.708 34.974 1.00 80.56 C ATOM 1511 HN3 PHE A 424 -10.490 13.325 31.336 1.00 0.00 H ATOM 1512 HN2 PHE A 424 -9.156 14.151 31.989 1.00 0.00 H ATOM 1513 HN1 PHE A 424 -9.890 12.895 32.866 1.00 0.00 H ATOM 1514 N PRO A 425 -6.998 12.621 29.593 1.00 71.84 N ATOM 1515 CA PRO A 425 -6.458 13.029 28.288 1.00 61.06 C ATOM 1516 C PRO A 425 -6.967 12.106 27.184 1.00 51.94 C ATOM 1517 O PRO A 425 -6.508 10.961 27.088 1.00 47.92 O ATOM 1518 CB PRO A 425 -4.947 12.873 28.471 1.00 64.72 C ATOM 1519 CG PRO A 425 -4.803 11.835 29.564 1.00 67.26 C ATOM 1520 CD PRO A 425 -5.958 12.075 30.485 1.00 70.74 C ATOM 1521 N ILE A 426 -7.880 12.611 26.360 1.00 34.96 N ATOM 1522 CA ILE A 426 -8.549 11.803 25.360 1.00 43.13 C ATOM 1523 C ILE A 426 -7.599 11.121 24.370 1.00 39.49 C ATOM 1524 O ILE A 426 -7.906 10.036 23.873 1.00 39.33 O ATOM 1525 CB ILE A 426 -9.572 12.665 24.587 1.00 51.69 C ATOM 1526 CG1 ILE A 426 -10.268 11.874 23.469 1.00 51.05 C ATOM 1527 CG2 ILE A 426 -8.869 13.838 23.956 1.00 56.20 C ATOM 1528 CD1 ILE A 426 -11.017 10.610 23.916 1.00 54.99 C ATOM 1529 H ILE A 426 -8.122 13.620 26.436 1.00 0.00 H ATOM 1530 N LYS A 427 -6.429 11.715 24.107 1.00 35.96 N ATOM 1531 CA LYS A 427 -5.546 11.176 23.060 1.00 30.62 C ATOM 1532 C LYS A 427 -4.909 9.878 23.505 1.00 30.14 C ATOM 1533 O LYS A 427 -4.460 9.076 22.681 1.00 33.08 O ATOM 1534 CB LYS A 427 -4.465 12.202 22.659 1.00 29.20 C ATOM 1535 CG LYS A 427 -5.044 13.385 21.864 1.00 34.03 C ATOM 1536 CD LYS A 427 -3.982 14.454 21.579 1.00 40.47 C ATOM 1537 CE LYS A 427 -4.622 15.763 21.081 1.00 51.19 C ATOM 1538 NZ LYS A 427 -3.658 16.940 21.120 1.00 41.90 N ATOM 1539 HZ1 LYS A 427 -3.339 17.093 22.098 1.00 0.00 H ATOM 1540 HZ2 LYS A 427 -2.838 16.735 20.514 1.00 0.00 H ATOM 1541 HZ3 LYS A 427 -4.141 17.794 20.774 1.00 0.00 H ATOM 1542 H LYS A 427 -6.143 12.559 24.643 1.00 0.00 H ATOM 1543 N TRP A 428 -4.852 9.661 24.813 1.00 25.55 N ATOM 1544 CA TRP A 428 -4.274 8.440 25.341 1.00 25.32 C ATOM 1545 C TRP A 428 -5.327 7.466 25.876 1.00 30.66 C ATOM 1546 O TRP A 428 -5.007 6.349 26.257 1.00 28.28 O ATOM 1547 CB TRP A 428 -3.307 8.769 26.463 1.00 32.51 C ATOM 1548 CG TRP A 428 -1.973 9.253 26.021 1.00 33.60 C ATOM 1549 CD1 TRP A 428 -0.844 8.509 25.856 1.00 33.17 C ATOM 1550 CD2 TRP A 428 -1.619 10.601 25.694 1.00 29.17 C ATOM 1551 NE1 TRP A 428 0.200 9.313 25.453 1.00 28.76 N ATOM 1552 CE2 TRP A 428 -0.252 10.600 25.345 1.00 28.26 C ATOM 1553 CE3 TRP A 428 -2.319 11.806 25.676 1.00 27.90 C ATOM 1554 CZ2 TRP A 428 0.426 11.763 24.971 1.00 31.08 C ATOM 1555 CZ3 TRP A 428 -1.645 12.965 25.294 1.00 36.47 C ATOM 1556 CH2 TRP A 428 -0.283 12.930 24.954 1.00 32.75 C ATOM 1557 HE1 TRP A 428 1.171 8.994 25.262 1.00 0.00 H ATOM 1558 H TRP A 428 -5.227 10.376 25.468 1.00 0.00 H ATOM 1559 N THR A 429 -6.571 7.913 25.984 1.00 29.31 N ATOM 1560 CA THR A 429 -7.600 7.110 26.633 1.00 31.11 C ATOM 1561 C THR A 429 -8.428 6.347 25.622 1.00 31.78 C ATOM 1562 O THR A 429 -8.791 6.905 24.588 1.00 33.41 O ATOM 1563 CB THR A 429 -8.504 8.013 27.486 1.00 29.51 C ATOM 1564 OG1 THR A 429 -7.669 8.817 28.318 1.00 31.37 O ATOM 1565 CG2 THR A 429 -9.449 7.195 28.374 1.00 30.19 C ATOM 1566 HG1 THR A 429 -7.073 9.368 27.751 1.00 0.00 H ATOM 1567 H THR A 429 -6.815 8.848 25.601 1.00 0.00 H ATOM 1568 N ALA A 430 -8.686 5.067 25.901 1.00 29.69 N ATOM 1569 CA ALA A 430 -9.539 4.251 25.049 1.00 33.00 C ATOM 1570 C ALA A 430 -10.940 4.864 24.962 1.00 37.95 C ATOM 1571 O ALA A 430 -11.445 5.414 25.935 1.00 32.25 O ATOM 1572 CB ALA A 430 -9.628 2.814 25.576 1.00 32.06 C ATOM 1573 H ALA A 430 -8.266 4.641 26.751 1.00 0.00 H ATOM 1574 N PRO A 431 -11.559 4.779 23.786 1.00 40.52 N ATOM 1575 CA PRO A 431 -12.900 5.346 23.611 1.00 39.49 C ATOM 1576 C PRO A 431 -13.907 4.853 24.647 1.00 36.43 C ATOM 1577 O PRO A 431 -14.591 5.685 25.223 1.00 37.84 O ATOM 1578 CB PRO A 431 -13.293 4.896 22.189 1.00 40.01 C ATOM 1579 CG PRO A 431 -12.158 3.977 21.714 1.00 40.95 C ATOM 1580 CD PRO A 431 -10.965 4.355 22.509 1.00 37.35 C ATOM 1581 N GLU A 432 -13.973 3.557 24.932 1.00 36.28 N ATOM 1582 CA GLU A 432 -14.996 3.100 25.867 1.00 39.60 C ATOM 1583 C GLU A 432 -14.767 3.666 27.285 1.00 41.93 C ATOM 1584 O GLU A 432 -15.713 3.806 28.086 1.00 40.21 O ATOM 1585 CB GLU A 432 -15.059 1.565 25.896 1.00 39.42 C ATOM 1586 CG GLU A 432 -13.958 0.863 26.678 1.00 43.42 C ATOM 1587 CD GLU A 432 -12.680 0.635 25.870 1.00 44.37 C ATOM 1588 OE1 GLU A 432 -12.593 1.074 24.698 1.00 42.30 O ATOM 1589 OE2 GLU A 432 -11.750 0.023 26.433 1.00 37.02 O ATOM 1590 H GLU A 432 -13.310 2.883 24.498 1.00 0.00 H ATOM 1591 N ALA A 433 -13.525 4.023 27.595 1.00 40.52 N ATOM 1592 CA ALA A 433 -13.220 4.565 28.922 1.00 35.62 C ATOM 1593 C ALA A 433 -13.537 6.054 28.959 1.00 35.33 C ATOM 1594 O ALA A 433 -14.122 6.542 29.925 1.00 36.40 O ATOM 1595 CB ALA A 433 -11.738 4.296 29.297 1.00 34.13 C ATOM 1596 H ALA A 433 -12.766 3.917 26.892 1.00 0.00 H ATOM 1597 N ALA A 434 -13.168 6.771 27.901 1.00 34.20 N ATOM 1598 CA ALA A 434 -13.440 8.201 27.804 1.00 34.20 C ATOM 1599 C ALA A 434 -14.943 8.512 27.696 1.00 44.39 C ATOM 1600 O ALA A 434 -15.433 9.458 28.322 1.00 44.93 O ATOM 1601 CB ALA A 434 -12.698 8.787 26.621 1.00 32.89 C ATOM 1602 H ALA A 434 -12.671 6.298 27.120 1.00 0.00 H ATOM 1603 N LEU A 435 -15.676 7.720 26.921 1.00 43.42 N ATOM 1604 CA LEU A 435 -17.093 7.995 26.724 1.00 46.07 C ATOM 1605 C LEU A 435 -17.955 7.470 27.865 1.00 44.62 C ATOM 1606 O LEU A 435 -18.814 8.175 28.381 1.00 49.31 O ATOM 1607 CB LEU A 435 -17.579 7.398 25.407 1.00 52.25 C ATOM 1608 CG LEU A 435 -17.086 8.097 24.138 1.00 56.67 C ATOM 1609 CD1 LEU A 435 -17.586 7.364 22.910 1.00 55.30 C ATOM 1610 CD2 LEU A 435 -17.541 9.541 24.125 1.00 57.47 C ATOM 1611 H LEU A 435 -15.237 6.901 26.454 1.00 0.00 H ATOM 1612 N TYR A 436 -17.717 6.227 28.254 1.00 47.44 N ATOM 1613 CA TYR A 436 -18.623 5.514 29.142 1.00 50.37 C ATOM 1614 C TYR A 436 -18.016 5.148 30.511 1.00 48.04 C ATOM 1615 O TYR A 436 -18.659 4.487 31.332 1.00 47.76 O ATOM 1616 CB TYR A 436 -19.127 4.267 28.403 1.00 52.47 C ATOM 1617 CG TYR A 436 -19.694 4.614 27.031 1.00 57.12 C ATOM 1618 CD1 TYR A 436 -20.660 5.603 26.896 1.00 67.23 C ATOM 1619 CD2 TYR A 436 -19.235 3.991 25.873 1.00 57.97 C ATOM 1620 CE1 TYR A 436 -21.181 5.937 25.653 1.00 68.11 C ATOM 1621 CE2 TYR A 436 -19.743 4.322 24.629 1.00 56.67 C ATOM 1622 CZ TYR A 436 -20.715 5.294 24.524 1.00 64.93 C ATOM 1623 OH TYR A 436 -21.229 5.629 23.290 1.00 65.92 O ATOM 1624 HH TYR A 436 -21.645 4.830 22.879 1.00 0.00 H ATOM 1625 H TYR A 436 -16.859 5.747 27.916 1.00 0.00 H ATOM 1626 N GLY A 437 -16.784 5.581 30.768 1.00 41.85 N ATOM 1627 CA GLY A 437 -16.169 5.327 32.064 1.00 43.19 C ATOM 1628 C GLY A 437 -15.777 3.871 32.258 1.00 46.69 C ATOM 1629 O GLY A 437 -15.585 3.411 33.379 1.00 42.75 O ATOM 1630 H GLY A 437 -16.257 6.104 30.039 1.00 0.00 H ATOM 1631 N ARG A 438 -15.652 3.146 31.151 1.00 44.26 N ATOM 1632 CA ARG A 438 -15.251 1.741 31.174 1.00 50.16 C ATOM 1633 C ARG A 438 -13.707 1.591 31.213 1.00 44.09 C ATOM 1634 O ARG A 438 -13.080 1.334 30.187 1.00 38.68 O ATOM 1635 CB ARG A 438 -15.824 1.031 29.935 1.00 54.85 C ATOM 1636 CG ARG A 438 -16.252 -0.418 30.121 1.00 63.93 C ATOM 1637 CD ARG A 438 -17.071 -0.929 28.904 1.00 73.00 C ATOM 1638 NE ARG A 438 -18.440 -0.396 28.885 1.00 76.49 N ATOM 1639 CZ ARG A 438 -19.251 -0.382 27.822 1.00 70.94 C ATOM 1640 NH1 ARG A 438 -18.841 -0.851 26.649 1.00 69.84 N ATOM 1641 NH2 ARG A 438 -20.476 0.122 27.933 1.00 60.02 N ATOM 1642 HE ARG A 438 -18.809 0.003 29.772 1.00 0.00 H ATOM 1643 HH12 ARG A 438 -19.481 -0.834 25.830 1.00 0.00 H ATOM 1644 HH11 ARG A 438 -17.880 -1.235 26.550 1.00 0.00 H ATOM 1645 HH22 ARG A 438 -21.110 0.135 27.109 1.00 0.00 H ATOM 1646 HH21 ARG A 438 -20.801 0.504 28.844 1.00 0.00 H ATOM 1647 H ARG A 438 -15.847 3.596 30.234 1.00 0.00 H ATOM 1648 N PHE A 439 -13.110 1.763 32.396 1.00 41.03 N ATOM 1649 CA PHE A 439 -11.659 1.594 32.593 1.00 39.33 C ATOM 1650 C PHE A 439 -11.325 0.172 33.044 1.00 48.46 C ATOM 1651 O PHE A 439 -11.768 -0.266 34.112 1.00 44.03 O ATOM 1652 CB PHE A 439 -11.130 2.569 33.633 1.00 39.95 C ATOM 1653 CG PHE A 439 -11.063 4.007 33.173 1.00 38.44 C ATOM 1654 CD1 PHE A 439 -12.140 4.862 33.372 1.00 43.91 C ATOM 1655 CD2 PHE A 439 -9.914 4.510 32.580 1.00 38.39 C ATOM 1656 CE1 PHE A 439 -12.084 6.195 32.965 1.00 40.36 C ATOM 1657 CE2 PHE A 439 -9.846 5.850 32.186 1.00 42.23 C ATOM 1658 CZ PHE A 439 -10.940 6.686 32.379 1.00 33.81 C ATOM 1659 H PHE A 439 -13.695 2.028 33.214 1.00 0.00 H ATOM 1660 N THR A 440 -10.563 -0.547 32.221 1.00 42.83 N ATOM 1661 CA THR A 440 -10.096 -1.896 32.530 1.00 40.39 C ATOM 1662 C THR A 440 -8.612 -2.013 32.180 1.00 43.51 C ATOM 1663 O THR A 440 -8.010 -1.056 31.684 1.00 36.74 O ATOM 1664 CB THR A 440 -10.882 -2.943 31.752 1.00 42.94 C ATOM 1665 OG1 THR A 440 -10.721 -2.692 30.349 1.00 40.82 O ATOM 1666 CG2 THR A 440 -12.390 -2.870 32.113 1.00 44.04 C ATOM 1667 HG1 THR A 440 -11.062 -1.788 30.135 1.00 0.00 H ATOM 1668 H THR A 440 -10.286 -0.126 31.311 1.00 0.00 H ATOM 1669 N ILE A 441 -8.027 -3.184 32.421 1.00 34.21 N ATOM 1670 CA ILE A 441 -6.646 -3.403 32.011 1.00 37.10 C ATOM 1671 C ILE A 441 -6.567 -3.297 30.467 1.00 32.40 C ATOM 1672 O ILE A 441 -5.548 -2.934 29.920 1.00 31.81 O ATOM 1673 CB ILE A 441 -6.098 -4.759 32.535 1.00 39.80 C ATOM 1674 CG1 ILE A 441 -4.572 -4.824 32.355 1.00 36.53 C ATOM 1675 CG2 ILE A 441 -6.787 -5.949 31.863 1.00 44.03 C ATOM 1676 CD1 ILE A 441 -3.819 -3.807 33.209 1.00 34.07 C ATOM 1677 H ILE A 441 -8.554 -3.941 32.901 1.00 0.00 H ATOM 1678 N LYS A 442 -7.673 -3.556 29.770 1.00 34.33 N ATOM 1679 CA LYS A 442 -7.690 -3.422 28.313 1.00 29.90 C ATOM 1680 C LYS A 442 -7.679 -1.957 27.852 1.00 33.24 C ATOM 1681 O LYS A 442 -7.217 -1.659 26.756 1.00 31.55 O ATOM 1682 CB LYS A 442 -8.924 -4.128 27.735 1.00 35.85 C ATOM 1683 CG LYS A 442 -8.926 -5.618 27.959 1.00 33.35 C ATOM 1684 CD LYS A 442 -7.675 -6.273 27.322 1.00 34.86 C ATOM 1685 CE LYS A 442 -7.775 -7.794 27.387 1.00 41.54 C ATOM 1686 NZ LYS A 442 -6.550 -8.478 26.837 1.00 34.95 N ATOM 1687 HZ1 LYS A 442 -6.421 -8.208 25.841 1.00 0.00 H ATOM 1688 HZ2 LYS A 442 -5.716 -8.188 27.387 1.00 0.00 H ATOM 1689 HZ3 LYS A 442 -6.670 -9.509 26.905 1.00 0.00 H ATOM 1690 H LYS A 442 -8.535 -3.857 30.268 1.00 0.00 H ATOM 1691 N SER A 443 -8.210 -1.033 28.653 1.00 33.49 N ATOM 1692 CA SER A 443 -8.064 0.373 28.267 1.00 33.08 C ATOM 1693 C SER A 443 -6.616 0.822 28.534 1.00 34.38 C ATOM 1694 O SER A 443 -6.110 1.699 27.841 1.00 30.56 O ATOM 1695 CB SER A 443 -9.079 1.279 28.976 1.00 35.20 C ATOM 1696 OG SER A 443 -9.124 1.064 30.370 1.00 38.33 O ATOM 1697 HG SER A 443 -8.232 1.245 30.760 1.00 0.00 H ATOM 1698 H SER A 443 -8.712 -1.301 29.524 1.00 0.00 H ATOM 1699 N ASP A 444 -5.942 0.210 29.507 1.00 30.46 N ATOM 1700 CA ASP A 444 -4.507 0.478 29.678 1.00 30.97 C ATOM 1701 C ASP A 444 -3.740 -0.081 28.452 1.00 29.99 C ATOM 1702 O ASP A 444 -2.757 0.498 28.004 1.00 30.06 O ATOM 1703 CB ASP A 444 -3.969 -0.172 30.951 1.00 30.08 C ATOM 1704 CG ASP A 444 -4.349 0.587 32.224 1.00 35.41 C ATOM 1705 OD1 ASP A 444 -4.762 1.773 32.153 1.00 33.15 O ATOM 1706 OD2 ASP A 444 -4.224 -0.028 33.316 1.00 37.39 O ATOM 1707 H ASP A 444 -6.429 -0.454 30.142 1.00 0.00 H ATOM 1708 N VAL A 445 -4.189 -1.216 27.916 1.00 25.49 N ATOM 1709 CA VAL A 445 -3.527 -1.768 26.722 1.00 25.47 C ATOM 1710 C VAL A 445 -3.659 -0.777 25.574 1.00 26.85 C ATOM 1711 O VAL A 445 -2.682 -0.527 24.878 1.00 26.77 O ATOM 1712 CB VAL A 445 -4.092 -3.159 26.309 1.00 32.02 C ATOM 1713 CG1 VAL A 445 -3.500 -3.626 24.947 1.00 21.61 C ATOM 1714 CG2 VAL A 445 -3.780 -4.195 27.371 1.00 24.75 C ATOM 1715 H VAL A 445 -5.002 -1.709 28.338 1.00 0.00 H ATOM 1716 N TRP A 446 -4.834 -0.170 25.406 1.00 24.95 N ATOM 1717 CA TRP A 446 -5.004 0.905 24.406 1.00 26.08 C ATOM 1718 C TRP A 446 -3.965 2.035 24.591 1.00 24.96 C ATOM 1719 O TRP A 446 -3.313 2.441 23.631 1.00 24.45 O ATOM 1720 CB TRP A 446 -6.435 1.510 24.477 1.00 34.20 C ATOM 1721 CG TRP A 446 -6.676 2.646 23.469 1.00 30.55 C ATOM 1722 CD1 TRP A 446 -6.157 3.903 23.515 1.00 23.29 C ATOM 1723 CD2 TRP A 446 -7.506 2.600 22.282 1.00 30.97 C ATOM 1724 NE1 TRP A 446 -6.599 4.645 22.446 1.00 26.91 N ATOM 1725 CE2 TRP A 446 -7.421 3.869 21.671 1.00 27.72 C ATOM 1726 CE3 TRP A 446 -8.309 1.614 21.694 1.00 26.64 C ATOM 1727 CZ2 TRP A 446 -8.099 4.174 20.486 1.00 29.32 C ATOM 1728 CZ3 TRP A 446 -9.003 1.925 20.518 1.00 33.06 C ATOM 1729 CH2 TRP A 446 -8.888 3.194 19.929 1.00 29.72 C ATOM 1730 HE1 TRP A 446 -6.350 5.637 22.256 1.00 0.00 H ATOM 1731 H TRP A 446 -5.646 -0.458 25.989 1.00 0.00 H ATOM 1732 N SER A 447 -3.847 2.542 25.825 1.00 22.91 N ATOM 1733 CA SER A 447 -2.917 3.611 26.168 1.00 22.20 C ATOM 1734 C SER A 447 -1.480 3.186 25.854 1.00 23.39 C ATOM 1735 O SER A 447 -0.687 4.015 25.394 1.00 30.51 O ATOM 1736 CB SER A 447 -3.024 3.995 27.658 1.00 21.53 C ATOM 1737 OG SER A 447 -4.357 4.411 27.964 1.00 27.94 O ATOM 1738 HG SER A 447 -4.592 5.196 27.408 1.00 0.00 H ATOM 1739 H SER A 447 -4.450 2.153 26.578 1.00 0.00 H ATOM 1740 N PHE A 448 -1.155 1.914 26.093 1.00 21.81 N ATOM 1741 CA PHE A 448 0.182 1.398 25.754 1.00 23.93 C ATOM 1742 C PHE A 448 0.447 1.504 24.244 1.00 27.60 C ATOM 1743 O PHE A 448 1.565 1.778 23.809 1.00 25.91 O ATOM 1744 CB PHE A 448 0.335 -0.064 26.222 1.00 24.20 C ATOM 1745 CG PHE A 448 1.715 -0.639 25.999 1.00 21.74 C ATOM 1746 CD1 PHE A 448 2.745 -0.383 26.904 1.00 26.25 C ATOM 1747 CD2 PHE A 448 1.975 -1.444 24.895 1.00 23.43 C ATOM 1748 CE1 PHE A 448 4.011 -0.909 26.716 1.00 21.69 C ATOM 1749 CE2 PHE A 448 3.252 -1.976 24.684 1.00 25.84 C ATOM 1750 CZ PHE A 448 4.278 -1.712 25.608 1.00 20.94 C ATOM 1751 H PHE A 448 -1.856 1.278 26.525 1.00 0.00 H ATOM 1752 N GLY A 449 -0.572 1.271 23.430 1.00 23.31 N ATOM 1753 CA GLY A 449 -0.408 1.435 21.982 1.00 22.63 C ATOM 1754 C GLY A 449 -0.048 2.874 21.614 1.00 26.42 C ATOM 1755 O GLY A 449 0.828 3.121 20.765 1.00 27.41 O ATOM 1756 H GLY A 449 -1.489 0.971 23.818 1.00 0.00 H ATOM 1757 N ILE A 450 -0.690 3.827 22.286 1.00 23.18 N ATOM 1758 CA ILE A 450 -0.366 5.226 22.072 1.00 24.54 C ATOM 1759 C ILE A 450 1.070 5.490 22.561 1.00 25.69 C ATOM 1760 O ILE A 450 1.807 6.253 21.931 1.00 22.35 O ATOM 1761 CB ILE A 450 -1.363 6.181 22.805 1.00 24.99 C ATOM 1762 CG1 ILE A 450 -2.824 5.909 22.396 1.00 27.80 C ATOM 1763 CG2 ILE A 450 -1.014 7.631 22.525 1.00 30.40 C ATOM 1764 CD1 ILE A 450 -3.084 6.151 20.925 1.00 26.56 C ATOM 1765 H ILE A 450 -1.429 3.567 22.970 1.00 0.00 H ATOM 1766 N LEU A 451 1.460 4.856 23.664 1.00 22.53 N ATOM 1767 CA LEU A 451 2.809 5.038 24.221 1.00 25.01 C ATOM 1768 C LEU A 451 3.841 4.556 23.211 1.00 25.68 C ATOM 1769 O LEU A 451 4.922 5.168 23.067 1.00 24.23 O ATOM 1770 CB LEU A 451 2.956 4.306 25.576 1.00 23.82 C ATOM 1771 CG LEU A 451 3.989 4.882 26.563 1.00 32.08 C ATOM 1772 CD1 LEU A 451 3.765 4.338 27.980 1.00 32.62 C ATOM 1773 CD2 LEU A 451 5.364 4.555 26.118 1.00 28.10 C ATOM 1774 H LEU A 451 0.795 4.216 24.144 1.00 0.00 H ATOM 1775 N LEU A 452 3.513 3.479 22.493 1.00 20.47 N ATOM 1776 CA LEU A 452 4.409 3.000 21.454 1.00 23.48 C ATOM 1777 C LEU A 452 4.625 4.054 20.363 1.00 28.24 C ATOM 1778 O LEU A 452 5.752 4.180 19.846 1.00 26.17 O ATOM 1779 CB LEU A 452 3.884 1.696 20.846 1.00 24.63 C ATOM 1780 CG LEU A 452 3.936 0.450 21.742 1.00 23.82 C ATOM 1781 CD1 LEU A 452 3.234 -0.738 21.023 1.00 25.50 C ATOM 1782 CD2 LEU A 452 5.372 0.083 22.080 1.00 23.92 C ATOM 1783 H LEU A 452 2.617 2.984 22.677 1.00 0.00 H ATOM 1784 N THR A 453 3.600 4.847 20.020 1.00 23.19 N ATOM 1785 CA THR A 453 3.826 5.894 18.997 1.00 22.06 C ATOM 1786 C THR A 453 4.695 7.019 19.567 1.00 24.38 C ATOM 1787 O THR A 453 5.474 7.616 18.840 1.00 31.99 O ATOM 1788 CB THR A 453 2.523 6.537 18.460 1.00 26.15 C ATOM 1789 OG1 THR A 453 1.965 7.380 19.480 1.00 36.37 O ATOM 1790 CG2 THR A 453 1.511 5.481 18.066 1.00 25.51 C ATOM 1791 HG1 THR A 453 1.764 6.836 20.283 1.00 0.00 H ATOM 1792 H THR A 453 2.666 4.730 20.463 1.00 0.00 H ATOM 1793 N GLU A 454 4.541 7.331 20.856 1.00 23.77 N ATOM 1794 CA GLU A 454 5.414 8.314 21.514 1.00 22.12 C ATOM 1795 C GLU A 454 6.871 7.853 21.463 1.00 25.30 C ATOM 1796 O GLU A 454 7.766 8.645 21.166 1.00 24.19 O ATOM 1797 CB GLU A 454 5.005 8.522 22.980 1.00 21.51 C ATOM 1798 CG GLU A 454 3.639 9.170 23.196 1.00 27.95 C ATOM 1799 CD GLU A 454 3.392 9.464 24.680 1.00 35.60 C ATOM 1800 OE1 GLU A 454 3.018 8.527 25.430 1.00 28.98 O ATOM 1801 OE2 GLU A 454 3.621 10.623 25.104 1.00 36.03 O ATOM 1802 H GLU A 454 3.788 6.869 21.406 1.00 0.00 H ATOM 1803 N LEU A 455 7.104 6.575 21.769 1.00 23.23 N ATOM 1804 CA LEU A 455 8.455 6.024 21.713 1.00 25.80 C ATOM 1805 C LEU A 455 9.025 6.131 20.299 1.00 27.38 C ATOM 1806 O LEU A 455 10.143 6.580 20.106 1.00 35.37 O ATOM 1807 CB LEU A 455 8.462 4.567 22.159 1.00 25.91 C ATOM 1808 CG LEU A 455 8.418 4.341 23.674 1.00 28.88 C ATOM 1809 CD1 LEU A 455 8.034 2.889 23.991 1.00 25.97 C ATOM 1810 CD2 LEU A 455 9.806 4.681 24.266 1.00 27.56 C ATOM 1811 H LEU A 455 6.312 5.963 22.051 1.00 0.00 H ATOM 1812 N THR A 456 8.237 5.792 19.294 1.00 20.97 N ATOM 1813 CA THR A 456 8.788 5.760 17.953 1.00 20.78 C ATOM 1814 C THR A 456 8.772 7.115 17.244 1.00 29.14 C ATOM 1815 O THR A 456 9.367 7.239 16.186 1.00 29.42 O ATOM 1816 CB THR A 456 8.057 4.708 17.085 1.00 26.67 C ATOM 1817 OG1 THR A 456 6.651 4.968 17.099 1.00 29.98 O ATOM 1818 CG2 THR A 456 8.293 3.332 17.662 1.00 24.03 C ATOM 1819 HG1 THR A 456 6.316 4.918 18.029 1.00 0.00 H ATOM 1820 H THR A 456 7.239 5.552 19.462 1.00 0.00 H ATOM 1821 N THR A 457 8.168 8.148 17.841 1.00 24.26 N ATOM 1822 CA THR A 457 8.274 9.483 17.244 1.00 27.84 C ATOM 1823 C THR A 457 9.122 10.411 18.114 1.00 24.65 C ATOM 1824 O THR A 457 9.132 11.613 17.908 1.00 26.82 O ATOM 1825 CB THR A 457 6.915 10.157 17.047 1.00 31.59 C ATOM 1826 OG1 THR A 457 6.290 10.332 18.338 1.00 30.30 O ATOM 1827 CG2 THR A 457 6.000 9.327 16.125 1.00 27.91 C ATOM 1828 HG1 THR A 457 6.168 9.448 18.767 1.00 0.00 H ATOM 1829 H THR A 457 7.629 8.006 18.719 1.00 0.00 H ATOM 1830 N LYS A 458 9.834 9.831 19.071 1.00 23.80 N ATOM 1831 CA LYS A 458 10.667 10.596 19.995 1.00 28.39 C ATOM 1832 C LYS A 458 9.848 11.617 20.775 1.00 26.73 C ATOM 1833 O LYS A 458 10.298 12.742 20.986 1.00 24.19 O ATOM 1834 CB LYS A 458 11.800 11.311 19.252 1.00 36.12 C ATOM 1835 CG LYS A 458 12.679 10.401 18.375 1.00 47.25 C ATOM 1836 CD LYS A 458 13.416 9.334 19.191 1.00 50.81 C ATOM 1837 CE LYS A 458 14.169 8.307 18.308 1.00 44.65 C ATOM 1838 NZ LYS A 458 15.285 8.839 17.458 1.00 42.74 N ATOM 1839 HZ1 LYS A 458 14.910 9.554 16.803 1.00 0.00 H ATOM 1840 HZ2 LYS A 458 16.008 9.272 18.068 1.00 0.00 H ATOM 1841 HZ3 LYS A 458 15.709 8.059 16.916 1.00 0.00 H ATOM 1842 H LYS A 458 9.798 8.796 19.167 1.00 0.00 H ATOM 1843 N GLY A 459 8.656 11.223 21.206 1.00 21.39 N ATOM 1844 CA GLY A 459 7.912 12.021 22.159 1.00 24.99 C ATOM 1845 C GLY A 459 6.916 13.022 21.601 1.00 24.43 C ATOM 1846 O GLY A 459 6.408 13.877 22.344 1.00 27.90 O ATOM 1847 H GLY A 459 8.252 10.331 20.856 1.00 0.00 H ATOM 1848 N ARG A 460 6.644 12.941 20.307 1.00 21.39 N ATOM 1849 CA ARG A 460 5.649 13.822 19.703 1.00 24.99 C ATOM 1850 C ARG A 460 4.254 13.539 20.254 1.00 24.84 C ATOM 1851 O ARG A 460 3.933 12.408 20.567 1.00 26.49 O ATOM 1852 CB ARG A 460 5.651 13.684 18.181 1.00 24.10 C ATOM 1853 CG ARG A 460 6.884 14.336 17.559 1.00 26.86 C ATOM 1854 CD ARG A 460 6.934 15.840 18.005 1.00 35.69 C ATOM 1855 NE ARG A 460 7.179 16.599 16.801 1.00 52.36 N ATOM 1856 CZ ARG A 460 6.469 17.605 16.325 1.00 45.92 C ATOM 1857 NH1 ARG A 460 6.863 18.112 15.186 1.00 50.99 N ATOM 1858 NH2 ARG A 460 5.433 18.131 16.968 1.00 41.01 N ATOM 1859 HE ARG A 460 8.012 16.321 16.244 1.00 0.00 H ATOM 1860 HH12 ARG A 460 6.342 18.906 14.762 1.00 0.00 H ATOM 1861 HH11 ARG A 460 7.697 17.721 14.704 1.00 0.00 H ATOM 1862 HH22 ARG A 460 4.908 18.924 16.547 1.00 0.00 H ATOM 1863 HH21 ARG A 460 5.147 17.750 17.893 1.00 0.00 H ATOM 1864 H ARG A 460 7.143 12.245 19.717 1.00 0.00 H ATOM 1865 N VAL A 461 3.450 14.586 20.384 1.00 30.95 N ATOM 1866 CA VAL A 461 2.049 14.453 20.781 1.00 31.01 C ATOM 1867 C VAL A 461 1.316 13.620 19.736 1.00 30.18 C ATOM 1868 O VAL A 461 1.464 13.856 18.550 1.00 31.24 O ATOM 1869 CB VAL A 461 1.381 15.821 20.923 1.00 29.42 C ATOM 1870 CG1 VAL A 461 -0.111 15.669 21.255 1.00 28.79 C ATOM 1871 CG2 VAL A 461 2.082 16.645 22.013 1.00 30.54 C ATOM 1872 H VAL A 461 3.830 15.536 20.197 1.00 0.00 H ATOM 1873 N PRO A 462 0.556 12.617 20.169 1.00 33.40 N ATOM 1874 CA PRO A 462 -0.192 11.806 19.202 1.00 29.99 C ATOM 1875 C PRO A 462 -1.247 12.613 18.418 1.00 27.61 C ATOM 1876 O PRO A 462 -1.589 13.725 18.802 1.00 25.03 O ATOM 1877 CB PRO A 462 -0.842 10.731 20.087 1.00 31.89 C ATOM 1878 CG PRO A 462 -0.825 11.298 21.454 1.00 37.06 C ATOM 1879 CD PRO A 462 0.387 12.135 21.548 1.00 35.46 C ATOM 1880 N TYR A 463 -1.740 12.046 17.319 1.00 31.96 N ATOM 1881 CA TYR A 463 -2.720 12.702 16.445 1.00 35.86 C ATOM 1882 C TYR A 463 -2.349 14.143 16.099 1.00 33.32 C ATOM 1883 O TYR A 463 -3.137 15.069 16.339 1.00 31.15 O ATOM 1884 CB TYR A 463 -4.109 12.675 17.083 1.00 40.92 C ATOM 1885 CG TYR A 463 -4.568 11.297 17.511 1.00 36.38 C ATOM 1886 CD1 TYR A 463 -5.165 10.424 16.607 1.00 36.11 C ATOM 1887 CD2 TYR A 463 -4.401 10.866 18.833 1.00 32.51 C ATOM 1888 CE1 TYR A 463 -5.588 9.170 16.997 1.00 31.81 C ATOM 1889 CE2 TYR A 463 -4.824 9.590 19.235 1.00 27.72 C ATOM 1890 CZ TYR A 463 -5.404 8.754 18.307 1.00 29.56 C ATOM 1891 OH TYR A 463 -5.814 7.501 18.694 1.00 30.70 O ATOM 1892 HH TYR A 463 -6.493 7.584 19.409 1.00 0.00 H ATOM 1893 H TYR A 463 -1.415 11.091 17.067 1.00 0.00 H ATOM 1894 N PRO A 464 -1.180 14.335 15.470 1.00 37.23 N ATOM 1895 CA PRO A 464 -0.661 15.691 15.239 1.00 40.56 C ATOM 1896 C PRO A 464 -1.654 16.575 14.480 1.00 44.07 C ATOM 1897 O PRO A 464 -2.213 16.136 13.476 1.00 47.67 O ATOM 1898 CB PRO A 464 0.585 15.459 14.370 1.00 42.59 C ATOM 1899 CG PRO A 464 0.905 13.979 14.506 1.00 43.64 C ATOM 1900 CD PRO A 464 -0.415 13.311 14.731 1.00 38.47 C ATOM 1901 N GLY A 465 -1.861 17.798 14.961 1.00 41.40 N ATOM 1902 CA GLY A 465 -2.725 18.764 14.301 1.00 45.10 C ATOM 1903 C GLY A 465 -4.210 18.588 14.571 1.00 51.83 C ATOM 1904 O GLY A 465 -5.022 19.355 14.068 1.00 56.70 O ATOM 1905 H GLY A 465 -1.386 18.074 15.844 1.00 0.00 H ATOM 1906 N MET A 466 -4.560 17.591 15.379 1.00 53.21 N ATOM 1907 CA MET A 466 -5.953 17.334 15.753 1.00 54.06 C ATOM 1908 C MET A 466 -6.218 17.732 17.184 1.00 52.60 C ATOM 1909 O MET A 466 -5.477 17.374 18.088 1.00 54.57 O ATOM 1910 CB MET A 466 -6.309 15.866 15.567 1.00 49.71 C ATOM 1911 CG MET A 466 -6.371 15.432 14.135 1.00 51.97 C ATOM 1912 SD MET A 466 -6.631 13.660 13.984 1.00 58.78 S ATOM 1913 CE MET A 466 -8.073 13.399 14.975 1.00 46.92 C ATOM 1914 H MET A 466 -3.817 16.971 15.759 1.00 0.00 H ATOM 1915 N VAL A 467 -7.277 18.487 17.388 1.00 53.55 N ATOM 1916 CA VAL A 467 -7.688 18.835 18.726 1.00 52.77 C ATOM 1917 C VAL A 467 -8.508 17.691 19.282 1.00 52.01 C ATOM 1918 O VAL A 467 -8.864 16.766 18.547 1.00 39.66 O ATOM 1919 CB VAL A 467 -8.486 20.123 18.740 1.00 55.15 C ATOM 1920 CG1 VAL A 467 -7.642 21.239 18.167 1.00 58.77 C ATOM 1921 CG2 VAL A 467 -9.778 19.966 17.943 1.00 55.39 C ATOM 1922 H VAL A 467 -7.823 18.836 16.575 1.00 0.00 H ATOM 1923 N ASN A 468 -8.808 17.758 20.573 1.00 55.53 N ATOM 1924 CA ASN A 468 -9.476 16.664 21.257 1.00 57.93 C ATOM 1925 C ASN A 468 -10.789 16.226 20.618 1.00 56.92 C ATOM 1926 O ASN A 468 -11.018 15.032 20.450 1.00 57.02 O ATOM 1927 CB ASN A 468 -9.745 17.059 22.705 1.00 65.27 C ATOM 1928 CG ASN A 468 -8.481 17.149 23.525 1.00 60.15 C ATOM 1929 OD1 ASN A 468 -7.444 16.622 23.141 1.00 57.38 O ATOM 1930 ND2 ASN A 468 -8.563 17.825 24.663 1.00 65.10 N ATOM 1931 HD22 ASN A 468 -9.466 18.256 24.948 1.00 0.00 H ATOM 1932 HD21 ASN A 468 -7.725 17.925 25.270 1.00 0.00 H ATOM 1933 H ASN A 468 -8.559 18.614 21.108 1.00 0.00 H ATOM 1934 N ARG A 469 -11.625 17.182 20.225 1.00 57.03 N ATOM 1935 CA ARG A 469 -12.941 16.874 19.649 1.00 63.56 C ATOM 1936 C ARG A 469 -12.854 16.107 18.339 1.00 61.07 C ATOM 1937 O ARG A 469 -13.725 15.289 18.045 1.00 57.18 O ATOM 1938 CB ARG A 469 -13.746 18.127 19.353 1.00 74.41 C ATOM 1939 CG ARG A 469 -14.098 18.991 20.477 1.00 86.98 C ATOM 1940 CD ARG A 469 -14.756 20.238 19.887 1.00 98.46 C ATOM 1941 NE ARG A 469 -14.668 21.341 20.787 1.00103.84 N ATOM 1942 CZ ARG A 469 -13.562 22.052 20.943 1.00107.99 C ATOM 1943 NH1 ARG A 469 -12.444 21.742 20.301 1.00103.11 N ATOM 1944 NH2 ARG A 469 -13.574 23.073 21.776 1.00108.82 N ATOM 1945 HE ARG A 469 -15.508 21.598 21.344 1.00 0.00 H ATOM 1946 HH12 ARG A 469 -11.588 22.316 20.440 1.00 0.00 H ATOM 1947 HH11 ARG A 469 -12.423 20.925 19.658 1.00 0.00 H ATOM 1948 HH22 ARG A 469 -12.715 23.643 21.912 1.00 0.00 H ATOM 1949 HH21 ARG A 469 -14.442 23.308 22.298 1.00 0.00 H ATOM 1950 H ARG A 469 -11.339 18.177 20.328 1.00 0.00 H ATOM 1951 N GLU A 470 -11.876 16.444 17.499 1.00 51.61 N ATOM 1952 CA GLU A 470 -11.729 15.715 16.253 1.00 54.59 C ATOM 1953 C GLU A 470 -11.271 14.313 16.589 1.00 53.29 C ATOM 1954 O GLU A 470 -11.742 13.351 15.985 1.00 53.29 O ATOM 1955 CB GLU A 470 -10.717 16.347 15.302 1.00 63.57 C ATOM 1956 CG GLU A 470 -10.710 17.835 15.237 1.00 79.47 C ATOM 1957 CD GLU A 470 -9.547 18.333 14.403 1.00 85.00 C ATOM 1958 OE1 GLU A 470 -9.182 17.641 13.429 1.00 82.67 O ATOM 1959 OE2 GLU A 470 -8.973 19.393 14.733 1.00 92.32 O ATOM 1960 H GLU A 470 -11.225 17.221 17.734 1.00 0.00 H ATOM 1961 N VAL A 471 -10.360 14.205 17.564 1.00 48.62 N ATOM 1962 CA VAL A 471 -9.809 12.907 17.961 1.00 45.22 C ATOM 1963 C VAL A 471 -10.907 11.952 18.385 1.00 45.64 C ATOM 1964 O VAL A 471 -10.965 10.817 17.929 1.00 43.94 O ATOM 1965 CB VAL A 471 -8.809 13.029 19.128 1.00 41.80 C ATOM 1966 CG1 VAL A 471 -8.329 11.651 19.543 1.00 38.32 C ATOM 1967 CG2 VAL A 471 -7.622 13.872 18.717 1.00 43.77 C ATOM 1968 H VAL A 471 -10.035 15.064 18.052 1.00 0.00 H ATOM 1969 N LEU A 472 -11.781 12.425 19.256 1.00 48.30 N ATOM 1970 CA LEU A 472 -12.909 11.629 19.697 1.00 56.14 C ATOM 1971 C LEU A 472 -13.719 11.169 18.497 1.00 57.53 C ATOM 1972 O LEU A 472 -13.926 9.977 18.291 1.00 50.32 O ATOM 1973 CB LEU A 472 -13.789 12.437 20.650 1.00 69.81 C ATOM 1974 CG LEU A 472 -13.792 11.945 22.098 1.00 77.45 C ATOM 1975 CD1 LEU A 472 -14.560 12.916 23.001 1.00 80.52 C ATOM 1976 CD2 LEU A 472 -14.368 10.535 22.180 1.00 72.17 C ATOM 1977 H LEU A 472 -11.657 13.387 19.632 1.00 0.00 H ATOM 1978 N ASP A 473 -14.155 12.148 17.712 1.00 64.82 N ATOM 1979 CA ASP A 473 -14.938 11.939 16.496 1.00 67.83 C ATOM 1980 C ASP A 473 -14.309 10.940 15.523 1.00 58.10 C ATOM 1981 O ASP A 473 -14.979 10.019 15.047 1.00 53.35 O ATOM 1982 CB ASP A 473 -15.127 13.274 15.790 1.00 78.70 C ATOM 1983 CG ASP A 473 -16.431 13.354 15.059 1.00 93.28 C ATOM 1984 OD1 ASP A 473 -17.343 14.031 15.578 1.00100.55 O ATOM 1985 OD2 ASP A 473 -16.546 12.737 13.979 1.00 96.35 O ATOM 1986 H ASP A 473 -13.924 13.126 17.980 1.00 0.00 H ATOM 1987 N GLN A 474 -13.038 11.164 15.203 1.00 47.15 N ATOM 1988 CA GLN A 474 -12.303 10.330 14.262 1.00 52.03 C ATOM 1989 C GLN A 474 -12.100 8.882 14.747 1.00 48.85 C ATOM 1990 O GLN A 474 -12.330 7.938 13.994 1.00 47.84 O ATOM 1991 CB GLN A 474 -10.940 10.974 13.964 1.00 54.09 C ATOM 1992 CG GLN A 474 -11.022 12.252 13.138 1.00 54.17 C ATOM 1993 CD GLN A 474 -11.528 12.011 11.732 1.00 66.30 C ATOM 1994 OE1 GLN A 474 -12.653 12.374 11.396 1.00 74.62 O ATOM 1995 NE2 GLN A 474 -10.691 11.402 10.895 1.00 65.67 N ATOM 1996 HE22 GLN A 474 -9.748 11.112 11.223 1.00 0.00 H ATOM 1997 HE21 GLN A 474 -10.981 11.216 9.914 1.00 0.00 H ATOM 1998 H GLN A 474 -12.548 11.969 15.643 1.00 0.00 H ATOM 1999 N VAL A 475 -11.648 8.706 15.985 1.00 39.59 N ATOM 2000 CA VAL A 475 -11.388 7.369 16.499 1.00 36.57 C ATOM 2001 C VAL A 475 -12.674 6.524 16.509 1.00 45.91 C ATOM 2002 O VAL A 475 -12.646 5.334 16.177 1.00 49.78 O ATOM 2003 CB VAL A 475 -10.730 7.422 17.913 1.00 47.58 C ATOM 2004 CG1 VAL A 475 -10.817 6.081 18.614 1.00 47.12 C ATOM 2005 CG2 VAL A 475 -9.253 7.855 17.797 1.00 36.46 C ATOM 2006 H VAL A 475 -11.478 9.533 16.593 1.00 0.00 H ATOM 2007 N GLU A 476 -13.805 7.131 16.850 1.00 51.87 N ATOM 2008 CA GLU A 476 -15.074 6.393 16.808 1.00 57.14 C ATOM 2009 C GLU A 476 -15.443 6.015 15.367 1.00 58.55 C ATOM 2010 O GLU A 476 -16.029 4.956 15.128 1.00 63.92 O ATOM 2011 CB GLU A 476 -16.213 7.211 17.447 1.00 65.35 C ATOM 2012 CG GLU A 476 -16.352 7.041 18.966 1.00 65.23 C ATOM 2013 CD GLU A 476 -16.560 5.594 19.394 1.00 66.47 C ATOM 2014 OE1 GLU A 476 -17.702 5.072 19.299 1.00 59.61 O ATOM 2015 OE2 GLU A 476 -15.562 4.972 19.816 1.00 66.20 O ATOM 2016 H GLU A 476 -13.792 8.128 17.146 1.00 0.00 H ATOM 2017 N ARG A 477 -15.073 6.870 14.412 1.00 50.33 N ATOM 2018 CA ARG A 477 -15.325 6.612 12.996 1.00 56.81 C ATOM 2019 C ARG A 477 -14.356 5.556 12.408 1.00 56.84 C ATOM 2020 O ARG A 477 -14.490 5.168 11.245 1.00 62.00 O ATOM 2021 CB ARG A 477 -15.222 7.915 12.190 1.00 67.73 C ATOM 2022 CG ARG A 477 -16.489 8.792 12.137 1.00 79.34 C ATOM 2023 CD ARG A 477 -16.257 10.016 11.236 1.00 89.17 C ATOM 2024 NE ARG A 477 -15.210 9.729 10.254 1.00101.39 N ATOM 2025 CZ ARG A 477 -14.554 10.643 9.542 1.00108.03 C ATOM 2026 NH1 ARG A 477 -14.823 11.934 9.694 1.00108.48 N ATOM 2027 NH2 ARG A 477 -13.621 10.259 8.677 1.00107.30 N ATOM 2028 HE ARG A 477 -14.959 8.732 10.100 1.00 0.00 H ATOM 2029 HH12 ARG A 477 -14.306 12.642 9.134 1.00 0.00 H ATOM 2030 HH11 ARG A 477 -15.550 12.237 10.373 1.00 0.00 H ATOM 2031 HH22 ARG A 477 -13.106 10.969 8.119 1.00 0.00 H ATOM 2032 HH21 ARG A 477 -13.406 9.248 8.559 1.00 0.00 H ATOM 2033 H ARG A 477 -14.589 7.749 14.684 1.00 0.00 H ATOM 2034 N GLY A 478 -13.364 5.127 13.193 1.00 49.98 N ATOM 2035 CA GLY A 478 -12.444 4.085 12.767 1.00 45.53 C ATOM 2036 C GLY A 478 -11.025 4.536 12.467 1.00 45.90 C ATOM 2037 O GLY A 478 -10.157 3.705 12.161 1.00 44.94 O ATOM 2038 H GLY A 478 -13.246 5.550 14.136 1.00 0.00 H ATOM 2039 N TYR A 479 -10.766 5.835 12.597 1.00 38.90 N ATOM 2040 CA TYR A 479 -9.437 6.370 12.322 1.00 43.99 C ATOM 2041 C TYR A 479 -8.431 5.826 13.327 1.00 44.93 C ATOM 2042 O TYR A 479 -8.728 5.731 14.531 1.00 43.41 O ATOM 2043 CB TYR A 479 -9.427 7.910 12.370 1.00 46.31 C ATOM 2044 CG TYR A 479 -8.054 8.507 12.114 1.00 45.68 C ATOM 2045 CD1 TYR A 479 -7.613 8.747 10.816 1.00 46.53 C ATOM 2046 CD2 TYR A 479 -7.178 8.776 13.161 1.00 43.81 C ATOM 2047 CE1 TYR A 479 -6.365 9.257 10.575 1.00 40.97 C ATOM 2048 CE2 TYR A 479 -5.919 9.285 12.922 1.00 40.90 C ATOM 2049 CZ TYR A 479 -5.522 9.523 11.626 1.00 42.13 C ATOM 2050 OH TYR A 479 -4.264 10.032 11.385 1.00 43.38 O ATOM 2051 HH TYR A 479 -4.136 10.144 10.410 1.00 0.00 H ATOM 2052 H TYR A 479 -11.524 6.480 12.900 1.00 0.00 H ATOM 2053 N ARG A 480 -7.246 5.460 12.832 1.00 36.77 N ATOM 2054 CA ARG A 480 -6.123 5.092 13.685 1.00 38.78 C ATOM 2055 C ARG A 480 -4.893 5.809 13.129 1.00 40.91 C ATOM 2056 O ARG A 480 -4.828 6.065 11.917 1.00 39.60 O ATOM 2057 CB ARG A 480 -5.903 3.574 13.706 1.00 39.63 C ATOM 2058 CG ARG A 480 -7.079 2.750 14.201 1.00 39.44 C ATOM 2059 CD ARG A 480 -7.313 2.988 15.702 1.00 36.53 C ATOM 2060 NE ARG A 480 -8.377 2.132 16.244 1.00 34.60 N ATOM 2061 CZ ARG A 480 -9.660 2.487 16.362 1.00 36.58 C ATOM 2062 NH1 ARG A 480 -10.083 3.686 15.968 1.00 32.95 N ATOM 2063 NH2 ARG A 480 -10.521 1.632 16.886 1.00 33.77 N ATOM 2064 HE ARG A 480 -8.112 1.177 16.560 1.00 0.00 H ATOM 2065 HH12 ARG A 480 -11.086 3.943 16.069 1.00 0.00 H ATOM 2066 HH11 ARG A 480 -9.411 4.366 15.560 1.00 0.00 H ATOM 2067 HH22 ARG A 480 -11.522 1.896 16.983 1.00 0.00 H ATOM 2068 HH21 ARG A 480 -10.197 0.695 17.201 1.00 0.00 H ATOM 2069 H ARG A 480 -7.120 5.437 11.800 1.00 0.00 H ATOM 2070 N MET A 481 -3.939 6.143 13.990 1.00 35.54 N ATOM 2071 CA MET A 481 -2.684 6.757 13.529 1.00 36.56 C ATOM 2072 C MET A 481 -1.953 5.831 12.563 1.00 35.40 C ATOM 2073 O MET A 481 -1.966 4.622 12.750 1.00 33.95 O ATOM 2074 CB MET A 481 -1.775 7.111 14.712 1.00 30.81 C ATOM 2075 CG MET A 481 -2.183 8.387 15.458 1.00 30.84 C ATOM 2076 SD MET A 481 -1.014 8.781 16.792 1.00 35.99 S ATOM 2077 CE MET A 481 -1.613 7.670 18.071 1.00 31.91 C ATOM 2078 H MET A 481 -4.081 5.968 15.005 1.00 0.00 H ATOM 2079 N PRO A 482 -1.352 6.397 11.504 1.00 36.96 N ATOM 2080 CA PRO A 482 -0.611 5.575 10.545 1.00 39.16 C ATOM 2081 C PRO A 482 0.731 5.144 11.111 1.00 36.40 C ATOM 2082 O PRO A 482 1.104 5.537 12.224 1.00 33.56 O ATOM 2083 CB PRO A 482 -0.429 6.510 9.347 1.00 44.06 C ATOM 2084 CG PRO A 482 -0.340 7.869 9.969 1.00 42.25 C ATOM 2085 CD PRO A 482 -1.293 7.830 11.158 1.00 40.39 C ATOM 2086 N CYS A 483 1.413 4.276 10.379 1.00 32.70 N ATOM 2087 CA CYS A 483 2.760 3.841 10.736 1.00 34.24 C ATOM 2088 C CYS A 483 3.724 5.035 10.738 1.00 35.43 C ATOM 2089 O CYS A 483 3.882 5.699 9.707 1.00 38.68 O ATOM 2090 CB CYS A 483 3.250 2.771 9.730 1.00 37.78 C ATOM 2091 SG CYS A 483 4.825 1.990 10.189 1.00 38.08 S ATOM 2092 H CYS A 483 0.973 3.891 9.519 1.00 0.00 H ATOM 2093 N PRO A 484 4.362 5.320 11.887 1.00 37.34 N ATOM 2094 CA PRO A 484 5.385 6.380 11.952 1.00 36.28 C ATOM 2095 C PRO A 484 6.537 6.119 10.973 1.00 39.51 C ATOM 2096 O PRO A 484 6.833 4.966 10.639 1.00 37.05 O ATOM 2097 CB PRO A 484 5.884 6.312 13.397 1.00 32.60 C ATOM 2098 CG PRO A 484 4.746 5.683 14.172 1.00 37.05 C ATOM 2099 CD PRO A 484 4.143 4.676 13.193 1.00 34.50 C ATOM 2100 N PRO A 485 7.157 7.190 10.471 1.00 39.72 N ATOM 2101 CA PRO A 485 8.273 7.031 9.529 1.00 42.10 C ATOM 2102 C PRO A 485 9.417 6.212 10.123 1.00 32.67 C ATOM 2103 O PRO A 485 9.791 6.454 11.263 1.00 34.30 O ATOM 2104 CB PRO A 485 8.697 8.476 9.239 1.00 42.20 C ATOM 2105 CG PRO A 485 8.118 9.284 10.326 1.00 45.43 C ATOM 2106 CD PRO A 485 6.840 8.602 10.723 1.00 42.79 C ATOM 2107 N GLU A 486 9.908 5.238 9.349 1.00 32.86 N ATOM 2108 CA GLU A 486 10.986 4.328 9.722 1.00 38.20 C ATOM 2109 C GLU A 486 10.579 3.296 10.776 1.00 38.53 C ATOM 2110 O GLU A 486 11.405 2.532 11.256 1.00 39.01 O ATOM 2111 CB GLU A 486 12.201 5.108 10.230 1.00 42.68 C ATOM 2112 CG GLU A 486 12.894 5.970 9.184 1.00 53.05 C ATOM 2113 CD GLU A 486 14.150 6.638 9.727 1.00 59.80 C ATOM 2114 OE1 GLU A 486 14.333 7.846 9.481 1.00 66.76 O ATOM 2115 OE2 GLU A 486 14.953 5.958 10.396 1.00 59.15 O ATOM 2116 H GLU A 486 9.488 5.120 8.405 1.00 0.00 H ATOM 2117 N CYS A 487 9.314 3.277 11.158 1.00 35.48 N ATOM 2118 CA CYS A 487 8.836 2.251 12.084 1.00 31.04 C ATOM 2119 C CYS A 487 8.416 1.009 11.292 1.00 29.75 C ATOM 2120 O CYS A 487 7.640 1.146 10.367 1.00 29.46 O ATOM 2121 CB CYS A 487 7.657 2.777 12.889 1.00 30.98 C ATOM 2122 SG CYS A 487 6.950 1.552 14.027 1.00 33.78 S ATOM 2123 H CYS A 487 8.654 3.996 10.798 1.00 0.00 H ATOM 2124 N PRO A 488 8.910 -0.194 11.654 1.00 31.15 N ATOM 2125 CA PRO A 488 8.516 -1.393 10.895 1.00 32.48 C ATOM 2126 C PRO A 488 7.017 -1.619 10.943 1.00 28.65 C ATOM 2127 O PRO A 488 6.381 -1.327 11.952 1.00 27.47 O ATOM 2128 CB PRO A 488 9.269 -2.522 11.592 1.00 36.11 C ATOM 2129 CG PRO A 488 10.493 -1.826 12.213 1.00 34.73 C ATOM 2130 CD PRO A 488 9.953 -0.487 12.655 1.00 31.69 C ATOM 2131 N GLU A 489 6.452 -2.102 9.852 1.00 23.78 N ATOM 2132 CA GLU A 489 5.021 -2.299 9.818 1.00 33.14 C ATOM 2133 C GLU A 489 4.575 -3.289 10.924 1.00 30.15 C ATOM 2134 O GLU A 489 3.496 -3.150 11.505 1.00 26.45 O ATOM 2135 CB GLU A 489 4.563 -2.781 8.444 1.00 39.98 C ATOM 2136 CG GLU A 489 3.057 -2.727 8.371 1.00 61.21 C ATOM 2137 CD GLU A 489 2.525 -1.291 8.422 1.00 69.99 C ATOM 2138 OE1 GLU A 489 3.259 -0.372 8.002 1.00 75.08 O ATOM 2139 OE2 GLU A 489 1.424 -1.066 8.976 1.00 69.83 O ATOM 2140 H GLU A 489 7.033 -2.339 9.023 1.00 0.00 H ATOM 2141 N SER A 490 5.412 -4.274 11.228 1.00 28.93 N ATOM 2142 CA SER A 490 5.068 -5.242 12.268 1.00 30.78 C ATOM 2143 C SER A 490 4.871 -4.583 13.635 1.00 29.64 C ATOM 2144 O SER A 490 4.073 -5.070 14.444 1.00 28.83 O ATOM 2145 CB SER A 490 6.140 -6.321 12.382 1.00 34.36 C ATOM 2146 OG SER A 490 7.378 -5.728 12.716 1.00 31.54 O ATOM 2147 HG SER A 490 8.071 -6.432 12.789 1.00 0.00 H ATOM 2148 H SER A 490 6.318 -4.357 10.723 1.00 0.00 H ATOM 2149 N LEU A 491 5.622 -3.520 13.932 1.00 28.63 N ATOM 2150 CA LEU A 491 5.427 -2.847 15.219 1.00 26.78 C ATOM 2151 C LEU A 491 4.165 -1.990 15.181 1.00 26.95 C ATOM 2152 O LEU A 491 3.466 -1.894 16.186 1.00 31.49 O ATOM 2153 CB LEU A 491 6.635 -1.999 15.614 1.00 29.50 C ATOM 2154 CG LEU A 491 6.626 -1.400 17.026 1.00 33.53 C ATOM 2155 CD1 LEU A 491 6.426 -2.490 18.091 1.00 33.76 C ATOM 2156 CD2 LEU A 491 7.890 -0.585 17.305 1.00 27.48 C ATOM 2157 H LEU A 491 6.336 -3.174 13.259 1.00 0.00 H ATOM 2158 N HIS A 492 3.876 -1.371 14.034 1.00 28.07 N ATOM 2159 CA HIS A 492 2.628 -0.636 13.848 1.00 32.01 C ATOM 2160 C HIS A 492 1.429 -1.583 13.908 1.00 35.01 C ATOM 2161 O HIS A 492 0.348 -1.190 14.356 1.00 33.99 O ATOM 2162 CB HIS A 492 2.605 0.115 12.511 1.00 36.52 C ATOM 2163 CG HIS A 492 1.311 0.831 12.251 1.00 40.55 C ATOM 2164 ND1 HIS A 492 0.452 0.475 11.236 1.00 37.93 N ATOM 2165 CD2 HIS A 492 0.720 1.869 12.896 1.00 37.25 C ATOM 2166 CE1 HIS A 492 -0.604 1.266 11.253 1.00 39.62 C ATOM 2167 NE2 HIS A 492 -0.468 2.120 12.252 1.00 36.88 N ATOM 2168 H HIS A 492 4.559 -1.413 13.251 1.00 0.00 H ATOM 2169 N ASP A 493 1.598 -2.817 13.428 1.00 36.23 N ATOM 2170 CA ASP A 493 0.521 -3.792 13.554 1.00 37.74 C ATOM 2171 C ASP A 493 0.229 -4.124 15.033 1.00 37.15 C ATOM 2172 O ASP A 493 -0.922 -4.443 15.395 1.00 29.10 O ATOM 2173 CB ASP A 493 0.838 -5.078 12.814 1.00 39.74 C ATOM 2174 CG ASP A 493 -0.126 -6.173 13.168 1.00 59.34 C ATOM 2175 OD1 ASP A 493 -1.274 -6.136 12.668 1.00 71.41 O ATOM 2176 OD2 ASP A 493 0.249 -7.050 13.976 1.00 70.28 O ATOM 2177 H ASP A 493 2.492 -3.081 12.967 1.00 0.00 H ATOM 2178 N LEU A 494 1.270 -4.128 15.858 1.00 29.80 N ATOM 2179 CA LEU A 494 1.081 -4.324 17.294 1.00 31.15 C ATOM 2180 C LEU A 494 0.267 -3.166 17.875 1.00 30.30 C ATOM 2181 O LEU A 494 -0.628 -3.381 18.682 1.00 32.83 O ATOM 2182 CB LEU A 494 2.423 -4.425 18.024 1.00 29.02 C ATOM 2183 CG LEU A 494 2.355 -4.886 19.493 1.00 30.02 C ATOM 2184 CD1 LEU A 494 2.029 -6.368 19.569 1.00 27.01 C ATOM 2185 CD2 LEU A 494 3.663 -4.605 20.190 1.00 30.85 C ATOM 2186 H LEU A 494 2.229 -3.990 15.479 1.00 0.00 H ATOM 2187 N MET A 495 0.557 -1.940 17.447 1.00 28.78 N ATOM 2188 CA MET A 495 -0.223 -0.770 17.892 1.00 28.11 C ATOM 2189 C MET A 495 -1.698 -0.937 17.553 1.00 30.64 C ATOM 2190 O MET A 495 -2.549 -0.646 18.383 1.00 31.98 O ATOM 2191 CB MET A 495 0.300 0.522 17.250 1.00 27.34 C ATOM 2192 CG MET A 495 1.777 0.832 17.565 1.00 23.45 C ATOM 2193 SD MET A 495 2.293 2.196 16.521 1.00 31.99 S ATOM 2194 CE MET A 495 4.038 2.332 16.927 1.00 30.49 C ATOM 2195 H MET A 495 1.349 -1.804 16.786 1.00 0.00 H ATOM 2196 N CYS A 496 -1.998 -1.396 16.326 1.00 25.62 N ATOM 2197 CA CYS A 496 -3.387 -1.533 15.873 1.00 31.75 C ATOM 2198 C CYS A 496 -4.167 -2.594 16.652 1.00 33.03 C ATOM 2199 O CYS A 496 -5.383 -2.492 16.790 1.00 40.16 O ATOM 2200 CB CYS A 496 -3.438 -1.841 14.359 1.00 36.25 C ATOM 2201 SG CYS A 496 -2.937 -0.419 13.348 1.00 46.17 S ATOM 2202 H CYS A 496 -1.226 -1.661 15.681 1.00 0.00 H ATOM 2203 N GLN A 497 -3.477 -3.629 17.120 1.00 29.06 N ATOM 2204 CA GLN A 497 -4.084 -4.620 18.001 1.00 33.65 C ATOM 2205 C GLN A 497 -4.481 -3.993 19.347 1.00 33.31 C ATOM 2206 O GLN A 497 -5.564 -4.254 19.873 1.00 31.64 O ATOM 2207 CB GLN A 497 -3.115 -5.765 18.249 1.00 32.29 C ATOM 2208 CG GLN A 497 -2.825 -6.589 16.985 1.00 46.68 C ATOM 2209 CD GLN A 497 -1.796 -7.665 17.241 1.00 56.68 C ATOM 2210 OE1 GLN A 497 -1.821 -8.344 18.272 1.00 65.73 O ATOM 2211 NE2 GLN A 497 -0.869 -7.814 16.312 1.00 61.49 N ATOM 2212 HE22 GLN A 497 -0.887 -7.219 15.459 1.00 0.00 H ATOM 2213 HE21 GLN A 497 -0.121 -8.526 16.434 1.00 0.00 H ATOM 2214 H GLN A 497 -2.478 -3.735 16.851 1.00 0.00 H ATOM 2215 N CYS A 498 -3.611 -3.142 19.862 1.00 28.63 N ATOM 2216 CA CYS A 498 -3.892 -2.423 21.101 1.00 30.26 C ATOM 2217 C CYS A 498 -5.065 -1.478 20.891 1.00 28.49 C ATOM 2218 O CYS A 498 -5.713 -1.074 21.851 1.00 32.52 O ATOM 2219 CB CYS A 498 -2.664 -1.627 21.561 1.00 27.74 C ATOM 2220 SG CYS A 498 -1.185 -2.610 22.052 1.00 30.62 S ATOM 2221 H CYS A 498 -2.707 -2.981 19.374 1.00 0.00 H ATOM 2222 N TRP A 499 -5.321 -1.104 19.629 1.00 26.90 N ATOM 2223 CA TRP A 499 -6.367 -0.123 19.334 1.00 29.79 C ATOM 2224 C TRP A 499 -7.624 -0.742 18.739 1.00 33.88 C ATOM 2225 O TRP A 499 -8.406 -0.066 18.064 1.00 36.15 O ATOM 2226 CB TRP A 499 -5.848 0.943 18.377 1.00 35.78 C ATOM 2227 CG TRP A 499 -4.677 1.733 18.890 1.00 32.62 C ATOM 2228 CD1 TRP A 499 -4.357 1.999 20.191 1.00 31.62 C ATOM 2229 CD2 TRP A 499 -3.667 2.340 18.094 1.00 29.17 C ATOM 2230 NE1 TRP A 499 -3.208 2.746 20.249 1.00 30.43 N ATOM 2231 CE2 TRP A 499 -2.760 2.963 18.970 1.00 29.79 C ATOM 2232 CE3 TRP A 499 -3.440 2.416 16.718 1.00 28.89 C ATOM 2233 CZ2 TRP A 499 -1.640 3.660 18.512 1.00 28.86 C ATOM 2234 CZ3 TRP A 499 -2.334 3.105 16.264 1.00 29.14 C ATOM 2235 CH2 TRP A 499 -1.446 3.708 17.150 1.00 27.96 C ATOM 2236 HE1 TRP A 499 -2.752 3.091 21.118 1.00 0.00 H ATOM 2237 H TRP A 499 -4.769 -1.516 18.850 1.00 0.00 H ATOM 2238 N ARG A 500 -7.808 -2.032 18.955 1.00 32.08 N ATOM 2239 CA ARG A 500 -9.029 -2.674 18.467 1.00 40.88 C ATOM 2240 C ARG A 500 -10.213 -2.072 19.195 1.00 40.08 C ATOM 2241 O ARG A 500 -10.147 -1.820 20.403 1.00 36.39 O ATOM 2242 CB ARG A 500 -8.970 -4.188 18.667 1.00 41.24 C ATOM 2243 CG ARG A 500 -8.111 -4.909 17.611 1.00 43.62 C ATOM 2244 CD ARG A 500 -7.776 -6.350 18.014 1.00 48.90 C ATOM 2245 NE ARG A 500 -7.055 -7.068 16.955 1.00 61.63 N ATOM 2246 CZ ARG A 500 -6.364 -8.191 17.141 1.00 61.06 C ATOM 2247 NH1 ARG A 500 -6.259 -8.716 18.353 1.00 61.34 N ATOM 2248 NH2 ARG A 500 -5.744 -8.771 16.121 1.00 60.84 N ATOM 2249 HE ARG A 500 -7.086 -6.672 15.994 1.00 0.00 H ATOM 2250 HH12 ARG A 500 -5.719 -9.593 18.495 1.00 0.00 H ATOM 2251 HH11 ARG A 500 -6.717 -8.251 19.163 1.00 0.00 H ATOM 2252 HH22 ARG A 500 -5.205 -9.648 16.271 1.00 0.00 H ATOM 2253 HH21 ARG A 500 -5.797 -8.349 15.172 1.00 0.00 H ATOM 2254 H ARG A 500 -7.092 -2.586 19.467 1.00 0.00 H ATOM 2255 N LYS A 501 -11.272 -1.792 18.439 1.00 38.08 N ATOM 2256 CA LYS A 501 -12.483 -1.213 18.983 1.00 41.00 C ATOM 2257 C LYS A 501 -13.030 -2.110 20.092 1.00 42.68 C ATOM 2258 O LYS A 501 -13.526 -1.626 21.094 1.00 41.20 O ATOM 2259 CB LYS A 501 -13.542 -1.013 17.888 1.00 41.57 C ATOM 2260 CG LYS A 501 -14.807 -0.313 18.380 1.00 49.25 C ATOM 2261 CD LYS A 501 -15.990 -0.561 17.452 1.00 63.64 C ATOM 2262 CE LYS A 501 -17.261 0.171 17.918 1.00 67.05 C ATOM 2263 NZ LYS A 501 -17.038 1.632 18.107 1.00 67.01 N ATOM 2264 HZ1 LYS A 501 -16.300 1.779 18.825 1.00 0.00 H ATOM 2265 HZ2 LYS A 501 -16.735 2.055 17.206 1.00 0.00 H ATOM 2266 HZ3 LYS A 501 -17.923 2.079 18.421 1.00 0.00 H ATOM 2267 H LYS A 501 -11.228 -1.996 17.420 1.00 0.00 H ATOM 2268 N ASP A 502 -12.972 -3.419 19.901 1.00 47.79 N ATOM 2269 CA ASP A 502 -13.447 -4.315 20.948 1.00 53.49 C ATOM 2270 C ASP A 502 -12.353 -4.597 21.988 1.00 46.57 C ATOM 2271 O ASP A 502 -11.409 -5.349 21.710 1.00 44.79 O ATOM 2272 CB ASP A 502 -13.962 -5.616 20.336 1.00 57.96 C ATOM 2273 CG ASP A 502 -14.736 -6.447 21.320 1.00 69.62 C ATOM 2274 OD1 ASP A 502 -14.485 -6.333 22.541 1.00 70.19 O ATOM 2275 OD2 ASP A 502 -15.638 -7.188 20.877 1.00 75.92 O ATOM 2276 H ASP A 502 -12.591 -3.804 19.013 1.00 0.00 H ATOM 2277 N PRO A 503 -12.528 -4.068 23.216 1.00 42.12 N ATOM 2278 CA PRO A 503 -11.505 -4.161 24.267 1.00 40.87 C ATOM 2279 C PRO A 503 -11.046 -5.594 24.536 1.00 39.16 C ATOM 2280 O PRO A 503 -9.864 -5.849 24.812 1.00 37.96 O ATOM 2281 CB PRO A 503 -12.215 -3.580 25.504 1.00 45.33 C ATOM 2282 CG PRO A 503 -13.328 -2.736 24.954 1.00 48.39 C ATOM 2283 CD PRO A 503 -13.775 -3.455 23.713 1.00 45.24 C ATOM 2284 N GLU A 504 -11.961 -6.537 24.402 1.00 38.51 N ATOM 2285 CA GLU A 504 -11.653 -7.929 24.707 1.00 44.98 C ATOM 2286 C GLU A 504 -10.733 -8.570 23.658 1.00 44.85 C ATOM 2287 O GLU A 504 -10.136 -9.612 23.920 1.00 41.63 O ATOM 2288 CB GLU A 504 -12.948 -8.737 24.799 1.00 57.18 C ATOM 2289 CG GLU A 504 -14.127 -7.918 25.304 1.00 73.46 C ATOM 2290 CD GLU A 504 -13.916 -7.314 26.690 1.00 86.67 C ATOM 2291 OE1 GLU A 504 -13.031 -7.784 27.442 1.00 88.70 O ATOM 2292 OE2 GLU A 504 -14.650 -6.358 27.036 1.00 94.69 O ATOM 2293 H GLU A 504 -12.915 -6.283 24.074 1.00 0.00 H ATOM 2294 N GLU A 505 -10.613 -7.931 22.491 1.00 44.92 N ATOM 2295 CA GLU A 505 -9.786 -8.414 21.367 1.00 42.19 C ATOM 2296 C GLU A 505 -8.347 -7.902 21.427 1.00 44.22 C ATOM 2297 O GLU A 505 -7.479 -8.349 20.657 1.00 42.30 O ATOM 2298 CB GLU A 505 -10.396 -7.990 20.033 1.00 46.70 C ATOM 2299 CG GLU A 505 -11.751 -8.629 19.727 1.00 63.13 C ATOM 2300 CD GLU A 505 -11.684 -10.140 19.647 1.00 71.40 C ATOM 2301 OE1 GLU A 505 -10.701 -10.662 19.081 1.00 76.39 O ATOM 2302 OE2 GLU A 505 -12.604 -10.814 20.151 1.00 75.45 O ATOM 2303 H GLU A 505 -11.134 -7.039 22.367 1.00 0.00 H ATOM 2304 N ARG A 506 -8.098 -6.950 22.316 1.00 38.72 N ATOM 2305 CA ARG A 506 -6.747 -6.417 22.479 1.00 36.55 C ATOM 2306 C ARG A 506 -5.867 -7.436 23.185 1.00 32.04 C ATOM 2307 O ARG A 506 -6.343 -8.228 23.995 1.00 35.69 O ATOM 2308 CB ARG A 506 -6.774 -5.093 23.263 1.00 32.76 C ATOM 2309 CG ARG A 506 -7.569 -3.978 22.572 1.00 32.47 C ATOM 2310 CD ARG A 506 -7.868 -2.784 23.518 1.00 30.48 C ATOM 2311 NE ARG A 506 -8.987 -2.018 22.985 1.00 30.37 N ATOM 2312 CZ ARG A 506 -9.748 -1.187 23.690 1.00 35.43 C ATOM 2313 NH1 ARG A 506 -9.502 -0.981 24.981 1.00 29.58 N ATOM 2314 NH2 ARG A 506 -10.779 -0.578 23.105 1.00 30.98 N ATOM 2315 HE ARG A 506 -9.207 -2.130 21.975 1.00 0.00 H ATOM 2316 HH12 ARG A 506 -10.101 -0.330 25.527 1.00 0.00 H ATOM 2317 HH11 ARG A 506 -8.710 -1.471 25.444 1.00 0.00 H ATOM 2318 HH22 ARG A 506 -11.377 0.073 23.653 1.00 0.00 H ATOM 2319 HH21 ARG A 506 -10.985 -0.754 22.101 1.00 0.00 H ATOM 2320 H ARG A 506 -8.872 -6.579 22.903 1.00 0.00 H ATOM 2321 N PRO A 507 -4.573 -7.438 22.871 1.00 31.29 N ATOM 2322 CA PRO A 507 -3.689 -8.401 23.526 1.00 28.65 C ATOM 2323 C PRO A 507 -3.513 -8.134 25.030 1.00 35.20 C ATOM 2324 O PRO A 507 -3.850 -7.043 25.525 1.00 34.05 O ATOM 2325 CB PRO A 507 -2.356 -8.194 22.789 1.00 30.55 C ATOM 2326 CG PRO A 507 -2.405 -6.794 22.341 1.00 33.01 C ATOM 2327 CD PRO A 507 -3.834 -6.521 21.982 1.00 29.22 C ATOM 2328 N THR A 508 -3.003 -9.126 25.752 1.00 30.10 N ATOM 2329 CA THR A 508 -2.648 -8.935 27.160 1.00 33.32 C ATOM 2330 C THR A 508 -1.279 -8.280 27.277 1.00 33.46 C ATOM 2331 O THR A 508 -0.477 -8.312 26.337 1.00 28.87 O ATOM 2332 CB THR A 508 -2.572 -10.260 27.917 1.00 35.03 C ATOM 2333 OG1 THR A 508 -1.486 -11.037 27.378 1.00 34.04 O ATOM 2334 CG2 THR A 508 -3.884 -11.045 27.795 1.00 39.18 C ATOM 2335 HG1 THR A 508 -1.427 -11.899 27.861 1.00 0.00 H ATOM 2336 H THR A 508 -2.853 -10.055 25.309 1.00 0.00 H ATOM 2337 N PHE A 509 -0.978 -7.723 28.442 1.00 31.17 N ATOM 2338 CA PHE A 509 0.363 -7.222 28.641 1.00 29.60 C ATOM 2339 C PHE A 509 1.351 -8.388 28.690 1.00 31.32 C ATOM 2340 O PHE A 509 2.497 -8.245 28.302 1.00 31.57 O ATOM 2341 CB PHE A 509 0.438 -6.378 29.917 1.00 29.02 C ATOM 2342 CG PHE A 509 -0.062 -4.979 29.726 1.00 25.46 C ATOM 2343 CD1 PHE A 509 0.651 -4.083 28.949 1.00 25.94 C ATOM 2344 CD2 PHE A 509 -1.247 -4.563 30.307 1.00 24.96 C ATOM 2345 CE1 PHE A 509 0.207 -2.785 28.759 1.00 28.55 C ATOM 2346 CE2 PHE A 509 -1.693 -3.235 30.135 1.00 24.20 C ATOM 2347 CZ PHE A 509 -0.968 -2.362 29.352 1.00 23.82 C ATOM 2348 H PHE A 509 -1.691 -7.648 29.196 1.00 0.00 H ATOM 2349 N GLU A 510 0.900 -9.544 29.154 1.00 31.18 N ATOM 2350 CA GLU A 510 1.753 -10.726 29.122 1.00 34.04 C ATOM 2351 C GLU A 510 2.196 -11.042 27.691 1.00 32.09 C ATOM 2352 O GLU A 510 3.383 -11.298 27.447 1.00 27.01 O ATOM 2353 CB GLU A 510 1.038 -11.940 29.706 1.00 41.02 C ATOM 2354 CG GLU A 510 1.850 -13.220 29.601 1.00 47.74 C ATOM 2355 CD GLU A 510 1.079 -14.423 30.109 1.00 67.27 C ATOM 2356 OE1 GLU A 510 1.696 -15.321 30.720 1.00 78.24 O ATOM 2357 OE2 GLU A 510 -0.150 -14.477 29.887 1.00 68.57 O ATOM 2358 H GLU A 510 -0.063 -9.608 29.541 1.00 0.00 H ATOM 2359 N TYR A 511 1.253 -11.007 26.748 1.00 29.60 N ATOM 2360 CA TYR A 511 1.585 -11.189 25.329 1.00 28.49 C ATOM 2361 C TYR A 511 2.523 -10.080 24.825 1.00 29.38 C ATOM 2362 O TYR A 511 3.512 -10.355 24.093 1.00 25.70 O ATOM 2363 CB TYR A 511 0.299 -11.224 24.470 1.00 24.36 C ATOM 2364 CG TYR A 511 0.550 -11.258 22.958 1.00 31.63 C ATOM 2365 CD1 TYR A 511 0.682 -12.473 22.266 1.00 36.80 C ATOM 2366 CD2 TYR A 511 0.695 -10.082 22.238 1.00 31.19 C ATOM 2367 CE1 TYR A 511 0.915 -12.499 20.895 1.00 37.92 C ATOM 2368 CE2 TYR A 511 0.934 -10.096 20.877 1.00 35.19 C ATOM 2369 CZ TYR A 511 1.046 -11.300 20.210 1.00 47.60 C ATOM 2370 OH TYR A 511 1.287 -11.281 18.847 1.00 52.49 O ATOM 2371 HH TYR A 511 1.342 -12.210 18.510 1.00 0.00 H ATOM 2372 H TYR A 511 0.263 -10.848 27.023 1.00 0.00 H ATOM 2373 N LEU A 512 2.206 -8.829 25.179 1.00 26.13 N ATOM 2374 CA LEU A 512 2.972 -7.683 24.706 1.00 22.62 C ATOM 2375 C LEU A 512 4.406 -7.776 25.187 1.00 28.58 C ATOM 2376 O LEU A 512 5.328 -7.521 24.430 1.00 22.41 O ATOM 2377 CB LEU A 512 2.351 -6.352 25.188 1.00 28.17 C ATOM 2378 CG LEU A 512 1.062 -5.875 24.514 1.00 30.82 C ATOM 2379 CD1 LEU A 512 0.394 -4.754 25.311 1.00 29.67 C ATOM 2380 CD2 LEU A 512 1.362 -5.416 23.070 1.00 29.23 C ATOM 2381 H LEU A 512 1.393 -8.671 25.807 1.00 0.00 H ATOM 2382 N GLN A 513 4.584 -8.153 26.454 1.00 24.26 N ATOM 2383 CA GLN A 513 5.929 -8.261 27.006 1.00 27.17 C ATOM 2384 C GLN A 513 6.763 -9.298 26.233 1.00 27.00 C ATOM 2385 O GLN A 513 7.919 -9.049 25.900 1.00 23.44 O ATOM 2386 CB GLN A 513 5.878 -8.647 28.486 1.00 23.09 C ATOM 2387 CG GLN A 513 7.270 -8.744 29.140 1.00 27.06 C ATOM 2388 CD GLN A 513 7.217 -9.339 30.545 1.00 32.40 C ATOM 2389 OE1 GLN A 513 6.167 -9.333 31.193 1.00 32.41 O ATOM 2390 NE2 GLN A 513 8.349 -9.882 31.008 1.00 31.52 N ATOM 2391 HE22 GLN A 513 9.211 -9.864 30.426 1.00 0.00 H ATOM 2392 HE21 GLN A 513 8.367 -10.322 31.950 1.00 0.00 H ATOM 2393 H GLN A 513 3.760 -8.371 27.050 1.00 0.00 H ATOM 2394 N ALA A 514 6.180 -10.457 25.957 1.00 24.47 N ATOM 2395 CA ALA A 514 6.900 -11.532 25.276 1.00 22.82 C ATOM 2396 C ALA A 514 7.247 -11.147 23.840 1.00 28.88 C ATOM 2397 O ALA A 514 8.365 -11.380 23.356 1.00 29.04 O ATOM 2398 CB ALA A 514 6.070 -12.809 25.296 1.00 23.91 C ATOM 2399 H ALA A 514 5.188 -10.605 26.231 1.00 0.00 H ATOM 2400 N PHE A 515 6.282 -10.523 23.171 1.00 31.20 N ATOM 2401 CA PHE A 515 6.447 -10.068 21.799 1.00 28.01 C ATOM 2402 C PHE A 515 7.585 -9.082 21.696 1.00 30.49 C ATOM 2403 O PHE A 515 8.428 -9.199 20.811 1.00 26.26 O ATOM 2404 CB PHE A 515 5.152 -9.431 21.300 1.00 29.01 C ATOM 2405 CG PHE A 515 5.219 -8.921 19.891 1.00 30.19 C ATOM 2406 CD1 PHE A 515 5.601 -7.614 19.638 1.00 34.57 C ATOM 2407 CD2 PHE A 515 4.874 -9.727 18.824 1.00 34.02 C ATOM 2408 CE1 PHE A 515 5.654 -7.135 18.338 1.00 36.15 C ATOM 2409 CE2 PHE A 515 4.915 -9.244 17.537 1.00 35.20 C ATOM 2410 CZ PHE A 515 5.312 -7.943 17.296 1.00 29.71 C ATOM 2411 H PHE A 515 5.373 -10.353 23.647 1.00 0.00 H ATOM 2412 N LEU A 516 7.613 -8.107 22.609 1.00 25.09 N ATOM 2413 CA LEU A 516 8.613 -7.053 22.538 1.00 22.70 C ATOM 2414 C LEU A 516 10.001 -7.555 22.951 1.00 23.46 C ATOM 2415 O LEU A 516 11.015 -7.119 22.375 1.00 21.70 O ATOM 2416 CB LEU A 516 8.195 -5.854 23.427 1.00 24.30 C ATOM 2417 CG LEU A 516 6.969 -5.090 22.882 1.00 23.77 C ATOM 2418 CD1 LEU A 516 6.339 -4.178 23.976 1.00 20.38 C ATOM 2419 CD2 LEU A 516 7.220 -4.339 21.571 1.00 22.79 C ATOM 2420 H LEU A 516 6.913 -8.102 23.378 1.00 0.00 H ATOM 2421 N GLU A 517 10.057 -8.461 23.939 1.00 22.60 N ATOM 2422 CA GLU A 517 11.342 -9.046 24.360 1.00 27.74 C ATOM 2423 C GLU A 517 12.009 -9.831 23.229 1.00 31.14 C ATOM 2424 O GLU A 517 13.238 -9.797 23.054 1.00 25.63 O ATOM 2425 CB GLU A 517 11.152 -9.980 25.565 1.00 22.46 C ATOM 2426 CG GLU A 517 10.902 -9.211 26.905 1.00 24.69 C ATOM 2427 CD GLU A 517 10.615 -10.138 28.064 1.00 29.94 C ATOM 2428 OE1 GLU A 517 10.490 -11.363 27.842 1.00 41.04 O ATOM 2429 OE2 GLU A 517 10.506 -9.645 29.203 1.00 35.06 O ATOM 2430 H GLU A 517 9.180 -8.755 24.415 1.00 0.00 H ATOM 2431 N ASP A 518 11.196 -10.554 22.472 1.00 23.88 N ATOM 2432 CA ASP A 518 11.712 -11.423 21.408 1.00 23.91 C ATOM 2433 C ASP A 518 11.784 -10.741 20.034 1.00 22.00 C ATOM 2434 O ASP A 518 12.130 -11.375 19.041 1.00 27.01 O ATOM 2435 CB ASP A 518 10.827 -12.670 21.290 1.00 21.79 C ATOM 2436 CG ASP A 518 10.981 -13.622 22.476 1.00 29.43 C ATOM 2437 OD1 ASP A 518 11.657 -13.261 23.473 1.00 30.25 O ATOM 2438 OD2 ASP A 518 10.409 -14.721 22.411 1.00 26.22 O ATOM 2439 H ASP A 518 10.170 -10.504 22.636 1.00 0.00 H ATOM 2440 N TYR A 519 11.424 -9.468 19.975 1.00 22.86 N ATOM 2441 CA TYR A 519 11.119 -8.782 18.704 1.00 23.58 C ATOM 2442 C TYR A 519 12.169 -8.931 17.609 1.00 25.20 C ATOM 2443 O TYR A 519 11.847 -9.234 16.440 1.00 27.13 O ATOM 2444 CB TYR A 519 10.884 -7.279 18.981 1.00 26.31 C ATOM 2445 CG TYR A 519 10.385 -6.496 17.773 1.00 23.94 C ATOM 2446 CD1 TYR A 519 9.087 -6.653 17.305 1.00 24.32 C ATOM 2447 CD2 TYR A 519 11.222 -5.629 17.099 1.00 22.33 C ATOM 2448 CE1 TYR A 519 8.623 -5.924 16.215 1.00 23.02 C ATOM 2449 CE2 TYR A 519 10.778 -4.888 16.013 1.00 26.02 C ATOM 2450 CZ TYR A 519 9.484 -5.050 15.568 1.00 25.49 C ATOM 2451 OH TYR A 519 9.056 -4.339 14.474 1.00 31.95 O ATOM 2452 HH TYR A 519 8.111 -4.566 14.283 1.00 0.00 H ATOM 2453 H TYR A 519 11.353 -8.929 20.861 1.00 0.00 H ATOM 2454 N PHE A 520 13.428 -8.727 17.960 1.00 23.86 N ATOM 2455 CA PHE A 520 14.452 -8.699 16.930 1.00 25.58 C ATOM 2456 C PHE A 520 14.953 -10.076 16.494 1.00 27.44 C ATOM 2457 O PHE A 520 15.749 -10.180 15.559 1.00 32.42 O ATOM 2458 CB PHE A 520 15.603 -7.804 17.409 1.00 23.84 C ATOM 2459 CG PHE A 520 15.221 -6.355 17.435 1.00 28.43 C ATOM 2460 CD1 PHE A 520 15.188 -5.617 16.248 1.00 28.18 C ATOM 2461 CD2 PHE A 520 14.832 -5.735 18.617 1.00 28.36 C ATOM 2462 CE1 PHE A 520 14.804 -4.288 16.238 1.00 23.17 C ATOM 2463 CE2 PHE A 520 14.431 -4.387 18.609 1.00 29.69 C ATOM 2464 CZ PHE A 520 14.434 -3.663 17.417 1.00 25.93 C ATOM 2465 H PHE A 520 13.681 -8.589 18.959 1.00 0.00 H ATOM 2466 N THR A 521 14.437 -11.142 17.095 1.00 25.52 N ATOM 2467 CA THR A 521 14.758 -12.486 16.601 1.00 31.66 C ATOM 2468 C THR A 521 13.531 -13.082 15.914 1.00 34.17 C ATOM 2469 O THR A 521 13.605 -13.577 14.800 1.00 36.17 O ATOM 2470 CB THR A 521 15.214 -13.432 17.729 1.00 32.79 C ATOM 2471 OG1 THR A 521 16.414 -12.924 18.323 1.00 38.13 O ATOM 2472 CG2 THR A 521 15.445 -14.828 17.198 1.00 29.61 C ATOM 2473 HG1 THR A 521 16.706 -13.533 19.047 1.00 0.00 H ATOM 2474 H THR A 521 13.807 -11.025 17.914 1.00 0.00 H ATOM 2475 N SER A 522 12.387 -12.998 16.579 1.00 29.50 N ATOM 2476 CA SER A 522 11.180 -13.647 16.075 1.00 32.41 C ATOM 2477 C SER A 522 10.362 -12.846 15.031 1.00 36.78 C ATOM 2478 O SER A 522 9.697 -13.438 14.170 1.00 33.19 O ATOM 2479 CB SER A 522 10.255 -13.992 17.255 1.00 25.85 C ATOM 2480 OG SER A 522 10.874 -14.870 18.185 1.00 29.81 O ATOM 2481 HG SER A 522 10.244 -15.063 18.924 1.00 0.00 H ATOM 2482 H SER A 522 12.349 -12.463 17.470 1.00 0.00 H ATOM 2483 N THR A 523 10.407 -11.523 15.097 1.00 31.03 N ATOM 2484 CA THR A 523 9.515 -10.702 14.282 1.00 30.88 C ATOM 2485 C THR A 523 10.246 -9.849 13.245 1.00 32.75 C ATOM 2486 O THR A 523 9.829 -9.811 12.084 1.00 34.40 O ATOM 2487 CB THR A 523 8.645 -9.806 15.180 1.00 27.00 C ATOM 2488 OG1 THR A 523 8.022 -10.633 16.167 1.00 26.42 O ATOM 2489 CG2 THR A 523 7.558 -9.120 14.335 1.00 24.73 C ATOM 2490 HG1 THR A 523 7.460 -11.314 15.719 1.00 0.00 H ATOM 2491 H THR A 523 11.086 -11.064 15.737 1.00 0.00 H ATOM 2492 N GLU A 524 11.343 -9.192 13.633 1.00 30.28 N ATOM 2493 CA GLU A 524 12.173 -8.465 12.652 1.00 29.04 C ATOM 2494 C GLU A 524 13.627 -8.933 12.662 1.00 28.91 C ATOM 2495 O GLU A 524 14.523 -8.174 13.069 1.00 30.59 O ATOM 2496 CB GLU A 524 12.140 -6.946 12.909 1.00 28.37 C ATOM 2497 CG GLU A 524 10.779 -6.310 12.706 1.00 32.78 C ATOM 2498 CD GLU A 524 10.266 -6.408 11.277 1.00 41.35 C ATOM 2499 OE1 GLU A 524 11.083 -6.429 10.337 1.00 41.61 O ATOM 2500 OE2 GLU A 524 9.031 -6.495 11.101 1.00 44.08 O ATOM 2501 H GLU A 524 11.615 -9.193 14.637 1.00 0.00 H ATOM 2502 N PRO A 525 13.885 -10.186 12.217 1.00 33.12 N ATOM 2503 CA PRO A 525 15.276 -10.628 12.216 1.00 31.60 C ATOM 2504 C PRO A 525 16.104 -9.913 11.157 1.00 34.78 C ATOM 2505 O PRO A 525 17.321 -10.063 11.199 1.00 36.82 O ATOM 2506 CB PRO A 525 15.174 -12.134 11.899 1.00 34.65 C ATOM 2507 CG PRO A 525 13.916 -12.263 11.131 1.00 36.55 C ATOM 2508 CD PRO A 525 12.973 -11.242 11.728 1.00 30.69 C ATOM 2509 N GLN A 526 15.490 -9.180 10.220 1.00 31.58 N ATOM 2510 CA GLN A 526 16.311 -8.495 9.217 1.00 41.96 C ATOM 2511 C GLN A 526 16.347 -6.984 9.442 1.00 37.85 C ATOM 2512 O GLN A 526 16.730 -6.236 8.557 1.00 35.89 O ATOM 2513 CB GLN A 526 15.794 -8.798 7.813 1.00 52.76 C ATOM 2514 CG GLN A 526 15.525 -10.269 7.659 1.00 62.14 C ATOM 2515 CD GLN A 526 16.765 -11.076 7.880 1.00 69.99 C ATOM 2516 OE1 GLN A 526 17.888 -10.568 7.771 1.00 77.19 O ATOM 2517 NE2 GLN A 526 16.579 -12.319 8.300 1.00 69.52 N ATOM 2518 HE22 GLN A 526 15.616 -12.704 8.376 1.00 0.00 H ATOM 2519 HE21 GLN A 526 17.396 -12.910 8.554 1.00 0.00 H ATOM 2520 H GLN A 526 14.453 -9.098 10.204 1.00 0.00 H ATOM 2521 N TYR A 527 16.016 -6.547 10.653 1.00 31.50 N ATOM 2522 CA TYR A 527 16.075 -5.122 10.971 1.00 34.44 C ATOM 2523 C TYR A 527 17.460 -4.550 10.637 1.00 36.64 C ATOM 2524 O TYR A 527 18.484 -5.154 10.950 1.00 38.16 O ATOM 2525 CB TYR A 527 15.759 -4.890 12.462 1.00 29.60 C ATOM 2526 CG TYR A 527 16.216 -3.541 12.976 1.00 33.11 C ATOM 2527 CD1 TYR A 527 15.436 -2.408 12.795 1.00 30.43 C ATOM 2528 CD2 TYR A 527 17.444 -3.401 13.616 1.00 35.34 C ATOM 2529 CE1 TYR A 527 15.852 -1.167 13.254 1.00 28.02 C ATOM 2530 CE2 TYR A 527 17.881 -2.167 14.067 1.00 37.58 C ATOM 2531 CZ TYR A 527 17.080 -1.054 13.889 1.00 35.27 C ATOM 2532 OH TYR A 527 17.516 0.165 14.354 1.00 31.92 O ATOM 2533 HH TYR A 527 16.837 0.856 14.152 1.00 0.00 H ATOM 2534 H TYR A 527 15.712 -7.225 11.381 1.00 0.00 H ATOM 2535 N GLN A 528 17.491 -3.381 10.010 1.00 36.27 N ATOM 2536 CA GLN A 528 18.749 -2.634 9.897 1.00 41.16 C ATOM 2537 C GLN A 528 18.555 -1.191 10.354 1.00 40.49 C ATOM 2538 O GLN A 528 17.523 -0.595 10.084 1.00 33.97 O ATOM 2539 CB GLN A 528 19.285 -2.650 8.453 1.00 50.12 C ATOM 2540 CG GLN A 528 19.769 -4.004 7.916 1.00 67.44 C ATOM 2541 CD GLN A 528 20.938 -4.595 8.713 1.00 79.49 C ATOM 2542 OE1 GLN A 528 21.836 -3.871 9.151 1.00 82.15 O ATOM 2543 NE2 GLN A 528 20.955 -5.921 8.853 1.00 80.07 N ATOM 2544 HE22 GLN A 528 20.177 -6.495 8.468 1.00 0.00 H ATOM 2545 HE21 GLN A 528 21.746 -6.382 9.347 1.00 0.00 H ATOM 2546 H GLN A 528 16.619 -2.992 9.597 1.00 0.00 H ATOM 2547 N PRO A 529 19.562 -0.626 11.041 1.00 44.29 N ATOM 2548 CA PRO A 529 19.440 0.737 11.571 1.00 42.55 C ATOM 2549 C PRO A 529 19.246 1.785 10.478 1.00 40.85 C ATOM 2550 O PRO A 529 19.785 1.669 9.382 1.00 40.85 O ATOM 2551 CB PRO A 529 20.769 0.952 12.310 1.00 47.52 C ATOM 2552 CG PRO A 529 21.688 -0.096 11.798 1.00 54.16 C ATOM 2553 CD PRO A 529 20.821 -1.268 11.451 1.00 47.92 C ATOM 2554 N GLY A 530 18.418 2.783 10.768 1.00 40.02 N ATOM 2555 CA GLY A 530 18.205 3.902 9.863 1.00 43.42 C ATOM 2556 C GLY A 530 18.680 5.210 10.475 1.00 45.09 C ATOM 2557 O GLY A 530 19.433 5.213 11.455 1.00 44.05 O ATOM 2558 H GLY A 530 17.905 2.764 11.672 1.00 0.00 H ATOM 2559 N GLU A 531 18.206 6.325 9.926 1.00 47.64 N ATOM 2560 CA GLU A 531 18.634 7.639 10.390 1.00 46.31 C ATOM 2561 C GLU A 531 18.032 8.016 11.738 1.00 42.94 C ATOM 2562 O GLU A 531 18.722 8.585 12.575 1.00 42.81 O ATOM 2563 CB GLU A 531 18.273 8.699 9.349 1.00 51.74 C ATOM 2564 CG GLU A 531 19.105 8.609 8.096 1.00 69.36 C ATOM 2565 CD GLU A 531 20.581 8.839 8.368 1.00 81.46 C ATOM 2566 OE1 GLU A 531 20.901 9.762 9.153 1.00 79.47 O ATOM 2567 OE2 GLU A 531 21.413 8.082 7.818 1.00 88.34 O ATOM 2568 H GLU A 531 17.516 6.258 9.150 1.00 0.00 H ATOM 2569 N ASN A 532 16.781 7.629 11.974 1.00 30.81 N ATOM 2570 CA ASN A 532 16.106 7.967 13.212 1.00 35.92 C ATOM 2571 C ASN A 532 15.688 6.769 14.050 1.00 39.19 C ATOM 2572 O ASN A 532 15.651 6.869 15.282 1.00 35.10 O ATOM 2573 CB ASN A 532 14.877 8.826 12.909 1.00 41.51 C ATOM 2574 CG ASN A 532 15.249 10.143 12.265 1.00 46.07 C ATOM 2575 OD1 ASN A 532 15.665 11.078 12.947 1.00 48.58 O ATOM 2576 ND2 ASN A 532 15.156 10.206 10.939 1.00 40.51 N ATOM 2577 HD22 ASN A 532 14.798 9.390 10.403 1.00 0.00 H ATOM 2578 HD21 ASN A 532 15.441 11.072 10.438 1.00 0.00 H ATOM 2579 H ASN A 532 16.276 7.072 11.255 1.00 0.00 H ATOM 2580 N LEU A 533 15.333 5.663 13.390 1.00 36.80 N ATOM 2581 CA LEU A 533 14.943 4.424 14.079 1.00 36.48 C ATOM 2582 C LEU A 533 15.781 3.219 13.627 1.00 40.02 C ATOM 2583 O LEU A 533 16.056 2.302 14.405 1.00 32.41 O ATOM 2584 CB LEU A 533 13.470 4.119 13.849 1.00 31.15 C ATOM 2585 CG LEU A 533 12.501 5.079 14.511 1.00 33.31 C ATOM 2586 CD1 LEU A 533 11.042 4.699 14.182 1.00 30.67 C ATOM 2587 CD2 LEU A 533 12.741 4.986 16.014 1.00 33.20 C ATOM 2588 OXT LEU A 533 16.206 3.128 12.480 1.00 47.75 O ATOM 2589 H LEU A 533 15.332 5.679 12.350 1.00 0.00 H TER 2590 LEU A 533 HETATM 2591 MG MG A 1 4.105 12.971 35.703 1.00 74.43 MG HETATM 2592 O HOH 2 7.188 19.158 13.650 1.00 41.35 O HETATM 2593 O HOH 3 -2.827 14.428 12.595 1.00 56.55 O HETATM 2594 O HOH 4 -10.931 23.115 20.247 1.00 61.16 O HETATM 2595 O HOH 5 -20.666 4.455 21.690 1.00 51.84 O HETATM 2596 O HOH 6 0.976 -8.755 16.712 1.00 45.96 O HETATM 2597 O HOH 7 -1.580 -13.884 28.433 1.00 56.54 O HETATM 2598 O HOH 8 13.945 12.988 31.610 1.00 54.53 O HETATM 2599 O HOH 9 -0.196 -10.388 32.879 1.00 43.40 O HETATM 2600 O HOH 10 14.869 7.232 58.604 1.00 56.25 O HETATM 2601 O HOH 11 24.139 14.889 46.857 1.00 71.27 O HETATM 2602 O HOH 12 24.441 8.439 34.135 1.00 66.92 O HETATM 2603 O HOH 13 -15.536 -8.767 22.556 1.00 55.92 O HETATM 2604 O HOH 14 -2.955 16.406 18.968 1.00 49.93 O HETATM 2605 O HOH 15 8.323 17.357 28.189 1.00 49.54 O HETATM 2606 O HOH 16 -9.811 -10.861 25.873 1.00 54.51 O HETATM 2607 O HOH 17 -15.066 2.682 19.690 1.00 64.06 O HETATM 2608 O HOH 18 -12.025 -1.218 28.982 1.00 38.51 O HETATM 2609 O HOH 19 15.720 1.303 10.836 1.00 42.77 O HETATM 2610 O HOH 20 11.966 15.140 33.616 1.00 43.68 O HETATM 2611 O HOH 21 13.187 -8.434 9.471 1.00 38.35 O HETATM 2612 O HOH 22 9.287 -15.415 20.153 1.00 24.70 O HETATM 2613 O HOH 23 -5.128 -8.082 29.367 1.00 41.62 O HETATM 2614 O HOH 24 17.126 5.764 44.821 1.00 48.78 O HETATM 2615 O HOH 25 11.273 -0.653 41.474 1.00 37.50 O HETATM 2616 O HOH 26 -17.718 13.463 11.743 1.00 62.79 O HETATM 2617 O HOH 27 -3.244 17.420 23.678 1.00 45.36 O HETATM 2618 O HOH 28 18.608 -14.269 18.968 1.00 46.52 O HETATM 2619 O HOH 29 2.078 14.195 27.722 1.00 28.92 O HETATM 2620 O HOH 30 -8.723 8.110 22.220 1.00 33.01 O HETATM 2621 O HOH 31 8.337 8.921 42.049 1.00 55.31 O HETATM 2622 O HOH 32 -7.194 2.623 31.360 1.00 32.53 O HETATM 2623 O HOH 33 9.429 12.629 15.450 1.00 46.91 O HETATM 2624 O HOH 34 17.170 13.378 26.649 1.00 35.47 O HETATM 2625 O HOH 35 -11.686 0.829 36.891 1.00 58.31 O HETATM 2626 O HOH 36 2.727 -7.868 14.628 1.00 48.14 O HETATM 2627 O HOH 37 7.337 10.648 34.926 1.00 43.54 O HETATM 2628 O HOH 38 0.451 0.808 7.304 1.00 55.60 O HETATM 2629 O HOH 39 8.401 -11.137 18.789 1.00 23.95 O HETATM 2630 O HOH 40 -2.876 11.382 13.266 1.00 40.77 O HETATM 2631 O HOH 41 5.934 1.147 45.788 1.00 44.39 O HETATM 2632 O HOH 42 15.295 11.128 15.624 1.00 50.55 O HETATM 2633 O HOH 43 -16.035 -4.082 27.499 1.00 59.41 O HETATM 2634 O HOH 44 -6.334 7.378 21.356 1.00 31.45 O HETATM 2635 O HOH 45 9.825 18.354 21.007 1.00 58.70 O HETATM 2636 O HOH 46 18.258 6.413 39.080 1.00 37.79 O HETATM 2637 O HOH 47 10.425 15.154 19.717 1.00 39.68 O HETATM 2638 O HOH 48 3.896 -12.571 22.548 1.00 34.38 O HETATM 2639 O HOH 49 -5.122 5.679 43.264 1.00 60.86 O HETATM 2640 O HOH 50 7.453 -5.154 9.322 1.00 32.95 O HETATM 2641 O HOH 51 6.176 10.535 40.011 1.00 63.20 O HETATM 2642 O HOH 52 -6.958 -0.704 15.451 1.00 45.87 O HETATM 2643 O HOH 53 3.194 -8.620 44.736 1.00 52.44 O HETATM 2644 O HOH 54 4.593 -11.514 31.814 1.00 37.03 O HETATM 2645 O HOH 55 3.259 10.185 19.063 1.00 27.08 O HETATM 2646 O HOH 56 0.333 12.525 36.243 1.00 58.48 O HETATM 2647 O HOH 57 -12.033 8.300 39.552 1.00 61.77 O HETATM 2648 O HOH 58 3.584 12.855 23.463 1.00 30.04 O HETATM 2649 O HOH 59 -7.456 -11.101 26.773 1.00 44.66 O HETATM 2650 O HOH 60 -4.127 4.214 30.992 1.00 30.34 O HETATM 2651 O HOH 61 6.039 -8.873 34.708 1.00 38.92 O HETATM 2652 O HOH 62 12.706 16.811 20.339 1.00 41.28 O HETATM 2653 O HOH 63 -2.711 6.347 38.031 1.00 36.58 O HETATM 2654 O HOH 64 8.450 -12.692 29.207 1.00 37.48 O HETATM 2655 O HOH 65 10.880 -6.912 29.637 1.00 33.58 O HETATM 2656 O HOH 66 10.301 -6.589 7.659 1.00 48.43 O HETATM 2657 O HOH 67 18.815 4.161 37.903 1.00 44.33 O HETATM 2658 O HOH 68 13.363 -5.903 23.310 1.00 36.15 O HETATM 2659 O HOH 69 7.025 -14.140 14.681 1.00 45.22 O HETATM 2660 O HOH 70 11.122 -7.683 33.865 1.00 41.14 O HETATM 2661 O HOH 71 8.991 8.006 13.469 1.00 47.57 O HETATM 2662 O HOH 72 7.456 -1.113 42.950 1.00 39.54 O HETATM 2663 O HOH 73 -1.010 4.448 65.970 1.00 67.95 O HETATM 2664 O HOH 74 14.543 -9.015 20.665 1.00 24.18 O HETATM 2665 O HOH 75 13.467 17.418 27.181 1.00 34.88 O HETATM 2666 O HOH 76 19.273 -7.664 12.019 1.00 50.38 O HETATM 2667 O HOH 77 19.398 12.609 54.689 1.00 51.04 O HETATM 2668 O HOH 78 12.693 -15.752 13.213 1.00 26.83 O HETATM 2669 O HOH 79 15.313 -4.611 21.964 1.00 31.49 O HETATM 2670 O HOH 80 15.098 -2.479 8.748 1.00 46.42 O HETATM 2671 O HOH 81 2.450 -11.871 33.158 1.00 42.31 O HETATM 2672 O HOH 82 12.712 -16.956 17.501 1.00 24.83 O HETATM 2673 O HOH 83 -7.131 4.339 28.679 1.00 39.05 O HETATM 2674 O HOH 84 15.126 -8.747 24.942 1.00 39.54 O HETATM 2675 O HOH 85 16.053 12.483 9.441 1.00 57.86 O HETATM 2676 O HOH 86 6.797 14.825 31.796 1.00 39.67 O HETATM 2677 O HOH 87 5.675 -11.885 15.060 1.00 36.25 O HETATM 2678 O HOH 88 0.289 3.412 7.866 1.00 38.17 O HETATM 2679 O HOH 89 -4.617 5.592 16.743 1.00 29.63 O HETATM 2680 O HOH 90 2.808 11.505 27.742 1.00 24.47 O HETATM 2681 O HOH 91 20.126 0.343 15.602 1.00 34.69 O HETATM 2682 O HOH 92 -7.057 -9.614 43.137 1.00 65.04 O HETATM 2683 O HOH 93 -3.095 10.368 8.734 1.00 53.89 O HETATM 2684 O HOH 94 -8.651 11.798 8.838 1.00 61.07 O HETATM 2685 O HOH 95 21.050 0.164 18.456 1.00 50.04 O HETATM 2686 O HOH 96 9.990 -7.708 40.335 1.00 51.37 O HETATM 2687 O HOH 97 5.438 -12.510 29.150 1.00 29.49 O HETATM 2688 O HOH 98 -21.553 7.958 29.407 1.00 46.35 O HETATM 2689 O HOH 99 -9.404 -5.199 34.063 1.00 50.39 O HETATM 2690 O HOH 100 20.148 5.921 31.024 1.00 36.79 O HETATM 2691 O HOH 101 11.704 8.748 15.099 1.00 35.81 O HETATM 2692 O HOH 102 -5.961 14.586 24.792 1.00 50.56 O HETATM 2693 O HOH 103 17.391 -8.106 14.161 1.00 53.87 O HETATM 2694 O HOH 104 24.298 8.690 31.706 1.00 48.65 O HETATM 2695 O HOH 105 14.068 -6.664 25.841 1.00 36.73 O HETATM 2696 O HOH 106 -6.321 6.661 29.915 1.00 41.50 O HETATM 2697 O HOH 107 8.824 15.196 14.710 1.00 36.46 O HETATM 2698 O HOH 108 -7.398 4.906 9.875 1.00 47.37 O HETATM 2699 O HOH 109 -3.389 7.649 29.864 1.00 36.61 O HETATM 2700 O HOH 110 8.378 -10.189 36.714 1.00 59.64 O HETATM 2701 O HOH 111 5.863 5.019 7.492 1.00 50.75 O HETATM 2702 O HOH 112 -11.061 -2.235 15.420 1.00 45.54 O HETATM 2703 O HOH 113 -4.329 6.532 8.934 1.00 47.33 O HETATM 2704 O HOH 114 23.422 -3.593 30.515 1.00 66.83 O HETATM 2705 O HOH 115 7.111 -8.836 42.058 1.00 63.03 O HETATM 2706 O HOH 116 3.294 -12.440 16.809 1.00 48.27 O HETATM 2707 O HOH 117 -13.436 2.452 17.620 1.00 47.51 O HETATM 2708 O HOH 118 2.385 8.148 13.376 1.00 60.59 O HETATM 2709 O HOH 119 -2.990 15.728 28.287 1.00 51.73 O HETATM 2710 O HOH 120 14.925 0.011 44.696 1.00 66.04 O HETATM 2711 O HOH 121 8.516 -10.952 33.963 1.00 45.05 O HETATM 2712 O HOH 122 11.766 1.009 52.481 1.00 62.74 O HETATM 2713 O HOH 123 -3.057 -11.816 24.056 1.00 36.76 O HETATM 2714 O HOH 124 -3.545 2.812 10.644 1.00 48.96 O HETATM 2715 O HOH 125 14.744 -14.804 9.173 1.00 40.85 O HETATM 2716 O HOH 126 16.737 14.411 37.142 1.00 67.33 O HETATM 2717 O HOH 127 2.548 11.505 16.633 1.00 35.37 O HETATM 2718 O HOH 128 14.563 14.088 37.233 1.00 47.77 O HETATM 2719 O HOH 129 -12.183 -5.636 29.815 1.00 53.32 O HETATM 2720 O HOH 130 -14.311 1.551 21.634 1.00 56.53 O HETATM 2721 O HOH 131 5.575 -11.043 40.482 1.00 50.03 O HETATM 2722 O HOH 132 -2.515 5.625 65.087 1.00 70.81 O HETATM 2723 O HOH 133 4.319 15.392 15.390 1.00 36.77 O HETATM 2724 O HOH 134 -1.044 19.028 17.971 1.00 42.13 O HETATM 2725 O HOH 135 10.441 -15.396 11.530 1.00 41.16 O HETATM 2726 O HOH 136 3.406 14.831 34.142 1.00 54.21 O HETATM 2727 O HOH 137 13.292 -0.279 10.813 1.00 68.93 O HETATM 2728 O HOH 138 -1.120 19.123 19.854 1.00 49.25 O HETATM 2729 O HOH 139 13.075 -7.159 28.675 1.00 44.56 O HETATM 2730 O HOH 140 4.880 -15.029 29.033 1.00 42.97 O HETATM 2731 O HOH 141 11.742 -2.888 43.880 1.00 60.47 O HETATM 2732 O HOH 142 2.536 -14.794 34.228 1.00 64.29 O HETATM 2733 O HOH 143 2.391 -16.156 27.233 1.00 53.37 O HETATM 2734 O HOH 144 -14.123 -3.219 29.091 1.00 49.64 O HETATM 2735 O HOH 145 -22.654 -0.977 25.156 1.00 54.84 O HETATM 2736 O HOH 146 -10.365 -6.506 31.146 1.00 58.33 O HETATM 2737 O HOH 147 -9.445 -1.392 14.501 1.00 58.78 O HETATM 2738 O HOH 148 21.597 -2.439 19.211 1.00 63.72 O HETATM 2739 O HOH 149 -2.542 -14.342 25.429 1.00 59.11 O HETATM 2740 O HOH 150 6.492 -13.065 33.654 1.00 54.06 O HETATM 2741 O HOH 151 13.214 -0.649 45.250 1.00 66.93 O HETATM 2742 O HOH 152 3.509 -8.857 12.279 1.00 67.15 O HETATM 2743 O HOH 153 11.641 -7.546 42.649 1.00 61.96 O HETATM 2744 O HOH 154 0.234 16.276 31.598 1.00 58.42 O HETATM 2745 O HOH 155 1.261 -14.977 25.228 1.00 60.53 O HETATM 2746 O HOH 156 5.334 -6.970 7.930 1.00 55.37 O HETATM 2747 O HOH 157 -4.430 16.262 26.219 1.00 59.44 O HETATM 2748 O HOH 158 16.136 0.979 50.070 1.00 66.53 O HETATM 2749 O HOH 159 21.727 -3.669 13.521 1.00 64.62 O HETATM 2750 O HOH 160 -9.503 24.048 18.021 1.00 51.35 O HETATM 2751 O HOH 161 4.200 12.525 15.119 1.00 38.31 O HETATM 2752 O HOH 162 8.566 10.821 13.582 1.00 52.20 O HETATM 2753 O HOH 163 -15.924 -3.358 31.073 1.00 54.07 O HETATM 2754 O HOH 164 3.861 9.722 12.407 1.00 53.50 O HETATM 2755 O HOH 165 4.611 -10.600 13.272 1.00 70.35 O HETATM 2756 O HOH 166 10.630 20.641 29.653 1.00 65.83 O HETATM 2757 O HOH 167 -7.535 -9.404 31.154 1.00 56.53 O HETATM 2758 O HOH 168 -7.130 -9.724 33.475 1.00 56.25 O HETATM 2759 O HOH 169 13.782 18.808 29.170 1.00 58.65 O HETATM 2760 O HOH 170 16.835 15.948 34.343 1.00 66.02 O HETATM 2761 O HOH 171 1.973 10.382 14.781 1.00 55.18 O HETATM 2762 O HOH 172 -5.897 -0.271 12.394 1.00 43.92 O HETATM 2763 O HOH 173 21.821 -2.125 15.766 1.00 55.30 O HETATM 2764 O HOH 174 17.005 -6.898 21.129 1.00 46.51 O HETATM 2765 O HOH 175 19.151 -6.283 16.088 1.00 57.46 O HETATM 2766 O HOH 176 4.646 -11.203 42.564 1.00 60.62 O HETATM 2767 PB MOL A 177 2.422 14.853 38.592 1.00 0.10 P HETATM 2768 O1B MOL A 177 2.302 14.164 37.291 1.00 -0.56 O HETATM 2769 O2B MOL A 177 1.323 15.854 38.563 1.00 -0.56 O HETATM 2770 O3B MOL A 177 1.986 13.854 39.589 1.00 -0.56 O HETATM 2771 C3A MOL A 177 4.071 15.565 38.925 1.00 0.19 C HETATM 2772 PA MOL A 177 5.348 14.283 38.699 1.00 0.15 P HETATM 2773 O1A MOL A 177 5.188 13.577 37.413 1.00 -0.62 O HETATM 2774 O2A MOL A 177 5.145 13.171 39.653 1.00 -0.62 O HETATM 2775 O5' MOL A 177 6.837 14.907 38.845 1.00 -0.27 O HETATM 2776 C5' MOL A 177 7.286 15.968 37.978 1.00 0.11 C HETATM 2777 C4' MOL A 177 8.740 15.795 37.649 1.00 0.12 C HETATM 2778 O4' MOL A 177 9.524 15.392 38.865 1.00 -0.34 O HETATM 2779 C1' MOL A 177 10.444 14.287 38.391 1.00 0.20 C HETATM 2780 C2' MOL A 177 10.171 14.055 36.967 1.00 0.14 C HETATM 2781 C3' MOL A 177 8.922 14.731 36.643 1.00 0.12 C HETATM 2782 O3' MOL A 177 8.976 15.295 35.299 1.00 -0.39 O HETATM 2783 H5 MOL A 177 9.705 15.901 35.240 1.00 0.21 H HETATM 2784 H4 MOL A 177 8.086 14.018 36.700 1.00 0.06 H HETATM 2785 O MOL A 177 11.258 14.623 36.166 1.00 -0.38 O HETATM 2786 H12 MOL A 177 11.082 14.473 35.245 1.00 0.21 H HETATM 2787 H6 MOL A 177 10.083 12.977 36.767 1.00 0.07 H HETATM 2788 N9 MOL A 177 10.245 13.117 39.128 1.00 -0.19 N HETATM 2789 C8 MOL A 177 9.064 12.787 39.492 1.00 0.11 C HETATM 2790 N7 MOL A 177 9.170 11.611 40.196 1.00 -0.30 N HETATM 2791 C5 MOL A 177 10.661 11.281 40.195 1.00 0.10 C HETATM 2792 C6 MOL A 177 11.481 10.275 40.694 1.00 0.13 C HETATM 2793 N6 MOL A 177 10.915 9.158 41.436 1.00 -0.32 N HETATM 2794 H9 MOL A 177 11.531 8.418 41.802 1.00 0.18 H HETATM 2795 H10 MOL A 177 9.899 9.108 41.596 1.00 0.18 H HETATM 2796 N1 MOL A 177 12.802 10.348 40.479 1.00 -0.27 N HETATM 2797 C2 MOL A 177 13.326 11.373 39.779 1.00 0.05 C HETATM 2798 N3 MOL A 177 12.594 12.380 39.255 1.00 -0.27 N HETATM 2799 C4 MOL A 177 11.261 12.389 39.431 1.00 0.16 C HETATM 2800 H11 MOL A 177 14.399 11.391 39.627 1.00 0.10 H HETATM 2801 H8 MOL A 177 8.146 13.335 39.283 1.00 0.13 H HETATM 2802 H7 MOL A 177 11.489 14.607 38.514 1.00 0.10 H HETATM 2803 H3 MOL A 177 9.131 16.745 37.257 1.00 0.07 H HETATM 2804 H1 MOL A 177 7.141 16.934 38.483 1.00 0.07 H HETATM 2805 H2 MOL A 177 6.699 15.949 37.048 1.00 0.07 H HETATM 2806 CL2 MOL A 177 4.134 16.150 40.554 1.00 -0.08 CL HETATM 2807 H13 MOL A 177 4.258 16.396 38.229 1.00 0.09 H CONECT 1 2 13 14 15 CONECT 13 1 CONECT 14 1 CONECT 15 1 CONECT 1430 1428 2591 CONECT 1500 1501 1511 1512 1513 CONECT 1511 1500 CONECT 1512 1500 CONECT 1513 1500 CONECT 2591 1430 CONECT 2767 2768 2769 2770 2771 CONECT 2768 2767 CONECT 2769 2767 CONECT 2770 2767 CONECT 2771 2767 2772 2806 2807 CONECT 2772 2771 2773 2774 2775 CONECT 2773 2772 CONECT 2774 2772 CONECT 2775 2772 2776 CONECT 2776 2775 2777 2804 2805 CONECT 2777 2776 2778 2781 2803 CONECT 2778 2777 2779 CONECT 2779 2778 2780 2788 2802 CONECT 2780 2779 2781 2785 2787 CONECT 2781 2777 2780 2782 2784 CONECT 2782 2781 2783 CONECT 2783 2782 CONECT 2784 2781 CONECT 2785 2780 2786 CONECT 2786 2785 CONECT 2787 2780 CONECT 2788 2779 2789 2799 CONECT 2789 2788 2790 2801 CONECT 2790 2789 2791 CONECT 2791 2790 2792 2799 CONECT 2792 2791 2793 2796 CONECT 2793 2792 2794 2795 CONECT 2794 2793 CONECT 2795 2793 CONECT 2796 2792 2797 CONECT 2797 2796 2798 2800 CONECT 2798 2797 2799 CONECT 2799 2788 2791 2798 CONECT 2800 2797 CONECT 2801 2789 CONECT 2802 2779 CONECT 2803 2777 CONECT 2804 2776 CONECT 2805 2776 CONECT 2806 2771 CONECT 2807 2771 MASTER 0 0 0 0 0 0 0 0 2805 2 51 21 END
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Related entries of code: 5xp7
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
1a07
RCSB PDB
PDBbind
107aa, >1A07_1|Chains... at 99%
1a08
RCSB PDB
PDBbind
107aa, >1A08_1|Chains... at 99%
1a09
RCSB PDB
PDBbind
107aa, >1A09_1|Chains... at 99%
1a1b
RCSB PDB
PDBbind
107aa, >1A1B_1|Chains... at 99%
1a1c
RCSB PDB
PDBbind
107aa, >1A1C_1|Chains... at 99%
1a1e
RCSB PDB
PDBbind
107aa, >1A1E_1|Chains... at 99%
1is0
RCSB PDB
PDBbind
106aa, >1IS0_1|Chains... at 97%
1nlp
RCSB PDB
PDBbind
64aa, >1NLP_1|Chain... at 93%
1nzl
RCSB PDB
PDBbind
103aa, >1NZL_1|Chains... at 97%
1nzv
RCSB PDB
PDBbind
103aa, >1NZV_1|Chains... at 97%
1o41
RCSB PDB
PDBbind
108aa, >1O41_1|Chain... at 100%
1o42
RCSB PDB
PDBbind
108aa, >1O42_1|Chain... at 100%
1o43
RCSB PDB
PDBbind
108aa, >1O43_1|Chain... at 100%
1o44
RCSB PDB
PDBbind
108aa, >1O44_1|Chain... at 100%
1o45
RCSB PDB
PDBbind
108aa, >1O45_1|Chain... at 100%
1o46
RCSB PDB
PDBbind
108aa, >1O46_1|Chain... at 100%
1o47
RCSB PDB
PDBbind
108aa, >1O47_1|Chain... at 100%
1o48
RCSB PDB
PDBbind
108aa, >1O48_1|Chain... at 100%
1o49
RCSB PDB
PDBbind
108aa, >1O49_1|Chain... at 100%
1o4a
RCSB PDB
PDBbind
108aa, >1O4A_1|Chain... at 100%
1o4b
RCSB PDB
PDBbind
108aa, >1O4B_1|Chain... at 100%
1o4d
RCSB PDB
PDBbind
108aa, >1O4D_1|Chain... at 100%
1o4e
RCSB PDB
PDBbind
108aa, >1O4E_1|Chain... at 100%
1o4f
RCSB PDB
PDBbind
108aa, >1O4F_1|Chain... at 100%
1o4g
RCSB PDB
PDBbind
108aa, >1O4G_1|Chain... at 100%
1o4h
RCSB PDB
PDBbind
108aa, >1O4H_1|Chain... at 100%
1o4i
RCSB PDB
PDBbind
108aa, >1O4I_1|Chain... at 100%
1o4j
RCSB PDB
PDBbind
108aa, >1O4J_1|Chain... at 100%
1o4k
RCSB PDB
PDBbind
108aa, >1O4K_1|Chain... at 100%
1o4l
RCSB PDB
PDBbind
108aa, >1O4L_1|Chain... at 100%
1o4m
RCSB PDB
PDBbind
108aa, >1O4M_1|Chain... at 100%
1o4n
RCSB PDB
PDBbind
108aa, >1O4N_1|Chain... at 100%
1o4o
RCSB PDB
PDBbind
108aa, >1O4O_1|Chain... at 100%
1o4p
RCSB PDB
PDBbind
108aa, >1O4P_1|Chain... at 100%
1o4q
RCSB PDB
PDBbind
108aa, >1O4Q_1|Chain... at 100%
1o4r
RCSB PDB
PDBbind
108aa, >1O4R_1|Chain... at 100%
1prl
RCSB PDB
PDBbind
64aa, >1PRL_1|Chain... at 96%
1prm
RCSB PDB
PDBbind
64aa, >1PRM_1|Chain... at 96%
1rlp
RCSB PDB
PDBbind
64aa, >1RLP_1|Chain... at 96%
1rlq
RCSB PDB
PDBbind
64aa, >1RLQ_1|Chain... at 96%
1shd
RCSB PDB
PDBbind
107aa, >1SHD_1|Chain... at 99%
1skj
RCSB PDB
PDBbind
113aa, >1SKJ_1|Chain... at 90%
1y57
RCSB PDB
PDBbind
452aa, >1Y57_1|Chain... at 99%
2bdf
RCSB PDB
PDBbind
279aa, >2BDF_1|Chains... at 100%
2bdj
RCSB PDB
PDBbind
279aa, >2BDJ_1|Chain... at 100%
2h8h
RCSB PDB
PDBbind
535aa, >2H8H_1|Chain... *
2hwo
RCSB PDB
PDBbind
286aa, >2HWO_1|Chains... at 97%
2hwp
RCSB PDB
PDBbind
286aa, >2HWP_1|Chains... at 97%
2oiq
RCSB PDB
PDBbind
286aa, >2OIQ_1|Chains... at 98%
2qlq
RCSB PDB
PDBbind
286aa, >2QLQ_1|Chains... at 97%
2qq7
RCSB PDB
PDBbind
286aa, >2QQ7_1|Chains... at 97%
3el7
RCSB PDB
PDBbind
286aa, >3EL7_1|Chain... at 98%
3el8
RCSB PDB
PDBbind
286aa, >3EL8_1|Chains... at 98%
3f3t
RCSB PDB
PDBbind
286aa, >3F3T_1|Chains... at 97%
3f3u
RCSB PDB
PDBbind
286aa, >3F3U_1|Chains... at 97%
3f3v
RCSB PDB
PDBbind
286aa, >3F3V_1|Chains... at 97%
3f3w
RCSB PDB
PDBbind
286aa, >3F3W_1|Chains... at 97%
3g5d
RCSB PDB
PDBbind
286aa, >3G5D_1|Chains... at 97%
3g6g
RCSB PDB
PDBbind
286aa, >3G6G_1|Chains... at 98%
3g6h
RCSB PDB
PDBbind
286aa, >3G6H_1|Chains... at 97%
3lok
RCSB PDB
PDBbind
286aa, >3LOK_1|Chains... at 97%
3svv
RCSB PDB
PDBbind
286aa, >3SVV_1|Chains... at 97%
3u4w
RCSB PDB
PDBbind
275aa, >3U4W_1|Chain... at 99%
3u51
RCSB PDB
PDBbind
275aa, >3U51_1|Chains... at 99%
3uqf
RCSB PDB
PDBbind
286aa, >3UQF_1|Chains... at 98%
3uqg
RCSB PDB
PDBbind
286aa, >3UQG_1|Chains... at 98%
4dgg
RCSB PDB
PDBbind
286aa, >4DGG_1|Chains... at 98%
4fic
RCSB PDB
PDBbind
286aa, >4FIC_1|Chains... at 98%
4hxj
RCSB PDB
PDBbind
60aa, >4HXJ_1|Chains... at 98%
4lgg
RCSB PDB
PDBbind
270aa, >4LGG_1|Chains... at 98%
4lgh
RCSB PDB
PDBbind
277aa, >4LGH_1|Chains... at 98%
4mcv
RCSB PDB
PDBbind
278aa, >4MCV_1|Chains... at 98%
4o2p
RCSB PDB
PDBbind
286aa, >4O2P_1|Chains... at 98%
4u5j
RCSB PDB
PDBbind
286aa, >4U5J_1|Chains... at 98%
4ybj
RCSB PDB
PDBbind
286aa, >4YBJ_1|Chains... at 98%
4ybk
RCSB PDB
PDBbind
286aa, >4YBK_1|Chain... at 98%
5bmm
RCSB PDB
PDBbind
286aa, >5BMM_1|Chains... at 98%
5d10
RCSB PDB
PDBbind
286aa, >5D10_1|Chains... at 97%
5d11
RCSB PDB
PDBbind
286aa, >5D11_1|Chains... at 97%
5d12
RCSB PDB
PDBbind
286aa, >5D12_1|Chains... at 97%
6f3f
RCSB PDB
PDBbind
455aa, >6F3F_1|Chain... at 98%
5teh
RCSB PDB
PDBbind
286aa, >5TEH_1|Chains... at 97%
5sys
RCSB PDB
PDBbind
286aa, >5SYS_1|Chains... at 97%
5swh
RCSB PDB
PDBbind
286aa, >5SWH_1|Chains... at 97%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5xp7
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Proto-oncogene tyrosine-protein kinase Src
Ligand Name
8C6
EC.Number
E.C.2.7.10.2
Resolution
2.01(Å)
Affinity (Kd/Ki/IC50)
Ki=0.038mM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Am. Chem. Soc. Vol. 139: pp. 7701-7704
Ligand Properties
Formula
C
1
1
H
1
8
ClN
5
O
9
P
2
Molecular Weight
461.689
Exact Mass
461.027
No. of atoms
46
No. of bonds
48
Polar Surface Area
256.87
LOGP Value
-4.28 (
Computed with XLOGP3
)
-1.37 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 14
No. of Rings: 3
Canonical SMILES
O[C@@H]1[C@@H](COP([C@@H](P(O)(O)O)Cl)(O)O)O[C@H]([C@@H]1O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C11H20ClN5O9P2/c12-11(27(20,21)22)28(23,24)25-1-4-6(18)7(19)10(26-4)17-3-16-5-8(13)14-2-15-9(5)17/h2-4,6-7,10-11,18-24,27-28H,1H2,(H2,13,14,15)/t4-,6-,7-,10-,11-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00523
Entrez Gene ID
NCBI Entrez Gene ID:
396442
ASD
Information of known allosteric effects of PDB entries
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