USER MOD reduce.3.24.130724 H: found=0, std=0, add=572, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 576 hydrogens (19 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B 4 M3L H2 : B 4 M3L N : B 3 THR C :(H bumps) USER MOD NoAdj-H: B 4 M3L H : B 4 M3L N : B 3 THR C :(H bumps) USER MOD Set 1.1: A 284 SER OG : rot 180:sc= 0.448 USER MOD Set 1.2: A 287 GLN : amide:sc= 1.1 K(o=1.6,f=1) USER MOD Set 2.1: A 271 CYS SG : rot 180:sc= 0.279 USER MOD Set 2.2: A 273 ASN : amide:sc= 1.04 K(o=1.3,f=-2.4!) USER MOD Set 3.1: A 253 CYS SG : rot 19:sc= 0 USER MOD Set 3.2: B 5 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 240 SER OG : rot 180:sc= 0 USER MOD Single : A 241 SER OG : rot 180:sc= 0 USER MOD Single : A 243 SER OG : rot 180:sc= 0.0947 USER MOD Single : A 244 SER OG : rot 17:sc= 0.365 USER MOD Single : A 248 SER OG : rot 180:sc= 0 USER MOD Single : A 252 GLN : amide:sc= 0.674 K(o=0.67,f=-0.0056) USER MOD Single : A 258 GLN : amide:sc= 0.866 K(o=0.87,f=-2.8!) USER MOD Single : A 260 SER OG : rot 180:sc= 0 USER MOD Single : A 263 ASN : amide:sc= -0.107 K(o=-0.11,f=-0.69) USER MOD Single : A 266 LYS NZ :NH3+ -106:sc= 1.4 (180deg=0.0906) USER MOD Single : A 277 SER OG : rot -35:sc= 0.00455 USER MOD Single : A 282 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 288 ASN : amide:sc= -0.215 X(o=-0.22,f=-0.29) USER MOD Single : A 289 THR OG1 : rot 180:sc= 0.0034 USER MOD Single : A 292 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 293 TYR OH : rot 180:sc= 0 USER MOD Single : A 294 ASN : amide:sc= -0.137 K(o=-0.14,f=-1) USER MOD Single : A 302 THR OG1 : rot 180:sc= 0 USER MOD Single : A 304 THR OG1 : rot 43:sc= 0.0109 USER MOD Single : B 1 ALA N :NH3+ 167:sc= 1.34 (180deg=1.25) USER MOD Single : B 3 THR OG1 : rot 180:sc= 0 USER MOD Single : B 6 THR OG1 : rot 180:sc=-0.00734 USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 239 -11.067 -13.958 -29.538 1.00 0.00 N ATOM 2 CA GLY A 239 -9.742 -14.054 -28.890 1.00 0.00 C ATOM 3 C GLY A 239 -9.863 -14.612 -27.482 1.00 0.00 C ATOM 4 O GLY A 239 -10.355 -15.724 -27.298 1.00 0.00 O ATOM 0 HA2 GLY A 239 -9.089 -14.694 -29.483 1.00 0.00 H new ATOM 0 HA3 GLY A 239 -9.278 -13.068 -28.856 1.00 0.00 H new ATOM 10 N SER A 240 -9.435 -13.852 -26.474 1.00 0.00 N ATOM 11 CA SER A 240 -9.401 -14.262 -25.057 1.00 0.00 C ATOM 12 C SER A 240 -9.261 -13.052 -24.109 1.00 0.00 C ATOM 13 O SER A 240 -8.951 -11.936 -24.538 1.00 0.00 O ATOM 14 CB SER A 240 -8.266 -15.281 -24.819 1.00 0.00 C ATOM 15 OG SER A 240 -6.986 -14.759 -25.168 1.00 0.00 O ATOM 0 H SER A 240 -9.090 -12.903 -26.618 1.00 0.00 H new ATOM 0 HA SER A 240 -10.354 -14.739 -24.829 1.00 0.00 H new ATOM 0 HB2 SER A 240 -8.261 -15.577 -23.770 1.00 0.00 H new ATOM 0 HB3 SER A 240 -8.460 -16.180 -25.403 1.00 0.00 H new ATOM 0 HG SER A 240 -6.299 -15.437 -24.999 1.00 0.00 H new ATOM 21 N SER A 241 -9.494 -13.256 -22.809 1.00 0.00 N ATOM 22 CA SER A 241 -9.414 -12.227 -21.756 1.00 0.00 C ATOM 23 C SER A 241 -9.277 -12.881 -20.365 1.00 0.00 C ATOM 24 O SER A 241 -9.638 -14.051 -20.183 1.00 0.00 O ATOM 25 CB SER A 241 -10.655 -11.318 -21.813 1.00 0.00 C ATOM 26 OG SER A 241 -10.503 -10.158 -21.002 1.00 0.00 O ATOM 0 H SER A 241 -9.753 -14.172 -22.443 1.00 0.00 H new ATOM 0 HA SER A 241 -8.527 -11.617 -21.929 1.00 0.00 H new ATOM 0 HB2 SER A 241 -10.838 -11.018 -22.845 1.00 0.00 H new ATOM 0 HB3 SER A 241 -11.530 -11.878 -21.484 1.00 0.00 H new ATOM 0 HG SER A 241 -11.310 -9.606 -21.066 1.00 0.00 H new ATOM 32 N GLY A 242 -8.744 -12.144 -19.381 1.00 0.00 N ATOM 33 CA GLY A 242 -8.449 -12.634 -18.028 1.00 0.00 C ATOM 34 C GLY A 242 -7.232 -11.945 -17.407 1.00 0.00 C ATOM 35 O GLY A 242 -7.096 -10.723 -17.487 1.00 0.00 O ATOM 0 H GLY A 242 -8.499 -11.162 -19.508 1.00 0.00 H new ATOM 0 HA2 GLY A 242 -9.318 -12.474 -17.390 1.00 0.00 H new ATOM 0 HA3 GLY A 242 -8.274 -13.709 -18.065 1.00 0.00 H new ATOM 39 N SER A 243 -6.361 -12.724 -16.766 1.00 0.00 N ATOM 40 CA SER A 243 -5.107 -12.235 -16.167 1.00 0.00 C ATOM 41 C SER A 243 -4.018 -11.917 -17.223 1.00 0.00 C ATOM 42 O SER A 243 -4.219 -12.073 -18.431 1.00 0.00 O ATOM 43 CB SER A 243 -4.615 -13.250 -15.121 1.00 0.00 C ATOM 44 OG SER A 243 -3.642 -12.672 -14.258 1.00 0.00 O ATOM 0 H SER A 243 -6.503 -13.727 -16.643 1.00 0.00 H new ATOM 0 HA SER A 243 -5.314 -11.285 -15.674 1.00 0.00 H new ATOM 0 HB2 SER A 243 -5.460 -13.607 -14.532 1.00 0.00 H new ATOM 0 HB3 SER A 243 -4.188 -14.117 -15.625 1.00 0.00 H new ATOM 0 HG SER A 243 -3.349 -13.339 -13.603 1.00 0.00 H new ATOM 50 N SER A 244 -2.848 -11.454 -16.781 1.00 0.00 N ATOM 51 CA SER A 244 -1.717 -10.994 -17.608 1.00 0.00 C ATOM 52 C SER A 244 -0.388 -11.055 -16.829 1.00 0.00 C ATOM 53 O SER A 244 -0.376 -11.104 -15.594 1.00 0.00 O ATOM 54 CB SER A 244 -1.960 -9.552 -18.096 1.00 0.00 C ATOM 55 OG SER A 244 -2.950 -9.485 -19.115 1.00 0.00 O ATOM 0 H SER A 244 -2.647 -11.384 -15.784 1.00 0.00 H new ATOM 0 HA SER A 244 -1.645 -11.662 -18.466 1.00 0.00 H new ATOM 0 HB2 SER A 244 -2.267 -8.933 -17.253 1.00 0.00 H new ATOM 0 HB3 SER A 244 -1.026 -9.136 -18.473 1.00 0.00 H new ATOM 0 HG SER A 244 -3.474 -10.313 -19.117 1.00 0.00 H new ATOM 61 N GLY A 245 0.742 -11.037 -17.552 1.00 0.00 N ATOM 62 CA GLY A 245 2.093 -11.038 -16.974 1.00 0.00 C ATOM 63 C GLY A 245 2.498 -9.691 -16.360 1.00 0.00 C ATOM 64 O GLY A 245 1.838 -8.670 -16.563 1.00 0.00 O ATOM 0 H GLY A 245 0.742 -11.021 -18.572 1.00 0.00 H new ATOM 0 HA2 GLY A 245 2.151 -11.810 -16.207 1.00 0.00 H new ATOM 0 HA3 GLY A 245 2.811 -11.305 -17.749 1.00 0.00 H new ATOM 68 N GLU A 246 3.617 -9.699 -15.632 1.00 0.00 N ATOM 69 CA GLU A 246 4.124 -8.570 -14.832 1.00 0.00 C ATOM 70 C GLU A 246 5.567 -8.174 -15.198 1.00 0.00 C ATOM 71 O GLU A 246 6.313 -7.622 -14.388 1.00 0.00 O ATOM 72 CB GLU A 246 3.928 -8.868 -13.334 1.00 0.00 C ATOM 73 CG GLU A 246 4.710 -10.084 -12.815 1.00 0.00 C ATOM 74 CD GLU A 246 4.446 -10.302 -11.318 1.00 0.00 C ATOM 75 OE1 GLU A 246 3.293 -10.627 -10.949 1.00 0.00 O ATOM 76 OE2 GLU A 246 5.391 -10.162 -10.504 1.00 0.00 O ATOM 0 H GLU A 246 4.221 -10.520 -15.578 1.00 0.00 H new ATOM 0 HA GLU A 246 3.537 -7.684 -15.075 1.00 0.00 H new ATOM 0 HB2 GLU A 246 4.225 -7.990 -12.761 1.00 0.00 H new ATOM 0 HB3 GLU A 246 2.866 -9.028 -13.145 1.00 0.00 H new ATOM 0 HG2 GLU A 246 4.420 -10.974 -13.374 1.00 0.00 H new ATOM 0 HG3 GLU A 246 5.777 -9.935 -12.983 1.00 0.00 H new ATOM 83 N ILE A 247 5.974 -8.467 -16.436 1.00 0.00 N ATOM 84 CA ILE A 247 7.319 -8.189 -16.964 1.00 0.00 C ATOM 85 C ILE A 247 7.409 -6.702 -17.346 1.00 0.00 C ATOM 86 O ILE A 247 6.936 -6.285 -18.405 1.00 0.00 O ATOM 87 CB ILE A 247 7.663 -9.141 -18.141 1.00 0.00 C ATOM 88 CG1 ILE A 247 7.493 -10.629 -17.736 1.00 0.00 C ATOM 89 CG2 ILE A 247 9.104 -8.876 -18.623 1.00 0.00 C ATOM 90 CD1 ILE A 247 7.727 -11.631 -18.875 1.00 0.00 C ATOM 0 H ILE A 247 5.364 -8.916 -17.119 1.00 0.00 H new ATOM 0 HA ILE A 247 8.069 -8.384 -16.198 1.00 0.00 H new ATOM 0 HB ILE A 247 6.968 -8.940 -18.956 1.00 0.00 H new ATOM 0 HG12 ILE A 247 8.186 -10.853 -16.925 1.00 0.00 H new ATOM 0 HG13 ILE A 247 6.486 -10.773 -17.344 1.00 0.00 H new ATOM 0 HG21 ILE A 247 9.340 -9.547 -19.449 1.00 0.00 H new ATOM 0 HG22 ILE A 247 9.191 -7.843 -18.958 1.00 0.00 H new ATOM 0 HG23 ILE A 247 9.800 -9.051 -17.803 1.00 0.00 H new ATOM 0 HD11 ILE A 247 7.587 -12.645 -18.502 1.00 0.00 H new ATOM 0 HD12 ILE A 247 7.017 -11.439 -19.680 1.00 0.00 H new ATOM 0 HD13 ILE A 247 8.743 -11.521 -19.254 1.00 0.00 H new ATOM 102 N SER A 248 8.012 -5.893 -16.477 1.00 0.00 N ATOM 103 CA SER A 248 8.146 -4.438 -16.633 1.00 0.00 C ATOM 104 C SER A 248 9.243 -3.888 -15.704 1.00 0.00 C ATOM 105 O SER A 248 9.254 -4.181 -14.504 1.00 0.00 O ATOM 106 CB SER A 248 6.801 -3.753 -16.337 1.00 0.00 C ATOM 107 OG SER A 248 6.880 -2.354 -16.575 1.00 0.00 O ATOM 0 H SER A 248 8.436 -6.239 -15.616 1.00 0.00 H new ATOM 0 HA SER A 248 8.434 -4.224 -17.662 1.00 0.00 H new ATOM 0 HB2 SER A 248 6.021 -4.189 -16.962 1.00 0.00 H new ATOM 0 HB3 SER A 248 6.517 -3.934 -15.300 1.00 0.00 H new ATOM 0 HG SER A 248 6.013 -1.940 -16.382 1.00 0.00 H new ATOM 113 N GLY A 249 10.176 -3.099 -16.253 1.00 0.00 N ATOM 114 CA GLY A 249 11.281 -2.470 -15.514 1.00 0.00 C ATOM 115 C GLY A 249 10.859 -1.120 -14.938 1.00 0.00 C ATOM 116 O GLY A 249 10.219 -1.058 -13.886 1.00 0.00 O ATOM 0 H GLY A 249 10.184 -2.874 -17.248 1.00 0.00 H new ATOM 0 HA2 GLY A 249 11.604 -3.128 -14.707 1.00 0.00 H new ATOM 0 HA3 GLY A 249 12.136 -2.335 -16.177 1.00 0.00 H new ATOM 120 N PHE A 250 11.219 -0.038 -15.629 1.00 0.00 N ATOM 121 CA PHE A 250 10.790 1.326 -15.306 1.00 0.00 C ATOM 122 C PHE A 250 9.363 1.601 -15.816 1.00 0.00 C ATOM 123 O PHE A 250 8.922 1.020 -16.812 1.00 0.00 O ATOM 124 CB PHE A 250 11.803 2.323 -15.889 1.00 0.00 C ATOM 125 CG PHE A 250 13.217 2.138 -15.367 1.00 0.00 C ATOM 126 CD1 PHE A 250 13.562 2.615 -14.088 1.00 0.00 C ATOM 127 CD2 PHE A 250 14.181 1.466 -16.145 1.00 0.00 C ATOM 128 CE1 PHE A 250 14.863 2.422 -13.588 1.00 0.00 C ATOM 129 CE2 PHE A 250 15.481 1.273 -15.645 1.00 0.00 C ATOM 130 CZ PHE A 250 15.822 1.750 -14.366 1.00 0.00 C ATOM 0 H PHE A 250 11.829 -0.085 -16.445 1.00 0.00 H new ATOM 0 HA PHE A 250 10.760 1.446 -14.223 1.00 0.00 H new ATOM 0 HB2 PHE A 250 11.811 2.225 -16.975 1.00 0.00 H new ATOM 0 HB3 PHE A 250 11.472 3.337 -15.663 1.00 0.00 H new ATOM 0 HD1 PHE A 250 12.826 3.131 -13.489 1.00 0.00 H new ATOM 0 HD2 PHE A 250 13.921 1.099 -17.127 1.00 0.00 H new ATOM 0 HE1 PHE A 250 15.125 2.790 -12.607 1.00 0.00 H new ATOM 0 HE2 PHE A 250 16.218 0.758 -16.243 1.00 0.00 H new ATOM 0 HZ PHE A 250 16.820 1.600 -13.982 1.00 0.00 H new ATOM 140 N GLY A 251 8.643 2.499 -15.132 1.00 0.00 N ATOM 141 CA GLY A 251 7.272 2.917 -15.473 1.00 0.00 C ATOM 142 C GLY A 251 6.170 2.271 -14.624 1.00 0.00 C ATOM 143 O GLY A 251 5.016 2.689 -14.725 1.00 0.00 O ATOM 0 H GLY A 251 9.006 2.969 -14.303 1.00 0.00 H new ATOM 0 HA2 GLY A 251 7.202 4.000 -15.370 1.00 0.00 H new ATOM 0 HA3 GLY A 251 7.087 2.683 -16.521 1.00 0.00 H new ATOM 147 N GLN A 252 6.503 1.290 -13.776 1.00 0.00 N ATOM 148 CA GLN A 252 5.598 0.749 -12.753 1.00 0.00 C ATOM 149 C GLN A 252 5.783 1.474 -11.404 1.00 0.00 C ATOM 150 O GLN A 252 6.725 2.250 -11.221 1.00 0.00 O ATOM 151 CB GLN A 252 5.750 -0.782 -12.628 1.00 0.00 C ATOM 152 CG GLN A 252 7.132 -1.270 -12.152 1.00 0.00 C ATOM 153 CD GLN A 252 7.068 -2.679 -11.554 1.00 0.00 C ATOM 154 OE1 GLN A 252 6.422 -2.921 -10.541 1.00 0.00 O ATOM 155 NE2 GLN A 252 7.718 -3.670 -12.130 1.00 0.00 N ATOM 0 H GLN A 252 7.420 0.844 -13.781 1.00 0.00 H new ATOM 0 HA GLN A 252 4.573 0.938 -13.071 1.00 0.00 H new ATOM 0 HB2 GLN A 252 4.994 -1.150 -11.934 1.00 0.00 H new ATOM 0 HB3 GLN A 252 5.538 -1.232 -13.598 1.00 0.00 H new ATOM 0 HG2 GLN A 252 7.828 -1.263 -12.991 1.00 0.00 H new ATOM 0 HG3 GLN A 252 7.524 -0.577 -11.407 1.00 0.00 H new ATOM 0 HE21 GLN A 252 8.264 -3.499 -12.974 1.00 0.00 H new ATOM 0 HE22 GLN A 252 7.675 -4.608 -11.732 1.00 0.00 H new ATOM 164 N CYS A 253 4.889 1.205 -10.448 1.00 0.00 N ATOM 165 CA CYS A 253 4.845 1.834 -9.123 1.00 0.00 C ATOM 166 C CYS A 253 4.244 0.895 -8.064 1.00 0.00 C ATOM 167 O CYS A 253 3.659 -0.146 -8.388 1.00 0.00 O ATOM 168 CB CYS A 253 4.068 3.161 -9.230 1.00 0.00 C ATOM 169 SG CYS A 253 2.325 2.856 -9.644 1.00 0.00 S ATOM 0 H CYS A 253 4.148 0.517 -10.580 1.00 0.00 H new ATOM 0 HA CYS A 253 5.861 2.044 -8.790 1.00 0.00 H new ATOM 0 HB2 CYS A 253 4.133 3.703 -8.286 1.00 0.00 H new ATOM 0 HB3 CYS A 253 4.522 3.793 -9.993 1.00 0.00 H new ATOM 0 HG CYS A 253 2.025 1.620 -9.374 1.00 0.00 H new ATOM 175 N LEU A 254 4.367 1.279 -6.792 1.00 0.00 N ATOM 176 CA LEU A 254 3.806 0.562 -5.645 1.00 0.00 C ATOM 177 C LEU A 254 2.534 1.292 -5.184 1.00 0.00 C ATOM 178 O LEU A 254 2.575 2.493 -4.907 1.00 0.00 O ATOM 179 CB LEU A 254 4.908 0.479 -4.572 1.00 0.00 C ATOM 180 CG LEU A 254 4.724 -0.560 -3.448 1.00 0.00 C ATOM 181 CD1 LEU A 254 5.936 -0.502 -2.505 1.00 0.00 C ATOM 182 CD2 LEU A 254 3.438 -0.369 -2.643 1.00 0.00 C ATOM 0 H LEU A 254 4.875 2.122 -6.524 1.00 0.00 H new ATOM 0 HA LEU A 254 3.503 -0.457 -5.884 1.00 0.00 H new ATOM 0 HB2 LEU A 254 5.852 0.269 -5.074 1.00 0.00 H new ATOM 0 HB3 LEU A 254 5.004 1.462 -4.110 1.00 0.00 H new ATOM 0 HG LEU A 254 4.646 -1.536 -3.927 1.00 0.00 H new ATOM 0 HD11 LEU A 254 5.812 -1.235 -1.708 1.00 0.00 H new ATOM 0 HD12 LEU A 254 6.844 -0.726 -3.065 1.00 0.00 H new ATOM 0 HD13 LEU A 254 6.013 0.496 -2.072 1.00 0.00 H new ATOM 0 HD21 LEU A 254 3.375 -1.135 -1.870 1.00 0.00 H new ATOM 0 HD22 LEU A 254 3.443 0.617 -2.177 1.00 0.00 H new ATOM 0 HD23 LEU A 254 2.577 -0.452 -3.307 1.00 0.00 H new ATOM 194 N VAL A 255 1.416 0.571 -5.106 1.00 0.00 N ATOM 195 CA VAL A 255 0.104 1.095 -4.685 1.00 0.00 C ATOM 196 C VAL A 255 -0.083 0.874 -3.181 1.00 0.00 C ATOM 197 O VAL A 255 0.128 -0.232 -2.681 1.00 0.00 O ATOM 198 CB VAL A 255 -1.049 0.426 -5.476 1.00 0.00 C ATOM 199 CG1 VAL A 255 -2.424 1.006 -5.098 1.00 0.00 C ATOM 200 CG2 VAL A 255 -0.848 0.580 -6.996 1.00 0.00 C ATOM 0 H VAL A 255 1.390 -0.422 -5.339 1.00 0.00 H new ATOM 0 HA VAL A 255 0.076 2.164 -4.898 1.00 0.00 H new ATOM 0 HB VAL A 255 -1.027 -0.630 -5.208 1.00 0.00 H new ATOM 0 HG11 VAL A 255 -3.201 0.507 -5.677 1.00 0.00 H new ATOM 0 HG12 VAL A 255 -2.606 0.848 -4.035 1.00 0.00 H new ATOM 0 HG13 VAL A 255 -2.440 2.074 -5.314 1.00 0.00 H new ATOM 0 HG21 VAL A 255 -1.673 0.100 -7.523 1.00 0.00 H new ATOM 0 HG22 VAL A 255 -0.820 1.639 -7.254 1.00 0.00 H new ATOM 0 HG23 VAL A 255 0.091 0.110 -7.288 1.00 0.00 H new ATOM 210 N TRP A 256 -0.511 1.921 -2.471 1.00 0.00 N ATOM 211 CA TRP A 256 -0.850 1.882 -1.045 1.00 0.00 C ATOM 212 C TRP A 256 -2.329 2.255 -0.822 1.00 0.00 C ATOM 213 O TRP A 256 -2.867 3.144 -1.487 1.00 0.00 O ATOM 214 CB TRP A 256 0.074 2.825 -0.254 1.00 0.00 C ATOM 215 CG TRP A 256 1.508 2.422 -0.089 1.00 0.00 C ATOM 216 CD1 TRP A 256 2.492 2.638 -0.990 1.00 0.00 C ATOM 217 CD2 TRP A 256 2.152 1.735 1.035 1.00 0.00 C ATOM 218 NE1 TRP A 256 3.690 2.162 -0.496 1.00 0.00 N ATOM 219 CE2 TRP A 256 3.533 1.557 0.727 1.00 0.00 C ATOM 220 CE3 TRP A 256 1.709 1.219 2.273 1.00 0.00 C ATOM 221 CZ2 TRP A 256 4.421 0.878 1.574 1.00 0.00 C ATOM 222 CZ3 TRP A 256 2.579 0.491 3.110 1.00 0.00 C ATOM 223 CH2 TRP A 256 3.932 0.327 2.768 1.00 0.00 C ATOM 0 H TRP A 256 -0.635 2.846 -2.883 1.00 0.00 H new ATOM 0 HA TRP A 256 -0.702 0.865 -0.683 1.00 0.00 H new ATOM 0 HB2 TRP A 256 0.054 3.800 -0.741 1.00 0.00 H new ATOM 0 HB3 TRP A 256 -0.353 2.957 0.740 1.00 0.00 H new ATOM 0 HD1 TRP A 256 2.361 3.112 -1.952 1.00 0.00 H new ATOM 0 HE1 TRP A 256 4.583 2.249 -0.980 1.00 0.00 H new ATOM 0 HE3 TRP A 256 0.688 1.385 2.583 1.00 0.00 H new ATOM 0 HZ2 TRP A 256 5.464 0.781 1.311 1.00 0.00 H new ATOM 0 HZ3 TRP A 256 2.202 0.055 4.023 1.00 0.00 H new ATOM 0 HH2 TRP A 256 4.593 -0.222 3.422 1.00 0.00 H new ATOM 234 N VAL A 257 -2.968 1.592 0.143 1.00 0.00 N ATOM 235 CA VAL A 257 -4.398 1.744 0.488 1.00 0.00 C ATOM 236 C VAL A 257 -4.568 2.053 1.968 1.00 0.00 C ATOM 237 O VAL A 257 -3.925 1.420 2.802 1.00 0.00 O ATOM 238 CB VAL A 257 -5.221 0.477 0.153 1.00 0.00 C ATOM 239 CG1 VAL A 257 -5.667 0.505 -1.304 1.00 0.00 C ATOM 240 CG2 VAL A 257 -4.469 -0.834 0.438 1.00 0.00 C ATOM 0 H VAL A 257 -2.494 0.907 0.732 1.00 0.00 H new ATOM 0 HA VAL A 257 -4.771 2.572 -0.115 1.00 0.00 H new ATOM 0 HB VAL A 257 -6.088 0.495 0.813 1.00 0.00 H new ATOM 0 HG11 VAL A 257 -6.245 -0.392 -1.525 1.00 0.00 H new ATOM 0 HG12 VAL A 257 -6.284 1.386 -1.479 1.00 0.00 H new ATOM 0 HG13 VAL A 257 -4.791 0.541 -1.952 1.00 0.00 H new ATOM 0 HG21 VAL A 257 -5.104 -1.681 0.180 1.00 0.00 H new ATOM 0 HG22 VAL A 257 -3.558 -0.868 -0.160 1.00 0.00 H new ATOM 0 HG23 VAL A 257 -4.211 -0.883 1.496 1.00 0.00 H new ATOM 250 N GLN A 258 -5.429 3.023 2.284 1.00 0.00 N ATOM 251 CA GLN A 258 -5.734 3.421 3.657 1.00 0.00 C ATOM 252 C GLN A 258 -7.004 2.720 4.165 1.00 0.00 C ATOM 253 O GLN A 258 -8.038 2.711 3.489 1.00 0.00 O ATOM 254 CB GLN A 258 -5.873 4.946 3.761 1.00 0.00 C ATOM 255 CG GLN A 258 -5.916 5.426 5.226 1.00 0.00 C ATOM 256 CD GLN A 258 -5.807 6.950 5.374 1.00 0.00 C ATOM 257 OE1 GLN A 258 -6.437 7.728 4.671 1.00 0.00 O ATOM 258 NE2 GLN A 258 -5.025 7.453 6.306 1.00 0.00 N ATOM 0 H GLN A 258 -5.940 3.560 1.583 1.00 0.00 H new ATOM 0 HA GLN A 258 -4.904 3.110 4.291 1.00 0.00 H new ATOM 0 HB2 GLN A 258 -5.037 5.422 3.249 1.00 0.00 H new ATOM 0 HB3 GLN A 258 -6.782 5.262 3.249 1.00 0.00 H new ATOM 0 HG2 GLN A 258 -6.847 5.090 5.683 1.00 0.00 H new ATOM 0 HG3 GLN A 258 -5.102 4.956 5.778 1.00 0.00 H new ATOM 0 HE21 GLN A 258 -4.486 6.832 6.909 1.00 0.00 H new ATOM 0 HE22 GLN A 258 -4.958 8.464 6.425 1.00 0.00 H new ATOM 267 N CYS A 259 -6.919 2.163 5.377 1.00 0.00 N ATOM 268 CA CYS A 259 -8.015 1.515 6.089 1.00 0.00 C ATOM 269 C CYS A 259 -9.252 2.428 6.218 1.00 0.00 C ATOM 270 O CYS A 259 -9.133 3.618 6.527 1.00 0.00 O ATOM 271 CB CYS A 259 -7.465 1.116 7.464 1.00 0.00 C ATOM 272 SG CYS A 259 -8.592 -0.062 8.260 1.00 0.00 S ATOM 0 H CYS A 259 -6.047 2.153 5.907 1.00 0.00 H new ATOM 0 HA CYS A 259 -8.362 0.642 5.536 1.00 0.00 H new ATOM 0 HB2 CYS A 259 -6.476 0.670 7.355 1.00 0.00 H new ATOM 0 HB3 CYS A 259 -7.348 2.001 8.090 1.00 0.00 H new ATOM 277 N SER A 260 -10.447 1.874 5.996 1.00 0.00 N ATOM 278 CA SER A 260 -11.720 2.616 6.082 1.00 0.00 C ATOM 279 C SER A 260 -12.056 3.076 7.518 1.00 0.00 C ATOM 280 O SER A 260 -12.719 4.103 7.708 1.00 0.00 O ATOM 281 CB SER A 260 -12.866 1.806 5.459 1.00 0.00 C ATOM 282 OG SER A 260 -14.099 2.512 5.486 1.00 0.00 O ATOM 0 H SER A 260 -10.565 0.891 5.749 1.00 0.00 H new ATOM 0 HA SER A 260 -11.594 3.530 5.501 1.00 0.00 H new ATOM 0 HB2 SER A 260 -12.614 1.557 4.428 1.00 0.00 H new ATOM 0 HB3 SER A 260 -12.977 0.864 5.996 1.00 0.00 H new ATOM 0 HG SER A 260 -14.800 1.962 5.079 1.00 0.00 H new ATOM 288 N PHE A 261 -11.560 2.376 8.549 1.00 0.00 N ATOM 289 CA PHE A 261 -11.790 2.759 9.938 1.00 0.00 C ATOM 290 C PHE A 261 -10.970 3.996 10.345 1.00 0.00 C ATOM 291 O PHE A 261 -9.760 4.041 10.098 1.00 0.00 O ATOM 292 CB PHE A 261 -11.502 1.589 10.880 1.00 0.00 C ATOM 293 CG PHE A 261 -12.442 0.415 10.728 1.00 0.00 C ATOM 294 CD1 PHE A 261 -13.770 0.520 11.182 1.00 0.00 C ATOM 295 CD2 PHE A 261 -11.986 -0.791 10.161 1.00 0.00 C ATOM 296 CE1 PHE A 261 -14.642 -0.577 11.060 1.00 0.00 C ATOM 297 CE2 PHE A 261 -12.851 -1.891 10.057 1.00 0.00 C ATOM 298 CZ PHE A 261 -14.184 -1.781 10.495 1.00 0.00 C ATOM 0 H PHE A 261 -10.993 1.535 8.438 1.00 0.00 H new ATOM 0 HA PHE A 261 -12.843 3.027 10.024 1.00 0.00 H new ATOM 0 HB2 PHE A 261 -10.482 1.245 10.710 1.00 0.00 H new ATOM 0 HB3 PHE A 261 -11.551 1.947 11.908 1.00 0.00 H new ATOM 0 HD1 PHE A 261 -14.119 1.442 11.624 1.00 0.00 H new ATOM 0 HD2 PHE A 261 -10.969 -0.869 9.806 1.00 0.00 H new ATOM 0 HE1 PHE A 261 -15.664 -0.495 11.400 1.00 0.00 H new ATOM 0 HE2 PHE A 261 -12.494 -2.822 9.641 1.00 0.00 H new ATOM 0 HZ PHE A 261 -14.855 -2.621 10.397 1.00 0.00 H new ATOM 308 N PRO A 262 -11.603 4.972 11.027 1.00 0.00 N ATOM 309 CA PRO A 262 -10.966 6.210 11.466 1.00 0.00 C ATOM 310 C PRO A 262 -9.985 5.983 12.625 1.00 0.00 C ATOM 311 O PRO A 262 -8.968 6.667 12.714 1.00 0.00 O ATOM 312 CB PRO A 262 -12.131 7.104 11.891 1.00 0.00 C ATOM 313 CG PRO A 262 -13.205 6.128 12.370 1.00 0.00 C ATOM 314 CD PRO A 262 -12.999 4.937 11.445 1.00 0.00 C ATOM 0 HA PRO A 262 -10.362 6.654 10.675 1.00 0.00 H new ATOM 0 HB2 PRO A 262 -11.836 7.791 12.684 1.00 0.00 H new ATOM 0 HB3 PRO A 262 -12.489 7.712 11.060 1.00 0.00 H new ATOM 0 HG2 PRO A 262 -13.070 5.857 13.417 1.00 0.00 H new ATOM 0 HG3 PRO A 262 -14.207 6.547 12.276 1.00 0.00 H new ATOM 0 HD2 PRO A 262 -13.226 4.003 11.959 1.00 0.00 H new ATOM 0 HD3 PRO A 262 -13.663 4.996 10.583 1.00 0.00 H new ATOM 322 N ASN A 263 -10.259 4.992 13.481 1.00 0.00 N ATOM 323 CA ASN A 263 -9.365 4.545 14.557 1.00 0.00 C ATOM 324 C ASN A 263 -8.143 3.735 14.055 1.00 0.00 C ATOM 325 O ASN A 263 -7.230 3.456 14.837 1.00 0.00 O ATOM 326 CB ASN A 263 -10.191 3.764 15.595 1.00 0.00 C ATOM 327 CG ASN A 263 -10.843 2.508 15.016 1.00 0.00 C ATOM 328 OD1 ASN A 263 -10.179 1.542 14.665 1.00 0.00 O ATOM 329 ND2 ASN A 263 -12.159 2.492 14.878 1.00 0.00 N ATOM 0 H ASN A 263 -11.131 4.465 13.444 1.00 0.00 H new ATOM 0 HA ASN A 263 -8.930 5.429 15.023 1.00 0.00 H new ATOM 0 HB2 ASN A 263 -9.546 3.481 16.427 1.00 0.00 H new ATOM 0 HB3 ASN A 263 -10.966 4.415 16.000 1.00 0.00 H new ATOM 0 HD21 ASN A 263 -12.620 1.674 14.479 1.00 0.00 H new ATOM 0 HD22 ASN A 263 -12.712 3.297 15.171 1.00 0.00 H new ATOM 336 N CYS A 264 -8.108 3.403 12.758 1.00 0.00 N ATOM 337 CA CYS A 264 -6.984 2.780 12.066 1.00 0.00 C ATOM 338 C CYS A 264 -6.231 3.856 11.265 1.00 0.00 C ATOM 339 O CYS A 264 -5.192 4.356 11.701 1.00 0.00 O ATOM 340 CB CYS A 264 -7.526 1.649 11.171 1.00 0.00 C ATOM 341 SG CYS A 264 -6.471 0.182 11.212 1.00 0.00 S ATOM 0 H CYS A 264 -8.901 3.571 12.139 1.00 0.00 H new ATOM 0 HA CYS A 264 -6.276 2.341 12.769 1.00 0.00 H new ATOM 0 HB2 CYS A 264 -8.531 1.381 11.496 1.00 0.00 H new ATOM 0 HB3 CYS A 264 -7.608 2.007 10.145 1.00 0.00 H new ATOM 346 N GLY A 265 -6.771 4.216 10.091 1.00 0.00 N ATOM 347 CA GLY A 265 -6.155 5.140 9.147 1.00 0.00 C ATOM 348 C GLY A 265 -4.823 4.630 8.600 1.00 0.00 C ATOM 349 O GLY A 265 -4.042 5.422 8.076 1.00 0.00 O ATOM 0 H GLY A 265 -7.671 3.859 9.770 1.00 0.00 H new ATOM 0 HA2 GLY A 265 -6.840 5.314 8.317 1.00 0.00 H new ATOM 0 HA3 GLY A 265 -5.997 6.101 9.637 1.00 0.00 H new ATOM 353 N LYS A 266 -4.547 3.329 8.739 1.00 0.00 N ATOM 354 CA LYS A 266 -3.265 2.723 8.383 1.00 0.00 C ATOM 355 C LYS A 266 -3.126 2.527 6.878 1.00 0.00 C ATOM 356 O LYS A 266 -4.086 2.126 6.218 1.00 0.00 O ATOM 357 CB LYS A 266 -3.105 1.368 9.075 1.00 0.00 C ATOM 358 CG LYS A 266 -2.966 1.507 10.584 1.00 0.00 C ATOM 359 CD LYS A 266 -2.793 0.100 11.146 1.00 0.00 C ATOM 360 CE LYS A 266 -2.755 0.114 12.667 1.00 0.00 C ATOM 361 NZ LYS A 266 -4.074 0.476 13.251 1.00 0.00 N ATOM 0 H LYS A 266 -5.221 2.659 9.108 1.00 0.00 H new ATOM 0 HA LYS A 266 -2.486 3.409 8.717 1.00 0.00 H new ATOM 0 HB2 LYS A 266 -3.967 0.741 8.847 1.00 0.00 H new ATOM 0 HB3 LYS A 266 -2.227 0.859 8.676 1.00 0.00 H new ATOM 0 HG2 LYS A 266 -2.109 2.131 10.837 1.00 0.00 H new ATOM 0 HG3 LYS A 266 -3.847 1.987 11.010 1.00 0.00 H new ATOM 0 HD2 LYS A 266 -3.613 -0.533 10.806 1.00 0.00 H new ATOM 0 HD3 LYS A 266 -1.872 -0.337 10.761 1.00 0.00 H new ATOM 0 HE2 LYS A 266 -2.454 -0.868 13.032 1.00 0.00 H new ATOM 0 HE3 LYS A 266 -2.001 0.825 13.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 266 -4.035 1.447 13.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 266 -4.808 0.415 12.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 266 -4.303 -0.180 14.024 1.00 0.00 H new ATOM 375 N TRP A 267 -1.921 2.727 6.348 1.00 0.00 N ATOM 376 CA TRP A 267 -1.589 2.436 4.957 1.00 0.00 C ATOM 377 C TRP A 267 -0.939 1.051 4.846 1.00 0.00 C ATOM 378 O TRP A 267 0.034 0.759 5.544 1.00 0.00 O ATOM 379 CB TRP A 267 -0.699 3.552 4.399 1.00 0.00 C ATOM 380 CG TRP A 267 -1.370 4.887 4.295 1.00 0.00 C ATOM 381 CD1 TRP A 267 -1.430 5.817 5.270 1.00 0.00 C ATOM 382 CD2 TRP A 267 -2.106 5.451 3.167 1.00 0.00 C ATOM 383 NE1 TRP A 267 -2.109 6.930 4.815 1.00 0.00 N ATOM 384 CE2 TRP A 267 -2.543 6.764 3.517 1.00 0.00 C ATOM 385 CE3 TRP A 267 -2.459 4.975 1.890 1.00 0.00 C ATOM 386 CZ2 TRP A 267 -3.261 7.577 2.623 1.00 0.00 C ATOM 387 CZ3 TRP A 267 -3.191 5.775 0.993 1.00 0.00 C ATOM 388 CH2 TRP A 267 -3.574 7.080 1.347 1.00 0.00 C ATOM 0 H TRP A 267 -1.137 3.101 6.882 1.00 0.00 H new ATOM 0 HA TRP A 267 -2.496 2.407 4.354 1.00 0.00 H new ATOM 0 HB2 TRP A 267 0.181 3.650 5.035 1.00 0.00 H new ATOM 0 HB3 TRP A 267 -0.347 3.258 3.410 1.00 0.00 H new ATOM 0 HD1 TRP A 267 -1.010 5.708 6.259 1.00 0.00 H new ATOM 0 HE1 TRP A 267 -2.270 7.770 5.370 1.00 0.00 H new ATOM 0 HE3 TRP A 267 -2.163 3.979 1.594 1.00 0.00 H new ATOM 0 HZ2 TRP A 267 -3.568 8.571 2.913 1.00 0.00 H new ATOM 0 HZ3 TRP A 267 -3.461 5.382 0.024 1.00 0.00 H new ATOM 0 HH2 TRP A 267 -4.107 7.699 0.640 1.00 0.00 H new ATOM 399 N ARG A 268 -1.475 0.211 3.954 1.00 0.00 N ATOM 400 CA ARG A 268 -0.929 -1.105 3.600 1.00 0.00 C ATOM 401 C ARG A 268 -0.572 -1.131 2.106 1.00 0.00 C ATOM 402 O ARG A 268 -1.259 -0.496 1.294 1.00 0.00 O ATOM 403 CB ARG A 268 -1.937 -2.225 3.919 1.00 0.00 C ATOM 404 CG ARG A 268 -2.643 -2.171 5.287 1.00 0.00 C ATOM 405 CD ARG A 268 -1.730 -2.185 6.510 1.00 0.00 C ATOM 406 NE ARG A 268 -2.535 -2.396 7.724 1.00 0.00 N ATOM 407 CZ ARG A 268 -2.093 -2.577 8.957 1.00 0.00 C ATOM 408 NH1 ARG A 268 -0.834 -2.411 9.295 1.00 0.00 N ATOM 409 NH2 ARG A 268 -2.942 -2.917 9.886 1.00 0.00 N ATOM 0 H ARG A 268 -2.328 0.435 3.442 1.00 0.00 H new ATOM 0 HA ARG A 268 -0.031 -1.277 4.193 1.00 0.00 H new ATOM 0 HB2 ARG A 268 -2.703 -2.220 3.144 1.00 0.00 H new ATOM 0 HB3 ARG A 268 -1.415 -3.179 3.846 1.00 0.00 H new ATOM 0 HG2 ARG A 268 -3.253 -1.269 5.324 1.00 0.00 H new ATOM 0 HG3 ARG A 268 -3.324 -3.019 5.356 1.00 0.00 H new ATOM 0 HD2 ARG A 268 -0.986 -2.976 6.412 1.00 0.00 H new ATOM 0 HD3 ARG A 268 -1.186 -1.243 6.581 1.00 0.00 H new ATOM 0 HE ARG A 268 -3.547 -2.403 7.600 1.00 0.00 H new ATOM 0 HH11 ARG A 268 -0.150 -2.130 8.592 1.00 0.00 H new ATOM 0 HH12 ARG A 268 -0.541 -2.563 10.260 1.00 0.00 H new ATOM 0 HH21 ARG A 268 -3.928 -3.039 9.656 1.00 0.00 H new ATOM 0 HH22 ARG A 268 -2.620 -3.061 10.843 1.00 0.00 H new ATOM 423 N ARG A 269 0.508 -1.838 1.761 1.00 0.00 N ATOM 424 CA ARG A 269 0.990 -2.029 0.384 1.00 0.00 C ATOM 425 C ARG A 269 0.205 -3.129 -0.347 1.00 0.00 C ATOM 426 O ARG A 269 -0.331 -4.037 0.286 1.00 0.00 O ATOM 427 CB ARG A 269 2.498 -2.342 0.381 1.00 0.00 C ATOM 428 CG ARG A 269 2.875 -3.622 1.138 1.00 0.00 C ATOM 429 CD ARG A 269 4.372 -3.938 1.013 1.00 0.00 C ATOM 430 NE ARG A 269 4.640 -5.364 1.266 1.00 0.00 N ATOM 431 CZ ARG A 269 5.821 -5.963 1.306 1.00 0.00 C ATOM 432 NH1 ARG A 269 6.959 -5.304 1.224 1.00 0.00 N ATOM 433 NH2 ARG A 269 5.847 -7.270 1.412 1.00 0.00 N ATOM 0 H ARG A 269 1.092 -2.309 2.452 1.00 0.00 H new ATOM 0 HA ARG A 269 0.824 -1.097 -0.157 1.00 0.00 H new ATOM 0 HB2 ARG A 269 2.838 -2.430 -0.651 1.00 0.00 H new ATOM 0 HB3 ARG A 269 3.033 -1.501 0.822 1.00 0.00 H new ATOM 0 HG2 ARG A 269 2.613 -3.512 2.190 1.00 0.00 H new ATOM 0 HG3 ARG A 269 2.293 -4.458 0.750 1.00 0.00 H new ATOM 0 HD2 ARG A 269 4.720 -3.672 0.015 1.00 0.00 H new ATOM 0 HD3 ARG A 269 4.935 -3.329 1.720 1.00 0.00 H new ATOM 0 HE ARG A 269 3.826 -5.956 1.429 1.00 0.00 H new ATOM 0 HH11 ARG A 269 6.954 -4.289 1.125 1.00 0.00 H new ATOM 0 HH12 ARG A 269 7.844 -5.809 1.259 1.00 0.00 H new ATOM 0 HH21 ARG A 269 4.974 -7.795 1.461 1.00 0.00 H new ATOM 0 HH22 ARG A 269 6.740 -7.761 1.445 1.00 0.00 H new ATOM 447 N LEU A 270 0.194 -3.065 -1.680 1.00 0.00 N ATOM 448 CA LEU A 270 -0.486 -4.001 -2.585 1.00 0.00 C ATOM 449 C LEU A 270 0.430 -4.466 -3.727 1.00 0.00 C ATOM 450 O LEU A 270 1.475 -3.869 -3.998 1.00 0.00 O ATOM 451 CB LEU A 270 -1.735 -3.324 -3.181 1.00 0.00 C ATOM 452 CG LEU A 270 -2.822 -2.898 -2.181 1.00 0.00 C ATOM 453 CD1 LEU A 270 -3.958 -2.258 -2.983 1.00 0.00 C ATOM 454 CD2 LEU A 270 -3.400 -4.057 -1.356 1.00 0.00 C ATOM 0 H LEU A 270 0.682 -2.325 -2.184 1.00 0.00 H new ATOM 0 HA LEU A 270 -0.768 -4.878 -2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 270 -1.414 -2.441 -3.734 1.00 0.00 H new ATOM 0 HB3 LEU A 270 -2.183 -4.007 -3.903 1.00 0.00 H new ATOM 0 HG LEU A 270 -2.362 -2.212 -1.469 1.00 0.00 H new ATOM 0 HD11 LEU A 270 -4.750 -1.942 -2.304 1.00 0.00 H new ATOM 0 HD12 LEU A 270 -3.578 -1.392 -3.525 1.00 0.00 H new ATOM 0 HD13 LEU A 270 -4.356 -2.983 -3.692 1.00 0.00 H new ATOM 0 HD21 LEU A 270 -4.160 -3.675 -0.675 1.00 0.00 H new ATOM 0 HD22 LEU A 270 -3.849 -4.792 -2.025 1.00 0.00 H new ATOM 0 HD23 LEU A 270 -2.602 -4.528 -0.782 1.00 0.00 H new ATOM 466 N CYS A 271 -0.004 -5.519 -4.425 1.00 0.00 N ATOM 467 CA CYS A 271 0.644 -6.055 -5.624 1.00 0.00 C ATOM 468 C CYS A 271 0.575 -5.063 -6.803 1.00 0.00 C ATOM 469 O CYS A 271 -0.452 -4.415 -7.022 1.00 0.00 O ATOM 470 CB CYS A 271 -0.047 -7.389 -5.961 1.00 0.00 C ATOM 471 SG CYS A 271 0.852 -8.251 -7.281 1.00 0.00 S ATOM 0 H CYS A 271 -0.842 -6.038 -4.163 1.00 0.00 H new ATOM 0 HA CYS A 271 1.706 -6.217 -5.437 1.00 0.00 H new ATOM 0 HB2 CYS A 271 -0.091 -8.018 -5.072 1.00 0.00 H new ATOM 0 HB3 CYS A 271 -1.075 -7.205 -6.273 1.00 0.00 H new ATOM 0 HG CYS A 271 0.256 -9.374 -7.550 1.00 0.00 H new ATOM 477 N GLY A 272 1.636 -5.000 -7.617 1.00 0.00 N ATOM 478 CA GLY A 272 1.722 -4.134 -8.808 1.00 0.00 C ATOM 479 C GLY A 272 0.754 -4.504 -9.942 1.00 0.00 C ATOM 480 O GLY A 272 0.580 -3.722 -10.876 1.00 0.00 O ATOM 0 H GLY A 272 2.476 -5.558 -7.467 1.00 0.00 H new ATOM 0 HA2 GLY A 272 1.530 -3.104 -8.506 1.00 0.00 H new ATOM 0 HA3 GLY A 272 2.741 -4.169 -9.193 1.00 0.00 H new ATOM 484 N ASN A 273 0.089 -5.661 -9.849 1.00 0.00 N ATOM 485 CA ASN A 273 -0.997 -6.088 -10.741 1.00 0.00 C ATOM 486 C ASN A 273 -2.371 -5.476 -10.375 1.00 0.00 C ATOM 487 O ASN A 273 -3.349 -5.693 -11.094 1.00 0.00 O ATOM 488 CB ASN A 273 -1.067 -7.626 -10.733 1.00 0.00 C ATOM 489 CG ASN A 273 0.191 -8.278 -11.303 1.00 0.00 C ATOM 490 OD1 ASN A 273 0.562 -8.049 -12.449 1.00 0.00 O ATOM 491 ND2 ASN A 273 0.867 -9.106 -10.527 1.00 0.00 N ATOM 0 H ASN A 273 0.299 -6.350 -9.126 1.00 0.00 H new ATOM 0 HA ASN A 273 -0.769 -5.719 -11.741 1.00 0.00 H new ATOM 0 HB2 ASN A 273 -1.220 -7.973 -9.711 1.00 0.00 H new ATOM 0 HB3 ASN A 273 -1.932 -7.949 -11.312 1.00 0.00 H new ATOM 0 HD21 ASN A 273 1.708 -9.563 -10.879 1.00 0.00 H new ATOM 0 HD22 ASN A 273 0.548 -9.288 -9.575 1.00 0.00 H new ATOM 498 N ILE A 274 -2.474 -4.725 -9.271 1.00 0.00 N ATOM 499 CA ILE A 274 -3.726 -4.135 -8.756 1.00 0.00 C ATOM 500 C ILE A 274 -3.740 -2.620 -9.011 1.00 0.00 C ATOM 501 O ILE A 274 -2.695 -1.967 -8.993 1.00 0.00 O ATOM 502 CB ILE A 274 -3.888 -4.487 -7.252 1.00 0.00 C ATOM 503 CG1 ILE A 274 -3.887 -6.023 -7.043 1.00 0.00 C ATOM 504 CG2 ILE A 274 -5.175 -3.872 -6.673 1.00 0.00 C ATOM 505 CD1 ILE A 274 -3.909 -6.485 -5.582 1.00 0.00 C ATOM 0 H ILE A 274 -1.666 -4.502 -8.690 1.00 0.00 H new ATOM 0 HA ILE A 274 -4.582 -4.554 -9.285 1.00 0.00 H new ATOM 0 HB ILE A 274 -3.037 -4.062 -6.719 1.00 0.00 H new ATOM 0 HG12 ILE A 274 -4.754 -6.443 -7.553 1.00 0.00 H new ATOM 0 HG13 ILE A 274 -3.002 -6.438 -7.525 1.00 0.00 H new ATOM 0 HG21 ILE A 274 -5.262 -4.135 -5.619 1.00 0.00 H new ATOM 0 HG22 ILE A 274 -5.137 -2.787 -6.774 1.00 0.00 H new ATOM 0 HG23 ILE A 274 -6.038 -4.257 -7.215 1.00 0.00 H new ATOM 0 HD11 ILE A 274 -3.907 -7.574 -5.545 1.00 0.00 H new ATOM 0 HD12 ILE A 274 -3.028 -6.102 -5.066 1.00 0.00 H new ATOM 0 HD13 ILE A 274 -4.808 -6.107 -5.094 1.00 0.00 H new ATOM 517 N ASP A 275 -4.928 -2.051 -9.235 1.00 0.00 N ATOM 518 CA ASP A 275 -5.141 -0.626 -9.498 1.00 0.00 C ATOM 519 C ASP A 275 -6.174 -0.035 -8.519 1.00 0.00 C ATOM 520 O ASP A 275 -7.229 -0.646 -8.307 1.00 0.00 O ATOM 521 CB ASP A 275 -5.605 -0.466 -10.952 1.00 0.00 C ATOM 522 CG ASP A 275 -5.610 0.998 -11.412 1.00 0.00 C ATOM 523 OD1 ASP A 275 -6.510 1.748 -10.970 1.00 0.00 O ATOM 524 OD2 ASP A 275 -4.716 1.385 -12.197 1.00 0.00 O ATOM 0 H ASP A 275 -5.796 -2.587 -9.238 1.00 0.00 H new ATOM 0 HA ASP A 275 -4.210 -0.080 -9.349 1.00 0.00 H new ATOM 0 HB2 ASP A 275 -4.951 -1.046 -11.604 1.00 0.00 H new ATOM 0 HB3 ASP A 275 -6.608 -0.879 -11.057 1.00 0.00 H new ATOM 529 N PRO A 276 -5.923 1.152 -7.935 1.00 0.00 N ATOM 530 CA PRO A 276 -6.826 1.748 -6.957 1.00 0.00 C ATOM 531 C PRO A 276 -8.202 2.149 -7.518 1.00 0.00 C ATOM 532 O PRO A 276 -9.126 2.373 -6.739 1.00 0.00 O ATOM 533 CB PRO A 276 -6.067 2.938 -6.369 1.00 0.00 C ATOM 534 CG PRO A 276 -5.060 3.314 -7.451 1.00 0.00 C ATOM 535 CD PRO A 276 -4.735 1.979 -8.110 1.00 0.00 C ATOM 0 HA PRO A 276 -7.085 1.011 -6.197 1.00 0.00 H new ATOM 0 HB2 PRO A 276 -6.739 3.767 -6.145 1.00 0.00 H new ATOM 0 HB3 PRO A 276 -5.569 2.671 -5.437 1.00 0.00 H new ATOM 0 HG2 PRO A 276 -5.482 4.022 -8.164 1.00 0.00 H new ATOM 0 HG3 PRO A 276 -4.170 3.780 -7.028 1.00 0.00 H new ATOM 0 HD2 PRO A 276 -4.502 2.111 -9.167 1.00 0.00 H new ATOM 0 HD3 PRO A 276 -3.864 1.516 -7.647 1.00 0.00 H new ATOM 543 N SER A 277 -8.380 2.182 -8.845 1.00 0.00 N ATOM 544 CA SER A 277 -9.682 2.394 -9.501 1.00 0.00 C ATOM 545 C SER A 277 -10.589 1.139 -9.474 1.00 0.00 C ATOM 546 O SER A 277 -11.790 1.250 -9.731 1.00 0.00 O ATOM 547 CB SER A 277 -9.457 2.895 -10.941 1.00 0.00 C ATOM 548 OG SER A 277 -10.603 3.550 -11.473 1.00 0.00 O ATOM 0 H SER A 277 -7.613 2.060 -9.506 1.00 0.00 H new ATOM 0 HA SER A 277 -10.218 3.153 -8.932 1.00 0.00 H new ATOM 0 HB2 SER A 277 -8.610 3.581 -10.956 1.00 0.00 H new ATOM 0 HB3 SER A 277 -9.195 2.051 -11.580 1.00 0.00 H new ATOM 0 HG SER A 277 -11.414 3.114 -11.138 1.00 0.00 H new ATOM 554 N VAL A 278 -10.057 -0.045 -9.114 1.00 0.00 N ATOM 555 CA VAL A 278 -10.826 -1.311 -9.002 1.00 0.00 C ATOM 556 C VAL A 278 -10.890 -1.868 -7.564 1.00 0.00 C ATOM 557 O VAL A 278 -11.111 -3.064 -7.368 1.00 0.00 O ATOM 558 CB VAL A 278 -10.385 -2.383 -10.035 1.00 0.00 C ATOM 559 CG1 VAL A 278 -10.529 -1.857 -11.473 1.00 0.00 C ATOM 560 CG2 VAL A 278 -8.953 -2.902 -9.829 1.00 0.00 C ATOM 0 H VAL A 278 -9.068 -0.156 -8.889 1.00 0.00 H new ATOM 0 HA VAL A 278 -11.851 -1.043 -9.259 1.00 0.00 H new ATOM 0 HB VAL A 278 -11.057 -3.225 -9.870 1.00 0.00 H new ATOM 0 HG11 VAL A 278 -10.213 -2.628 -12.176 1.00 0.00 H new ATOM 0 HG12 VAL A 278 -11.570 -1.597 -11.663 1.00 0.00 H new ATOM 0 HG13 VAL A 278 -9.905 -0.972 -11.601 1.00 0.00 H new ATOM 0 HG21 VAL A 278 -8.723 -3.647 -10.591 1.00 0.00 H new ATOM 0 HG22 VAL A 278 -8.250 -2.072 -9.909 1.00 0.00 H new ATOM 0 HG23 VAL A 278 -8.869 -3.355 -8.841 1.00 0.00 H new ATOM 570 N LEU A 279 -10.721 -1.007 -6.549 1.00 0.00 N ATOM 571 CA LEU A 279 -10.797 -1.364 -5.123 1.00 0.00 C ATOM 572 C LEU A 279 -12.050 -0.773 -4.436 1.00 0.00 C ATOM 573 O LEU A 279 -12.560 0.261 -4.885 1.00 0.00 O ATOM 574 CB LEU A 279 -9.497 -0.921 -4.420 1.00 0.00 C ATOM 575 CG LEU A 279 -8.258 -1.736 -4.846 1.00 0.00 C ATOM 576 CD1 LEU A 279 -6.990 -1.116 -4.256 1.00 0.00 C ATOM 577 CD2 LEU A 279 -8.359 -3.190 -4.353 1.00 0.00 C ATOM 0 H LEU A 279 -10.523 -0.018 -6.700 1.00 0.00 H new ATOM 0 HA LEU A 279 -10.897 -2.446 -5.041 1.00 0.00 H new ATOM 0 HB2 LEU A 279 -9.319 0.133 -4.633 1.00 0.00 H new ATOM 0 HB3 LEU A 279 -9.628 -1.011 -3.342 1.00 0.00 H new ATOM 0 HG LEU A 279 -8.214 -1.723 -5.935 1.00 0.00 H new ATOM 0 HD11 LEU A 279 -6.122 -1.700 -4.564 1.00 0.00 H new ATOM 0 HD12 LEU A 279 -6.884 -0.092 -4.615 1.00 0.00 H new ATOM 0 HD13 LEU A 279 -7.058 -1.113 -3.168 1.00 0.00 H new ATOM 0 HD21 LEU A 279 -7.473 -3.743 -4.666 1.00 0.00 H new ATOM 0 HD22 LEU A 279 -8.428 -3.201 -3.265 1.00 0.00 H new ATOM 0 HD23 LEU A 279 -9.248 -3.657 -4.778 1.00 0.00 H new ATOM 589 N PRO A 280 -12.555 -1.428 -3.367 1.00 0.00 N ATOM 590 CA PRO A 280 -13.791 -1.066 -2.677 1.00 0.00 C ATOM 591 C PRO A 280 -13.619 0.192 -1.820 1.00 0.00 C ATOM 592 O PRO A 280 -12.541 0.459 -1.293 1.00 0.00 O ATOM 593 CB PRO A 280 -14.149 -2.289 -1.821 1.00 0.00 C ATOM 594 CG PRO A 280 -12.804 -2.951 -1.538 1.00 0.00 C ATOM 595 CD PRO A 280 -11.991 -2.640 -2.785 1.00 0.00 C ATOM 0 HA PRO A 280 -14.585 -0.822 -3.383 1.00 0.00 H new ATOM 0 HB2 PRO A 280 -14.652 -1.997 -0.899 1.00 0.00 H new ATOM 0 HB3 PRO A 280 -14.822 -2.963 -2.351 1.00 0.00 H new ATOM 0 HG2 PRO A 280 -12.336 -2.544 -0.641 1.00 0.00 H new ATOM 0 HG3 PRO A 280 -12.909 -4.025 -1.384 1.00 0.00 H new ATOM 0 HD2 PRO A 280 -10.940 -2.495 -2.535 1.00 0.00 H new ATOM 0 HD3 PRO A 280 -12.039 -3.467 -3.493 1.00 0.00 H new ATOM 603 N ASP A 281 -14.702 0.953 -1.641 1.00 0.00 N ATOM 604 CA ASP A 281 -14.702 2.179 -0.826 1.00 0.00 C ATOM 605 C ASP A 281 -14.763 1.908 0.691 1.00 0.00 C ATOM 606 O ASP A 281 -14.503 2.797 1.499 1.00 0.00 O ATOM 607 CB ASP A 281 -15.850 3.084 -1.291 1.00 0.00 C ATOM 608 CG ASP A 281 -15.772 4.499 -0.691 1.00 0.00 C ATOM 609 OD1 ASP A 281 -14.675 5.107 -0.726 1.00 0.00 O ATOM 610 OD2 ASP A 281 -16.812 5.003 -0.204 1.00 0.00 O ATOM 0 H ASP A 281 -15.608 0.739 -2.057 1.00 0.00 H new ATOM 0 HA ASP A 281 -13.749 2.685 -0.980 1.00 0.00 H new ATOM 0 HB2 ASP A 281 -15.834 3.154 -2.379 1.00 0.00 H new ATOM 0 HB3 ASP A 281 -16.801 2.629 -1.014 1.00 0.00 H new ATOM 615 N ASN A 282 -15.029 0.658 1.075 1.00 0.00 N ATOM 616 CA ASN A 282 -14.955 0.147 2.449 1.00 0.00 C ATOM 617 C ASN A 282 -13.751 -0.799 2.633 1.00 0.00 C ATOM 618 O ASN A 282 -13.770 -1.663 3.513 1.00 0.00 O ATOM 619 CB ASN A 282 -16.298 -0.515 2.806 1.00 0.00 C ATOM 620 CG ASN A 282 -17.460 0.475 2.793 1.00 0.00 C ATOM 621 OD1 ASN A 282 -17.471 1.462 3.522 1.00 0.00 O ATOM 622 ND2 ASN A 282 -18.476 0.237 1.980 1.00 0.00 N ATOM 0 H ASN A 282 -15.315 -0.059 0.408 1.00 0.00 H new ATOM 0 HA ASN A 282 -14.786 0.971 3.142 1.00 0.00 H new ATOM 0 HB2 ASN A 282 -16.502 -1.319 2.099 1.00 0.00 H new ATOM 0 HB3 ASN A 282 -16.224 -0.970 3.794 1.00 0.00 H new ATOM 0 HD21 ASN A 282 -19.272 0.875 1.958 1.00 0.00 H new ATOM 0 HD22 ASN A 282 -18.464 -0.584 1.375 1.00 0.00 H new ATOM 629 N TRP A 283 -12.703 -0.651 1.809 1.00 0.00 N ATOM 630 CA TRP A 283 -11.429 -1.358 1.989 1.00 0.00 C ATOM 631 C TRP A 283 -10.871 -1.170 3.412 1.00 0.00 C ATOM 632 O TRP A 283 -10.875 -0.069 3.957 1.00 0.00 O ATOM 633 CB TRP A 283 -10.404 -0.900 0.944 1.00 0.00 C ATOM 634 CG TRP A 283 -9.186 -1.763 0.921 1.00 0.00 C ATOM 635 CD1 TRP A 283 -8.994 -2.824 0.105 1.00 0.00 C ATOM 636 CD2 TRP A 283 -8.038 -1.729 1.822 1.00 0.00 C ATOM 637 NE1 TRP A 283 -7.831 -3.476 0.466 1.00 0.00 N ATOM 638 CE2 TRP A 283 -7.219 -2.861 1.539 1.00 0.00 C ATOM 639 CE3 TRP A 283 -7.631 -0.889 2.885 1.00 0.00 C ATOM 640 CZ2 TRP A 283 -6.073 -3.152 2.287 1.00 0.00 C ATOM 641 CZ3 TRP A 283 -6.485 -1.175 3.644 1.00 0.00 C ATOM 642 CH2 TRP A 283 -5.717 -2.312 3.351 1.00 0.00 C ATOM 0 H TRP A 283 -12.717 -0.035 0.996 1.00 0.00 H new ATOM 0 HA TRP A 283 -11.621 -2.422 1.847 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -10.868 -0.906 -0.042 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -10.112 0.129 1.153 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -9.648 -3.116 -0.703 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -7.470 -4.307 -0.002 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -8.214 -0.010 3.117 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -5.469 -4.015 2.047 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -6.195 -0.520 4.453 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -4.847 -2.541 3.948 1.00 0.00 H new ATOM 653 N SER A 284 -10.361 -2.233 4.019 1.00 0.00 N ATOM 654 CA SER A 284 -9.794 -2.235 5.373 1.00 0.00 C ATOM 655 C SER A 284 -8.603 -3.192 5.448 1.00 0.00 C ATOM 656 O SER A 284 -8.393 -3.987 4.529 1.00 0.00 O ATOM 657 CB SER A 284 -10.874 -2.629 6.395 1.00 0.00 C ATOM 658 OG SER A 284 -11.361 -3.949 6.168 1.00 0.00 O ATOM 0 H SER A 284 -10.326 -3.150 3.574 1.00 0.00 H new ATOM 0 HA SER A 284 -9.441 -1.232 5.611 1.00 0.00 H new ATOM 0 HB2 SER A 284 -10.463 -2.561 7.402 1.00 0.00 H new ATOM 0 HB3 SER A 284 -11.702 -1.922 6.340 1.00 0.00 H new ATOM 0 HG SER A 284 -12.044 -4.165 6.837 1.00 0.00 H new ATOM 664 N CYS A 285 -7.842 -3.154 6.546 1.00 0.00 N ATOM 665 CA CYS A 285 -6.701 -4.056 6.760 1.00 0.00 C ATOM 666 C CYS A 285 -7.052 -5.554 6.543 1.00 0.00 C ATOM 667 O CYS A 285 -6.210 -6.336 6.106 1.00 0.00 O ATOM 668 CB CYS A 285 -6.139 -3.875 8.178 1.00 0.00 C ATOM 669 SG CYS A 285 -5.654 -2.172 8.569 1.00 0.00 S ATOM 0 H CYS A 285 -7.997 -2.499 7.312 1.00 0.00 H new ATOM 0 HA CYS A 285 -5.956 -3.783 6.013 1.00 0.00 H new ATOM 0 HB2 CYS A 285 -6.888 -4.203 8.899 1.00 0.00 H new ATOM 0 HB3 CYS A 285 -5.273 -4.525 8.300 1.00 0.00 H new ATOM 674 N ASP A 286 -8.302 -5.957 6.801 1.00 0.00 N ATOM 675 CA ASP A 286 -8.825 -7.314 6.577 1.00 0.00 C ATOM 676 C ASP A 286 -8.895 -7.719 5.084 1.00 0.00 C ATOM 677 O ASP A 286 -9.007 -8.903 4.760 1.00 0.00 O ATOM 678 CB ASP A 286 -10.209 -7.404 7.240 1.00 0.00 C ATOM 679 CG ASP A 286 -10.793 -8.828 7.231 1.00 0.00 C ATOM 680 OD1 ASP A 286 -10.256 -9.703 7.951 1.00 0.00 O ATOM 681 OD2 ASP A 286 -11.815 -9.054 6.538 1.00 0.00 O ATOM 0 H ASP A 286 -9.004 -5.325 7.186 1.00 0.00 H new ATOM 0 HA ASP A 286 -8.130 -8.024 7.026 1.00 0.00 H new ATOM 0 HB2 ASP A 286 -10.135 -7.055 8.270 1.00 0.00 H new ATOM 0 HB3 ASP A 286 -10.896 -6.733 6.725 1.00 0.00 H new ATOM 686 N GLN A 287 -8.790 -6.747 4.175 1.00 0.00 N ATOM 687 CA GLN A 287 -8.866 -6.897 2.719 1.00 0.00 C ATOM 688 C GLN A 287 -7.476 -6.770 2.053 1.00 0.00 C ATOM 689 O GLN A 287 -7.372 -6.588 0.837 1.00 0.00 O ATOM 690 CB GLN A 287 -9.888 -5.868 2.194 1.00 0.00 C ATOM 691 CG GLN A 287 -11.320 -6.211 2.639 1.00 0.00 C ATOM 692 CD GLN A 287 -12.288 -5.046 2.457 1.00 0.00 C ATOM 693 OE1 GLN A 287 -12.784 -4.773 1.372 1.00 0.00 O ATOM 694 NE2 GLN A 287 -12.588 -4.308 3.506 1.00 0.00 N ATOM 0 H GLN A 287 -8.641 -5.777 4.451 1.00 0.00 H new ATOM 0 HA GLN A 287 -9.205 -7.899 2.457 1.00 0.00 H new ATOM 0 HB2 GLN A 287 -9.623 -4.874 2.555 1.00 0.00 H new ATOM 0 HB3 GLN A 287 -9.844 -5.834 1.105 1.00 0.00 H new ATOM 0 HG2 GLN A 287 -11.678 -7.068 2.068 1.00 0.00 H new ATOM 0 HG3 GLN A 287 -11.309 -6.508 3.688 1.00 0.00 H new ATOM 0 HE21 GLN A 287 -12.181 -4.525 4.416 1.00 0.00 H new ATOM 0 HE22 GLN A 287 -13.227 -3.519 3.409 1.00 0.00 H new ATOM 703 N ASN A 288 -6.396 -6.872 2.836 1.00 0.00 N ATOM 704 CA ASN A 288 -5.010 -6.788 2.365 1.00 0.00 C ATOM 705 C ASN A 288 -4.522 -8.057 1.641 1.00 0.00 C ATOM 706 O ASN A 288 -4.972 -9.171 1.930 1.00 0.00 O ATOM 707 CB ASN A 288 -4.093 -6.458 3.555 1.00 0.00 C ATOM 708 CG ASN A 288 -2.770 -5.852 3.107 1.00 0.00 C ATOM 709 OD1 ASN A 288 -2.734 -4.965 2.269 1.00 0.00 O ATOM 710 ND2 ASN A 288 -1.649 -6.335 3.606 1.00 0.00 N ATOM 0 H ASN A 288 -6.465 -7.019 3.843 1.00 0.00 H new ATOM 0 HA ASN A 288 -4.972 -5.993 1.620 1.00 0.00 H new ATOM 0 HB2 ASN A 288 -4.602 -5.763 4.223 1.00 0.00 H new ATOM 0 HB3 ASN A 288 -3.900 -7.366 4.127 1.00 0.00 H new ATOM 0 HD21 ASN A 288 -0.751 -5.967 3.292 1.00 0.00 H new ATOM 0 HD22 ASN A 288 -1.680 -7.076 4.306 1.00 0.00 H new ATOM 717 N THR A 289 -3.546 -7.886 0.737 1.00 0.00 N ATOM 718 CA THR A 289 -2.896 -8.973 -0.021 1.00 0.00 C ATOM 719 C THR A 289 -1.702 -9.589 0.702 1.00 0.00 C ATOM 720 O THR A 289 -1.250 -10.667 0.322 1.00 0.00 O ATOM 721 CB THR A 289 -2.472 -8.478 -1.409 1.00 0.00 C ATOM 722 OG1 THR A 289 -1.685 -7.311 -1.293 1.00 0.00 O ATOM 723 CG2 THR A 289 -3.693 -8.134 -2.257 1.00 0.00 C ATOM 0 H THR A 289 -3.175 -6.965 0.505 1.00 0.00 H new ATOM 0 HA THR A 289 -3.641 -9.762 -0.120 1.00 0.00 H new ATOM 0 HB THR A 289 -1.902 -9.278 -1.882 1.00 0.00 H new ATOM 0 HG1 THR A 289 -1.419 -7.006 -2.185 1.00 0.00 H new ATOM 0 HG21 THR A 289 -3.369 -7.785 -3.237 1.00 0.00 H new ATOM 0 HG22 THR A 289 -4.315 -9.021 -2.375 1.00 0.00 H new ATOM 0 HG23 THR A 289 -4.268 -7.350 -1.765 1.00 0.00 H new ATOM 731 N ASP A 290 -1.205 -8.930 1.750 1.00 0.00 N ATOM 732 CA ASP A 290 -0.022 -9.328 2.517 1.00 0.00 C ATOM 733 C ASP A 290 -0.409 -9.762 3.942 1.00 0.00 C ATOM 734 O ASP A 290 -0.888 -8.955 4.740 1.00 0.00 O ATOM 735 CB ASP A 290 0.993 -8.166 2.537 1.00 0.00 C ATOM 736 CG ASP A 290 2.399 -8.589 2.088 1.00 0.00 C ATOM 737 OD1 ASP A 290 2.834 -9.712 2.429 1.00 0.00 O ATOM 738 OD2 ASP A 290 3.071 -7.781 1.406 1.00 0.00 O ATOM 0 H ASP A 290 -1.631 -8.072 2.101 1.00 0.00 H new ATOM 0 HA ASP A 290 0.443 -10.189 2.036 1.00 0.00 H new ATOM 0 HB2 ASP A 290 0.635 -7.367 1.887 1.00 0.00 H new ATOM 0 HB3 ASP A 290 1.048 -7.756 3.546 1.00 0.00 H new ATOM 743 N VAL A 291 -0.175 -11.037 4.266 1.00 0.00 N ATOM 744 CA VAL A 291 -0.586 -11.675 5.542 1.00 0.00 C ATOM 745 C VAL A 291 0.135 -11.111 6.773 1.00 0.00 C ATOM 746 O VAL A 291 -0.330 -11.269 7.901 1.00 0.00 O ATOM 747 CB VAL A 291 -0.397 -13.212 5.523 1.00 0.00 C ATOM 748 CG1 VAL A 291 -1.234 -13.847 4.404 1.00 0.00 C ATOM 749 CG2 VAL A 291 1.081 -13.621 5.371 1.00 0.00 C ATOM 0 H VAL A 291 0.316 -11.677 3.642 1.00 0.00 H new ATOM 0 HA VAL A 291 -1.646 -11.437 5.627 1.00 0.00 H new ATOM 0 HB VAL A 291 -0.742 -13.583 6.488 1.00 0.00 H new ATOM 0 HG11 VAL A 291 -1.087 -14.927 4.408 1.00 0.00 H new ATOM 0 HG12 VAL A 291 -2.288 -13.624 4.567 1.00 0.00 H new ATOM 0 HG13 VAL A 291 -0.922 -13.442 3.441 1.00 0.00 H new ATOM 0 HG21 VAL A 291 1.159 -14.708 5.363 1.00 0.00 H new ATOM 0 HG22 VAL A 291 1.474 -13.222 4.436 1.00 0.00 H new ATOM 0 HG23 VAL A 291 1.657 -13.222 6.206 1.00 0.00 H new ATOM 759 N GLN A 292 1.261 -10.433 6.547 1.00 0.00 N ATOM 760 CA GLN A 292 2.052 -9.743 7.563 1.00 0.00 C ATOM 761 C GLN A 292 1.358 -8.491 8.116 1.00 0.00 C ATOM 762 O GLN A 292 1.721 -8.036 9.199 1.00 0.00 O ATOM 763 CB GLN A 292 3.454 -9.426 7.010 1.00 0.00 C ATOM 764 CG GLN A 292 3.508 -9.086 5.511 1.00 0.00 C ATOM 765 CD GLN A 292 4.830 -8.455 5.070 1.00 0.00 C ATOM 766 OE1 GLN A 292 4.878 -7.352 4.545 1.00 0.00 O ATOM 767 NE2 GLN A 292 5.956 -9.116 5.260 1.00 0.00 N ATOM 0 H GLN A 292 1.662 -10.347 5.613 1.00 0.00 H new ATOM 0 HA GLN A 292 2.154 -10.416 8.414 1.00 0.00 H new ATOM 0 HB2 GLN A 292 3.867 -8.588 7.571 1.00 0.00 H new ATOM 0 HB3 GLN A 292 4.102 -10.283 7.195 1.00 0.00 H new ATOM 0 HG2 GLN A 292 3.340 -9.996 4.935 1.00 0.00 H new ATOM 0 HG3 GLN A 292 2.693 -8.403 5.273 1.00 0.00 H new ATOM 0 HE21 GLN A 292 5.939 -10.038 5.696 1.00 0.00 H new ATOM 0 HE22 GLN A 292 6.844 -8.705 4.971 1.00 0.00 H new ATOM 776 N TYR A 293 0.341 -7.967 7.419 1.00 0.00 N ATOM 777 CA TYR A 293 -0.406 -6.760 7.806 1.00 0.00 C ATOM 778 C TYR A 293 -1.911 -6.849 7.468 1.00 0.00 C ATOM 779 O TYR A 293 -2.577 -5.837 7.248 1.00 0.00 O ATOM 780 CB TYR A 293 0.266 -5.516 7.199 1.00 0.00 C ATOM 781 CG TYR A 293 1.691 -5.266 7.654 1.00 0.00 C ATOM 782 CD1 TYR A 293 1.930 -4.524 8.824 1.00 0.00 C ATOM 783 CD2 TYR A 293 2.779 -5.786 6.927 1.00 0.00 C ATOM 784 CE1 TYR A 293 3.245 -4.306 9.278 1.00 0.00 C ATOM 785 CE2 TYR A 293 4.095 -5.586 7.378 1.00 0.00 C ATOM 786 CZ TYR A 293 4.335 -4.844 8.557 1.00 0.00 C ATOM 787 OH TYR A 293 5.611 -4.656 8.996 1.00 0.00 O ATOM 0 H TYR A 293 0.006 -8.380 6.549 1.00 0.00 H new ATOM 0 HA TYR A 293 -0.369 -6.674 8.892 1.00 0.00 H new ATOM 0 HB2 TYR A 293 0.260 -5.613 6.113 1.00 0.00 H new ATOM 0 HB3 TYR A 293 -0.336 -4.641 7.445 1.00 0.00 H new ATOM 0 HD1 TYR A 293 1.098 -4.118 9.379 1.00 0.00 H new ATOM 0 HD2 TYR A 293 2.601 -6.341 6.018 1.00 0.00 H new ATOM 0 HE1 TYR A 293 3.420 -3.730 10.174 1.00 0.00 H new ATOM 0 HE2 TYR A 293 4.924 -6.000 6.823 1.00 0.00 H new ATOM 0 HH TYR A 293 6.236 -5.094 8.382 1.00 0.00 H new ATOM 797 N ASN A 294 -2.466 -8.067 7.430 1.00 0.00 N ATOM 798 CA ASN A 294 -3.856 -8.342 7.032 1.00 0.00 C ATOM 799 C ASN A 294 -4.897 -8.197 8.170 1.00 0.00 C ATOM 800 O ASN A 294 -5.988 -8.767 8.090 1.00 0.00 O ATOM 801 CB ASN A 294 -3.942 -9.701 6.313 1.00 0.00 C ATOM 802 CG ASN A 294 -3.841 -10.915 7.239 1.00 0.00 C ATOM 803 OD1 ASN A 294 -3.453 -10.828 8.398 1.00 0.00 O ATOM 804 ND2 ASN A 294 -4.198 -12.088 6.749 1.00 0.00 N ATOM 0 H ASN A 294 -1.950 -8.910 7.681 1.00 0.00 H new ATOM 0 HA ASN A 294 -4.138 -7.557 6.330 1.00 0.00 H new ATOM 0 HB2 ASN A 294 -4.886 -9.752 5.770 1.00 0.00 H new ATOM 0 HB3 ASN A 294 -3.144 -9.757 5.572 1.00 0.00 H new ATOM 0 HD21 ASN A 294 -4.151 -12.921 7.335 1.00 0.00 H new ATOM 0 HD22 ASN A 294 -4.521 -12.161 5.784 1.00 0.00 H new ATOM 811 N ARG A 295 -4.554 -7.466 9.239 1.00 0.00 N ATOM 812 CA ARG A 295 -5.397 -7.225 10.414 1.00 0.00 C ATOM 813 C ARG A 295 -5.224 -5.811 10.961 1.00 0.00 C ATOM 814 O ARG A 295 -4.107 -5.322 11.117 1.00 0.00 O ATOM 815 CB ARG A 295 -5.026 -8.215 11.526 1.00 0.00 C ATOM 816 CG ARG A 295 -5.851 -9.504 11.470 1.00 0.00 C ATOM 817 CD ARG A 295 -5.373 -10.447 12.578 1.00 0.00 C ATOM 818 NE ARG A 295 -6.250 -11.624 12.708 1.00 0.00 N ATOM 819 CZ ARG A 295 -6.154 -12.578 13.628 1.00 0.00 C ATOM 820 NH1 ARG A 295 -5.213 -12.565 14.549 1.00 0.00 N ATOM 821 NH2 ARG A 295 -7.018 -13.569 13.630 1.00 0.00 N ATOM 0 H ARG A 295 -3.645 -7.009 9.310 1.00 0.00 H new ATOM 0 HA ARG A 295 -6.433 -7.355 10.100 1.00 0.00 H new ATOM 0 HB2 ARG A 295 -3.967 -8.463 11.448 1.00 0.00 H new ATOM 0 HB3 ARG A 295 -5.171 -7.738 12.495 1.00 0.00 H new ATOM 0 HG2 ARG A 295 -6.910 -9.280 11.597 1.00 0.00 H new ATOM 0 HG3 ARG A 295 -5.741 -9.980 10.496 1.00 0.00 H new ATOM 0 HD2 ARG A 295 -4.355 -10.773 12.364 1.00 0.00 H new ATOM 0 HD3 ARG A 295 -5.343 -9.909 13.526 1.00 0.00 H new ATOM 0 HE ARG A 295 -7.003 -11.715 12.026 1.00 0.00 H new ATOM 0 HH11 ARG A 295 -4.530 -11.807 14.570 1.00 0.00 H new ATOM 0 HH12 ARG A 295 -5.167 -13.313 15.241 1.00 0.00 H new ATOM 0 HH21 ARG A 295 -7.757 -13.603 12.928 1.00 0.00 H new ATOM 0 HH22 ARG A 295 -6.949 -14.304 14.334 1.00 0.00 H new ATOM 835 N CYS A 296 -6.339 -5.214 11.368 1.00 0.00 N ATOM 836 CA CYS A 296 -6.423 -3.903 12.013 1.00 0.00 C ATOM 837 C CYS A 296 -5.702 -3.791 13.376 1.00 0.00 C ATOM 838 O CYS A 296 -5.436 -2.688 13.859 1.00 0.00 O ATOM 839 CB CYS A 296 -7.916 -3.607 12.173 1.00 0.00 C ATOM 840 SG CYS A 296 -8.547 -2.763 10.693 1.00 0.00 S ATOM 0 H CYS A 296 -7.254 -5.650 11.253 1.00 0.00 H new ATOM 0 HA CYS A 296 -5.903 -3.179 11.386 1.00 0.00 H new ATOM 0 HB2 CYS A 296 -8.464 -4.536 12.333 1.00 0.00 H new ATOM 0 HB3 CYS A 296 -8.079 -2.985 13.053 1.00 0.00 H new ATOM 845 N ASP A 297 -5.362 -4.930 13.984 1.00 0.00 N ATOM 846 CA ASP A 297 -4.663 -5.021 15.268 1.00 0.00 C ATOM 847 C ASP A 297 -3.135 -5.075 15.074 1.00 0.00 C ATOM 848 O ASP A 297 -2.377 -5.117 16.041 1.00 0.00 O ATOM 849 CB ASP A 297 -5.235 -6.240 16.007 1.00 0.00 C ATOM 850 CG ASP A 297 -4.766 -6.340 17.470 1.00 0.00 C ATOM 851 OD1 ASP A 297 -5.060 -5.412 18.262 1.00 0.00 O ATOM 852 OD2 ASP A 297 -4.147 -7.370 17.832 1.00 0.00 O ATOM 0 H ASP A 297 -5.573 -5.844 13.583 1.00 0.00 H new ATOM 0 HA ASP A 297 -4.828 -4.130 15.874 1.00 0.00 H new ATOM 0 HB2 ASP A 297 -6.324 -6.192 15.984 1.00 0.00 H new ATOM 0 HB3 ASP A 297 -4.945 -7.147 15.477 1.00 0.00 H new ATOM 857 N ILE A 298 -2.684 -5.041 13.813 1.00 0.00 N ATOM 858 CA ILE A 298 -1.275 -5.019 13.429 1.00 0.00 C ATOM 859 C ILE A 298 -0.858 -3.570 13.142 1.00 0.00 C ATOM 860 O ILE A 298 -1.554 -2.887 12.380 1.00 0.00 O ATOM 861 CB ILE A 298 -1.004 -5.926 12.211 1.00 0.00 C ATOM 862 CG1 ILE A 298 -1.505 -7.356 12.506 1.00 0.00 C ATOM 863 CG2 ILE A 298 0.497 -5.933 11.883 1.00 0.00 C ATOM 864 CD1 ILE A 298 -1.252 -8.372 11.384 1.00 0.00 C ATOM 0 H ILE A 298 -3.313 -5.028 13.010 1.00 0.00 H new ATOM 0 HA ILE A 298 -0.678 -5.412 14.252 1.00 0.00 H new ATOM 0 HB ILE A 298 -1.542 -5.539 11.345 1.00 0.00 H new ATOM 0 HG12 ILE A 298 -1.023 -7.714 13.416 1.00 0.00 H new ATOM 0 HG13 ILE A 298 -2.576 -7.316 12.706 1.00 0.00 H new ATOM 0 HG21 ILE A 298 0.678 -6.576 11.022 1.00 0.00 H new ATOM 0 HG22 ILE A 298 0.824 -4.919 11.654 1.00 0.00 H new ATOM 0 HG23 ILE A 298 1.055 -6.309 12.740 1.00 0.00 H new ATOM 0 HD11 ILE A 298 -1.638 -9.347 11.682 1.00 0.00 H new ATOM 0 HD12 ILE A 298 -1.757 -8.044 10.476 1.00 0.00 H new ATOM 0 HD13 ILE A 298 -0.181 -8.448 11.196 1.00 0.00 H new ATOM 876 N PRO A 299 0.274 -3.108 13.702 1.00 0.00 N ATOM 877 CA PRO A 299 0.781 -1.751 13.527 1.00 0.00 C ATOM 878 C PRO A 299 1.121 -1.441 12.065 1.00 0.00 C ATOM 879 O PRO A 299 1.340 -2.344 11.259 1.00 0.00 O ATOM 880 CB PRO A 299 2.014 -1.667 14.430 1.00 0.00 C ATOM 881 CG PRO A 299 2.495 -3.109 14.564 1.00 0.00 C ATOM 882 CD PRO A 299 1.193 -3.901 14.505 1.00 0.00 C ATOM 0 HA PRO A 299 0.030 -1.008 13.796 1.00 0.00 H new ATOM 0 HB2 PRO A 299 2.784 -1.032 13.991 1.00 0.00 H new ATOM 0 HB3 PRO A 299 1.765 -1.241 15.402 1.00 0.00 H new ATOM 0 HG2 PRO A 299 3.175 -3.386 13.758 1.00 0.00 H new ATOM 0 HG3 PRO A 299 3.027 -3.273 15.501 1.00 0.00 H new ATOM 0 HD2 PRO A 299 1.354 -4.882 14.058 1.00 0.00 H new ATOM 0 HD3 PRO A 299 0.793 -4.068 15.505 1.00 0.00 H new ATOM 890 N GLU A 300 1.156 -0.153 11.713 1.00 0.00 N ATOM 891 CA GLU A 300 1.500 0.323 10.378 1.00 0.00 C ATOM 892 C GLU A 300 2.969 -0.008 10.027 1.00 0.00 C ATOM 893 O GLU A 300 3.864 0.135 10.866 1.00 0.00 O ATOM 894 CB GLU A 300 1.231 1.836 10.327 1.00 0.00 C ATOM 895 CG GLU A 300 0.838 2.233 8.910 1.00 0.00 C ATOM 896 CD GLU A 300 0.814 3.751 8.698 1.00 0.00 C ATOM 897 OE1 GLU A 300 1.831 4.434 8.962 1.00 0.00 O ATOM 898 OE2 GLU A 300 -0.231 4.261 8.237 1.00 0.00 O ATOM 0 H GLU A 300 0.941 0.601 12.365 1.00 0.00 H new ATOM 0 HA GLU A 300 0.886 -0.182 9.632 1.00 0.00 H new ATOM 0 HB2 GLU A 300 0.435 2.099 11.024 1.00 0.00 H new ATOM 0 HB3 GLU A 300 2.120 2.385 10.637 1.00 0.00 H new ATOM 0 HG2 GLU A 300 1.538 1.784 8.205 1.00 0.00 H new ATOM 0 HG3 GLU A 300 -0.147 1.825 8.684 1.00 0.00 H new ATOM 905 N GLU A 301 3.226 -0.453 8.791 1.00 0.00 N ATOM 906 CA GLU A 301 4.576 -0.793 8.321 1.00 0.00 C ATOM 907 C GLU A 301 5.475 0.453 8.244 1.00 0.00 C ATOM 908 O GLU A 301 5.047 1.524 7.796 1.00 0.00 O ATOM 909 CB GLU A 301 4.505 -1.505 6.959 1.00 0.00 C ATOM 910 CG GLU A 301 5.889 -1.941 6.446 1.00 0.00 C ATOM 911 CD GLU A 301 5.841 -2.837 5.196 1.00 0.00 C ATOM 912 OE1 GLU A 301 4.848 -2.792 4.434 1.00 0.00 O ATOM 913 OE2 GLU A 301 6.838 -3.559 4.951 1.00 0.00 O ATOM 0 H GLU A 301 2.502 -0.588 8.086 1.00 0.00 H new ATOM 0 HA GLU A 301 5.024 -1.474 9.045 1.00 0.00 H new ATOM 0 HB2 GLU A 301 3.861 -2.380 7.044 1.00 0.00 H new ATOM 0 HB3 GLU A 301 4.044 -0.840 6.229 1.00 0.00 H new ATOM 0 HG2 GLU A 301 6.478 -1.052 6.220 1.00 0.00 H new ATOM 0 HG3 GLU A 301 6.409 -2.474 7.242 1.00 0.00 H new ATOM 920 N THR A 302 6.742 0.287 8.647 1.00 0.00 N ATOM 921 CA THR A 302 7.791 1.315 8.565 1.00 0.00 C ATOM 922 C THR A 302 8.290 1.416 7.124 1.00 0.00 C ATOM 923 O THR A 302 9.277 0.788 6.741 1.00 0.00 O ATOM 924 CB THR A 302 8.928 1.029 9.561 1.00 0.00 C ATOM 925 OG1 THR A 302 8.370 0.830 10.845 1.00 0.00 O ATOM 926 CG2 THR A 302 9.909 2.201 9.657 1.00 0.00 C ATOM 0 H THR A 302 7.075 -0.589 9.050 1.00 0.00 H new ATOM 0 HA THR A 302 7.375 2.282 8.848 1.00 0.00 H new ATOM 0 HB THR A 302 9.464 0.148 9.209 1.00 0.00 H new ATOM 0 HG1 THR A 302 9.086 0.645 11.488 1.00 0.00 H new ATOM 0 HG21 THR A 302 10.697 1.959 10.371 1.00 0.00 H new ATOM 0 HG22 THR A 302 10.351 2.387 8.678 1.00 0.00 H new ATOM 0 HG23 THR A 302 9.379 3.093 9.991 1.00 0.00 H new ATOM 934 N TRP A 303 7.590 2.210 6.313 1.00 0.00 N ATOM 935 CA TRP A 303 7.887 2.432 4.889 1.00 0.00 C ATOM 936 C TRP A 303 8.959 3.506 4.629 1.00 0.00 C ATOM 937 O TRP A 303 9.328 3.775 3.482 1.00 0.00 O ATOM 938 CB TRP A 303 6.571 2.745 4.156 1.00 0.00 C ATOM 939 CG TRP A 303 5.962 4.077 4.488 1.00 0.00 C ATOM 940 CD1 TRP A 303 5.168 4.335 5.551 1.00 0.00 C ATOM 941 CD2 TRP A 303 6.109 5.354 3.787 1.00 0.00 C ATOM 942 NE1 TRP A 303 4.837 5.675 5.575 1.00 0.00 N ATOM 943 CE2 TRP A 303 5.401 6.355 4.518 1.00 0.00 C ATOM 944 CE3 TRP A 303 6.771 5.769 2.612 1.00 0.00 C ATOM 945 CZ2 TRP A 303 5.364 7.698 4.113 1.00 0.00 C ATOM 946 CZ3 TRP A 303 6.733 7.112 2.189 1.00 0.00 C ATOM 947 CH2 TRP A 303 6.038 8.076 2.939 1.00 0.00 C ATOM 0 H TRP A 303 6.776 2.734 6.634 1.00 0.00 H new ATOM 0 HA TRP A 303 8.328 1.516 4.495 1.00 0.00 H new ATOM 0 HB2 TRP A 303 6.752 2.702 3.082 1.00 0.00 H new ATOM 0 HB3 TRP A 303 5.848 1.963 4.389 1.00 0.00 H new ATOM 0 HD1 TRP A 303 4.841 3.602 6.274 1.00 0.00 H new ATOM 0 HE1 TRP A 303 4.248 6.108 6.287 1.00 0.00 H new ATOM 0 HE3 TRP A 303 7.317 5.044 2.026 1.00 0.00 H new ATOM 0 HZ2 TRP A 303 4.825 8.431 4.695 1.00 0.00 H new ATOM 0 HZ3 TRP A 303 7.242 7.403 1.282 1.00 0.00 H new ATOM 0 HH2 TRP A 303 6.022 9.106 2.614 1.00 0.00 H new ATOM 958 N THR A 304 9.462 4.105 5.707 1.00 0.00 N ATOM 959 CA THR A 304 10.411 5.225 5.744 1.00 0.00 C ATOM 960 C THR A 304 11.818 4.724 6.060 1.00 0.00 C ATOM 961 O THR A 304 12.025 3.974 7.014 1.00 0.00 O ATOM 962 CB THR A 304 9.961 6.282 6.765 1.00 0.00 C ATOM 963 OG1 THR A 304 9.691 5.674 8.013 1.00 0.00 O ATOM 964 CG2 THR A 304 8.685 6.991 6.302 1.00 0.00 C ATOM 0 H THR A 304 9.201 3.802 6.645 1.00 0.00 H new ATOM 0 HA THR A 304 10.431 5.694 4.760 1.00 0.00 H new ATOM 0 HB THR A 304 10.770 7.006 6.858 1.00 0.00 H new ATOM 0 HG1 THR A 304 10.388 5.015 8.214 1.00 0.00 H new ATOM 0 HG21 THR A 304 8.391 7.733 7.045 1.00 0.00 H new ATOM 0 HG22 THR A 304 8.869 7.485 5.348 1.00 0.00 H new ATOM 0 HG23 THR A 304 7.885 6.260 6.183 1.00 0.00 H new ATOM 972 N GLY A 305 12.793 5.147 5.257 1.00 0.00 N ATOM 973 CA GLY A 305 14.202 4.762 5.375 1.00 0.00 C ATOM 974 C GLY A 305 15.106 5.419 4.333 1.00 0.00 C ATOM 975 O GLY A 305 14.638 6.150 3.457 1.00 0.00 O ATOM 0 H GLY A 305 12.621 5.787 4.482 1.00 0.00 H new ATOM 0 HA2 GLY A 305 14.559 5.024 6.371 1.00 0.00 H new ATOM 0 HA3 GLY A 305 14.283 3.679 5.283 1.00 0.00 H new ATOM 979 N LEU A 306 16.411 5.149 4.432 1.00 0.00 N ATOM 980 CA LEU A 306 17.475 5.718 3.595 1.00 0.00 C ATOM 981 C LEU A 306 18.715 4.805 3.619 1.00 0.00 C ATOM 982 O LEU A 306 18.969 4.128 4.618 1.00 0.00 O ATOM 983 CB LEU A 306 17.772 7.156 4.081 1.00 0.00 C ATOM 984 CG LEU A 306 18.744 7.980 3.212 1.00 0.00 C ATOM 985 CD1 LEU A 306 18.230 8.169 1.777 1.00 0.00 C ATOM 986 CD2 LEU A 306 18.956 9.356 3.858 1.00 0.00 C ATOM 0 H LEU A 306 16.772 4.498 5.129 1.00 0.00 H new ATOM 0 HA LEU A 306 17.159 5.777 2.553 1.00 0.00 H new ATOM 0 HB2 LEU A 306 16.828 7.697 4.147 1.00 0.00 H new ATOM 0 HB3 LEU A 306 18.179 7.100 5.091 1.00 0.00 H new ATOM 0 HG LEU A 306 19.683 7.429 3.155 1.00 0.00 H new ATOM 0 HD11 LEU A 306 18.950 8.755 1.207 1.00 0.00 H new ATOM 0 HD12 LEU A 306 18.101 7.195 1.306 1.00 0.00 H new ATOM 0 HD13 LEU A 306 17.273 8.691 1.799 1.00 0.00 H new ATOM 0 HD21 LEU A 306 19.643 9.943 3.248 1.00 0.00 H new ATOM 0 HD22 LEU A 306 18.000 9.875 3.930 1.00 0.00 H new ATOM 0 HD23 LEU A 306 19.376 9.229 4.856 1.00 0.00 H new ATOM 998 N GLU A 307 19.479 4.782 2.524 1.00 0.00 N ATOM 999 CA GLU A 307 20.630 3.880 2.282 1.00 0.00 C ATOM 1000 C GLU A 307 21.833 4.565 1.605 1.00 0.00 C ATOM 1001 O GLU A 307 22.978 4.112 1.842 1.00 0.00 O ATOM 1002 CB GLU A 307 20.162 2.633 1.501 1.00 0.00 C ATOM 1003 CG GLU A 307 19.691 2.912 0.062 1.00 0.00 C ATOM 1004 CD GLU A 307 19.245 1.612 -0.648 1.00 0.00 C ATOM 1005 OE1 GLU A 307 20.100 0.921 -1.259 1.00 0.00 O ATOM 1006 OE2 GLU A 307 18.034 1.276 -0.621 1.00 0.00 O ATOM 1007 OXT GLU A 307 21.634 5.564 0.872 1.00 0.00 O ATOM 0 H GLU A 307 19.313 5.416 1.742 1.00 0.00 H new ATOM 0 HA GLU A 307 21.004 3.573 3.259 1.00 0.00 H new ATOM 0 HB2 GLU A 307 20.981 1.914 1.467 1.00 0.00 H new ATOM 0 HB3 GLU A 307 19.347 2.162 2.050 1.00 0.00 H new ATOM 0 HG2 GLU A 307 18.863 3.621 0.080 1.00 0.00 H new ATOM 0 HG3 GLU A 307 20.498 3.378 -0.503 1.00 0.00 H new TER 1014 GLU A 307 ATOM 1015 N ALA B 1 -12.572 4.856 1.168 1.00 0.00 N ATOM 1016 CA ALA B 1 -11.207 4.277 1.188 1.00 0.00 C ATOM 1017 C ALA B 1 -10.236 5.191 0.438 1.00 0.00 C ATOM 1018 O ALA B 1 -10.377 5.385 -0.772 1.00 0.00 O ATOM 1019 CB ALA B 1 -11.177 2.848 0.607 1.00 0.00 C ATOM 0 H1 ALA B 1 -13.258 4.139 1.479 1.00 0.00 H new ATOM 0 H2 ALA B 1 -12.611 5.674 1.809 1.00 0.00 H new ATOM 0 H3 ALA B 1 -12.805 5.162 0.202 1.00 0.00 H new ATOM 0 HA ALA B 1 -10.892 4.204 2.229 1.00 0.00 H new ATOM 0 HB1 ALA B 1 -10.158 2.463 0.641 1.00 0.00 H new ATOM 0 HB2 ALA B 1 -11.829 2.202 1.195 1.00 0.00 H new ATOM 0 HB3 ALA B 1 -11.523 2.868 -0.426 1.00 0.00 H new ATOM 1027 N ARG B 2 -9.248 5.762 1.142 1.00 0.00 N ATOM 1028 CA ARG B 2 -8.163 6.546 0.527 1.00 0.00 C ATOM 1029 C ARG B 2 -7.148 5.634 -0.170 1.00 0.00 C ATOM 1030 O ARG B 2 -6.919 4.491 0.239 1.00 0.00 O ATOM 1031 CB ARG B 2 -7.450 7.418 1.576 1.00 0.00 C ATOM 1032 CG ARG B 2 -7.783 8.915 1.507 1.00 0.00 C ATOM 1033 CD ARG B 2 -7.078 9.630 0.349 1.00 0.00 C ATOM 1034 NE ARG B 2 -7.303 11.084 0.418 1.00 0.00 N ATOM 1035 CZ ARG B 2 -6.690 12.015 -0.305 1.00 0.00 C ATOM 1036 NH1 ARG B 2 -5.797 11.714 -1.227 1.00 0.00 N ATOM 1037 NH2 ARG B 2 -6.975 13.284 -0.105 1.00 0.00 N ATOM 0 H ARG B 2 -9.177 5.694 2.157 1.00 0.00 H new ATOM 0 HA ARG B 2 -8.615 7.197 -0.221 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -7.707 7.049 2.569 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -6.373 7.294 1.459 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -8.861 9.038 1.401 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -7.499 9.389 2.447 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -6.009 9.421 0.383 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -7.448 9.245 -0.601 1.00 0.00 H new ATOM 0 HE ARG B 2 -8.000 11.409 1.088 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -5.556 10.739 -1.405 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -5.347 12.456 -1.763 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -7.662 13.547 0.601 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -6.509 14.004 -0.656 1.00 0.00 H new ATOM 1051 N THR B 3 -6.508 6.194 -1.192 1.00 0.00 N ATOM 1052 CA THR B 3 -5.577 5.534 -2.119 1.00 0.00 C ATOM 1053 C THR B 3 -4.463 6.490 -2.509 1.00 0.00 C ATOM 1054 O THR B 3 -4.689 7.690 -2.674 1.00 0.00 O ATOM 1055 CB THR B 3 -6.303 5.052 -3.385 1.00 0.00 C ATOM 1056 OG1 THR B 3 -7.220 6.025 -3.843 1.00 0.00 O ATOM 1057 CG2 THR B 3 -7.061 3.754 -3.133 1.00 0.00 C ATOM 0 H THR B 3 -6.629 7.182 -1.414 1.00 0.00 H new ATOM 0 HA THR B 3 -5.155 4.668 -1.609 1.00 0.00 H new ATOM 0 HB THR B 3 -5.537 4.881 -4.141 1.00 0.00 H new ATOM 0 HG1 THR B 3 -7.669 5.697 -4.650 1.00 0.00 H new ATOM 0 HG21 THR B 3 -7.563 3.442 -4.049 1.00 0.00 H new ATOM 0 HG22 THR B 3 -6.361 2.979 -2.820 1.00 0.00 H new ATOM 0 HG23 THR B 3 -7.802 3.912 -2.349 1.00 0.00 H new HETATM 1065 N M3L B 4 -3.270 5.926 -2.687 1.00 0.00 N HETATM 1066 CA M3L B 4 -2.079 6.598 -3.235 1.00 0.00 C HETATM 1067 CB M3L B 4 -1.340 7.369 -2.113 1.00 0.00 C HETATM 1068 CG M3L B 4 -0.477 6.462 -1.223 1.00 0.00 C HETATM 1069 CD M3L B 4 0.244 7.217 -0.103 1.00 0.00 C HETATM 1070 CE M3L B 4 1.318 6.274 0.486 1.00 0.00 C HETATM 1071 NZ M3L B 4 2.026 6.772 1.679 1.00 0.00 N HETATM 1072 C M3L B 4 -1.156 5.630 -3.994 1.00 0.00 C HETATM 1073 O M3L B 4 -1.368 4.417 -4.013 1.00 0.00 O HETATM 1074 CM1 M3L B 4 1.116 7.008 2.796 1.00 0.00 C HETATM 1075 CM2 M3L B 4 2.763 8.003 1.400 1.00 0.00 C HETATM 1076 CM3 M3L B 4 2.976 5.744 2.092 1.00 0.00 C HETATM 0 HM33 M3L B 4 2.439 4.825 2.326 1.00 0.00 H new HETATM 0 HM32 M3L B 4 3.682 5.555 1.283 1.00 0.00 H new HETATM 0 HM31 M3L B 4 3.518 6.083 2.975 1.00 0.00 H new HETATM 0 HM23 M3L B 4 3.500 7.817 0.619 1.00 0.00 H new HETATM 0 HM22 M3L B 4 2.069 8.775 1.068 1.00 0.00 H new HETATM 0 HM21 M3L B 4 3.270 8.336 2.305 1.00 0.00 H new HETATM 0 HM13 M3L B 4 0.371 7.750 2.508 1.00 0.00 H new HETATM 0 HM12 M3L B 4 0.616 6.076 3.061 1.00 0.00 H new HETATM 0 HM11 M3L B 4 1.680 7.374 3.654 1.00 0.00 H new HETATM 0 HG3 M3L B 4 -1.109 5.690 -0.783 1.00 0.00 H new HETATM 0 HG2 M3L B 4 0.262 5.954 -1.843 1.00 0.00 H new HETATM 0 HE3 M3L B 4 0.843 5.326 0.738 1.00 0.00 H new HETATM 0 HE2 M3L B 4 2.055 6.065 -0.289 1.00 0.00 H new HETATM 0 HD3 M3L B 4 0.704 8.126 -0.490 1.00 0.00 H new HETATM 0 HD2 M3L B 4 -0.463 7.521 0.669 1.00 0.00 H new HETATM 0 HB3 M3L B 4 -0.707 8.134 -2.563 1.00 0.00 H new HETATM 0 HB2 M3L B 4 -2.072 7.885 -1.493 1.00 0.00 H new HETATM 0 HA M3L B 4 -2.411 7.323 -3.978 1.00 0.00 H new ATOM 1096 N GLN B 5 -0.090 6.184 -4.559 1.00 0.00 N ATOM 1097 CA GLN B 5 1.023 5.454 -5.169 1.00 0.00 C ATOM 1098 C GLN B 5 2.345 6.095 -4.715 1.00 0.00 C ATOM 1099 O GLN B 5 2.368 7.276 -4.349 1.00 0.00 O ATOM 1100 CB GLN B 5 0.902 5.488 -6.704 1.00 0.00 C ATOM 1101 CG GLN B 5 -0.400 4.856 -7.232 1.00 0.00 C ATOM 1102 CD GLN B 5 -0.477 4.803 -8.762 1.00 0.00 C ATOM 1103 OE1 GLN B 5 0.153 5.565 -9.486 1.00 0.00 O ATOM 1104 NE2 GLN B 5 -1.257 3.900 -9.320 1.00 0.00 N ATOM 0 H GLN B 5 0.031 7.196 -4.608 1.00 0.00 H new ATOM 0 HA GLN B 5 1.000 4.411 -4.852 1.00 0.00 H new ATOM 0 HB2 GLN B 5 0.957 6.523 -7.042 1.00 0.00 H new ATOM 0 HB3 GLN B 5 1.753 4.965 -7.139 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -0.490 3.844 -6.836 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -1.250 5.423 -6.853 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -1.790 3.256 -8.736 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -1.328 3.845 -10.336 1.00 0.00 H new ATOM 1113 N THR B 6 3.448 5.335 -4.758 1.00 0.00 N ATOM 1114 CA THR B 6 4.798 5.819 -4.425 1.00 0.00 C ATOM 1115 C THR B 6 5.839 5.333 -5.434 1.00 0.00 C ATOM 1116 O THR B 6 5.593 4.409 -6.212 1.00 0.00 O ATOM 1117 CB THR B 6 5.155 5.499 -2.969 1.00 0.00 C ATOM 1118 OG1 THR B 6 6.318 6.217 -2.623 1.00 0.00 O ATOM 1119 CG2 THR B 6 5.408 4.015 -2.711 1.00 0.00 C ATOM 0 H THR B 6 3.429 4.352 -5.029 1.00 0.00 H new ATOM 0 HA THR B 6 4.802 6.906 -4.506 1.00 0.00 H new ATOM 0 HB THR B 6 4.296 5.786 -2.362 1.00 0.00 H new ATOM 0 HG1 THR B 6 6.557 6.023 -1.693 1.00 0.00 H new ATOM 0 HG21 THR B 6 5.655 3.865 -1.660 1.00 0.00 H new ATOM 0 HG22 THR B 6 4.512 3.445 -2.958 1.00 0.00 H new ATOM 0 HG23 THR B 6 6.237 3.674 -3.331 1.00 0.00 H new ATOM 1127 N ALA B 7 7.011 5.968 -5.411 1.00 0.00 N ATOM 1128 CA ALA B 7 8.105 5.804 -6.378 1.00 0.00 C ATOM 1129 C ALA B 7 8.897 4.481 -6.248 1.00 0.00 C ATOM 1130 O ALA B 7 9.812 4.226 -7.039 1.00 0.00 O ATOM 1131 CB ALA B 7 9.017 7.033 -6.253 1.00 0.00 C ATOM 0 H ALA B 7 7.238 6.645 -4.683 1.00 0.00 H new ATOM 0 HA ALA B 7 7.668 5.735 -7.374 1.00 0.00 H new ATOM 0 HB1 ALA B 7 9.843 6.946 -6.958 1.00 0.00 H new ATOM 0 HB2 ALA B 7 8.445 7.934 -6.473 1.00 0.00 H new ATOM 0 HB3 ALA B 7 9.411 7.092 -5.238 1.00 0.00 H new ATOM 1137 N ARG B 8 8.547 3.634 -5.272 1.00 0.00 N ATOM 1138 CA ARG B 8 9.056 2.265 -5.123 1.00 0.00 C ATOM 1139 C ARG B 8 8.790 1.439 -6.393 1.00 0.00 C ATOM 1140 O ARG B 8 7.660 1.384 -6.884 1.00 0.00 O ATOM 1141 CB ARG B 8 8.380 1.595 -3.919 1.00 0.00 C ATOM 1142 CG ARG B 8 8.746 2.163 -2.538 1.00 0.00 C ATOM 1143 CD ARG B 8 10.160 1.766 -2.099 1.00 0.00 C ATOM 1144 NE ARG B 8 10.371 2.056 -0.668 1.00 0.00 N ATOM 1145 CZ ARG B 8 10.184 1.219 0.349 1.00 0.00 C ATOM 1146 NH1 ARG B 8 9.782 -0.024 0.175 1.00 0.00 N ATOM 1147 NH2 ARG B 8 10.403 1.624 1.579 1.00 0.00 N ATOM 0 H ARG B 8 7.882 3.890 -4.542 1.00 0.00 H new ATOM 0 HA ARG B 8 10.133 2.311 -4.963 1.00 0.00 H new ATOM 0 HB2 ARG B 8 7.300 1.670 -4.046 1.00 0.00 H new ATOM 0 HB3 ARG B 8 8.630 0.534 -3.931 1.00 0.00 H new ATOM 0 HG2 ARG B 8 8.668 3.250 -2.563 1.00 0.00 H new ATOM 0 HG3 ARG B 8 8.026 1.809 -1.800 1.00 0.00 H new ATOM 0 HD2 ARG B 8 10.318 0.704 -2.285 1.00 0.00 H new ATOM 0 HD3 ARG B 8 10.895 2.307 -2.695 1.00 0.00 H new ATOM 0 HE ARG B 8 10.693 2.995 -0.434 1.00 0.00 H new ATOM 0 HH11 ARG B 8 9.603 -0.375 -0.766 1.00 0.00 H new ATOM 0 HH12 ARG B 8 9.650 -0.635 0.981 1.00 0.00 H new ATOM 0 HH21 ARG B 8 10.716 2.579 1.753 1.00 0.00 H new ATOM 0 HH22 ARG B 8 10.260 0.984 2.360 1.00 0.00 H new ATOM 1161 N LYS B 9 9.830 0.770 -6.897 1.00 0.00 N ATOM 1162 CA LYS B 9 9.787 -0.081 -8.105 1.00 0.00 C ATOM 1163 C LYS B 9 10.205 -1.552 -7.861 1.00 0.00 C ATOM 1164 O LYS B 9 10.039 -2.389 -8.753 1.00 0.00 O ATOM 1165 CB LYS B 9 10.606 0.599 -9.220 1.00 0.00 C ATOM 1166 CG LYS B 9 12.121 0.655 -8.934 1.00 0.00 C ATOM 1167 CD LYS B 9 12.917 1.371 -10.038 1.00 0.00 C ATOM 1168 CE LYS B 9 12.570 2.861 -10.219 1.00 0.00 C ATOM 1169 NZ LYS B 9 12.892 3.681 -9.019 1.00 0.00 N ATOM 0 H LYS B 9 10.755 0.802 -6.469 1.00 0.00 H new ATOM 0 HA LYS B 9 8.747 -0.165 -8.420 1.00 0.00 H new ATOM 0 HB2 LYS B 9 10.442 0.065 -10.156 1.00 0.00 H new ATOM 0 HB3 LYS B 9 10.235 1.614 -9.363 1.00 0.00 H new ATOM 0 HG2 LYS B 9 12.287 1.165 -7.985 1.00 0.00 H new ATOM 0 HG3 LYS B 9 12.501 -0.360 -8.820 1.00 0.00 H new ATOM 0 HD2 LYS B 9 13.980 1.284 -9.815 1.00 0.00 H new ATOM 0 HD3 LYS B 9 12.746 0.855 -10.983 1.00 0.00 H new ATOM 0 HE2 LYS B 9 13.114 3.254 -11.078 1.00 0.00 H new ATOM 0 HE3 LYS B 9 11.508 2.957 -10.444 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 12.638 4.673 -9.198 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 12.354 3.328 -8.202 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 13.910 3.616 -8.817 1.00 0.00 H new ATOM 1183 N SER B 10 10.711 -1.860 -6.655 1.00 0.00 N ATOM 1184 CA SER B 10 11.052 -3.207 -6.142 1.00 0.00 C ATOM 1185 C SER B 10 11.999 -3.994 -7.070 1.00 0.00 C ATOM 1186 O SER B 10 11.686 -5.142 -7.461 1.00 0.00 O ATOM 1187 CB SER B 10 9.766 -3.978 -5.810 1.00 0.00 C ATOM 1188 OG SER B 10 8.997 -3.233 -4.873 1.00 0.00 O ATOM 1189 OXT SER B 10 13.093 -3.460 -7.368 1.00 0.00 O ATOM 0 H SER B 10 10.907 -1.134 -5.966 1.00 0.00 H new ATOM 0 HA SER B 10 11.622 -3.077 -5.222 1.00 0.00 H new ATOM 0 HB2 SER B 10 9.187 -4.150 -6.718 1.00 0.00 H new ATOM 0 HB3 SER B 10 10.012 -4.957 -5.399 1.00 0.00 H new ATOM 0 HG SER B 10 8.175 -3.723 -4.661 1.00 0.00 H new TER 1195 SER B 10 HETATM 1196 ZN ZN A 501 -7.316 -1.204 9.692 1.00 0.00 ZN