USER MOD reduce.3.24.130724 H: found=0, std=0, add=511, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 514 hydrogens (0 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 Set 1.1: A 294 GLN :FLIP amide:sc= -1.28 F(o=-1.7!,f=-0.046) USER MOD Set 1.2: A 298 THR OG1 : rot 81:sc= 1.23 USER MOD Set 1.3: A 324 TYR OH : rot 180:sc= 0 USER MOD Single : A 266 SER OG : rot 35:sc= 0.213 USER MOD Single : A 272 THR OG1 : rot 180:sc= 0 USER MOD Single : A 276 THR OG1 : rot -29:sc= 1.18 USER MOD Single : A 277 THR OG1 : rot 180:sc= 0 USER MOD Single : A 280 GLN :FLIP amide:sc=-0.00395 F(o=-0.97,f=-0.0039) USER MOD Single : A 281 THR OG1 : rot 180:sc= 0 USER MOD Single : A 284 MET CE :methyl -148:sc= -1.65 (180deg=-3.78!) USER MOD Single : A 285 MET CE :methyl 154:sc= 0 (180deg=-0.784) USER MOD Single : A 288 ASN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 290 LYS NZ :NH3+ -135:sc=-0.00904 (180deg=-0.356) USER MOD Single : A 291 LYS NZ :NH3+ 161:sc= -0.0713 (180deg=-0.429) USER MOD Single : A 297 TYR OH : rot 180:sc= 0 USER MOD Single : A 302 TYR OH : rot 180:sc= 0 USER MOD Single : A 304 ASN : amide:sc= -0.113 K(o=-0.11,f=-0.76!) USER MOD Single : A 305 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 308 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 310 MET CE :methyl -154:sc= -0.11 (180deg=-1.25) USER MOD Single : A 311 SER OG : rot -100:sc= 0.113 USER MOD Single : A 312 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 316 SER OG : rot 180:sc= 0 USER MOD Single : A 318 ASN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 319 SER OG : rot -77:sc= 0.604 USER MOD Single : A 323 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 266 9.372 -2.103 5.442 1.00 0.00 N ATOM 2 CA SER A 266 9.263 -1.032 4.430 1.00 0.00 C ATOM 3 C SER A 266 10.447 -1.071 3.469 1.00 0.00 C ATOM 4 O SER A 266 10.880 -0.040 2.955 1.00 0.00 O ATOM 5 CB SER A 266 9.194 0.323 5.129 1.00 0.00 C ATOM 6 OG SER A 266 8.194 0.317 6.136 1.00 0.00 O ATOM 0 HA SER A 266 8.353 -1.187 3.850 1.00 0.00 H new ATOM 0 HB2 SER A 266 10.162 0.559 5.572 1.00 0.00 H new ATOM 0 HB3 SER A 266 8.978 1.104 4.400 1.00 0.00 H new ATOM 0 HG SER A 266 8.158 -0.568 6.556 1.00 0.00 H new ATOM 14 N ASP A 267 10.967 -2.266 3.225 1.00 0.00 N ATOM 15 CA ASP A 267 12.112 -2.434 2.344 1.00 0.00 C ATOM 16 C ASP A 267 11.907 -3.654 1.460 1.00 0.00 C ATOM 17 O ASP A 267 10.809 -4.213 1.423 1.00 0.00 O ATOM 18 CB ASP A 267 13.411 -2.568 3.151 1.00 0.00 C ATOM 19 CG ASP A 267 13.460 -3.820 4.003 1.00 0.00 C ATOM 20 OD1 ASP A 267 12.901 -3.806 5.122 1.00 0.00 O ATOM 21 OD2 ASP A 267 14.069 -4.815 3.563 1.00 0.00 O ATOM 0 H ASP A 267 10.613 -3.134 3.626 1.00 0.00 H new ATOM 0 HA ASP A 267 12.199 -1.548 1.715 1.00 0.00 H new ATOM 0 HB2 ASP A 267 14.258 -2.570 2.465 1.00 0.00 H new ATOM 0 HB3 ASP A 267 13.523 -1.695 3.794 1.00 0.00 H new ATOM 26 N VAL A 268 12.955 -4.063 0.755 1.00 0.00 N ATOM 27 CA VAL A 268 12.873 -5.183 -0.175 1.00 0.00 C ATOM 28 C VAL A 268 12.423 -6.461 0.534 1.00 0.00 C ATOM 29 O VAL A 268 11.473 -7.109 0.094 1.00 0.00 O ATOM 30 CB VAL A 268 14.229 -5.432 -0.863 1.00 0.00 C ATOM 31 CG1 VAL A 268 14.110 -6.534 -1.905 1.00 0.00 C ATOM 32 CG2 VAL A 268 14.748 -4.149 -1.495 1.00 0.00 C ATOM 0 H VAL A 268 13.878 -3.632 0.811 1.00 0.00 H new ATOM 0 HA VAL A 268 12.133 -4.919 -0.930 1.00 0.00 H new ATOM 0 HB VAL A 268 14.943 -5.757 -0.106 1.00 0.00 H new ATOM 0 HG11 VAL A 268 15.079 -6.693 -2.378 1.00 0.00 H new ATOM 0 HG12 VAL A 268 13.785 -7.456 -1.424 1.00 0.00 H new ATOM 0 HG13 VAL A 268 13.380 -6.243 -2.661 1.00 0.00 H new ATOM 0 HG21 VAL A 268 15.706 -4.342 -1.977 1.00 0.00 H new ATOM 0 HG22 VAL A 268 14.034 -3.795 -2.238 1.00 0.00 H new ATOM 0 HG23 VAL A 268 14.876 -3.390 -0.724 1.00 0.00 H new ATOM 42 N LEU A 269 13.088 -6.798 1.632 1.00 0.00 N ATOM 43 CA LEU A 269 12.743 -7.978 2.429 1.00 0.00 C ATOM 44 C LEU A 269 12.813 -9.271 1.617 1.00 0.00 C ATOM 45 O LEU A 269 11.789 -9.924 1.398 1.00 0.00 O ATOM 46 CB LEU A 269 11.349 -7.832 3.038 1.00 0.00 C ATOM 47 CG LEU A 269 11.249 -6.822 4.173 1.00 0.00 C ATOM 48 CD1 LEU A 269 9.795 -6.583 4.539 1.00 0.00 C ATOM 49 CD2 LEU A 269 12.026 -7.305 5.387 1.00 0.00 C ATOM 0 H LEU A 269 13.878 -6.267 1.997 1.00 0.00 H new ATOM 0 HA LEU A 269 13.485 -8.043 3.225 1.00 0.00 H new ATOM 0 HB2 LEU A 269 10.653 -7.543 2.251 1.00 0.00 H new ATOM 0 HB3 LEU A 269 11.026 -8.805 3.407 1.00 0.00 H new ATOM 0 HG LEU A 269 11.684 -5.881 3.837 1.00 0.00 H new ATOM 0 HD11 LEU A 269 9.739 -5.859 5.352 1.00 0.00 H new ATOM 0 HD12 LEU A 269 9.260 -6.197 3.671 1.00 0.00 H new ATOM 0 HD13 LEU A 269 9.341 -7.521 4.857 1.00 0.00 H new ATOM 0 HD21 LEU A 269 11.943 -6.570 6.188 1.00 0.00 H new ATOM 0 HD22 LEU A 269 11.618 -8.258 5.725 1.00 0.00 H new ATOM 0 HD23 LEU A 269 13.075 -7.434 5.120 1.00 0.00 H new ATOM 61 N ASP A 270 14.021 -9.616 1.170 1.00 0.00 N ATOM 62 CA ASP A 270 14.296 -10.902 0.513 1.00 0.00 C ATOM 63 C ASP A 270 13.542 -11.062 -0.808 1.00 0.00 C ATOM 64 O ASP A 270 12.320 -11.210 -0.834 1.00 0.00 O ATOM 65 CB ASP A 270 13.961 -12.066 1.451 1.00 0.00 C ATOM 66 CG ASP A 270 14.272 -13.416 0.836 1.00 0.00 C ATOM 67 OD1 ASP A 270 15.467 -13.770 0.748 1.00 0.00 O ATOM 68 OD2 ASP A 270 13.326 -14.138 0.464 1.00 0.00 O ATOM 0 H ASP A 270 14.840 -9.013 1.252 1.00 0.00 H new ATOM 0 HA ASP A 270 15.361 -10.914 0.281 1.00 0.00 H new ATOM 0 HB2 ASP A 270 14.523 -11.955 2.378 1.00 0.00 H new ATOM 0 HB3 ASP A 270 12.904 -12.025 1.713 1.00 0.00 H new ATOM 73 N ILE A 271 14.280 -11.051 -1.906 1.00 0.00 N ATOM 74 CA ILE A 271 13.682 -11.195 -3.224 1.00 0.00 C ATOM 75 C ILE A 271 13.360 -12.660 -3.505 1.00 0.00 C ATOM 76 O ILE A 271 14.245 -13.449 -3.842 1.00 0.00 O ATOM 77 CB ILE A 271 14.612 -10.647 -4.330 1.00 0.00 C ATOM 78 CG1 ILE A 271 14.940 -9.175 -4.065 1.00 0.00 C ATOM 79 CG2 ILE A 271 13.963 -10.806 -5.696 1.00 0.00 C ATOM 80 CD1 ILE A 271 15.837 -8.547 -5.111 1.00 0.00 C ATOM 0 H ILE A 271 15.294 -10.944 -1.911 1.00 0.00 H new ATOM 0 HA ILE A 271 12.760 -10.613 -3.231 1.00 0.00 H new ATOM 0 HB ILE A 271 15.540 -11.219 -4.319 1.00 0.00 H new ATOM 0 HG12 ILE A 271 14.010 -8.610 -4.012 1.00 0.00 H new ATOM 0 HG13 ILE A 271 15.421 -9.090 -3.090 1.00 0.00 H new ATOM 0 HG21 ILE A 271 14.631 -10.415 -6.464 1.00 0.00 H new ATOM 0 HG22 ILE A 271 13.770 -11.862 -5.886 1.00 0.00 H new ATOM 0 HG23 ILE A 271 13.023 -10.255 -5.718 1.00 0.00 H new ATOM 0 HD11 ILE A 271 16.023 -7.505 -4.852 1.00 0.00 H new ATOM 0 HD12 ILE A 271 16.784 -9.086 -5.149 1.00 0.00 H new ATOM 0 HD13 ILE A 271 15.351 -8.598 -6.085 1.00 0.00 H new ATOM 92 N THR A 272 12.096 -13.025 -3.353 1.00 0.00 N ATOM 93 CA THR A 272 11.676 -14.401 -3.574 1.00 0.00 C ATOM 94 C THR A 272 10.389 -14.466 -4.402 1.00 0.00 C ATOM 95 O THR A 272 10.168 -15.418 -5.152 1.00 0.00 O ATOM 96 CB THR A 272 11.485 -15.150 -2.233 1.00 0.00 C ATOM 97 OG1 THR A 272 11.191 -16.535 -2.468 1.00 0.00 O ATOM 98 CG2 THR A 272 10.369 -14.526 -1.405 1.00 0.00 C ATOM 0 H THR A 272 11.346 -12.391 -3.079 1.00 0.00 H new ATOM 0 HA THR A 272 12.470 -14.894 -4.136 1.00 0.00 H new ATOM 0 HB THR A 272 12.418 -15.068 -1.675 1.00 0.00 H new ATOM 0 HG1 THR A 272 11.075 -16.995 -1.610 1.00 0.00 H new ATOM 0 HG21 THR A 272 10.260 -15.075 -0.469 1.00 0.00 H new ATOM 0 HG22 THR A 272 10.614 -13.486 -1.189 1.00 0.00 H new ATOM 0 HG23 THR A 272 9.434 -14.570 -1.963 1.00 0.00 H new ATOM 106 N ALA A 273 9.551 -13.442 -4.282 1.00 0.00 N ATOM 107 CA ALA A 273 8.273 -13.422 -4.978 1.00 0.00 C ATOM 108 C ALA A 273 8.303 -12.479 -6.175 1.00 0.00 C ATOM 109 O ALA A 273 7.394 -12.493 -7.004 1.00 0.00 O ATOM 110 CB ALA A 273 7.160 -13.026 -4.020 1.00 0.00 C ATOM 0 H ALA A 273 9.735 -12.617 -3.710 1.00 0.00 H new ATOM 0 HA ALA A 273 8.080 -14.427 -5.353 1.00 0.00 H new ATOM 0 HB1 ALA A 273 6.209 -13.015 -4.552 1.00 0.00 H new ATOM 0 HB2 ALA A 273 7.110 -13.746 -3.203 1.00 0.00 H new ATOM 0 HB3 ALA A 273 7.362 -12.034 -3.617 1.00 0.00 H new ATOM 116 N ASP A 274 9.343 -11.653 -6.253 1.00 0.00 N ATOM 117 CA ASP A 274 9.492 -10.707 -7.360 1.00 0.00 C ATOM 118 C ASP A 274 9.579 -11.434 -8.708 1.00 0.00 C ATOM 119 O ASP A 274 8.729 -11.216 -9.570 1.00 0.00 O ATOM 120 CB ASP A 274 10.700 -9.788 -7.134 1.00 0.00 C ATOM 121 CG ASP A 274 11.098 -9.017 -8.377 1.00 0.00 C ATOM 122 OD1 ASP A 274 10.260 -8.264 -8.915 1.00 0.00 O ATOM 123 OD2 ASP A 274 12.266 -9.144 -8.807 1.00 0.00 O ATOM 0 H ASP A 274 10.095 -11.618 -5.565 1.00 0.00 H new ATOM 0 HA ASP A 274 8.600 -10.081 -7.390 1.00 0.00 H new ATOM 0 HB2 ASP A 274 10.469 -9.084 -6.335 1.00 0.00 H new ATOM 0 HB3 ASP A 274 11.547 -10.386 -6.797 1.00 0.00 H new ATOM 128 N PRO A 275 10.571 -12.326 -8.923 1.00 0.00 N ATOM 129 CA PRO A 275 10.619 -13.136 -10.135 1.00 0.00 C ATOM 130 C PRO A 275 9.685 -14.337 -10.016 1.00 0.00 C ATOM 131 O PRO A 275 10.127 -15.487 -9.993 1.00 0.00 O ATOM 132 CB PRO A 275 12.078 -13.576 -10.203 1.00 0.00 C ATOM 133 CG PRO A 275 12.509 -13.662 -8.781 1.00 0.00 C ATOM 134 CD PRO A 275 11.716 -12.621 -8.030 1.00 0.00 C ATOM 0 HA PRO A 275 10.297 -12.599 -11.027 1.00 0.00 H new ATOM 0 HB2 PRO A 275 12.179 -14.537 -10.707 1.00 0.00 H new ATOM 0 HB3 PRO A 275 12.683 -12.859 -10.758 1.00 0.00 H new ATOM 0 HG2 PRO A 275 12.322 -14.657 -8.378 1.00 0.00 H new ATOM 0 HG3 PRO A 275 13.579 -13.476 -8.688 1.00 0.00 H new ATOM 0 HD2 PRO A 275 11.381 -12.996 -7.063 1.00 0.00 H new ATOM 0 HD3 PRO A 275 12.311 -11.729 -7.837 1.00 0.00 H new ATOM 142 N THR A 276 8.391 -14.039 -9.940 1.00 0.00 N ATOM 143 CA THR A 276 7.358 -15.026 -9.660 1.00 0.00 C ATOM 144 C THR A 276 7.492 -16.270 -10.538 1.00 0.00 C ATOM 145 O THR A 276 7.253 -16.229 -11.747 1.00 0.00 O ATOM 146 CB THR A 276 5.965 -14.407 -9.856 1.00 0.00 C ATOM 147 OG1 THR A 276 5.920 -13.119 -9.223 1.00 0.00 O ATOM 148 CG2 THR A 276 4.882 -15.302 -9.271 1.00 0.00 C ATOM 0 H THR A 276 8.029 -13.095 -10.073 1.00 0.00 H new ATOM 0 HA THR A 276 7.485 -15.336 -8.623 1.00 0.00 H new ATOM 0 HB THR A 276 5.782 -14.302 -10.925 1.00 0.00 H new ATOM 0 HG1 THR A 276 6.533 -13.109 -8.459 1.00 0.00 H new ATOM 0 HG21 THR A 276 3.907 -14.840 -9.423 1.00 0.00 H new ATOM 0 HG22 THR A 276 4.905 -16.273 -9.766 1.00 0.00 H new ATOM 0 HG23 THR A 276 5.057 -15.435 -8.203 1.00 0.00 H new ATOM 156 N THR A 277 7.886 -17.368 -9.915 1.00 0.00 N ATOM 157 CA THR A 277 8.042 -18.629 -10.608 1.00 0.00 C ATOM 158 C THR A 277 7.215 -19.701 -9.903 1.00 0.00 C ATOM 159 O THR A 277 6.888 -19.547 -8.722 1.00 0.00 O ATOM 160 CB THR A 277 9.531 -19.047 -10.665 1.00 0.00 C ATOM 161 OG1 THR A 277 9.695 -20.209 -11.488 1.00 0.00 O ATOM 162 CG2 THR A 277 10.080 -19.323 -9.271 1.00 0.00 C ATOM 0 H THR A 277 8.105 -17.407 -8.920 1.00 0.00 H new ATOM 0 HA THR A 277 7.688 -18.514 -11.632 1.00 0.00 H new ATOM 0 HB THR A 277 10.091 -18.218 -11.099 1.00 0.00 H new ATOM 0 HG1 THR A 277 10.642 -20.460 -11.515 1.00 0.00 H new ATOM 0 HG21 THR A 277 11.128 -19.614 -9.344 1.00 0.00 H new ATOM 0 HG22 THR A 277 9.995 -18.423 -8.662 1.00 0.00 H new ATOM 0 HG23 THR A 277 9.510 -20.129 -8.809 1.00 0.00 H new ATOM 170 N ALA A 278 6.870 -20.764 -10.636 1.00 0.00 N ATOM 171 CA ALA A 278 6.052 -21.864 -10.116 1.00 0.00 C ATOM 172 C ALA A 278 4.606 -21.424 -9.868 1.00 0.00 C ATOM 173 O ALA A 278 4.340 -20.277 -9.499 1.00 0.00 O ATOM 174 CB ALA A 278 6.667 -22.451 -8.849 1.00 0.00 C ATOM 0 H ALA A 278 7.151 -20.886 -11.609 1.00 0.00 H new ATOM 0 HA ALA A 278 6.032 -22.644 -10.877 1.00 0.00 H new ATOM 0 HB1 ALA A 278 6.041 -23.265 -8.484 1.00 0.00 H new ATOM 0 HB2 ALA A 278 7.664 -22.832 -9.071 1.00 0.00 H new ATOM 0 HB3 ALA A 278 6.736 -21.676 -8.086 1.00 0.00 H new ATOM 180 N PRO A 279 3.642 -22.337 -10.070 1.00 0.00 N ATOM 181 CA PRO A 279 2.218 -22.037 -9.902 1.00 0.00 C ATOM 182 C PRO A 279 1.779 -22.020 -8.438 1.00 0.00 C ATOM 183 O PRO A 279 0.809 -22.682 -8.059 1.00 0.00 O ATOM 184 CB PRO A 279 1.538 -23.178 -10.653 1.00 0.00 C ATOM 185 CG PRO A 279 2.478 -24.327 -10.520 1.00 0.00 C ATOM 186 CD PRO A 279 3.862 -23.736 -10.496 1.00 0.00 C ATOM 0 HA PRO A 279 1.966 -21.043 -10.272 1.00 0.00 H new ATOM 0 HB2 PRO A 279 0.564 -23.411 -10.223 1.00 0.00 H new ATOM 0 HB3 PRO A 279 1.372 -22.921 -11.699 1.00 0.00 H new ATOM 0 HG2 PRO A 279 2.279 -24.889 -9.608 1.00 0.00 H new ATOM 0 HG3 PRO A 279 2.365 -25.021 -11.353 1.00 0.00 H new ATOM 0 HD2 PRO A 279 4.512 -24.268 -9.801 1.00 0.00 H new ATOM 0 HD3 PRO A 279 4.335 -23.786 -11.477 1.00 0.00 H new ATOM 194 N GLN A 280 2.493 -21.258 -7.621 1.00 0.00 N ATOM 195 CA GLN A 280 2.155 -21.119 -6.212 1.00 0.00 C ATOM 196 C GLN A 280 1.238 -19.912 -6.026 1.00 0.00 C ATOM 197 O GLN A 280 1.570 -18.954 -5.320 1.00 0.00 O ATOM 198 CB GLN A 280 3.424 -20.974 -5.366 1.00 0.00 C ATOM 199 CG GLN A 280 4.454 -22.064 -5.630 1.00 0.00 C ATOM 200 CD GLN A 280 5.672 -21.969 -4.730 1.00 0.00 C ATOM 201 OE1 GLN A 280 5.472 -21.556 -3.490 1.00 0.00 O flip ATOM 202 NE2 GLN A 280 6.787 -22.296 -5.140 1.00 0.00 N flip ATOM 0 H GLN A 280 3.313 -20.725 -7.911 1.00 0.00 H new ATOM 0 HA GLN A 280 1.633 -22.016 -5.878 1.00 0.00 H new ATOM 0 HB2 GLN A 280 3.875 -20.002 -5.565 1.00 0.00 H new ATOM 0 HB3 GLN A 280 3.152 -20.989 -4.311 1.00 0.00 H new ATOM 0 HG2 GLN A 280 3.985 -23.038 -5.493 1.00 0.00 H new ATOM 0 HG3 GLN A 280 4.774 -22.007 -6.670 1.00 0.00 H new ATOM 0 HE21 GLN A 280 6.904 -22.610 -6.103 1.00 0.00 H new ATOM 0 HE22 GLN A 280 7.593 -22.253 -4.516 1.00 0.00 H new ATOM 211 N THR A 281 0.078 -19.984 -6.669 1.00 0.00 N ATOM 212 CA THR A 281 -0.883 -18.891 -6.699 1.00 0.00 C ATOM 213 C THR A 281 -1.380 -18.532 -5.299 1.00 0.00 C ATOM 214 O THR A 281 -1.756 -17.389 -5.043 1.00 0.00 O ATOM 215 CB THR A 281 -2.085 -19.267 -7.587 1.00 0.00 C ATOM 216 OG1 THR A 281 -1.614 -19.763 -8.849 1.00 0.00 O ATOM 217 CG2 THR A 281 -2.991 -18.071 -7.822 1.00 0.00 C ATOM 0 H THR A 281 -0.223 -20.809 -7.188 1.00 0.00 H new ATOM 0 HA THR A 281 -0.373 -18.020 -7.112 1.00 0.00 H new ATOM 0 HB THR A 281 -2.660 -20.037 -7.073 1.00 0.00 H new ATOM 0 HG1 THR A 281 -2.379 -20.003 -9.412 1.00 0.00 H new ATOM 0 HG21 THR A 281 -3.830 -18.368 -8.452 1.00 0.00 H new ATOM 0 HG22 THR A 281 -3.367 -17.706 -6.866 1.00 0.00 H new ATOM 0 HG23 THR A 281 -2.428 -17.280 -8.317 1.00 0.00 H new ATOM 225 N GLU A 282 -1.369 -19.510 -4.401 1.00 0.00 N ATOM 226 CA GLU A 282 -1.817 -19.303 -3.028 1.00 0.00 C ATOM 227 C GLU A 282 -1.095 -18.117 -2.395 1.00 0.00 C ATOM 228 O GLU A 282 -1.731 -17.163 -1.947 1.00 0.00 O ATOM 229 CB GLU A 282 -1.583 -20.572 -2.204 1.00 0.00 C ATOM 230 CG GLU A 282 -2.123 -20.502 -0.784 1.00 0.00 C ATOM 231 CD GLU A 282 -3.616 -20.257 -0.735 1.00 0.00 C ATOM 232 OE1 GLU A 282 -4.383 -21.122 -1.205 1.00 0.00 O ATOM 233 OE2 GLU A 282 -4.034 -19.203 -0.214 1.00 0.00 O ATOM 0 H GLU A 282 -1.053 -20.459 -4.600 1.00 0.00 H new ATOM 0 HA GLU A 282 -2.884 -19.082 -3.042 1.00 0.00 H new ATOM 0 HB2 GLU A 282 -2.047 -21.415 -2.716 1.00 0.00 H new ATOM 0 HB3 GLU A 282 -0.513 -20.774 -2.164 1.00 0.00 H new ATOM 0 HG2 GLU A 282 -1.895 -21.434 -0.267 1.00 0.00 H new ATOM 0 HG3 GLU A 282 -1.611 -19.705 -0.244 1.00 0.00 H new ATOM 240 N ARG A 283 0.234 -18.168 -2.384 1.00 0.00 N ATOM 241 CA ARG A 283 1.028 -17.090 -1.815 1.00 0.00 C ATOM 242 C ARG A 283 0.819 -15.798 -2.589 1.00 0.00 C ATOM 243 O ARG A 283 0.656 -14.733 -1.999 1.00 0.00 O ATOM 244 CB ARG A 283 2.517 -17.438 -1.808 1.00 0.00 C ATOM 245 CG ARG A 283 2.852 -18.701 -1.037 1.00 0.00 C ATOM 246 CD ARG A 283 4.340 -18.797 -0.745 1.00 0.00 C ATOM 247 NE ARG A 283 5.158 -18.654 -1.951 1.00 0.00 N ATOM 248 CZ ARG A 283 6.473 -18.870 -1.985 1.00 0.00 C ATOM 249 NH1 ARG A 283 7.117 -19.258 -0.889 1.00 0.00 N ATOM 250 NH2 ARG A 283 7.144 -18.700 -3.117 1.00 0.00 N ATOM 0 H ARG A 283 0.780 -18.942 -2.762 1.00 0.00 H new ATOM 0 HA ARG A 283 0.694 -16.953 -0.786 1.00 0.00 H new ATOM 0 HB2 ARG A 283 2.858 -17.552 -2.837 1.00 0.00 H new ATOM 0 HB3 ARG A 283 3.072 -16.604 -1.378 1.00 0.00 H new ATOM 0 HG2 ARG A 283 2.295 -18.715 -0.100 1.00 0.00 H new ATOM 0 HG3 ARG A 283 2.536 -19.573 -1.610 1.00 0.00 H new ATOM 0 HD2 ARG A 283 4.617 -18.024 -0.028 1.00 0.00 H new ATOM 0 HD3 ARG A 283 4.554 -19.758 -0.276 1.00 0.00 H new ATOM 0 HE ARG A 283 4.695 -18.373 -2.815 1.00 0.00 H new ATOM 0 HH11 ARG A 283 6.605 -19.392 -0.017 1.00 0.00 H new ATOM 0 HH12 ARG A 283 8.123 -19.422 -0.920 1.00 0.00 H new ATOM 0 HH21 ARG A 283 6.654 -18.404 -3.961 1.00 0.00 H new ATOM 0 HH22 ARG A 283 8.150 -18.865 -3.143 1.00 0.00 H new ATOM 264 N MET A 284 0.807 -15.906 -3.912 1.00 0.00 N ATOM 265 CA MET A 284 0.680 -14.741 -4.781 1.00 0.00 C ATOM 266 C MET A 284 -0.611 -13.980 -4.500 1.00 0.00 C ATOM 267 O MET A 284 -0.621 -12.750 -4.474 1.00 0.00 O ATOM 268 CB MET A 284 0.734 -15.162 -6.253 1.00 0.00 C ATOM 269 CG MET A 284 0.645 -14.003 -7.243 1.00 0.00 C ATOM 270 SD MET A 284 2.234 -13.203 -7.583 1.00 0.00 S ATOM 271 CE MET A 284 2.598 -12.378 -6.033 1.00 0.00 C ATOM 0 H MET A 284 0.884 -16.793 -4.409 1.00 0.00 H new ATOM 0 HA MET A 284 1.518 -14.077 -4.572 1.00 0.00 H new ATOM 0 HB2 MET A 284 1.663 -15.704 -6.430 1.00 0.00 H new ATOM 0 HB3 MET A 284 -0.083 -15.856 -6.450 1.00 0.00 H new ATOM 0 HG2 MET A 284 0.227 -14.370 -8.180 1.00 0.00 H new ATOM 0 HG3 MET A 284 -0.049 -13.258 -6.854 1.00 0.00 H new ATOM 0 HE1 MET A 284 3.154 -11.462 -6.230 1.00 0.00 H new ATOM 0 HE2 MET A 284 1.666 -12.134 -5.523 1.00 0.00 H new ATOM 0 HE3 MET A 284 3.195 -13.036 -5.402 1.00 0.00 H new ATOM 281 N MET A 285 -1.688 -14.714 -4.274 1.00 0.00 N ATOM 282 CA MET A 285 -2.978 -14.102 -3.993 1.00 0.00 C ATOM 283 C MET A 285 -2.945 -13.388 -2.646 1.00 0.00 C ATOM 284 O MET A 285 -3.495 -12.299 -2.495 1.00 0.00 O ATOM 285 CB MET A 285 -4.093 -15.151 -4.015 1.00 0.00 C ATOM 286 CG MET A 285 -5.484 -14.563 -3.830 1.00 0.00 C ATOM 287 SD MET A 285 -6.794 -15.781 -4.063 1.00 0.00 S ATOM 288 CE MET A 285 -8.242 -14.770 -3.767 1.00 0.00 C ATOM 0 H MET A 285 -1.696 -15.734 -4.279 1.00 0.00 H new ATOM 0 HA MET A 285 -3.185 -13.368 -4.771 1.00 0.00 H new ATOM 0 HB2 MET A 285 -4.057 -15.688 -4.963 1.00 0.00 H new ATOM 0 HB3 MET A 285 -3.909 -15.882 -3.228 1.00 0.00 H new ATOM 0 HG2 MET A 285 -5.564 -14.137 -2.830 1.00 0.00 H new ATOM 0 HG3 MET A 285 -5.625 -13.745 -4.537 1.00 0.00 H new ATOM 0 HE1 MET A 285 -9.096 -15.194 -4.295 1.00 0.00 H new ATOM 0 HE2 MET A 285 -8.454 -14.742 -2.698 1.00 0.00 H new ATOM 0 HE3 MET A 285 -8.059 -13.758 -4.127 1.00 0.00 H new ATOM 298 N ARG A 286 -2.274 -13.995 -1.674 1.00 0.00 N ATOM 299 CA ARG A 286 -2.139 -13.397 -0.354 1.00 0.00 C ATOM 300 C ARG A 286 -1.269 -12.146 -0.430 1.00 0.00 C ATOM 301 O ARG A 286 -1.500 -11.177 0.292 1.00 0.00 O ATOM 302 CB ARG A 286 -1.534 -14.397 0.636 1.00 0.00 C ATOM 303 CG ARG A 286 -2.257 -15.732 0.690 1.00 0.00 C ATOM 304 CD ARG A 286 -3.707 -15.585 1.121 1.00 0.00 C ATOM 305 NE ARG A 286 -4.431 -16.849 1.012 1.00 0.00 N ATOM 306 CZ ARG A 286 -5.598 -17.103 1.598 1.00 0.00 C ATOM 307 NH1 ARG A 286 -6.183 -16.188 2.359 1.00 0.00 N ATOM 308 NH2 ARG A 286 -6.180 -18.280 1.416 1.00 0.00 N ATOM 0 H ARG A 286 -1.816 -14.900 -1.776 1.00 0.00 H new ATOM 0 HA ARG A 286 -3.132 -13.120 -0.001 1.00 0.00 H new ATOM 0 HB2 ARG A 286 -0.492 -14.571 0.369 1.00 0.00 H new ATOM 0 HB3 ARG A 286 -1.538 -13.954 1.632 1.00 0.00 H new ATOM 0 HG2 ARG A 286 -2.218 -16.204 -0.292 1.00 0.00 H new ATOM 0 HG3 ARG A 286 -1.740 -16.395 1.383 1.00 0.00 H new ATOM 0 HD2 ARG A 286 -3.747 -15.230 2.151 1.00 0.00 H new ATOM 0 HD3 ARG A 286 -4.196 -14.831 0.504 1.00 0.00 H new ATOM 0 HE ARG A 286 -4.013 -17.588 0.447 1.00 0.00 H new ATOM 0 HH11 ARG A 286 -5.738 -15.281 2.499 1.00 0.00 H new ATOM 0 HH12 ARG A 286 -7.078 -16.391 2.804 1.00 0.00 H new ATOM 0 HH21 ARG A 286 -5.733 -18.985 0.829 1.00 0.00 H new ATOM 0 HH22 ARG A 286 -7.075 -18.481 1.863 1.00 0.00 H new ATOM 322 N ILE A 287 -0.270 -12.174 -1.309 1.00 0.00 N ATOM 323 CA ILE A 287 0.564 -11.003 -1.563 1.00 0.00 C ATOM 324 C ILE A 287 -0.266 -9.911 -2.230 1.00 0.00 C ATOM 325 O ILE A 287 -0.163 -8.737 -1.881 1.00 0.00 O ATOM 326 CB ILE A 287 1.781 -11.343 -2.455 1.00 0.00 C ATOM 327 CG1 ILE A 287 2.654 -12.417 -1.795 1.00 0.00 C ATOM 328 CG2 ILE A 287 2.606 -10.095 -2.744 1.00 0.00 C ATOM 329 CD1 ILE A 287 3.194 -12.019 -0.437 1.00 0.00 C ATOM 0 H ILE A 287 -0.019 -12.996 -1.858 1.00 0.00 H new ATOM 0 HA ILE A 287 0.940 -10.653 -0.602 1.00 0.00 H new ATOM 0 HB ILE A 287 1.406 -11.735 -3.401 1.00 0.00 H new ATOM 0 HG12 ILE A 287 2.070 -13.331 -1.689 1.00 0.00 H new ATOM 0 HG13 ILE A 287 3.491 -12.647 -2.455 1.00 0.00 H new ATOM 0 HG21 ILE A 287 3.456 -10.359 -3.373 1.00 0.00 H new ATOM 0 HG22 ILE A 287 1.987 -9.361 -3.260 1.00 0.00 H new ATOM 0 HG23 ILE A 287 2.966 -9.671 -1.806 1.00 0.00 H new ATOM 0 HD11 ILE A 287 3.801 -12.830 -0.035 1.00 0.00 H new ATOM 0 HD12 ILE A 287 3.806 -11.123 -0.537 1.00 0.00 H new ATOM 0 HD13 ILE A 287 2.364 -11.818 0.240 1.00 0.00 H new ATOM 341 N ASN A 288 -1.101 -10.317 -3.183 1.00 0.00 N ATOM 342 CA ASN A 288 -2.041 -9.409 -3.827 1.00 0.00 C ATOM 343 C ASN A 288 -2.939 -8.747 -2.787 1.00 0.00 C ATOM 344 O ASN A 288 -3.229 -7.553 -2.870 1.00 0.00 O ATOM 345 CB ASN A 288 -2.885 -10.170 -4.857 1.00 0.00 C ATOM 346 CG ASN A 288 -4.019 -9.336 -5.417 1.00 0.00 C ATOM 347 OD1 ASN A 288 -5.137 -9.366 -4.901 1.00 0.00 O ATOM 348 ND2 ASN A 288 -3.743 -8.586 -6.470 1.00 0.00 N ATOM 0 H ASN A 288 -1.144 -11.276 -3.527 1.00 0.00 H new ATOM 0 HA ASN A 288 -1.479 -8.629 -4.342 1.00 0.00 H new ATOM 0 HB2 ASN A 288 -2.243 -10.498 -5.675 1.00 0.00 H new ATOM 0 HB3 ASN A 288 -3.295 -11.067 -4.393 1.00 0.00 H new ATOM 0 HD21 ASN A 288 -4.470 -8.003 -6.886 1.00 0.00 H new ATOM 0 HD22 ASN A 288 -2.803 -8.590 -6.867 1.00 0.00 H new ATOM 355 N TRP A 289 -3.365 -9.530 -1.803 1.00 0.00 N ATOM 356 CA TRP A 289 -4.137 -9.006 -0.685 1.00 0.00 C ATOM 357 C TRP A 289 -3.329 -7.987 0.111 1.00 0.00 C ATOM 358 O TRP A 289 -3.846 -6.937 0.490 1.00 0.00 O ATOM 359 CB TRP A 289 -4.603 -10.144 0.224 1.00 0.00 C ATOM 360 CG TRP A 289 -5.879 -10.775 -0.236 1.00 0.00 C ATOM 361 CD1 TRP A 289 -6.027 -11.999 -0.816 1.00 0.00 C ATOM 362 CD2 TRP A 289 -7.190 -10.206 -0.159 1.00 0.00 C ATOM 363 NE1 TRP A 289 -7.349 -12.230 -1.098 1.00 0.00 N ATOM 364 CE2 TRP A 289 -8.084 -11.143 -0.707 1.00 0.00 C ATOM 365 CE3 TRP A 289 -7.695 -8.995 0.320 1.00 0.00 C ATOM 366 CZ2 TRP A 289 -9.454 -10.909 -0.786 1.00 0.00 C ATOM 367 CZ3 TRP A 289 -9.054 -8.763 0.241 1.00 0.00 C ATOM 368 CH2 TRP A 289 -9.921 -9.716 -0.309 1.00 0.00 C ATOM 0 H TRP A 289 -3.188 -10.533 -1.758 1.00 0.00 H new ATOM 0 HA TRP A 289 -5.014 -8.500 -1.090 1.00 0.00 H new ATOM 0 HB2 TRP A 289 -3.824 -10.905 0.272 1.00 0.00 H new ATOM 0 HB3 TRP A 289 -4.737 -9.761 1.236 1.00 0.00 H new ATOM 0 HD1 TRP A 289 -5.221 -12.687 -1.023 1.00 0.00 H new ATOM 0 HE1 TRP A 289 -7.724 -13.075 -1.529 1.00 0.00 H new ATOM 0 HE3 TRP A 289 -7.034 -8.253 0.745 1.00 0.00 H new ATOM 0 HZ2 TRP A 289 -10.124 -11.643 -1.209 1.00 0.00 H new ATOM 0 HZ3 TRP A 289 -9.455 -7.831 0.610 1.00 0.00 H new ATOM 0 HH2 TRP A 289 -10.979 -9.504 -0.357 1.00 0.00 H new ATOM 379 N LYS A 290 -2.054 -8.290 0.346 1.00 0.00 N ATOM 380 CA LYS A 290 -1.168 -7.369 1.053 1.00 0.00 C ATOM 381 C LYS A 290 -1.045 -6.063 0.279 1.00 0.00 C ATOM 382 O LYS A 290 -1.071 -4.977 0.859 1.00 0.00 O ATOM 383 CB LYS A 290 0.223 -7.981 1.253 1.00 0.00 C ATOM 384 CG LYS A 290 0.217 -9.299 2.009 1.00 0.00 C ATOM 385 CD LYS A 290 -0.452 -9.164 3.367 1.00 0.00 C ATOM 386 CE LYS A 290 -0.497 -10.493 4.099 1.00 0.00 C ATOM 387 NZ LYS A 290 -1.190 -11.543 3.308 1.00 0.00 N ATOM 0 H LYS A 290 -1.613 -9.163 0.058 1.00 0.00 H new ATOM 0 HA LYS A 290 -1.602 -7.173 2.033 1.00 0.00 H new ATOM 0 HB2 LYS A 290 0.684 -8.136 0.277 1.00 0.00 H new ATOM 0 HB3 LYS A 290 0.848 -7.268 1.791 1.00 0.00 H new ATOM 0 HG2 LYS A 290 -0.304 -10.054 1.420 1.00 0.00 H new ATOM 0 HG3 LYS A 290 1.241 -9.648 2.141 1.00 0.00 H new ATOM 0 HD2 LYS A 290 0.089 -8.434 3.969 1.00 0.00 H new ATOM 0 HD3 LYS A 290 -1.465 -8.784 3.238 1.00 0.00 H new ATOM 0 HE2 LYS A 290 0.519 -10.819 4.321 1.00 0.00 H new ATOM 0 HE3 LYS A 290 -1.006 -10.364 5.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 290 -1.847 -12.065 3.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 290 -1.721 -11.099 2.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 290 -0.488 -12.201 2.914 1.00 0.00 H new ATOM 401 N LYS A 291 -0.923 -6.181 -1.036 1.00 0.00 N ATOM 402 CA LYS A 291 -0.843 -5.019 -1.908 1.00 0.00 C ATOM 403 C LYS A 291 -2.145 -4.230 -1.881 1.00 0.00 C ATOM 404 O LYS A 291 -2.128 -3.001 -1.883 1.00 0.00 O ATOM 405 CB LYS A 291 -0.516 -5.445 -3.338 1.00 0.00 C ATOM 406 CG LYS A 291 0.877 -6.028 -3.500 1.00 0.00 C ATOM 407 CD LYS A 291 1.950 -5.012 -3.146 1.00 0.00 C ATOM 408 CE LYS A 291 3.335 -5.514 -3.513 1.00 0.00 C ATOM 409 NZ LYS A 291 3.480 -5.706 -4.977 1.00 0.00 N ATOM 0 H LYS A 291 -0.877 -7.076 -1.524 1.00 0.00 H new ATOM 0 HA LYS A 291 -0.043 -4.376 -1.541 1.00 0.00 H new ATOM 0 HB2 LYS A 291 -1.249 -6.183 -3.664 1.00 0.00 H new ATOM 0 HB3 LYS A 291 -0.618 -4.582 -3.997 1.00 0.00 H new ATOM 0 HG2 LYS A 291 0.981 -6.906 -2.863 1.00 0.00 H new ATOM 0 HG3 LYS A 291 1.016 -6.362 -4.528 1.00 0.00 H new ATOM 0 HD2 LYS A 291 1.752 -4.075 -3.667 1.00 0.00 H new ATOM 0 HD3 LYS A 291 1.911 -4.797 -2.078 1.00 0.00 H new ATOM 0 HE2 LYS A 291 4.084 -4.803 -3.163 1.00 0.00 H new ATOM 0 HE3 LYS A 291 3.527 -6.457 -3.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 291 4.490 -5.732 -5.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 291 3.032 -6.602 -5.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 291 3.020 -4.919 -5.478 1.00 0.00 H new ATOM 423 N TRP A 292 -3.267 -4.939 -1.846 1.00 0.00 N ATOM 424 CA TRP A 292 -4.574 -4.297 -1.782 1.00 0.00 C ATOM 425 C TRP A 292 -4.720 -3.503 -0.488 1.00 0.00 C ATOM 426 O TRP A 292 -5.164 -2.354 -0.502 1.00 0.00 O ATOM 427 CB TRP A 292 -5.691 -5.338 -1.894 1.00 0.00 C ATOM 428 CG TRP A 292 -7.065 -4.740 -1.847 1.00 0.00 C ATOM 429 CD1 TRP A 292 -7.978 -4.855 -0.837 1.00 0.00 C ATOM 430 CD2 TRP A 292 -7.678 -3.921 -2.850 1.00 0.00 C ATOM 431 NE1 TRP A 292 -9.122 -4.164 -1.155 1.00 0.00 N ATOM 432 CE2 TRP A 292 -8.963 -3.583 -2.385 1.00 0.00 C ATOM 433 CE3 TRP A 292 -7.268 -3.445 -4.098 1.00 0.00 C ATOM 434 CZ2 TRP A 292 -9.836 -2.787 -3.122 1.00 0.00 C ATOM 435 CZ3 TRP A 292 -8.136 -2.656 -4.829 1.00 0.00 C ATOM 436 CH2 TRP A 292 -9.408 -2.336 -4.339 1.00 0.00 C ATOM 0 H TRP A 292 -3.298 -5.958 -1.861 1.00 0.00 H new ATOM 0 HA TRP A 292 -4.656 -3.608 -2.622 1.00 0.00 H new ATOM 0 HB2 TRP A 292 -5.573 -5.888 -2.828 1.00 0.00 H new ATOM 0 HB3 TRP A 292 -5.588 -6.060 -1.084 1.00 0.00 H new ATOM 0 HD1 TRP A 292 -7.823 -5.408 0.078 1.00 0.00 H new ATOM 0 HE1 TRP A 292 -9.955 -4.095 -0.570 1.00 0.00 H new ATOM 0 HE3 TRP A 292 -6.290 -3.689 -4.485 1.00 0.00 H new ATOM 0 HZ2 TRP A 292 -10.816 -2.535 -2.745 1.00 0.00 H new ATOM 0 HZ3 TRP A 292 -7.828 -2.280 -5.794 1.00 0.00 H new ATOM 0 HH2 TRP A 292 -10.065 -1.720 -4.935 1.00 0.00 H new ATOM 447 N TRP A 293 -4.332 -4.113 0.627 1.00 0.00 N ATOM 448 CA TRP A 293 -4.378 -3.436 1.918 1.00 0.00 C ATOM 449 C TRP A 293 -3.385 -2.279 1.951 1.00 0.00 C ATOM 450 O TRP A 293 -3.586 -1.294 2.662 1.00 0.00 O ATOM 451 CB TRP A 293 -4.104 -4.419 3.060 1.00 0.00 C ATOM 452 CG TRP A 293 -5.169 -5.465 3.204 1.00 0.00 C ATOM 453 CD1 TRP A 293 -6.515 -5.279 3.081 1.00 0.00 C ATOM 454 CD2 TRP A 293 -4.982 -6.853 3.510 1.00 0.00 C ATOM 455 NE1 TRP A 293 -7.175 -6.466 3.278 1.00 0.00 N ATOM 456 CE2 TRP A 293 -6.258 -7.446 3.544 1.00 0.00 C ATOM 457 CE3 TRP A 293 -3.863 -7.653 3.752 1.00 0.00 C ATOM 458 CZ2 TRP A 293 -6.445 -8.799 3.811 1.00 0.00 C ATOM 459 CZ3 TRP A 293 -4.050 -8.997 4.019 1.00 0.00 C ATOM 460 CH2 TRP A 293 -5.332 -9.558 4.045 1.00 0.00 C ATOM 0 H TRP A 293 -3.984 -5.071 0.663 1.00 0.00 H new ATOM 0 HA TRP A 293 -5.381 -3.032 2.055 1.00 0.00 H new ATOM 0 HB2 TRP A 293 -3.145 -4.907 2.889 1.00 0.00 H new ATOM 0 HB3 TRP A 293 -4.018 -3.866 3.995 1.00 0.00 H new ATOM 0 HD1 TRP A 293 -6.992 -4.335 2.861 1.00 0.00 H new ATOM 0 HE1 TRP A 293 -8.186 -6.597 3.233 1.00 0.00 H new ATOM 0 HE3 TRP A 293 -2.870 -7.230 3.731 1.00 0.00 H new ATOM 0 HZ2 TRP A 293 -7.433 -9.234 3.833 1.00 0.00 H new ATOM 0 HZ3 TRP A 293 -3.192 -9.624 4.211 1.00 0.00 H new ATOM 0 HH2 TRP A 293 -5.444 -10.612 4.254 1.00 0.00 H new ATOM 471 N GLN A 294 -2.323 -2.398 1.163 1.00 0.00 N ATOM 472 CA GLN A 294 -1.364 -1.319 1.007 1.00 0.00 C ATOM 473 C GLN A 294 -2.024 -0.163 0.266 1.00 0.00 C ATOM 474 O GLN A 294 -1.854 0.997 0.634 1.00 0.00 O ATOM 475 CB GLN A 294 -0.113 -1.827 0.270 1.00 0.00 C ATOM 476 CG GLN A 294 0.877 -0.744 -0.151 1.00 0.00 C ATOM 477 CD GLN A 294 0.501 -0.066 -1.461 1.00 0.00 C ATOM 478 OE1 GLN A 294 -0.149 -0.802 -2.351 1.00 0.00 O flip ATOM 479 NE2 GLN A 294 0.794 1.110 -1.671 1.00 0.00 N flip ATOM 0 H GLN A 294 -2.107 -3.235 0.622 1.00 0.00 H new ATOM 0 HA GLN A 294 -1.044 -0.960 1.985 1.00 0.00 H new ATOM 0 HB2 GLN A 294 0.404 -2.539 0.913 1.00 0.00 H new ATOM 0 HB3 GLN A 294 -0.431 -2.372 -0.619 1.00 0.00 H new ATOM 0 HG2 GLN A 294 0.939 0.008 0.635 1.00 0.00 H new ATOM 0 HG3 GLN A 294 1.869 -1.185 -0.249 1.00 0.00 H new ATOM 0 HE21 GLN A 294 1.295 1.645 -0.962 1.00 0.00 H new ATOM 0 HE22 GLN A 294 0.536 1.550 -2.554 1.00 0.00 H new ATOM 488 N VAL A 295 -2.789 -0.494 -0.772 1.00 0.00 N ATOM 489 CA VAL A 295 -3.536 0.505 -1.527 1.00 0.00 C ATOM 490 C VAL A 295 -4.517 1.221 -0.611 1.00 0.00 C ATOM 491 O VAL A 295 -4.534 2.447 -0.547 1.00 0.00 O ATOM 492 CB VAL A 295 -4.304 -0.126 -2.713 1.00 0.00 C ATOM 493 CG1 VAL A 295 -5.168 0.909 -3.416 1.00 0.00 C ATOM 494 CG2 VAL A 295 -3.338 -0.764 -3.702 1.00 0.00 C ATOM 0 H VAL A 295 -2.907 -1.450 -1.109 1.00 0.00 H new ATOM 0 HA VAL A 295 -2.816 1.217 -1.931 1.00 0.00 H new ATOM 0 HB VAL A 295 -4.956 -0.902 -2.312 1.00 0.00 H new ATOM 0 HG11 VAL A 295 -5.697 0.439 -4.245 1.00 0.00 H new ATOM 0 HG12 VAL A 295 -5.891 1.319 -2.711 1.00 0.00 H new ATOM 0 HG13 VAL A 295 -4.537 1.712 -3.797 1.00 0.00 H new ATOM 0 HG21 VAL A 295 -3.899 -1.202 -4.528 1.00 0.00 H new ATOM 0 HG22 VAL A 295 -2.658 -0.005 -4.088 1.00 0.00 H new ATOM 0 HG23 VAL A 295 -2.765 -1.543 -3.200 1.00 0.00 H new ATOM 504 N PHE A 296 -5.304 0.436 0.118 1.00 0.00 N ATOM 505 CA PHE A 296 -6.279 0.971 1.063 1.00 0.00 C ATOM 506 C PHE A 296 -5.615 1.919 2.058 1.00 0.00 C ATOM 507 O PHE A 296 -6.104 3.024 2.298 1.00 0.00 O ATOM 508 CB PHE A 296 -6.969 -0.180 1.804 1.00 0.00 C ATOM 509 CG PHE A 296 -7.906 0.266 2.894 1.00 0.00 C ATOM 510 CD1 PHE A 296 -9.109 0.879 2.588 1.00 0.00 C ATOM 511 CD2 PHE A 296 -7.579 0.070 4.228 1.00 0.00 C ATOM 512 CE1 PHE A 296 -9.971 1.286 3.589 1.00 0.00 C ATOM 513 CE2 PHE A 296 -8.437 0.475 5.233 1.00 0.00 C ATOM 514 CZ PHE A 296 -9.634 1.084 4.913 1.00 0.00 C ATOM 0 H PHE A 296 -5.285 -0.583 0.071 1.00 0.00 H new ATOM 0 HA PHE A 296 -7.025 1.538 0.506 1.00 0.00 H new ATOM 0 HB2 PHE A 296 -7.526 -0.780 1.084 1.00 0.00 H new ATOM 0 HB3 PHE A 296 -6.207 -0.828 2.237 1.00 0.00 H new ATOM 0 HD1 PHE A 296 -9.377 1.041 1.555 1.00 0.00 H new ATOM 0 HD2 PHE A 296 -6.643 -0.405 4.484 1.00 0.00 H new ATOM 0 HE1 PHE A 296 -10.907 1.761 3.336 1.00 0.00 H new ATOM 0 HE2 PHE A 296 -8.171 0.315 6.268 1.00 0.00 H new ATOM 0 HZ PHE A 296 -10.306 1.402 5.697 1.00 0.00 H new ATOM 524 N TYR A 297 -4.494 1.486 2.624 1.00 0.00 N ATOM 525 CA TYR A 297 -3.768 2.293 3.596 1.00 0.00 C ATOM 526 C TYR A 297 -3.225 3.561 2.940 1.00 0.00 C ATOM 527 O TYR A 297 -3.270 4.644 3.524 1.00 0.00 O ATOM 528 CB TYR A 297 -2.622 1.484 4.205 1.00 0.00 C ATOM 529 CG TYR A 297 -2.084 2.058 5.495 1.00 0.00 C ATOM 530 CD1 TYR A 297 -2.692 1.763 6.707 1.00 0.00 C ATOM 531 CD2 TYR A 297 -0.969 2.891 5.507 1.00 0.00 C ATOM 532 CE1 TYR A 297 -2.210 2.279 7.892 1.00 0.00 C ATOM 533 CE2 TYR A 297 -0.480 3.411 6.691 1.00 0.00 C ATOM 534 CZ TYR A 297 -1.105 3.102 7.880 1.00 0.00 C ATOM 535 OH TYR A 297 -0.624 3.613 9.065 1.00 0.00 O ATOM 0 H TYR A 297 -4.069 0.580 2.426 1.00 0.00 H new ATOM 0 HA TYR A 297 -4.458 2.580 4.390 1.00 0.00 H new ATOM 0 HB2 TYR A 297 -2.966 0.466 4.388 1.00 0.00 H new ATOM 0 HB3 TYR A 297 -1.810 1.421 3.481 1.00 0.00 H new ATOM 0 HD1 TYR A 297 -3.558 1.118 6.723 1.00 0.00 H new ATOM 0 HD2 TYR A 297 -0.478 3.135 4.577 1.00 0.00 H new ATOM 0 HE1 TYR A 297 -2.697 2.039 8.826 1.00 0.00 H new ATOM 0 HE2 TYR A 297 0.387 4.056 6.684 1.00 0.00 H new ATOM 0 HH TYR A 297 0.160 4.173 8.885 1.00 0.00 H new ATOM 545 N THR A 298 -2.730 3.420 1.716 1.00 0.00 N ATOM 546 CA THR A 298 -2.192 4.551 0.976 1.00 0.00 C ATOM 547 C THR A 298 -3.296 5.544 0.626 1.00 0.00 C ATOM 548 O THR A 298 -3.066 6.746 0.621 1.00 0.00 O ATOM 549 CB THR A 298 -1.475 4.094 -0.308 1.00 0.00 C ATOM 550 OG1 THR A 298 -0.455 3.142 0.020 1.00 0.00 O ATOM 551 CG2 THR A 298 -0.848 5.273 -1.039 1.00 0.00 C ATOM 0 H THR A 298 -2.691 2.532 1.216 1.00 0.00 H new ATOM 0 HA THR A 298 -1.463 5.043 1.620 1.00 0.00 H new ATOM 0 HB THR A 298 -2.216 3.636 -0.964 1.00 0.00 H new ATOM 0 HG1 THR A 298 -0.860 2.259 0.146 1.00 0.00 H new ATOM 0 HG21 THR A 298 -0.349 4.918 -1.941 1.00 0.00 H new ATOM 0 HG22 THR A 298 -1.625 5.987 -1.311 1.00 0.00 H new ATOM 0 HG23 THR A 298 -0.120 5.759 -0.389 1.00 0.00 H new ATOM 559 N VAL A 299 -4.496 5.042 0.347 1.00 0.00 N ATOM 560 CA VAL A 299 -5.643 5.909 0.096 1.00 0.00 C ATOM 561 C VAL A 299 -5.929 6.770 1.321 1.00 0.00 C ATOM 562 O VAL A 299 -6.079 7.987 1.216 1.00 0.00 O ATOM 563 CB VAL A 299 -6.911 5.102 -0.272 1.00 0.00 C ATOM 564 CG1 VAL A 299 -8.129 6.013 -0.372 1.00 0.00 C ATOM 565 CG2 VAL A 299 -6.709 4.353 -1.579 1.00 0.00 C ATOM 0 H VAL A 299 -4.699 4.044 0.289 1.00 0.00 H new ATOM 0 HA VAL A 299 -5.388 6.543 -0.753 1.00 0.00 H new ATOM 0 HB VAL A 299 -7.088 4.378 0.523 1.00 0.00 H new ATOM 0 HG11 VAL A 299 -9.006 5.420 -0.632 1.00 0.00 H new ATOM 0 HG12 VAL A 299 -8.295 6.506 0.586 1.00 0.00 H new ATOM 0 HG13 VAL A 299 -7.958 6.765 -1.142 1.00 0.00 H new ATOM 0 HG21 VAL A 299 -7.612 3.792 -1.820 1.00 0.00 H new ATOM 0 HG22 VAL A 299 -6.500 5.065 -2.378 1.00 0.00 H new ATOM 0 HG23 VAL A 299 -5.870 3.664 -1.478 1.00 0.00 H new ATOM 575 N VAL A 300 -5.972 6.130 2.485 1.00 0.00 N ATOM 576 CA VAL A 300 -6.205 6.832 3.741 1.00 0.00 C ATOM 577 C VAL A 300 -5.116 7.879 3.973 1.00 0.00 C ATOM 578 O VAL A 300 -5.401 9.024 4.333 1.00 0.00 O ATOM 579 CB VAL A 300 -6.239 5.854 4.938 1.00 0.00 C ATOM 580 CG1 VAL A 300 -6.513 6.597 6.237 1.00 0.00 C ATOM 581 CG2 VAL A 300 -7.283 4.769 4.716 1.00 0.00 C ATOM 0 H VAL A 300 -5.848 5.122 2.584 1.00 0.00 H new ATOM 0 HA VAL A 300 -7.176 7.322 3.668 1.00 0.00 H new ATOM 0 HB VAL A 300 -5.260 5.381 5.015 1.00 0.00 H new ATOM 0 HG11 VAL A 300 -6.532 5.888 7.065 1.00 0.00 H new ATOM 0 HG12 VAL A 300 -5.727 7.333 6.408 1.00 0.00 H new ATOM 0 HG13 VAL A 300 -7.476 7.103 6.170 1.00 0.00 H new ATOM 0 HG21 VAL A 300 -7.291 4.091 5.570 1.00 0.00 H new ATOM 0 HG22 VAL A 300 -8.266 5.227 4.607 1.00 0.00 H new ATOM 0 HG23 VAL A 300 -7.041 4.211 3.812 1.00 0.00 H new ATOM 591 N ASP A 301 -3.873 7.477 3.739 1.00 0.00 N ATOM 592 CA ASP A 301 -2.730 8.370 3.891 1.00 0.00 C ATOM 593 C ASP A 301 -2.766 9.490 2.855 1.00 0.00 C ATOM 594 O ASP A 301 -2.423 10.631 3.154 1.00 0.00 O ATOM 595 CB ASP A 301 -1.422 7.585 3.764 1.00 0.00 C ATOM 596 CG ASP A 301 -0.197 8.476 3.849 1.00 0.00 C ATOM 597 OD1 ASP A 301 0.111 8.966 4.954 1.00 0.00 O ATOM 598 OD2 ASP A 301 0.466 8.687 2.810 1.00 0.00 O ATOM 0 H ASP A 301 -3.629 6.532 3.441 1.00 0.00 H new ATOM 0 HA ASP A 301 -2.784 8.818 4.883 1.00 0.00 H new ATOM 0 HB2 ASP A 301 -1.376 6.833 4.552 1.00 0.00 H new ATOM 0 HB3 ASP A 301 -1.413 7.051 2.814 1.00 0.00 H new ATOM 603 N TYR A 302 -3.193 9.158 1.645 1.00 0.00 N ATOM 604 CA TYR A 302 -3.274 10.127 0.559 1.00 0.00 C ATOM 605 C TYR A 302 -4.296 11.207 0.885 1.00 0.00 C ATOM 606 O TYR A 302 -4.056 12.389 0.645 1.00 0.00 O ATOM 607 CB TYR A 302 -3.641 9.430 -0.754 1.00 0.00 C ATOM 608 CG TYR A 302 -3.506 10.310 -1.976 1.00 0.00 C ATOM 609 CD1 TYR A 302 -2.258 10.574 -2.523 1.00 0.00 C ATOM 610 CD2 TYR A 302 -4.622 10.869 -2.584 1.00 0.00 C ATOM 611 CE1 TYR A 302 -2.125 11.371 -3.643 1.00 0.00 C ATOM 612 CE2 TYR A 302 -4.497 11.670 -3.705 1.00 0.00 C ATOM 613 CZ TYR A 302 -3.247 11.917 -4.230 1.00 0.00 C ATOM 614 OH TYR A 302 -3.115 12.709 -5.349 1.00 0.00 O ATOM 0 H TYR A 302 -3.491 8.217 1.388 1.00 0.00 H new ATOM 0 HA TYR A 302 -2.297 10.596 0.443 1.00 0.00 H new ATOM 0 HB2 TYR A 302 -3.005 8.553 -0.878 1.00 0.00 H new ATOM 0 HB3 TYR A 302 -4.668 9.072 -0.689 1.00 0.00 H new ATOM 0 HD1 TYR A 302 -1.377 10.149 -2.065 1.00 0.00 H new ATOM 0 HD2 TYR A 302 -5.603 10.676 -2.176 1.00 0.00 H new ATOM 0 HE1 TYR A 302 -1.147 11.566 -4.057 1.00 0.00 H new ATOM 0 HE2 TYR A 302 -5.374 12.099 -4.166 1.00 0.00 H new ATOM 0 HH TYR A 302 -4.000 13.014 -5.640 1.00 0.00 H new ATOM 624 N VAL A 303 -5.431 10.795 1.441 1.00 0.00 N ATOM 625 CA VAL A 303 -6.460 11.737 1.858 1.00 0.00 C ATOM 626 C VAL A 303 -5.925 12.650 2.959 1.00 0.00 C ATOM 627 O VAL A 303 -6.206 13.843 2.981 1.00 0.00 O ATOM 628 CB VAL A 303 -7.737 11.016 2.345 1.00 0.00 C ATOM 629 CG1 VAL A 303 -8.776 12.020 2.820 1.00 0.00 C ATOM 630 CG2 VAL A 303 -8.312 10.142 1.241 1.00 0.00 C ATOM 0 H VAL A 303 -5.660 9.816 1.612 1.00 0.00 H new ATOM 0 HA VAL A 303 -6.728 12.336 0.987 1.00 0.00 H new ATOM 0 HB VAL A 303 -7.466 10.378 3.187 1.00 0.00 H new ATOM 0 HG11 VAL A 303 -9.666 11.490 3.158 1.00 0.00 H new ATOM 0 HG12 VAL A 303 -8.367 12.605 3.644 1.00 0.00 H new ATOM 0 HG13 VAL A 303 -9.040 12.686 1.999 1.00 0.00 H new ATOM 0 HG21 VAL A 303 -9.211 9.643 1.603 1.00 0.00 H new ATOM 0 HG22 VAL A 303 -8.563 10.762 0.380 1.00 0.00 H new ATOM 0 HG23 VAL A 303 -7.575 9.395 0.948 1.00 0.00 H new ATOM 640 N ASN A 304 -5.129 12.084 3.853 1.00 0.00 N ATOM 641 CA ASN A 304 -4.491 12.859 4.913 1.00 0.00 C ATOM 642 C ASN A 304 -3.467 13.816 4.303 1.00 0.00 C ATOM 643 O ASN A 304 -3.352 14.978 4.704 1.00 0.00 O ATOM 644 CB ASN A 304 -3.813 11.908 5.911 1.00 0.00 C ATOM 645 CG ASN A 304 -3.402 12.577 7.213 1.00 0.00 C ATOM 646 OD1 ASN A 304 -3.093 13.768 7.258 1.00 0.00 O ATOM 647 ND2 ASN A 304 -3.394 11.803 8.292 1.00 0.00 N ATOM 0 H ASN A 304 -4.907 11.089 3.868 1.00 0.00 H new ATOM 0 HA ASN A 304 -5.243 13.443 5.443 1.00 0.00 H new ATOM 0 HB2 ASN A 304 -4.493 11.086 6.135 1.00 0.00 H new ATOM 0 HB3 ASN A 304 -2.930 11.473 5.442 1.00 0.00 H new ATOM 0 HD21 ASN A 304 -3.126 12.191 9.196 1.00 0.00 H new ATOM 0 HD22 ASN A 304 -3.656 10.820 8.217 1.00 0.00 H new ATOM 654 N GLN A 305 -2.747 13.318 3.305 1.00 0.00 N ATOM 655 CA GLN A 305 -1.712 14.082 2.622 1.00 0.00 C ATOM 656 C GLN A 305 -2.289 15.295 1.900 1.00 0.00 C ATOM 657 O GLN A 305 -1.800 16.411 2.068 1.00 0.00 O ATOM 658 CB GLN A 305 -0.979 13.180 1.626 1.00 0.00 C ATOM 659 CG GLN A 305 0.103 13.891 0.833 1.00 0.00 C ATOM 660 CD GLN A 305 0.781 12.984 -0.173 1.00 0.00 C ATOM 661 OE1 GLN A 305 0.350 12.875 -1.321 1.00 0.00 O ATOM 662 NE2 GLN A 305 1.843 12.320 0.252 1.00 0.00 N ATOM 0 H GLN A 305 -2.865 12.371 2.946 1.00 0.00 H new ATOM 0 HA GLN A 305 -1.012 14.447 3.374 1.00 0.00 H new ATOM 0 HB2 GLN A 305 -0.531 12.347 2.167 1.00 0.00 H new ATOM 0 HB3 GLN A 305 -1.705 12.756 0.932 1.00 0.00 H new ATOM 0 HG2 GLN A 305 -0.334 14.742 0.312 1.00 0.00 H new ATOM 0 HG3 GLN A 305 0.850 14.288 1.520 1.00 0.00 H new ATOM 0 HE21 GLN A 305 2.168 12.438 1.211 1.00 0.00 H new ATOM 0 HE22 GLN A 305 2.337 11.690 -0.380 1.00 0.00 H new ATOM 671 N ILE A 306 -3.336 15.079 1.112 1.00 0.00 N ATOM 672 CA ILE A 306 -3.938 16.159 0.333 1.00 0.00 C ATOM 673 C ILE A 306 -4.551 17.231 1.227 1.00 0.00 C ATOM 674 O ILE A 306 -4.830 18.338 0.772 1.00 0.00 O ATOM 675 CB ILE A 306 -5.013 15.645 -0.641 1.00 0.00 C ATOM 676 CG1 ILE A 306 -6.055 14.798 0.093 1.00 0.00 C ATOM 677 CG2 ILE A 306 -4.371 14.860 -1.776 1.00 0.00 C ATOM 678 CD1 ILE A 306 -7.165 14.281 -0.798 1.00 0.00 C ATOM 0 H ILE A 306 -3.785 14.171 0.995 1.00 0.00 H new ATOM 0 HA ILE A 306 -3.123 16.597 -0.243 1.00 0.00 H new ATOM 0 HB ILE A 306 -5.527 16.505 -1.070 1.00 0.00 H new ATOM 0 HG12 ILE A 306 -5.555 13.951 0.562 1.00 0.00 H new ATOM 0 HG13 ILE A 306 -6.493 15.393 0.894 1.00 0.00 H new ATOM 0 HG21 ILE A 306 -5.145 14.504 -2.455 1.00 0.00 H new ATOM 0 HG22 ILE A 306 -3.680 15.505 -2.319 1.00 0.00 H new ATOM 0 HG23 ILE A 306 -3.827 14.008 -1.367 1.00 0.00 H new ATOM 0 HD11 ILE A 306 -7.863 13.690 -0.204 1.00 0.00 H new ATOM 0 HD12 ILE A 306 -7.693 15.122 -1.247 1.00 0.00 H new ATOM 0 HD13 ILE A 306 -6.740 13.658 -1.585 1.00 0.00 H new ATOM 690 N ILE A 307 -4.767 16.895 2.488 1.00 0.00 N ATOM 691 CA ILE A 307 -5.246 17.866 3.465 1.00 0.00 C ATOM 692 C ILE A 307 -4.081 18.691 4.004 1.00 0.00 C ATOM 693 O ILE A 307 -4.171 19.914 4.117 1.00 0.00 O ATOM 694 CB ILE A 307 -5.989 17.183 4.638 1.00 0.00 C ATOM 695 CG1 ILE A 307 -7.224 16.435 4.129 1.00 0.00 C ATOM 696 CG2 ILE A 307 -6.388 18.201 5.694 1.00 0.00 C ATOM 697 CD1 ILE A 307 -8.257 17.324 3.466 1.00 0.00 C ATOM 0 H ILE A 307 -4.619 15.958 2.862 1.00 0.00 H new ATOM 0 HA ILE A 307 -5.953 18.521 2.955 1.00 0.00 H new ATOM 0 HB ILE A 307 -5.309 16.464 5.095 1.00 0.00 H new ATOM 0 HG12 ILE A 307 -6.906 15.673 3.418 1.00 0.00 H new ATOM 0 HG13 ILE A 307 -7.691 15.915 4.966 1.00 0.00 H new ATOM 0 HG21 ILE A 307 -6.909 17.696 6.508 1.00 0.00 H new ATOM 0 HG22 ILE A 307 -5.495 18.691 6.083 1.00 0.00 H new ATOM 0 HG23 ILE A 307 -7.047 18.947 5.250 1.00 0.00 H new ATOM 0 HD11 ILE A 307 -9.100 16.717 3.134 1.00 0.00 H new ATOM 0 HD12 ILE A 307 -8.606 18.071 4.179 1.00 0.00 H new ATOM 0 HD13 ILE A 307 -7.809 17.824 2.607 1.00 0.00 H new ATOM 709 N GLN A 308 -2.982 18.015 4.318 1.00 0.00 N ATOM 710 CA GLN A 308 -1.782 18.685 4.812 1.00 0.00 C ATOM 711 C GLN A 308 -1.171 19.564 3.727 1.00 0.00 C ATOM 712 O GLN A 308 -0.795 20.709 3.978 1.00 0.00 O ATOM 713 CB GLN A 308 -0.755 17.656 5.288 1.00 0.00 C ATOM 714 CG GLN A 308 -1.219 16.843 6.484 1.00 0.00 C ATOM 715 CD GLN A 308 -0.195 15.814 6.920 1.00 0.00 C ATOM 716 OE1 GLN A 308 0.680 16.098 7.737 1.00 0.00 O ATOM 717 NE2 GLN A 308 -0.306 14.608 6.388 1.00 0.00 N ATOM 0 H GLN A 308 -2.896 17.002 4.240 1.00 0.00 H new ATOM 0 HA GLN A 308 -2.067 19.317 5.653 1.00 0.00 H new ATOM 0 HB2 GLN A 308 -0.524 16.978 4.466 1.00 0.00 H new ATOM 0 HB3 GLN A 308 0.170 18.171 5.546 1.00 0.00 H new ATOM 0 HG2 GLN A 308 -1.431 17.515 7.316 1.00 0.00 H new ATOM 0 HG3 GLN A 308 -2.153 16.339 6.236 1.00 0.00 H new ATOM 0 HE21 GLN A 308 -1.046 14.414 5.714 1.00 0.00 H new ATOM 0 HE22 GLN A 308 0.349 13.872 6.652 1.00 0.00 H new ATOM 726 N LEU A 309 -1.074 19.017 2.523 1.00 0.00 N ATOM 727 CA LEU A 309 -0.552 19.755 1.381 1.00 0.00 C ATOM 728 C LEU A 309 -1.577 20.773 0.899 1.00 0.00 C ATOM 729 O LEU A 309 -1.276 21.962 0.787 1.00 0.00 O ATOM 730 CB LEU A 309 -0.176 18.792 0.247 1.00 0.00 C ATOM 731 CG LEU A 309 1.203 18.123 0.365 1.00 0.00 C ATOM 732 CD1 LEU A 309 2.303 19.168 0.437 1.00 0.00 C ATOM 733 CD2 LEU A 309 1.272 17.200 1.573 1.00 0.00 C ATOM 0 H LEU A 309 -1.352 18.059 2.311 1.00 0.00 H new ATOM 0 HA LEU A 309 0.347 20.288 1.691 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -0.934 18.011 0.193 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -0.214 19.338 -0.695 1.00 0.00 H new ATOM 0 HG LEU A 309 1.352 17.518 -0.530 1.00 0.00 H new ATOM 0 HD11 LEU A 309 3.270 18.673 0.520 1.00 0.00 H new ATOM 0 HD12 LEU A 309 2.284 19.779 -0.466 1.00 0.00 H new ATOM 0 HD13 LEU A 309 2.145 19.804 1.308 1.00 0.00 H new ATOM 0 HD21 LEU A 309 2.260 16.744 1.626 1.00 0.00 H new ATOM 0 HD22 LEU A 309 1.088 17.775 2.481 1.00 0.00 H new ATOM 0 HD23 LEU A 309 0.517 16.420 1.478 1.00 0.00 H new ATOM 745 N MET A 310 -2.786 20.290 0.627 1.00 0.00 N ATOM 746 CA MET A 310 -3.917 21.141 0.262 1.00 0.00 C ATOM 747 C MET A 310 -3.583 22.044 -0.926 1.00 0.00 C ATOM 748 O MET A 310 -3.417 23.255 -0.776 1.00 0.00 O ATOM 749 CB MET A 310 -4.356 21.973 1.475 1.00 0.00 C ATOM 750 CG MET A 310 -5.644 22.755 1.259 1.00 0.00 C ATOM 751 SD MET A 310 -6.153 23.677 2.724 1.00 0.00 S ATOM 752 CE MET A 310 -6.462 22.342 3.880 1.00 0.00 C ATOM 0 H MET A 310 -3.011 19.295 0.653 1.00 0.00 H new ATOM 0 HA MET A 310 -4.742 20.498 -0.045 1.00 0.00 H new ATOM 0 HB2 MET A 310 -4.486 21.309 2.330 1.00 0.00 H new ATOM 0 HB3 MET A 310 -3.559 22.671 1.731 1.00 0.00 H new ATOM 0 HG2 MET A 310 -5.509 23.447 0.428 1.00 0.00 H new ATOM 0 HG3 MET A 310 -6.439 22.066 0.974 1.00 0.00 H new ATOM 0 HE1 MET A 310 -7.188 22.667 4.625 1.00 0.00 H new ATOM 0 HE2 MET A 310 -6.855 21.479 3.343 1.00 0.00 H new ATOM 0 HE3 MET A 310 -5.531 22.067 4.376 1.00 0.00 H new ATOM 762 N SER A 311 -3.480 21.453 -2.108 1.00 0.00 N ATOM 763 CA SER A 311 -3.201 22.225 -3.314 1.00 0.00 C ATOM 764 C SER A 311 -4.168 21.866 -4.448 1.00 0.00 C ATOM 765 O SER A 311 -4.332 22.639 -5.395 1.00 0.00 O ATOM 766 CB SER A 311 -1.745 22.019 -3.750 1.00 0.00 C ATOM 767 OG SER A 311 -1.411 20.642 -3.826 1.00 0.00 O ATOM 0 H SER A 311 -3.584 20.450 -2.259 1.00 0.00 H new ATOM 0 HA SER A 311 -3.350 23.280 -3.082 1.00 0.00 H new ATOM 0 HB2 SER A 311 -1.586 22.486 -4.722 1.00 0.00 H new ATOM 0 HB3 SER A 311 -1.080 22.517 -3.044 1.00 0.00 H new ATOM 0 HG SER A 311 -0.921 20.379 -3.019 1.00 0.00 H new ATOM 773 N LYS A 312 -4.811 20.697 -4.322 1.00 0.00 N ATOM 774 CA LYS A 312 -5.781 20.180 -5.299 1.00 0.00 C ATOM 775 C LYS A 312 -5.143 19.812 -6.643 1.00 0.00 C ATOM 776 O LYS A 312 -5.465 18.777 -7.225 1.00 0.00 O ATOM 777 CB LYS A 312 -6.908 21.186 -5.505 1.00 0.00 C ATOM 778 CG LYS A 312 -7.744 21.412 -4.260 1.00 0.00 C ATOM 779 CD LYS A 312 -8.236 22.840 -4.199 1.00 0.00 C ATOM 780 CE LYS A 312 -9.183 23.069 -3.032 1.00 0.00 C ATOM 781 NZ LYS A 312 -8.490 22.988 -1.721 1.00 0.00 N ATOM 0 H LYS A 312 -4.670 20.074 -3.527 1.00 0.00 H new ATOM 0 HA LYS A 312 -6.184 19.257 -4.883 1.00 0.00 H new ATOM 0 HB2 LYS A 312 -6.483 22.137 -5.827 1.00 0.00 H new ATOM 0 HB3 LYS A 312 -7.555 20.837 -6.310 1.00 0.00 H new ATOM 0 HG2 LYS A 312 -8.593 20.729 -4.257 1.00 0.00 H new ATOM 0 HG3 LYS A 312 -7.152 21.188 -3.373 1.00 0.00 H new ATOM 0 HD2 LYS A 312 -7.383 23.513 -4.111 1.00 0.00 H new ATOM 0 HD3 LYS A 312 -8.743 23.088 -5.131 1.00 0.00 H new ATOM 0 HE2 LYS A 312 -9.651 24.048 -3.133 1.00 0.00 H new ATOM 0 HE3 LYS A 312 -9.982 22.329 -3.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 312 -9.175 23.151 -0.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 312 -8.065 22.045 -1.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 312 -7.744 23.711 -1.677 1.00 0.00 H new ATOM 795 N ARG A 313 -4.241 20.645 -7.127 1.00 0.00 N ATOM 796 CA ARG A 313 -3.655 20.453 -8.448 1.00 0.00 C ATOM 797 C ARG A 313 -2.345 19.688 -8.374 1.00 0.00 C ATOM 798 O ARG A 313 -1.350 20.090 -8.977 1.00 0.00 O ATOM 799 CB ARG A 313 -3.439 21.801 -9.139 1.00 0.00 C ATOM 800 CG ARG A 313 -4.724 22.573 -9.365 1.00 0.00 C ATOM 801 CD ARG A 313 -5.688 21.797 -10.247 1.00 0.00 C ATOM 802 NE ARG A 313 -7.017 22.396 -10.255 1.00 0.00 N ATOM 803 CZ ARG A 313 -8.142 21.704 -10.090 1.00 0.00 C ATOM 804 NH1 ARG A 313 -8.107 20.382 -9.965 1.00 0.00 N ATOM 805 NH2 ARG A 313 -9.305 22.338 -10.066 1.00 0.00 N ATOM 0 H ARG A 313 -3.895 21.464 -6.627 1.00 0.00 H new ATOM 0 HA ARG A 313 -4.356 19.860 -9.035 1.00 0.00 H new ATOM 0 HB2 ARG A 313 -2.761 22.406 -8.536 1.00 0.00 H new ATOM 0 HB3 ARG A 313 -2.950 21.635 -10.099 1.00 0.00 H new ATOM 0 HG2 ARG A 313 -5.196 22.785 -8.406 1.00 0.00 H new ATOM 0 HG3 ARG A 313 -4.497 23.533 -9.828 1.00 0.00 H new ATOM 0 HD2 ARG A 313 -5.300 21.760 -11.265 1.00 0.00 H new ATOM 0 HD3 ARG A 313 -5.755 20.768 -9.894 1.00 0.00 H new ATOM 0 HE ARG A 313 -7.089 23.404 -10.395 1.00 0.00 H new ATOM 0 HH11 ARG A 313 -7.214 19.890 -9.995 1.00 0.00 H new ATOM 0 HH12 ARG A 313 -8.973 19.859 -9.839 1.00 0.00 H new ATOM 0 HH21 ARG A 313 -9.335 23.352 -10.174 1.00 0.00 H new ATOM 0 HH22 ARG A 313 -10.170 21.812 -9.940 1.00 0.00 H new ATOM 819 N SER A 314 -2.357 18.586 -7.629 1.00 0.00 N ATOM 820 CA SER A 314 -1.203 17.698 -7.536 1.00 0.00 C ATOM 821 C SER A 314 -0.008 18.396 -6.888 1.00 0.00 C ATOM 822 O SER A 314 -0.098 19.541 -6.437 1.00 0.00 O ATOM 823 CB SER A 314 -0.828 17.189 -8.932 1.00 0.00 C ATOM 824 OG SER A 314 -1.926 16.536 -9.549 1.00 0.00 O ATOM 0 H SER A 314 -3.160 18.285 -7.077 1.00 0.00 H new ATOM 0 HA SER A 314 -1.474 16.854 -6.902 1.00 0.00 H new ATOM 0 HB2 SER A 314 -0.503 18.024 -9.552 1.00 0.00 H new ATOM 0 HB3 SER A 314 0.014 16.500 -8.858 1.00 0.00 H new ATOM 0 HG SER A 314 -1.662 16.222 -10.439 1.00 0.00 H new ATOM 830 N ARG A 315 1.104 17.687 -6.827 1.00 0.00 N ATOM 831 CA ARG A 315 2.331 18.228 -6.275 1.00 0.00 C ATOM 832 C ARG A 315 3.433 18.151 -7.318 1.00 0.00 C ATOM 833 O ARG A 315 4.112 17.129 -7.428 1.00 0.00 O ATOM 834 CB ARG A 315 2.735 17.455 -5.017 1.00 0.00 C ATOM 835 CG ARG A 315 1.743 17.568 -3.869 1.00 0.00 C ATOM 836 CD ARG A 315 1.871 18.898 -3.143 1.00 0.00 C ATOM 837 NE ARG A 315 1.479 20.042 -3.967 1.00 0.00 N ATOM 838 CZ ARG A 315 2.200 21.158 -4.088 1.00 0.00 C ATOM 839 NH1 ARG A 315 3.386 21.260 -3.499 1.00 0.00 N ATOM 840 NH2 ARG A 315 1.741 22.169 -4.812 1.00 0.00 N ATOM 0 H ARG A 315 1.182 16.725 -7.157 1.00 0.00 H new ATOM 0 HA ARG A 315 2.170 19.270 -6.000 1.00 0.00 H new ATOM 0 HB2 ARG A 315 2.857 16.403 -5.274 1.00 0.00 H new ATOM 0 HB3 ARG A 315 3.707 17.815 -4.679 1.00 0.00 H new ATOM 0 HG2 ARG A 315 0.729 17.459 -4.253 1.00 0.00 H new ATOM 0 HG3 ARG A 315 1.907 16.752 -3.165 1.00 0.00 H new ATOM 0 HD2 ARG A 315 1.253 18.876 -2.245 1.00 0.00 H new ATOM 0 HD3 ARG A 315 2.903 19.029 -2.817 1.00 0.00 H new ATOM 0 HE ARG A 315 0.600 19.982 -4.481 1.00 0.00 H new ATOM 0 HH11 ARG A 315 3.751 20.482 -2.950 1.00 0.00 H new ATOM 0 HH12 ARG A 315 3.932 22.116 -3.596 1.00 0.00 H new ATOM 0 HH21 ARG A 315 0.836 22.094 -5.277 1.00 0.00 H new ATOM 0 HH22 ARG A 315 2.293 23.022 -4.904 1.00 0.00 H new ATOM 854 N SER A 316 3.591 19.226 -8.085 1.00 0.00 N ATOM 855 CA SER A 316 4.562 19.274 -9.174 1.00 0.00 C ATOM 856 C SER A 316 5.938 18.790 -8.721 1.00 0.00 C ATOM 857 O SER A 316 6.397 19.134 -7.629 1.00 0.00 O ATOM 858 CB SER A 316 4.656 20.699 -9.721 1.00 0.00 C ATOM 859 OG SER A 316 3.382 21.170 -10.135 1.00 0.00 O ATOM 0 H SER A 316 3.052 20.085 -7.970 1.00 0.00 H new ATOM 0 HA SER A 316 4.220 18.604 -9.963 1.00 0.00 H new ATOM 0 HB2 SER A 316 5.061 21.360 -8.955 1.00 0.00 H new ATOM 0 HB3 SER A 316 5.348 20.724 -10.563 1.00 0.00 H new ATOM 0 HG SER A 316 3.467 22.084 -10.479 1.00 0.00 H new ATOM 865 N LEU A 317 6.568 17.976 -9.571 1.00 0.00 N ATOM 866 CA LEU A 317 7.868 17.354 -9.291 1.00 0.00 C ATOM 867 C LEU A 317 7.745 16.248 -8.243 1.00 0.00 C ATOM 868 O LEU A 317 8.159 15.116 -8.482 1.00 0.00 O ATOM 869 CB LEU A 317 8.912 18.391 -8.851 1.00 0.00 C ATOM 870 CG LEU A 317 9.176 19.523 -9.850 1.00 0.00 C ATOM 871 CD1 LEU A 317 10.271 20.441 -9.336 1.00 0.00 C ATOM 872 CD2 LEU A 317 9.551 18.963 -11.211 1.00 0.00 C ATOM 0 H LEU A 317 6.187 17.726 -10.484 1.00 0.00 H new ATOM 0 HA LEU A 317 8.210 16.906 -10.224 1.00 0.00 H new ATOM 0 HB2 LEU A 317 8.588 18.830 -7.908 1.00 0.00 H new ATOM 0 HB3 LEU A 317 9.852 17.875 -8.656 1.00 0.00 H new ATOM 0 HG LEU A 317 8.259 20.102 -9.958 1.00 0.00 H new ATOM 0 HD11 LEU A 317 10.445 21.239 -10.058 1.00 0.00 H new ATOM 0 HD12 LEU A 317 9.966 20.874 -8.383 1.00 0.00 H new ATOM 0 HD13 LEU A 317 11.189 19.870 -9.197 1.00 0.00 H new ATOM 0 HD21 LEU A 317 9.734 19.784 -11.904 1.00 0.00 H new ATOM 0 HD22 LEU A 317 10.453 18.358 -11.119 1.00 0.00 H new ATOM 0 HD23 LEU A 317 8.736 18.345 -11.587 1.00 0.00 H new ATOM 884 N ASN A 318 7.163 16.578 -7.098 1.00 0.00 N ATOM 885 CA ASN A 318 7.002 15.630 -5.997 1.00 0.00 C ATOM 886 C ASN A 318 6.265 14.369 -6.447 1.00 0.00 C ATOM 887 O ASN A 318 6.687 13.250 -6.148 1.00 0.00 O ATOM 888 CB ASN A 318 6.250 16.294 -4.838 1.00 0.00 C ATOM 889 CG ASN A 318 5.952 15.336 -3.697 1.00 0.00 C ATOM 890 OD1 ASN A 318 4.898 14.700 -3.661 1.00 0.00 O ATOM 891 ND2 ASN A 318 6.872 15.233 -2.751 1.00 0.00 N ATOM 0 H ASN A 318 6.789 17.507 -6.904 1.00 0.00 H new ATOM 0 HA ASN A 318 7.996 15.334 -5.661 1.00 0.00 H new ATOM 0 HB2 ASN A 318 6.841 17.128 -4.460 1.00 0.00 H new ATOM 0 HB3 ASN A 318 5.314 16.709 -5.210 1.00 0.00 H new ATOM 0 HD21 ASN A 318 6.720 14.610 -1.957 1.00 0.00 H new ATOM 0 HD22 ASN A 318 7.733 15.776 -2.816 1.00 0.00 H new ATOM 898 N SER A 319 5.170 14.551 -7.171 1.00 0.00 N ATOM 899 CA SER A 319 4.387 13.430 -7.664 1.00 0.00 C ATOM 900 C SER A 319 5.007 12.867 -8.934 1.00 0.00 C ATOM 901 O SER A 319 5.272 11.667 -9.036 1.00 0.00 O ATOM 902 CB SER A 319 2.954 13.885 -7.938 1.00 0.00 C ATOM 903 OG SER A 319 2.924 14.962 -8.859 1.00 0.00 O ATOM 0 H SER A 319 4.804 15.467 -7.430 1.00 0.00 H new ATOM 0 HA SER A 319 4.377 12.646 -6.907 1.00 0.00 H new ATOM 0 HB2 SER A 319 2.374 13.050 -8.332 1.00 0.00 H new ATOM 0 HB3 SER A 319 2.482 14.189 -7.004 1.00 0.00 H new ATOM 0 HG SER A 319 3.182 15.790 -8.403 1.00 0.00 H new ATOM 909 N ALA A 320 5.252 13.760 -9.880 1.00 0.00 N ATOM 910 CA ALA A 320 5.772 13.406 -11.203 1.00 0.00 C ATOM 911 C ALA A 320 7.065 12.590 -11.132 1.00 0.00 C ATOM 912 O ALA A 320 7.365 11.820 -12.046 1.00 0.00 O ATOM 913 CB ALA A 320 5.993 14.665 -12.026 1.00 0.00 C ATOM 0 H ALA A 320 5.096 14.760 -9.756 1.00 0.00 H new ATOM 0 HA ALA A 320 5.025 12.774 -11.683 1.00 0.00 H new ATOM 0 HB1 ALA A 320 6.380 14.394 -13.008 1.00 0.00 H new ATOM 0 HB2 ALA A 320 5.047 15.195 -12.142 1.00 0.00 H new ATOM 0 HB3 ALA A 320 6.711 15.310 -11.519 1.00 0.00 H new ATOM 919 N ALA A 321 7.823 12.759 -10.051 1.00 0.00 N ATOM 920 CA ALA A 321 9.075 12.029 -9.859 1.00 0.00 C ATOM 921 C ALA A 321 8.867 10.518 -9.930 1.00 0.00 C ATOM 922 O ALA A 321 9.711 9.793 -10.460 1.00 0.00 O ATOM 923 CB ALA A 321 9.712 12.407 -8.529 1.00 0.00 C ATOM 0 H ALA A 321 7.591 13.398 -9.291 1.00 0.00 H new ATOM 0 HA ALA A 321 9.745 12.311 -10.671 1.00 0.00 H new ATOM 0 HB1 ALA A 321 10.643 11.855 -8.402 1.00 0.00 H new ATOM 0 HB2 ALA A 321 9.920 13.477 -8.516 1.00 0.00 H new ATOM 0 HB3 ALA A 321 9.030 12.160 -7.716 1.00 0.00 H new ATOM 929 N PHE A 322 7.746 10.046 -9.397 1.00 0.00 N ATOM 930 CA PHE A 322 7.444 8.623 -9.402 1.00 0.00 C ATOM 931 C PHE A 322 6.234 8.331 -10.277 1.00 0.00 C ATOM 932 O PHE A 322 6.084 7.217 -10.786 1.00 0.00 O ATOM 933 CB PHE A 322 7.180 8.122 -7.980 1.00 0.00 C ATOM 934 CG PHE A 322 8.304 8.398 -7.026 1.00 0.00 C ATOM 935 CD1 PHE A 322 9.448 7.617 -7.036 1.00 0.00 C ATOM 936 CD2 PHE A 322 8.216 9.440 -6.118 1.00 0.00 C ATOM 937 CE1 PHE A 322 10.483 7.871 -6.157 1.00 0.00 C ATOM 938 CE2 PHE A 322 9.247 9.698 -5.238 1.00 0.00 C ATOM 939 CZ PHE A 322 10.382 8.912 -5.257 1.00 0.00 C ATOM 0 H PHE A 322 7.033 10.628 -8.957 1.00 0.00 H new ATOM 0 HA PHE A 322 8.310 8.100 -9.809 1.00 0.00 H new ATOM 0 HB2 PHE A 322 6.271 8.590 -7.602 1.00 0.00 H new ATOM 0 HB3 PHE A 322 6.996 7.048 -8.011 1.00 0.00 H new ATOM 0 HD1 PHE A 322 9.532 6.801 -7.738 1.00 0.00 H new ATOM 0 HD2 PHE A 322 7.330 10.058 -6.098 1.00 0.00 H new ATOM 0 HE1 PHE A 322 11.370 7.255 -6.174 1.00 0.00 H new ATOM 0 HE2 PHE A 322 9.166 10.514 -4.535 1.00 0.00 H new ATOM 0 HZ PHE A 322 11.190 9.112 -4.568 1.00 0.00 H new ATOM 949 N TYR A 323 5.384 9.349 -10.444 1.00 0.00 N ATOM 950 CA TYR A 323 4.132 9.241 -11.196 1.00 0.00 C ATOM 951 C TYR A 323 3.141 8.362 -10.437 1.00 0.00 C ATOM 952 O TYR A 323 2.178 8.864 -9.854 1.00 0.00 O ATOM 953 CB TYR A 323 4.380 8.685 -12.608 1.00 0.00 C ATOM 954 CG TYR A 323 3.201 8.836 -13.547 1.00 0.00 C ATOM 955 CD1 TYR A 323 2.859 10.078 -14.071 1.00 0.00 C ATOM 956 CD2 TYR A 323 2.431 7.739 -13.912 1.00 0.00 C ATOM 957 CE1 TYR A 323 1.782 10.219 -14.926 1.00 0.00 C ATOM 958 CE2 TYR A 323 1.353 7.873 -14.768 1.00 0.00 C ATOM 959 CZ TYR A 323 1.032 9.114 -15.270 1.00 0.00 C ATOM 960 OH TYR A 323 -0.046 9.251 -16.118 1.00 0.00 O ATOM 0 H TYR A 323 5.548 10.279 -10.057 1.00 0.00 H new ATOM 0 HA TYR A 323 3.708 10.239 -11.303 1.00 0.00 H new ATOM 0 HB2 TYR A 323 5.243 9.192 -13.040 1.00 0.00 H new ATOM 0 HB3 TYR A 323 4.637 7.628 -12.531 1.00 0.00 H new ATOM 0 HD1 TYR A 323 3.444 10.946 -13.806 1.00 0.00 H new ATOM 0 HD2 TYR A 323 2.679 6.764 -13.520 1.00 0.00 H new ATOM 0 HE1 TYR A 323 1.529 11.191 -15.323 1.00 0.00 H new ATOM 0 HE2 TYR A 323 0.766 7.009 -15.041 1.00 0.00 H new ATOM 0 HH TYR A 323 -0.465 8.376 -16.259 1.00 0.00 H new ATOM 970 N TYR A 324 3.401 7.061 -10.437 1.00 0.00 N ATOM 971 CA TYR A 324 2.581 6.087 -9.719 1.00 0.00 C ATOM 972 C TYR A 324 1.111 6.204 -10.136 1.00 0.00 C ATOM 973 O TYR A 324 0.204 6.186 -9.298 1.00 0.00 O ATOM 974 CB TYR A 324 2.751 6.271 -8.200 1.00 0.00 C ATOM 975 CG TYR A 324 2.189 5.135 -7.370 1.00 0.00 C ATOM 976 CD1 TYR A 324 2.661 3.837 -7.522 1.00 0.00 C ATOM 977 CD2 TYR A 324 1.182 5.361 -6.441 1.00 0.00 C ATOM 978 CE1 TYR A 324 2.146 2.798 -6.770 1.00 0.00 C ATOM 979 CE2 TYR A 324 0.663 4.330 -5.687 1.00 0.00 C ATOM 980 CZ TYR A 324 1.147 3.050 -5.855 1.00 0.00 C ATOM 981 OH TYR A 324 0.626 2.020 -5.104 1.00 0.00 O ATOM 0 H TYR A 324 4.189 6.648 -10.936 1.00 0.00 H new ATOM 0 HA TYR A 324 2.916 5.083 -9.979 1.00 0.00 H new ATOM 0 HB2 TYR A 324 3.812 6.380 -7.975 1.00 0.00 H new ATOM 0 HB3 TYR A 324 2.265 7.200 -7.901 1.00 0.00 H new ATOM 0 HD1 TYR A 324 3.443 3.637 -8.239 1.00 0.00 H new ATOM 0 HD2 TYR A 324 0.799 6.362 -6.307 1.00 0.00 H new ATOM 0 HE1 TYR A 324 2.524 1.795 -6.899 1.00 0.00 H new ATOM 0 HE2 TYR A 324 -0.119 4.524 -4.968 1.00 0.00 H new ATOM 0 HH TYR A 324 -0.069 2.369 -4.507 1.00 0.00 H new ATOM 991 N ARG A 325 0.906 6.375 -11.445 1.00 0.00 N ATOM 992 CA ARG A 325 -0.424 6.448 -12.060 1.00 0.00 C ATOM 993 C ARG A 325 -1.118 7.770 -11.745 1.00 0.00 C ATOM 994 O ARG A 325 -2.108 8.125 -12.380 1.00 0.00 O ATOM 995 CB ARG A 325 -1.275 5.272 -11.596 1.00 0.00 C ATOM 996 CG ARG A 325 -1.905 4.476 -12.725 1.00 0.00 C ATOM 997 CD ARG A 325 -2.991 5.267 -13.427 1.00 0.00 C ATOM 998 NE ARG A 325 -4.091 5.611 -12.524 1.00 0.00 N ATOM 999 CZ ARG A 325 -5.169 6.302 -12.888 1.00 0.00 C ATOM 1000 NH1 ARG A 325 -5.297 6.725 -14.140 1.00 0.00 N ATOM 1001 NH2 ARG A 325 -6.119 6.572 -11.999 1.00 0.00 N ATOM 0 H ARG A 325 1.668 6.468 -12.117 1.00 0.00 H new ATOM 0 HA ARG A 325 -0.300 6.396 -13.142 1.00 0.00 H new ATOM 0 HB2 ARG A 325 -0.656 4.604 -10.997 1.00 0.00 H new ATOM 0 HB3 ARG A 325 -2.065 5.645 -10.944 1.00 0.00 H new ATOM 0 HG2 ARG A 325 -1.137 4.194 -13.445 1.00 0.00 H new ATOM 0 HG3 ARG A 325 -2.326 3.552 -12.329 1.00 0.00 H new ATOM 0 HD2 ARG A 325 -2.564 6.180 -13.842 1.00 0.00 H new ATOM 0 HD3 ARG A 325 -3.378 4.687 -14.265 1.00 0.00 H new ATOM 0 HE ARG A 325 -4.027 5.301 -11.554 1.00 0.00 H new ATOM 0 HH11 ARG A 325 -4.569 6.521 -14.824 1.00 0.00 H new ATOM 0 HH12 ARG A 325 -6.124 7.254 -14.417 1.00 0.00 H new ATOM 0 HH21 ARG A 325 -6.023 6.250 -11.036 1.00 0.00 H new ATOM 0 HH22 ARG A 325 -6.944 7.102 -12.280 1.00 0.00 H new ATOM 1015 N VAL A 326 -0.560 8.497 -10.789 1.00 0.00 N ATOM 1016 CA VAL A 326 -1.126 9.764 -10.319 1.00 0.00 C ATOM 1017 C VAL A 326 -2.488 9.539 -9.664 1.00 0.00 C ATOM 1018 O VAL A 326 -3.505 9.465 -10.382 1.00 0.00 O ATOM 1019 CB VAL A 326 -1.248 10.811 -11.452 1.00 0.00 C ATOM 1020 CG1 VAL A 326 -1.870 12.103 -10.936 1.00 0.00 C ATOM 1021 CG2 VAL A 326 0.115 11.091 -12.064 1.00 0.00 C ATOM 1022 OXT VAL A 326 -2.531 9.419 -8.424 1.00 0.00 O ATOM 0 H VAL A 326 0.301 8.229 -10.312 1.00 0.00 H new ATOM 0 HA VAL A 326 -0.433 10.162 -9.578 1.00 0.00 H new ATOM 0 HB VAL A 326 -1.902 10.401 -12.222 1.00 0.00 H new ATOM 0 HG11 VAL A 326 -1.945 12.822 -11.752 1.00 0.00 H new ATOM 0 HG12 VAL A 326 -2.865 11.896 -10.543 1.00 0.00 H new ATOM 0 HG13 VAL A 326 -1.246 12.516 -10.144 1.00 0.00 H new ATOM 0 HG21 VAL A 326 0.012 11.829 -12.859 1.00 0.00 H new ATOM 0 HG22 VAL A 326 0.786 11.476 -11.296 1.00 0.00 H new ATOM 0 HG23 VAL A 326 0.525 10.169 -12.476 1.00 0.00 H new TER 1032 VAL A 326