USER MOD reduce.3.24.130724 H: found=0, std=0, add=514, rem=0, adj=18 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 390 ASN : amide:sc= 0 X(o=-0.83,f=-1.1) USER MOD Set 1.2: A 393 ASN : amide:sc= -0.827 K(o=-0.83,f=-0.019) USER MOD Set 2.1: A 364 ASN : amide:sc= 1.9 K(o=2.7,f=-5.7!) USER MOD Set 2.2: A 366 ASN : amide:sc= 0.769 K(o=2.7,f=1.2) USER MOD Set 3.1: A 331 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 350 THR OG1 : rot 180:sc= 0 USER MOD Single : A 324 SER OG : rot 48:sc= 0.288 USER MOD Single : A 325 LYS NZ :NH3+ 158:sc= -0.103 (180deg=-0.642) USER MOD Single : A 326 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 327 CYS SG : rot 180:sc= 0 USER MOD Single : A 333 THR OG1 : rot 180:sc= 0.0672 USER MOD Single : A 334 SER OG : rot 180:sc= 0.0209 USER MOD Single : A 335 ASN : amide:sc= -0.069 X(o=-0.069,f=-0.16) USER MOD Single : A 340 ASN : amide:sc= 1.24 K(o=1.2,f=-0.037) USER MOD Single : A 341 THR OG1 : rot -130:sc= -1.06! USER MOD Single : A 342 LYS NZ :NH3+ -174:sc= 1.26 (180deg=1.23) USER MOD Single : A 346 LYS NZ :NH3+ -153:sc= 1.38 (180deg=-0.2) USER MOD Single : A 348 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 353 LYS NZ :NH3+ -164:sc= -0.273 (180deg=-0.843) USER MOD Single : A 357 SER OG : rot 180:sc= 0 USER MOD Single : A 358 ASN : amide:sc=-0.00584 K(o=-0.0058,f=-3.1!) USER MOD Single : A 359 HIS : no HD1:sc= 0.615 K(o=0.62,f=-2.6!) USER MOD Single : A 360 MET CE :methyl -116:sc= -1.58 (180deg=-6.66!) USER MOD Single : A 365 GLN : amide:sc= -3.13 K(o=-3.1,f=-0.57) USER MOD Single : A 368 LYS NZ :NH3+ 148:sc= -0.725! (180deg=-3.41!) USER MOD Single : A 382 HIS : no HE2:sc= -1.5! C(o=-1.5!,f=-6.8!) USER MOD Single : A 384 SER OG : rot 180:sc= 0 USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 388 ASN : amide:sc= -0.0986 X(o=-0.099,f=-0.0016) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 323 12.519 13.128 -1.332 1.00 0.00 N ATOM 2 CA GLY A 323 12.518 11.717 -1.745 1.00 0.00 C ATOM 3 C GLY A 323 12.580 11.575 -3.241 1.00 0.00 C ATOM 4 O GLY A 323 12.212 12.499 -3.968 1.00 0.00 O ATOM 0 HA2 GLY A 323 13.369 11.206 -1.295 1.00 0.00 H new ATOM 0 HA3 GLY A 323 11.618 11.229 -1.370 1.00 0.00 H new ATOM 10 N SER A 324 13.048 10.434 -3.704 1.00 0.00 N ATOM 11 CA SER A 324 13.156 10.176 -5.123 1.00 0.00 C ATOM 12 C SER A 324 11.802 9.794 -5.704 1.00 0.00 C ATOM 13 O SER A 324 11.331 8.674 -5.515 1.00 0.00 O ATOM 14 CB SER A 324 14.176 9.068 -5.369 1.00 0.00 C ATOM 15 OG SER A 324 13.922 7.951 -4.525 1.00 0.00 O ATOM 0 H SER A 324 13.362 9.665 -3.111 1.00 0.00 H new ATOM 0 HA SER A 324 13.493 11.085 -5.622 1.00 0.00 H new ATOM 0 HB2 SER A 324 14.137 8.757 -6.413 1.00 0.00 H new ATOM 0 HB3 SER A 324 15.182 9.446 -5.186 1.00 0.00 H new ATOM 0 HG SER A 324 12.969 7.725 -4.559 1.00 0.00 H new ATOM 21 N LYS A 325 11.177 10.722 -6.393 1.00 0.00 N ATOM 22 CA LYS A 325 9.883 10.471 -6.976 1.00 0.00 C ATOM 23 C LYS A 325 9.990 10.411 -8.491 1.00 0.00 C ATOM 24 O LYS A 325 9.777 11.403 -9.188 1.00 0.00 O ATOM 25 CB LYS A 325 8.875 11.539 -6.546 1.00 0.00 C ATOM 26 CG LYS A 325 7.425 11.138 -6.760 1.00 0.00 C ATOM 27 CD LYS A 325 6.473 12.198 -6.235 1.00 0.00 C ATOM 28 CE LYS A 325 5.056 11.659 -6.116 1.00 0.00 C ATOM 29 NZ LYS A 325 4.973 10.549 -5.132 1.00 0.00 N1+ ATOM 0 H LYS A 325 11.546 11.658 -6.562 1.00 0.00 H new ATOM 0 HA LYS A 325 9.525 9.507 -6.616 1.00 0.00 H new ATOM 0 HB2 LYS A 325 9.027 11.765 -5.491 1.00 0.00 H new ATOM 0 HB3 LYS A 325 9.074 12.456 -7.100 1.00 0.00 H new ATOM 0 HG2 LYS A 325 7.243 10.978 -7.823 1.00 0.00 H new ATOM 0 HG3 LYS A 325 7.230 10.191 -6.257 1.00 0.00 H new ATOM 0 HD2 LYS A 325 6.815 12.546 -5.260 1.00 0.00 H new ATOM 0 HD3 LYS A 325 6.482 13.060 -6.902 1.00 0.00 H new ATOM 0 HE2 LYS A 325 4.384 12.463 -5.815 1.00 0.00 H new ATOM 0 HE3 LYS A 325 4.717 11.308 -7.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 325 3.993 10.454 -4.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 325 5.272 9.661 -5.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 325 5.596 10.753 -4.325 1.00 0.00 H new ATOM 43 N LYS A 326 10.355 9.248 -8.993 1.00 0.00 N ATOM 44 CA LYS A 326 10.504 9.040 -10.423 1.00 0.00 C ATOM 45 C LYS A 326 9.243 8.433 -11.005 1.00 0.00 C ATOM 46 O LYS A 326 9.162 8.158 -12.201 1.00 0.00 O ATOM 47 CB LYS A 326 11.709 8.145 -10.703 1.00 0.00 C ATOM 48 CG LYS A 326 13.033 8.760 -10.272 1.00 0.00 C ATOM 49 CD LYS A 326 14.187 7.784 -10.425 1.00 0.00 C ATOM 50 CE LYS A 326 14.020 6.578 -9.516 1.00 0.00 C ATOM 51 NZ LYS A 326 15.203 5.686 -9.546 1.00 0.00 N1+ ATOM 0 H LYS A 326 10.556 8.424 -8.427 1.00 0.00 H new ATOM 0 HA LYS A 326 10.670 10.006 -10.900 1.00 0.00 H new ATOM 0 HB2 LYS A 326 11.574 7.194 -10.187 1.00 0.00 H new ATOM 0 HB3 LYS A 326 11.749 7.926 -11.770 1.00 0.00 H new ATOM 0 HG2 LYS A 326 13.230 9.652 -10.867 1.00 0.00 H new ATOM 0 HG3 LYS A 326 12.963 9.080 -9.232 1.00 0.00 H new ATOM 0 HD2 LYS A 326 14.250 7.454 -11.462 1.00 0.00 H new ATOM 0 HD3 LYS A 326 15.125 8.289 -10.193 1.00 0.00 H new ATOM 0 HE2 LYS A 326 13.848 6.916 -8.494 1.00 0.00 H new ATOM 0 HE3 LYS A 326 13.136 6.017 -9.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 326 15.044 4.877 -8.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 326 15.353 5.341 -10.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 326 16.043 6.213 -9.232 1.00 0.00 H new ATOM 65 N CYS A 327 8.266 8.212 -10.150 1.00 0.00 N ATOM 66 CA CYS A 327 6.989 7.687 -10.575 1.00 0.00 C ATOM 67 C CYS A 327 6.040 8.835 -10.866 1.00 0.00 C ATOM 68 O CYS A 327 5.827 9.711 -10.019 1.00 0.00 O ATOM 69 CB CYS A 327 6.410 6.778 -9.496 1.00 0.00 C ATOM 70 SG CYS A 327 7.489 5.404 -9.044 1.00 0.00 S ATOM 0 H CYS A 327 8.335 8.390 -9.148 1.00 0.00 H new ATOM 0 HA CYS A 327 7.125 7.100 -11.483 1.00 0.00 H new ATOM 0 HB2 CYS A 327 6.203 7.373 -8.606 1.00 0.00 H new ATOM 0 HB3 CYS A 327 5.456 6.380 -9.843 1.00 0.00 H new ATOM 0 HG CYS A 327 6.917 4.689 -8.121 1.00 0.00 H new ATOM 76 N ASP A 328 5.491 8.855 -12.058 1.00 0.00 N ATOM 77 CA ASP A 328 4.592 9.919 -12.452 1.00 0.00 C ATOM 78 C ASP A 328 3.151 9.469 -12.327 1.00 0.00 C ATOM 79 O ASP A 328 2.533 9.036 -13.298 1.00 0.00 O ATOM 80 CB ASP A 328 4.894 10.391 -13.877 1.00 0.00 C ATOM 81 CG ASP A 328 4.197 11.691 -14.216 1.00 0.00 C ATOM 82 OD1 ASP A 328 4.705 12.761 -13.819 1.00 0.00 O1- ATOM 83 OD2 ASP A 328 3.145 11.656 -14.879 1.00 0.00 O ATOM 0 H ASP A 328 5.650 8.146 -12.774 1.00 0.00 H new ATOM 0 HA ASP A 328 4.747 10.763 -11.780 1.00 0.00 H new ATOM 0 HB2 ASP A 328 5.970 10.518 -13.994 1.00 0.00 H new ATOM 0 HB3 ASP A 328 4.585 9.621 -14.584 1.00 0.00 H new ATOM 88 N ASP A 329 2.643 9.517 -11.115 1.00 0.00 N ATOM 89 CA ASP A 329 1.266 9.136 -10.849 1.00 0.00 C ATOM 90 C ASP A 329 0.406 10.374 -10.708 1.00 0.00 C ATOM 91 O ASP A 329 0.749 11.295 -9.963 1.00 0.00 O ATOM 92 CB ASP A 329 1.162 8.289 -9.573 1.00 0.00 C ATOM 93 CG ASP A 329 1.912 6.976 -9.662 1.00 0.00 C ATOM 94 OD1 ASP A 329 1.462 6.071 -10.394 1.00 0.00 O ATOM 95 OD2 ASP A 329 2.946 6.830 -8.980 1.00 0.00 O1- ATOM 0 H ASP A 329 3.164 9.818 -10.291 1.00 0.00 H new ATOM 0 HA ASP A 329 0.913 8.538 -11.689 1.00 0.00 H new ATOM 0 HB2 ASP A 329 1.548 8.864 -8.731 1.00 0.00 H new ATOM 0 HB3 ASP A 329 0.112 8.086 -9.365 1.00 0.00 H new ATOM 100 N ASP A 330 -0.701 10.403 -11.422 1.00 0.00 N ATOM 101 CA ASP A 330 -1.605 11.544 -11.375 1.00 0.00 C ATOM 102 C ASP A 330 -2.706 11.291 -10.342 1.00 0.00 C ATOM 103 O ASP A 330 -2.743 10.229 -9.711 1.00 0.00 O ATOM 104 CB ASP A 330 -2.215 11.800 -12.764 1.00 0.00 C ATOM 105 CG ASP A 330 -2.796 13.199 -12.908 1.00 0.00 C ATOM 106 OD1 ASP A 330 -3.998 13.389 -12.602 1.00 0.00 O1- ATOM 107 OD2 ASP A 330 -2.061 14.110 -13.323 1.00 0.00 O ATOM 0 H ASP A 330 -1.000 9.651 -12.043 1.00 0.00 H new ATOM 0 HA ASP A 330 -1.044 12.431 -11.080 1.00 0.00 H new ATOM 0 HB2 ASP A 330 -1.449 11.650 -13.525 1.00 0.00 H new ATOM 0 HB3 ASP A 330 -2.998 11.066 -12.952 1.00 0.00 H new ATOM 112 N SER A 331 -3.595 12.251 -10.169 1.00 0.00 N ATOM 113 CA SER A 331 -4.672 12.130 -9.206 1.00 0.00 C ATOM 114 C SER A 331 -5.989 11.763 -9.895 1.00 0.00 C ATOM 115 O SER A 331 -6.986 11.459 -9.230 1.00 0.00 O ATOM 116 CB SER A 331 -4.821 13.434 -8.429 1.00 0.00 C ATOM 117 OG SER A 331 -3.573 13.836 -7.878 1.00 0.00 O ATOM 0 H SER A 331 -3.591 13.129 -10.687 1.00 0.00 H new ATOM 0 HA SER A 331 -4.425 11.327 -8.511 1.00 0.00 H new ATOM 0 HB2 SER A 331 -5.202 14.214 -9.088 1.00 0.00 H new ATOM 0 HB3 SER A 331 -5.552 13.306 -7.631 1.00 0.00 H new ATOM 0 HG SER A 331 -3.688 14.675 -7.385 1.00 0.00 H new ATOM 123 N GLU A 332 -5.989 11.791 -11.229 1.00 0.00 N ATOM 124 CA GLU A 332 -7.185 11.450 -11.998 1.00 0.00 C ATOM 125 C GLU A 332 -7.510 9.962 -11.885 1.00 0.00 C ATOM 126 O GLU A 332 -8.649 9.547 -12.098 1.00 0.00 O ATOM 127 CB GLU A 332 -7.028 11.839 -13.469 1.00 0.00 C ATOM 128 CG GLU A 332 -5.837 11.203 -14.161 1.00 0.00 C ATOM 129 CD GLU A 332 -5.914 11.336 -15.660 1.00 0.00 C ATOM 130 OE1 GLU A 332 -6.125 12.466 -16.156 1.00 0.00 O ATOM 131 OE2 GLU A 332 -5.774 10.313 -16.356 1.00 0.00 O1- ATOM 0 H GLU A 332 -5.179 12.045 -11.795 1.00 0.00 H new ATOM 0 HA GLU A 332 -8.013 12.019 -11.575 1.00 0.00 H new ATOM 0 HB2 GLU A 332 -7.936 11.561 -14.005 1.00 0.00 H new ATOM 0 HB3 GLU A 332 -6.937 12.923 -13.538 1.00 0.00 H new ATOM 0 HG2 GLU A 332 -4.919 11.669 -13.803 1.00 0.00 H new ATOM 0 HG3 GLU A 332 -5.784 10.148 -13.893 1.00 0.00 H new ATOM 138 N THR A 333 -6.510 9.166 -11.551 1.00 0.00 N ATOM 139 CA THR A 333 -6.693 7.752 -11.386 1.00 0.00 C ATOM 140 C THR A 333 -7.228 7.450 -9.990 1.00 0.00 C ATOM 141 O THR A 333 -6.523 6.916 -9.134 1.00 0.00 O ATOM 142 CB THR A 333 -5.379 7.007 -11.633 1.00 0.00 C ATOM 143 OG1 THR A 333 -4.291 7.742 -11.048 1.00 0.00 O ATOM 144 CG2 THR A 333 -5.133 6.840 -13.121 1.00 0.00 C ATOM 0 H THR A 333 -5.556 9.488 -11.389 1.00 0.00 H new ATOM 0 HA THR A 333 -7.422 7.407 -12.119 1.00 0.00 H new ATOM 0 HB THR A 333 -5.446 6.020 -11.175 1.00 0.00 H new ATOM 0 HG1 THR A 333 -3.451 7.263 -11.206 1.00 0.00 H new ATOM 0 HG21 THR A 333 -4.194 6.308 -13.277 1.00 0.00 H new ATOM 0 HG22 THR A 333 -5.951 6.271 -13.563 1.00 0.00 H new ATOM 0 HG23 THR A 333 -5.077 7.821 -13.593 1.00 0.00 H new ATOM 152 N SER A 334 -8.469 7.820 -9.770 1.00 0.00 N ATOM 153 CA SER A 334 -9.107 7.662 -8.484 1.00 0.00 C ATOM 154 C SER A 334 -10.073 6.499 -8.476 1.00 0.00 C ATOM 155 O SER A 334 -11.071 6.512 -7.754 1.00 0.00 O ATOM 156 CB SER A 334 -9.807 8.959 -8.103 1.00 0.00 C ATOM 157 OG SER A 334 -10.476 9.523 -9.226 1.00 0.00 O ATOM 0 H SER A 334 -9.066 8.241 -10.482 1.00 0.00 H new ATOM 0 HA SER A 334 -8.340 7.438 -7.743 1.00 0.00 H new ATOM 0 HB2 SER A 334 -10.524 8.769 -7.305 1.00 0.00 H new ATOM 0 HB3 SER A 334 -9.078 9.670 -7.714 1.00 0.00 H new ATOM 0 HG SER A 334 -10.920 10.355 -8.958 1.00 0.00 H new ATOM 163 N ASN A 335 -9.743 5.472 -9.239 1.00 0.00 N ATOM 164 CA ASN A 335 -10.571 4.278 -9.331 1.00 0.00 C ATOM 165 C ASN A 335 -10.770 3.627 -7.962 1.00 0.00 C ATOM 166 O ASN A 335 -11.755 2.932 -7.732 1.00 0.00 O ATOM 167 CB ASN A 335 -9.966 3.273 -10.327 1.00 0.00 C ATOM 168 CG ASN A 335 -8.581 2.791 -9.920 1.00 0.00 C ATOM 169 OD1 ASN A 335 -7.571 3.430 -10.231 1.00 0.00 O ATOM 170 ND2 ASN A 335 -8.519 1.662 -9.244 1.00 0.00 N ATOM 0 H ASN A 335 -8.899 5.440 -9.810 1.00 0.00 H new ATOM 0 HA ASN A 335 -11.551 4.583 -9.698 1.00 0.00 H new ATOM 0 HB2 ASN A 335 -10.631 2.414 -10.417 1.00 0.00 H new ATOM 0 HB3 ASN A 335 -9.908 3.736 -11.312 1.00 0.00 H new ATOM 0 HD21 ASN A 335 -7.614 1.287 -8.959 1.00 0.00 H new ATOM 0 HD22 ASN A 335 -9.376 1.163 -9.006 1.00 0.00 H new ATOM 177 N TRP A 336 -9.832 3.862 -7.060 1.00 0.00 N ATOM 178 CA TRP A 336 -9.916 3.330 -5.706 1.00 0.00 C ATOM 179 C TRP A 336 -10.006 4.468 -4.700 1.00 0.00 C ATOM 180 O TRP A 336 -10.606 4.336 -3.640 1.00 0.00 O ATOM 181 CB TRP A 336 -8.710 2.429 -5.400 1.00 0.00 C ATOM 182 CG TRP A 336 -7.377 3.102 -5.588 1.00 0.00 C ATOM 183 CD1 TRP A 336 -6.740 3.340 -6.770 1.00 0.00 C ATOM 184 CD2 TRP A 336 -6.516 3.613 -4.563 1.00 0.00 C ATOM 185 NE1 TRP A 336 -5.547 3.974 -6.546 1.00 0.00 N ATOM 186 CE2 TRP A 336 -5.382 4.152 -5.201 1.00 0.00 C ATOM 187 CE3 TRP A 336 -6.594 3.670 -3.170 1.00 0.00 C ATOM 188 CZ2 TRP A 336 -4.337 4.737 -4.493 1.00 0.00 C ATOM 189 CZ3 TRP A 336 -5.555 4.252 -2.468 1.00 0.00 C ATOM 190 CH2 TRP A 336 -4.441 4.779 -3.132 1.00 0.00 C ATOM 0 H TRP A 336 -8.998 4.421 -7.240 1.00 0.00 H new ATOM 0 HA TRP A 336 -10.818 2.724 -5.627 1.00 0.00 H new ATOM 0 HB2 TRP A 336 -8.785 2.077 -4.371 1.00 0.00 H new ATOM 0 HB3 TRP A 336 -8.755 1.550 -6.042 1.00 0.00 H new ATOM 0 HD1 TRP A 336 -7.122 3.068 -7.743 1.00 0.00 H new ATOM 0 HE1 TRP A 336 -4.888 4.266 -7.267 1.00 0.00 H new ATOM 0 HE3 TRP A 336 -7.451 3.267 -2.650 1.00 0.00 H new ATOM 0 HZ2 TRP A 336 -3.475 5.143 -5.001 1.00 0.00 H new ATOM 0 HZ3 TRP A 336 -5.604 4.301 -1.390 1.00 0.00 H new ATOM 0 HH2 TRP A 336 -3.646 5.229 -2.555 1.00 0.00 H new ATOM 201 N ILE A 337 -9.419 5.594 -5.062 1.00 0.00 N ATOM 202 CA ILE A 337 -9.417 6.789 -4.228 1.00 0.00 C ATOM 203 C ILE A 337 -10.844 7.269 -3.946 1.00 0.00 C ATOM 204 O ILE A 337 -11.106 7.873 -2.915 1.00 0.00 O ATOM 205 CB ILE A 337 -8.600 7.919 -4.911 1.00 0.00 C ATOM 206 CG1 ILE A 337 -7.119 7.531 -4.965 1.00 0.00 C ATOM 207 CG2 ILE A 337 -8.789 9.256 -4.200 1.00 0.00 C ATOM 208 CD1 ILE A 337 -6.280 8.435 -5.844 1.00 0.00 C ATOM 0 H ILE A 337 -8.926 5.709 -5.948 1.00 0.00 H new ATOM 0 HA ILE A 337 -8.950 6.535 -3.277 1.00 0.00 H new ATOM 0 HB ILE A 337 -8.970 8.042 -5.929 1.00 0.00 H new ATOM 0 HG12 ILE A 337 -6.713 7.545 -3.954 1.00 0.00 H new ATOM 0 HG13 ILE A 337 -7.035 6.507 -5.328 1.00 0.00 H new ATOM 0 HG21 ILE A 337 -8.202 10.023 -4.706 1.00 0.00 H new ATOM 0 HG22 ILE A 337 -9.843 9.533 -4.220 1.00 0.00 H new ATOM 0 HG23 ILE A 337 -8.457 9.168 -3.166 1.00 0.00 H new ATOM 0 HD11 ILE A 337 -5.244 8.096 -5.831 1.00 0.00 H new ATOM 0 HD12 ILE A 337 -6.659 8.403 -6.865 1.00 0.00 H new ATOM 0 HD13 ILE A 337 -6.332 9.457 -5.469 1.00 0.00 H new ATOM 220 N ALA A 338 -11.760 6.944 -4.857 1.00 0.00 N ATOM 221 CA ALA A 338 -13.166 7.349 -4.754 1.00 0.00 C ATOM 222 C ALA A 338 -13.763 7.077 -3.364 1.00 0.00 C ATOM 223 O ALA A 338 -14.593 7.852 -2.878 1.00 0.00 O ATOM 224 CB ALA A 338 -13.988 6.652 -5.826 1.00 0.00 C ATOM 0 H ALA A 338 -11.551 6.392 -5.689 1.00 0.00 H new ATOM 0 HA ALA A 338 -13.201 8.428 -4.907 1.00 0.00 H new ATOM 0 HB1 ALA A 338 -15.031 6.959 -5.742 1.00 0.00 H new ATOM 0 HB2 ALA A 338 -13.608 6.925 -6.811 1.00 0.00 H new ATOM 0 HB3 ALA A 338 -13.916 5.572 -5.695 1.00 0.00 H new ATOM 230 N ALA A 339 -13.348 5.985 -2.729 1.00 0.00 N ATOM 231 CA ALA A 339 -13.861 5.657 -1.405 1.00 0.00 C ATOM 232 C ALA A 339 -12.790 5.069 -0.493 1.00 0.00 C ATOM 233 O ALA A 339 -13.092 4.615 0.611 1.00 0.00 O ATOM 234 CB ALA A 339 -15.041 4.704 -1.514 1.00 0.00 C ATOM 0 H ALA A 339 -12.669 5.322 -3.103 1.00 0.00 H new ATOM 0 HA ALA A 339 -14.192 6.591 -0.952 1.00 0.00 H new ATOM 0 HB1 ALA A 339 -15.412 4.469 -0.516 1.00 0.00 H new ATOM 0 HB2 ALA A 339 -15.835 5.173 -2.096 1.00 0.00 H new ATOM 0 HB3 ALA A 339 -14.723 3.786 -2.008 1.00 0.00 H new ATOM 240 N ASN A 340 -11.544 5.087 -0.935 1.00 0.00 N ATOM 241 CA ASN A 340 -10.461 4.530 -0.123 1.00 0.00 C ATOM 242 C ASN A 340 -9.453 5.588 0.249 1.00 0.00 C ATOM 243 O ASN A 340 -8.509 5.327 0.988 1.00 0.00 O ATOM 244 CB ASN A 340 -9.757 3.376 -0.843 1.00 0.00 C ATOM 245 CG ASN A 340 -10.654 2.177 -1.046 1.00 0.00 C ATOM 246 OD1 ASN A 340 -10.736 1.293 -0.194 1.00 0.00 O ATOM 247 ND2 ASN A 340 -11.330 2.143 -2.168 1.00 0.00 N ATOM 0 H ASN A 340 -11.254 5.472 -1.834 1.00 0.00 H new ATOM 0 HA ASN A 340 -10.916 4.145 0.789 1.00 0.00 H new ATOM 0 HB2 ASN A 340 -9.398 3.723 -1.812 1.00 0.00 H new ATOM 0 HB3 ASN A 340 -8.881 3.075 -0.268 1.00 0.00 H new ATOM 0 HD21 ASN A 340 -11.955 1.361 -2.363 1.00 0.00 H new ATOM 0 HD22 ASN A 340 -11.231 2.898 -2.846 1.00 0.00 H new ATOM 254 N THR A 341 -9.634 6.776 -0.278 1.00 0.00 N ATOM 255 CA THR A 341 -8.735 7.874 0.014 1.00 0.00 C ATOM 256 C THR A 341 -9.487 9.202 -0.090 1.00 0.00 C ATOM 257 O THR A 341 -10.575 9.250 -0.645 1.00 0.00 O ATOM 258 CB THR A 341 -7.536 7.881 -0.955 1.00 0.00 C ATOM 259 OG1 THR A 341 -7.489 6.644 -1.677 1.00 0.00 O ATOM 260 CG2 THR A 341 -6.241 8.048 -0.188 1.00 0.00 C ATOM 0 H THR A 341 -10.397 7.010 -0.913 1.00 0.00 H new ATOM 0 HA THR A 341 -8.357 7.744 1.028 1.00 0.00 H new ATOM 0 HB THR A 341 -7.657 8.713 -1.648 1.00 0.00 H new ATOM 0 HG1 THR A 341 -6.585 6.269 -1.625 1.00 0.00 H new ATOM 0 HG21 THR A 341 -5.403 8.051 -0.885 1.00 0.00 H new ATOM 0 HG22 THR A 341 -6.261 8.990 0.359 1.00 0.00 H new ATOM 0 HG23 THR A 341 -6.125 7.223 0.515 1.00 0.00 H new ATOM 268 N LYS A 342 -8.919 10.268 0.460 1.00 0.00 N ATOM 269 CA LYS A 342 -9.553 11.591 0.405 1.00 0.00 C ATOM 270 C LYS A 342 -8.501 12.669 0.206 1.00 0.00 C ATOM 271 O LYS A 342 -7.314 12.365 0.064 1.00 0.00 O ATOM 272 CB LYS A 342 -10.403 11.879 1.670 1.00 0.00 C ATOM 273 CG LYS A 342 -11.567 10.906 1.857 1.00 0.00 C ATOM 274 CD LYS A 342 -12.623 11.417 2.838 1.00 0.00 C ATOM 275 CE LYS A 342 -12.085 11.562 4.254 1.00 0.00 C ATOM 276 NZ LYS A 342 -13.185 11.694 5.246 1.00 0.00 N1+ ATOM 0 H LYS A 342 -8.024 10.249 0.949 1.00 0.00 H new ATOM 0 HA LYS A 342 -10.233 11.598 -0.447 1.00 0.00 H new ATOM 0 HB2 LYS A 342 -9.759 11.836 2.548 1.00 0.00 H new ATOM 0 HB3 LYS A 342 -10.795 12.895 1.612 1.00 0.00 H new ATOM 0 HG2 LYS A 342 -12.036 10.720 0.891 1.00 0.00 H new ATOM 0 HG3 LYS A 342 -11.181 9.951 2.213 1.00 0.00 H new ATOM 0 HD2 LYS A 342 -12.996 12.382 2.494 1.00 0.00 H new ATOM 0 HD3 LYS A 342 -13.470 10.731 2.844 1.00 0.00 H new ATOM 0 HE2 LYS A 342 -11.473 10.695 4.502 1.00 0.00 H new ATOM 0 HE3 LYS A 342 -11.437 12.437 4.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 342 -12.784 11.892 6.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 342 -13.813 12.474 4.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 342 -13.728 10.808 5.282 1.00 0.00 H new ATOM 290 N GLU A 343 -8.925 13.921 0.193 1.00 0.00 N ATOM 291 CA GLU A 343 -8.007 15.027 -0.037 1.00 0.00 C ATOM 292 C GLU A 343 -8.022 16.014 1.117 1.00 0.00 C ATOM 293 O GLU A 343 -8.955 16.028 1.931 1.00 0.00 O ATOM 294 CB GLU A 343 -8.371 15.754 -1.327 1.00 0.00 C ATOM 295 CG GLU A 343 -8.401 14.861 -2.550 1.00 0.00 C ATOM 296 CD GLU A 343 -8.904 15.585 -3.775 1.00 0.00 C ATOM 297 OE1 GLU A 343 -10.119 15.870 -3.850 1.00 0.00 O ATOM 298 OE2 GLU A 343 -8.090 15.874 -4.673 1.00 0.00 O1- ATOM 0 H GLU A 343 -9.896 14.198 0.338 1.00 0.00 H new ATOM 0 HA GLU A 343 -7.004 14.608 -0.119 1.00 0.00 H new ATOM 0 HB2 GLU A 343 -9.349 16.220 -1.206 1.00 0.00 H new ATOM 0 HB3 GLU A 343 -7.654 16.558 -1.494 1.00 0.00 H new ATOM 0 HG2 GLU A 343 -7.399 14.478 -2.743 1.00 0.00 H new ATOM 0 HG3 GLU A 343 -9.039 13.999 -2.352 1.00 0.00 H new ATOM 305 N CYS A 344 -6.982 16.837 1.178 1.00 0.00 N ATOM 306 CA CYS A 344 -6.861 17.869 2.190 1.00 0.00 C ATOM 307 C CYS A 344 -7.951 18.909 2.005 1.00 0.00 C ATOM 308 O CYS A 344 -8.092 19.474 0.925 1.00 0.00 O ATOM 309 CB CYS A 344 -5.483 18.531 2.086 1.00 0.00 C ATOM 310 SG CYS A 344 -5.200 19.920 3.237 1.00 0.00 S ATOM 0 H CYS A 344 -6.200 16.804 0.524 1.00 0.00 H new ATOM 0 HA CYS A 344 -6.970 17.418 3.176 1.00 0.00 H new ATOM 0 HB2 CYS A 344 -4.719 17.773 2.261 1.00 0.00 H new ATOM 0 HB3 CYS A 344 -5.347 18.891 1.066 1.00 0.00 H new ATOM 315 N PRO A 345 -8.724 19.189 3.055 1.00 0.00 N ATOM 316 CA PRO A 345 -9.800 20.172 2.995 1.00 0.00 C ATOM 317 C PRO A 345 -9.272 21.607 2.999 1.00 0.00 C ATOM 318 O PRO A 345 -10.041 22.566 3.083 1.00 0.00 O ATOM 319 CB PRO A 345 -10.605 19.893 4.268 1.00 0.00 C ATOM 320 CG PRO A 345 -9.620 19.302 5.219 1.00 0.00 C ATOM 321 CD PRO A 345 -8.611 18.560 4.383 1.00 0.00 C ATOM 0 HA PRO A 345 -10.384 20.086 2.079 1.00 0.00 H new ATOM 0 HB2 PRO A 345 -11.042 20.808 4.668 1.00 0.00 H new ATOM 0 HB3 PRO A 345 -11.428 19.206 4.073 1.00 0.00 H new ATOM 0 HG2 PRO A 345 -9.137 20.080 5.810 1.00 0.00 H new ATOM 0 HG3 PRO A 345 -10.113 18.629 5.920 1.00 0.00 H new ATOM 0 HD2 PRO A 345 -7.604 18.660 4.789 1.00 0.00 H new ATOM 0 HD3 PRO A 345 -8.833 17.494 4.341 1.00 0.00 H new ATOM 329 N LYS A 346 -7.963 21.743 2.900 1.00 0.00 N ATOM 330 CA LYS A 346 -7.332 23.032 2.904 1.00 0.00 C ATOM 331 C LYS A 346 -6.744 23.377 1.532 1.00 0.00 C ATOM 332 O LYS A 346 -7.083 24.405 0.949 1.00 0.00 O ATOM 333 CB LYS A 346 -6.269 23.078 4.004 1.00 0.00 C ATOM 334 CG LYS A 346 -5.217 24.135 3.801 1.00 0.00 C ATOM 335 CD LYS A 346 -4.609 24.569 5.117 1.00 0.00 C ATOM 336 CE LYS A 346 -3.595 25.678 4.918 1.00 0.00 C ATOM 337 NZ LYS A 346 -2.416 25.221 4.142 1.00 0.00 N1+ ATOM 0 H LYS A 346 -7.316 20.959 2.815 1.00 0.00 H new ATOM 0 HA LYS A 346 -8.086 23.791 3.116 1.00 0.00 H new ATOM 0 HB2 LYS A 346 -6.760 23.249 4.962 1.00 0.00 H new ATOM 0 HB3 LYS A 346 -5.783 22.104 4.065 1.00 0.00 H new ATOM 0 HG2 LYS A 346 -4.435 23.751 3.146 1.00 0.00 H new ATOM 0 HG3 LYS A 346 -5.657 24.997 3.300 1.00 0.00 H new ATOM 0 HD2 LYS A 346 -5.397 24.910 5.789 1.00 0.00 H new ATOM 0 HD3 LYS A 346 -4.129 23.716 5.597 1.00 0.00 H new ATOM 0 HE2 LYS A 346 -4.068 26.513 4.401 1.00 0.00 H new ATOM 0 HE3 LYS A 346 -3.268 26.049 5.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 346 -1.587 25.794 4.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 346 -2.226 24.221 4.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 346 -2.607 25.327 3.125 1.00 0.00 H new ATOM 351 N CYS A 347 -5.886 22.512 1.007 1.00 0.00 N ATOM 352 CA CYS A 347 -5.243 22.786 -0.276 1.00 0.00 C ATOM 353 C CYS A 347 -5.693 21.815 -1.366 1.00 0.00 C ATOM 354 O CYS A 347 -5.287 21.942 -2.525 1.00 0.00 O ATOM 355 CB CYS A 347 -3.728 22.754 -0.121 1.00 0.00 C ATOM 356 SG CYS A 347 -3.081 21.201 0.550 1.00 0.00 S ATOM 0 H CYS A 347 -5.621 21.627 1.440 1.00 0.00 H new ATOM 0 HA CYS A 347 -5.550 23.783 -0.591 1.00 0.00 H new ATOM 0 HB2 CYS A 347 -3.271 22.934 -1.094 1.00 0.00 H new ATOM 0 HB3 CYS A 347 -3.424 23.573 0.531 1.00 0.00 H new ATOM 361 N HIS A 348 -6.527 20.855 -0.981 1.00 0.00 N ATOM 362 CA HIS A 348 -7.061 19.849 -1.892 1.00 0.00 C ATOM 363 C HIS A 348 -5.959 19.039 -2.533 1.00 0.00 C ATOM 364 O HIS A 348 -5.686 19.155 -3.732 1.00 0.00 O ATOM 365 CB HIS A 348 -7.978 20.457 -2.961 1.00 0.00 C ATOM 366 CG HIS A 348 -9.236 21.055 -2.410 1.00 0.00 C ATOM 367 ND1 HIS A 348 -10.440 20.402 -2.509 1.00 0.00 N ATOM 368 CD2 HIS A 348 -9.422 22.236 -1.775 1.00 0.00 C ATOM 369 CE1 HIS A 348 -11.326 21.196 -1.935 1.00 0.00 C ATOM 370 NE2 HIS A 348 -10.757 22.319 -1.477 1.00 0.00 N ATOM 0 H HIS A 348 -6.854 20.752 -0.020 1.00 0.00 H new ATOM 0 HA HIS A 348 -7.669 19.178 -1.286 1.00 0.00 H new ATOM 0 HB2 HIS A 348 -7.428 21.226 -3.503 1.00 0.00 H new ATOM 0 HB3 HIS A 348 -8.240 19.684 -3.683 1.00 0.00 H new ATOM 0 HD2 HIS A 348 -8.664 22.971 -1.547 1.00 0.00 H new ATOM 0 HE1 HIS A 348 -12.378 20.968 -1.846 1.00 0.00 H new ATOM 0 HE2 HIS A 348 -11.227 23.088 -0.999 1.00 0.00 H new ATOM 378 N VAL A 349 -5.308 18.242 -1.729 1.00 0.00 N ATOM 379 CA VAL A 349 -4.265 17.372 -2.201 1.00 0.00 C ATOM 380 C VAL A 349 -4.560 15.949 -1.756 1.00 0.00 C ATOM 381 O VAL A 349 -5.000 15.728 -0.626 1.00 0.00 O ATOM 382 CB VAL A 349 -2.864 17.833 -1.703 1.00 0.00 C ATOM 383 CG1 VAL A 349 -2.805 17.881 -0.197 1.00 0.00 C ATOM 384 CG2 VAL A 349 -1.755 16.952 -2.256 1.00 0.00 C ATOM 0 H VAL A 349 -5.486 18.178 -0.727 1.00 0.00 H new ATOM 0 HA VAL A 349 -4.242 17.413 -3.290 1.00 0.00 H new ATOM 0 HB VAL A 349 -2.707 18.843 -2.080 1.00 0.00 H new ATOM 0 HG11 VAL A 349 -1.814 18.206 0.118 1.00 0.00 H new ATOM 0 HG12 VAL A 349 -3.552 18.582 0.174 1.00 0.00 H new ATOM 0 HG13 VAL A 349 -3.006 16.889 0.207 1.00 0.00 H new ATOM 0 HG21 VAL A 349 -0.792 17.304 -1.887 1.00 0.00 H new ATOM 0 HG22 VAL A 349 -1.913 15.923 -1.933 1.00 0.00 H new ATOM 0 HG23 VAL A 349 -1.764 16.996 -3.345 1.00 0.00 H new ATOM 394 N THR A 350 -4.360 14.999 -2.649 1.00 0.00 N ATOM 395 CA THR A 350 -4.644 13.609 -2.361 1.00 0.00 C ATOM 396 C THR A 350 -3.757 13.089 -1.229 1.00 0.00 C ATOM 397 O THR A 350 -2.539 12.955 -1.383 1.00 0.00 O ATOM 398 CB THR A 350 -4.453 12.739 -3.614 1.00 0.00 C ATOM 399 OG1 THR A 350 -5.044 13.398 -4.752 1.00 0.00 O ATOM 400 CG2 THR A 350 -5.113 11.384 -3.426 1.00 0.00 C ATOM 0 H THR A 350 -3.999 15.168 -3.588 1.00 0.00 H new ATOM 0 HA THR A 350 -5.685 13.546 -2.044 1.00 0.00 H new ATOM 0 HB THR A 350 -3.385 12.595 -3.779 1.00 0.00 H new ATOM 0 HG1 THR A 350 -4.921 12.844 -5.551 1.00 0.00 H new ATOM 0 HG21 THR A 350 -4.968 10.781 -4.322 1.00 0.00 H new ATOM 0 HG22 THR A 350 -4.665 10.877 -2.571 1.00 0.00 H new ATOM 0 HG23 THR A 350 -6.180 11.520 -3.249 1.00 0.00 H new ATOM 408 N ILE A 351 -4.372 12.816 -0.097 1.00 0.00 N ATOM 409 CA ILE A 351 -3.658 12.317 1.059 1.00 0.00 C ATOM 410 C ILE A 351 -3.839 10.811 1.149 1.00 0.00 C ATOM 411 O ILE A 351 -4.208 10.183 0.166 1.00 0.00 O ATOM 412 CB ILE A 351 -4.162 12.990 2.366 1.00 0.00 C ATOM 413 CG1 ILE A 351 -5.619 12.625 2.627 1.00 0.00 C ATOM 414 CG2 ILE A 351 -3.993 14.505 2.300 1.00 0.00 C ATOM 415 CD1 ILE A 351 -6.249 13.420 3.740 1.00 0.00 C ATOM 0 H ILE A 351 -5.375 12.933 0.047 1.00 0.00 H new ATOM 0 HA ILE A 351 -2.601 12.558 0.944 1.00 0.00 H new ATOM 0 HB ILE A 351 -3.558 12.618 3.194 1.00 0.00 H new ATOM 0 HG12 ILE A 351 -6.193 12.778 1.713 1.00 0.00 H new ATOM 0 HG13 ILE A 351 -5.681 11.564 2.869 1.00 0.00 H new ATOM 0 HG21 ILE A 351 -4.353 14.952 3.227 1.00 0.00 H new ATOM 0 HG22 ILE A 351 -2.939 14.748 2.166 1.00 0.00 H new ATOM 0 HG23 ILE A 351 -4.566 14.899 1.461 1.00 0.00 H new ATOM 0 HD11 ILE A 351 -7.285 13.107 3.869 1.00 0.00 H new ATOM 0 HD12 ILE A 351 -5.700 13.248 4.666 1.00 0.00 H new ATOM 0 HD13 ILE A 351 -6.219 14.481 3.492 1.00 0.00 H new ATOM 427 N GLU A 352 -3.575 10.236 2.311 1.00 0.00 N ATOM 428 CA GLU A 352 -3.752 8.805 2.501 1.00 0.00 C ATOM 429 C GLU A 352 -3.796 8.461 3.981 1.00 0.00 C ATOM 430 O GLU A 352 -2.878 8.791 4.735 1.00 0.00 O ATOM 431 CB GLU A 352 -2.647 8.025 1.807 1.00 0.00 C ATOM 432 CG GLU A 352 -2.949 6.548 1.678 1.00 0.00 C ATOM 433 CD GLU A 352 -1.839 5.796 0.991 1.00 0.00 C ATOM 434 OE1 GLU A 352 -0.855 5.431 1.664 1.00 0.00 O1- ATOM 435 OE2 GLU A 352 -1.933 5.573 -0.236 1.00 0.00 O ATOM 0 H GLU A 352 -3.239 10.736 3.134 1.00 0.00 H new ATOM 0 HA GLU A 352 -4.704 8.521 2.052 1.00 0.00 H new ATOM 0 HB2 GLU A 352 -2.484 8.444 0.814 1.00 0.00 H new ATOM 0 HB3 GLU A 352 -1.718 8.152 2.363 1.00 0.00 H new ATOM 0 HG2 GLU A 352 -3.113 6.125 2.669 1.00 0.00 H new ATOM 0 HG3 GLU A 352 -3.875 6.416 1.118 1.00 0.00 H new ATOM 442 N LYS A 353 -4.869 7.808 4.387 1.00 0.00 N ATOM 443 CA LYS A 353 -5.091 7.454 5.779 1.00 0.00 C ATOM 444 C LYS A 353 -4.195 6.300 6.221 1.00 0.00 C ATOM 445 O LYS A 353 -3.918 5.380 5.450 1.00 0.00 O ATOM 446 CB LYS A 353 -6.562 7.083 5.979 1.00 0.00 C ATOM 447 CG LYS A 353 -6.931 6.664 7.391 1.00 0.00 C ATOM 448 CD LYS A 353 -6.920 7.830 8.365 1.00 0.00 C ATOM 449 CE LYS A 353 -7.457 7.401 9.727 1.00 0.00 C ATOM 450 NZ LYS A 353 -8.705 6.584 9.611 1.00 0.00 N1+ ATOM 0 H LYS A 353 -5.614 7.507 3.759 1.00 0.00 H new ATOM 0 HA LYS A 353 -4.838 8.318 6.394 1.00 0.00 H new ATOM 0 HB2 LYS A 353 -7.178 7.937 5.697 1.00 0.00 H new ATOM 0 HB3 LYS A 353 -6.812 6.270 5.298 1.00 0.00 H new ATOM 0 HG2 LYS A 353 -7.922 6.209 7.385 1.00 0.00 H new ATOM 0 HG3 LYS A 353 -6.232 5.901 7.735 1.00 0.00 H new ATOM 0 HD2 LYS A 353 -5.904 8.211 8.473 1.00 0.00 H new ATOM 0 HD3 LYS A 353 -7.526 8.646 7.970 1.00 0.00 H new ATOM 0 HE2 LYS A 353 -6.695 6.824 10.251 1.00 0.00 H new ATOM 0 HE3 LYS A 353 -7.659 8.286 10.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 353 -9.181 6.544 10.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 353 -9.341 7.019 8.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 353 -8.462 5.620 9.304 1.00 0.00 H new ATOM 464 N ASP A 354 -3.756 6.362 7.470 1.00 0.00 N ATOM 465 CA ASP A 354 -2.920 5.320 8.057 1.00 0.00 C ATOM 466 C ASP A 354 -3.780 4.145 8.494 1.00 0.00 C ATOM 467 O ASP A 354 -3.518 2.996 8.137 1.00 0.00 O ATOM 468 CB ASP A 354 -2.145 5.875 9.259 1.00 0.00 C ATOM 469 CG ASP A 354 -1.521 4.784 10.114 1.00 0.00 C ATOM 470 OD1 ASP A 354 -0.452 4.258 9.743 1.00 0.00 O1- ATOM 471 OD2 ASP A 354 -2.101 4.448 11.167 1.00 0.00 O ATOM 0 H ASP A 354 -3.967 7.132 8.104 1.00 0.00 H new ATOM 0 HA ASP A 354 -2.208 4.979 7.305 1.00 0.00 H new ATOM 0 HB2 ASP A 354 -1.361 6.543 8.903 1.00 0.00 H new ATOM 0 HB3 ASP A 354 -2.818 6.472 9.875 1.00 0.00 H new ATOM 476 N GLY A 355 -4.806 4.445 9.263 1.00 0.00 N ATOM 477 CA GLY A 355 -5.706 3.425 9.729 1.00 0.00 C ATOM 478 C GLY A 355 -6.214 3.726 11.113 1.00 0.00 C ATOM 479 O GLY A 355 -7.178 4.479 11.278 1.00 0.00 O ATOM 0 H GLY A 355 -5.033 5.389 9.576 1.00 0.00 H new ATOM 0 HA2 GLY A 355 -6.548 3.340 9.042 1.00 0.00 H new ATOM 0 HA3 GLY A 355 -5.196 2.461 9.729 1.00 0.00 H new ATOM 483 N GLY A 356 -5.549 3.160 12.111 1.00 0.00 N ATOM 484 CA GLY A 356 -5.937 3.377 13.488 1.00 0.00 C ATOM 485 C GLY A 356 -5.730 4.810 13.923 1.00 0.00 C ATOM 486 O GLY A 356 -6.588 5.392 14.595 1.00 0.00 O ATOM 0 H GLY A 356 -4.741 2.550 11.988 1.00 0.00 H new ATOM 0 HA2 GLY A 356 -6.986 3.109 13.614 1.00 0.00 H new ATOM 0 HA3 GLY A 356 -5.359 2.716 14.134 1.00 0.00 H new ATOM 490 N SER A 357 -4.595 5.383 13.547 1.00 0.00 N ATOM 491 CA SER A 357 -4.303 6.763 13.888 1.00 0.00 C ATOM 492 C SER A 357 -5.220 7.699 13.118 1.00 0.00 C ATOM 493 O SER A 357 -5.290 7.648 11.885 1.00 0.00 O ATOM 494 CB SER A 357 -2.846 7.102 13.590 1.00 0.00 C ATOM 495 OG SER A 357 -1.962 6.242 14.296 1.00 0.00 O ATOM 0 H SER A 357 -3.866 4.914 13.009 1.00 0.00 H new ATOM 0 HA SER A 357 -4.475 6.892 14.957 1.00 0.00 H new ATOM 0 HB2 SER A 357 -2.662 7.017 12.519 1.00 0.00 H new ATOM 0 HB3 SER A 357 -2.647 8.138 13.866 1.00 0.00 H new ATOM 0 HG SER A 357 -1.035 6.481 14.085 1.00 0.00 H new ATOM 501 N ASN A 358 -5.915 8.545 13.841 1.00 0.00 N ATOM 502 CA ASN A 358 -6.832 9.485 13.243 1.00 0.00 C ATOM 503 C ASN A 358 -6.141 10.798 12.986 1.00 0.00 C ATOM 504 O ASN A 358 -6.679 11.669 12.300 1.00 0.00 O ATOM 505 CB ASN A 358 -8.043 9.700 14.139 1.00 0.00 C ATOM 506 CG ASN A 358 -8.886 8.450 14.286 1.00 0.00 C ATOM 507 OD1 ASN A 358 -8.736 7.694 15.243 1.00 0.00 O ATOM 508 ND2 ASN A 358 -9.774 8.224 13.340 1.00 0.00 N ATOM 0 H ASN A 358 -5.861 8.601 14.858 1.00 0.00 H new ATOM 0 HA ASN A 358 -7.173 9.072 12.293 1.00 0.00 H new ATOM 0 HB2 ASN A 358 -7.709 10.027 15.124 1.00 0.00 H new ATOM 0 HB3 ASN A 358 -8.657 10.502 13.729 1.00 0.00 H new ATOM 0 HD21 ASN A 358 -10.368 7.396 13.386 1.00 0.00 H new ATOM 0 HD22 ASN A 358 -9.867 8.877 12.562 1.00 0.00 H new ATOM 515 N HIS A 359 -4.945 10.937 13.552 1.00 0.00 N ATOM 516 CA HIS A 359 -4.136 12.128 13.366 1.00 0.00 C ATOM 517 C HIS A 359 -3.617 12.168 11.933 1.00 0.00 C ATOM 518 O HIS A 359 -2.510 11.718 11.639 1.00 0.00 O ATOM 519 CB HIS A 359 -2.969 12.137 14.366 1.00 0.00 C ATOM 520 CG HIS A 359 -2.298 13.474 14.544 1.00 0.00 C ATOM 521 ND1 HIS A 359 -1.587 13.760 15.683 1.00 0.00 N ATOM 522 CD2 HIS A 359 -2.252 14.548 13.715 1.00 0.00 C ATOM 523 CE1 HIS A 359 -1.127 14.989 15.524 1.00 0.00 C ATOM 524 NE2 HIS A 359 -1.501 15.506 14.351 1.00 0.00 N ATOM 0 H HIS A 359 -4.516 10.229 14.148 1.00 0.00 H new ATOM 0 HA HIS A 359 -4.745 13.013 13.547 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -3.337 11.799 15.335 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -2.223 11.413 14.038 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -2.716 14.633 12.743 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -0.524 15.510 16.252 1.00 0.00 H new ATOM 0 HE2 HIS A 359 -1.273 16.434 13.996 1.00 0.00 H new ATOM 532 N MET A 360 -4.449 12.657 11.052 1.00 0.00 N ATOM 533 CA MET A 360 -4.126 12.744 9.650 1.00 0.00 C ATOM 534 C MET A 360 -3.544 14.113 9.299 1.00 0.00 C ATOM 535 O MET A 360 -4.126 15.151 9.608 1.00 0.00 O ATOM 536 CB MET A 360 -5.378 12.426 8.805 1.00 0.00 C ATOM 537 CG MET A 360 -5.441 13.141 7.465 1.00 0.00 C ATOM 538 SD MET A 360 -4.156 12.608 6.327 1.00 0.00 S ATOM 539 CE MET A 360 -4.642 10.917 6.064 1.00 0.00 C ATOM 0 H MET A 360 -5.377 13.009 11.287 1.00 0.00 H new ATOM 0 HA MET A 360 -3.358 12.005 9.420 1.00 0.00 H new ATOM 0 HB2 MET A 360 -5.417 11.351 8.630 1.00 0.00 H new ATOM 0 HB3 MET A 360 -6.265 12.687 9.382 1.00 0.00 H new ATOM 0 HG2 MET A 360 -6.417 12.966 7.011 1.00 0.00 H new ATOM 0 HG3 MET A 360 -5.353 14.215 7.628 1.00 0.00 H new ATOM 0 HE1 MET A 360 -3.868 10.252 6.447 1.00 0.00 H new ATOM 0 HE2 MET A 360 -5.578 10.722 6.587 1.00 0.00 H new ATOM 0 HE3 MET A 360 -4.778 10.739 4.997 1.00 0.00 H new ATOM 549 N VAL A 361 -2.391 14.105 8.669 1.00 0.00 N ATOM 550 CA VAL A 361 -1.742 15.332 8.264 1.00 0.00 C ATOM 551 C VAL A 361 -1.514 15.361 6.750 1.00 0.00 C ATOM 552 O VAL A 361 -1.212 14.337 6.131 1.00 0.00 O ATOM 553 CB VAL A 361 -0.410 15.560 9.033 1.00 0.00 C ATOM 554 CG1 VAL A 361 0.502 14.362 8.928 1.00 0.00 C ATOM 555 CG2 VAL A 361 0.302 16.817 8.551 1.00 0.00 C ATOM 0 H VAL A 361 -1.880 13.257 8.425 1.00 0.00 H new ATOM 0 HA VAL A 361 -2.411 16.153 8.521 1.00 0.00 H new ATOM 0 HB VAL A 361 -0.667 15.697 10.083 1.00 0.00 H new ATOM 0 HG11 VAL A 361 1.423 14.557 9.477 1.00 0.00 H new ATOM 0 HG12 VAL A 361 0.005 13.489 9.351 1.00 0.00 H new ATOM 0 HG13 VAL A 361 0.737 14.174 7.880 1.00 0.00 H new ATOM 0 HG21 VAL A 361 1.229 16.947 9.109 1.00 0.00 H new ATOM 0 HG22 VAL A 361 0.528 16.723 7.489 1.00 0.00 H new ATOM 0 HG23 VAL A 361 -0.341 17.683 8.709 1.00 0.00 H new ATOM 565 N CYS A 362 -1.689 16.539 6.181 1.00 0.00 N ATOM 566 CA CYS A 362 -1.551 16.782 4.756 1.00 0.00 C ATOM 567 C CYS A 362 -0.187 16.334 4.212 1.00 0.00 C ATOM 568 O CYS A 362 0.782 16.152 4.959 1.00 0.00 O ATOM 569 CB CYS A 362 -1.762 18.272 4.490 1.00 0.00 C ATOM 570 SG CYS A 362 -1.689 18.758 2.746 1.00 0.00 S ATOM 0 H CYS A 362 -1.937 17.375 6.710 1.00 0.00 H new ATOM 0 HA CYS A 362 -2.304 16.190 4.236 1.00 0.00 H new ATOM 0 HB2 CYS A 362 -2.732 18.563 4.892 1.00 0.00 H new ATOM 0 HB3 CYS A 362 -1.007 18.834 5.040 1.00 0.00 H new ATOM 575 N ARG A 363 -0.129 16.184 2.901 1.00 0.00 N ATOM 576 CA ARG A 363 1.078 15.745 2.211 1.00 0.00 C ATOM 577 C ARG A 363 1.791 16.948 1.646 1.00 0.00 C ATOM 578 O ARG A 363 3.023 16.991 1.584 1.00 0.00 O ATOM 579 CB ARG A 363 0.714 14.821 1.048 1.00 0.00 C ATOM 580 CG ARG A 363 -0.572 14.049 1.255 1.00 0.00 C ATOM 581 CD ARG A 363 -0.448 13.032 2.373 1.00 0.00 C ATOM 582 NE ARG A 363 0.350 11.883 1.955 1.00 0.00 N ATOM 583 CZ ARG A 363 0.592 10.817 2.705 1.00 0.00 C ATOM 584 NH1 ARG A 363 0.123 10.751 3.940 1.00 0.00 N1+ ATOM 585 NH2 ARG A 363 1.306 9.814 2.218 1.00 0.00 N ATOM 0 H ARG A 363 -0.918 16.363 2.280 1.00 0.00 H new ATOM 0 HA ARG A 363 1.714 15.215 2.920 1.00 0.00 H new ATOM 0 HB2 ARG A 363 0.627 15.415 0.139 1.00 0.00 H new ATOM 0 HB3 ARG A 363 1.529 14.114 0.890 1.00 0.00 H new ATOM 0 HG2 ARG A 363 -1.380 14.744 1.485 1.00 0.00 H new ATOM 0 HG3 ARG A 363 -0.843 13.540 0.330 1.00 0.00 H new ATOM 0 HD2 ARG A 363 0.011 13.499 3.244 1.00 0.00 H new ATOM 0 HD3 ARG A 363 -1.440 12.698 2.676 1.00 0.00 H new ATOM 0 HE ARG A 363 0.751 11.902 1.017 1.00 0.00 H new ATOM 0 HH11 ARG A 363 -0.427 11.522 4.319 1.00 0.00 H new ATOM 0 HH12 ARG A 363 0.311 9.929 4.514 1.00 0.00 H new ATOM 0 HH21 ARG A 363 1.670 9.862 1.266 1.00 0.00 H new ATOM 0 HH22 ARG A 363 1.493 8.994 2.795 1.00 0.00 H new ATOM 599 N ASN A 364 0.996 17.927 1.242 1.00 0.00 N ATOM 600 CA ASN A 364 1.489 19.135 0.621 1.00 0.00 C ATOM 601 C ASN A 364 2.473 19.850 1.527 1.00 0.00 C ATOM 602 O ASN A 364 2.145 20.241 2.641 1.00 0.00 O ATOM 603 CB ASN A 364 0.306 20.038 0.244 1.00 0.00 C ATOM 604 CG ASN A 364 0.708 21.398 -0.292 1.00 0.00 C ATOM 605 OD1 ASN A 364 1.821 21.593 -0.785 1.00 0.00 O ATOM 606 ND2 ASN A 364 -0.214 22.336 -0.228 1.00 0.00 N ATOM 0 H ASN A 364 -0.019 17.900 1.340 1.00 0.00 H new ATOM 0 HA ASN A 364 2.028 18.874 -0.290 1.00 0.00 H new ATOM 0 HB2 ASN A 364 -0.300 19.529 -0.505 1.00 0.00 H new ATOM 0 HB3 ASN A 364 -0.324 20.178 1.122 1.00 0.00 H new ATOM 0 HD21 ASN A 364 -0.020 23.268 -0.595 1.00 0.00 H new ATOM 0 HD22 ASN A 364 -1.122 22.131 0.189 1.00 0.00 H new ATOM 613 N GLN A 365 3.686 20.009 1.027 1.00 0.00 N ATOM 614 CA GLN A 365 4.771 20.649 1.768 1.00 0.00 C ATOM 615 C GLN A 365 4.538 22.145 1.912 1.00 0.00 C ATOM 616 O GLN A 365 5.272 22.833 2.615 1.00 0.00 O ATOM 617 CB GLN A 365 6.118 20.391 1.090 1.00 0.00 C ATOM 618 CG GLN A 365 6.061 20.392 -0.431 1.00 0.00 C ATOM 619 CD GLN A 365 5.912 18.988 -1.021 1.00 0.00 C ATOM 620 OE1 GLN A 365 6.346 18.729 -2.139 1.00 0.00 O ATOM 621 NE2 GLN A 365 5.322 18.073 -0.264 1.00 0.00 N ATOM 0 H GLN A 365 3.952 19.698 0.093 1.00 0.00 H new ATOM 0 HA GLN A 365 4.789 20.209 2.765 1.00 0.00 H new ATOM 0 HB2 GLN A 365 6.828 21.151 1.416 1.00 0.00 H new ATOM 0 HB3 GLN A 365 6.504 19.429 1.427 1.00 0.00 H new ATOM 0 HG2 GLN A 365 5.224 21.009 -0.758 1.00 0.00 H new ATOM 0 HG3 GLN A 365 6.968 20.851 -0.823 1.00 0.00 H new ATOM 0 HE21 GLN A 365 4.973 18.324 0.661 1.00 0.00 H new ATOM 0 HE22 GLN A 365 5.217 17.118 -0.607 1.00 0.00 H new ATOM 630 N ASN A 366 3.529 22.637 1.231 1.00 0.00 N ATOM 631 CA ASN A 366 3.142 24.037 1.312 1.00 0.00 C ATOM 632 C ASN A 366 1.946 24.175 2.243 1.00 0.00 C ATOM 633 O ASN A 366 1.362 25.251 2.371 1.00 0.00 O ATOM 634 CB ASN A 366 2.762 24.567 -0.076 1.00 0.00 C ATOM 635 CG ASN A 366 3.873 24.439 -1.091 1.00 0.00 C ATOM 636 OD1 ASN A 366 4.712 25.325 -1.227 1.00 0.00 O ATOM 637 ND2 ASN A 366 3.873 23.345 -1.828 1.00 0.00 N ATOM 0 H ASN A 366 2.949 22.081 0.603 1.00 0.00 H new ATOM 0 HA ASN A 366 3.984 24.614 1.695 1.00 0.00 H new ATOM 0 HB2 ASN A 366 1.887 24.026 -0.436 1.00 0.00 H new ATOM 0 HB3 ASN A 366 2.476 25.615 0.009 1.00 0.00 H new ATOM 0 HD21 ASN A 366 4.588 23.212 -2.543 1.00 0.00 H new ATOM 0 HD22 ASN A 366 3.158 22.632 -1.683 1.00 0.00 H new ATOM 644 N CYS A 367 1.596 23.073 2.899 1.00 0.00 N ATOM 645 CA CYS A 367 0.429 23.020 3.763 1.00 0.00 C ATOM 646 C CYS A 367 0.759 22.302 5.064 1.00 0.00 C ATOM 647 O CYS A 367 1.001 22.941 6.089 1.00 0.00 O ATOM 648 CB CYS A 367 -0.705 22.294 3.039 1.00 0.00 C ATOM 649 SG CYS A 367 -2.266 22.176 3.968 1.00 0.00 S ATOM 0 H CYS A 367 2.114 22.196 2.845 1.00 0.00 H new ATOM 0 HA CYS A 367 0.118 24.037 4.002 1.00 0.00 H new ATOM 0 HB2 CYS A 367 -0.899 22.806 2.096 1.00 0.00 H new ATOM 0 HB3 CYS A 367 -0.371 21.286 2.792 1.00 0.00 H new ATOM 654 N LYS A 368 0.793 20.966 5.001 1.00 0.00 N ATOM 655 CA LYS A 368 1.094 20.119 6.164 1.00 0.00 C ATOM 656 C LYS A 368 0.057 20.309 7.271 1.00 0.00 C ATOM 657 O LYS A 368 0.360 20.135 8.459 1.00 0.00 O ATOM 658 CB LYS A 368 2.491 20.428 6.686 1.00 0.00 C ATOM 659 CG LYS A 368 3.575 20.253 5.645 1.00 0.00 C ATOM 660 CD LYS A 368 4.734 21.211 5.862 1.00 0.00 C ATOM 661 CE LYS A 368 4.353 22.659 5.534 1.00 0.00 C ATOM 662 NZ LYS A 368 3.639 23.350 6.645 1.00 0.00 N1+ ATOM 0 H LYS A 368 0.613 20.441 4.145 1.00 0.00 H new ATOM 0 HA LYS A 368 1.055 19.077 5.846 1.00 0.00 H new ATOM 0 HB2 LYS A 368 2.514 21.453 7.055 1.00 0.00 H new ATOM 0 HB3 LYS A 368 2.705 19.779 7.535 1.00 0.00 H new ATOM 0 HG2 LYS A 368 3.943 19.227 5.674 1.00 0.00 H new ATOM 0 HG3 LYS A 368 3.154 20.413 4.653 1.00 0.00 H new ATOM 0 HD2 LYS A 368 5.066 21.150 6.899 1.00 0.00 H new ATOM 0 HD3 LYS A 368 5.576 20.908 5.240 1.00 0.00 H new ATOM 0 HE2 LYS A 368 5.256 23.218 5.289 1.00 0.00 H new ATOM 0 HE3 LYS A 368 3.722 22.668 4.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 368 3.875 24.363 6.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 368 2.613 23.232 6.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 368 3.931 22.938 7.554 1.00 0.00 H new ATOM 676 N ALA A 369 -1.160 20.651 6.877 1.00 0.00 N ATOM 677 CA ALA A 369 -2.242 20.849 7.820 1.00 0.00 C ATOM 678 C ALA A 369 -2.633 19.537 8.488 1.00 0.00 C ATOM 679 O ALA A 369 -2.749 18.507 7.829 1.00 0.00 O ATOM 680 CB ALA A 369 -3.447 21.469 7.125 1.00 0.00 C ATOM 0 H ALA A 369 -1.421 20.797 5.902 1.00 0.00 H new ATOM 0 HA ALA A 369 -1.894 21.533 8.594 1.00 0.00 H new ATOM 0 HB1 ALA A 369 -4.251 21.611 7.848 1.00 0.00 H new ATOM 0 HB2 ALA A 369 -3.166 22.433 6.701 1.00 0.00 H new ATOM 0 HB3 ALA A 369 -3.788 20.807 6.329 1.00 0.00 H new ATOM 686 N GLU A 370 -2.814 19.576 9.790 1.00 0.00 N ATOM 687 CA GLU A 370 -3.210 18.400 10.543 1.00 0.00 C ATOM 688 C GLU A 370 -4.693 18.470 10.856 1.00 0.00 C ATOM 689 O GLU A 370 -5.156 19.402 11.523 1.00 0.00 O ATOM 690 CB GLU A 370 -2.394 18.292 11.826 1.00 0.00 C ATOM 691 CG GLU A 370 -0.906 18.128 11.584 1.00 0.00 C ATOM 692 CD GLU A 370 -0.086 18.413 12.809 1.00 0.00 C ATOM 693 OE1 GLU A 370 0.223 19.598 13.059 1.00 0.00 O ATOM 694 OE2 GLU A 370 0.258 17.458 13.530 1.00 0.00 O1- ATOM 0 H GLU A 370 -2.693 20.416 10.356 1.00 0.00 H new ATOM 0 HA GLU A 370 -3.018 17.510 9.943 1.00 0.00 H new ATOM 0 HB2 GLU A 370 -2.560 19.185 12.429 1.00 0.00 H new ATOM 0 HB3 GLU A 370 -2.755 17.443 12.407 1.00 0.00 H new ATOM 0 HG2 GLU A 370 -0.707 17.111 11.247 1.00 0.00 H new ATOM 0 HG3 GLU A 370 -0.597 18.797 10.781 1.00 0.00 H new ATOM 701 N PHE A 371 -5.435 17.496 10.374 1.00 0.00 N ATOM 702 CA PHE A 371 -6.876 17.485 10.540 1.00 0.00 C ATOM 703 C PHE A 371 -7.394 16.085 10.830 1.00 0.00 C ATOM 704 O PHE A 371 -6.697 15.090 10.618 1.00 0.00 O ATOM 705 CB PHE A 371 -7.563 18.055 9.281 1.00 0.00 C ATOM 706 CG PHE A 371 -7.057 17.481 7.984 1.00 0.00 C ATOM 707 CD1 PHE A 371 -7.635 16.347 7.439 1.00 0.00 C ATOM 708 CD2 PHE A 371 -6.001 18.079 7.313 1.00 0.00 C ATOM 709 CE1 PHE A 371 -7.168 15.822 6.251 1.00 0.00 C ATOM 710 CE2 PHE A 371 -5.531 17.556 6.127 1.00 0.00 C ATOM 711 CZ PHE A 371 -6.114 16.428 5.596 1.00 0.00 C ATOM 0 H PHE A 371 -5.063 16.697 9.861 1.00 0.00 H new ATOM 0 HA PHE A 371 -7.116 18.115 11.397 1.00 0.00 H new ATOM 0 HB2 PHE A 371 -8.635 17.871 9.352 1.00 0.00 H new ATOM 0 HB3 PHE A 371 -7.425 19.136 9.264 1.00 0.00 H new ATOM 0 HD1 PHE A 371 -8.459 15.869 7.948 1.00 0.00 H new ATOM 0 HD2 PHE A 371 -5.541 18.965 7.724 1.00 0.00 H new ATOM 0 HE1 PHE A 371 -7.627 14.938 5.834 1.00 0.00 H new ATOM 0 HE2 PHE A 371 -4.707 18.031 5.616 1.00 0.00 H new ATOM 0 HZ PHE A 371 -5.747 16.017 4.667 1.00 0.00 H new ATOM 721 N CYS A 372 -8.615 16.016 11.316 1.00 0.00 N ATOM 722 CA CYS A 372 -9.249 14.753 11.590 1.00 0.00 C ATOM 723 C CYS A 372 -9.773 14.185 10.295 1.00 0.00 C ATOM 724 O CYS A 372 -10.686 14.726 9.710 1.00 0.00 O ATOM 725 CB CYS A 372 -10.393 14.933 12.585 1.00 0.00 C ATOM 726 SG CYS A 372 -11.198 13.371 13.104 1.00 0.00 S ATOM 0 H CYS A 372 -9.190 16.831 11.530 1.00 0.00 H new ATOM 0 HA CYS A 372 -8.523 14.069 12.029 1.00 0.00 H new ATOM 0 HB2 CYS A 372 -10.012 15.442 13.470 1.00 0.00 H new ATOM 0 HB3 CYS A 372 -11.145 15.585 12.141 1.00 0.00 H new ATOM 731 N TRP A 373 -9.180 13.109 9.853 1.00 0.00 N ATOM 732 CA TRP A 373 -9.564 12.460 8.604 1.00 0.00 C ATOM 733 C TRP A 373 -11.055 12.099 8.567 1.00 0.00 C ATOM 734 O TRP A 373 -11.700 12.191 7.516 1.00 0.00 O ATOM 735 CB TRP A 373 -8.716 11.201 8.412 1.00 0.00 C ATOM 736 CG TRP A 373 -9.298 10.199 7.462 1.00 0.00 C ATOM 737 CD1 TRP A 373 -10.244 9.263 7.751 1.00 0.00 C ATOM 738 CD2 TRP A 373 -8.967 10.021 6.089 1.00 0.00 C ATOM 739 NE1 TRP A 373 -10.516 8.511 6.642 1.00 0.00 N ATOM 740 CE2 TRP A 373 -9.746 8.954 5.608 1.00 0.00 C ATOM 741 CE3 TRP A 373 -8.090 10.655 5.219 1.00 0.00 C ATOM 742 CZ2 TRP A 373 -9.671 8.510 4.298 1.00 0.00 C ATOM 743 CZ3 TRP A 373 -8.017 10.213 3.918 1.00 0.00 C ATOM 744 CH2 TRP A 373 -8.801 9.152 3.471 1.00 0.00 C ATOM 0 H TRP A 373 -8.413 12.647 10.342 1.00 0.00 H new ATOM 0 HA TRP A 373 -9.387 13.165 7.792 1.00 0.00 H new ATOM 0 HB2 TRP A 373 -7.730 11.494 8.052 1.00 0.00 H new ATOM 0 HB3 TRP A 373 -8.573 10.723 9.381 1.00 0.00 H new ATOM 0 HD1 TRP A 373 -10.711 9.134 8.716 1.00 0.00 H new ATOM 0 HE1 TRP A 373 -11.186 7.743 6.596 1.00 0.00 H new ATOM 0 HE3 TRP A 373 -7.478 11.478 5.557 1.00 0.00 H new ATOM 0 HZ2 TRP A 373 -10.278 7.688 3.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 373 -7.339 10.698 3.231 1.00 0.00 H new ATOM 0 HH2 TRP A 373 -8.717 8.831 2.443 1.00 0.00 H new ATOM 755 N VAL A 374 -11.583 11.699 9.707 1.00 0.00 N ATOM 756 CA VAL A 374 -12.954 11.210 9.802 1.00 0.00 C ATOM 757 C VAL A 374 -13.963 12.266 9.376 1.00 0.00 C ATOM 758 O VAL A 374 -14.701 12.084 8.401 1.00 0.00 O ATOM 759 CB VAL A 374 -13.269 10.747 11.238 1.00 0.00 C ATOM 760 CG1 VAL A 374 -14.612 10.032 11.303 1.00 0.00 C ATOM 761 CG2 VAL A 374 -12.159 9.857 11.753 1.00 0.00 C ATOM 0 H VAL A 374 -11.079 11.702 10.594 1.00 0.00 H new ATOM 0 HA VAL A 374 -13.038 10.363 9.121 1.00 0.00 H new ATOM 0 HB VAL A 374 -13.334 11.628 11.876 1.00 0.00 H new ATOM 0 HG11 VAL A 374 -14.807 9.717 12.328 1.00 0.00 H new ATOM 0 HG12 VAL A 374 -15.401 10.709 10.975 1.00 0.00 H new ATOM 0 HG13 VAL A 374 -14.591 9.158 10.653 1.00 0.00 H new ATOM 0 HG21 VAL A 374 -12.392 9.536 12.768 1.00 0.00 H new ATOM 0 HG22 VAL A 374 -12.065 8.983 11.108 1.00 0.00 H new ATOM 0 HG23 VAL A 374 -11.220 10.410 11.754 1.00 0.00 H new ATOM 771 N CYS A 375 -13.980 13.373 10.088 1.00 0.00 N ATOM 772 CA CYS A 375 -14.912 14.440 9.803 1.00 0.00 C ATOM 773 C CYS A 375 -14.278 15.510 8.922 1.00 0.00 C ATOM 774 O CYS A 375 -14.930 16.492 8.566 1.00 0.00 O ATOM 775 CB CYS A 375 -15.413 15.050 11.116 1.00 0.00 C ATOM 776 SG CYS A 375 -14.091 15.454 12.302 1.00 0.00 S ATOM 0 H CYS A 375 -13.355 13.557 10.873 1.00 0.00 H new ATOM 0 HA CYS A 375 -15.757 14.023 9.255 1.00 0.00 H new ATOM 0 HB2 CYS A 375 -15.974 15.957 10.892 1.00 0.00 H new ATOM 0 HB3 CYS A 375 -16.107 14.353 11.586 1.00 0.00 H new ATOM 781 N LEU A 376 -13.002 15.306 8.576 1.00 0.00 N ATOM 782 CA LEU A 376 -12.226 16.267 7.777 1.00 0.00 C ATOM 783 C LEU A 376 -12.209 17.645 8.428 1.00 0.00 C ATOM 784 O LEU A 376 -12.087 18.669 7.749 1.00 0.00 O ATOM 785 CB LEU A 376 -12.727 16.344 6.325 1.00 0.00 C ATOM 786 CG LEU A 376 -12.284 15.205 5.399 1.00 0.00 C ATOM 787 CD1 LEU A 376 -12.751 15.465 3.976 1.00 0.00 C ATOM 788 CD2 LEU A 376 -10.770 15.033 5.437 1.00 0.00 C ATOM 0 H LEU A 376 -12.477 14.472 8.840 1.00 0.00 H new ATOM 0 HA LEU A 376 -11.200 15.900 7.745 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -13.817 16.371 6.339 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -12.390 17.287 5.895 1.00 0.00 H new ATOM 0 HG LEU A 376 -12.742 14.281 5.753 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -12.428 14.647 3.332 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -13.839 15.534 3.957 1.00 0.00 H new ATOM 0 HD13 LEU A 376 -12.322 16.400 3.617 1.00 0.00 H new ATOM 0 HD21 LEU A 376 -10.479 14.219 4.772 1.00 0.00 H new ATOM 0 HD22 LEU A 376 -10.291 15.956 5.111 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -10.456 14.800 6.454 1.00 0.00 H new ATOM 800 N GLY A 377 -12.312 17.660 9.747 1.00 0.00 N ATOM 801 CA GLY A 377 -12.288 18.899 10.477 1.00 0.00 C ATOM 802 C GLY A 377 -10.971 19.094 11.187 1.00 0.00 C ATOM 803 O GLY A 377 -10.052 18.314 10.998 1.00 0.00 O ATOM 0 H GLY A 377 -12.412 16.826 10.325 1.00 0.00 H new ATOM 0 HA2 GLY A 377 -12.461 19.730 9.793 1.00 0.00 H new ATOM 0 HA3 GLY A 377 -13.100 18.911 11.204 1.00 0.00 H new ATOM 807 N PRO A 378 -10.857 20.120 12.020 1.00 0.00 N ATOM 808 CA PRO A 378 -9.621 20.404 12.744 1.00 0.00 C ATOM 809 C PRO A 378 -9.325 19.349 13.816 1.00 0.00 C ATOM 810 O PRO A 378 -10.233 18.840 14.471 1.00 0.00 O ATOM 811 CB PRO A 378 -9.892 21.767 13.388 1.00 0.00 C ATOM 812 CG PRO A 378 -11.376 21.849 13.493 1.00 0.00 C ATOM 813 CD PRO A 378 -11.923 21.075 12.331 1.00 0.00 C ATOM 0 HA PRO A 378 -8.750 20.396 12.089 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -9.421 21.842 14.368 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -9.493 22.579 12.780 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -11.723 21.430 14.437 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -11.711 22.886 13.462 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -12.853 20.568 12.589 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -12.139 21.725 11.483 1.00 0.00 H new ATOM 821 N TRP A 379 -8.057 19.023 13.979 1.00 0.00 N ATOM 822 CA TRP A 379 -7.627 18.043 14.964 1.00 0.00 C ATOM 823 C TRP A 379 -7.628 18.644 16.379 1.00 0.00 C ATOM 824 O TRP A 379 -7.675 17.920 17.369 1.00 0.00 O ATOM 825 CB TRP A 379 -6.226 17.513 14.607 1.00 0.00 C ATOM 826 CG TRP A 379 -5.671 16.552 15.613 1.00 0.00 C ATOM 827 CD1 TRP A 379 -4.718 16.814 16.553 1.00 0.00 C ATOM 828 CD2 TRP A 379 -6.047 15.183 15.792 1.00 0.00 C ATOM 829 NE1 TRP A 379 -4.476 15.690 17.302 1.00 0.00 N ATOM 830 CE2 TRP A 379 -5.278 14.675 16.854 1.00 0.00 C ATOM 831 CE3 TRP A 379 -6.959 14.337 15.154 1.00 0.00 C ATOM 832 CZ2 TRP A 379 -5.391 13.362 17.295 1.00 0.00 C ATOM 833 CZ3 TRP A 379 -7.071 13.033 15.593 1.00 0.00 C ATOM 834 CH2 TRP A 379 -6.291 12.556 16.654 1.00 0.00 C ATOM 0 H TRP A 379 -7.295 19.428 13.435 1.00 0.00 H new ATOM 0 HA TRP A 379 -8.334 17.213 14.951 1.00 0.00 H new ATOM 0 HB2 TRP A 379 -6.270 17.022 13.635 1.00 0.00 H new ATOM 0 HB3 TRP A 379 -5.543 18.356 14.508 1.00 0.00 H new ATOM 0 HD1 TRP A 379 -4.226 17.766 16.688 1.00 0.00 H new ATOM 0 HE1 TRP A 379 -3.807 15.622 18.069 1.00 0.00 H new ATOM 0 HE3 TRP A 379 -7.564 14.696 14.334 1.00 0.00 H new ATOM 0 HZ2 TRP A 379 -4.791 12.992 18.113 1.00 0.00 H new ATOM 0 HZ3 TRP A 379 -7.772 12.369 15.110 1.00 0.00 H new ATOM 0 HH2 TRP A 379 -6.403 11.530 16.973 1.00 0.00 H new ATOM 845 N GLU A 380 -7.592 19.967 16.456 1.00 0.00 N ATOM 846 CA GLU A 380 -7.570 20.673 17.747 1.00 0.00 C ATOM 847 C GLU A 380 -8.721 20.235 18.691 1.00 0.00 C ATOM 848 O GLU A 380 -8.459 19.843 19.831 1.00 0.00 O ATOM 849 CB GLU A 380 -7.583 22.187 17.537 1.00 0.00 C ATOM 850 CG GLU A 380 -6.347 22.706 16.837 1.00 0.00 C ATOM 851 CD GLU A 380 -6.476 24.147 16.430 1.00 0.00 C ATOM 852 OE1 GLU A 380 -6.196 25.034 17.257 1.00 0.00 O1- ATOM 853 OE2 GLU A 380 -6.850 24.402 15.269 1.00 0.00 O ATOM 0 H GLU A 380 -7.577 20.582 15.642 1.00 0.00 H new ATOM 0 HA GLU A 380 -6.639 20.395 18.241 1.00 0.00 H new ATOM 0 HB2 GLU A 380 -8.463 22.458 16.954 1.00 0.00 H new ATOM 0 HB3 GLU A 380 -7.678 22.680 18.505 1.00 0.00 H new ATOM 0 HG2 GLU A 380 -5.486 22.594 17.496 1.00 0.00 H new ATOM 0 HG3 GLU A 380 -6.152 22.099 15.953 1.00 0.00 H new ATOM 860 N PRO A 381 -10.013 20.289 18.244 1.00 0.00 N ATOM 861 CA PRO A 381 -11.153 19.845 19.073 1.00 0.00 C ATOM 862 C PRO A 381 -11.089 18.347 19.394 1.00 0.00 C ATOM 863 O PRO A 381 -11.792 17.859 20.272 1.00 0.00 O ATOM 864 CB PRO A 381 -12.380 20.143 18.198 1.00 0.00 C ATOM 865 CG PRO A 381 -11.849 20.233 16.817 1.00 0.00 C ATOM 866 CD PRO A 381 -10.470 20.805 16.942 1.00 0.00 C ATOM 0 HA PRO A 381 -11.168 20.351 20.038 1.00 0.00 H new ATOM 0 HB2 PRO A 381 -13.127 19.354 18.284 1.00 0.00 H new ATOM 0 HB3 PRO A 381 -12.863 21.073 18.497 1.00 0.00 H new ATOM 0 HG2 PRO A 381 -11.823 19.251 16.344 1.00 0.00 H new ATOM 0 HG3 PRO A 381 -12.481 20.869 16.197 1.00 0.00 H new ATOM 0 HD2 PRO A 381 -9.822 20.478 16.129 1.00 0.00 H new ATOM 0 HD3 PRO A 381 -10.482 21.895 16.922 1.00 0.00 H new ATOM 874 N HIS A 382 -10.234 17.634 18.678 1.00 0.00 N ATOM 875 CA HIS A 382 -10.066 16.201 18.878 1.00 0.00 C ATOM 876 C HIS A 382 -8.921 15.923 19.841 1.00 0.00 C ATOM 877 O HIS A 382 -8.638 14.773 20.172 1.00 0.00 O ATOM 878 CB HIS A 382 -9.808 15.501 17.542 1.00 0.00 C ATOM 879 CG HIS A 382 -10.966 15.560 16.597 1.00 0.00 C ATOM 880 ND1 HIS A 382 -11.209 16.606 15.733 1.00 0.00 N ATOM 881 CD2 HIS A 382 -11.957 14.667 16.389 1.00 0.00 C ATOM 882 CE1 HIS A 382 -12.319 16.326 15.048 1.00 0.00 C ATOM 883 NE2 HIS A 382 -12.817 15.156 15.404 1.00 0.00 N ATOM 0 H HIS A 382 -9.641 18.027 17.947 1.00 0.00 H new ATOM 0 HA HIS A 382 -10.987 15.808 19.309 1.00 0.00 H new ATOM 0 HB2 HIS A 382 -8.939 15.955 17.066 1.00 0.00 H new ATOM 0 HB3 HIS A 382 -9.558 14.457 17.731 1.00 0.00 H new ATOM 0 HD1 HIS A 382 -10.640 17.447 15.635 1.00 0.00 H new ATOM 0 HD2 HIS A 382 -12.067 13.724 16.903 1.00 0.00 H new ATOM 0 HE1 HIS A 382 -12.754 16.972 14.300 1.00 0.00 H new ATOM 891 N GLY A 383 -8.262 16.977 20.284 1.00 0.00 N ATOM 892 CA GLY A 383 -7.165 16.824 21.207 1.00 0.00 C ATOM 893 C GLY A 383 -7.628 16.841 22.644 1.00 0.00 C ATOM 894 O GLY A 383 -7.299 17.766 23.394 1.00 0.00 O ATOM 0 H GLY A 383 -8.469 17.940 20.019 1.00 0.00 H new ATOM 0 HA2 GLY A 383 -6.648 15.886 21.004 1.00 0.00 H new ATOM 0 HA3 GLY A 383 -6.444 17.626 21.049 1.00 0.00 H new ATOM 898 N SER A 384 -8.417 15.829 23.016 1.00 0.00 N ATOM 899 CA SER A 384 -8.935 15.684 24.378 1.00 0.00 C ATOM 900 C SER A 384 -9.829 16.867 24.767 1.00 0.00 C ATOM 901 O SER A 384 -9.949 17.205 25.945 1.00 0.00 O ATOM 902 CB SER A 384 -7.777 15.541 25.371 1.00 0.00 C ATOM 903 OG SER A 384 -6.883 14.508 24.964 1.00 0.00 O ATOM 0 H SER A 384 -8.714 15.088 22.381 1.00 0.00 H new ATOM 0 HA SER A 384 -9.546 14.782 24.411 1.00 0.00 H new ATOM 0 HB2 SER A 384 -7.238 16.485 25.446 1.00 0.00 H new ATOM 0 HB3 SER A 384 -8.169 15.318 26.363 1.00 0.00 H new ATOM 0 HG SER A 384 -6.151 14.435 25.611 1.00 0.00 H new ATOM 909 N ALA A 385 -10.462 17.479 23.780 1.00 0.00 N ATOM 910 CA ALA A 385 -11.335 18.609 24.027 1.00 0.00 C ATOM 911 C ALA A 385 -12.767 18.143 24.251 1.00 0.00 C ATOM 912 O ALA A 385 -13.025 16.950 24.382 1.00 0.00 O ATOM 913 CB ALA A 385 -11.265 19.601 22.873 1.00 0.00 C ATOM 0 H ALA A 385 -10.386 17.210 22.799 1.00 0.00 H new ATOM 0 HA ALA A 385 -10.996 19.113 24.932 1.00 0.00 H new ATOM 0 HB1 ALA A 385 -11.927 20.443 23.076 1.00 0.00 H new ATOM 0 HB2 ALA A 385 -10.242 19.962 22.765 1.00 0.00 H new ATOM 0 HB3 ALA A 385 -11.576 19.109 21.951 1.00 0.00 H new ATOM 919 N TRP A 386 -13.691 19.091 24.284 1.00 0.00 N ATOM 920 CA TRP A 386 -15.112 18.804 24.504 1.00 0.00 C ATOM 921 C TRP A 386 -15.685 17.967 23.356 1.00 0.00 C ATOM 922 O TRP A 386 -16.685 17.261 23.513 1.00 0.00 O ATOM 923 CB TRP A 386 -15.894 20.126 24.584 1.00 0.00 C ATOM 924 CG TRP A 386 -15.991 20.833 23.255 1.00 0.00 C ATOM 925 CD1 TRP A 386 -15.031 21.598 22.655 1.00 0.00 C ATOM 926 CD2 TRP A 386 -17.108 20.818 22.354 1.00 0.00 C ATOM 927 NE1 TRP A 386 -15.480 22.056 21.444 1.00 0.00 N ATOM 928 CE2 TRP A 386 -16.752 21.594 21.237 1.00 0.00 C ATOM 929 CE3 TRP A 386 -18.372 20.222 22.386 1.00 0.00 C ATOM 930 CZ2 TRP A 386 -17.612 21.791 20.164 1.00 0.00 C ATOM 931 CZ3 TRP A 386 -19.225 20.419 21.319 1.00 0.00 C ATOM 932 CH2 TRP A 386 -18.841 21.194 20.222 1.00 0.00 C ATOM 0 H TRP A 386 -13.484 20.082 24.160 1.00 0.00 H new ATOM 0 HA TRP A 386 -15.207 18.245 25.435 1.00 0.00 H new ATOM 0 HB2 TRP A 386 -16.898 19.926 24.957 1.00 0.00 H new ATOM 0 HB3 TRP A 386 -15.411 20.785 25.306 1.00 0.00 H new ATOM 0 HD1 TRP A 386 -14.059 21.811 23.074 1.00 0.00 H new ATOM 0 HE1 TRP A 386 -14.952 22.646 20.801 1.00 0.00 H new ATOM 0 HE3 TRP A 386 -18.675 19.619 23.229 1.00 0.00 H new ATOM 0 HZ2 TRP A 386 -17.321 22.393 19.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 386 -20.206 19.967 21.332 1.00 0.00 H new ATOM 0 HH2 TRP A 386 -19.530 21.325 19.401 1.00 0.00 H new ATOM 943 N TYR A 387 -15.046 18.059 22.213 1.00 0.00 N ATOM 944 CA TYR A 387 -15.528 17.438 21.012 1.00 0.00 C ATOM 945 C TYR A 387 -14.989 16.023 20.856 1.00 0.00 C ATOM 946 O TYR A 387 -13.795 15.775 21.013 1.00 0.00 O ATOM 947 CB TYR A 387 -15.135 18.298 19.814 1.00 0.00 C ATOM 948 CG TYR A 387 -15.763 17.872 18.505 1.00 0.00 C ATOM 949 CD1 TYR A 387 -17.084 18.190 18.209 1.00 0.00 C ATOM 950 CD2 TYR A 387 -15.034 17.160 17.563 1.00 0.00 C ATOM 951 CE1 TYR A 387 -17.656 17.807 17.011 1.00 0.00 C ATOM 952 CE2 TYR A 387 -15.599 16.775 16.368 1.00 0.00 C ATOM 953 CZ TYR A 387 -16.908 17.101 16.094 1.00 0.00 C ATOM 954 OH TYR A 387 -17.472 16.716 14.898 1.00 0.00 O ATOM 0 H TYR A 387 -14.172 18.571 22.095 1.00 0.00 H new ATOM 0 HA TYR A 387 -16.614 17.362 21.070 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -15.414 19.332 20.017 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -14.051 18.276 19.707 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -17.671 18.744 18.926 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -14.006 16.903 17.771 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -18.684 18.060 16.795 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -15.017 16.219 15.648 1.00 0.00 H new ATOM 0 HH TYR A 387 -16.809 16.228 14.366 1.00 0.00 H new ATOM 964 N ASN A 388 -15.883 15.105 20.556 1.00 0.00 N ATOM 965 CA ASN A 388 -15.521 13.718 20.312 1.00 0.00 C ATOM 966 C ASN A 388 -15.799 13.381 18.859 1.00 0.00 C ATOM 967 O ASN A 388 -16.504 14.124 18.175 1.00 0.00 O ATOM 968 CB ASN A 388 -16.311 12.770 21.232 1.00 0.00 C ATOM 969 CG ASN A 388 -17.814 12.831 21.003 1.00 0.00 C ATOM 970 OD1 ASN A 388 -18.518 13.608 21.645 1.00 0.00 O ATOM 971 ND2 ASN A 388 -18.316 12.010 20.094 1.00 0.00 N ATOM 0 H ASN A 388 -16.882 15.295 20.474 1.00 0.00 H new ATOM 0 HA ASN A 388 -14.460 13.588 20.528 1.00 0.00 H new ATOM 0 HB2 ASN A 388 -15.966 11.748 21.073 1.00 0.00 H new ATOM 0 HB3 ASN A 388 -16.097 13.020 22.271 1.00 0.00 H new ATOM 0 HD21 ASN A 388 -19.319 12.008 19.907 1.00 0.00 H new ATOM 0 HD22 ASN A 388 -17.700 11.379 19.581 1.00 0.00 H new ATOM 978 N CYS A 389 -15.261 12.273 18.389 1.00 0.00 N ATOM 979 CA CYS A 389 -15.465 11.872 17.014 1.00 0.00 C ATOM 980 C CYS A 389 -15.671 10.368 16.930 1.00 0.00 C ATOM 981 O CYS A 389 -14.811 9.579 17.356 1.00 0.00 O ATOM 982 CB CYS A 389 -14.270 12.295 16.156 1.00 0.00 C ATOM 983 SG CYS A 389 -14.557 12.257 14.351 1.00 0.00 S ATOM 0 H CYS A 389 -14.682 11.638 18.938 1.00 0.00 H new ATOM 0 HA CYS A 389 -16.358 12.367 16.634 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -13.978 13.306 16.440 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -13.428 11.643 16.388 1.00 0.00 H new ATOM 988 N ASN A 390 -16.803 9.970 16.402 1.00 0.00 N ATOM 989 CA ASN A 390 -17.109 8.563 16.237 1.00 0.00 C ATOM 990 C ASN A 390 -16.427 8.029 14.988 1.00 0.00 C ATOM 991 O ASN A 390 -17.027 7.963 13.914 1.00 0.00 O ATOM 992 CB ASN A 390 -18.621 8.325 16.165 1.00 0.00 C ATOM 993 CG ASN A 390 -19.322 8.473 17.507 1.00 0.00 C ATOM 994 OD1 ASN A 390 -18.877 9.214 18.386 1.00 0.00 O ATOM 995 ND2 ASN A 390 -20.425 7.768 17.671 1.00 0.00 N ATOM 0 H ASN A 390 -17.534 10.602 16.076 1.00 0.00 H new ATOM 0 HA ASN A 390 -16.732 8.027 17.108 1.00 0.00 H new ATOM 0 HB2 ASN A 390 -19.058 9.028 15.456 1.00 0.00 H new ATOM 0 HB3 ASN A 390 -18.805 7.324 15.776 1.00 0.00 H new ATOM 0 HD21 ASN A 390 -20.941 7.825 18.549 1.00 0.00 H new ATOM 0 HD22 ASN A 390 -20.762 7.166 16.920 1.00 0.00 H new ATOM 1002 N ARG A 391 -15.160 7.674 15.131 1.00 0.00 N ATOM 1003 CA ARG A 391 -14.370 7.209 14.008 1.00 0.00 C ATOM 1004 C ARG A 391 -14.575 5.719 13.745 1.00 0.00 C ATOM 1005 O ARG A 391 -14.746 5.301 12.600 1.00 0.00 O ATOM 1006 CB ARG A 391 -12.873 7.533 14.202 1.00 0.00 C ATOM 1007 CG ARG A 391 -12.219 6.853 15.389 1.00 0.00 C ATOM 1008 CD ARG A 391 -12.287 7.705 16.653 1.00 0.00 C ATOM 1009 NE ARG A 391 -11.105 8.559 16.805 1.00 0.00 N ATOM 1010 CZ ARG A 391 -11.070 9.700 17.510 1.00 0.00 C ATOM 1011 NH1 ARG A 391 -12.178 10.198 18.046 1.00 0.00 N1+ ATOM 1012 NH2 ARG A 391 -9.924 10.349 17.666 1.00 0.00 N ATOM 0 H ARG A 391 -14.657 7.700 16.018 1.00 0.00 H new ATOM 0 HA ARG A 391 -14.721 7.747 13.128 1.00 0.00 H new ATOM 0 HB2 ARG A 391 -12.335 7.249 13.298 1.00 0.00 H new ATOM 0 HB3 ARG A 391 -12.762 8.612 14.313 1.00 0.00 H new ATOM 0 HG2 ARG A 391 -12.708 5.896 15.572 1.00 0.00 H new ATOM 0 HG3 ARG A 391 -11.177 6.639 15.153 1.00 0.00 H new ATOM 0 HD2 ARG A 391 -13.182 8.327 16.623 1.00 0.00 H new ATOM 0 HD3 ARG A 391 -12.379 7.055 17.523 1.00 0.00 H new ATOM 0 HE ARG A 391 -10.246 8.264 16.341 1.00 0.00 H new ATOM 0 HH11 ARG A 391 -13.067 9.712 17.924 1.00 0.00 H new ATOM 0 HH12 ARG A 391 -12.141 11.066 18.580 1.00 0.00 H new ATOM 0 HH21 ARG A 391 -9.069 9.981 17.250 1.00 0.00 H new ATOM 0 HH22 ARG A 391 -9.898 11.216 18.202 1.00 0.00 H new ATOM 1026 N TYR A 392 -14.570 4.926 14.799 1.00 0.00 N ATOM 1027 CA TYR A 392 -14.744 3.491 14.663 1.00 0.00 C ATOM 1028 C TYR A 392 -16.094 3.077 15.201 1.00 0.00 C ATOM 1029 O TYR A 392 -16.601 2.004 14.886 1.00 0.00 O ATOM 1030 CB TYR A 392 -13.629 2.734 15.402 1.00 0.00 C ATOM 1031 CG TYR A 392 -13.691 2.839 16.917 1.00 0.00 C ATOM 1032 CD1 TYR A 392 -13.302 3.999 17.571 1.00 0.00 C ATOM 1033 CD2 TYR A 392 -14.140 1.772 17.688 1.00 0.00 C ATOM 1034 CE1 TYR A 392 -13.358 4.094 18.948 1.00 0.00 C ATOM 1035 CE2 TYR A 392 -14.197 1.860 19.065 1.00 0.00 C ATOM 1036 CZ TYR A 392 -13.805 3.024 19.688 1.00 0.00 C ATOM 1037 OH TYR A 392 -13.863 3.117 21.059 1.00 0.00 O ATOM 0 H TYR A 392 -14.448 5.250 15.758 1.00 0.00 H new ATOM 0 HA TYR A 392 -14.689 3.239 13.604 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -13.674 1.682 15.122 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -12.665 3.113 15.064 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -12.950 4.841 16.994 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -14.449 0.859 17.201 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -13.052 5.005 19.442 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -14.547 1.022 19.649 1.00 0.00 H new ATOM 0 HH TYR A 392 -14.202 2.275 21.430 1.00 0.00 H new ATOM 1047 N ASN A 393 -16.672 3.940 16.009 1.00 0.00 N ATOM 1048 CA ASN A 393 -17.956 3.669 16.614 1.00 0.00 C ATOM 1049 C ASN A 393 -19.076 3.996 15.637 1.00 0.00 C ATOM 1050 O ASN A 393 -19.397 5.167 15.412 1.00 0.00 O ATOM 1051 CB ASN A 393 -18.119 4.481 17.906 1.00 0.00 C ATOM 1052 CG ASN A 393 -19.355 4.097 18.710 1.00 0.00 C ATOM 1053 OD1 ASN A 393 -19.994 4.950 19.322 1.00 0.00 O ATOM 1054 ND2 ASN A 393 -19.673 2.813 18.753 1.00 0.00 N ATOM 0 H ASN A 393 -16.268 4.842 16.263 1.00 0.00 H new ATOM 0 HA ASN A 393 -18.009 2.609 16.863 1.00 0.00 H new ATOM 0 HB2 ASN A 393 -17.234 4.344 18.527 1.00 0.00 H new ATOM 0 HB3 ASN A 393 -18.172 5.541 17.656 1.00 0.00 H new ATOM 0 HD21 ASN A 393 -20.471 2.504 19.307 1.00 0.00 H new ATOM 0 HD22 ASN A 393 -19.120 2.133 18.232 1.00 0.00 H new ATOM 1061 N GLU A 394 -19.634 2.961 15.031 1.00 0.00 N ATOM 1062 CA GLU A 394 -20.737 3.116 14.096 1.00 0.00 C ATOM 1063 C GLU A 394 -21.998 3.530 14.839 1.00 0.00 C ATOM 1064 O GLU A 394 -22.123 3.289 16.047 1.00 0.00 O ATOM 1065 CB GLU A 394 -20.976 1.805 13.344 1.00 0.00 C ATOM 1066 CG GLU A 394 -19.849 1.422 12.398 1.00 0.00 C ATOM 1067 CD GLU A 394 -19.805 2.293 11.161 1.00 0.00 C ATOM 1068 OE1 GLU A 394 -19.243 3.402 11.221 1.00 0.00 O1- ATOM 1069 OE2 GLU A 394 -20.347 1.874 10.119 1.00 0.00 O ATOM 0 H GLU A 394 -19.338 1.995 15.172 1.00 0.00 H new ATOM 0 HA GLU A 394 -20.482 3.894 13.376 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -21.117 1.003 14.068 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -21.902 1.888 12.775 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -18.897 1.496 12.924 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -19.968 0.380 12.100 1.00 0.00 H new ATOM 1076 N ASP A 395 -22.936 4.126 14.125 1.00 0.00 N ATOM 1077 CA ASP A 395 -24.169 4.593 14.736 1.00 0.00 C ATOM 1078 C ASP A 395 -25.103 3.422 14.938 1.00 0.00 C ATOM 1079 O ASP A 395 -25.953 3.426 15.833 1.00 0.00 O ATOM 1080 CB ASP A 395 -24.836 5.654 13.857 1.00 0.00 C ATOM 1081 CG ASP A 395 -25.967 6.371 14.568 1.00 0.00 C ATOM 1082 OD1 ASP A 395 -25.683 7.303 15.338 1.00 0.00 O1- ATOM 1083 OD2 ASP A 395 -27.140 6.011 14.360 1.00 0.00 O ATOM 0 H ASP A 395 -22.868 4.298 13.122 1.00 0.00 H new ATOM 0 HA ASP A 395 -23.939 5.045 15.701 1.00 0.00 H new ATOM 0 HB2 ASP A 395 -24.089 6.383 13.543 1.00 0.00 H new ATOM 0 HB3 ASP A 395 -25.221 5.182 12.953 1.00 0.00 H new ATOM 1088 N ASP A 396 -24.931 2.412 14.113 1.00 0.00 N ATOM 1089 CA ASP A 396 -25.741 1.221 14.183 1.00 0.00 C ATOM 1090 C ASP A 396 -24.872 -0.013 14.021 1.00 0.00 C ATOM 1091 O ASP A 396 -24.563 -0.378 12.875 1.00 0.00 O ATOM 1092 CB ASP A 396 -26.817 1.248 13.107 1.00 0.00 C ATOM 1093 CG ASP A 396 -27.775 0.083 13.230 1.00 0.00 C ATOM 1094 OD1 ASP A 396 -28.576 0.069 14.190 1.00 0.00 O ATOM 1095 OD2 ASP A 396 -27.740 -0.821 12.370 1.00 0.00 O1- ATOM 1096 OXT ASP A 396 -24.482 -0.604 15.047 1.00 0.00 O ATOM 0 H ASP A 396 -24.226 2.396 13.376 1.00 0.00 H new ATOM 0 HA ASP A 396 -26.225 1.186 15.159 1.00 0.00 H new ATOM 0 HB2 ASP A 396 -27.373 2.183 13.175 1.00 0.00 H new ATOM 0 HB3 ASP A 396 -26.347 1.228 12.124 1.00 0.00 H new TER 1101 ASP A 396 HETATM 1102 ZN ZN A 401 -3.128 20.497 2.669 1.00 0.00 ZN HETATM 1103 ZN ZN A 402 -13.259 13.941 13.658 1.00 0.00 ZN