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 364 ASN : amide:sc= 1.92 K(o=2.5,f=-3.7!) USER MOD Set 1.2: A 366 ASN : amide:sc= 0.631 K(o=2.5,f=1.4) USER MOD Set 2.1: A 353 LYS NZ :NH3+ -144:sc= 1.07 (180deg=-0.544) USER MOD Set 2.2: A 358 ASN : amide:sc= 0.591 K(o=1.7,f=-6.6!) USER MOD Set 3.1: A 324 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 325 LYS NZ :NH3+ -136:sc= -0.0667 (180deg=-0.342) USER MOD Single : A 326 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 327 CYS SG : rot -0:sc= 0.0636 USER MOD Single : A 331 SER OG : rot 180:sc= 0 USER MOD Single : A 333 THR OG1 : rot 180:sc= 0.0524 USER MOD Single : A 334 SER OG : rot 180:sc= 0 USER MOD Single : A 335 ASN : amide:sc= -0.162 K(o=-0.16,f=-1.5) USER MOD Single : A 340 ASN : amide:sc= 0.981 K(o=0.98,f=0) USER MOD Single : A 341 THR OG1 : rot -142:sc= -0.693 USER MOD Single : A 342 LYS NZ :NH3+ -171:sc= 0.636 (180deg=0.276) USER MOD Single : A 346 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 348 HIS : no HD1:sc= -0.0166 X(o=-0.017,f=-0.021) USER MOD Single : A 350 THR OG1 : rot 180:sc= 0.00383 USER MOD Single : A 357 SER OG : rot 180:sc= 0 USER MOD Single : A 359 HIS : no HD1:sc= 0.852 K(o=0.85,f=-3.9!) USER MOD Single : A 360 MET CE :methyl -128:sc= -1.15 (180deg=-4.7) USER MOD Single : A 365 GLN :FLIP amide:sc= -0.385 F(o=-3.8!,f=-0.38) USER MOD Single : A 368 LYS NZ :NH3+ -126:sc= -0.74 (180deg=-2.17!) USER MOD Single : A 382 HIS : +bothHN:sc= -0.117 K(o=-0.12,f=-5!) 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= -0.0119 X(o=-0.012,f=-0.1) USER MOD Single : A 390 ASN : amide:sc= 0.88 K(o=0.88,f=-5.6!) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 393 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 323 4.040 -6.646 -23.538 1.00 0.00 N ATOM 2 CA GLY A 323 3.160 -5.666 -22.873 1.00 0.00 C ATOM 3 C GLY A 323 2.734 -4.568 -23.809 1.00 0.00 C ATOM 4 O GLY A 323 3.478 -4.205 -24.722 1.00 0.00 O ATOM 0 HA2 GLY A 323 2.278 -6.175 -22.485 1.00 0.00 H new ATOM 0 HA3 GLY A 323 3.680 -5.233 -22.018 1.00 0.00 H new ATOM 10 N SER A 324 1.541 -4.044 -23.597 1.00 0.00 N ATOM 11 CA SER A 324 1.022 -2.972 -24.415 1.00 0.00 C ATOM 12 C SER A 324 0.491 -1.845 -23.535 1.00 0.00 C ATOM 13 O SER A 324 -0.285 -2.087 -22.601 1.00 0.00 O ATOM 14 CB SER A 324 -0.086 -3.492 -25.336 1.00 0.00 C ATOM 15 OG SER A 324 -0.575 -2.460 -26.176 1.00 0.00 O ATOM 0 H SER A 324 0.910 -4.350 -22.856 1.00 0.00 H new ATOM 0 HA SER A 324 1.832 -2.582 -25.031 1.00 0.00 H new ATOM 0 HB2 SER A 324 0.297 -4.311 -25.945 1.00 0.00 H new ATOM 0 HB3 SER A 324 -0.902 -3.895 -24.737 1.00 0.00 H new ATOM 0 HG SER A 324 -1.280 -2.817 -26.756 1.00 0.00 H new ATOM 21 N LYS A 325 0.939 -0.620 -23.835 1.00 0.00 N ATOM 22 CA LYS A 325 0.522 0.596 -23.117 1.00 0.00 C ATOM 23 C LYS A 325 0.922 0.538 -21.645 1.00 0.00 C ATOM 24 O LYS A 325 0.345 1.231 -20.805 1.00 0.00 O ATOM 25 CB LYS A 325 -0.994 0.822 -23.246 1.00 0.00 C ATOM 26 CG LYS A 325 -1.509 0.803 -24.678 1.00 0.00 C ATOM 27 CD LYS A 325 -0.847 1.867 -25.538 1.00 0.00 C ATOM 28 CE LYS A 325 -1.360 1.809 -26.970 1.00 0.00 C ATOM 29 NZ LYS A 325 -1.109 0.484 -27.604 1.00 0.00 N1+ ATOM 0 H LYS A 325 1.605 -0.441 -24.587 1.00 0.00 H new ATOM 0 HA LYS A 325 1.039 1.438 -23.578 1.00 0.00 H new ATOM 0 HB2 LYS A 325 -1.514 0.053 -22.675 1.00 0.00 H new ATOM 0 HB3 LYS A 325 -1.247 1.781 -22.794 1.00 0.00 H new ATOM 0 HG2 LYS A 325 -1.329 -0.179 -25.115 1.00 0.00 H new ATOM 0 HG3 LYS A 325 -2.588 0.958 -24.677 1.00 0.00 H new ATOM 0 HD2 LYS A 325 -1.043 2.853 -25.117 1.00 0.00 H new ATOM 0 HD3 LYS A 325 0.234 1.726 -25.529 1.00 0.00 H new ATOM 0 HE2 LYS A 325 -2.430 2.018 -26.980 1.00 0.00 H new ATOM 0 HE3 LYS A 325 -0.878 2.589 -27.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 325 -0.752 0.624 -28.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 325 -0.404 -0.039 -27.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 325 -1.996 -0.058 -27.637 1.00 0.00 H new ATOM 43 N LYS A 326 1.925 -0.265 -21.346 1.00 0.00 N ATOM 44 CA LYS A 326 2.395 -0.419 -19.988 1.00 0.00 C ATOM 45 C LYS A 326 3.379 0.694 -19.663 1.00 0.00 C ATOM 46 O LYS A 326 4.525 0.681 -20.118 1.00 0.00 O ATOM 47 CB LYS A 326 3.048 -1.804 -19.807 1.00 0.00 C ATOM 48 CG LYS A 326 3.197 -2.266 -18.354 1.00 0.00 C ATOM 49 CD LYS A 326 4.339 -1.565 -17.632 1.00 0.00 C ATOM 50 CE LYS A 326 4.486 -2.072 -16.205 1.00 0.00 C ATOM 51 NZ LYS A 326 5.658 -1.467 -15.517 1.00 0.00 N1+ ATOM 0 H LYS A 326 2.432 -0.823 -22.033 1.00 0.00 H new ATOM 0 HA LYS A 326 1.552 -0.351 -19.300 1.00 0.00 H new ATOM 0 HB2 LYS A 326 2.455 -2.542 -20.348 1.00 0.00 H new ATOM 0 HB3 LYS A 326 4.035 -1.787 -20.270 1.00 0.00 H new ATOM 0 HG2 LYS A 326 2.265 -2.080 -17.820 1.00 0.00 H new ATOM 0 HG3 LYS A 326 3.366 -3.343 -18.334 1.00 0.00 H new ATOM 0 HD2 LYS A 326 5.270 -1.728 -18.175 1.00 0.00 H new ATOM 0 HD3 LYS A 326 4.160 -0.490 -17.621 1.00 0.00 H new ATOM 0 HE2 LYS A 326 3.579 -1.845 -15.644 1.00 0.00 H new ATOM 0 HE3 LYS A 326 4.591 -3.157 -16.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 326 5.722 -1.839 -14.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 326 6.527 -1.705 -16.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 326 5.546 -0.434 -15.484 1.00 0.00 H new ATOM 65 N CYS A 327 2.918 1.671 -18.916 1.00 0.00 N ATOM 66 CA CYS A 327 3.750 2.791 -18.534 1.00 0.00 C ATOM 67 C CYS A 327 3.473 3.208 -17.094 1.00 0.00 C ATOM 68 O CYS A 327 2.467 2.808 -16.503 1.00 0.00 O ATOM 69 CB CYS A 327 3.533 3.967 -19.489 1.00 0.00 C ATOM 70 SG CYS A 327 3.962 3.606 -21.211 1.00 0.00 S ATOM 0 H CYS A 327 1.964 1.713 -18.558 1.00 0.00 H new ATOM 0 HA CYS A 327 4.793 2.480 -18.600 1.00 0.00 H new ATOM 0 HB2 CYS A 327 2.488 4.272 -19.442 1.00 0.00 H new ATOM 0 HB3 CYS A 327 4.128 4.814 -19.147 1.00 0.00 H new ATOM 0 HG CYS A 327 4.396 2.384 -21.303 1.00 0.00 H new ATOM 76 N ASP A 328 4.369 4.001 -16.536 1.00 0.00 N ATOM 77 CA ASP A 328 4.258 4.460 -15.157 1.00 0.00 C ATOM 78 C ASP A 328 4.007 5.964 -15.106 1.00 0.00 C ATOM 79 O ASP A 328 4.457 6.658 -14.188 1.00 0.00 O ATOM 80 CB ASP A 328 5.534 4.099 -14.373 1.00 0.00 C ATOM 81 CG ASP A 328 6.790 4.779 -14.904 1.00 0.00 C ATOM 82 OD1 ASP A 328 7.144 4.563 -16.086 1.00 0.00 O ATOM 83 OD2 ASP A 328 7.443 5.510 -14.141 1.00 0.00 O1- ATOM 0 H ASP A 328 5.196 4.347 -17.023 1.00 0.00 H new ATOM 0 HA ASP A 328 3.408 3.959 -14.693 1.00 0.00 H new ATOM 0 HB2 ASP A 328 5.397 4.373 -13.327 1.00 0.00 H new ATOM 0 HB3 ASP A 328 5.675 3.019 -14.403 1.00 0.00 H new ATOM 88 N ASP A 329 3.258 6.457 -16.084 1.00 0.00 N ATOM 89 CA ASP A 329 2.937 7.879 -16.178 1.00 0.00 C ATOM 90 C ASP A 329 1.910 8.302 -15.116 1.00 0.00 C ATOM 91 O ASP A 329 1.649 7.559 -14.166 1.00 0.00 O ATOM 92 CB ASP A 329 2.446 8.236 -17.593 1.00 0.00 C ATOM 93 CG ASP A 329 1.248 7.424 -18.033 1.00 0.00 C ATOM 94 OD1 ASP A 329 1.444 6.317 -18.573 1.00 0.00 O1- ATOM 95 OD2 ASP A 329 0.110 7.886 -17.850 1.00 0.00 O ATOM 0 H ASP A 329 2.857 5.889 -16.830 1.00 0.00 H new ATOM 0 HA ASP A 329 3.853 8.436 -15.983 1.00 0.00 H new ATOM 0 HB2 ASP A 329 2.190 9.295 -17.625 1.00 0.00 H new ATOM 0 HB3 ASP A 329 3.260 8.083 -18.302 1.00 0.00 H new ATOM 100 N ASP A 330 1.354 9.504 -15.292 1.00 0.00 N ATOM 101 CA ASP A 330 0.400 10.120 -14.346 1.00 0.00 C ATOM 102 C ASP A 330 -0.635 9.136 -13.806 1.00 0.00 C ATOM 103 O ASP A 330 -1.309 8.436 -14.567 1.00 0.00 O ATOM 104 CB ASP A 330 -0.322 11.296 -15.015 1.00 0.00 C ATOM 105 CG ASP A 330 0.598 12.452 -15.331 1.00 0.00 C ATOM 106 OD1 ASP A 330 1.458 12.312 -16.229 1.00 0.00 O1- ATOM 107 OD2 ASP A 330 0.472 13.508 -14.681 1.00 0.00 O ATOM 0 H ASP A 330 1.552 10.089 -16.103 1.00 0.00 H new ATOM 0 HA ASP A 330 0.991 10.466 -13.498 1.00 0.00 H new ATOM 0 HB2 ASP A 330 -0.791 10.950 -15.936 1.00 0.00 H new ATOM 0 HB3 ASP A 330 -1.122 11.644 -14.361 1.00 0.00 H new ATOM 112 N SER A 331 -0.774 9.106 -12.489 1.00 0.00 N ATOM 113 CA SER A 331 -1.730 8.233 -11.829 1.00 0.00 C ATOM 114 C SER A 331 -3.114 8.874 -11.845 1.00 0.00 C ATOM 115 O SER A 331 -3.697 9.171 -10.801 1.00 0.00 O ATOM 116 CB SER A 331 -1.290 7.946 -10.390 1.00 0.00 C ATOM 117 OG SER A 331 0.052 7.469 -10.347 1.00 0.00 O ATOM 0 H SER A 331 -0.229 9.685 -11.850 1.00 0.00 H new ATOM 0 HA SER A 331 -1.773 7.287 -12.368 1.00 0.00 H new ATOM 0 HB2 SER A 331 -1.375 8.854 -9.793 1.00 0.00 H new ATOM 0 HB3 SER A 331 -1.956 7.207 -9.944 1.00 0.00 H new ATOM 0 HG SER A 331 0.308 7.295 -9.417 1.00 0.00 H new ATOM 123 N GLU A 332 -3.614 9.102 -13.040 1.00 0.00 N ATOM 124 CA GLU A 332 -4.918 9.726 -13.246 1.00 0.00 C ATOM 125 C GLU A 332 -6.069 8.757 -12.969 1.00 0.00 C ATOM 126 O GLU A 332 -7.234 9.132 -13.065 1.00 0.00 O ATOM 127 CB GLU A 332 -5.021 10.258 -14.671 1.00 0.00 C ATOM 128 CG GLU A 332 -3.999 11.329 -14.999 1.00 0.00 C ATOM 129 CD GLU A 332 -4.122 12.538 -14.100 1.00 0.00 C ATOM 130 OE1 GLU A 332 -5.082 13.315 -14.274 1.00 0.00 O ATOM 131 OE2 GLU A 332 -3.259 12.725 -13.217 1.00 0.00 O1- ATOM 0 H GLU A 332 -3.131 8.861 -13.905 1.00 0.00 H new ATOM 0 HA GLU A 332 -5.003 10.550 -12.537 1.00 0.00 H new ATOM 0 HB2 GLU A 332 -4.901 9.429 -15.368 1.00 0.00 H new ATOM 0 HB3 GLU A 332 -6.021 10.663 -14.826 1.00 0.00 H new ATOM 0 HG2 GLU A 332 -2.997 10.911 -14.906 1.00 0.00 H new ATOM 0 HG3 GLU A 332 -4.121 11.638 -16.037 1.00 0.00 H new ATOM 138 N THR A 333 -5.739 7.532 -12.621 1.00 0.00 N ATOM 139 CA THR A 333 -6.726 6.526 -12.343 1.00 0.00 C ATOM 140 C THR A 333 -7.177 6.587 -10.886 1.00 0.00 C ATOM 141 O THR A 333 -6.695 5.844 -10.035 1.00 0.00 O ATOM 142 CB THR A 333 -6.178 5.130 -12.670 1.00 0.00 C ATOM 143 OG1 THR A 333 -4.788 5.066 -12.306 1.00 0.00 O ATOM 144 CG2 THR A 333 -6.333 4.818 -14.150 1.00 0.00 C ATOM 0 H THR A 333 -4.776 7.211 -12.524 1.00 0.00 H new ATOM 0 HA THR A 333 -7.591 6.722 -12.976 1.00 0.00 H new ATOM 0 HB THR A 333 -6.745 4.392 -12.103 1.00 0.00 H new ATOM 0 HG1 THR A 333 -4.436 4.175 -12.512 1.00 0.00 H new ATOM 0 HG21 THR A 333 -5.937 3.823 -14.356 1.00 0.00 H new ATOM 0 HG22 THR A 333 -7.388 4.852 -14.420 1.00 0.00 H new ATOM 0 HG23 THR A 333 -5.785 5.555 -14.737 1.00 0.00 H new ATOM 152 N SER A 334 -8.087 7.494 -10.611 1.00 0.00 N ATOM 153 CA SER A 334 -8.620 7.684 -9.264 1.00 0.00 C ATOM 154 C SER A 334 -9.799 6.763 -9.004 1.00 0.00 C ATOM 155 O SER A 334 -10.658 7.050 -8.166 1.00 0.00 O ATOM 156 CB SER A 334 -9.043 9.135 -9.066 1.00 0.00 C ATOM 157 OG SER A 334 -7.972 10.026 -9.341 1.00 0.00 O ATOM 0 H SER A 334 -8.484 8.124 -11.308 1.00 0.00 H new ATOM 0 HA SER A 334 -7.831 7.437 -8.553 1.00 0.00 H new ATOM 0 HB2 SER A 334 -9.885 9.363 -9.719 1.00 0.00 H new ATOM 0 HB3 SER A 334 -9.386 9.280 -8.041 1.00 0.00 H new ATOM 0 HG SER A 334 -8.272 10.949 -9.208 1.00 0.00 H new ATOM 163 N ASN A 335 -9.808 5.633 -9.684 1.00 0.00 N ATOM 164 CA ASN A 335 -10.887 4.672 -9.558 1.00 0.00 C ATOM 165 C ASN A 335 -10.953 4.094 -8.148 1.00 0.00 C ATOM 166 O ASN A 335 -11.997 3.615 -7.711 1.00 0.00 O ATOM 167 CB ASN A 335 -10.728 3.549 -10.594 1.00 0.00 C ATOM 168 CG ASN A 335 -9.470 2.727 -10.388 1.00 0.00 C ATOM 169 OD1 ASN A 335 -8.394 3.089 -10.864 1.00 0.00 O ATOM 170 ND2 ASN A 335 -9.595 1.616 -9.697 1.00 0.00 N ATOM 0 H ASN A 335 -9.073 5.356 -10.335 1.00 0.00 H new ATOM 0 HA ASN A 335 -11.825 5.194 -9.748 1.00 0.00 H new ATOM 0 HB2 ASN A 335 -11.597 2.892 -10.546 1.00 0.00 H new ATOM 0 HB3 ASN A 335 -10.712 3.984 -11.593 1.00 0.00 H new ATOM 0 HD21 ASN A 335 -8.783 1.020 -9.539 1.00 0.00 H new ATOM 0 HD22 ASN A 335 -10.504 1.350 -9.319 1.00 0.00 H new ATOM 177 N TRP A 336 -9.847 4.164 -7.435 1.00 0.00 N ATOM 178 CA TRP A 336 -9.787 3.635 -6.084 1.00 0.00 C ATOM 179 C TRP A 336 -9.937 4.760 -5.068 1.00 0.00 C ATOM 180 O TRP A 336 -10.520 4.580 -4.003 1.00 0.00 O ATOM 181 CB TRP A 336 -8.479 2.855 -5.861 1.00 0.00 C ATOM 182 CG TRP A 336 -7.239 3.646 -6.150 1.00 0.00 C ATOM 183 CD1 TRP A 336 -6.725 3.948 -7.378 1.00 0.00 C ATOM 184 CD2 TRP A 336 -6.350 4.226 -5.191 1.00 0.00 C ATOM 185 NE1 TRP A 336 -5.583 4.691 -7.240 1.00 0.00 N ATOM 186 CE2 TRP A 336 -5.328 4.874 -5.908 1.00 0.00 C ATOM 187 CE3 TRP A 336 -6.321 4.266 -3.794 1.00 0.00 C ATOM 188 CZ2 TRP A 336 -4.291 5.552 -5.277 1.00 0.00 C ATOM 189 CZ3 TRP A 336 -5.289 4.940 -3.171 1.00 0.00 C ATOM 190 CH2 TRP A 336 -4.288 5.573 -3.913 1.00 0.00 C ATOM 0 H TRP A 336 -8.977 4.581 -7.767 1.00 0.00 H new ATOM 0 HA TRP A 336 -10.615 2.940 -5.946 1.00 0.00 H new ATOM 0 HB2 TRP A 336 -8.445 2.511 -4.827 1.00 0.00 H new ATOM 0 HB3 TRP A 336 -8.486 1.967 -6.492 1.00 0.00 H new ATOM 0 HD1 TRP A 336 -7.156 3.645 -8.321 1.00 0.00 H new ATOM 0 HE1 TRP A 336 -5.014 5.050 -8.007 1.00 0.00 H new ATOM 0 HE3 TRP A 336 -7.091 3.779 -3.213 1.00 0.00 H new ATOM 0 HZ2 TRP A 336 -3.516 6.044 -5.846 1.00 0.00 H new ATOM 0 HZ3 TRP A 336 -5.255 4.979 -2.092 1.00 0.00 H new ATOM 0 HH2 TRP A 336 -3.494 6.090 -3.395 1.00 0.00 H new ATOM 201 N ILE A 337 -9.441 5.930 -5.428 1.00 0.00 N ATOM 202 CA ILE A 337 -9.506 7.107 -4.571 1.00 0.00 C ATOM 203 C ILE A 337 -10.961 7.519 -4.330 1.00 0.00 C ATOM 204 O ILE A 337 -11.275 8.182 -3.344 1.00 0.00 O ATOM 205 CB ILE A 337 -8.726 8.284 -5.207 1.00 0.00 C ATOM 206 CG1 ILE A 337 -7.265 7.885 -5.410 1.00 0.00 C ATOM 207 CG2 ILE A 337 -8.825 9.533 -4.339 1.00 0.00 C ATOM 208 CD1 ILE A 337 -6.486 8.835 -6.288 1.00 0.00 C ATOM 0 H ILE A 337 -8.981 6.094 -6.323 1.00 0.00 H new ATOM 0 HA ILE A 337 -9.049 6.855 -3.614 1.00 0.00 H new ATOM 0 HB ILE A 337 -9.169 8.515 -6.176 1.00 0.00 H new ATOM 0 HG12 ILE A 337 -6.777 7.823 -4.437 1.00 0.00 H new ATOM 0 HG13 ILE A 337 -7.229 6.888 -5.849 1.00 0.00 H new ATOM 0 HG21 ILE A 337 -8.269 10.346 -4.806 1.00 0.00 H new ATOM 0 HG22 ILE A 337 -9.871 9.821 -4.234 1.00 0.00 H new ATOM 0 HG23 ILE A 337 -8.406 9.326 -3.354 1.00 0.00 H new ATOM 0 HD11 ILE A 337 -5.459 8.483 -6.383 1.00 0.00 H new ATOM 0 HD12 ILE A 337 -6.947 8.880 -7.275 1.00 0.00 H new ATOM 0 HD13 ILE A 337 -6.489 9.829 -5.841 1.00 0.00 H new ATOM 220 N ALA A 338 -11.842 7.081 -5.225 1.00 0.00 N ATOM 221 CA ALA A 338 -13.270 7.383 -5.144 1.00 0.00 C ATOM 222 C ALA A 338 -13.852 7.083 -3.756 1.00 0.00 C ATOM 223 O ALA A 338 -14.758 7.782 -3.297 1.00 0.00 O ATOM 224 CB ALA A 338 -14.027 6.612 -6.214 1.00 0.00 C ATOM 0 H ALA A 338 -11.587 6.506 -6.028 1.00 0.00 H new ATOM 0 HA ALA A 338 -13.387 8.453 -5.315 1.00 0.00 H new ATOM 0 HB1 ALA A 338 -15.090 6.843 -6.146 1.00 0.00 H new ATOM 0 HB2 ALA A 338 -13.656 6.897 -7.199 1.00 0.00 H new ATOM 0 HB3 ALA A 338 -13.878 5.542 -6.066 1.00 0.00 H new ATOM 230 N ALA A 339 -13.334 6.056 -3.084 1.00 0.00 N ATOM 231 CA ALA A 339 -13.836 5.709 -1.756 1.00 0.00 C ATOM 232 C ALA A 339 -12.750 5.163 -0.840 1.00 0.00 C ATOM 233 O ALA A 339 -13.022 4.800 0.304 1.00 0.00 O ATOM 234 CB ALA A 339 -14.971 4.711 -1.866 1.00 0.00 C ATOM 0 H ALA A 339 -12.582 5.460 -3.429 1.00 0.00 H new ATOM 0 HA ALA A 339 -14.201 6.633 -1.307 1.00 0.00 H new ATOM 0 HB1 ALA A 339 -15.335 4.462 -0.869 1.00 0.00 H new ATOM 0 HB2 ALA A 339 -15.782 5.146 -2.450 1.00 0.00 H new ATOM 0 HB3 ALA A 339 -14.614 3.806 -2.358 1.00 0.00 H new ATOM 240 N ASN A 340 -11.525 5.128 -1.320 1.00 0.00 N ATOM 241 CA ASN A 340 -10.432 4.570 -0.526 1.00 0.00 C ATOM 242 C ASN A 340 -9.493 5.643 -0.062 1.00 0.00 C ATOM 243 O ASN A 340 -8.619 5.406 0.770 1.00 0.00 O ATOM 244 CB ASN A 340 -9.665 3.519 -1.321 1.00 0.00 C ATOM 245 CG ASN A 340 -10.478 2.267 -1.547 1.00 0.00 C ATOM 246 OD1 ASN A 340 -10.423 1.330 -0.761 1.00 0.00 O ATOM 247 ND2 ASN A 340 -11.240 2.251 -2.620 1.00 0.00 N ATOM 0 H ASN A 340 -11.255 5.472 -2.242 1.00 0.00 H new ATOM 0 HA ASN A 340 -10.875 4.096 0.350 1.00 0.00 H new ATOM 0 HB2 ASN A 340 -9.371 3.938 -2.284 1.00 0.00 H new ATOM 0 HB3 ASN A 340 -8.748 3.263 -0.791 1.00 0.00 H new ATOM 0 HD21 ASN A 340 -11.816 1.435 -2.824 1.00 0.00 H new ATOM 0 HD22 ASN A 340 -11.254 3.055 -3.247 1.00 0.00 H new ATOM 254 N THR A 341 -9.664 6.821 -0.592 1.00 0.00 N ATOM 255 CA THR A 341 -8.814 7.922 -0.238 1.00 0.00 C ATOM 256 C THR A 341 -9.580 9.227 -0.306 1.00 0.00 C ATOM 257 O THR A 341 -10.654 9.293 -0.905 1.00 0.00 O ATOM 258 CB THR A 341 -7.591 7.993 -1.163 1.00 0.00 C ATOM 259 OG1 THR A 341 -7.558 6.843 -2.019 1.00 0.00 O ATOM 260 CG2 THR A 341 -6.325 8.036 -0.346 1.00 0.00 C ATOM 0 H THR A 341 -10.388 7.044 -1.274 1.00 0.00 H new ATOM 0 HA THR A 341 -8.470 7.761 0.784 1.00 0.00 H new ATOM 0 HB THR A 341 -7.664 8.897 -1.767 1.00 0.00 H new ATOM 0 HG1 THR A 341 -6.630 6.554 -2.143 1.00 0.00 H new ATOM 0 HG21 THR A 341 -5.464 8.086 -1.012 1.00 0.00 H new ATOM 0 HG22 THR A 341 -6.337 8.915 0.298 1.00 0.00 H new ATOM 0 HG23 THR A 341 -6.257 7.138 0.268 1.00 0.00 H new ATOM 268 N LYS A 342 -9.037 10.254 0.312 1.00 0.00 N ATOM 269 CA LYS A 342 -9.661 11.555 0.312 1.00 0.00 C ATOM 270 C LYS A 342 -8.602 12.617 0.134 1.00 0.00 C ATOM 271 O LYS A 342 -7.420 12.300 -0.040 1.00 0.00 O ATOM 272 CB LYS A 342 -10.458 11.794 1.613 1.00 0.00 C ATOM 273 CG LYS A 342 -11.553 10.762 1.857 1.00 0.00 C ATOM 274 CD LYS A 342 -12.554 11.212 2.917 1.00 0.00 C ATOM 275 CE LYS A 342 -11.919 11.362 4.288 1.00 0.00 C ATOM 276 NZ LYS A 342 -12.941 11.592 5.341 1.00 0.00 N1+ ATOM 0 H LYS A 342 -8.156 10.209 0.825 1.00 0.00 H new ATOM 0 HA LYS A 342 -10.367 11.605 -0.517 1.00 0.00 H new ATOM 0 HB2 LYS A 342 -9.769 11.787 2.458 1.00 0.00 H new ATOM 0 HB3 LYS A 342 -10.907 12.786 1.577 1.00 0.00 H new ATOM 0 HG2 LYS A 342 -12.080 10.569 0.923 1.00 0.00 H new ATOM 0 HG3 LYS A 342 -11.098 9.821 2.167 1.00 0.00 H new ATOM 0 HD2 LYS A 342 -12.993 12.164 2.617 1.00 0.00 H new ATOM 0 HD3 LYS A 342 -13.368 10.489 2.974 1.00 0.00 H new ATOM 0 HE2 LYS A 342 -11.347 10.465 4.525 1.00 0.00 H new ATOM 0 HE3 LYS A 342 -11.215 12.194 4.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 342 -12.469 11.841 6.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 342 -13.568 12.370 5.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 342 -13.502 10.727 5.475 1.00 0.00 H new ATOM 290 N GLU A 343 -9.006 13.858 0.174 1.00 0.00 N ATOM 291 CA GLU A 343 -8.076 14.949 -0.006 1.00 0.00 C ATOM 292 C GLU A 343 -8.095 15.878 1.184 1.00 0.00 C ATOM 293 O GLU A 343 -8.992 15.811 2.027 1.00 0.00 O ATOM 294 CB GLU A 343 -8.393 15.727 -1.280 1.00 0.00 C ATOM 295 CG GLU A 343 -8.277 14.906 -2.550 1.00 0.00 C ATOM 296 CD GLU A 343 -8.576 15.717 -3.784 1.00 0.00 C ATOM 297 OE1 GLU A 343 -9.733 16.149 -3.947 1.00 0.00 O1- ATOM 298 OE2 GLU A 343 -7.657 15.929 -4.596 1.00 0.00 O ATOM 0 H GLU A 343 -9.973 14.143 0.330 1.00 0.00 H new ATOM 0 HA GLU A 343 -7.077 14.521 -0.096 1.00 0.00 H new ATOM 0 HB2 GLU A 343 -9.405 16.125 -1.208 1.00 0.00 H new ATOM 0 HB3 GLU A 343 -7.719 16.581 -1.349 1.00 0.00 H new ATOM 0 HG2 GLU A 343 -7.270 14.495 -2.623 1.00 0.00 H new ATOM 0 HG3 GLU A 343 -8.964 14.061 -2.498 1.00 0.00 H new ATOM 305 N CYS A 344 -7.093 16.735 1.247 1.00 0.00 N ATOM 306 CA CYS A 344 -6.991 17.722 2.294 1.00 0.00 C ATOM 307 C CYS A 344 -8.148 18.704 2.194 1.00 0.00 C ATOM 308 O CYS A 344 -8.474 19.178 1.111 1.00 0.00 O ATOM 309 CB CYS A 344 -5.651 18.458 2.178 1.00 0.00 C ATOM 310 SG CYS A 344 -5.371 19.758 3.427 1.00 0.00 S ATOM 0 H CYS A 344 -6.329 16.763 0.572 1.00 0.00 H new ATOM 0 HA CYS A 344 -7.039 17.228 3.264 1.00 0.00 H new ATOM 0 HB2 CYS A 344 -4.845 17.727 2.250 1.00 0.00 H new ATOM 0 HB3 CYS A 344 -5.586 18.908 1.187 1.00 0.00 H new ATOM 315 N PRO A 345 -8.788 19.008 3.312 1.00 0.00 N ATOM 316 CA PRO A 345 -9.889 19.957 3.345 1.00 0.00 C ATOM 317 C PRO A 345 -9.390 21.399 3.363 1.00 0.00 C ATOM 318 O PRO A 345 -10.174 22.340 3.476 1.00 0.00 O ATOM 319 CB PRO A 345 -10.600 19.616 4.649 1.00 0.00 C ATOM 320 CG PRO A 345 -9.527 19.078 5.538 1.00 0.00 C ATOM 321 CD PRO A 345 -8.504 18.436 4.638 1.00 0.00 C ATOM 0 HA PRO A 345 -10.531 19.886 2.467 1.00 0.00 H new ATOM 0 HB2 PRO A 345 -11.071 20.497 5.085 1.00 0.00 H new ATOM 0 HB3 PRO A 345 -11.388 18.880 4.489 1.00 0.00 H new ATOM 0 HG2 PRO A 345 -9.077 19.876 6.129 1.00 0.00 H new ATOM 0 HG3 PRO A 345 -9.934 18.352 6.241 1.00 0.00 H new ATOM 0 HD2 PRO A 345 -7.488 18.664 4.962 1.00 0.00 H new ATOM 0 HD3 PRO A 345 -8.601 17.350 4.634 1.00 0.00 H new ATOM 329 N LYS A 346 -8.085 21.562 3.259 1.00 0.00 N ATOM 330 CA LYS A 346 -7.482 22.865 3.250 1.00 0.00 C ATOM 331 C LYS A 346 -6.932 23.215 1.866 1.00 0.00 C ATOM 332 O LYS A 346 -7.310 24.237 1.279 1.00 0.00 O ATOM 333 CB LYS A 346 -6.393 22.952 4.326 1.00 0.00 C ATOM 334 CG LYS A 346 -5.346 24.008 4.064 1.00 0.00 C ATOM 335 CD LYS A 346 -4.696 24.482 5.343 1.00 0.00 C ATOM 336 CE LYS A 346 -3.668 25.559 5.061 1.00 0.00 C ATOM 337 NZ LYS A 346 -3.142 26.167 6.304 1.00 0.00 N1+ ATOM 0 H LYS A 346 -7.421 20.792 3.179 1.00 0.00 H new ATOM 0 HA LYS A 346 -8.251 23.601 3.483 1.00 0.00 H new ATOM 0 HB2 LYS A 346 -6.864 23.154 5.288 1.00 0.00 H new ATOM 0 HB3 LYS A 346 -5.902 21.982 4.409 1.00 0.00 H new ATOM 0 HG2 LYS A 346 -4.584 23.607 3.396 1.00 0.00 H new ATOM 0 HG3 LYS A 346 -5.804 24.855 3.553 1.00 0.00 H new ATOM 0 HD2 LYS A 346 -5.457 24.869 6.021 1.00 0.00 H new ATOM 0 HD3 LYS A 346 -4.219 23.641 5.846 1.00 0.00 H new ATOM 0 HE2 LYS A 346 -2.844 25.132 4.490 1.00 0.00 H new ATOM 0 HE3 LYS A 346 -4.117 26.335 4.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 346 -2.442 26.898 6.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 346 -3.924 26.598 6.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 346 -2.690 25.433 6.885 1.00 0.00 H new ATOM 351 N CYS A 347 -6.067 22.361 1.331 1.00 0.00 N ATOM 352 CA CYS A 347 -5.467 22.623 0.028 1.00 0.00 C ATOM 353 C CYS A 347 -5.993 21.673 -1.041 1.00 0.00 C ATOM 354 O CYS A 347 -5.703 21.846 -2.227 1.00 0.00 O ATOM 355 CB CYS A 347 -3.947 22.544 0.113 1.00 0.00 C ATOM 356 SG CYS A 347 -3.315 20.967 0.726 1.00 0.00 S ATOM 0 H CYS A 347 -5.768 21.492 1.773 1.00 0.00 H new ATOM 0 HA CYS A 347 -5.751 23.634 -0.265 1.00 0.00 H new ATOM 0 HB2 CYS A 347 -3.530 22.729 -0.877 1.00 0.00 H new ATOM 0 HB3 CYS A 347 -3.590 23.342 0.763 1.00 0.00 H new ATOM 361 N HIS A 348 -6.762 20.684 -0.614 1.00 0.00 N ATOM 362 CA HIS A 348 -7.366 19.702 -1.516 1.00 0.00 C ATOM 363 C HIS A 348 -6.318 18.881 -2.244 1.00 0.00 C ATOM 364 O HIS A 348 -6.350 18.751 -3.464 1.00 0.00 O ATOM 365 CB HIS A 348 -8.316 20.371 -2.518 1.00 0.00 C ATOM 366 CG HIS A 348 -9.585 20.869 -1.902 1.00 0.00 C ATOM 367 ND1 HIS A 348 -10.806 20.414 -2.326 1.00 0.00 N ATOM 368 CD2 HIS A 348 -9.770 21.776 -0.914 1.00 0.00 C ATOM 369 CE1 HIS A 348 -11.704 21.048 -1.592 1.00 0.00 C ATOM 370 NE2 HIS A 348 -11.123 21.884 -0.722 1.00 0.00 N ATOM 0 H HIS A 348 -6.989 20.535 0.369 1.00 0.00 H new ATOM 0 HA HIS A 348 -7.948 19.022 -0.895 1.00 0.00 H new ATOM 0 HB2 HIS A 348 -7.800 21.206 -2.992 1.00 0.00 H new ATOM 0 HB3 HIS A 348 -8.560 19.658 -3.306 1.00 0.00 H new ATOM 0 HD2 HIS A 348 -8.999 22.312 -0.380 1.00 0.00 H new ATOM 0 HE1 HIS A 348 -12.771 20.909 -1.682 1.00 0.00 H new ATOM 0 HE2 HIS A 348 -11.596 22.485 -0.047 1.00 0.00 H new ATOM 378 N VAL A 349 -5.391 18.333 -1.491 1.00 0.00 N ATOM 379 CA VAL A 349 -4.361 17.484 -2.051 1.00 0.00 C ATOM 380 C VAL A 349 -4.672 16.028 -1.722 1.00 0.00 C ATOM 381 O VAL A 349 -5.179 15.730 -0.640 1.00 0.00 O ATOM 382 CB VAL A 349 -2.947 17.860 -1.514 1.00 0.00 C ATOM 383 CG1 VAL A 349 -2.863 17.657 -0.021 1.00 0.00 C ATOM 384 CG2 VAL A 349 -1.857 17.074 -2.226 1.00 0.00 C ATOM 0 H VAL A 349 -5.329 18.461 -0.481 1.00 0.00 H new ATOM 0 HA VAL A 349 -4.352 17.629 -3.131 1.00 0.00 H new ATOM 0 HB VAL A 349 -2.787 18.918 -1.723 1.00 0.00 H new ATOM 0 HG11 VAL A 349 -1.866 17.927 0.327 1.00 0.00 H new ATOM 0 HG12 VAL A 349 -3.603 18.286 0.474 1.00 0.00 H new ATOM 0 HG13 VAL A 349 -3.059 16.611 0.216 1.00 0.00 H new ATOM 0 HG21 VAL A 349 -0.883 17.360 -1.828 1.00 0.00 H new ATOM 0 HG22 VAL A 349 -2.015 16.007 -2.067 1.00 0.00 H new ATOM 0 HG23 VAL A 349 -1.890 17.291 -3.294 1.00 0.00 H new ATOM 394 N THR A 350 -4.400 15.135 -2.653 1.00 0.00 N ATOM 395 CA THR A 350 -4.664 13.728 -2.451 1.00 0.00 C ATOM 396 C THR A 350 -3.773 13.165 -1.346 1.00 0.00 C ATOM 397 O THR A 350 -2.553 13.072 -1.496 1.00 0.00 O ATOM 398 CB THR A 350 -4.435 12.939 -3.746 1.00 0.00 C ATOM 399 OG1 THR A 350 -4.998 13.670 -4.857 1.00 0.00 O ATOM 400 CG2 THR A 350 -5.090 11.569 -3.663 1.00 0.00 C ATOM 0 H THR A 350 -3.994 15.363 -3.561 1.00 0.00 H new ATOM 0 HA THR A 350 -5.708 13.625 -2.154 1.00 0.00 H new ATOM 0 HB THR A 350 -3.363 12.807 -3.889 1.00 0.00 H new ATOM 0 HG1 THR A 350 -4.852 13.169 -5.686 1.00 0.00 H new ATOM 0 HG21 THR A 350 -4.916 11.026 -4.592 1.00 0.00 H new ATOM 0 HG22 THR A 350 -4.662 11.011 -2.830 1.00 0.00 H new ATOM 0 HG23 THR A 350 -6.162 11.687 -3.508 1.00 0.00 H new ATOM 408 N ILE A 351 -4.391 12.810 -0.237 1.00 0.00 N ATOM 409 CA ILE A 351 -3.676 12.262 0.893 1.00 0.00 C ATOM 410 C ILE A 351 -3.919 10.766 0.948 1.00 0.00 C ATOM 411 O ILE A 351 -4.350 10.182 -0.036 1.00 0.00 O ATOM 412 CB ILE A 351 -4.146 12.914 2.221 1.00 0.00 C ATOM 413 CG1 ILE A 351 -5.607 12.557 2.508 1.00 0.00 C ATOM 414 CG2 ILE A 351 -3.968 14.433 2.171 1.00 0.00 C ATOM 415 CD1 ILE A 351 -6.197 13.293 3.685 1.00 0.00 C ATOM 0 H ILE A 351 -5.398 12.894 -0.096 1.00 0.00 H new ATOM 0 HA ILE A 351 -2.613 12.470 0.771 1.00 0.00 H new ATOM 0 HB ILE A 351 -3.529 12.522 3.029 1.00 0.00 H new ATOM 0 HG12 ILE A 351 -6.204 12.772 1.622 1.00 0.00 H new ATOM 0 HG13 ILE A 351 -5.680 11.485 2.689 1.00 0.00 H new ATOM 0 HG21 ILE A 351 -4.304 14.870 3.112 1.00 0.00 H new ATOM 0 HG22 ILE A 351 -2.916 14.671 2.015 1.00 0.00 H new ATOM 0 HG23 ILE A 351 -4.558 14.842 1.350 1.00 0.00 H new ATOM 0 HD11 ILE A 351 -7.234 12.986 3.824 1.00 0.00 H new ATOM 0 HD12 ILE A 351 -5.626 13.059 4.584 1.00 0.00 H new ATOM 0 HD13 ILE A 351 -6.158 14.366 3.499 1.00 0.00 H new ATOM 427 N GLU A 352 -3.637 10.152 2.086 1.00 0.00 N ATOM 428 CA GLU A 352 -3.880 8.732 2.270 1.00 0.00 C ATOM 429 C GLU A 352 -3.719 8.357 3.726 1.00 0.00 C ATOM 430 O GLU A 352 -2.704 8.679 4.350 1.00 0.00 O ATOM 431 CB GLU A 352 -2.952 7.893 1.400 1.00 0.00 C ATOM 432 CG GLU A 352 -3.295 6.412 1.410 1.00 0.00 C ATOM 433 CD GLU A 352 -2.512 5.621 0.393 1.00 0.00 C ATOM 434 OE1 GLU A 352 -2.976 5.505 -0.755 1.00 0.00 O1- ATOM 435 OE2 GLU A 352 -1.433 5.105 0.738 1.00 0.00 O ATOM 0 H GLU A 352 -3.237 10.619 2.900 1.00 0.00 H new ATOM 0 HA GLU A 352 -4.905 8.524 1.962 1.00 0.00 H new ATOM 0 HB2 GLU A 352 -2.994 8.262 0.375 1.00 0.00 H new ATOM 0 HB3 GLU A 352 -1.926 8.024 1.744 1.00 0.00 H new ATOM 0 HG2 GLU A 352 -3.104 6.007 2.404 1.00 0.00 H new ATOM 0 HG3 GLU A 352 -4.361 6.290 1.216 1.00 0.00 H new ATOM 442 N LYS A 353 -4.731 7.688 4.265 1.00 0.00 N ATOM 443 CA LYS A 353 -4.742 7.289 5.663 1.00 0.00 C ATOM 444 C LYS A 353 -3.646 6.265 5.940 1.00 0.00 C ATOM 445 O LYS A 353 -3.386 5.373 5.121 1.00 0.00 O ATOM 446 CB LYS A 353 -6.113 6.723 6.030 1.00 0.00 C ATOM 447 CG LYS A 353 -6.330 6.487 7.516 1.00 0.00 C ATOM 448 CD LYS A 353 -6.377 7.790 8.290 1.00 0.00 C ATOM 449 CE LYS A 353 -6.735 7.557 9.750 1.00 0.00 C ATOM 450 NZ LYS A 353 -7.945 6.706 9.920 1.00 0.00 N1+ ATOM 0 H LYS A 353 -5.563 7.409 3.746 1.00 0.00 H new ATOM 0 HA LYS A 353 -4.546 8.166 6.280 1.00 0.00 H new ATOM 0 HB2 LYS A 353 -6.881 7.407 5.669 1.00 0.00 H new ATOM 0 HB3 LYS A 353 -6.254 5.780 5.503 1.00 0.00 H new ATOM 0 HG2 LYS A 353 -7.262 5.941 7.666 1.00 0.00 H new ATOM 0 HG3 LYS A 353 -5.528 5.861 7.906 1.00 0.00 H new ATOM 0 HD2 LYS A 353 -5.409 8.288 8.226 1.00 0.00 H new ATOM 0 HD3 LYS A 353 -7.109 8.458 7.837 1.00 0.00 H new ATOM 0 HE2 LYS A 353 -5.892 7.086 10.255 1.00 0.00 H new ATOM 0 HE3 LYS A 353 -6.902 8.518 10.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 353 -8.490 7.038 10.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 353 -8.535 6.766 9.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 353 -7.656 5.719 10.072 1.00 0.00 H new ATOM 464 N ASP A 354 -3.015 6.397 7.089 1.00 0.00 N ATOM 465 CA ASP A 354 -1.907 5.527 7.469 1.00 0.00 C ATOM 466 C ASP A 354 -2.417 4.283 8.165 1.00 0.00 C ATOM 467 O ASP A 354 -1.982 3.170 7.863 1.00 0.00 O ATOM 468 CB ASP A 354 -0.924 6.279 8.380 1.00 0.00 C ATOM 469 CG ASP A 354 0.225 5.417 8.872 1.00 0.00 C ATOM 470 OD1 ASP A 354 1.276 5.370 8.192 1.00 0.00 O ATOM 471 OD2 ASP A 354 0.095 4.800 9.956 1.00 0.00 O1- ATOM 0 H ASP A 354 -3.249 7.104 7.786 1.00 0.00 H new ATOM 0 HA ASP A 354 -1.384 5.225 6.562 1.00 0.00 H new ATOM 0 HB2 ASP A 354 -0.520 7.134 7.838 1.00 0.00 H new ATOM 0 HB3 ASP A 354 -1.466 6.673 9.239 1.00 0.00 H new ATOM 476 N GLY A 355 -3.357 4.462 9.079 1.00 0.00 N ATOM 477 CA GLY A 355 -3.887 3.343 9.795 1.00 0.00 C ATOM 478 C GLY A 355 -5.016 3.716 10.727 1.00 0.00 C ATOM 479 O GLY A 355 -5.929 4.455 10.343 1.00 0.00 O ATOM 0 H GLY A 355 -3.757 5.366 9.331 1.00 0.00 H new ATOM 0 HA2 GLY A 355 -4.243 2.599 9.082 1.00 0.00 H new ATOM 0 HA3 GLY A 355 -3.088 2.876 10.371 1.00 0.00 H new ATOM 483 N GLY A 356 -4.945 3.215 11.954 1.00 0.00 N ATOM 484 CA GLY A 356 -5.998 3.439 12.927 1.00 0.00 C ATOM 485 C GLY A 356 -6.002 4.843 13.488 1.00 0.00 C ATOM 486 O GLY A 356 -7.065 5.408 13.749 1.00 0.00 O ATOM 0 H GLY A 356 -4.167 2.651 12.296 1.00 0.00 H new ATOM 0 HA2 GLY A 356 -6.963 3.238 12.461 1.00 0.00 H new ATOM 0 HA3 GLY A 356 -5.885 2.728 13.745 1.00 0.00 H new ATOM 490 N SER A 357 -4.820 5.412 13.673 1.00 0.00 N ATOM 491 CA SER A 357 -4.705 6.752 14.214 1.00 0.00 C ATOM 492 C SER A 357 -5.350 7.761 13.277 1.00 0.00 C ATOM 493 O SER A 357 -4.926 7.920 12.135 1.00 0.00 O ATOM 494 CB SER A 357 -3.243 7.109 14.434 1.00 0.00 C ATOM 495 OG SER A 357 -2.596 6.124 15.226 1.00 0.00 O ATOM 0 H SER A 357 -3.929 4.965 13.456 1.00 0.00 H new ATOM 0 HA SER A 357 -5.224 6.782 15.172 1.00 0.00 H new ATOM 0 HB2 SER A 357 -2.737 7.198 13.473 1.00 0.00 H new ATOM 0 HB3 SER A 357 -3.171 8.080 14.923 1.00 0.00 H new ATOM 0 HG SER A 357 -1.657 6.372 15.354 1.00 0.00 H new ATOM 501 N ASN A 358 -6.364 8.443 13.767 1.00 0.00 N ATOM 502 CA ASN A 358 -7.096 9.411 12.974 1.00 0.00 C ATOM 503 C ASN A 358 -6.362 10.729 12.889 1.00 0.00 C ATOM 504 O ASN A 358 -6.842 11.674 12.255 1.00 0.00 O ATOM 505 CB ASN A 358 -8.490 9.611 13.539 1.00 0.00 C ATOM 506 CG ASN A 358 -9.387 8.422 13.274 1.00 0.00 C ATOM 507 OD1 ASN A 358 -9.248 7.734 12.255 1.00 0.00 O ATOM 508 ND2 ASN A 358 -10.309 8.170 14.178 1.00 0.00 N ATOM 0 H ASN A 358 -6.704 8.343 14.723 1.00 0.00 H new ATOM 0 HA ASN A 358 -7.180 9.016 11.961 1.00 0.00 H new ATOM 0 HB2 ASN A 358 -8.424 9.783 14.613 1.00 0.00 H new ATOM 0 HB3 ASN A 358 -8.934 10.505 13.100 1.00 0.00 H new ATOM 0 HD21 ASN A 358 -10.944 7.382 14.053 1.00 0.00 H new ATOM 0 HD22 ASN A 358 -10.389 8.763 15.004 1.00 0.00 H new ATOM 515 N HIS A 359 -5.204 10.790 13.534 1.00 0.00 N ATOM 516 CA HIS A 359 -4.349 11.965 13.490 1.00 0.00 C ATOM 517 C HIS A 359 -3.710 12.073 12.103 1.00 0.00 C ATOM 518 O HIS A 359 -2.528 11.783 11.918 1.00 0.00 O ATOM 519 CB HIS A 359 -3.268 11.866 14.582 1.00 0.00 C ATOM 520 CG HIS A 359 -2.520 13.142 14.852 1.00 0.00 C ATOM 521 ND1 HIS A 359 -1.752 13.288 15.981 1.00 0.00 N ATOM 522 CD2 HIS A 359 -2.456 14.285 14.125 1.00 0.00 C ATOM 523 CE1 HIS A 359 -1.242 14.504 15.917 1.00 0.00 C ATOM 524 NE2 HIS A 359 -1.640 15.142 14.814 1.00 0.00 N ATOM 0 H HIS A 359 -4.833 10.027 14.101 1.00 0.00 H new ATOM 0 HA HIS A 359 -4.942 12.860 13.676 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -3.738 11.535 15.508 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -2.552 11.096 14.295 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -2.952 14.481 13.186 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -0.586 14.929 16.662 1.00 0.00 H new ATOM 0 HE2 HIS A 359 -1.384 16.090 14.537 1.00 0.00 H new ATOM 532 N MET A 360 -4.515 12.448 11.142 1.00 0.00 N ATOM 533 CA MET A 360 -4.086 12.568 9.764 1.00 0.00 C ATOM 534 C MET A 360 -3.510 13.950 9.482 1.00 0.00 C ATOM 535 O MET A 360 -4.080 14.969 9.863 1.00 0.00 O ATOM 536 CB MET A 360 -5.266 12.252 8.822 1.00 0.00 C ATOM 537 CG MET A 360 -5.232 12.975 7.482 1.00 0.00 C ATOM 538 SD MET A 360 -3.897 12.425 6.403 1.00 0.00 S ATOM 539 CE MET A 360 -4.489 10.806 5.952 1.00 0.00 C ATOM 0 H MET A 360 -5.497 12.682 11.291 1.00 0.00 H new ATOM 0 HA MET A 360 -3.290 11.846 9.582 1.00 0.00 H new ATOM 0 HB2 MET A 360 -5.286 11.178 8.638 1.00 0.00 H new ATOM 0 HB3 MET A 360 -6.196 12.506 9.331 1.00 0.00 H new ATOM 0 HG2 MET A 360 -6.184 12.826 6.973 1.00 0.00 H new ATOM 0 HG3 MET A 360 -5.129 14.046 7.658 1.00 0.00 H new ATOM 0 HE1 MET A 360 -3.710 10.068 6.142 1.00 0.00 H new ATOM 0 HE2 MET A 360 -5.371 10.563 6.544 1.00 0.00 H new ATOM 0 HE3 MET A 360 -4.748 10.795 4.893 1.00 0.00 H new ATOM 549 N VAL A 361 -2.375 13.976 8.825 1.00 0.00 N ATOM 550 CA VAL A 361 -1.739 15.218 8.464 1.00 0.00 C ATOM 551 C VAL A 361 -1.484 15.274 6.960 1.00 0.00 C ATOM 552 O VAL A 361 -1.092 14.273 6.339 1.00 0.00 O ATOM 553 CB VAL A 361 -0.427 15.455 9.269 1.00 0.00 C ATOM 554 CG1 VAL A 361 0.487 14.253 9.200 1.00 0.00 C ATOM 555 CG2 VAL A 361 0.296 16.710 8.797 1.00 0.00 C ATOM 0 H VAL A 361 -1.870 13.141 8.528 1.00 0.00 H new ATOM 0 HA VAL A 361 -2.422 16.026 8.726 1.00 0.00 H new ATOM 0 HB VAL A 361 -0.710 15.603 10.311 1.00 0.00 H new ATOM 0 HG11 VAL A 361 1.393 14.452 9.772 1.00 0.00 H new ATOM 0 HG12 VAL A 361 -0.022 13.384 9.617 1.00 0.00 H new ATOM 0 HG13 VAL A 361 0.750 14.055 8.161 1.00 0.00 H new ATOM 0 HG21 VAL A 361 1.207 16.846 9.380 1.00 0.00 H new ATOM 0 HG22 VAL A 361 0.551 16.608 7.742 1.00 0.00 H new ATOM 0 HG23 VAL A 361 -0.353 17.576 8.931 1.00 0.00 H new ATOM 565 N CYS A 362 -1.746 16.441 6.387 1.00 0.00 N ATOM 566 CA CYS A 362 -1.599 16.684 4.959 1.00 0.00 C ATOM 567 C CYS A 362 -0.213 16.293 4.452 1.00 0.00 C ATOM 568 O CYS A 362 0.770 16.324 5.196 1.00 0.00 O ATOM 569 CB CYS A 362 -1.857 18.156 4.672 1.00 0.00 C ATOM 570 SG CYS A 362 -1.824 18.595 2.918 1.00 0.00 S ATOM 0 H CYS A 362 -2.071 17.256 6.908 1.00 0.00 H new ATOM 0 HA CYS A 362 -2.326 16.063 4.434 1.00 0.00 H new ATOM 0 HB2 CYS A 362 -2.829 18.428 5.084 1.00 0.00 H new ATOM 0 HB3 CYS A 362 -1.110 18.752 5.197 1.00 0.00 H new ATOM 575 N ARG A 363 -0.145 15.942 3.181 1.00 0.00 N ATOM 576 CA ARG A 363 1.110 15.526 2.569 1.00 0.00 C ATOM 577 C ARG A 363 1.740 16.700 1.862 1.00 0.00 C ATOM 578 O ARG A 363 2.951 16.741 1.662 1.00 0.00 O ATOM 579 CB ARG A 363 0.888 14.398 1.552 1.00 0.00 C ATOM 580 CG ARG A 363 -0.321 13.509 1.829 1.00 0.00 C ATOM 581 CD ARG A 363 -0.305 12.909 3.236 1.00 0.00 C ATOM 582 NE ARG A 363 0.841 12.038 3.468 1.00 0.00 N ATOM 583 CZ ARG A 363 1.270 11.670 4.679 1.00 0.00 C ATOM 584 NH1 ARG A 363 0.681 12.145 5.774 1.00 0.00 N1+ ATOM 585 NH2 ARG A 363 2.294 10.835 4.796 1.00 0.00 N ATOM 0 H ARG A 363 -0.945 15.936 2.548 1.00 0.00 H new ATOM 0 HA ARG A 363 1.764 15.160 3.360 1.00 0.00 H new ATOM 0 HB2 ARG A 363 0.777 14.839 0.561 1.00 0.00 H new ATOM 0 HB3 ARG A 363 1.781 13.773 1.524 1.00 0.00 H new ATOM 0 HG2 ARG A 363 -1.233 14.092 1.698 1.00 0.00 H new ATOM 0 HG3 ARG A 363 -0.350 12.703 1.096 1.00 0.00 H new ATOM 0 HD2 ARG A 363 -0.297 13.715 3.969 1.00 0.00 H new ATOM 0 HD3 ARG A 363 -1.223 12.343 3.395 1.00 0.00 H new ATOM 0 HE ARG A 363 1.347 11.687 2.655 1.00 0.00 H new ATOM 0 HH11 ARG A 363 -0.102 12.793 5.691 1.00 0.00 H new ATOM 0 HH12 ARG A 363 1.013 11.861 6.696 1.00 0.00 H new ATOM 0 HH21 ARG A 363 2.755 10.473 3.961 1.00 0.00 H new ATOM 0 HH22 ARG A 363 2.621 10.555 5.721 1.00 0.00 H new ATOM 599 N ASN A 364 0.904 17.655 1.480 1.00 0.00 N ATOM 600 CA ASN A 364 1.363 18.837 0.776 1.00 0.00 C ATOM 601 C ASN A 364 2.367 19.601 1.615 1.00 0.00 C ATOM 602 O ASN A 364 2.070 20.044 2.720 1.00 0.00 O ATOM 603 CB ASN A 364 0.172 19.725 0.380 1.00 0.00 C ATOM 604 CG ASN A 364 0.576 21.033 -0.283 1.00 0.00 C ATOM 605 OD1 ASN A 364 1.689 21.178 -0.794 1.00 0.00 O ATOM 606 ND2 ASN A 364 -0.343 21.980 -0.309 1.00 0.00 N ATOM 0 H ASN A 364 -0.102 17.631 1.649 1.00 0.00 H new ATOM 0 HA ASN A 364 1.865 18.524 -0.140 1.00 0.00 H new ATOM 0 HB2 ASN A 364 -0.474 19.169 -0.299 1.00 0.00 H new ATOM 0 HB3 ASN A 364 -0.416 19.946 1.271 1.00 0.00 H new ATOM 0 HD21 ASN A 364 -0.144 22.871 -0.764 1.00 0.00 H new ATOM 0 HD22 ASN A 364 -1.252 21.821 0.125 1.00 0.00 H new ATOM 613 N GLN A 365 3.565 19.733 1.074 1.00 0.00 N ATOM 614 CA GLN A 365 4.666 20.418 1.744 1.00 0.00 C ATOM 615 C GLN A 365 4.374 21.903 1.944 1.00 0.00 C ATOM 616 O GLN A 365 5.040 22.575 2.720 1.00 0.00 O ATOM 617 CB GLN A 365 5.974 20.236 0.962 1.00 0.00 C ATOM 618 CG GLN A 365 5.809 20.348 -0.547 1.00 0.00 C ATOM 619 CD GLN A 365 5.638 18.994 -1.234 1.00 0.00 C ATOM 620 OE1 GLN A 365 5.160 17.999 -0.496 1.00 0.00 O flip ATOM 621 NE2 GLN A 365 5.961 18.843 -2.411 1.00 0.00 N flip ATOM 0 H GLN A 365 3.807 19.368 0.153 1.00 0.00 H new ATOM 0 HA GLN A 365 4.776 19.965 2.729 1.00 0.00 H new ATOM 0 HB2 GLN A 365 6.693 20.984 1.296 1.00 0.00 H new ATOM 0 HB3 GLN A 365 6.396 19.260 1.200 1.00 0.00 H new ATOM 0 HG2 GLN A 365 4.942 20.972 -0.766 1.00 0.00 H new ATOM 0 HG3 GLN A 365 6.680 20.853 -0.965 1.00 0.00 H new ATOM 0 HE21 GLN A 365 6.324 19.632 -2.945 1.00 0.00 H new ATOM 0 HE22 GLN A 365 5.865 17.929 -2.853 1.00 0.00 H new ATOM 630 N ASN A 366 3.381 22.403 1.240 1.00 0.00 N ATOM 631 CA ASN A 366 2.983 23.800 1.361 1.00 0.00 C ATOM 632 C ASN A 366 1.781 23.920 2.285 1.00 0.00 C ATOM 633 O ASN A 366 1.151 24.972 2.369 1.00 0.00 O ATOM 634 CB ASN A 366 2.629 24.382 -0.013 1.00 0.00 C ATOM 635 CG ASN A 366 3.726 24.188 -1.036 1.00 0.00 C ATOM 636 OD1 ASN A 366 4.648 24.994 -1.136 1.00 0.00 O ATOM 637 ND2 ASN A 366 3.624 23.125 -1.816 1.00 0.00 N ATOM 0 H ASN A 366 2.829 21.864 0.573 1.00 0.00 H new ATOM 0 HA ASN A 366 3.821 24.360 1.777 1.00 0.00 H new ATOM 0 HB2 ASN A 366 1.714 23.913 -0.376 1.00 0.00 H new ATOM 0 HB3 ASN A 366 2.421 25.447 0.092 1.00 0.00 H new ATOM 0 HD21 ASN A 366 4.327 22.950 -2.534 1.00 0.00 H new ATOM 0 HD22 ASN A 366 2.842 22.480 -1.700 1.00 0.00 H new ATOM 644 N CYS A 367 1.482 22.840 2.990 1.00 0.00 N ATOM 645 CA CYS A 367 0.324 22.790 3.859 1.00 0.00 C ATOM 646 C CYS A 367 0.672 22.105 5.170 1.00 0.00 C ATOM 647 O CYS A 367 0.891 22.769 6.185 1.00 0.00 O ATOM 648 CB CYS A 367 -0.809 22.046 3.157 1.00 0.00 C ATOM 649 SG CYS A 367 -2.394 22.023 4.061 1.00 0.00 S ATOM 0 H CYS A 367 2.032 21.981 2.974 1.00 0.00 H new ATOM 0 HA CYS A 367 0.002 23.807 4.081 1.00 0.00 H new ATOM 0 HB2 CYS A 367 -0.972 22.501 2.180 1.00 0.00 H new ATOM 0 HB3 CYS A 367 -0.494 21.018 2.981 1.00 0.00 H new ATOM 654 N LYS A 368 0.745 20.767 5.130 1.00 0.00 N ATOM 655 CA LYS A 368 1.068 19.958 6.308 1.00 0.00 C ATOM 656 C LYS A 368 0.083 20.218 7.446 1.00 0.00 C ATOM 657 O LYS A 368 0.449 20.188 8.623 1.00 0.00 O ATOM 658 CB LYS A 368 2.498 20.248 6.750 1.00 0.00 C ATOM 659 CG LYS A 368 3.524 19.917 5.685 1.00 0.00 C ATOM 660 CD LYS A 368 4.812 20.702 5.866 1.00 0.00 C ATOM 661 CE LYS A 368 4.577 22.205 5.732 1.00 0.00 C ATOM 662 NZ LYS A 368 4.399 22.874 7.049 1.00 0.00 N1+ ATOM 0 H LYS A 368 0.582 20.220 4.284 1.00 0.00 H new ATOM 0 HA LYS A 368 0.984 18.904 6.041 1.00 0.00 H new ATOM 0 HB2 LYS A 368 2.584 21.302 7.015 1.00 0.00 H new ATOM 0 HB3 LYS A 368 2.718 19.674 7.650 1.00 0.00 H new ATOM 0 HG2 LYS A 368 3.744 18.850 5.714 1.00 0.00 H new ATOM 0 HG3 LYS A 368 3.106 20.130 4.701 1.00 0.00 H new ATOM 0 HD2 LYS A 368 5.236 20.485 6.846 1.00 0.00 H new ATOM 0 HD3 LYS A 368 5.543 20.380 5.124 1.00 0.00 H new ATOM 0 HE2 LYS A 368 5.421 22.656 5.210 1.00 0.00 H new ATOM 0 HE3 LYS A 368 3.693 22.378 5.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 368 3.508 23.411 7.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 368 4.371 22.157 7.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 368 5.194 23.523 7.219 1.00 0.00 H new ATOM 676 N ALA A 369 -1.163 20.470 7.090 1.00 0.00 N ATOM 677 CA ALA A 369 -2.205 20.712 8.071 1.00 0.00 C ATOM 678 C ALA A 369 -2.638 19.403 8.723 1.00 0.00 C ATOM 679 O ALA A 369 -2.868 18.409 8.040 1.00 0.00 O ATOM 680 CB ALA A 369 -3.395 21.402 7.414 1.00 0.00 C ATOM 0 H ALA A 369 -1.480 20.513 6.121 1.00 0.00 H new ATOM 0 HA ALA A 369 -1.809 21.366 8.848 1.00 0.00 H new ATOM 0 HB1 ALA A 369 -4.170 21.578 8.159 1.00 0.00 H new ATOM 0 HB2 ALA A 369 -3.075 22.354 6.991 1.00 0.00 H new ATOM 0 HB3 ALA A 369 -3.791 20.767 6.621 1.00 0.00 H new ATOM 686 N GLU A 370 -2.725 19.401 10.039 1.00 0.00 N ATOM 687 CA GLU A 370 -3.165 18.226 10.772 1.00 0.00 C ATOM 688 C GLU A 370 -4.665 18.307 10.999 1.00 0.00 C ATOM 689 O GLU A 370 -5.161 19.277 11.576 1.00 0.00 O ATOM 690 CB GLU A 370 -2.428 18.116 12.109 1.00 0.00 C ATOM 691 CG GLU A 370 -0.926 17.922 11.973 1.00 0.00 C ATOM 692 CD GLU A 370 -0.196 18.103 13.282 1.00 0.00 C ATOM 693 OE1 GLU A 370 -0.036 17.109 14.025 1.00 0.00 O ATOM 694 OE2 GLU A 370 0.222 19.232 13.583 1.00 0.00 O1- ATOM 0 H GLU A 370 -2.496 20.203 10.626 1.00 0.00 H new ATOM 0 HA GLU A 370 -2.936 17.335 10.187 1.00 0.00 H new ATOM 0 HB2 GLU A 370 -2.616 19.018 12.691 1.00 0.00 H new ATOM 0 HB3 GLU A 370 -2.842 17.280 12.673 1.00 0.00 H new ATOM 0 HG2 GLU A 370 -0.726 16.923 11.585 1.00 0.00 H new ATOM 0 HG3 GLU A 370 -0.536 18.631 11.243 1.00 0.00 H new ATOM 701 N PHE A 371 -5.385 17.302 10.547 1.00 0.00 N ATOM 702 CA PHE A 371 -6.832 17.297 10.659 1.00 0.00 C ATOM 703 C PHE A 371 -7.368 15.908 10.953 1.00 0.00 C ATOM 704 O PHE A 371 -6.677 14.904 10.773 1.00 0.00 O ATOM 705 CB PHE A 371 -7.485 17.857 9.379 1.00 0.00 C ATOM 706 CG PHE A 371 -6.974 17.254 8.099 1.00 0.00 C ATOM 707 CD1 PHE A 371 -7.568 16.128 7.558 1.00 0.00 C ATOM 708 CD2 PHE A 371 -5.900 17.824 7.435 1.00 0.00 C ATOM 709 CE1 PHE A 371 -7.098 15.580 6.382 1.00 0.00 C ATOM 710 CE2 PHE A 371 -5.427 17.279 6.260 1.00 0.00 C ATOM 711 CZ PHE A 371 -6.025 16.159 5.734 1.00 0.00 C ATOM 0 H PHE A 371 -4.993 16.475 10.097 1.00 0.00 H new ATOM 0 HA PHE A 371 -7.091 17.942 11.498 1.00 0.00 H new ATOM 0 HB2 PHE A 371 -8.562 17.697 9.436 1.00 0.00 H new ATOM 0 HB3 PHE A 371 -7.325 18.935 9.347 1.00 0.00 H new ATOM 0 HD1 PHE A 371 -8.408 15.673 8.061 1.00 0.00 H new ATOM 0 HD2 PHE A 371 -5.428 18.706 7.842 1.00 0.00 H new ATOM 0 HE1 PHE A 371 -7.569 14.700 5.969 1.00 0.00 H new ATOM 0 HE2 PHE A 371 -4.587 17.732 5.754 1.00 0.00 H new ATOM 0 HZ PHE A 371 -5.656 15.732 4.814 1.00 0.00 H new ATOM 721 N CYS A 372 -8.600 15.861 11.399 1.00 0.00 N ATOM 722 CA CYS A 372 -9.257 14.615 11.680 1.00 0.00 C ATOM 723 C CYS A 372 -9.724 14.004 10.384 1.00 0.00 C ATOM 724 O CYS A 372 -10.651 14.495 9.770 1.00 0.00 O ATOM 725 CB CYS A 372 -10.449 14.847 12.609 1.00 0.00 C ATOM 726 SG CYS A 372 -11.333 13.326 13.102 1.00 0.00 S ATOM 0 H CYS A 372 -9.172 16.687 11.576 1.00 0.00 H new ATOM 0 HA CYS A 372 -8.560 13.938 12.174 1.00 0.00 H new ATOM 0 HB2 CYS A 372 -10.100 15.356 13.507 1.00 0.00 H new ATOM 0 HB3 CYS A 372 -11.153 15.517 12.116 1.00 0.00 H new ATOM 731 N TRP A 373 -9.059 12.953 9.959 1.00 0.00 N ATOM 732 CA TRP A 373 -9.400 12.261 8.720 1.00 0.00 C ATOM 733 C TRP A 373 -10.886 11.883 8.654 1.00 0.00 C ATOM 734 O TRP A 373 -11.501 11.958 7.588 1.00 0.00 O ATOM 735 CB TRP A 373 -8.526 11.011 8.565 1.00 0.00 C ATOM 736 CG TRP A 373 -9.082 9.975 7.631 1.00 0.00 C ATOM 737 CD1 TRP A 373 -9.979 9.007 7.949 1.00 0.00 C ATOM 738 CD2 TRP A 373 -8.778 9.802 6.243 1.00 0.00 C ATOM 739 NE1 TRP A 373 -10.252 8.235 6.855 1.00 0.00 N ATOM 740 CE2 TRP A 373 -9.528 8.697 5.794 1.00 0.00 C ATOM 741 CE3 TRP A 373 -7.950 10.463 5.341 1.00 0.00 C ATOM 742 CZ2 TRP A 373 -9.473 8.244 4.482 1.00 0.00 C ATOM 743 CZ3 TRP A 373 -7.897 10.011 4.037 1.00 0.00 C ATOM 744 CH2 TRP A 373 -8.654 8.911 3.620 1.00 0.00 C ATOM 0 H TRP A 373 -8.266 12.548 10.457 1.00 0.00 H new ATOM 0 HA TRP A 373 -9.208 12.948 7.896 1.00 0.00 H new ATOM 0 HB2 TRP A 373 -7.542 11.313 8.208 1.00 0.00 H new ATOM 0 HB3 TRP A 373 -8.384 10.558 9.546 1.00 0.00 H new ATOM 0 HD1 TRP A 373 -10.415 8.867 8.927 1.00 0.00 H new ATOM 0 HE1 TRP A 373 -10.893 7.442 6.835 1.00 0.00 H new ATOM 0 HE3 TRP A 373 -7.361 11.312 5.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 373 -10.057 7.396 4.157 1.00 0.00 H new ATOM 0 HZ3 TRP A 373 -7.260 10.516 3.326 1.00 0.00 H new ATOM 0 HH2 TRP A 373 -8.588 8.583 2.593 1.00 0.00 H new ATOM 755 N VAL A 374 -11.447 11.487 9.791 1.00 0.00 N ATOM 756 CA VAL A 374 -12.838 11.030 9.859 1.00 0.00 C ATOM 757 C VAL A 374 -13.807 12.076 9.322 1.00 0.00 C ATOM 758 O VAL A 374 -14.417 11.894 8.264 1.00 0.00 O ATOM 759 CB VAL A 374 -13.241 10.667 11.306 1.00 0.00 C ATOM 760 CG1 VAL A 374 -14.694 10.213 11.374 1.00 0.00 C ATOM 761 CG2 VAL A 374 -12.325 9.591 11.854 1.00 0.00 C ATOM 0 H VAL A 374 -10.959 11.472 10.687 1.00 0.00 H new ATOM 0 HA VAL A 374 -12.899 10.140 9.232 1.00 0.00 H new ATOM 0 HB VAL A 374 -13.139 11.562 11.920 1.00 0.00 H new ATOM 0 HG11 VAL A 374 -14.950 9.964 12.404 1.00 0.00 H new ATOM 0 HG12 VAL A 374 -15.343 11.015 11.023 1.00 0.00 H new ATOM 0 HG13 VAL A 374 -14.830 9.334 10.744 1.00 0.00 H new ATOM 0 HG21 VAL A 374 -12.621 9.346 12.874 1.00 0.00 H new ATOM 0 HG22 VAL A 374 -12.397 8.700 11.231 1.00 0.00 H new ATOM 0 HG23 VAL A 374 -11.297 9.953 11.852 1.00 0.00 H new ATOM 771 N CYS A 375 -13.928 13.174 10.041 1.00 0.00 N ATOM 772 CA CYS A 375 -14.856 14.222 9.680 1.00 0.00 C ATOM 773 C CYS A 375 -14.205 15.244 8.758 1.00 0.00 C ATOM 774 O CYS A 375 -14.872 16.165 8.275 1.00 0.00 O ATOM 775 CB CYS A 375 -15.380 14.903 10.946 1.00 0.00 C ATOM 776 SG CYS A 375 -14.075 15.462 12.090 1.00 0.00 S ATOM 0 H CYS A 375 -13.389 13.363 10.886 1.00 0.00 H new ATOM 0 HA CYS A 375 -15.689 13.773 9.139 1.00 0.00 H new ATOM 0 HB2 CYS A 375 -15.987 15.761 10.658 1.00 0.00 H new ATOM 0 HB3 CYS A 375 -16.036 14.210 11.472 1.00 0.00 H new ATOM 781 N LEU A 376 -12.907 15.067 8.508 1.00 0.00 N ATOM 782 CA LEU A 376 -12.122 16.016 7.705 1.00 0.00 C ATOM 783 C LEU A 376 -12.144 17.403 8.335 1.00 0.00 C ATOM 784 O LEU A 376 -12.021 18.416 7.644 1.00 0.00 O ATOM 785 CB LEU A 376 -12.608 16.067 6.247 1.00 0.00 C ATOM 786 CG LEU A 376 -12.151 14.921 5.346 1.00 0.00 C ATOM 787 CD1 LEU A 376 -12.740 15.077 3.954 1.00 0.00 C ATOM 788 CD2 LEU A 376 -10.629 14.866 5.279 1.00 0.00 C ATOM 0 H LEU A 376 -12.371 14.270 8.851 1.00 0.00 H new ATOM 0 HA LEU A 376 -11.092 15.661 7.691 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -13.698 16.088 6.249 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -12.272 17.005 5.806 1.00 0.00 H new ATOM 0 HG LEU A 376 -12.509 13.983 5.771 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -12.406 14.253 3.323 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -13.828 15.068 4.016 1.00 0.00 H new ATOM 0 HD13 LEU A 376 -12.409 16.022 3.523 1.00 0.00 H new ATOM 0 HD21 LEU A 376 -10.323 14.043 4.633 1.00 0.00 H new ATOM 0 HD22 LEU A 376 -10.248 15.805 4.877 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -10.226 14.710 6.280 1.00 0.00 H new ATOM 800 N GLY A 377 -12.282 17.438 9.648 1.00 0.00 N ATOM 801 CA GLY A 377 -12.288 18.689 10.355 1.00 0.00 C ATOM 802 C GLY A 377 -10.981 18.918 11.071 1.00 0.00 C ATOM 803 O GLY A 377 -10.073 18.111 10.963 1.00 0.00 O ATOM 0 H GLY A 377 -12.391 16.613 10.238 1.00 0.00 H new ATOM 0 HA2 GLY A 377 -12.470 19.504 9.655 1.00 0.00 H new ATOM 0 HA3 GLY A 377 -13.106 18.699 11.075 1.00 0.00 H new ATOM 807 N PRO A 378 -10.864 20.007 11.819 1.00 0.00 N ATOM 808 CA PRO A 378 -9.643 20.331 12.553 1.00 0.00 C ATOM 809 C PRO A 378 -9.361 19.310 13.656 1.00 0.00 C ATOM 810 O PRO A 378 -10.257 18.927 14.406 1.00 0.00 O ATOM 811 CB PRO A 378 -9.939 21.708 13.155 1.00 0.00 C ATOM 812 CG PRO A 378 -11.425 21.799 13.183 1.00 0.00 C ATOM 813 CD PRO A 378 -11.916 21.001 12.017 1.00 0.00 C ATOM 0 HA PRO A 378 -8.760 20.321 11.914 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -9.518 21.801 14.156 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -9.505 22.505 12.551 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -11.821 21.405 14.119 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -11.753 22.836 13.110 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -12.877 20.532 12.227 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -12.052 21.624 11.133 1.00 0.00 H new ATOM 821 N TRP A 379 -8.122 18.879 13.749 1.00 0.00 N ATOM 822 CA TRP A 379 -7.721 17.891 14.736 1.00 0.00 C ATOM 823 C TRP A 379 -7.577 18.518 16.126 1.00 0.00 C ATOM 824 O TRP A 379 -7.611 17.814 17.136 1.00 0.00 O ATOM 825 CB TRP A 379 -6.408 17.225 14.310 1.00 0.00 C ATOM 826 CG TRP A 379 -5.918 16.191 15.276 1.00 0.00 C ATOM 827 CD1 TRP A 379 -4.886 16.321 16.158 1.00 0.00 C ATOM 828 CD2 TRP A 379 -6.451 14.876 15.471 1.00 0.00 C ATOM 829 NE1 TRP A 379 -4.735 15.162 16.880 1.00 0.00 N ATOM 830 CE2 TRP A 379 -5.686 14.261 16.476 1.00 0.00 C ATOM 831 CE3 TRP A 379 -7.501 14.160 14.892 1.00 0.00 C ATOM 832 CZ2 TRP A 379 -5.936 12.964 16.914 1.00 0.00 C ATOM 833 CZ3 TRP A 379 -7.749 12.876 15.326 1.00 0.00 C ATOM 834 CH2 TRP A 379 -6.970 12.288 16.329 1.00 0.00 C ATOM 0 H TRP A 379 -7.364 19.200 13.147 1.00 0.00 H new ATOM 0 HA TRP A 379 -8.502 17.133 14.794 1.00 0.00 H new ATOM 0 HB2 TRP A 379 -6.546 16.761 13.333 1.00 0.00 H new ATOM 0 HB3 TRP A 379 -5.643 17.992 14.193 1.00 0.00 H new ATOM 0 HD1 TRP A 379 -4.277 17.205 16.272 1.00 0.00 H new ATOM 0 HE1 TRP A 379 -4.030 14.999 17.599 1.00 0.00 H new ATOM 0 HE3 TRP A 379 -8.108 14.605 14.118 1.00 0.00 H new ATOM 0 HZ2 TRP A 379 -5.335 12.508 17.687 1.00 0.00 H new ATOM 0 HZ3 TRP A 379 -8.558 12.314 14.885 1.00 0.00 H new ATOM 0 HH2 TRP A 379 -7.190 11.280 16.647 1.00 0.00 H new ATOM 845 N GLU A 380 -7.427 19.836 16.172 1.00 0.00 N ATOM 846 CA GLU A 380 -7.260 20.548 17.442 1.00 0.00 C ATOM 847 C GLU A 380 -8.376 20.212 18.474 1.00 0.00 C ATOM 848 O GLU A 380 -8.065 19.779 19.585 1.00 0.00 O ATOM 849 CB GLU A 380 -7.152 22.062 17.228 1.00 0.00 C ATOM 850 CG GLU A 380 -5.895 22.493 16.493 1.00 0.00 C ATOM 851 CD GLU A 380 -5.817 23.992 16.314 1.00 0.00 C ATOM 852 OE1 GLU A 380 -5.473 24.692 17.286 1.00 0.00 O1- ATOM 853 OE2 GLU A 380 -6.114 24.482 15.204 1.00 0.00 O ATOM 0 H GLU A 380 -7.417 20.437 15.348 1.00 0.00 H new ATOM 0 HA GLU A 380 -6.320 20.195 17.866 1.00 0.00 H new ATOM 0 HB2 GLU A 380 -8.023 22.403 16.668 1.00 0.00 H new ATOM 0 HB3 GLU A 380 -7.182 22.559 18.198 1.00 0.00 H new ATOM 0 HG2 GLU A 380 -5.019 22.150 17.044 1.00 0.00 H new ATOM 0 HG3 GLU A 380 -5.866 22.011 15.516 1.00 0.00 H new ATOM 860 N PRO A 381 -9.692 20.395 18.131 1.00 0.00 N ATOM 861 CA PRO A 381 -10.799 20.071 19.057 1.00 0.00 C ATOM 862 C PRO A 381 -10.844 18.579 19.409 1.00 0.00 C ATOM 863 O PRO A 381 -11.504 18.173 20.359 1.00 0.00 O ATOM 864 CB PRO A 381 -12.065 20.473 18.281 1.00 0.00 C ATOM 865 CG PRO A 381 -11.644 20.523 16.856 1.00 0.00 C ATOM 866 CD PRO A 381 -10.200 20.939 16.857 1.00 0.00 C ATOM 0 HA PRO A 381 -10.689 20.591 20.009 1.00 0.00 H new ATOM 0 HB2 PRO A 381 -12.866 19.749 18.431 1.00 0.00 H new ATOM 0 HB3 PRO A 381 -12.442 21.439 18.615 1.00 0.00 H new ATOM 0 HG2 PRO A 381 -11.768 19.551 16.380 1.00 0.00 H new ATOM 0 HG3 PRO A 381 -12.253 21.233 16.295 1.00 0.00 H new ATOM 0 HD2 PRO A 381 -9.663 20.529 16.002 1.00 0.00 H new ATOM 0 HD3 PRO A 381 -10.093 22.023 16.811 1.00 0.00 H new ATOM 874 N HIS A 382 -10.119 17.774 18.639 1.00 0.00 N ATOM 875 CA HIS A 382 -10.053 16.335 18.867 1.00 0.00 C ATOM 876 C HIS A 382 -8.926 15.999 19.841 1.00 0.00 C ATOM 877 O HIS A 382 -8.561 14.831 20.016 1.00 0.00 O ATOM 878 CB HIS A 382 -9.848 15.585 17.543 1.00 0.00 C ATOM 879 CG HIS A 382 -11.005 15.695 16.593 1.00 0.00 C ATOM 880 ND1 HIS A 382 -11.223 16.769 15.758 1.00 0.00 N ATOM 881 CD2 HIS A 382 -12.019 14.827 16.351 1.00 0.00 C ATOM 882 CE1 HIS A 382 -12.335 16.533 15.054 1.00 0.00 C ATOM 883 NE2 HIS A 382 -12.860 15.364 15.373 1.00 0.00 N ATOM 0 H HIS A 382 -9.565 18.097 17.846 1.00 0.00 H new ATOM 0 HA HIS A 382 -11.000 16.016 19.303 1.00 0.00 H new ATOM 0 HB2 HIS A 382 -8.952 15.969 17.055 1.00 0.00 H new ATOM 0 HB3 HIS A 382 -9.667 14.532 17.758 1.00 0.00 H new ATOM 0 HD1 HIS A 382 -10.637 17.601 15.689 1.00 0.00 H new ATOM 0 HD2 HIS A 382 -12.155 13.872 16.837 1.00 0.00 H new ATOM 0 HE1 HIS A 382 -12.749 17.209 14.321 1.00 0.00 H new ATOM 0 HE2 HIS A 382 -13.704 14.941 14.986 1.00 0.00 H new ATOM 891 N GLY A 383 -8.362 17.026 20.454 1.00 0.00 N ATOM 892 CA GLY A 383 -7.320 16.830 21.433 1.00 0.00 C ATOM 893 C GLY A 383 -7.878 16.809 22.833 1.00 0.00 C ATOM 894 O GLY A 383 -8.807 16.051 23.127 1.00 0.00 O ATOM 0 H GLY A 383 -8.612 18.001 20.288 1.00 0.00 H new ATOM 0 HA2 GLY A 383 -6.802 15.892 21.232 1.00 0.00 H new ATOM 0 HA3 GLY A 383 -6.582 17.627 21.346 1.00 0.00 H new ATOM 898 N SER A 384 -7.333 17.639 23.698 1.00 0.00 N ATOM 899 CA SER A 384 -7.810 17.718 25.055 1.00 0.00 C ATOM 900 C SER A 384 -8.872 18.806 25.167 1.00 0.00 C ATOM 901 O SER A 384 -8.586 19.942 25.566 1.00 0.00 O ATOM 902 CB SER A 384 -6.652 17.979 26.026 1.00 0.00 C ATOM 903 OG SER A 384 -7.057 17.783 27.371 1.00 0.00 O ATOM 0 H SER A 384 -6.559 18.267 23.481 1.00 0.00 H new ATOM 0 HA SER A 384 -8.259 16.763 25.326 1.00 0.00 H new ATOM 0 HB2 SER A 384 -5.821 17.313 25.793 1.00 0.00 H new ATOM 0 HB3 SER A 384 -6.289 18.999 25.898 1.00 0.00 H new ATOM 0 HG SER A 384 -6.300 17.954 27.969 1.00 0.00 H new ATOM 909 N ALA A 385 -10.084 18.460 24.773 1.00 0.00 N ATOM 910 CA ALA A 385 -11.205 19.377 24.804 1.00 0.00 C ATOM 911 C ALA A 385 -12.501 18.601 24.701 1.00 0.00 C ATOM 912 O ALA A 385 -12.511 17.376 24.817 1.00 0.00 O ATOM 913 CB ALA A 385 -11.110 20.388 23.655 1.00 0.00 C ATOM 0 H ALA A 385 -10.318 17.531 24.422 1.00 0.00 H new ATOM 0 HA ALA A 385 -11.182 19.924 25.747 1.00 0.00 H new ATOM 0 HB1 ALA A 385 -11.961 21.067 23.697 1.00 0.00 H new ATOM 0 HB2 ALA A 385 -10.186 20.958 23.748 1.00 0.00 H new ATOM 0 HB3 ALA A 385 -11.115 19.858 22.703 1.00 0.00 H new ATOM 919 N TRP A 386 -13.581 19.319 24.493 1.00 0.00 N ATOM 920 CA TRP A 386 -14.895 18.726 24.309 1.00 0.00 C ATOM 921 C TRP A 386 -15.013 18.214 22.861 1.00 0.00 C ATOM 922 O TRP A 386 -13.999 17.956 22.209 1.00 0.00 O ATOM 923 CB TRP A 386 -15.969 19.803 24.568 1.00 0.00 C ATOM 924 CG TRP A 386 -16.054 20.819 23.461 1.00 0.00 C ATOM 925 CD1 TRP A 386 -15.049 21.606 22.990 1.00 0.00 C ATOM 926 CD2 TRP A 386 -17.205 21.130 22.672 1.00 0.00 C ATOM 927 NE1 TRP A 386 -15.499 22.371 21.958 1.00 0.00 N ATOM 928 CE2 TRP A 386 -16.815 22.107 21.747 1.00 0.00 C ATOM 929 CE3 TRP A 386 -18.523 20.676 22.659 1.00 0.00 C ATOM 930 CZ2 TRP A 386 -17.682 22.640 20.817 1.00 0.00 C ATOM 931 CZ3 TRP A 386 -19.395 21.209 21.730 1.00 0.00 C ATOM 932 CH2 TRP A 386 -18.971 22.181 20.819 1.00 0.00 C ATOM 0 H TRP A 386 -13.577 20.338 24.446 1.00 0.00 H new ATOM 0 HA TRP A 386 -15.036 17.896 25.001 1.00 0.00 H new ATOM 0 HB2 TRP A 386 -16.939 19.321 24.688 1.00 0.00 H new ATOM 0 HB3 TRP A 386 -15.748 20.312 25.506 1.00 0.00 H new ATOM 0 HD1 TRP A 386 -14.041 21.621 23.378 1.00 0.00 H new ATOM 0 HE1 TRP A 386 -14.937 23.037 21.427 1.00 0.00 H new ATOM 0 HE3 TRP A 386 -18.855 19.924 23.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 386 -17.356 23.392 20.113 1.00 0.00 H new ATOM 0 HZ3 TRP A 386 -20.420 20.870 21.707 1.00 0.00 H new ATOM 0 HH2 TRP A 386 -19.675 22.578 20.102 1.00 0.00 H new ATOM 943 N TYR A 387 -16.249 18.070 22.379 1.00 0.00 N ATOM 944 CA TYR A 387 -16.530 17.708 20.994 1.00 0.00 C ATOM 945 C TYR A 387 -16.239 16.236 20.712 1.00 0.00 C ATOM 946 O TYR A 387 -15.085 15.819 20.625 1.00 0.00 O ATOM 947 CB TYR A 387 -15.752 18.613 20.014 1.00 0.00 C ATOM 948 CG TYR A 387 -16.099 18.374 18.558 1.00 0.00 C ATOM 949 CD1 TYR A 387 -17.302 18.820 18.029 1.00 0.00 C ATOM 950 CD2 TYR A 387 -15.223 17.697 17.714 1.00 0.00 C ATOM 951 CE1 TYR A 387 -17.626 18.599 16.704 1.00 0.00 C ATOM 952 CE2 TYR A 387 -15.540 17.474 16.389 1.00 0.00 C ATOM 953 CZ TYR A 387 -16.742 17.924 15.889 1.00 0.00 C ATOM 954 OH TYR A 387 -17.061 17.700 14.568 1.00 0.00 O ATOM 0 H TYR A 387 -17.087 18.203 22.945 1.00 0.00 H new ATOM 0 HA TYR A 387 -17.597 17.864 20.838 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -15.952 19.656 20.260 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -14.683 18.452 20.155 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -17.997 19.349 18.664 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -14.280 17.341 18.102 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -18.567 18.953 16.309 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -14.848 16.949 15.747 1.00 0.00 H new ATOM 0 HH TYR A 387 -16.330 17.213 14.133 1.00 0.00 H new ATOM 964 N ASN A 388 -17.289 15.452 20.581 1.00 0.00 N ATOM 965 CA ASN A 388 -17.142 14.038 20.273 1.00 0.00 C ATOM 966 C ASN A 388 -17.202 13.824 18.763 1.00 0.00 C ATOM 967 O ASN A 388 -18.059 14.390 18.078 1.00 0.00 O ATOM 968 CB ASN A 388 -18.223 13.206 20.989 1.00 0.00 C ATOM 969 CG ASN A 388 -19.633 13.478 20.484 1.00 0.00 C ATOM 970 OD1 ASN A 388 -20.289 14.430 20.914 1.00 0.00 O ATOM 971 ND2 ASN A 388 -20.117 12.633 19.597 1.00 0.00 N ATOM 0 H ASN A 388 -18.254 15.766 20.682 1.00 0.00 H new ATOM 0 HA ASN A 388 -16.170 13.701 20.634 1.00 0.00 H new ATOM 0 HB2 ASN A 388 -17.998 12.147 20.862 1.00 0.00 H new ATOM 0 HB3 ASN A 388 -18.182 13.415 22.058 1.00 0.00 H new ATOM 0 HD21 ASN A 388 -21.065 12.754 19.242 1.00 0.00 H new ATOM 0 HD22 ASN A 388 -19.543 11.858 19.265 1.00 0.00 H new ATOM 978 N CYS A 389 -16.285 13.024 18.242 1.00 0.00 N ATOM 979 CA CYS A 389 -16.235 12.770 16.814 1.00 0.00 C ATOM 980 C CYS A 389 -16.967 11.487 16.467 1.00 0.00 C ATOM 981 O CYS A 389 -16.924 10.502 17.212 1.00 0.00 O ATOM 982 CB CYS A 389 -14.782 12.711 16.322 1.00 0.00 C ATOM 983 SG CYS A 389 -14.595 12.566 14.515 1.00 0.00 S ATOM 0 H CYS A 389 -15.569 12.542 18.785 1.00 0.00 H new ATOM 0 HA CYS A 389 -16.735 13.596 16.308 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -14.263 13.609 16.656 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -14.287 11.862 16.794 1.00 0.00 H new ATOM 988 N ASN A 390 -17.607 11.498 15.324 1.00 0.00 N ATOM 989 CA ASN A 390 -18.369 10.362 14.828 1.00 0.00 C ATOM 990 C ASN A 390 -17.454 9.335 14.165 1.00 0.00 C ATOM 991 O ASN A 390 -17.765 8.794 13.105 1.00 0.00 O ATOM 992 CB ASN A 390 -19.465 10.836 13.842 1.00 0.00 C ATOM 993 CG ASN A 390 -18.960 11.804 12.764 1.00 0.00 C ATOM 994 OD1 ASN A 390 -18.073 12.632 13.002 1.00 0.00 O ATOM 995 ND2 ASN A 390 -19.520 11.707 11.575 1.00 0.00 N ATOM 0 H ASN A 390 -17.618 12.303 14.698 1.00 0.00 H new ATOM 0 HA ASN A 390 -18.852 9.880 15.678 1.00 0.00 H new ATOM 0 HB2 ASN A 390 -19.903 9.964 13.356 1.00 0.00 H new ATOM 0 HB3 ASN A 390 -20.262 11.321 14.406 1.00 0.00 H new ATOM 0 HD21 ASN A 390 -19.224 12.325 10.820 1.00 0.00 H new ATOM 0 HD22 ASN A 390 -20.249 11.013 11.410 1.00 0.00 H new ATOM 1002 N ARG A 391 -16.337 9.047 14.818 1.00 0.00 N ATOM 1003 CA ARG A 391 -15.359 8.096 14.298 1.00 0.00 C ATOM 1004 C ARG A 391 -15.793 6.653 14.550 1.00 0.00 C ATOM 1005 O ARG A 391 -15.220 5.716 13.996 1.00 0.00 O ATOM 1006 CB ARG A 391 -13.968 8.367 14.908 1.00 0.00 C ATOM 1007 CG ARG A 391 -13.869 8.145 16.415 1.00 0.00 C ATOM 1008 CD ARG A 391 -13.488 6.706 16.757 1.00 0.00 C ATOM 1009 NE ARG A 391 -12.071 6.433 16.505 1.00 0.00 N ATOM 1010 CZ ARG A 391 -11.603 5.523 15.642 1.00 0.00 C ATOM 1011 NH1 ARG A 391 -12.436 4.843 14.854 1.00 0.00 N1+ ATOM 1012 NH2 ARG A 391 -10.296 5.313 15.557 1.00 0.00 N ATOM 0 H ARG A 391 -16.083 9.460 15.715 1.00 0.00 H new ATOM 0 HA ARG A 391 -15.297 8.234 13.219 1.00 0.00 H new ATOM 0 HB2 ARG A 391 -13.240 7.725 14.413 1.00 0.00 H new ATOM 0 HB3 ARG A 391 -13.686 9.397 14.689 1.00 0.00 H new ATOM 0 HG2 ARG A 391 -13.128 8.826 16.834 1.00 0.00 H new ATOM 0 HG3 ARG A 391 -14.824 8.388 16.881 1.00 0.00 H new ATOM 0 HD2 ARG A 391 -13.712 6.512 17.806 1.00 0.00 H new ATOM 0 HD3 ARG A 391 -14.098 6.021 16.169 1.00 0.00 H new ATOM 0 HE ARG A 391 -11.387 6.979 17.028 1.00 0.00 H new ATOM 0 HH11 ARG A 391 -13.440 5.014 14.905 1.00 0.00 H new ATOM 0 HH12 ARG A 391 -12.069 4.152 14.200 1.00 0.00 H new ATOM 0 HH21 ARG A 391 -9.655 5.843 16.147 1.00 0.00 H new ATOM 0 HH22 ARG A 391 -9.932 4.621 14.902 1.00 0.00 H new ATOM 1026 N TYR A 392 -16.788 6.478 15.401 1.00 0.00 N ATOM 1027 CA TYR A 392 -17.295 5.148 15.710 1.00 0.00 C ATOM 1028 C TYR A 392 -18.821 5.139 15.771 1.00 0.00 C ATOM 1029 O TYR A 392 -19.469 4.222 15.269 1.00 0.00 O ATOM 1030 CB TYR A 392 -16.695 4.627 17.031 1.00 0.00 C ATOM 1031 CG TYR A 392 -17.147 5.365 18.279 1.00 0.00 C ATOM 1032 CD1 TYR A 392 -16.614 6.603 18.618 1.00 0.00 C ATOM 1033 CD2 TYR A 392 -18.112 4.818 19.116 1.00 0.00 C ATOM 1034 CE1 TYR A 392 -17.028 7.271 19.753 1.00 0.00 C ATOM 1035 CE2 TYR A 392 -18.529 5.478 20.251 1.00 0.00 C ATOM 1036 CZ TYR A 392 -17.988 6.703 20.567 1.00 0.00 C ATOM 1037 OH TYR A 392 -18.400 7.360 21.707 1.00 0.00 O ATOM 0 H TYR A 392 -17.262 7.237 15.891 1.00 0.00 H new ATOM 0 HA TYR A 392 -16.987 4.479 14.906 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -16.952 3.573 17.138 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -15.608 4.685 16.967 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -15.863 7.050 17.983 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -18.543 3.858 18.872 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -16.604 8.232 20.003 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -19.278 5.035 20.891 1.00 0.00 H new ATOM 0 HH TYR A 392 -19.081 6.824 22.165 1.00 0.00 H new ATOM 1047 N ASN A 393 -19.386 6.162 16.379 1.00 0.00 N ATOM 1048 CA ASN A 393 -20.824 6.263 16.527 1.00 0.00 C ATOM 1049 C ASN A 393 -21.370 7.245 15.507 1.00 0.00 C ATOM 1050 O ASN A 393 -21.010 8.424 15.525 1.00 0.00 O ATOM 1051 CB ASN A 393 -21.169 6.719 17.951 1.00 0.00 C ATOM 1052 CG ASN A 393 -22.655 6.657 18.262 1.00 0.00 C ATOM 1053 OD1 ASN A 393 -23.386 7.622 18.056 1.00 0.00 O ATOM 1054 ND2 ASN A 393 -23.105 5.523 18.764 1.00 0.00 N ATOM 0 H ASN A 393 -18.866 6.942 16.782 1.00 0.00 H new ATOM 0 HA ASN A 393 -21.279 5.287 16.356 1.00 0.00 H new ATOM 0 HB2 ASN A 393 -20.630 6.096 18.665 1.00 0.00 H new ATOM 0 HB3 ASN A 393 -20.818 7.741 18.092 1.00 0.00 H new ATOM 0 HD21 ASN A 393 -24.093 5.425 18.996 1.00 0.00 H new ATOM 0 HD22 ASN A 393 -22.465 4.745 18.920 1.00 0.00 H new ATOM 1061 N GLU A 394 -22.220 6.759 14.608 1.00 0.00 N ATOM 1062 CA GLU A 394 -22.781 7.602 13.559 1.00 0.00 C ATOM 1063 C GLU A 394 -23.741 8.641 14.131 1.00 0.00 C ATOM 1064 O GLU A 394 -24.194 8.524 15.268 1.00 0.00 O ATOM 1065 CB GLU A 394 -23.443 6.758 12.458 1.00 0.00 C ATOM 1066 CG GLU A 394 -24.444 5.729 12.957 1.00 0.00 C ATOM 1067 CD GLU A 394 -25.015 4.895 11.831 1.00 0.00 C ATOM 1068 OE1 GLU A 394 -24.256 4.120 11.216 1.00 0.00 O ATOM 1069 OE2 GLU A 394 -26.230 5.004 11.555 1.00 0.00 O1- ATOM 0 H GLU A 394 -22.534 5.789 14.585 1.00 0.00 H new ATOM 0 HA GLU A 394 -21.957 8.147 13.098 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -23.948 7.427 11.761 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -22.663 6.243 11.897 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -23.959 5.075 13.682 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -25.255 6.237 13.478 1.00 0.00 H new ATOM 1076 N ASP A 395 -24.062 9.642 13.326 1.00 0.00 N ATOM 1077 CA ASP A 395 -24.876 10.776 13.777 1.00 0.00 C ATOM 1078 C ASP A 395 -26.365 10.443 13.791 1.00 0.00 C ATOM 1079 O ASP A 395 -27.180 11.209 14.304 1.00 0.00 O ATOM 1080 CB ASP A 395 -24.606 11.996 12.888 1.00 0.00 C ATOM 1081 CG ASP A 395 -25.268 13.262 13.399 1.00 0.00 C ATOM 1082 OD1 ASP A 395 -24.888 13.739 14.489 1.00 0.00 O ATOM 1083 OD2 ASP A 395 -26.155 13.799 12.698 1.00 0.00 O1- ATOM 0 H ASP A 395 -23.772 9.698 12.350 1.00 0.00 H new ATOM 0 HA ASP A 395 -24.590 11.005 14.804 1.00 0.00 H new ATOM 0 HB2 ASP A 395 -23.530 12.158 12.820 1.00 0.00 H new ATOM 0 HB3 ASP A 395 -24.962 11.789 11.879 1.00 0.00 H new ATOM 1088 N ASP A 396 -26.713 9.302 13.230 1.00 0.00 N ATOM 1089 CA ASP A 396 -28.098 8.855 13.200 1.00 0.00 C ATOM 1090 C ASP A 396 -28.577 8.491 14.599 1.00 0.00 C ATOM 1091 O ASP A 396 -28.170 7.429 15.115 1.00 0.00 O ATOM 1092 CB ASP A 396 -28.259 7.664 12.258 1.00 0.00 C ATOM 1093 CG ASP A 396 -29.658 7.083 12.281 1.00 0.00 C ATOM 1094 OD1 ASP A 396 -30.603 7.753 11.798 1.00 0.00 O1- ATOM 1095 OD2 ASP A 396 -29.828 5.952 12.780 1.00 0.00 O ATOM 1096 OXT ASP A 396 -29.348 9.272 15.188 1.00 0.00 O ATOM 0 H ASP A 396 -26.054 8.662 12.786 1.00 0.00 H new ATOM 0 HA ASP A 396 -28.711 9.676 12.828 1.00 0.00 H new ATOM 0 HB2 ASP A 396 -28.016 7.975 11.242 1.00 0.00 H new ATOM 0 HB3 ASP A 396 -27.544 6.889 12.534 1.00 0.00 H new TER 1101 ASP A 396 HETATM 1102 ZN ZN A 401 -3.271 20.313 2.873 1.00 0.00 ZN HETATM 1103 ZN ZN A 402 -13.347 14.143 13.654 1.00 0.00 ZN