USER MOD reduce.3.24.130724 H: found=0, std=0, add=513, rem=0, adj=17 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 NoAdj-H: A 382 HIS HE2 : A 382 HIS NE2 : A 402 ZNZN :(H bumps) USER MOD Set 1.1: A 388 ASN : amide:sc= 0.998 K(o=2.2,f=1) USER MOD Set 1.2: A 392 TYR OH : rot 11:sc= 1.23 USER MOD Set 2.1: A 364 ASN : amide:sc= 2.21 K(o=3.2,f=-2.9!) USER MOD Set 2.2: A 366 ASN : amide:sc= 1.03 K(o=3.2,f=1.3) USER MOD Set 3.1: A 353 LYS NZ :NH3+ -154:sc= 0.86 (180deg=-1.02) USER MOD Set 3.2: A 358 ASN : amide:sc= -1.18! C(o=-0.32!,f=-13!) USER MOD Single : A 324 SER OG : rot 180:sc= 0 USER MOD Single : A 325 LYS NZ :NH3+ -165:sc= -0.081 (180deg=-0.383) USER MOD Single : A 326 LYS NZ :NH3+ -166:sc= -0.0322 (180deg=-0.272) USER MOD Single : A 327 CYS SG : rot 180:sc= 0 USER MOD Single : A 331 SER OG : rot 180:sc= 0 USER MOD Single : A 333 THR OG1 : rot 26:sc= 0.364 USER MOD Single : A 334 SER OG : rot 180:sc= 0 USER MOD Single : A 335 ASN : amide:sc=-0.00893 X(o=-0.0089,f=-0.077) USER MOD Single : A 340 ASN : amide:sc= 0.66 K(o=0.66,f=0) USER MOD Single : A 341 THR OG1 : rot -167:sc= -0.0917 USER MOD Single : A 342 LYS NZ :NH3+ -159:sc= 1.19 (180deg=1.05) USER MOD Single : A 346 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 348 HIS : no HD1:sc= -0.122 X(o=-0.12,f=0) USER MOD Single : A 350 THR OG1 : rot 180:sc=0.000849 USER MOD Single : A 357 SER OG : rot 180:sc= 0.00154 USER MOD Single : A 359 HIS : no HD1:sc= 0.169 K(o=0.17,f=-3.1!) USER MOD Single : A 360 MET CE :methyl -122:sc= -2.59! (180deg=-6.99!) USER MOD Single : A 365 GLN :FLIP amide:sc= -0.475 F(o=-4.3!,f=-0.48) USER MOD Single : A 368 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 390 ASN : amide:sc=-0.00246 K(o=-0.0025,f=-1.4) USER MOD Single : A 393 ASN : amide:sc= -0.0271 X(o=-0.027,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 323 -1.612 0.163 -0.370 1.00 0.00 N ATOM 2 CA GLY A 323 -1.939 -0.083 -1.787 1.00 0.00 C ATOM 3 C GLY A 323 -1.439 1.022 -2.691 1.00 0.00 C ATOM 4 O GLY A 323 -2.196 1.563 -3.497 1.00 0.00 O ATOM 0 HA2 GLY A 323 -1.501 -1.031 -2.099 1.00 0.00 H new ATOM 0 HA3 GLY A 323 -3.019 -0.179 -1.897 1.00 0.00 H new ATOM 10 N SER A 324 -0.167 1.361 -2.566 1.00 0.00 N ATOM 11 CA SER A 324 0.416 2.418 -3.364 1.00 0.00 C ATOM 12 C SER A 324 1.161 1.851 -4.564 1.00 0.00 C ATOM 13 O SER A 324 2.377 1.667 -4.521 1.00 0.00 O ATOM 14 CB SER A 324 1.359 3.273 -2.514 1.00 0.00 C ATOM 15 OG SER A 324 0.698 3.764 -1.362 1.00 0.00 O ATOM 0 H SER A 324 0.481 0.916 -1.916 1.00 0.00 H new ATOM 0 HA SER A 324 -0.395 3.046 -3.732 1.00 0.00 H new ATOM 0 HB2 SER A 324 2.224 2.681 -2.217 1.00 0.00 H new ATOM 0 HB3 SER A 324 1.733 4.108 -3.107 1.00 0.00 H new ATOM 0 HG SER A 324 1.321 4.306 -0.834 1.00 0.00 H new ATOM 21 N LYS A 325 0.428 1.535 -5.615 1.00 0.00 N ATOM 22 CA LYS A 325 1.040 1.032 -6.834 1.00 0.00 C ATOM 23 C LYS A 325 1.086 2.140 -7.880 1.00 0.00 C ATOM 24 O LYS A 325 1.759 2.030 -8.905 1.00 0.00 O ATOM 25 CB LYS A 325 0.275 -0.191 -7.361 1.00 0.00 C ATOM 26 CG LYS A 325 0.923 -0.853 -8.572 1.00 0.00 C ATOM 27 CD LYS A 325 0.224 -2.150 -8.956 1.00 0.00 C ATOM 28 CE LYS A 325 0.393 -3.217 -7.881 1.00 0.00 C ATOM 29 NZ LYS A 325 1.825 -3.500 -7.589 1.00 0.00 N1+ ATOM 0 H LYS A 325 -0.588 1.617 -5.651 1.00 0.00 H new ATOM 0 HA LYS A 325 2.060 0.715 -6.615 1.00 0.00 H new ATOM 0 HB2 LYS A 325 0.189 -0.926 -6.561 1.00 0.00 H new ATOM 0 HB3 LYS A 325 -0.738 0.113 -7.625 1.00 0.00 H new ATOM 0 HG2 LYS A 325 0.900 -0.165 -9.417 1.00 0.00 H new ATOM 0 HG3 LYS A 325 1.972 -1.057 -8.356 1.00 0.00 H new ATOM 0 HD2 LYS A 325 -0.837 -1.959 -9.116 1.00 0.00 H new ATOM 0 HD3 LYS A 325 0.628 -2.516 -9.900 1.00 0.00 H new ATOM 0 HE2 LYS A 325 -0.105 -2.892 -6.967 1.00 0.00 H new ATOM 0 HE3 LYS A 325 -0.099 -4.135 -8.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 325 1.901 -4.389 -7.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 325 2.351 -3.587 -8.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 325 2.225 -2.722 -7.026 1.00 0.00 H new ATOM 43 N LYS A 326 0.374 3.215 -7.601 1.00 0.00 N ATOM 44 CA LYS A 326 0.332 4.358 -8.492 1.00 0.00 C ATOM 45 C LYS A 326 1.598 5.186 -8.352 1.00 0.00 C ATOM 46 O LYS A 326 2.219 5.215 -7.286 1.00 0.00 O ATOM 47 CB LYS A 326 -0.896 5.221 -8.196 1.00 0.00 C ATOM 48 CG LYS A 326 -2.217 4.500 -8.392 1.00 0.00 C ATOM 49 CD LYS A 326 -2.431 4.105 -9.843 1.00 0.00 C ATOM 50 CE LYS A 326 -3.741 3.358 -10.026 1.00 0.00 C ATOM 51 NZ LYS A 326 -3.775 2.086 -9.253 1.00 0.00 N1+ ATOM 0 H LYS A 326 -0.188 3.320 -6.756 1.00 0.00 H new ATOM 0 HA LYS A 326 0.264 3.993 -9.517 1.00 0.00 H new ATOM 0 HB2 LYS A 326 -0.837 5.578 -7.168 1.00 0.00 H new ATOM 0 HB3 LYS A 326 -0.874 6.100 -8.840 1.00 0.00 H new ATOM 0 HG2 LYS A 326 -2.242 3.609 -7.765 1.00 0.00 H new ATOM 0 HG3 LYS A 326 -3.034 5.143 -8.065 1.00 0.00 H new ATOM 0 HD2 LYS A 326 -2.429 4.997 -10.469 1.00 0.00 H new ATOM 0 HD3 LYS A 326 -1.604 3.479 -10.177 1.00 0.00 H new ATOM 0 HE2 LYS A 326 -4.568 3.995 -9.711 1.00 0.00 H new ATOM 0 HE3 LYS A 326 -3.890 3.142 -11.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 326 -4.568 1.500 -9.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 326 -2.882 1.571 -9.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 326 -3.898 2.297 -8.242 1.00 0.00 H new ATOM 65 N CYS A 327 1.973 5.848 -9.423 1.00 0.00 N ATOM 66 CA CYS A 327 3.155 6.683 -9.432 1.00 0.00 C ATOM 67 C CYS A 327 2.833 8.066 -8.871 1.00 0.00 C ATOM 68 O CYS A 327 1.684 8.348 -8.517 1.00 0.00 O ATOM 69 CB CYS A 327 3.698 6.804 -10.854 1.00 0.00 C ATOM 70 SG CYS A 327 4.029 5.218 -11.657 1.00 0.00 S ATOM 0 H CYS A 327 1.470 5.824 -10.310 1.00 0.00 H new ATOM 0 HA CYS A 327 3.915 6.222 -8.801 1.00 0.00 H new ATOM 0 HB2 CYS A 327 2.983 7.362 -11.458 1.00 0.00 H new ATOM 0 HB3 CYS A 327 4.619 7.386 -10.831 1.00 0.00 H new ATOM 0 HG CYS A 327 4.483 5.426 -12.857 1.00 0.00 H new ATOM 76 N ASP A 328 3.846 8.918 -8.793 1.00 0.00 N ATOM 77 CA ASP A 328 3.682 10.276 -8.284 1.00 0.00 C ATOM 78 C ASP A 328 2.763 11.075 -9.194 1.00 0.00 C ATOM 79 O ASP A 328 1.917 11.843 -8.730 1.00 0.00 O ATOM 80 CB ASP A 328 5.040 10.957 -8.167 1.00 0.00 C ATOM 81 CG ASP A 328 4.954 12.347 -7.593 1.00 0.00 C ATOM 82 OD1 ASP A 328 4.738 12.479 -6.369 1.00 0.00 O ATOM 83 OD2 ASP A 328 5.139 13.320 -8.351 1.00 0.00 O1- ATOM 0 H ASP A 328 4.799 8.691 -9.078 1.00 0.00 H new ATOM 0 HA ASP A 328 3.228 10.228 -7.294 1.00 0.00 H new ATOM 0 HB2 ASP A 328 5.692 10.350 -7.538 1.00 0.00 H new ATOM 0 HB3 ASP A 328 5.502 11.005 -9.153 1.00 0.00 H new ATOM 88 N ASP A 329 2.941 10.894 -10.489 1.00 0.00 N ATOM 89 CA ASP A 329 2.078 11.519 -11.474 1.00 0.00 C ATOM 90 C ASP A 329 0.981 10.540 -11.843 1.00 0.00 C ATOM 91 O ASP A 329 1.211 9.320 -11.882 1.00 0.00 O ATOM 92 CB ASP A 329 2.871 11.931 -12.721 1.00 0.00 C ATOM 93 CG ASP A 329 3.404 10.749 -13.509 1.00 0.00 C ATOM 94 OD1 ASP A 329 4.408 10.140 -13.073 1.00 0.00 O ATOM 95 OD2 ASP A 329 2.830 10.431 -14.576 1.00 0.00 O1- ATOM 0 H ASP A 329 3.681 10.315 -10.886 1.00 0.00 H new ATOM 0 HA ASP A 329 1.643 12.425 -11.051 1.00 0.00 H new ATOM 0 HB2 ASP A 329 2.232 12.532 -13.368 1.00 0.00 H new ATOM 0 HB3 ASP A 329 3.705 12.564 -12.420 1.00 0.00 H new ATOM 100 N ASP A 330 -0.205 11.040 -12.109 1.00 0.00 N ATOM 101 CA ASP A 330 -1.314 10.152 -12.392 1.00 0.00 C ATOM 102 C ASP A 330 -2.167 10.656 -13.536 1.00 0.00 C ATOM 103 O ASP A 330 -2.287 11.860 -13.756 1.00 0.00 O ATOM 104 CB ASP A 330 -2.169 9.968 -11.153 1.00 0.00 C ATOM 105 CG ASP A 330 -3.069 8.771 -11.256 1.00 0.00 C ATOM 106 OD1 ASP A 330 -2.581 7.642 -11.058 1.00 0.00 O1- ATOM 107 OD2 ASP A 330 -4.265 8.944 -11.537 1.00 0.00 O ATOM 0 H ASP A 330 -0.426 12.035 -12.136 1.00 0.00 H new ATOM 0 HA ASP A 330 -0.893 9.192 -12.690 1.00 0.00 H new ATOM 0 HB2 ASP A 330 -1.524 9.861 -10.281 1.00 0.00 H new ATOM 0 HB3 ASP A 330 -2.773 10.862 -10.995 1.00 0.00 H new ATOM 112 N SER A 331 -2.771 9.727 -14.241 1.00 0.00 N ATOM 113 CA SER A 331 -3.605 10.023 -15.387 1.00 0.00 C ATOM 114 C SER A 331 -5.073 10.191 -14.973 1.00 0.00 C ATOM 115 O SER A 331 -5.982 9.860 -15.738 1.00 0.00 O ATOM 116 CB SER A 331 -3.474 8.887 -16.388 1.00 0.00 C ATOM 117 OG SER A 331 -2.109 8.664 -16.720 1.00 0.00 O ATOM 0 H SER A 331 -2.697 8.731 -14.033 1.00 0.00 H new ATOM 0 HA SER A 331 -3.277 10.961 -15.835 1.00 0.00 H new ATOM 0 HB2 SER A 331 -3.905 7.977 -15.971 1.00 0.00 H new ATOM 0 HB3 SER A 331 -4.039 9.123 -17.290 1.00 0.00 H new ATOM 0 HG SER A 331 -2.045 7.928 -17.364 1.00 0.00 H new ATOM 123 N GLU A 332 -5.287 10.713 -13.763 1.00 0.00 N ATOM 124 CA GLU A 332 -6.626 10.948 -13.220 1.00 0.00 C ATOM 125 C GLU A 332 -7.400 9.652 -13.011 1.00 0.00 C ATOM 126 O GLU A 332 -8.629 9.627 -13.111 1.00 0.00 O ATOM 127 CB GLU A 332 -7.416 11.898 -14.109 1.00 0.00 C ATOM 128 CG GLU A 332 -6.948 13.336 -14.044 1.00 0.00 C ATOM 129 CD GLU A 332 -7.847 14.262 -14.818 1.00 0.00 C ATOM 130 OE1 GLU A 332 -8.894 14.671 -14.275 1.00 0.00 O ATOM 131 OE2 GLU A 332 -7.510 14.591 -15.972 1.00 0.00 O1- ATOM 0 H GLU A 332 -4.534 10.985 -13.131 1.00 0.00 H new ATOM 0 HA GLU A 332 -6.492 11.411 -12.242 1.00 0.00 H new ATOM 0 HB2 GLU A 332 -7.351 11.552 -15.141 1.00 0.00 H new ATOM 0 HB3 GLU A 332 -8.467 11.856 -13.824 1.00 0.00 H new ATOM 0 HG2 GLU A 332 -6.909 13.657 -13.003 1.00 0.00 H new ATOM 0 HG3 GLU A 332 -5.934 13.404 -14.437 1.00 0.00 H new ATOM 138 N THR A 333 -6.693 8.588 -12.699 1.00 0.00 N ATOM 139 CA THR A 333 -7.321 7.324 -12.423 1.00 0.00 C ATOM 140 C THR A 333 -7.681 7.238 -10.945 1.00 0.00 C ATOM 141 O THR A 333 -7.108 6.459 -10.190 1.00 0.00 O ATOM 142 CB THR A 333 -6.412 6.152 -12.821 1.00 0.00 C ATOM 143 OG1 THR A 333 -5.056 6.431 -12.445 1.00 0.00 O ATOM 144 CG2 THR A 333 -6.482 5.898 -14.319 1.00 0.00 C ATOM 0 H THR A 333 -5.675 8.578 -12.631 1.00 0.00 H new ATOM 0 HA THR A 333 -8.231 7.256 -13.019 1.00 0.00 H new ATOM 0 HB THR A 333 -6.758 5.260 -12.298 1.00 0.00 H new ATOM 0 HG1 THR A 333 -5.048 7.054 -11.688 1.00 0.00 H new ATOM 0 HG21 THR A 333 -5.830 5.064 -14.577 1.00 0.00 H new ATOM 0 HG22 THR A 333 -7.507 5.658 -14.600 1.00 0.00 H new ATOM 0 HG23 THR A 333 -6.159 6.790 -14.855 1.00 0.00 H new ATOM 152 N SER A 334 -8.632 8.057 -10.543 1.00 0.00 N ATOM 153 CA SER A 334 -9.039 8.153 -9.156 1.00 0.00 C ATOM 154 C SER A 334 -10.206 7.228 -8.857 1.00 0.00 C ATOM 155 O SER A 334 -10.971 7.462 -7.920 1.00 0.00 O ATOM 156 CB SER A 334 -9.415 9.595 -8.839 1.00 0.00 C ATOM 157 OG SER A 334 -8.434 10.500 -9.338 1.00 0.00 O ATOM 0 H SER A 334 -9.145 8.676 -11.170 1.00 0.00 H new ATOM 0 HA SER A 334 -8.204 7.844 -8.527 1.00 0.00 H new ATOM 0 HB2 SER A 334 -10.385 9.827 -9.278 1.00 0.00 H new ATOM 0 HB3 SER A 334 -9.515 9.720 -7.761 1.00 0.00 H new ATOM 0 HG SER A 334 -8.698 11.419 -9.124 1.00 0.00 H new ATOM 163 N ASN A 335 -10.309 6.154 -9.618 1.00 0.00 N ATOM 164 CA ASN A 335 -11.398 5.203 -9.453 1.00 0.00 C ATOM 165 C ASN A 335 -11.319 4.494 -8.104 1.00 0.00 C ATOM 166 O ASN A 335 -12.302 3.933 -7.624 1.00 0.00 O ATOM 167 CB ASN A 335 -11.402 4.174 -10.590 1.00 0.00 C ATOM 168 CG ASN A 335 -10.176 3.277 -10.576 1.00 0.00 C ATOM 169 OD1 ASN A 335 -9.135 3.625 -11.129 1.00 0.00 O ATOM 170 ND2 ASN A 335 -10.294 2.116 -9.956 1.00 0.00 N ATOM 0 H ASN A 335 -9.650 5.916 -10.360 1.00 0.00 H new ATOM 0 HA ASN A 335 -12.330 5.767 -9.487 1.00 0.00 H new ATOM 0 HB2 ASN A 335 -12.298 3.558 -10.513 1.00 0.00 H new ATOM 0 HB3 ASN A 335 -11.454 4.695 -11.546 1.00 0.00 H new ATOM 0 HD21 ASN A 335 -9.504 1.472 -9.925 1.00 0.00 H new ATOM 0 HD22 ASN A 335 -11.175 1.864 -9.509 1.00 0.00 H new ATOM 177 N TRP A 336 -10.148 4.528 -7.498 1.00 0.00 N ATOM 178 CA TRP A 336 -9.949 3.897 -6.208 1.00 0.00 C ATOM 179 C TRP A 336 -9.987 4.942 -5.109 1.00 0.00 C ATOM 180 O TRP A 336 -10.463 4.693 -4.013 1.00 0.00 O ATOM 181 CB TRP A 336 -8.630 3.114 -6.179 1.00 0.00 C ATOM 182 CG TRP A 336 -7.416 3.943 -6.491 1.00 0.00 C ATOM 183 CD1 TRP A 336 -7.006 4.368 -7.721 1.00 0.00 C ATOM 184 CD2 TRP A 336 -6.448 4.434 -5.555 1.00 0.00 C ATOM 185 NE1 TRP A 336 -5.858 5.105 -7.605 1.00 0.00 N ATOM 186 CE2 TRP A 336 -5.490 5.156 -6.289 1.00 0.00 C ATOM 187 CE3 TRP A 336 -6.302 4.338 -4.170 1.00 0.00 C ATOM 188 CZ2 TRP A 336 -4.400 5.777 -5.683 1.00 0.00 C ATOM 189 CZ3 TRP A 336 -5.220 4.954 -3.573 1.00 0.00 C ATOM 190 CH2 TRP A 336 -4.283 5.665 -4.329 1.00 0.00 C ATOM 0 H TRP A 336 -9.320 4.986 -7.878 1.00 0.00 H new ATOM 0 HA TRP A 336 -10.757 3.186 -6.038 1.00 0.00 H new ATOM 0 HB2 TRP A 336 -8.507 2.667 -5.193 1.00 0.00 H new ATOM 0 HB3 TRP A 336 -8.691 2.295 -6.895 1.00 0.00 H new ATOM 0 HD1 TRP A 336 -7.513 4.154 -8.650 1.00 0.00 H new ATOM 0 HE1 TRP A 336 -5.357 5.546 -8.377 1.00 0.00 H new ATOM 0 HE3 TRP A 336 -7.021 3.793 -3.577 1.00 0.00 H new ATOM 0 HZ2 TRP A 336 -3.674 6.327 -6.264 1.00 0.00 H new ATOM 0 HZ3 TRP A 336 -5.095 4.885 -2.502 1.00 0.00 H new ATOM 0 HH2 TRP A 336 -3.449 6.136 -3.830 1.00 0.00 H new ATOM 201 N ILE A 337 -9.501 6.119 -5.430 1.00 0.00 N ATOM 202 CA ILE A 337 -9.493 7.237 -4.506 1.00 0.00 C ATOM 203 C ILE A 337 -10.920 7.647 -4.161 1.00 0.00 C ATOM 204 O ILE A 337 -11.181 8.153 -3.082 1.00 0.00 O ATOM 205 CB ILE A 337 -8.746 8.439 -5.125 1.00 0.00 C ATOM 206 CG1 ILE A 337 -7.296 8.061 -5.393 1.00 0.00 C ATOM 207 CG2 ILE A 337 -8.828 9.660 -4.219 1.00 0.00 C ATOM 208 CD1 ILE A 337 -6.566 9.028 -6.294 1.00 0.00 C ATOM 0 H ILE A 337 -9.098 6.332 -6.342 1.00 0.00 H new ATOM 0 HA ILE A 337 -8.979 6.927 -3.596 1.00 0.00 H new ATOM 0 HB ILE A 337 -9.224 8.698 -6.070 1.00 0.00 H new ATOM 0 HG12 ILE A 337 -6.767 7.996 -4.442 1.00 0.00 H new ATOM 0 HG13 ILE A 337 -7.267 7.069 -5.843 1.00 0.00 H new ATOM 0 HG21 ILE A 337 -8.294 10.491 -4.679 1.00 0.00 H new ATOM 0 HG22 ILE A 337 -9.872 9.936 -4.074 1.00 0.00 H new ATOM 0 HG23 ILE A 337 -8.377 9.428 -3.254 1.00 0.00 H new ATOM 0 HD11 ILE A 337 -5.540 8.689 -6.436 1.00 0.00 H new ATOM 0 HD12 ILE A 337 -7.069 9.076 -7.260 1.00 0.00 H new ATOM 0 HD13 ILE A 337 -6.561 10.018 -5.837 1.00 0.00 H new ATOM 220 N ALA A 338 -11.835 7.376 -5.085 1.00 0.00 N ATOM 221 CA ALA A 338 -13.247 7.728 -4.939 1.00 0.00 C ATOM 222 C ALA A 338 -13.817 7.343 -3.568 1.00 0.00 C ATOM 223 O ALA A 338 -14.613 8.086 -2.994 1.00 0.00 O ATOM 224 CB ALA A 338 -14.061 7.075 -6.048 1.00 0.00 C ATOM 0 H ALA A 338 -11.619 6.903 -5.963 1.00 0.00 H new ATOM 0 HA ALA A 338 -13.317 8.813 -5.016 1.00 0.00 H new ATOM 0 HB1 ALA A 338 -15.112 7.341 -5.933 1.00 0.00 H new ATOM 0 HB2 ALA A 338 -13.702 7.424 -7.016 1.00 0.00 H new ATOM 0 HB3 ALA A 338 -13.953 5.992 -5.989 1.00 0.00 H new ATOM 230 N ALA A 339 -13.407 6.198 -3.042 1.00 0.00 N ATOM 231 CA ALA A 339 -13.916 5.753 -1.752 1.00 0.00 C ATOM 232 C ALA A 339 -12.849 5.073 -0.901 1.00 0.00 C ATOM 233 O ALA A 339 -13.155 4.521 0.158 1.00 0.00 O ATOM 234 CB ALA A 339 -15.100 4.825 -1.951 1.00 0.00 C ATOM 0 H ALA A 339 -12.734 5.569 -3.480 1.00 0.00 H new ATOM 0 HA ALA A 339 -14.234 6.643 -1.209 1.00 0.00 H new ATOM 0 HB1 ALA A 339 -15.473 4.498 -0.980 1.00 0.00 H new ATOM 0 HB2 ALA A 339 -15.890 5.353 -2.485 1.00 0.00 H new ATOM 0 HB3 ALA A 339 -14.788 3.957 -2.531 1.00 0.00 H new ATOM 240 N ASN A 340 -11.603 5.120 -1.344 1.00 0.00 N ATOM 241 CA ASN A 340 -10.518 4.478 -0.593 1.00 0.00 C ATOM 242 C ASN A 340 -9.538 5.498 -0.094 1.00 0.00 C ATOM 243 O ASN A 340 -8.632 5.186 0.675 1.00 0.00 O ATOM 244 CB ASN A 340 -9.788 3.445 -1.451 1.00 0.00 C ATOM 245 CG ASN A 340 -10.628 2.223 -1.733 1.00 0.00 C ATOM 246 OD1 ASN A 340 -10.571 1.236 -1.000 1.00 0.00 O ATOM 247 ND2 ASN A 340 -11.414 2.282 -2.789 1.00 0.00 N ATOM 0 H ASN A 340 -11.313 5.586 -2.204 1.00 0.00 H new ATOM 0 HA ASN A 340 -10.969 3.970 0.259 1.00 0.00 H new ATOM 0 HB2 ASN A 340 -9.495 3.905 -2.395 1.00 0.00 H new ATOM 0 HB3 ASN A 340 -8.871 3.142 -0.946 1.00 0.00 H new ATOM 0 HD21 ASN A 340 -12.008 1.488 -3.027 1.00 0.00 H new ATOM 0 HD22 ASN A 340 -11.428 3.122 -3.368 1.00 0.00 H new ATOM 254 N THR A 341 -9.694 6.713 -0.545 1.00 0.00 N ATOM 255 CA THR A 341 -8.806 7.777 -0.156 1.00 0.00 C ATOM 256 C THR A 341 -9.545 9.109 -0.219 1.00 0.00 C ATOM 257 O THR A 341 -10.659 9.173 -0.718 1.00 0.00 O ATOM 258 CB THR A 341 -7.568 7.822 -1.079 1.00 0.00 C ATOM 259 OG1 THR A 341 -7.431 6.571 -1.771 1.00 0.00 O ATOM 260 CG2 THR A 341 -6.318 8.057 -0.267 1.00 0.00 C ATOM 0 H THR A 341 -10.434 6.993 -1.188 1.00 0.00 H new ATOM 0 HA THR A 341 -8.469 7.593 0.864 1.00 0.00 H new ATOM 0 HB THR A 341 -7.702 8.635 -1.793 1.00 0.00 H new ATOM 0 HG1 THR A 341 -6.547 6.524 -2.191 1.00 0.00 H new ATOM 0 HG21 THR A 341 -5.453 8.086 -0.930 1.00 0.00 H new ATOM 0 HG22 THR A 341 -6.401 9.006 0.263 1.00 0.00 H new ATOM 0 HG23 THR A 341 -6.195 7.249 0.454 1.00 0.00 H new ATOM 268 N LYS A 342 -8.940 10.161 0.306 1.00 0.00 N ATOM 269 CA LYS A 342 -9.554 11.479 0.279 1.00 0.00 C ATOM 270 C LYS A 342 -8.494 12.543 0.077 1.00 0.00 C ATOM 271 O LYS A 342 -7.310 12.230 -0.072 1.00 0.00 O ATOM 272 CB LYS A 342 -10.372 11.754 1.564 1.00 0.00 C ATOM 273 CG LYS A 342 -11.517 10.769 1.775 1.00 0.00 C ATOM 274 CD LYS A 342 -12.551 11.262 2.779 1.00 0.00 C ATOM 275 CE LYS A 342 -11.988 11.396 4.183 1.00 0.00 C ATOM 276 NZ LYS A 342 -13.071 11.509 5.195 1.00 0.00 N1+ ATOM 0 H LYS A 342 -8.025 10.129 0.756 1.00 0.00 H new ATOM 0 HA LYS A 342 -10.249 11.510 -0.560 1.00 0.00 H new ATOM 0 HB2 LYS A 342 -9.705 11.715 2.426 1.00 0.00 H new ATOM 0 HB3 LYS A 342 -10.776 12.765 1.519 1.00 0.00 H new ATOM 0 HG2 LYS A 342 -12.007 10.581 0.820 1.00 0.00 H new ATOM 0 HG3 LYS A 342 -11.111 9.817 2.118 1.00 0.00 H new ATOM 0 HD2 LYS A 342 -12.936 12.228 2.453 1.00 0.00 H new ATOM 0 HD3 LYS A 342 -13.394 10.571 2.795 1.00 0.00 H new ATOM 0 HE2 LYS A 342 -11.365 10.531 4.410 1.00 0.00 H new ATOM 0 HE3 LYS A 342 -11.345 12.275 4.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 342 -12.693 11.944 6.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 342 -13.839 12.100 4.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 342 -13.439 10.562 5.416 1.00 0.00 H new ATOM 290 N GLU A 343 -8.912 13.787 0.067 1.00 0.00 N ATOM 291 CA GLU A 343 -8.000 14.894 -0.143 1.00 0.00 C ATOM 292 C GLU A 343 -8.036 15.849 1.028 1.00 0.00 C ATOM 293 O GLU A 343 -8.946 15.794 1.865 1.00 0.00 O ATOM 294 CB GLU A 343 -8.364 15.642 -1.420 1.00 0.00 C ATOM 295 CG GLU A 343 -8.292 14.792 -2.670 1.00 0.00 C ATOM 296 CD GLU A 343 -9.120 15.355 -3.793 1.00 0.00 C ATOM 297 OE1 GLU A 343 -8.626 16.221 -4.527 1.00 0.00 O1- ATOM 298 OE2 GLU A 343 -10.279 14.925 -3.948 1.00 0.00 O ATOM 0 H GLU A 343 -9.885 14.062 0.203 1.00 0.00 H new ATOM 0 HA GLU A 343 -6.992 14.488 -0.235 1.00 0.00 H new ATOM 0 HB2 GLU A 343 -9.374 16.040 -1.321 1.00 0.00 H new ATOM 0 HB3 GLU A 343 -7.695 16.495 -1.533 1.00 0.00 H new ATOM 0 HG2 GLU A 343 -7.254 14.711 -2.992 1.00 0.00 H new ATOM 0 HG3 GLU A 343 -8.634 13.783 -2.440 1.00 0.00 H new ATOM 305 N CYS A 344 -7.043 16.716 1.085 1.00 0.00 N ATOM 306 CA CYS A 344 -6.958 17.723 2.115 1.00 0.00 C ATOM 307 C CYS A 344 -8.094 18.719 1.959 1.00 0.00 C ATOM 308 O CYS A 344 -8.345 19.216 0.863 1.00 0.00 O ATOM 309 CB CYS A 344 -5.610 18.443 2.026 1.00 0.00 C ATOM 310 SG CYS A 344 -5.357 19.767 3.256 1.00 0.00 S ATOM 0 H CYS A 344 -6.274 16.739 0.416 1.00 0.00 H new ATOM 0 HA CYS A 344 -7.040 17.245 3.091 1.00 0.00 H new ATOM 0 HB2 CYS A 344 -4.814 17.707 2.139 1.00 0.00 H new ATOM 0 HB3 CYS A 344 -5.509 18.871 1.029 1.00 0.00 H new ATOM 315 N PRO A 345 -8.795 19.024 3.044 1.00 0.00 N ATOM 316 CA PRO A 345 -9.883 19.986 3.023 1.00 0.00 C ATOM 317 C PRO A 345 -9.358 21.421 3.078 1.00 0.00 C ATOM 318 O PRO A 345 -10.117 22.372 3.278 1.00 0.00 O ATOM 319 CB PRO A 345 -10.671 19.640 4.284 1.00 0.00 C ATOM 320 CG PRO A 345 -9.647 19.110 5.230 1.00 0.00 C ATOM 321 CD PRO A 345 -8.591 18.445 4.383 1.00 0.00 C ATOM 0 HA PRO A 345 -10.481 19.935 2.113 1.00 0.00 H new ATOM 0 HB2 PRO A 345 -11.172 20.518 4.692 1.00 0.00 H new ATOM 0 HB3 PRO A 345 -11.443 18.899 4.079 1.00 0.00 H new ATOM 0 HG2 PRO A 345 -9.217 19.914 5.827 1.00 0.00 H new ATOM 0 HG3 PRO A 345 -10.092 18.399 5.926 1.00 0.00 H new ATOM 0 HD2 PRO A 345 -7.589 18.651 4.759 1.00 0.00 H new ATOM 0 HD3 PRO A 345 -8.711 17.362 4.372 1.00 0.00 H new ATOM 329 N LYS A 346 -8.053 21.563 2.918 1.00 0.00 N ATOM 330 CA LYS A 346 -7.422 22.854 2.920 1.00 0.00 C ATOM 331 C LYS A 346 -6.793 23.174 1.562 1.00 0.00 C ATOM 332 O LYS A 346 -7.105 24.201 0.957 1.00 0.00 O ATOM 333 CB LYS A 346 -6.394 22.943 4.052 1.00 0.00 C ATOM 334 CG LYS A 346 -5.298 23.947 3.800 1.00 0.00 C ATOM 335 CD LYS A 346 -4.621 24.382 5.074 1.00 0.00 C ATOM 336 CE LYS A 346 -3.529 25.379 4.772 1.00 0.00 C ATOM 337 NZ LYS A 346 -2.836 25.832 5.994 1.00 0.00 N1+ ATOM 0 H LYS A 346 -7.410 20.783 2.784 1.00 0.00 H new ATOM 0 HA LYS A 346 -8.189 23.607 3.099 1.00 0.00 H new ATOM 0 HB2 LYS A 346 -6.908 23.204 4.977 1.00 0.00 H new ATOM 0 HB3 LYS A 346 -5.947 21.960 4.202 1.00 0.00 H new ATOM 0 HG2 LYS A 346 -4.558 23.514 3.127 1.00 0.00 H new ATOM 0 HG3 LYS A 346 -5.715 24.819 3.296 1.00 0.00 H new ATOM 0 HD2 LYS A 346 -5.352 24.827 5.749 1.00 0.00 H new ATOM 0 HD3 LYS A 346 -4.201 23.516 5.585 1.00 0.00 H new ATOM 0 HE2 LYS A 346 -2.806 24.929 4.092 1.00 0.00 H new ATOM 0 HE3 LYS A 346 -3.957 26.240 4.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 346 -2.094 26.515 5.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 346 -3.520 26.285 6.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 346 -2.405 25.015 6.472 1.00 0.00 H new ATOM 351 N CYS A 347 -5.924 22.299 1.078 1.00 0.00 N ATOM 352 CA CYS A 347 -5.256 22.545 -0.195 1.00 0.00 C ATOM 353 C CYS A 347 -5.733 21.585 -1.281 1.00 0.00 C ATOM 354 O CYS A 347 -5.262 21.645 -2.421 1.00 0.00 O ATOM 355 CB CYS A 347 -3.739 22.476 -0.028 1.00 0.00 C ATOM 356 SG CYS A 347 -3.125 20.914 0.652 1.00 0.00 S ATOM 0 H CYS A 347 -5.667 21.425 1.537 1.00 0.00 H new ATOM 0 HA CYS A 347 -5.522 23.552 -0.518 1.00 0.00 H new ATOM 0 HB2 CYS A 347 -3.272 22.643 -0.999 1.00 0.00 H new ATOM 0 HB3 CYS A 347 -3.421 23.290 0.623 1.00 0.00 H new ATOM 361 N HIS A 348 -6.658 20.701 -0.916 1.00 0.00 N ATOM 362 CA HIS A 348 -7.258 19.740 -1.851 1.00 0.00 C ATOM 363 C HIS A 348 -6.202 18.839 -2.486 1.00 0.00 C ATOM 364 O HIS A 348 -6.221 18.588 -3.691 1.00 0.00 O ATOM 365 CB HIS A 348 -8.079 20.464 -2.935 1.00 0.00 C ATOM 366 CG HIS A 348 -9.267 21.221 -2.399 1.00 0.00 C ATOM 367 ND1 HIS A 348 -10.552 20.900 -2.772 1.00 0.00 N ATOM 368 CD2 HIS A 348 -9.307 22.271 -1.541 1.00 0.00 C ATOM 369 CE1 HIS A 348 -11.337 21.761 -2.135 1.00 0.00 C ATOM 370 NE2 HIS A 348 -10.627 22.604 -1.381 1.00 0.00 N ATOM 0 H HIS A 348 -7.016 20.627 0.036 1.00 0.00 H new ATOM 0 HA HIS A 348 -7.933 19.105 -1.277 1.00 0.00 H new ATOM 0 HB2 HIS A 348 -7.428 21.158 -3.466 1.00 0.00 H new ATOM 0 HB3 HIS A 348 -8.426 19.731 -3.664 1.00 0.00 H new ATOM 0 HD2 HIS A 348 -8.461 22.752 -1.073 1.00 0.00 H new ATOM 0 HE1 HIS A 348 -12.414 21.777 -2.216 1.00 0.00 H new ATOM 0 HE2 HIS A 348 -10.997 23.354 -0.797 1.00 0.00 H new ATOM 378 N VAL A 349 -5.292 18.342 -1.668 1.00 0.00 N ATOM 379 CA VAL A 349 -4.243 17.466 -2.151 1.00 0.00 C ATOM 380 C VAL A 349 -4.598 16.023 -1.838 1.00 0.00 C ATOM 381 O VAL A 349 -5.131 15.736 -0.768 1.00 0.00 O ATOM 382 CB VAL A 349 -2.852 17.815 -1.533 1.00 0.00 C ATOM 383 CG1 VAL A 349 -2.850 17.610 -0.037 1.00 0.00 C ATOM 384 CG2 VAL A 349 -1.741 17.006 -2.186 1.00 0.00 C ATOM 0 H VAL A 349 -5.259 18.531 -0.666 1.00 0.00 H new ATOM 0 HA VAL A 349 -4.166 17.607 -3.229 1.00 0.00 H new ATOM 0 HB VAL A 349 -2.663 18.870 -1.729 1.00 0.00 H new ATOM 0 HG11 VAL A 349 -1.868 17.861 0.363 1.00 0.00 H new ATOM 0 HG12 VAL A 349 -3.603 18.252 0.419 1.00 0.00 H new ATOM 0 HG13 VAL A 349 -3.078 16.568 0.188 1.00 0.00 H new ATOM 0 HG21 VAL A 349 -0.785 17.271 -1.735 1.00 0.00 H new ATOM 0 HG22 VAL A 349 -1.930 15.943 -2.038 1.00 0.00 H new ATOM 0 HG23 VAL A 349 -1.711 17.224 -3.254 1.00 0.00 H new ATOM 394 N THR A 350 -4.342 15.127 -2.772 1.00 0.00 N ATOM 395 CA THR A 350 -4.614 13.726 -2.555 1.00 0.00 C ATOM 396 C THR A 350 -3.728 13.191 -1.434 1.00 0.00 C ATOM 397 O THR A 350 -2.503 13.139 -1.563 1.00 0.00 O ATOM 398 CB THR A 350 -4.369 12.911 -3.833 1.00 0.00 C ATOM 399 OG1 THR A 350 -4.948 13.595 -4.955 1.00 0.00 O ATOM 400 CG2 THR A 350 -4.995 11.531 -3.710 1.00 0.00 C ATOM 0 H THR A 350 -3.947 15.348 -3.686 1.00 0.00 H new ATOM 0 HA THR A 350 -5.663 13.625 -2.275 1.00 0.00 H new ATOM 0 HB THR A 350 -3.294 12.801 -3.978 1.00 0.00 H new ATOM 0 HG1 THR A 350 -4.790 13.076 -5.771 1.00 0.00 H new ATOM 0 HG21 THR A 350 -4.812 10.966 -4.624 1.00 0.00 H new ATOM 0 HG22 THR A 350 -4.553 11.005 -2.864 1.00 0.00 H new ATOM 0 HG23 THR A 350 -6.069 11.631 -3.554 1.00 0.00 H new ATOM 408 N ILE A 351 -4.347 12.823 -0.334 1.00 0.00 N ATOM 409 CA ILE A 351 -3.628 12.308 0.803 1.00 0.00 C ATOM 410 C ILE A 351 -3.874 10.819 0.907 1.00 0.00 C ATOM 411 O ILE A 351 -4.358 10.211 -0.036 1.00 0.00 O ATOM 412 CB ILE A 351 -4.091 12.994 2.119 1.00 0.00 C ATOM 413 CG1 ILE A 351 -5.538 12.610 2.438 1.00 0.00 C ATOM 414 CG2 ILE A 351 -3.951 14.513 2.020 1.00 0.00 C ATOM 415 CD1 ILE A 351 -6.140 13.372 3.593 1.00 0.00 C ATOM 0 H ILE A 351 -5.358 12.873 -0.206 1.00 0.00 H new ATOM 0 HA ILE A 351 -2.567 12.513 0.664 1.00 0.00 H new ATOM 0 HB ILE A 351 -3.450 12.646 2.929 1.00 0.00 H new ATOM 0 HG12 ILE A 351 -6.150 12.774 1.551 1.00 0.00 H new ATOM 0 HG13 ILE A 351 -5.579 11.544 2.660 1.00 0.00 H new ATOM 0 HG21 ILE A 351 -4.281 14.970 2.953 1.00 0.00 H new ATOM 0 HG22 ILE A 351 -2.908 14.771 1.839 1.00 0.00 H new ATOM 0 HG23 ILE A 351 -4.564 14.882 1.198 1.00 0.00 H new ATOM 0 HD11 ILE A 351 -7.166 13.040 3.753 1.00 0.00 H new ATOM 0 HD12 ILE A 351 -5.555 13.189 4.494 1.00 0.00 H new ATOM 0 HD13 ILE A 351 -6.135 14.438 3.368 1.00 0.00 H new ATOM 427 N GLU A 352 -3.541 10.242 2.040 1.00 0.00 N ATOM 428 CA GLU A 352 -3.795 8.842 2.287 1.00 0.00 C ATOM 429 C GLU A 352 -3.774 8.574 3.769 1.00 0.00 C ATOM 430 O GLU A 352 -2.835 8.970 4.468 1.00 0.00 O ATOM 431 CB GLU A 352 -2.796 7.940 1.578 1.00 0.00 C ATOM 432 CG GLU A 352 -3.169 6.472 1.694 1.00 0.00 C ATOM 433 CD GLU A 352 -2.176 5.545 1.051 1.00 0.00 C ATOM 434 OE1 GLU A 352 -1.029 5.472 1.535 1.00 0.00 O ATOM 435 OE2 GLU A 352 -2.548 4.845 0.093 1.00 0.00 O1- ATOM 0 H GLU A 352 -3.088 10.729 2.813 1.00 0.00 H new ATOM 0 HA GLU A 352 -4.781 8.611 1.883 1.00 0.00 H new ATOM 0 HB2 GLU A 352 -2.741 8.218 0.525 1.00 0.00 H new ATOM 0 HB3 GLU A 352 -1.804 8.096 2.001 1.00 0.00 H new ATOM 0 HG2 GLU A 352 -3.265 6.213 2.748 1.00 0.00 H new ATOM 0 HG3 GLU A 352 -4.146 6.317 1.237 1.00 0.00 H new ATOM 442 N LYS A 353 -4.809 7.914 4.248 1.00 0.00 N ATOM 443 CA LYS A 353 -4.958 7.633 5.659 1.00 0.00 C ATOM 444 C LYS A 353 -3.860 6.713 6.179 1.00 0.00 C ATOM 445 O LYS A 353 -3.418 5.793 5.492 1.00 0.00 O ATOM 446 CB LYS A 353 -6.332 7.029 5.928 1.00 0.00 C ATOM 447 CG LYS A 353 -6.586 6.667 7.381 1.00 0.00 C ATOM 448 CD LYS A 353 -6.650 7.888 8.278 1.00 0.00 C ATOM 449 CE LYS A 353 -7.106 7.500 9.672 1.00 0.00 C ATOM 450 NZ LYS A 353 -8.326 6.645 9.647 1.00 0.00 N1+ ATOM 0 H LYS A 353 -5.570 7.558 3.669 1.00 0.00 H new ATOM 0 HA LYS A 353 -4.867 8.577 6.196 1.00 0.00 H new ATOM 0 HB2 LYS A 353 -7.096 7.736 5.604 1.00 0.00 H new ATOM 0 HB3 LYS A 353 -6.447 6.133 5.318 1.00 0.00 H new ATOM 0 HG2 LYS A 353 -7.523 6.114 7.457 1.00 0.00 H new ATOM 0 HG3 LYS A 353 -5.795 6.003 7.731 1.00 0.00 H new ATOM 0 HD2 LYS A 353 -5.669 8.361 8.328 1.00 0.00 H new ATOM 0 HD3 LYS A 353 -7.337 8.621 7.855 1.00 0.00 H new ATOM 0 HE2 LYS A 353 -6.302 6.968 10.181 1.00 0.00 H new ATOM 0 HE3 LYS A 353 -7.308 8.401 10.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 353 -8.849 6.760 10.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 353 -8.932 6.928 8.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 353 -8.050 5.649 9.534 1.00 0.00 H new ATOM 464 N ASP A 354 -3.424 6.991 7.392 1.00 0.00 N ATOM 465 CA ASP A 354 -2.412 6.189 8.055 1.00 0.00 C ATOM 466 C ASP A 354 -3.084 5.118 8.897 1.00 0.00 C ATOM 467 O ASP A 354 -2.763 3.931 8.789 1.00 0.00 O ATOM 468 CB ASP A 354 -1.527 7.074 8.938 1.00 0.00 C ATOM 469 CG ASP A 354 -0.489 6.280 9.708 1.00 0.00 C ATOM 470 OD1 ASP A 354 0.607 6.034 9.158 1.00 0.00 O ATOM 471 OD2 ASP A 354 -0.759 5.909 10.864 1.00 0.00 O1- ATOM 0 H ASP A 354 -3.760 7.778 7.946 1.00 0.00 H new ATOM 0 HA ASP A 354 -1.784 5.714 7.302 1.00 0.00 H new ATOM 0 HB2 ASP A 354 -1.024 7.814 8.316 1.00 0.00 H new ATOM 0 HB3 ASP A 354 -2.154 7.622 9.641 1.00 0.00 H new ATOM 476 N GLY A 355 -4.033 5.547 9.725 1.00 0.00 N ATOM 477 CA GLY A 355 -4.757 4.641 10.555 1.00 0.00 C ATOM 478 C GLY A 355 -4.585 4.949 12.017 1.00 0.00 C ATOM 479 O GLY A 355 -4.236 6.078 12.389 1.00 0.00 O ATOM 0 H GLY A 355 -4.306 6.525 9.825 1.00 0.00 H new ATOM 0 HA2 GLY A 355 -5.816 4.683 10.299 1.00 0.00 H new ATOM 0 HA3 GLY A 355 -4.421 3.623 10.358 1.00 0.00 H new ATOM 483 N GLY A 356 -4.869 3.953 12.827 1.00 0.00 N ATOM 484 CA GLY A 356 -4.689 4.022 14.272 1.00 0.00 C ATOM 485 C GLY A 356 -5.322 5.232 14.943 1.00 0.00 C ATOM 486 O GLY A 356 -6.547 5.308 15.097 1.00 0.00 O ATOM 0 H GLY A 356 -5.236 3.058 12.503 1.00 0.00 H new ATOM 0 HA2 GLY A 356 -5.106 3.119 14.718 1.00 0.00 H new ATOM 0 HA3 GLY A 356 -3.621 4.022 14.490 1.00 0.00 H new ATOM 490 N SER A 357 -4.472 6.181 15.320 1.00 0.00 N ATOM 491 CA SER A 357 -4.869 7.369 16.073 1.00 0.00 C ATOM 492 C SER A 357 -5.881 8.238 15.323 1.00 0.00 C ATOM 493 O SER A 357 -6.584 9.038 15.943 1.00 0.00 O ATOM 494 CB SER A 357 -3.632 8.204 16.399 1.00 0.00 C ATOM 495 OG SER A 357 -2.578 7.384 16.877 1.00 0.00 O ATOM 0 H SER A 357 -3.475 6.148 15.109 1.00 0.00 H new ATOM 0 HA SER A 357 -5.353 7.021 16.986 1.00 0.00 H new ATOM 0 HB2 SER A 357 -3.305 8.740 15.508 1.00 0.00 H new ATOM 0 HB3 SER A 357 -3.882 8.955 17.149 1.00 0.00 H new ATOM 0 HG SER A 357 -1.796 7.940 17.077 1.00 0.00 H new ATOM 501 N ASN A 358 -5.932 8.091 13.986 1.00 0.00 N ATOM 502 CA ASN A 358 -6.828 8.890 13.128 1.00 0.00 C ATOM 503 C ASN A 358 -6.273 10.287 12.932 1.00 0.00 C ATOM 504 O ASN A 358 -6.911 11.146 12.321 1.00 0.00 O ATOM 505 CB ASN A 358 -8.271 8.941 13.682 1.00 0.00 C ATOM 506 CG ASN A 358 -9.104 7.748 13.259 1.00 0.00 C ATOM 507 OD1 ASN A 358 -8.996 7.278 12.139 1.00 0.00 O ATOM 508 ND2 ASN A 358 -9.918 7.238 14.160 1.00 0.00 N ATOM 0 H ASN A 358 -5.359 7.421 13.473 1.00 0.00 H new ATOM 0 HA ASN A 358 -6.876 8.396 12.158 1.00 0.00 H new ATOM 0 HB2 ASN A 358 -8.236 8.987 14.770 1.00 0.00 H new ATOM 0 HB3 ASN A 358 -8.755 9.856 13.340 1.00 0.00 H new ATOM 0 HD21 ASN A 358 -10.485 6.422 13.931 1.00 0.00 H new ATOM 0 HD22 ASN A 358 -9.981 7.659 15.087 1.00 0.00 H new ATOM 515 N HIS A 359 -5.057 10.491 13.431 1.00 0.00 N ATOM 516 CA HIS A 359 -4.366 11.761 13.313 1.00 0.00 C ATOM 517 C HIS A 359 -3.812 11.903 11.903 1.00 0.00 C ATOM 518 O HIS A 359 -2.680 11.515 11.620 1.00 0.00 O ATOM 519 CB HIS A 359 -3.231 11.842 14.352 1.00 0.00 C ATOM 520 CG HIS A 359 -2.620 13.211 14.532 1.00 0.00 C ATOM 521 ND1 HIS A 359 -1.969 13.547 15.694 1.00 0.00 N ATOM 522 CD2 HIS A 359 -2.574 14.268 13.681 1.00 0.00 C ATOM 523 CE1 HIS A 359 -1.543 14.788 15.527 1.00 0.00 C ATOM 524 NE2 HIS A 359 -1.884 15.263 14.328 1.00 0.00 N ATOM 0 H HIS A 359 -4.526 9.776 13.929 1.00 0.00 H new ATOM 0 HA HIS A 359 -5.064 12.576 13.504 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -3.616 11.504 15.314 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -2.444 11.146 14.062 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -2.998 14.317 12.689 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -0.989 15.346 16.268 1.00 0.00 H new ATOM 0 HE2 HIS A 359 -1.672 16.191 13.961 1.00 0.00 H new ATOM 532 N MET A 360 -4.635 12.403 11.024 1.00 0.00 N ATOM 533 CA MET A 360 -4.257 12.594 9.641 1.00 0.00 C ATOM 534 C MET A 360 -3.576 13.948 9.420 1.00 0.00 C ATOM 535 O MET A 360 -4.115 15.003 9.766 1.00 0.00 O ATOM 536 CB MET A 360 -5.484 12.421 8.725 1.00 0.00 C ATOM 537 CG MET A 360 -5.407 13.180 7.407 1.00 0.00 C ATOM 538 SD MET A 360 -4.032 12.657 6.369 1.00 0.00 S ATOM 539 CE MET A 360 -4.531 10.999 5.977 1.00 0.00 C ATOM 0 H MET A 360 -5.589 12.692 11.241 1.00 0.00 H new ATOM 0 HA MET A 360 -3.525 11.830 9.381 1.00 0.00 H new ATOM 0 HB2 MET A 360 -5.613 11.360 8.511 1.00 0.00 H new ATOM 0 HB3 MET A 360 -6.373 12.748 9.265 1.00 0.00 H new ATOM 0 HG2 MET A 360 -6.340 13.042 6.860 1.00 0.00 H new ATOM 0 HG3 MET A 360 -5.313 14.246 7.614 1.00 0.00 H new ATOM 0 HE1 MET A 360 -3.761 10.300 6.305 1.00 0.00 H new ATOM 0 HE2 MET A 360 -5.468 10.771 6.485 1.00 0.00 H new ATOM 0 HE3 MET A 360 -4.671 10.906 4.900 1.00 0.00 H new ATOM 549 N VAL A 361 -2.382 13.897 8.858 1.00 0.00 N ATOM 550 CA VAL A 361 -1.622 15.088 8.540 1.00 0.00 C ATOM 551 C VAL A 361 -1.442 15.184 7.026 1.00 0.00 C ATOM 552 O VAL A 361 -1.108 14.184 6.368 1.00 0.00 O ATOM 553 CB VAL A 361 -0.230 15.066 9.217 1.00 0.00 C ATOM 554 CG1 VAL A 361 0.520 16.365 8.960 1.00 0.00 C ATOM 555 CG2 VAL A 361 -0.365 14.807 10.712 1.00 0.00 C ATOM 0 H VAL A 361 -1.913 13.026 8.610 1.00 0.00 H new ATOM 0 HA VAL A 361 -2.172 15.952 8.913 1.00 0.00 H new ATOM 0 HB VAL A 361 0.348 14.252 8.779 1.00 0.00 H new ATOM 0 HG11 VAL A 361 1.495 16.325 9.446 1.00 0.00 H new ATOM 0 HG12 VAL A 361 0.655 16.501 7.887 1.00 0.00 H new ATOM 0 HG13 VAL A 361 -0.052 17.201 9.363 1.00 0.00 H new ATOM 0 HG21 VAL A 361 0.624 14.795 11.170 1.00 0.00 H new ATOM 0 HG22 VAL A 361 -0.965 15.596 11.165 1.00 0.00 H new ATOM 0 HG23 VAL A 361 -0.850 13.844 10.872 1.00 0.00 H new ATOM 565 N CYS A 362 -1.681 16.373 6.479 1.00 0.00 N ATOM 566 CA CYS A 362 -1.564 16.615 5.043 1.00 0.00 C ATOM 567 C CYS A 362 -0.188 16.209 4.513 1.00 0.00 C ATOM 568 O CYS A 362 0.811 16.249 5.236 1.00 0.00 O ATOM 569 CB CYS A 362 -1.825 18.086 4.740 1.00 0.00 C ATOM 570 SG CYS A 362 -1.843 18.492 2.972 1.00 0.00 S ATOM 0 H CYS A 362 -1.960 17.194 7.016 1.00 0.00 H new ATOM 0 HA CYS A 362 -2.310 16.001 4.539 1.00 0.00 H new ATOM 0 HB2 CYS A 362 -2.783 18.370 5.176 1.00 0.00 H new ATOM 0 HB3 CYS A 362 -1.060 18.687 5.231 1.00 0.00 H new ATOM 575 N ARG A 363 -0.147 15.831 3.245 1.00 0.00 N ATOM 576 CA ARG A 363 1.097 15.397 2.620 1.00 0.00 C ATOM 577 C ARG A 363 1.749 16.572 1.931 1.00 0.00 C ATOM 578 O ARG A 363 2.958 16.586 1.703 1.00 0.00 O ATOM 579 CB ARG A 363 0.847 14.292 1.582 1.00 0.00 C ATOM 580 CG ARG A 363 -0.383 13.428 1.843 1.00 0.00 C ATOM 581 CD ARG A 363 -0.375 12.792 3.233 1.00 0.00 C ATOM 582 NE ARG A 363 0.712 11.840 3.413 1.00 0.00 N ATOM 583 CZ ARG A 363 1.220 11.504 4.598 1.00 0.00 C ATOM 584 NH1 ARG A 363 0.751 12.065 5.715 1.00 0.00 N1+ ATOM 585 NH2 ARG A 363 2.198 10.610 4.668 1.00 0.00 N ATOM 0 H ARG A 363 -0.959 15.815 2.627 1.00 0.00 H new ATOM 0 HA ARG A 363 1.746 15.001 3.401 1.00 0.00 H new ATOM 0 HB2 ARG A 363 0.746 14.753 0.600 1.00 0.00 H new ATOM 0 HB3 ARG A 363 1.724 13.646 1.543 1.00 0.00 H new ATOM 0 HG2 ARG A 363 -1.280 14.038 1.732 1.00 0.00 H new ATOM 0 HG3 ARG A 363 -0.436 12.643 1.089 1.00 0.00 H new ATOM 0 HD2 ARG A 363 -0.293 13.576 3.986 1.00 0.00 H new ATOM 0 HD3 ARG A 363 -1.326 12.287 3.401 1.00 0.00 H new ATOM 0 HE ARG A 363 1.109 11.404 2.581 1.00 0.00 H new ATOM 0 HH11 ARG A 363 0.001 12.754 5.663 1.00 0.00 H new ATOM 0 HH12 ARG A 363 1.143 11.805 6.620 1.00 0.00 H new ATOM 0 HH21 ARG A 363 2.559 10.182 3.816 1.00 0.00 H new ATOM 0 HH22 ARG A 363 2.589 10.351 5.574 1.00 0.00 H new ATOM 599 N ASN A 364 0.934 17.558 1.587 1.00 0.00 N ATOM 600 CA ASN A 364 1.415 18.750 0.926 1.00 0.00 C ATOM 601 C ASN A 364 2.376 19.498 1.828 1.00 0.00 C ATOM 602 O ASN A 364 2.011 19.957 2.903 1.00 0.00 O ATOM 603 CB ASN A 364 0.241 19.645 0.503 1.00 0.00 C ATOM 604 CG ASN A 364 0.672 20.964 -0.114 1.00 0.00 C ATOM 605 OD1 ASN A 364 1.785 21.096 -0.630 1.00 0.00 O ATOM 606 ND2 ASN A 364 -0.220 21.932 -0.091 1.00 0.00 N ATOM 0 H ASN A 364 -0.071 17.550 1.759 1.00 0.00 H new ATOM 0 HA ASN A 364 1.953 18.458 0.024 1.00 0.00 H new ATOM 0 HB2 ASN A 364 -0.378 19.104 -0.213 1.00 0.00 H new ATOM 0 HB3 ASN A 364 -0.382 19.848 1.374 1.00 0.00 H new ATOM 0 HD21 ASN A 364 -0.003 22.836 -0.511 1.00 0.00 H new ATOM 0 HD22 ASN A 364 -1.128 21.778 0.347 1.00 0.00 H new ATOM 613 N GLN A 365 3.607 19.598 1.377 1.00 0.00 N ATOM 614 CA GLN A 365 4.679 20.268 2.115 1.00 0.00 C ATOM 615 C GLN A 365 4.427 21.766 2.242 1.00 0.00 C ATOM 616 O GLN A 365 5.102 22.455 2.995 1.00 0.00 O ATOM 617 CB GLN A 365 6.025 20.025 1.434 1.00 0.00 C ATOM 618 CG GLN A 365 5.972 20.172 -0.078 1.00 0.00 C ATOM 619 CD GLN A 365 5.756 18.853 -0.809 1.00 0.00 C ATOM 620 OE1 GLN A 365 5.203 17.862 -0.123 1.00 0.00 O flip ATOM 621 NE2 GLN A 365 6.118 18.721 -1.975 1.00 0.00 N flip ATOM 0 H GLN A 365 3.905 19.216 0.479 1.00 0.00 H new ATOM 0 HA GLN A 365 4.698 19.844 3.119 1.00 0.00 H new ATOM 0 HB2 GLN A 365 6.758 20.726 1.834 1.00 0.00 H new ATOM 0 HB3 GLN A 365 6.374 19.022 1.682 1.00 0.00 H new ATOM 0 HG2 GLN A 365 5.168 20.860 -0.340 1.00 0.00 H new ATOM 0 HG3 GLN A 365 6.902 20.622 -0.424 1.00 0.00 H new ATOM 0 HE21 GLN A 365 6.540 19.507 -2.470 1.00 0.00 H new ATOM 0 HE22 GLN A 365 5.997 17.826 -2.448 1.00 0.00 H new ATOM 630 N ASN A 366 3.470 22.261 1.497 1.00 0.00 N ATOM 631 CA ASN A 366 3.098 23.664 1.563 1.00 0.00 C ATOM 632 C ASN A 366 1.885 23.823 2.466 1.00 0.00 C ATOM 633 O ASN A 366 1.305 24.906 2.572 1.00 0.00 O ATOM 634 CB ASN A 366 2.768 24.202 0.165 1.00 0.00 C ATOM 635 CG ASN A 366 3.872 23.960 -0.841 1.00 0.00 C ATOM 636 OD1 ASN A 366 4.793 24.756 -0.971 1.00 0.00 O ATOM 637 ND2 ASN A 366 3.775 22.865 -1.574 1.00 0.00 N ATOM 0 H ASN A 366 2.927 21.713 0.830 1.00 0.00 H new ATOM 0 HA ASN A 366 3.938 24.230 1.966 1.00 0.00 H new ATOM 0 HB2 ASN A 366 1.851 23.732 -0.191 1.00 0.00 H new ATOM 0 HB3 ASN A 366 2.573 25.272 0.231 1.00 0.00 H new ATOM 0 HD21 ASN A 366 4.483 22.658 -2.278 1.00 0.00 H new ATOM 0 HD22 ASN A 366 2.992 22.226 -1.435 1.00 0.00 H new ATOM 644 N CYS A 367 1.521 22.738 3.139 1.00 0.00 N ATOM 645 CA CYS A 367 0.336 22.710 3.969 1.00 0.00 C ATOM 646 C CYS A 367 0.622 22.009 5.284 1.00 0.00 C ATOM 647 O CYS A 367 0.802 22.662 6.316 1.00 0.00 O ATOM 648 CB CYS A 367 -0.784 21.988 3.225 1.00 0.00 C ATOM 649 SG CYS A 367 -2.379 21.926 4.099 1.00 0.00 S ATOM 0 H CYS A 367 2.040 21.860 3.121 1.00 0.00 H new ATOM 0 HA CYS A 367 0.030 23.733 4.186 1.00 0.00 H new ATOM 0 HB2 CYS A 367 -0.934 22.477 2.263 1.00 0.00 H new ATOM 0 HB3 CYS A 367 -0.462 20.968 3.017 1.00 0.00 H new ATOM 654 N LYS A 368 0.677 20.674 5.235 1.00 0.00 N ATOM 655 CA LYS A 368 0.939 19.846 6.411 1.00 0.00 C ATOM 656 C LYS A 368 -0.097 20.096 7.505 1.00 0.00 C ATOM 657 O LYS A 368 0.180 19.917 8.693 1.00 0.00 O ATOM 658 CB LYS A 368 2.347 20.113 6.925 1.00 0.00 C ATOM 659 CG LYS A 368 3.427 19.764 5.913 1.00 0.00 C ATOM 660 CD LYS A 368 4.716 20.494 6.208 1.00 0.00 C ATOM 661 CE LYS A 368 4.599 21.969 5.863 1.00 0.00 C ATOM 662 NZ LYS A 368 5.708 22.775 6.434 1.00 0.00 N1+ ATOM 0 H LYS A 368 0.541 20.139 4.377 1.00 0.00 H new ATOM 0 HA LYS A 368 0.861 18.798 6.122 1.00 0.00 H new ATOM 0 HB2 LYS A 368 2.436 21.166 7.194 1.00 0.00 H new ATOM 0 HB3 LYS A 368 2.511 19.537 7.836 1.00 0.00 H new ATOM 0 HG2 LYS A 368 3.605 18.689 5.925 1.00 0.00 H new ATOM 0 HG3 LYS A 368 3.084 20.019 4.910 1.00 0.00 H new ATOM 0 HD2 LYS A 368 4.968 20.383 7.263 1.00 0.00 H new ATOM 0 HD3 LYS A 368 5.530 20.047 5.637 1.00 0.00 H new ATOM 0 HE2 LYS A 368 4.589 22.086 4.779 1.00 0.00 H new ATOM 0 HE3 LYS A 368 3.648 22.351 6.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 368 5.583 23.773 6.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 368 5.703 22.687 7.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 368 6.616 22.430 6.061 1.00 0.00 H new ATOM 676 N ALA A 369 -1.293 20.502 7.092 1.00 0.00 N ATOM 677 CA ALA A 369 -2.379 20.767 8.017 1.00 0.00 C ATOM 678 C ALA A 369 -2.800 19.491 8.732 1.00 0.00 C ATOM 679 O ALA A 369 -2.872 18.424 8.124 1.00 0.00 O ATOM 680 CB ALA A 369 -3.566 21.380 7.280 1.00 0.00 C ATOM 0 H ALA A 369 -1.532 20.655 6.112 1.00 0.00 H new ATOM 0 HA ALA A 369 -2.027 21.478 8.764 1.00 0.00 H new ATOM 0 HB1 ALA A 369 -4.373 21.573 7.987 1.00 0.00 H new ATOM 0 HB2 ALA A 369 -3.260 22.316 6.813 1.00 0.00 H new ATOM 0 HB3 ALA A 369 -3.914 20.689 6.512 1.00 0.00 H new ATOM 686 N GLU A 370 -3.057 19.600 10.017 1.00 0.00 N ATOM 687 CA GLU A 370 -3.480 18.458 10.801 1.00 0.00 C ATOM 688 C GLU A 370 -4.985 18.478 10.964 1.00 0.00 C ATOM 689 O GLU A 370 -5.542 19.388 11.591 1.00 0.00 O ATOM 690 CB GLU A 370 -2.796 18.457 12.164 1.00 0.00 C ATOM 691 CG GLU A 370 -1.282 18.458 12.078 1.00 0.00 C ATOM 692 CD GLU A 370 -0.624 18.368 13.431 1.00 0.00 C ATOM 693 OE1 GLU A 370 -0.566 19.392 14.145 1.00 0.00 O ATOM 694 OE2 GLU A 370 -0.149 17.274 13.784 1.00 0.00 O1- ATOM 0 H GLU A 370 -2.980 20.470 10.543 1.00 0.00 H new ATOM 0 HA GLU A 370 -3.192 17.547 10.277 1.00 0.00 H new ATOM 0 HB2 GLU A 370 -3.121 19.332 12.726 1.00 0.00 H new ATOM 0 HB3 GLU A 370 -3.120 17.580 12.724 1.00 0.00 H new ATOM 0 HG2 GLU A 370 -0.956 17.619 11.463 1.00 0.00 H new ATOM 0 HG3 GLU A 370 -0.951 19.368 11.577 1.00 0.00 H new ATOM 701 N PHE A 371 -5.641 17.491 10.404 1.00 0.00 N ATOM 702 CA PHE A 371 -7.084 17.429 10.446 1.00 0.00 C ATOM 703 C PHE A 371 -7.575 16.017 10.706 1.00 0.00 C ATOM 704 O PHE A 371 -6.888 15.037 10.411 1.00 0.00 O ATOM 705 CB PHE A 371 -7.694 17.981 9.143 1.00 0.00 C ATOM 706 CG PHE A 371 -7.126 17.384 7.885 1.00 0.00 C ATOM 707 CD1 PHE A 371 -6.008 17.939 7.287 1.00 0.00 C ATOM 708 CD2 PHE A 371 -7.712 16.275 7.300 1.00 0.00 C ATOM 709 CE1 PHE A 371 -5.483 17.400 6.132 1.00 0.00 C ATOM 710 CE2 PHE A 371 -7.192 15.732 6.144 1.00 0.00 C ATOM 711 CZ PHE A 371 -6.075 16.296 5.560 1.00 0.00 C ATOM 0 H PHE A 371 -5.197 16.716 9.911 1.00 0.00 H new ATOM 0 HA PHE A 371 -7.414 18.054 11.276 1.00 0.00 H new ATOM 0 HB2 PHE A 371 -8.770 17.807 9.159 1.00 0.00 H new ATOM 0 HB3 PHE A 371 -7.546 19.061 9.117 1.00 0.00 H new ATOM 0 HD1 PHE A 371 -5.541 18.806 7.731 1.00 0.00 H new ATOM 0 HD2 PHE A 371 -8.585 15.830 7.754 1.00 0.00 H new ATOM 0 HE1 PHE A 371 -4.609 17.843 5.677 1.00 0.00 H new ATOM 0 HE2 PHE A 371 -7.658 14.867 5.696 1.00 0.00 H new ATOM 0 HZ PHE A 371 -5.666 15.872 4.655 1.00 0.00 H new ATOM 721 N CYS A 372 -8.763 15.925 11.261 1.00 0.00 N ATOM 722 CA CYS A 372 -9.382 14.657 11.538 1.00 0.00 C ATOM 723 C CYS A 372 -9.866 14.056 10.245 1.00 0.00 C ATOM 724 O CYS A 372 -10.794 14.555 9.648 1.00 0.00 O ATOM 725 CB CYS A 372 -10.557 14.849 12.493 1.00 0.00 C ATOM 726 SG CYS A 372 -11.386 13.298 13.011 1.00 0.00 S ATOM 0 H CYS A 372 -9.325 16.732 11.532 1.00 0.00 H new ATOM 0 HA CYS A 372 -8.657 13.990 12.005 1.00 0.00 H new ATOM 0 HB2 CYS A 372 -10.203 15.370 13.383 1.00 0.00 H new ATOM 0 HB3 CYS A 372 -11.293 15.496 12.016 1.00 0.00 H new ATOM 731 N TRP A 373 -9.220 13.005 9.809 1.00 0.00 N ATOM 732 CA TRP A 373 -9.588 12.328 8.571 1.00 0.00 C ATOM 733 C TRP A 373 -11.064 11.914 8.562 1.00 0.00 C ATOM 734 O TRP A 373 -11.731 11.982 7.523 1.00 0.00 O ATOM 735 CB TRP A 373 -8.696 11.097 8.378 1.00 0.00 C ATOM 736 CG TRP A 373 -9.232 10.086 7.404 1.00 0.00 C ATOM 737 CD1 TRP A 373 -10.162 9.127 7.663 1.00 0.00 C ATOM 738 CD2 TRP A 373 -8.864 9.928 6.036 1.00 0.00 C ATOM 739 NE1 TRP A 373 -10.393 8.379 6.543 1.00 0.00 N ATOM 740 CE2 TRP A 373 -9.610 8.847 5.529 1.00 0.00 C ATOM 741 CE3 TRP A 373 -7.980 10.588 5.190 1.00 0.00 C ATOM 742 CZ2 TRP A 373 -9.495 8.415 4.215 1.00 0.00 C ATOM 743 CZ3 TRP A 373 -7.868 10.160 3.884 1.00 0.00 C ATOM 744 CH2 TRP A 373 -8.620 9.082 3.410 1.00 0.00 C ATOM 0 H TRP A 373 -8.425 12.588 10.293 1.00 0.00 H new ATOM 0 HA TRP A 373 -9.441 13.027 7.748 1.00 0.00 H new ATOM 0 HB2 TRP A 373 -7.714 11.425 8.038 1.00 0.00 H new ATOM 0 HB3 TRP A 373 -8.553 10.612 9.344 1.00 0.00 H new ATOM 0 HD1 TRP A 373 -10.647 8.978 8.616 1.00 0.00 H new ATOM 0 HE1 TRP A 373 -11.045 7.598 6.476 1.00 0.00 H new ATOM 0 HE3 TRP A 373 -7.392 11.420 5.549 1.00 0.00 H new ATOM 0 HZ2 TRP A 373 -10.076 7.583 3.845 1.00 0.00 H new ATOM 0 HZ3 TRP A 373 -7.187 10.667 3.216 1.00 0.00 H new ATOM 0 HH2 TRP A 373 -8.505 8.770 2.382 1.00 0.00 H new ATOM 755 N VAL A 374 -11.558 11.501 9.718 1.00 0.00 N ATOM 756 CA VAL A 374 -12.917 10.982 9.850 1.00 0.00 C ATOM 757 C VAL A 374 -13.963 11.979 9.354 1.00 0.00 C ATOM 758 O VAL A 374 -14.759 11.666 8.468 1.00 0.00 O ATOM 759 CB VAL A 374 -13.223 10.596 11.311 1.00 0.00 C ATOM 760 CG1 VAL A 374 -14.608 9.971 11.432 1.00 0.00 C ATOM 761 CG2 VAL A 374 -12.155 9.649 11.837 1.00 0.00 C ATOM 0 H VAL A 374 -11.032 11.514 10.592 1.00 0.00 H new ATOM 0 HA VAL A 374 -12.973 10.091 9.224 1.00 0.00 H new ATOM 0 HB VAL A 374 -13.214 11.502 11.916 1.00 0.00 H new ATOM 0 HG11 VAL A 374 -14.799 9.708 12.472 1.00 0.00 H new ATOM 0 HG12 VAL A 374 -15.360 10.684 11.094 1.00 0.00 H new ATOM 0 HG13 VAL A 374 -14.657 9.073 10.816 1.00 0.00 H new ATOM 0 HG21 VAL A 374 -12.381 9.383 12.870 1.00 0.00 H new ATOM 0 HG22 VAL A 374 -12.136 8.747 11.226 1.00 0.00 H new ATOM 0 HG23 VAL A 374 -11.182 10.138 11.793 1.00 0.00 H new ATOM 771 N CYS A 375 -13.947 13.175 9.907 1.00 0.00 N ATOM 772 CA CYS A 375 -14.919 14.191 9.536 1.00 0.00 C ATOM 773 C CYS A 375 -14.305 15.237 8.619 1.00 0.00 C ATOM 774 O CYS A 375 -15.005 16.124 8.128 1.00 0.00 O ATOM 775 CB CYS A 375 -15.474 14.857 10.792 1.00 0.00 C ATOM 776 SG CYS A 375 -14.192 15.428 11.956 1.00 0.00 S ATOM 0 H CYS A 375 -13.274 13.470 10.614 1.00 0.00 H new ATOM 0 HA CYS A 375 -15.729 13.704 8.993 1.00 0.00 H new ATOM 0 HB2 CYS A 375 -16.089 15.708 10.498 1.00 0.00 H new ATOM 0 HB3 CYS A 375 -16.129 14.153 11.305 1.00 0.00 H new ATOM 781 N LEU A 376 -13.000 15.119 8.387 1.00 0.00 N ATOM 782 CA LEU A 376 -12.241 16.092 7.589 1.00 0.00 C ATOM 783 C LEU A 376 -12.262 17.473 8.244 1.00 0.00 C ATOM 784 O LEU A 376 -12.093 18.504 7.576 1.00 0.00 O ATOM 785 CB LEU A 376 -12.745 16.155 6.139 1.00 0.00 C ATOM 786 CG LEU A 376 -12.313 15.003 5.232 1.00 0.00 C ATOM 787 CD1 LEU A 376 -12.906 15.175 3.847 1.00 0.00 C ATOM 788 CD2 LEU A 376 -10.794 14.920 5.154 1.00 0.00 C ATOM 0 H LEU A 376 -12.435 14.349 8.744 1.00 0.00 H new ATOM 0 HA LEU A 376 -11.206 15.752 7.556 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -13.834 16.191 6.155 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -12.402 17.090 5.696 1.00 0.00 H new ATOM 0 HG LEU A 376 -12.684 14.071 5.658 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -12.591 14.348 3.211 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -13.994 15.186 3.916 1.00 0.00 H new ATOM 0 HD13 LEU A 376 -12.560 16.115 3.417 1.00 0.00 H new ATOM 0 HD21 LEU A 376 -10.508 14.094 4.504 1.00 0.00 H new ATOM 0 HD22 LEU A 376 -10.399 15.853 4.751 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -10.387 14.754 6.151 1.00 0.00 H new ATOM 800 N GLY A 377 -12.445 17.485 9.556 1.00 0.00 N ATOM 801 CA GLY A 377 -12.459 18.724 10.289 1.00 0.00 C ATOM 802 C GLY A 377 -11.144 18.961 10.988 1.00 0.00 C ATOM 803 O GLY A 377 -10.210 18.194 10.810 1.00 0.00 O ATOM 0 H GLY A 377 -12.585 16.650 10.125 1.00 0.00 H new ATOM 0 HA2 GLY A 377 -12.665 19.550 9.608 1.00 0.00 H new ATOM 0 HA3 GLY A 377 -13.265 18.706 11.022 1.00 0.00 H new ATOM 807 N PRO A 378 -11.042 20.008 11.797 1.00 0.00 N ATOM 808 CA PRO A 378 -9.807 20.328 12.516 1.00 0.00 C ATOM 809 C PRO A 378 -9.480 19.271 13.575 1.00 0.00 C ATOM 810 O PRO A 378 -10.366 18.794 14.278 1.00 0.00 O ATOM 811 CB PRO A 378 -10.120 21.676 13.176 1.00 0.00 C ATOM 812 CG PRO A 378 -11.606 21.711 13.275 1.00 0.00 C ATOM 813 CD PRO A 378 -12.121 20.956 12.089 1.00 0.00 C ATOM 0 HA PRO A 378 -8.938 20.359 11.859 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -9.655 21.753 14.159 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -9.743 22.506 12.579 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -11.945 21.254 14.205 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -11.972 22.738 13.272 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -13.056 20.444 12.314 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -12.315 21.617 11.244 1.00 0.00 H new ATOM 821 N TRP A 379 -8.213 18.908 13.678 1.00 0.00 N ATOM 822 CA TRP A 379 -7.779 17.903 14.639 1.00 0.00 C ATOM 823 C TRP A 379 -7.774 18.455 16.067 1.00 0.00 C ATOM 824 O TRP A 379 -7.883 17.698 17.028 1.00 0.00 O ATOM 825 CB TRP A 379 -6.388 17.362 14.273 1.00 0.00 C ATOM 826 CG TRP A 379 -5.854 16.374 15.268 1.00 0.00 C ATOM 827 CD1 TRP A 379 -4.881 16.596 16.201 1.00 0.00 C ATOM 828 CD2 TRP A 379 -6.281 15.019 15.447 1.00 0.00 C ATOM 829 NE1 TRP A 379 -4.673 15.460 16.942 1.00 0.00 N ATOM 830 CE2 TRP A 379 -5.519 14.477 16.499 1.00 0.00 C ATOM 831 CE3 TRP A 379 -7.231 14.211 14.816 1.00 0.00 C ATOM 832 CZ2 TRP A 379 -5.679 13.166 16.935 1.00 0.00 C ATOM 833 CZ3 TRP A 379 -7.388 12.911 15.250 1.00 0.00 C ATOM 834 CH2 TRP A 379 -6.617 12.400 16.300 1.00 0.00 C ATOM 0 H TRP A 379 -7.462 19.295 13.106 1.00 0.00 H new ATOM 0 HA TRP A 379 -8.496 17.083 14.598 1.00 0.00 H new ATOM 0 HB2 TRP A 379 -6.436 16.889 13.292 1.00 0.00 H new ATOM 0 HB3 TRP A 379 -5.692 18.196 14.191 1.00 0.00 H new ATOM 0 HD1 TRP A 379 -4.353 17.529 16.336 1.00 0.00 H new ATOM 0 HE1 TRP A 379 -3.998 15.363 17.700 1.00 0.00 H new ATOM 0 HE3 TRP A 379 -7.830 14.597 14.005 1.00 0.00 H new ATOM 0 HZ2 TRP A 379 -5.085 12.768 17.744 1.00 0.00 H new ATOM 0 HZ3 TRP A 379 -8.119 12.276 14.771 1.00 0.00 H new ATOM 0 HH2 TRP A 379 -6.766 11.378 16.616 1.00 0.00 H new ATOM 845 N GLU A 380 -7.661 19.772 16.199 1.00 0.00 N ATOM 846 CA GLU A 380 -7.610 20.410 17.521 1.00 0.00 C ATOM 847 C GLU A 380 -8.765 19.976 18.460 1.00 0.00 C ATOM 848 O GLU A 380 -8.503 19.524 19.574 1.00 0.00 O ATOM 849 CB GLU A 380 -7.533 21.928 17.411 1.00 0.00 C ATOM 850 CG GLU A 380 -6.211 22.430 16.867 1.00 0.00 C ATOM 851 CD GLU A 380 -6.058 23.919 17.022 1.00 0.00 C ATOM 852 OE1 GLU A 380 -5.818 24.376 18.165 1.00 0.00 O ATOM 853 OE2 GLU A 380 -6.176 24.638 16.015 1.00 0.00 O1- ATOM 0 H GLU A 380 -7.603 20.421 15.414 1.00 0.00 H new ATOM 0 HA GLU A 380 -6.690 20.054 17.984 1.00 0.00 H new ATOM 0 HB2 GLU A 380 -8.339 22.279 16.766 1.00 0.00 H new ATOM 0 HB3 GLU A 380 -7.700 22.364 18.396 1.00 0.00 H new ATOM 0 HG2 GLU A 380 -5.394 21.927 17.384 1.00 0.00 H new ATOM 0 HG3 GLU A 380 -6.131 22.167 15.812 1.00 0.00 H new ATOM 860 N PRO A 381 -10.058 20.099 18.037 1.00 0.00 N ATOM 861 CA PRO A 381 -11.201 19.666 18.867 1.00 0.00 C ATOM 862 C PRO A 381 -11.232 18.142 19.097 1.00 0.00 C ATOM 863 O PRO A 381 -12.122 17.625 19.766 1.00 0.00 O ATOM 864 CB PRO A 381 -12.429 20.103 18.058 1.00 0.00 C ATOM 865 CG PRO A 381 -11.937 20.243 16.663 1.00 0.00 C ATOM 866 CD PRO A 381 -10.511 20.698 16.768 1.00 0.00 C ATOM 0 HA PRO A 381 -11.151 20.102 19.865 1.00 0.00 H new ATOM 0 HB2 PRO A 381 -13.228 19.365 18.123 1.00 0.00 H new ATOM 0 HB3 PRO A 381 -12.833 21.044 18.431 1.00 0.00 H new ATOM 0 HG2 PRO A 381 -12.005 19.295 16.129 1.00 0.00 H new ATOM 0 HG3 PRO A 381 -12.537 20.965 16.109 1.00 0.00 H new ATOM 0 HD2 PRO A 381 -9.915 20.352 15.924 1.00 0.00 H new ATOM 0 HD3 PRO A 381 -10.436 21.785 16.787 1.00 0.00 H new ATOM 874 N HIS A 382 -10.264 17.442 18.539 1.00 0.00 N ATOM 875 CA HIS A 382 -10.175 15.999 18.692 1.00 0.00 C ATOM 876 C HIS A 382 -9.053 15.632 19.654 1.00 0.00 C ATOM 877 O HIS A 382 -9.203 14.737 20.488 1.00 0.00 O ATOM 878 CB HIS A 382 -9.950 15.329 17.336 1.00 0.00 C ATOM 879 CG HIS A 382 -11.098 15.493 16.390 1.00 0.00 C ATOM 880 ND1 HIS A 382 -11.333 16.629 15.648 1.00 0.00 N ATOM 881 CD2 HIS A 382 -12.092 14.639 16.084 1.00 0.00 C ATOM 882 CE1 HIS A 382 -12.444 16.434 14.932 1.00 0.00 C ATOM 883 NE2 HIS A 382 -12.947 15.237 15.157 1.00 0.00 N ATOM 0 H HIS A 382 -9.522 17.851 17.971 1.00 0.00 H new ATOM 0 HA HIS A 382 -11.118 15.640 19.105 1.00 0.00 H new ATOM 0 HB2 HIS A 382 -9.051 15.744 16.879 1.00 0.00 H new ATOM 0 HB3 HIS A 382 -9.767 14.266 17.491 1.00 0.00 H new ATOM 0 HD1 HIS A 382 -10.759 17.472 15.645 1.00 0.00 H new ATOM 0 HD2 HIS A 382 -12.210 13.646 16.492 1.00 0.00 H new ATOM 0 HE1 HIS A 382 -12.873 17.161 14.258 1.00 0.00 H new ATOM 891 N GLY A 383 -7.931 16.322 19.533 1.00 0.00 N ATOM 892 CA GLY A 383 -6.804 16.067 20.407 1.00 0.00 C ATOM 893 C GLY A 383 -6.979 16.718 21.763 1.00 0.00 C ATOM 894 O GLY A 383 -6.477 17.820 21.994 1.00 0.00 O ATOM 0 H GLY A 383 -7.779 17.057 18.843 1.00 0.00 H new ATOM 0 HA2 GLY A 383 -6.680 14.992 20.534 1.00 0.00 H new ATOM 0 HA3 GLY A 383 -5.892 16.440 19.941 1.00 0.00 H new ATOM 898 N SER A 384 -7.694 16.026 22.654 1.00 0.00 N ATOM 899 CA SER A 384 -7.980 16.516 24.003 1.00 0.00 C ATOM 900 C SER A 384 -8.822 17.788 23.962 1.00 0.00 C ATOM 901 O SER A 384 -8.300 18.902 24.067 1.00 0.00 O ATOM 902 CB SER A 384 -6.690 16.744 24.798 1.00 0.00 C ATOM 903 OG SER A 384 -5.929 15.549 24.876 1.00 0.00 O ATOM 0 H SER A 384 -8.092 15.107 22.458 1.00 0.00 H new ATOM 0 HA SER A 384 -8.557 15.746 24.514 1.00 0.00 H new ATOM 0 HB2 SER A 384 -6.098 17.527 24.323 1.00 0.00 H new ATOM 0 HB3 SER A 384 -6.933 17.092 25.802 1.00 0.00 H new ATOM 0 HG SER A 384 -5.109 15.716 25.386 1.00 0.00 H new ATOM 909 N ALA A 385 -10.122 17.617 23.783 1.00 0.00 N ATOM 910 CA ALA A 385 -11.030 18.741 23.722 1.00 0.00 C ATOM 911 C ALA A 385 -12.441 18.319 24.073 1.00 0.00 C ATOM 912 O ALA A 385 -12.710 17.139 24.288 1.00 0.00 O ATOM 913 CB ALA A 385 -10.998 19.386 22.345 1.00 0.00 C ATOM 0 H ALA A 385 -10.569 16.706 23.678 1.00 0.00 H new ATOM 0 HA ALA A 385 -10.701 19.476 24.456 1.00 0.00 H new ATOM 0 HB1 ALA A 385 -11.688 20.229 22.322 1.00 0.00 H new ATOM 0 HB2 ALA A 385 -9.989 19.738 22.131 1.00 0.00 H new ATOM 0 HB3 ALA A 385 -11.294 18.654 21.593 1.00 0.00 H new ATOM 919 N TRP A 386 -13.333 19.289 24.115 1.00 0.00 N ATOM 920 CA TRP A 386 -14.739 19.072 24.457 1.00 0.00 C ATOM 921 C TRP A 386 -15.440 18.189 23.422 1.00 0.00 C ATOM 922 O TRP A 386 -16.439 17.534 23.721 1.00 0.00 O ATOM 923 CB TRP A 386 -15.462 20.428 24.502 1.00 0.00 C ATOM 924 CG TRP A 386 -15.627 21.054 23.136 1.00 0.00 C ATOM 925 CD1 TRP A 386 -14.688 21.745 22.426 1.00 0.00 C ATOM 926 CD2 TRP A 386 -16.800 21.017 22.312 1.00 0.00 C ATOM 927 NE1 TRP A 386 -15.204 22.143 21.220 1.00 0.00 N ATOM 928 CE2 TRP A 386 -16.499 21.710 21.126 1.00 0.00 C ATOM 929 CE3 TRP A 386 -18.075 20.466 22.465 1.00 0.00 C ATOM 930 CZ2 TRP A 386 -17.422 21.865 20.100 1.00 0.00 C ATOM 931 CZ3 TRP A 386 -18.991 20.621 21.444 1.00 0.00 C ATOM 932 CH2 TRP A 386 -18.660 21.315 20.276 1.00 0.00 C ATOM 0 H TRP A 386 -13.107 20.263 23.912 1.00 0.00 H new ATOM 0 HA TRP A 386 -14.775 18.573 25.426 1.00 0.00 H new ATOM 0 HB2 TRP A 386 -16.444 20.295 24.956 1.00 0.00 H new ATOM 0 HB3 TRP A 386 -14.904 21.110 25.143 1.00 0.00 H new ATOM 0 HD1 TRP A 386 -13.683 21.949 22.766 1.00 0.00 H new ATOM 0 HE1 TRP A 386 -14.704 22.675 20.508 1.00 0.00 H new ATOM 0 HE3 TRP A 386 -18.339 19.929 23.364 1.00 0.00 H new ATOM 0 HZ2 TRP A 386 -17.170 22.400 19.196 1.00 0.00 H new ATOM 0 HZ3 TRP A 386 -19.980 20.199 21.549 1.00 0.00 H new ATOM 0 HH2 TRP A 386 -19.400 21.418 19.496 1.00 0.00 H new ATOM 943 N TYR A 387 -14.908 18.181 22.219 1.00 0.00 N ATOM 944 CA TYR A 387 -15.553 17.536 21.102 1.00 0.00 C ATOM 945 C TYR A 387 -15.165 16.066 20.958 1.00 0.00 C ATOM 946 O TYR A 387 -14.014 15.678 21.172 1.00 0.00 O ATOM 947 CB TYR A 387 -15.231 18.309 19.823 1.00 0.00 C ATOM 948 CG TYR A 387 -15.936 17.791 18.585 1.00 0.00 C ATOM 949 CD1 TYR A 387 -17.321 17.821 18.482 1.00 0.00 C ATOM 950 CD2 TYR A 387 -15.210 17.275 17.520 1.00 0.00 C ATOM 951 CE1 TYR A 387 -17.963 17.348 17.352 1.00 0.00 C ATOM 952 CE2 TYR A 387 -15.842 16.802 16.387 1.00 0.00 C ATOM 953 CZ TYR A 387 -17.218 16.840 16.307 1.00 0.00 C ATOM 954 OH TYR A 387 -17.853 16.367 15.176 1.00 0.00 O ATOM 0 H TYR A 387 -14.017 18.622 21.990 1.00 0.00 H new ATOM 0 HA TYR A 387 -16.627 17.547 21.286 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -15.499 19.356 19.968 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -14.155 18.276 19.654 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -17.906 18.220 19.297 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -14.132 17.243 17.579 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -19.041 17.376 17.288 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -15.261 16.404 15.568 1.00 0.00 H new ATOM 0 HH TYR A 387 -17.184 16.046 14.536 1.00 0.00 H new ATOM 964 N ASN A 388 -16.148 15.264 20.605 1.00 0.00 N ATOM 965 CA ASN A 388 -15.963 13.851 20.345 1.00 0.00 C ATOM 966 C ASN A 388 -16.348 13.558 18.905 1.00 0.00 C ATOM 967 O ASN A 388 -17.290 14.153 18.376 1.00 0.00 O ATOM 968 CB ASN A 388 -16.808 13.011 21.313 1.00 0.00 C ATOM 969 CG ASN A 388 -16.887 11.547 20.916 1.00 0.00 C ATOM 970 OD1 ASN A 388 -16.022 10.748 21.269 1.00 0.00 O ATOM 971 ND2 ASN A 388 -17.936 11.186 20.199 1.00 0.00 N ATOM 0 H ASN A 388 -17.111 15.579 20.489 1.00 0.00 H new ATOM 0 HA ASN A 388 -14.917 13.587 20.500 1.00 0.00 H new ATOM 0 HB2 ASN A 388 -16.386 13.088 22.315 1.00 0.00 H new ATOM 0 HB3 ASN A 388 -17.816 13.424 21.359 1.00 0.00 H new ATOM 0 HD21 ASN A 388 -18.051 10.212 19.918 1.00 0.00 H new ATOM 0 HD22 ASN A 388 -18.631 11.881 19.927 1.00 0.00 H new ATOM 978 N CYS A 389 -15.626 12.660 18.267 1.00 0.00 N ATOM 979 CA CYS A 389 -15.881 12.353 16.876 1.00 0.00 C ATOM 980 C CYS A 389 -16.295 10.906 16.706 1.00 0.00 C ATOM 981 O CYS A 389 -16.020 10.062 17.561 1.00 0.00 O ATOM 982 CB CYS A 389 -14.632 12.642 16.047 1.00 0.00 C ATOM 983 SG CYS A 389 -14.857 12.554 14.240 1.00 0.00 S ATOM 0 H CYS A 389 -14.861 12.132 18.688 1.00 0.00 H new ATOM 0 HA CYS A 389 -16.700 12.982 16.528 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -14.269 13.637 16.303 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -13.854 11.935 16.334 1.00 0.00 H new ATOM 988 N ASN A 390 -16.911 10.619 15.577 1.00 0.00 N ATOM 989 CA ASN A 390 -17.356 9.269 15.241 1.00 0.00 C ATOM 990 C ASN A 390 -16.188 8.440 14.720 1.00 0.00 C ATOM 991 O ASN A 390 -16.370 7.478 13.988 1.00 0.00 O ATOM 992 CB ASN A 390 -18.476 9.318 14.193 1.00 0.00 C ATOM 993 CG ASN A 390 -19.803 9.791 14.763 1.00 0.00 C ATOM 994 OD1 ASN A 390 -19.847 10.595 15.693 1.00 0.00 O ATOM 995 ND2 ASN A 390 -20.892 9.287 14.215 1.00 0.00 N ATOM 0 H ASN A 390 -17.121 11.313 14.860 1.00 0.00 H new ATOM 0 HA ASN A 390 -17.744 8.800 16.145 1.00 0.00 H new ATOM 0 HB2 ASN A 390 -18.178 9.982 13.382 1.00 0.00 H new ATOM 0 HB3 ASN A 390 -18.606 8.326 13.761 1.00 0.00 H new ATOM 0 HD21 ASN A 390 -21.811 9.562 14.561 1.00 0.00 H new ATOM 0 HD22 ASN A 390 -20.815 8.622 13.445 1.00 0.00 H new ATOM 1002 N ARG A 391 -14.990 8.823 15.133 1.00 0.00 N ATOM 1003 CA ARG A 391 -13.754 8.159 14.739 1.00 0.00 C ATOM 1004 C ARG A 391 -13.736 6.697 15.175 1.00 0.00 C ATOM 1005 O ARG A 391 -13.139 5.854 14.518 1.00 0.00 O ATOM 1006 CB ARG A 391 -12.569 8.903 15.342 1.00 0.00 C ATOM 1007 CG ARG A 391 -12.616 8.961 16.846 1.00 0.00 C ATOM 1008 CD ARG A 391 -11.788 10.089 17.387 1.00 0.00 C ATOM 1009 NE ARG A 391 -10.354 9.800 17.358 1.00 0.00 N ATOM 1010 CZ ARG A 391 -9.452 10.424 18.119 1.00 0.00 C ATOM 1011 NH1 ARG A 391 -9.827 11.408 18.930 1.00 0.00 N1+ ATOM 1012 NH2 ARG A 391 -8.175 10.072 18.058 1.00 0.00 N ATOM 0 H ARG A 391 -14.845 9.614 15.760 1.00 0.00 H new ATOM 0 HA ARG A 391 -13.687 8.175 13.651 1.00 0.00 H new ATOM 0 HB2 ARG A 391 -11.645 8.416 15.031 1.00 0.00 H new ATOM 0 HB3 ARG A 391 -12.544 9.918 14.945 1.00 0.00 H new ATOM 0 HG2 ARG A 391 -13.649 9.079 17.173 1.00 0.00 H new ATOM 0 HG3 ARG A 391 -12.258 8.017 17.257 1.00 0.00 H new ATOM 0 HD2 ARG A 391 -11.985 10.990 16.806 1.00 0.00 H new ATOM 0 HD3 ARG A 391 -12.092 10.298 18.413 1.00 0.00 H new ATOM 0 HE ARG A 391 -10.024 9.078 16.718 1.00 0.00 H new ATOM 0 HH11 ARG A 391 -10.807 11.689 18.972 1.00 0.00 H new ATOM 0 HH12 ARG A 391 -9.135 11.883 19.510 1.00 0.00 H new ATOM 0 HH21 ARG A 391 -7.882 9.324 17.429 1.00 0.00 H new ATOM 0 HH22 ARG A 391 -7.486 10.549 18.640 1.00 0.00 H new ATOM 1026 N TYR A 392 -14.376 6.416 16.295 1.00 0.00 N ATOM 1027 CA TYR A 392 -14.448 5.051 16.810 1.00 0.00 C ATOM 1028 C TYR A 392 -15.885 4.587 16.930 1.00 0.00 C ATOM 1029 O TYR A 392 -16.156 3.440 17.276 1.00 0.00 O ATOM 1030 CB TYR A 392 -13.771 4.970 18.172 1.00 0.00 C ATOM 1031 CG TYR A 392 -14.399 5.851 19.244 1.00 0.00 C ATOM 1032 CD1 TYR A 392 -14.032 7.182 19.378 1.00 0.00 C ATOM 1033 CD2 TYR A 392 -15.350 5.344 20.124 1.00 0.00 C ATOM 1034 CE1 TYR A 392 -14.591 7.984 20.352 1.00 0.00 C ATOM 1035 CE2 TYR A 392 -15.913 6.142 21.103 1.00 0.00 C ATOM 1036 CZ TYR A 392 -15.529 7.460 21.212 1.00 0.00 C ATOM 1037 OH TYR A 392 -16.083 8.260 22.191 1.00 0.00 O ATOM 0 H TYR A 392 -14.855 7.110 16.869 1.00 0.00 H new ATOM 0 HA TYR A 392 -13.932 4.399 16.106 1.00 0.00 H new ATOM 0 HB2 TYR A 392 -13.792 3.935 18.513 1.00 0.00 H new ATOM 0 HB3 TYR A 392 -12.723 5.248 18.060 1.00 0.00 H new ATOM 0 HD1 TYR A 392 -13.295 7.598 18.707 1.00 0.00 H new ATOM 0 HD2 TYR A 392 -15.653 4.311 20.041 1.00 0.00 H new ATOM 0 HE1 TYR A 392 -14.294 9.019 20.439 1.00 0.00 H new ATOM 0 HE2 TYR A 392 -16.650 5.734 21.779 1.00 0.00 H new ATOM 0 HH TYR A 392 -15.838 9.195 22.027 1.00 0.00 H new ATOM 1047 N ASN A 393 -16.788 5.471 16.632 1.00 0.00 N ATOM 1048 CA ASN A 393 -18.208 5.194 16.780 1.00 0.00 C ATOM 1049 C ASN A 393 -18.949 5.260 15.451 1.00 0.00 C ATOM 1050 O ASN A 393 -19.026 6.313 14.824 1.00 0.00 O ATOM 1051 CB ASN A 393 -18.827 6.185 17.777 1.00 0.00 C ATOM 1052 CG ASN A 393 -20.343 6.094 17.855 1.00 0.00 C ATOM 1053 OD1 ASN A 393 -20.892 5.299 18.613 1.00 0.00 O ATOM 1054 ND2 ASN A 393 -21.029 6.923 17.086 1.00 0.00 N ATOM 0 H ASN A 393 -16.576 6.405 16.280 1.00 0.00 H new ATOM 0 HA ASN A 393 -18.309 4.176 17.157 1.00 0.00 H new ATOM 0 HB2 ASN A 393 -18.408 6.003 18.767 1.00 0.00 H new ATOM 0 HB3 ASN A 393 -18.545 7.199 17.493 1.00 0.00 H new ATOM 0 HD21 ASN A 393 -22.049 6.916 17.110 1.00 0.00 H new ATOM 0 HD22 ASN A 393 -20.538 7.570 16.469 1.00 0.00 H new ATOM 1061 N GLU A 394 -19.488 4.133 15.026 1.00 0.00 N ATOM 1062 CA GLU A 394 -20.303 4.091 13.826 1.00 0.00 C ATOM 1063 C GLU A 394 -21.737 4.421 14.174 1.00 0.00 C ATOM 1064 O GLU A 394 -22.186 4.173 15.296 1.00 0.00 O ATOM 1065 CB GLU A 394 -20.241 2.717 13.165 1.00 0.00 C ATOM 1066 CG GLU A 394 -19.020 2.495 12.294 1.00 0.00 C ATOM 1067 CD GLU A 394 -19.062 3.329 11.033 1.00 0.00 C ATOM 1068 OE1 GLU A 394 -19.895 3.042 10.158 1.00 0.00 O1- ATOM 1069 OE2 GLU A 394 -18.270 4.281 10.913 1.00 0.00 O ATOM 0 H GLU A 394 -19.376 3.234 15.494 1.00 0.00 H new ATOM 0 HA GLU A 394 -19.913 4.827 13.123 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -20.262 1.952 13.942 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -21.135 2.579 12.558 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -18.122 2.740 12.861 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -18.952 1.440 12.028 1.00 0.00 H new ATOM 1076 N ASP A 395 -22.454 4.980 13.230 1.00 0.00 N ATOM 1077 CA ASP A 395 -23.850 5.321 13.448 1.00 0.00 C ATOM 1078 C ASP A 395 -24.723 4.090 13.286 1.00 0.00 C ATOM 1079 O ASP A 395 -25.782 3.972 13.905 1.00 0.00 O ATOM 1080 CB ASP A 395 -24.306 6.421 12.489 1.00 0.00 C ATOM 1081 CG ASP A 395 -25.768 6.779 12.678 1.00 0.00 C ATOM 1082 OD1 ASP A 395 -26.078 7.576 13.594 1.00 0.00 O ATOM 1083 OD2 ASP A 395 -26.612 6.264 11.918 1.00 0.00 O1- ATOM 0 H ASP A 395 -22.100 5.211 12.302 1.00 0.00 H new ATOM 0 HA ASP A 395 -23.950 5.697 14.466 1.00 0.00 H new ATOM 0 HB2 ASP A 395 -23.694 7.310 12.642 1.00 0.00 H new ATOM 0 HB3 ASP A 395 -24.144 6.095 11.462 1.00 0.00 H new ATOM 1088 N ASP A 396 -24.272 3.174 12.461 1.00 0.00 N ATOM 1089 CA ASP A 396 -24.992 1.944 12.229 1.00 0.00 C ATOM 1090 C ASP A 396 -24.658 0.931 13.306 1.00 0.00 C ATOM 1091 O ASP A 396 -23.598 0.282 13.210 1.00 0.00 O ATOM 1092 CB ASP A 396 -24.667 1.384 10.851 1.00 0.00 C ATOM 1093 CG ASP A 396 -25.370 0.076 10.581 1.00 0.00 C ATOM 1094 OD1 ASP A 396 -26.618 0.065 10.557 1.00 0.00 O ATOM 1095 OD2 ASP A 396 -24.681 -0.947 10.378 1.00 0.00 O1- ATOM 1096 OXT ASP A 396 -25.442 0.804 14.263 1.00 0.00 O ATOM 0 H ASP A 396 -23.402 3.259 11.935 1.00 0.00 H new ATOM 0 HA ASP A 396 -26.061 2.155 12.268 1.00 0.00 H new ATOM 0 HB2 ASP A 396 -24.952 2.110 10.090 1.00 0.00 H new ATOM 0 HB3 ASP A 396 -23.590 1.239 10.765 1.00 0.00 H new TER 1101 ASP A 396 HETATM 1102 ZN ZN A 401 -3.214 20.248 2.815 1.00 0.00 ZN HETATM 1103 ZN ZN A 402 -13.427 14.042 13.428 1.00 0.00 ZN