USER MOD reduce.3.24.130724 H: found=0, std=0, add=394, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 396 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 317 SER OG : rot -97:sc= 0.909 USER MOD Set 1.2: A 319 ASN : amide:sc= 0.956 K(o=1.9,f=-5.4!) USER MOD Single : A 310 TYR OH : rot 180:sc= 0 USER MOD Single : A 333 SER OG : rot 170:sc= -1.47 USER MOD Single : A 334 TYR OH : rot -77:sc= -0.111 USER MOD Single : A 335 HIS : no HE2:sc= -9.22! C(o=-9.2!,f=-13!) USER MOD Single : A 336 THR OG1 : rot 118:sc= 0.611! USER MOD Single : A 344 HIS : no HD1:sc= -0.0616 X(o=-0.062,f=-0.062) USER MOD Single : A 348 LYS NZ :NH3+ 157:sc= -0.0621 (180deg=-0.523) USER MOD Single : A 355 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 359 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 306 6.480 14.901 5.751 1.00 0.00 N ATOM 2 CA ALA A 306 5.219 15.673 5.927 1.00 0.00 C ATOM 3 C ALA A 306 4.033 14.707 5.987 1.00 0.00 C ATOM 4 O ALA A 306 4.104 13.592 5.510 1.00 0.00 O ATOM 5 CB ALA A 306 5.037 16.631 4.747 1.00 0.00 C ATOM 0 HA ALA A 306 5.270 16.244 6.854 1.00 0.00 H new ATOM 0 HB1 ALA A 306 4.114 17.196 4.876 1.00 0.00 H new ATOM 0 HB2 ALA A 306 5.881 17.320 4.704 1.00 0.00 H new ATOM 0 HB3 ALA A 306 4.987 16.060 3.820 1.00 0.00 H new ATOM 13 N VAL A 307 2.943 15.126 6.570 1.00 0.00 N ATOM 14 CA VAL A 307 1.756 14.232 6.660 1.00 0.00 C ATOM 15 C VAL A 307 1.288 13.860 5.252 1.00 0.00 C ATOM 16 O VAL A 307 0.908 12.736 4.990 1.00 0.00 O ATOM 17 CB VAL A 307 0.627 14.954 7.398 1.00 0.00 C ATOM 18 CG1 VAL A 307 -0.651 14.116 7.325 1.00 0.00 C ATOM 19 CG2 VAL A 307 1.022 15.151 8.863 1.00 0.00 C ATOM 0 H VAL A 307 2.824 16.049 6.988 1.00 0.00 H new ATOM 0 HA VAL A 307 2.025 13.327 7.204 1.00 0.00 H new ATOM 0 HB VAL A 307 0.452 15.924 6.933 1.00 0.00 H new ATOM 0 HG11 VAL A 307 -1.455 14.631 7.851 1.00 0.00 H new ATOM 0 HG12 VAL A 307 -0.933 13.973 6.282 1.00 0.00 H new ATOM 0 HG13 VAL A 307 -0.477 13.146 7.790 1.00 0.00 H new ATOM 0 HG21 VAL A 307 0.219 15.665 9.390 1.00 0.00 H new ATOM 0 HG22 VAL A 307 1.197 14.180 9.326 1.00 0.00 H new ATOM 0 HG23 VAL A 307 1.932 15.748 8.917 1.00 0.00 H new ATOM 29 N ASP A 308 1.315 14.793 4.340 1.00 0.00 N ATOM 30 CA ASP A 308 0.872 14.490 2.950 1.00 0.00 C ATOM 31 C ASP A 308 2.049 13.925 2.151 1.00 0.00 C ATOM 32 O ASP A 308 1.968 13.744 0.953 1.00 0.00 O ATOM 33 CB ASP A 308 0.365 15.772 2.285 1.00 0.00 C ATOM 34 CG ASP A 308 1.512 16.780 2.159 1.00 0.00 C ATOM 35 OD1 ASP A 308 2.648 16.387 2.364 1.00 0.00 O ATOM 36 OD2 ASP A 308 1.232 17.929 1.860 1.00 0.00 O ATOM 0 H ASP A 308 1.625 15.752 4.498 1.00 0.00 H new ATOM 0 HA ASP A 308 0.068 13.755 2.976 1.00 0.00 H new ATOM 0 HB2 ASP A 308 -0.042 15.545 1.300 1.00 0.00 H new ATOM 0 HB3 ASP A 308 -0.446 16.202 2.873 1.00 0.00 H new ATOM 41 N LEU A 309 3.142 13.649 2.808 1.00 0.00 N ATOM 42 CA LEU A 309 4.326 13.099 2.090 1.00 0.00 C ATOM 43 C LEU A 309 3.946 11.790 1.392 1.00 0.00 C ATOM 44 O LEU A 309 4.413 11.500 0.308 1.00 0.00 O ATOM 45 CB LEU A 309 5.451 12.835 3.093 1.00 0.00 C ATOM 46 CG LEU A 309 6.711 12.387 2.345 1.00 0.00 C ATOM 47 CD1 LEU A 309 7.266 13.552 1.519 1.00 0.00 C ATOM 48 CD2 LEU A 309 7.766 11.934 3.355 1.00 0.00 C ATOM 0 H LEU A 309 3.266 13.781 3.812 1.00 0.00 H new ATOM 0 HA LEU A 309 4.663 13.819 1.344 1.00 0.00 H new ATOM 0 HB2 LEU A 309 5.659 13.737 3.668 1.00 0.00 H new ATOM 0 HB3 LEU A 309 5.145 12.067 3.804 1.00 0.00 H new ATOM 0 HG LEU A 309 6.460 11.561 1.679 1.00 0.00 H new ATOM 0 HD11 LEU A 309 8.162 13.228 0.989 1.00 0.00 H new ATOM 0 HD12 LEU A 309 6.516 13.877 0.798 1.00 0.00 H new ATOM 0 HD13 LEU A 309 7.516 14.381 2.181 1.00 0.00 H new ATOM 0 HD21 LEU A 309 8.663 11.615 2.825 1.00 0.00 H new ATOM 0 HD22 LEU A 309 8.012 12.762 4.020 1.00 0.00 H new ATOM 0 HD23 LEU A 309 7.375 11.102 3.941 1.00 0.00 H new ATOM 60 N TYR A 310 3.109 10.995 2.007 1.00 0.00 N ATOM 61 CA TYR A 310 2.705 9.702 1.382 1.00 0.00 C ATOM 62 C TYR A 310 1.226 9.736 0.995 1.00 0.00 C ATOM 63 O TYR A 310 0.363 10.019 1.803 1.00 0.00 O ATOM 64 CB TYR A 310 2.940 8.560 2.372 1.00 0.00 C ATOM 65 CG TYR A 310 4.366 8.078 2.260 1.00 0.00 C ATOM 66 CD1 TYR A 310 4.697 7.102 1.313 1.00 0.00 C ATOM 67 CD2 TYR A 310 5.355 8.604 3.101 1.00 0.00 C ATOM 68 CE1 TYR A 310 6.017 6.650 1.206 1.00 0.00 C ATOM 69 CE2 TYR A 310 6.676 8.150 2.993 1.00 0.00 C ATOM 70 CZ TYR A 310 7.007 7.173 2.046 1.00 0.00 C ATOM 71 OH TYR A 310 8.308 6.726 1.941 1.00 0.00 O ATOM 0 H TYR A 310 2.688 11.186 2.916 1.00 0.00 H new ATOM 0 HA TYR A 310 3.304 9.545 0.485 1.00 0.00 H new ATOM 0 HB2 TYR A 310 2.739 8.899 3.388 1.00 0.00 H new ATOM 0 HB3 TYR A 310 2.251 7.740 2.167 1.00 0.00 H new ATOM 0 HD1 TYR A 310 3.934 6.698 0.665 1.00 0.00 H new ATOM 0 HD2 TYR A 310 5.100 9.358 3.831 1.00 0.00 H new ATOM 0 HE1 TYR A 310 6.272 5.897 0.475 1.00 0.00 H new ATOM 0 HE2 TYR A 310 7.440 8.554 3.641 1.00 0.00 H new ATOM 0 HH TYR A 310 8.868 7.192 2.596 1.00 0.00 H new ATOM 81 N VAL A 311 0.932 9.432 -0.239 1.00 0.00 N ATOM 82 CA VAL A 311 -0.484 9.421 -0.702 1.00 0.00 C ATOM 83 C VAL A 311 -0.724 8.140 -1.502 1.00 0.00 C ATOM 84 O VAL A 311 0.206 7.515 -1.972 1.00 0.00 O ATOM 85 CB VAL A 311 -0.743 10.639 -1.590 1.00 0.00 C ATOM 86 CG1 VAL A 311 -0.418 11.916 -0.814 1.00 0.00 C ATOM 87 CG2 VAL A 311 0.145 10.559 -2.833 1.00 0.00 C ATOM 0 H VAL A 311 1.619 9.189 -0.953 1.00 0.00 H new ATOM 0 HA VAL A 311 -1.158 9.458 0.154 1.00 0.00 H new ATOM 0 HB VAL A 311 -1.791 10.654 -1.890 1.00 0.00 H new ATOM 0 HG11 VAL A 311 -0.603 12.784 -1.447 1.00 0.00 H new ATOM 0 HG12 VAL A 311 -1.049 11.973 0.073 1.00 0.00 H new ATOM 0 HG13 VAL A 311 0.630 11.903 -0.514 1.00 0.00 H new ATOM 0 HG21 VAL A 311 -0.038 11.426 -3.467 1.00 0.00 H new ATOM 0 HG22 VAL A 311 1.192 10.544 -2.532 1.00 0.00 H new ATOM 0 HG23 VAL A 311 -0.086 9.649 -3.387 1.00 0.00 H new ATOM 97 N CYS A 312 -1.954 7.735 -1.669 1.00 0.00 N ATOM 98 CA CYS A 312 -2.212 6.494 -2.447 1.00 0.00 C ATOM 99 C CYS A 312 -2.263 6.838 -3.936 1.00 0.00 C ATOM 100 O CYS A 312 -3.059 7.647 -4.370 1.00 0.00 O ATOM 101 CB CYS A 312 -3.539 5.875 -2.006 1.00 0.00 C ATOM 102 SG CYS A 312 -4.016 4.572 -3.166 1.00 0.00 S ATOM 0 H CYS A 312 -2.782 8.205 -1.304 1.00 0.00 H new ATOM 0 HA CYS A 312 -1.413 5.775 -2.269 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -3.444 5.464 -1.001 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -4.313 6.641 -1.965 1.00 0.00 H new ATOM 107 N LEU A 313 -1.411 6.236 -4.721 1.00 0.00 N ATOM 108 CA LEU A 313 -1.400 6.536 -6.179 1.00 0.00 C ATOM 109 C LEU A 313 -2.739 6.138 -6.800 1.00 0.00 C ATOM 110 O LEU A 313 -3.251 6.804 -7.677 1.00 0.00 O ATOM 111 CB LEU A 313 -0.273 5.748 -6.851 1.00 0.00 C ATOM 112 CG LEU A 313 1.074 6.430 -6.585 1.00 0.00 C ATOM 113 CD1 LEU A 313 1.113 7.789 -7.288 1.00 0.00 C ATOM 114 CD2 LEU A 313 1.264 6.632 -5.080 1.00 0.00 C ATOM 0 H LEU A 313 -0.722 5.549 -4.414 1.00 0.00 H new ATOM 0 HA LEU A 313 -1.239 7.604 -6.326 1.00 0.00 H new ATOM 0 HB2 LEU A 313 -0.255 4.727 -6.470 1.00 0.00 H new ATOM 0 HB3 LEU A 313 -0.452 5.684 -7.924 1.00 0.00 H new ATOM 0 HG LEU A 313 1.875 5.798 -6.970 1.00 0.00 H new ATOM 0 HD11 LEU A 313 2.072 8.270 -7.096 1.00 0.00 H new ATOM 0 HD12 LEU A 313 0.986 7.647 -8.361 1.00 0.00 H new ATOM 0 HD13 LEU A 313 0.309 8.419 -6.908 1.00 0.00 H new ATOM 0 HD21 LEU A 313 2.223 7.117 -4.896 1.00 0.00 H new ATOM 0 HD22 LEU A 313 0.460 7.258 -4.693 1.00 0.00 H new ATOM 0 HD23 LEU A 313 1.244 5.665 -4.578 1.00 0.00 H new ATOM 126 N LEU A 314 -3.308 5.052 -6.357 1.00 0.00 N ATOM 127 CA LEU A 314 -4.607 4.605 -6.923 1.00 0.00 C ATOM 128 C LEU A 314 -5.682 5.657 -6.650 1.00 0.00 C ATOM 129 O LEU A 314 -6.546 5.901 -7.470 1.00 0.00 O ATOM 130 CB LEU A 314 -5.004 3.288 -6.264 1.00 0.00 C ATOM 131 CG LEU A 314 -3.864 2.282 -6.423 1.00 0.00 C ATOM 132 CD1 LEU A 314 -4.273 0.954 -5.792 1.00 0.00 C ATOM 133 CD2 LEU A 314 -3.572 2.073 -7.910 1.00 0.00 C ATOM 0 H LEU A 314 -2.926 4.454 -5.624 1.00 0.00 H new ATOM 0 HA LEU A 314 -4.510 4.469 -8.000 1.00 0.00 H new ATOM 0 HB2 LEU A 314 -5.220 3.447 -5.207 1.00 0.00 H new ATOM 0 HB3 LEU A 314 -5.914 2.899 -6.720 1.00 0.00 H new ATOM 0 HG LEU A 314 -2.969 2.661 -5.929 1.00 0.00 H new ATOM 0 HD11 LEU A 314 -3.463 0.233 -5.903 1.00 0.00 H new ATOM 0 HD12 LEU A 314 -4.483 1.104 -4.733 1.00 0.00 H new ATOM 0 HD13 LEU A 314 -5.166 0.575 -6.289 1.00 0.00 H new ATOM 0 HD21 LEU A 314 -2.759 1.356 -8.024 1.00 0.00 H new ATOM 0 HD22 LEU A 314 -4.465 1.692 -8.406 1.00 0.00 H new ATOM 0 HD23 LEU A 314 -3.284 3.022 -8.361 1.00 0.00 H new ATOM 145 N CYS A 315 -5.637 6.280 -5.505 1.00 0.00 N ATOM 146 CA CYS A 315 -6.658 7.316 -5.174 1.00 0.00 C ATOM 147 C CYS A 315 -5.961 8.595 -4.704 1.00 0.00 C ATOM 148 O CYS A 315 -6.142 9.656 -5.268 1.00 0.00 O ATOM 149 CB CYS A 315 -7.575 6.796 -4.064 1.00 0.00 C ATOM 150 SG CYS A 315 -7.618 4.982 -4.098 1.00 0.00 S ATOM 0 H CYS A 315 -4.936 6.117 -4.782 1.00 0.00 H new ATOM 0 HA CYS A 315 -7.251 7.534 -6.062 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -7.218 7.142 -3.094 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -8.581 7.195 -4.195 1.00 0.00 H new ATOM 155 N GLY A 316 -5.168 8.504 -3.673 1.00 0.00 N ATOM 156 CA GLY A 316 -4.460 9.713 -3.161 1.00 0.00 C ATOM 157 C GLY A 316 -5.436 10.572 -2.355 1.00 0.00 C ATOM 158 O GLY A 316 -5.451 11.782 -2.462 1.00 0.00 O ATOM 0 H GLY A 316 -4.979 7.643 -3.161 1.00 0.00 H new ATOM 0 HA2 GLY A 316 -3.618 9.417 -2.536 1.00 0.00 H new ATOM 0 HA3 GLY A 316 -4.053 10.289 -3.992 1.00 0.00 H new ATOM 162 N SER A 317 -6.256 9.951 -1.554 1.00 0.00 N ATOM 163 CA SER A 317 -7.242 10.726 -0.743 1.00 0.00 C ATOM 164 C SER A 317 -6.510 11.688 0.196 1.00 0.00 C ATOM 165 O SER A 317 -6.927 12.811 0.399 1.00 0.00 O ATOM 166 CB SER A 317 -8.091 9.759 0.082 1.00 0.00 C ATOM 167 OG SER A 317 -9.144 10.477 0.711 1.00 0.00 O ATOM 0 H SER A 317 -6.288 8.940 -1.424 1.00 0.00 H new ATOM 0 HA SER A 317 -7.882 11.300 -1.413 1.00 0.00 H new ATOM 0 HB2 SER A 317 -8.500 8.978 -0.559 1.00 0.00 H new ATOM 0 HB3 SER A 317 -7.474 9.264 0.832 1.00 0.00 H new ATOM 0 HG SER A 317 -8.889 10.692 1.632 1.00 0.00 H new ATOM 173 N GLY A 318 -5.425 11.255 0.772 1.00 0.00 N ATOM 174 CA GLY A 318 -4.666 12.139 1.702 1.00 0.00 C ATOM 175 C GLY A 318 -5.015 11.776 3.147 1.00 0.00 C ATOM 176 O GLY A 318 -4.169 11.773 4.019 1.00 0.00 O ATOM 0 H GLY A 318 -5.029 10.325 0.639 1.00 0.00 H new ATOM 0 HA2 GLY A 318 -3.595 12.026 1.536 1.00 0.00 H new ATOM 0 HA3 GLY A 318 -4.910 13.184 1.509 1.00 0.00 H new ATOM 180 N ASN A 319 -6.255 11.458 3.404 1.00 0.00 N ATOM 181 CA ASN A 319 -6.657 11.083 4.790 1.00 0.00 C ATOM 182 C ASN A 319 -6.642 9.560 4.912 1.00 0.00 C ATOM 183 O ASN A 319 -6.845 9.003 5.973 1.00 0.00 O ATOM 184 CB ASN A 319 -8.068 11.601 5.071 1.00 0.00 C ATOM 185 CG ASN A 319 -9.074 10.801 4.242 1.00 0.00 C ATOM 186 OD1 ASN A 319 -9.271 11.076 3.075 1.00 0.00 O ATOM 187 ND2 ASN A 319 -9.721 9.812 4.796 1.00 0.00 N ATOM 0 H ASN A 319 -7.007 11.442 2.715 1.00 0.00 H new ATOM 0 HA ASN A 319 -5.964 11.521 5.508 1.00 0.00 H new ATOM 0 HB2 ASN A 319 -8.298 11.507 6.132 1.00 0.00 H new ATOM 0 HB3 ASN A 319 -8.135 12.660 4.823 1.00 0.00 H new ATOM 0 HD21 ASN A 319 -10.391 9.271 4.249 1.00 0.00 H new ATOM 0 HD22 ASN A 319 -9.557 9.580 5.776 1.00 0.00 H new ATOM 194 N ASP A 320 -6.402 8.890 3.822 1.00 0.00 N ATOM 195 CA ASP A 320 -6.364 7.407 3.830 1.00 0.00 C ATOM 196 C ASP A 320 -4.965 6.937 4.232 1.00 0.00 C ATOM 197 O ASP A 320 -4.707 5.757 4.368 1.00 0.00 O ATOM 198 CB ASP A 320 -6.707 6.895 2.434 1.00 0.00 C ATOM 199 CG ASP A 320 -8.171 7.206 2.122 1.00 0.00 C ATOM 200 OD1 ASP A 320 -8.886 7.579 3.038 1.00 0.00 O ATOM 201 OD2 ASP A 320 -8.554 7.064 0.972 1.00 0.00 O ATOM 0 H ASP A 320 -6.228 9.316 2.912 1.00 0.00 H new ATOM 0 HA ASP A 320 -7.088 7.018 4.546 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -6.059 7.364 1.694 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -6.532 5.821 2.376 1.00 0.00 H new ATOM 206 N GLU A 321 -4.056 7.856 4.407 1.00 0.00 N ATOM 207 CA GLU A 321 -2.664 7.485 4.780 1.00 0.00 C ATOM 208 C GLU A 321 -2.674 6.570 6.006 1.00 0.00 C ATOM 209 O GLU A 321 -1.763 5.794 6.217 1.00 0.00 O ATOM 210 CB GLU A 321 -1.883 8.757 5.104 1.00 0.00 C ATOM 211 CG GLU A 321 -1.792 9.633 3.854 1.00 0.00 C ATOM 212 CD GLU A 321 -0.960 10.877 4.164 1.00 0.00 C ATOM 213 OE1 GLU A 321 -0.670 11.093 5.329 1.00 0.00 O ATOM 214 OE2 GLU A 321 -0.628 11.591 3.234 1.00 0.00 O ATOM 0 H GLU A 321 -4.221 8.858 4.306 1.00 0.00 H new ATOM 0 HA GLU A 321 -2.195 6.958 3.949 1.00 0.00 H new ATOM 0 HB2 GLU A 321 -2.375 9.303 5.909 1.00 0.00 H new ATOM 0 HB3 GLU A 321 -0.883 8.503 5.456 1.00 0.00 H new ATOM 0 HG2 GLU A 321 -1.338 9.073 3.037 1.00 0.00 H new ATOM 0 HG3 GLU A 321 -2.790 9.922 3.526 1.00 0.00 H new ATOM 221 N ASP A 322 -3.687 6.653 6.820 1.00 0.00 N ATOM 222 CA ASP A 322 -3.739 5.790 8.029 1.00 0.00 C ATOM 223 C ASP A 322 -3.666 4.314 7.624 1.00 0.00 C ATOM 224 O ASP A 322 -3.045 3.513 8.296 1.00 0.00 O ATOM 225 CB ASP A 322 -5.048 6.052 8.774 1.00 0.00 C ATOM 226 CG ASP A 322 -5.033 7.468 9.352 1.00 0.00 C ATOM 227 OD1 ASP A 322 -3.976 8.077 9.350 1.00 0.00 O ATOM 228 OD2 ASP A 322 -6.080 7.921 9.785 1.00 0.00 O ATOM 0 H ASP A 322 -4.481 7.282 6.700 1.00 0.00 H new ATOM 0 HA ASP A 322 -2.892 6.021 8.675 1.00 0.00 H new ATOM 0 HB2 ASP A 322 -5.894 5.933 8.097 1.00 0.00 H new ATOM 0 HB3 ASP A 322 -5.175 5.323 9.574 1.00 0.00 H new ATOM 233 N ARG A 323 -4.295 3.944 6.538 1.00 0.00 N ATOM 234 CA ARG A 323 -4.262 2.516 6.099 1.00 0.00 C ATOM 235 C ARG A 323 -3.453 2.368 4.807 1.00 0.00 C ATOM 236 O ARG A 323 -3.469 1.331 4.177 1.00 0.00 O ATOM 237 CB ARG A 323 -5.687 2.009 5.872 1.00 0.00 C ATOM 238 CG ARG A 323 -6.444 2.023 7.201 1.00 0.00 C ATOM 239 CD ARG A 323 -7.791 1.320 7.033 1.00 0.00 C ATOM 240 NE ARG A 323 -8.658 1.620 8.208 1.00 0.00 N ATOM 241 CZ ARG A 323 -8.345 1.158 9.389 1.00 0.00 C ATOM 242 NH1 ARG A 323 -7.281 0.419 9.541 1.00 0.00 N ATOM 243 NH2 ARG A 323 -9.100 1.433 10.416 1.00 0.00 N ATOM 0 H ARG A 323 -4.830 4.569 5.936 1.00 0.00 H new ATOM 0 HA ARG A 323 -3.785 1.925 6.881 1.00 0.00 H new ATOM 0 HB2 ARG A 323 -6.197 2.638 5.142 1.00 0.00 H new ATOM 0 HB3 ARG A 323 -5.665 0.999 5.463 1.00 0.00 H new ATOM 0 HG2 ARG A 323 -5.856 1.524 7.971 1.00 0.00 H new ATOM 0 HG3 ARG A 323 -6.597 3.050 7.533 1.00 0.00 H new ATOM 0 HD2 ARG A 323 -8.276 1.654 6.115 1.00 0.00 H new ATOM 0 HD3 ARG A 323 -7.643 0.244 6.942 1.00 0.00 H new ATOM 0 HE ARG A 323 -9.497 2.187 8.089 1.00 0.00 H new ATOM 0 HH11 ARG A 323 -6.692 0.201 8.737 1.00 0.00 H new ATOM 0 HH12 ARG A 323 -7.038 0.059 10.464 1.00 0.00 H new ATOM 0 HH21 ARG A 323 -9.934 2.008 10.297 1.00 0.00 H new ATOM 0 HH22 ARG A 323 -8.857 1.073 11.339 1.00 0.00 H new ATOM 257 N LEU A 324 -2.741 3.386 4.409 1.00 0.00 N ATOM 258 CA LEU A 324 -1.934 3.278 3.162 1.00 0.00 C ATOM 259 C LEU A 324 -0.754 2.338 3.411 1.00 0.00 C ATOM 260 O LEU A 324 0.000 2.503 4.350 1.00 0.00 O ATOM 261 CB LEU A 324 -1.429 4.669 2.762 1.00 0.00 C ATOM 262 CG LEU A 324 -0.477 4.567 1.568 1.00 0.00 C ATOM 263 CD1 LEU A 324 -1.214 3.961 0.375 1.00 0.00 C ATOM 264 CD2 LEU A 324 0.020 5.966 1.196 1.00 0.00 C ATOM 0 H LEU A 324 -2.683 4.283 4.891 1.00 0.00 H new ATOM 0 HA LEU A 324 -2.546 2.878 2.353 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -2.273 5.311 2.509 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -0.917 5.134 3.605 1.00 0.00 H new ATOM 0 HG LEU A 324 0.369 3.933 1.833 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -0.534 3.889 -0.474 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -1.574 2.966 0.637 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -2.060 4.595 0.110 1.00 0.00 H new ATOM 0 HD21 LEU A 324 0.698 5.897 0.346 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -0.830 6.596 0.932 1.00 0.00 H new ATOM 0 HD23 LEU A 324 0.546 6.403 2.045 1.00 0.00 H new ATOM 276 N LEU A 325 -0.599 1.343 2.582 1.00 0.00 N ATOM 277 CA LEU A 325 0.517 0.377 2.768 1.00 0.00 C ATOM 278 C LEU A 325 1.637 0.680 1.771 1.00 0.00 C ATOM 279 O LEU A 325 1.410 0.789 0.583 1.00 0.00 O ATOM 280 CB LEU A 325 -0.012 -1.044 2.530 1.00 0.00 C ATOM 281 CG LEU A 325 1.031 -2.084 2.960 1.00 0.00 C ATOM 282 CD1 LEU A 325 0.313 -3.312 3.524 1.00 0.00 C ATOM 283 CD2 LEU A 325 1.873 -2.510 1.750 1.00 0.00 C ATOM 0 H LEU A 325 -1.201 1.158 1.780 1.00 0.00 H new ATOM 0 HA LEU A 325 0.911 0.462 3.781 1.00 0.00 H new ATOM 0 HB2 LEU A 325 -0.935 -1.193 3.090 1.00 0.00 H new ATOM 0 HB3 LEU A 325 -0.253 -1.177 1.475 1.00 0.00 H new ATOM 0 HG LEU A 325 1.681 -1.648 3.719 1.00 0.00 H new ATOM 0 HD11 LEU A 325 1.049 -4.055 3.831 1.00 0.00 H new ATOM 0 HD12 LEU A 325 -0.288 -3.019 4.385 1.00 0.00 H new ATOM 0 HD13 LEU A 325 -0.335 -3.739 2.758 1.00 0.00 H new ATOM 0 HD21 LEU A 325 2.611 -3.248 2.062 1.00 0.00 H new ATOM 0 HD22 LEU A 325 1.224 -2.945 0.990 1.00 0.00 H new ATOM 0 HD23 LEU A 325 2.383 -1.640 1.337 1.00 0.00 H new ATOM 295 N LEU A 326 2.847 0.804 2.245 1.00 0.00 N ATOM 296 CA LEU A 326 3.982 1.084 1.325 1.00 0.00 C ATOM 297 C LEU A 326 4.618 -0.243 0.911 1.00 0.00 C ATOM 298 O LEU A 326 4.835 -1.120 1.724 1.00 0.00 O ATOM 299 CB LEU A 326 5.019 1.957 2.038 1.00 0.00 C ATOM 300 CG LEU A 326 6.167 2.298 1.080 1.00 0.00 C ATOM 301 CD1 LEU A 326 5.680 3.281 0.014 1.00 0.00 C ATOM 302 CD2 LEU A 326 7.311 2.935 1.870 1.00 0.00 C ATOM 0 H LEU A 326 3.097 0.723 3.231 1.00 0.00 H new ATOM 0 HA LEU A 326 3.623 1.612 0.442 1.00 0.00 H new ATOM 0 HB2 LEU A 326 4.550 2.873 2.397 1.00 0.00 H new ATOM 0 HB3 LEU A 326 5.407 1.434 2.912 1.00 0.00 H new ATOM 0 HG LEU A 326 6.515 1.386 0.595 1.00 0.00 H new ATOM 0 HD11 LEU A 326 6.500 3.519 -0.663 1.00 0.00 H new ATOM 0 HD12 LEU A 326 4.863 2.831 -0.550 1.00 0.00 H new ATOM 0 HD13 LEU A 326 5.329 4.194 0.494 1.00 0.00 H new ATOM 0 HD21 LEU A 326 8.129 3.179 1.193 1.00 0.00 H new ATOM 0 HD22 LEU A 326 6.957 3.845 2.354 1.00 0.00 H new ATOM 0 HD23 LEU A 326 7.664 2.235 2.628 1.00 0.00 H new ATOM 314 N CYS A 327 4.904 -0.405 -0.349 1.00 0.00 N ATOM 315 CA CYS A 327 5.507 -1.681 -0.817 1.00 0.00 C ATOM 316 C CYS A 327 7.019 -1.662 -0.594 1.00 0.00 C ATOM 317 O CYS A 327 7.739 -0.906 -1.215 1.00 0.00 O ATOM 318 CB CYS A 327 5.222 -1.849 -2.307 1.00 0.00 C ATOM 319 SG CYS A 327 6.184 -3.236 -2.953 1.00 0.00 S ATOM 0 H CYS A 327 4.746 0.293 -1.076 1.00 0.00 H new ATOM 0 HA CYS A 327 5.075 -2.509 -0.256 1.00 0.00 H new ATOM 0 HB2 CYS A 327 4.158 -2.025 -2.467 1.00 0.00 H new ATOM 0 HB3 CYS A 327 5.478 -0.935 -2.842 1.00 0.00 H new ATOM 324 N ASP A 328 7.506 -2.495 0.285 1.00 0.00 N ATOM 325 CA ASP A 328 8.972 -2.536 0.541 1.00 0.00 C ATOM 326 C ASP A 328 9.696 -3.048 -0.707 1.00 0.00 C ATOM 327 O ASP A 328 10.773 -2.593 -1.042 1.00 0.00 O ATOM 328 CB ASP A 328 9.258 -3.474 1.716 1.00 0.00 C ATOM 329 CG ASP A 328 8.659 -2.887 2.996 1.00 0.00 C ATOM 330 OD1 ASP A 328 8.294 -1.724 2.977 1.00 0.00 O ATOM 331 OD2 ASP A 328 8.575 -3.613 3.974 1.00 0.00 O ATOM 0 H ASP A 328 6.951 -3.149 0.837 1.00 0.00 H new ATOM 0 HA ASP A 328 9.326 -1.533 0.780 1.00 0.00 H new ATOM 0 HB2 ASP A 328 8.832 -4.458 1.521 1.00 0.00 H new ATOM 0 HB3 ASP A 328 10.333 -3.609 1.834 1.00 0.00 H new ATOM 336 N GLY A 329 9.117 -3.996 -1.392 1.00 0.00 N ATOM 337 CA GLY A 329 9.774 -4.546 -2.615 1.00 0.00 C ATOM 338 C GLY A 329 10.018 -3.426 -3.625 1.00 0.00 C ATOM 339 O GLY A 329 11.044 -3.374 -4.275 1.00 0.00 O ATOM 0 H GLY A 329 8.217 -4.415 -1.159 1.00 0.00 H new ATOM 0 HA2 GLY A 329 10.719 -5.019 -2.349 1.00 0.00 H new ATOM 0 HA3 GLY A 329 9.146 -5.318 -3.060 1.00 0.00 H new ATOM 343 N CYS A 330 9.084 -2.527 -3.764 1.00 0.00 N ATOM 344 CA CYS A 330 9.262 -1.408 -4.733 1.00 0.00 C ATOM 345 C CYS A 330 8.518 -0.176 -4.219 1.00 0.00 C ATOM 346 O CYS A 330 7.623 -0.277 -3.406 1.00 0.00 O ATOM 347 CB CYS A 330 8.710 -1.820 -6.100 1.00 0.00 C ATOM 348 SG CYS A 330 6.939 -1.458 -6.178 1.00 0.00 S ATOM 0 H CYS A 330 8.204 -2.518 -3.248 1.00 0.00 H new ATOM 0 HA CYS A 330 10.322 -1.174 -4.835 1.00 0.00 H new ATOM 0 HB2 CYS A 330 9.235 -1.285 -6.891 1.00 0.00 H new ATOM 0 HB3 CYS A 330 8.881 -2.884 -6.266 1.00 0.00 H new ATOM 353 N ASP A 331 8.882 0.988 -4.676 1.00 0.00 N ATOM 354 CA ASP A 331 8.196 2.220 -4.195 1.00 0.00 C ATOM 355 C ASP A 331 6.767 2.259 -4.737 1.00 0.00 C ATOM 356 O ASP A 331 6.505 2.797 -5.793 1.00 0.00 O ATOM 357 CB ASP A 331 8.959 3.453 -4.684 1.00 0.00 C ATOM 358 CG ASP A 331 8.352 4.710 -4.059 1.00 0.00 C ATOM 359 OD1 ASP A 331 7.474 4.569 -3.226 1.00 0.00 O ATOM 360 OD2 ASP A 331 8.778 5.794 -4.425 1.00 0.00 O ATOM 0 H ASP A 331 9.623 1.141 -5.360 1.00 0.00 H new ATOM 0 HA ASP A 331 8.169 2.215 -3.105 1.00 0.00 H new ATOM 0 HB2 ASP A 331 10.012 3.372 -4.415 1.00 0.00 H new ATOM 0 HB3 ASP A 331 8.912 3.515 -5.771 1.00 0.00 H new ATOM 365 N ASP A 332 5.838 1.699 -4.011 1.00 0.00 N ATOM 366 CA ASP A 332 4.421 1.709 -4.472 1.00 0.00 C ATOM 367 C ASP A 332 3.496 1.730 -3.254 1.00 0.00 C ATOM 368 O ASP A 332 3.529 0.836 -2.431 1.00 0.00 O ATOM 369 CB ASP A 332 4.144 0.454 -5.303 1.00 0.00 C ATOM 370 CG ASP A 332 2.746 0.546 -5.917 1.00 0.00 C ATOM 371 OD1 ASP A 332 2.121 1.584 -5.765 1.00 0.00 O ATOM 372 OD2 ASP A 332 2.325 -0.420 -6.529 1.00 0.00 O ATOM 0 H ASP A 332 6.000 1.234 -3.117 1.00 0.00 H new ATOM 0 HA ASP A 332 4.241 2.593 -5.084 1.00 0.00 H new ATOM 0 HB2 ASP A 332 4.892 0.353 -6.089 1.00 0.00 H new ATOM 0 HB3 ASP A 332 4.219 -0.434 -4.676 1.00 0.00 H new ATOM 377 N SER A 333 2.680 2.743 -3.126 1.00 0.00 N ATOM 378 CA SER A 333 1.763 2.816 -1.953 1.00 0.00 C ATOM 379 C SER A 333 0.309 2.670 -2.410 1.00 0.00 C ATOM 380 O SER A 333 -0.120 3.277 -3.375 1.00 0.00 O ATOM 381 CB SER A 333 1.934 4.171 -1.269 1.00 0.00 C ATOM 382 OG SER A 333 3.313 4.398 -1.016 1.00 0.00 O ATOM 0 H SER A 333 2.610 3.521 -3.782 1.00 0.00 H new ATOM 0 HA SER A 333 2.005 2.009 -1.261 1.00 0.00 H new ATOM 0 HB2 SER A 333 1.533 4.963 -1.901 1.00 0.00 H new ATOM 0 HB3 SER A 333 1.373 4.193 -0.335 1.00 0.00 H new ATOM 0 HG SER A 333 3.444 5.325 -0.728 1.00 0.00 H new ATOM 388 N TYR A 334 -0.455 1.882 -1.703 1.00 0.00 N ATOM 389 CA TYR A 334 -1.890 1.692 -2.057 1.00 0.00 C ATOM 390 C TYR A 334 -2.674 1.363 -0.786 1.00 0.00 C ATOM 391 O TYR A 334 -2.119 0.906 0.193 1.00 0.00 O ATOM 392 CB TYR A 334 -2.032 0.555 -3.070 1.00 0.00 C ATOM 393 CG TYR A 334 -1.099 -0.570 -2.705 1.00 0.00 C ATOM 394 CD1 TYR A 334 -1.336 -1.334 -1.557 1.00 0.00 C ATOM 395 CD2 TYR A 334 0.001 -0.852 -3.520 1.00 0.00 C ATOM 396 CE1 TYR A 334 -0.470 -2.380 -1.222 1.00 0.00 C ATOM 397 CE2 TYR A 334 0.868 -1.899 -3.186 1.00 0.00 C ATOM 398 CZ TYR A 334 0.634 -2.663 -2.037 1.00 0.00 C ATOM 399 OH TYR A 334 1.490 -3.692 -1.706 1.00 0.00 O ATOM 0 H TYR A 334 -0.142 1.356 -0.887 1.00 0.00 H new ATOM 0 HA TYR A 334 -2.283 2.605 -2.504 1.00 0.00 H new ATOM 0 HB2 TYR A 334 -3.061 0.196 -3.086 1.00 0.00 H new ATOM 0 HB3 TYR A 334 -1.805 0.918 -4.072 1.00 0.00 H new ATOM 0 HD1 TYR A 334 -2.188 -1.116 -0.930 1.00 0.00 H new ATOM 0 HD2 TYR A 334 0.182 -0.263 -4.407 1.00 0.00 H new ATOM 0 HE1 TYR A 334 -0.652 -2.969 -0.335 1.00 0.00 H new ATOM 0 HE2 TYR A 334 1.718 -2.117 -3.815 1.00 0.00 H new ATOM 0 HH TYR A 334 2.084 -3.403 -0.982 1.00 0.00 H new ATOM 409 N HIS A 335 -3.956 1.599 -0.782 1.00 0.00 N ATOM 410 CA HIS A 335 -4.754 1.308 0.440 1.00 0.00 C ATOM 411 C HIS A 335 -4.952 -0.197 0.594 1.00 0.00 C ATOM 412 O HIS A 335 -4.899 -0.948 -0.361 1.00 0.00 O ATOM 413 CB HIS A 335 -6.112 1.996 0.343 1.00 0.00 C ATOM 414 CG HIS A 335 -5.895 3.474 0.221 1.00 0.00 C ATOM 415 ND1 HIS A 335 -6.522 4.245 -0.751 1.00 0.00 N ATOM 416 CD2 HIS A 335 -5.113 4.339 0.942 1.00 0.00 C ATOM 417 CE1 HIS A 335 -6.108 5.515 -0.580 1.00 0.00 C ATOM 418 NE2 HIS A 335 -5.250 5.622 0.434 1.00 0.00 N ATOM 0 H HIS A 335 -4.483 1.979 -1.568 1.00 0.00 H new ATOM 0 HA HIS A 335 -4.217 1.685 1.310 1.00 0.00 H new ATOM 0 HB2 HIS A 335 -6.664 1.623 -0.520 1.00 0.00 H new ATOM 0 HB3 HIS A 335 -6.712 1.774 1.226 1.00 0.00 H new ATOM 0 HD1 HIS A 335 -7.174 3.911 -1.461 1.00 0.00 H new ATOM 0 HD2 HIS A 335 -4.486 4.063 1.777 1.00 0.00 H new ATOM 0 HE1 HIS A 335 -6.432 6.345 -1.190 1.00 0.00 H new ATOM 426 N THR A 336 -5.172 -0.639 1.798 1.00 0.00 N ATOM 427 CA THR A 336 -5.367 -2.086 2.049 1.00 0.00 C ATOM 428 C THR A 336 -6.701 -2.547 1.455 1.00 0.00 C ATOM 429 O THR A 336 -6.933 -3.725 1.280 1.00 0.00 O ATOM 430 CB THR A 336 -5.373 -2.315 3.561 1.00 0.00 C ATOM 431 OG1 THR A 336 -6.491 -1.650 4.132 1.00 0.00 O ATOM 432 CG2 THR A 336 -4.084 -1.759 4.166 1.00 0.00 C ATOM 0 H THR A 336 -5.225 -0.049 2.628 1.00 0.00 H new ATOM 0 HA THR A 336 -4.563 -2.655 1.582 1.00 0.00 H new ATOM 0 HB THR A 336 -5.438 -3.383 3.769 1.00 0.00 H new ATOM 0 HG1 THR A 336 -7.080 -2.307 4.557 1.00 0.00 H new ATOM 0 HG21 THR A 336 -4.088 -1.922 5.244 1.00 0.00 H new ATOM 0 HG22 THR A 336 -3.226 -2.267 3.725 1.00 0.00 H new ATOM 0 HG23 THR A 336 -4.017 -0.691 3.961 1.00 0.00 H new ATOM 440 N PHE A 337 -7.587 -1.628 1.161 1.00 0.00 N ATOM 441 CA PHE A 337 -8.914 -2.020 0.601 1.00 0.00 C ATOM 442 C PHE A 337 -9.078 -1.527 -0.844 1.00 0.00 C ATOM 443 O PHE A 337 -10.121 -1.715 -1.439 1.00 0.00 O ATOM 444 CB PHE A 337 -10.016 -1.398 1.457 1.00 0.00 C ATOM 445 CG PHE A 337 -9.955 0.103 1.323 1.00 0.00 C ATOM 446 CD1 PHE A 337 -9.125 0.848 2.168 1.00 0.00 C ATOM 447 CD2 PHE A 337 -10.726 0.750 0.351 1.00 0.00 C ATOM 448 CE1 PHE A 337 -9.064 2.240 2.039 1.00 0.00 C ATOM 449 CE2 PHE A 337 -10.667 2.142 0.221 1.00 0.00 C ATOM 450 CZ PHE A 337 -9.835 2.888 1.066 1.00 0.00 C ATOM 0 H PHE A 337 -7.448 -0.625 1.285 1.00 0.00 H new ATOM 0 HA PHE A 337 -8.981 -3.108 0.607 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -10.992 -1.765 1.139 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -9.891 -1.688 2.500 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -8.532 0.349 2.920 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -11.367 0.174 -0.300 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -8.422 2.815 2.690 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -11.262 2.641 -0.530 1.00 0.00 H new ATOM 0 HZ PHE A 337 -9.788 3.962 0.967 1.00 0.00 H new ATOM 460 N CYS A 338 -8.081 -0.895 -1.412 1.00 0.00 N ATOM 461 CA CYS A 338 -8.225 -0.398 -2.818 1.00 0.00 C ATOM 462 C CYS A 338 -7.173 -1.044 -3.723 1.00 0.00 C ATOM 463 O CYS A 338 -6.736 -0.457 -4.693 1.00 0.00 O ATOM 464 CB CYS A 338 -8.084 1.132 -2.846 1.00 0.00 C ATOM 465 SG CYS A 338 -6.353 1.606 -3.100 1.00 0.00 S ATOM 0 H CYS A 338 -7.182 -0.702 -0.970 1.00 0.00 H new ATOM 0 HA CYS A 338 -9.213 -0.671 -3.189 1.00 0.00 H new ATOM 0 HB2 CYS A 338 -8.701 1.545 -3.644 1.00 0.00 H new ATOM 0 HB3 CYS A 338 -8.449 1.554 -1.910 1.00 0.00 H new ATOM 470 N LEU A 339 -6.780 -2.257 -3.429 1.00 0.00 N ATOM 471 CA LEU A 339 -5.770 -2.943 -4.290 1.00 0.00 C ATOM 472 C LEU A 339 -5.557 -4.380 -3.813 1.00 0.00 C ATOM 473 O LEU A 339 -5.461 -5.300 -4.601 1.00 0.00 O ATOM 474 CB LEU A 339 -4.434 -2.202 -4.221 1.00 0.00 C ATOM 475 CG LEU A 339 -3.473 -2.787 -5.263 1.00 0.00 C ATOM 476 CD1 LEU A 339 -3.901 -2.355 -6.670 1.00 0.00 C ATOM 477 CD2 LEU A 339 -2.056 -2.282 -4.988 1.00 0.00 C ATOM 0 H LEU A 339 -7.113 -2.800 -2.633 1.00 0.00 H new ATOM 0 HA LEU A 339 -6.140 -2.947 -5.315 1.00 0.00 H new ATOM 0 HB2 LEU A 339 -4.585 -1.139 -4.406 1.00 0.00 H new ATOM 0 HB3 LEU A 339 -4.006 -2.294 -3.223 1.00 0.00 H new ATOM 0 HG LEU A 339 -3.496 -3.875 -5.199 1.00 0.00 H new ATOM 0 HD11 LEU A 339 -3.213 -2.775 -7.404 1.00 0.00 H new ATOM 0 HD12 LEU A 339 -4.910 -2.716 -6.870 1.00 0.00 H new ATOM 0 HD13 LEU A 339 -3.884 -1.267 -6.737 1.00 0.00 H new ATOM 0 HD21 LEU A 339 -1.372 -2.697 -5.728 1.00 0.00 H new ATOM 0 HD22 LEU A 339 -2.039 -1.194 -5.049 1.00 0.00 H new ATOM 0 HD23 LEU A 339 -1.745 -2.595 -3.991 1.00 0.00 H new ATOM 489 N ILE A 340 -5.454 -4.571 -2.530 1.00 0.00 N ATOM 490 CA ILE A 340 -5.214 -5.933 -1.988 1.00 0.00 C ATOM 491 C ILE A 340 -6.458 -6.423 -1.236 1.00 0.00 C ATOM 492 O ILE A 340 -7.200 -5.634 -0.685 1.00 0.00 O ATOM 493 CB ILE A 340 -4.022 -5.845 -1.038 1.00 0.00 C ATOM 494 CG1 ILE A 340 -4.413 -5.011 0.182 1.00 0.00 C ATOM 495 CG2 ILE A 340 -2.849 -5.172 -1.754 1.00 0.00 C ATOM 496 CD1 ILE A 340 -3.180 -4.767 1.053 1.00 0.00 C ATOM 0 H ILE A 340 -5.527 -3.835 -1.828 1.00 0.00 H new ATOM 0 HA ILE A 340 -5.007 -6.638 -2.793 1.00 0.00 H new ATOM 0 HB ILE A 340 -3.731 -6.847 -0.723 1.00 0.00 H new ATOM 0 HG12 ILE A 340 -4.840 -4.060 -0.137 1.00 0.00 H new ATOM 0 HG13 ILE A 340 -5.181 -5.528 0.758 1.00 0.00 H new ATOM 0 HG21 ILE A 340 -1.997 -5.109 -1.077 1.00 0.00 H new ATOM 0 HG22 ILE A 340 -2.573 -5.758 -2.630 1.00 0.00 H new ATOM 0 HG23 ILE A 340 -3.140 -4.169 -2.066 1.00 0.00 H new ATOM 0 HD11 ILE A 340 -3.461 -4.172 1.922 1.00 0.00 H new ATOM 0 HD12 ILE A 340 -2.773 -5.723 1.383 1.00 0.00 H new ATOM 0 HD13 ILE A 340 -2.426 -4.232 0.475 1.00 0.00 H new ATOM 508 N PRO A 341 -6.686 -7.720 -1.203 1.00 0.00 N ATOM 509 CA PRO A 341 -7.856 -8.299 -0.497 1.00 0.00 C ATOM 510 C PRO A 341 -8.066 -7.670 0.889 1.00 0.00 C ATOM 511 O PRO A 341 -9.155 -7.232 1.199 1.00 0.00 O ATOM 512 CB PRO A 341 -7.556 -9.800 -0.384 1.00 0.00 C ATOM 513 CG PRO A 341 -6.257 -10.046 -1.092 1.00 0.00 C ATOM 514 CD PRO A 341 -5.863 -8.763 -1.827 1.00 0.00 C ATOM 0 HA PRO A 341 -8.780 -8.104 -1.042 1.00 0.00 H new ATOM 0 HB2 PRO A 341 -7.488 -10.101 0.661 1.00 0.00 H new ATOM 0 HB3 PRO A 341 -8.357 -10.387 -0.833 1.00 0.00 H new ATOM 0 HG2 PRO A 341 -5.483 -10.329 -0.379 1.00 0.00 H new ATOM 0 HG3 PRO A 341 -6.358 -10.872 -1.796 1.00 0.00 H new ATOM 0 HD2 PRO A 341 -4.800 -8.551 -1.715 1.00 0.00 H new ATOM 0 HD3 PRO A 341 -6.062 -8.840 -2.896 1.00 0.00 H new ATOM 522 N PRO A 342 -7.039 -7.598 1.715 1.00 0.00 N ATOM 523 CA PRO A 342 -7.147 -6.980 3.058 1.00 0.00 C ATOM 524 C PRO A 342 -8.123 -5.797 3.076 1.00 0.00 C ATOM 525 O PRO A 342 -8.465 -5.250 2.049 1.00 0.00 O ATOM 526 CB PRO A 342 -5.724 -6.508 3.335 1.00 0.00 C ATOM 527 CG PRO A 342 -4.834 -7.456 2.597 1.00 0.00 C ATOM 528 CD PRO A 342 -5.671 -8.106 1.488 1.00 0.00 C ATOM 0 HA PRO A 342 -7.534 -7.675 3.804 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -5.577 -5.484 2.991 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -5.508 -6.519 4.403 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -3.980 -6.928 2.173 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -4.437 -8.214 3.272 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -5.304 -7.830 0.499 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -5.636 -9.194 1.549 1.00 0.00 H new ATOM 536 N LEU A 343 -8.576 -5.404 4.235 1.00 0.00 N ATOM 537 CA LEU A 343 -9.536 -4.268 4.315 1.00 0.00 C ATOM 538 C LEU A 343 -9.105 -3.291 5.411 1.00 0.00 C ATOM 539 O LEU A 343 -7.985 -2.824 5.438 1.00 0.00 O ATOM 540 CB LEU A 343 -10.933 -4.805 4.641 1.00 0.00 C ATOM 541 CG LEU A 343 -11.375 -5.795 3.562 1.00 0.00 C ATOM 542 CD1 LEU A 343 -12.711 -6.423 3.965 1.00 0.00 C ATOM 543 CD2 LEU A 343 -11.549 -5.062 2.229 1.00 0.00 C ATOM 0 H LEU A 343 -8.322 -5.821 5.130 1.00 0.00 H new ATOM 0 HA LEU A 343 -9.551 -3.748 3.357 1.00 0.00 H new ATOM 0 HB2 LEU A 343 -10.926 -5.294 5.615 1.00 0.00 H new ATOM 0 HB3 LEU A 343 -11.643 -3.981 4.704 1.00 0.00 H new ATOM 0 HG LEU A 343 -10.618 -6.572 3.455 1.00 0.00 H new ATOM 0 HD11 LEU A 343 -13.028 -7.129 3.197 1.00 0.00 H new ATOM 0 HD12 LEU A 343 -12.595 -6.947 4.914 1.00 0.00 H new ATOM 0 HD13 LEU A 343 -13.463 -5.641 4.071 1.00 0.00 H new ATOM 0 HD21 LEU A 343 -11.864 -5.770 1.463 1.00 0.00 H new ATOM 0 HD22 LEU A 343 -12.305 -4.285 2.337 1.00 0.00 H new ATOM 0 HD23 LEU A 343 -10.602 -4.609 1.937 1.00 0.00 H new ATOM 555 N HIS A 344 -9.997 -2.975 6.309 1.00 0.00 N ATOM 556 CA HIS A 344 -9.657 -2.021 7.401 1.00 0.00 C ATOM 557 C HIS A 344 -8.383 -2.477 8.115 1.00 0.00 C ATOM 558 O HIS A 344 -7.557 -1.674 8.498 1.00 0.00 O ATOM 559 CB HIS A 344 -10.811 -1.966 8.404 1.00 0.00 C ATOM 560 CG HIS A 344 -12.053 -1.474 7.714 1.00 0.00 C ATOM 561 ND1 HIS A 344 -12.199 -0.155 7.304 1.00 0.00 N ATOM 562 CD2 HIS A 344 -13.215 -2.110 7.353 1.00 0.00 C ATOM 563 CE1 HIS A 344 -13.409 -0.042 6.727 1.00 0.00 C ATOM 564 NE2 HIS A 344 -14.066 -1.203 6.732 1.00 0.00 N ATOM 0 H HIS A 344 -10.950 -3.338 6.333 1.00 0.00 H new ATOM 0 HA HIS A 344 -9.493 -1.031 6.974 1.00 0.00 H new ATOM 0 HB2 HIS A 344 -10.985 -2.955 8.828 1.00 0.00 H new ATOM 0 HB3 HIS A 344 -10.556 -1.304 9.232 1.00 0.00 H new ATOM 0 HD2 HIS A 344 -13.434 -3.153 7.525 1.00 0.00 H new ATOM 0 HE1 HIS A 344 -13.800 0.875 6.311 1.00 0.00 H new ATOM 0 HE2 HIS A 344 -14.997 -1.387 6.359 1.00 0.00 H new ATOM 573 N ASP A 345 -8.221 -3.755 8.307 1.00 0.00 N ATOM 574 CA ASP A 345 -7.007 -4.251 9.005 1.00 0.00 C ATOM 575 C ASP A 345 -5.847 -4.369 8.015 1.00 0.00 C ATOM 576 O ASP A 345 -5.997 -4.877 6.921 1.00 0.00 O ATOM 577 CB ASP A 345 -7.305 -5.622 9.612 1.00 0.00 C ATOM 578 CG ASP A 345 -8.335 -5.473 10.733 1.00 0.00 C ATOM 579 OD1 ASP A 345 -8.586 -4.349 11.135 1.00 0.00 O ATOM 580 OD2 ASP A 345 -8.856 -6.486 11.170 1.00 0.00 O ATOM 0 H ASP A 345 -8.878 -4.477 8.010 1.00 0.00 H new ATOM 0 HA ASP A 345 -6.729 -3.551 9.793 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -7.683 -6.297 8.844 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -6.389 -6.065 10.002 1.00 0.00 H new ATOM 585 N VAL A 346 -4.686 -3.904 8.393 1.00 0.00 N ATOM 586 CA VAL A 346 -3.513 -3.987 7.485 1.00 0.00 C ATOM 587 C VAL A 346 -2.775 -5.313 7.726 1.00 0.00 C ATOM 588 O VAL A 346 -2.706 -5.788 8.842 1.00 0.00 O ATOM 589 CB VAL A 346 -2.571 -2.820 7.777 1.00 0.00 C ATOM 590 CG1 VAL A 346 -3.219 -1.512 7.321 1.00 0.00 C ATOM 591 CG2 VAL A 346 -2.295 -2.752 9.281 1.00 0.00 C ATOM 0 H VAL A 346 -4.502 -3.469 9.297 1.00 0.00 H new ATOM 0 HA VAL A 346 -3.845 -3.940 6.448 1.00 0.00 H new ATOM 0 HB VAL A 346 -1.634 -2.968 7.240 1.00 0.00 H new ATOM 0 HG11 VAL A 346 -2.546 -0.680 7.530 1.00 0.00 H new ATOM 0 HG12 VAL A 346 -3.417 -1.558 6.250 1.00 0.00 H new ATOM 0 HG13 VAL A 346 -4.156 -1.364 7.857 1.00 0.00 H new ATOM 0 HG21 VAL A 346 -1.623 -1.920 9.490 1.00 0.00 H new ATOM 0 HG22 VAL A 346 -3.233 -2.605 9.817 1.00 0.00 H new ATOM 0 HG23 VAL A 346 -1.832 -3.683 9.608 1.00 0.00 H new ATOM 601 N PRO A 347 -2.231 -5.913 6.693 1.00 0.00 N ATOM 602 CA PRO A 347 -1.497 -7.207 6.820 1.00 0.00 C ATOM 603 C PRO A 347 -0.275 -7.088 7.738 1.00 0.00 C ATOM 604 O PRO A 347 0.413 -6.086 7.743 1.00 0.00 O ATOM 605 CB PRO A 347 -1.063 -7.544 5.388 1.00 0.00 C ATOM 606 CG PRO A 347 -1.180 -6.273 4.613 1.00 0.00 C ATOM 607 CD PRO A 347 -2.247 -5.429 5.305 1.00 0.00 C ATOM 0 HA PRO A 347 -2.124 -7.979 7.267 1.00 0.00 H new ATOM 0 HB2 PRO A 347 -0.040 -7.920 5.369 1.00 0.00 H new ATOM 0 HB3 PRO A 347 -1.697 -8.321 4.961 1.00 0.00 H new ATOM 0 HG2 PRO A 347 -0.226 -5.746 4.589 1.00 0.00 H new ATOM 0 HG3 PRO A 347 -1.458 -6.475 3.579 1.00 0.00 H new ATOM 0 HD2 PRO A 347 -2.014 -4.366 5.249 1.00 0.00 H new ATOM 0 HD3 PRO A 347 -3.226 -5.566 4.845 1.00 0.00 H new ATOM 615 N LYS A 348 -0.006 -8.099 8.517 1.00 0.00 N ATOM 616 CA LYS A 348 1.166 -8.043 9.438 1.00 0.00 C ATOM 617 C LYS A 348 2.438 -7.858 8.620 1.00 0.00 C ATOM 618 O LYS A 348 3.321 -7.101 8.973 1.00 0.00 O ATOM 619 CB LYS A 348 1.264 -9.360 10.202 1.00 0.00 C ATOM 620 CG LYS A 348 -0.061 -9.627 10.903 1.00 0.00 C ATOM 621 CD LYS A 348 0.067 -10.866 11.792 1.00 0.00 C ATOM 622 CE LYS A 348 -1.298 -11.207 12.393 1.00 0.00 C ATOM 623 NZ LYS A 348 -2.222 -11.648 11.309 1.00 0.00 N ATOM 0 H LYS A 348 -0.547 -8.963 8.556 1.00 0.00 H new ATOM 0 HA LYS A 348 1.045 -7.213 10.134 1.00 0.00 H new ATOM 0 HB2 LYS A 348 1.499 -10.175 9.518 1.00 0.00 H new ATOM 0 HB3 LYS A 348 2.073 -9.313 10.931 1.00 0.00 H new ATOM 0 HG2 LYS A 348 -0.346 -8.764 11.504 1.00 0.00 H new ATOM 0 HG3 LYS A 348 -0.850 -9.776 10.166 1.00 0.00 H new ATOM 0 HD2 LYS A 348 0.440 -11.708 11.209 1.00 0.00 H new ATOM 0 HD3 LYS A 348 0.791 -10.683 12.587 1.00 0.00 H new ATOM 0 HE2 LYS A 348 -1.192 -11.995 13.139 1.00 0.00 H new ATOM 0 HE3 LYS A 348 -1.710 -10.337 12.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 348 -2.980 -12.232 11.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 348 -2.637 -10.814 10.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 348 -1.694 -12.206 10.608 1.00 0.00 H new ATOM 637 N GLY A 349 2.536 -8.560 7.530 1.00 0.00 N ATOM 638 CA GLY A 349 3.751 -8.447 6.675 1.00 0.00 C ATOM 639 C GLY A 349 3.599 -7.276 5.705 1.00 0.00 C ATOM 640 O GLY A 349 2.556 -6.661 5.614 1.00 0.00 O ATOM 0 H GLY A 349 1.826 -9.210 7.191 1.00 0.00 H new ATOM 0 HA2 GLY A 349 4.633 -8.301 7.299 1.00 0.00 H new ATOM 0 HA3 GLY A 349 3.903 -9.373 6.120 1.00 0.00 H new ATOM 644 N ASP A 350 4.636 -6.970 4.974 1.00 0.00 N ATOM 645 CA ASP A 350 4.558 -5.845 4.001 1.00 0.00 C ATOM 646 C ASP A 350 3.994 -6.366 2.679 1.00 0.00 C ATOM 647 O ASP A 350 4.544 -7.261 2.069 1.00 0.00 O ATOM 648 CB ASP A 350 5.959 -5.272 3.769 1.00 0.00 C ATOM 649 CG ASP A 350 5.863 -4.035 2.875 1.00 0.00 C ATOM 650 OD1 ASP A 350 5.596 -2.967 3.401 1.00 0.00 O ATOM 651 OD2 ASP A 350 6.057 -4.177 1.678 1.00 0.00 O ATOM 0 H ASP A 350 5.535 -7.451 5.009 1.00 0.00 H new ATOM 0 HA ASP A 350 3.909 -5.062 4.394 1.00 0.00 H new ATOM 0 HB2 ASP A 350 6.419 -5.010 4.722 1.00 0.00 H new ATOM 0 HB3 ASP A 350 6.598 -6.022 3.303 1.00 0.00 H new ATOM 656 N TRP A 351 2.899 -5.818 2.230 1.00 0.00 N ATOM 657 CA TRP A 351 2.309 -6.293 0.950 1.00 0.00 C ATOM 658 C TRP A 351 3.131 -5.750 -0.216 1.00 0.00 C ATOM 659 O TRP A 351 3.518 -4.598 -0.237 1.00 0.00 O ATOM 660 CB TRP A 351 0.864 -5.804 0.831 1.00 0.00 C ATOM 661 CG TRP A 351 0.012 -6.908 0.288 1.00 0.00 C ATOM 662 CD1 TRP A 351 -0.597 -7.858 1.036 1.00 0.00 C ATOM 663 CD2 TRP A 351 -0.334 -7.198 -1.098 1.00 0.00 C ATOM 664 NE1 TRP A 351 -1.294 -8.709 0.200 1.00 0.00 N ATOM 665 CE2 TRP A 351 -1.164 -8.344 -1.125 1.00 0.00 C ATOM 666 CE3 TRP A 351 -0.013 -6.585 -2.323 1.00 0.00 C ATOM 667 CZ2 TRP A 351 -1.657 -8.863 -2.324 1.00 0.00 C ATOM 668 CZ3 TRP A 351 -0.507 -7.104 -3.530 1.00 0.00 C ATOM 669 CH2 TRP A 351 -1.328 -8.241 -3.530 1.00 0.00 C ATOM 0 H TRP A 351 2.390 -5.065 2.693 1.00 0.00 H new ATOM 0 HA TRP A 351 2.319 -7.383 0.929 1.00 0.00 H new ATOM 0 HB2 TRP A 351 0.493 -5.489 1.806 1.00 0.00 H new ATOM 0 HB3 TRP A 351 0.815 -4.935 0.175 1.00 0.00 H new ATOM 0 HD1 TRP A 351 -0.546 -7.938 2.112 1.00 0.00 H new ATOM 0 HE1 TRP A 351 -1.838 -9.509 0.522 1.00 0.00 H new ATOM 0 HE3 TRP A 351 0.618 -5.709 -2.335 1.00 0.00 H new ATOM 0 HZ2 TRP A 351 -2.288 -9.739 -2.319 1.00 0.00 H new ATOM 0 HZ3 TRP A 351 -0.253 -6.625 -4.464 1.00 0.00 H new ATOM 0 HH2 TRP A 351 -1.705 -8.635 -4.462 1.00 0.00 H new ATOM 680 N ARG A 352 3.409 -6.579 -1.179 1.00 0.00 N ATOM 681 CA ARG A 352 4.215 -6.141 -2.350 1.00 0.00 C ATOM 682 C ARG A 352 3.405 -6.326 -3.626 1.00 0.00 C ATOM 683 O ARG A 352 2.753 -7.332 -3.820 1.00 0.00 O ATOM 684 CB ARG A 352 5.480 -6.991 -2.426 1.00 0.00 C ATOM 685 CG ARG A 352 6.372 -6.680 -1.226 1.00 0.00 C ATOM 686 CD ARG A 352 7.591 -7.597 -1.259 1.00 0.00 C ATOM 687 NE ARG A 352 8.512 -7.244 -0.142 1.00 0.00 N ATOM 688 CZ ARG A 352 9.381 -8.118 0.288 1.00 0.00 C ATOM 689 NH1 ARG A 352 9.443 -9.301 -0.259 1.00 0.00 N ATOM 690 NH2 ARG A 352 10.188 -7.809 1.266 1.00 0.00 N ATOM 0 H ARG A 352 3.109 -7.553 -1.206 1.00 0.00 H new ATOM 0 HA ARG A 352 4.480 -5.089 -2.241 1.00 0.00 H new ATOM 0 HB2 ARG A 352 5.220 -8.050 -2.436 1.00 0.00 H new ATOM 0 HB3 ARG A 352 6.014 -6.786 -3.354 1.00 0.00 H new ATOM 0 HG2 ARG A 352 6.686 -5.636 -1.251 1.00 0.00 H new ATOM 0 HG3 ARG A 352 5.818 -6.824 -0.298 1.00 0.00 H new ATOM 0 HD2 ARG A 352 7.278 -8.638 -1.171 1.00 0.00 H new ATOM 0 HD3 ARG A 352 8.107 -7.499 -2.214 1.00 0.00 H new ATOM 0 HE ARG A 352 8.463 -6.320 0.286 1.00 0.00 H new ATOM 0 HH11 ARG A 352 8.812 -9.543 -1.023 1.00 0.00 H new ATOM 0 HH12 ARG A 352 10.122 -9.983 0.077 1.00 0.00 H new ATOM 0 HH21 ARG A 352 10.140 -6.885 1.694 1.00 0.00 H new ATOM 0 HH22 ARG A 352 10.867 -8.492 1.602 1.00 0.00 H new ATOM 704 N CYS A 353 3.446 -5.366 -4.504 1.00 0.00 N ATOM 705 CA CYS A 353 2.685 -5.497 -5.768 1.00 0.00 C ATOM 706 C CYS A 353 3.241 -6.709 -6.534 1.00 0.00 C ATOM 707 O CYS A 353 4.376 -7.097 -6.348 1.00 0.00 O ATOM 708 CB CYS A 353 2.831 -4.211 -6.589 1.00 0.00 C ATOM 709 SG CYS A 353 3.511 -2.892 -5.547 1.00 0.00 S ATOM 0 H CYS A 353 3.973 -4.499 -4.399 1.00 0.00 H new ATOM 0 HA CYS A 353 1.624 -5.649 -5.571 1.00 0.00 H new ATOM 0 HB2 CYS A 353 3.485 -4.386 -7.443 1.00 0.00 H new ATOM 0 HB3 CYS A 353 1.862 -3.910 -6.986 1.00 0.00 H new ATOM 714 N PRO A 354 2.434 -7.339 -7.344 1.00 0.00 N ATOM 715 CA PRO A 354 2.836 -8.566 -8.098 1.00 0.00 C ATOM 716 C PRO A 354 4.174 -8.434 -8.848 1.00 0.00 C ATOM 717 O PRO A 354 4.957 -9.361 -8.883 1.00 0.00 O ATOM 718 CB PRO A 354 1.692 -8.792 -9.097 1.00 0.00 C ATOM 719 CG PRO A 354 0.794 -7.595 -8.997 1.00 0.00 C ATOM 720 CD PRO A 354 1.053 -6.955 -7.638 1.00 0.00 C ATOM 0 HA PRO A 354 2.994 -9.394 -7.407 1.00 0.00 H new ATOM 0 HB2 PRO A 354 2.078 -8.903 -10.110 1.00 0.00 H new ATOM 0 HB3 PRO A 354 1.147 -9.706 -8.862 1.00 0.00 H new ATOM 0 HG2 PRO A 354 1.001 -6.889 -9.801 1.00 0.00 H new ATOM 0 HG3 PRO A 354 -0.251 -7.888 -9.092 1.00 0.00 H new ATOM 0 HD2 PRO A 354 0.935 -5.872 -7.674 1.00 0.00 H new ATOM 0 HD3 PRO A 354 0.362 -7.325 -6.880 1.00 0.00 H new ATOM 728 N LYS A 355 4.447 -7.308 -9.447 1.00 0.00 N ATOM 729 CA LYS A 355 5.736 -7.161 -10.190 1.00 0.00 C ATOM 730 C LYS A 355 6.923 -7.378 -9.250 1.00 0.00 C ATOM 731 O LYS A 355 7.919 -7.971 -9.613 1.00 0.00 O ATOM 732 CB LYS A 355 5.819 -5.759 -10.793 1.00 0.00 C ATOM 733 CG LYS A 355 5.768 -4.725 -9.669 1.00 0.00 C ATOM 734 CD LYS A 355 5.715 -3.318 -10.267 1.00 0.00 C ATOM 735 CE LYS A 355 5.943 -2.285 -9.163 1.00 0.00 C ATOM 736 NZ LYS A 355 5.544 -0.936 -9.656 1.00 0.00 N ATOM 0 H LYS A 355 3.841 -6.488 -9.456 1.00 0.00 H new ATOM 0 HA LYS A 355 5.771 -7.909 -10.982 1.00 0.00 H new ATOM 0 HB2 LYS A 355 6.742 -5.649 -11.363 1.00 0.00 H new ATOM 0 HB3 LYS A 355 4.994 -5.600 -11.488 1.00 0.00 H new ATOM 0 HG2 LYS A 355 4.893 -4.898 -9.042 1.00 0.00 H new ATOM 0 HG3 LYS A 355 6.644 -4.826 -9.028 1.00 0.00 H new ATOM 0 HD2 LYS A 355 6.475 -3.212 -11.041 1.00 0.00 H new ATOM 0 HD3 LYS A 355 4.749 -3.150 -10.743 1.00 0.00 H new ATOM 0 HE2 LYS A 355 5.362 -2.547 -8.279 1.00 0.00 H new ATOM 0 HE3 LYS A 355 6.992 -2.280 -8.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 355 5.699 -0.232 -8.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 355 6.117 -0.687 -10.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 355 4.538 -0.946 -9.919 1.00 0.00 H new ATOM 750 N CYS A 356 6.825 -6.891 -8.051 1.00 0.00 N ATOM 751 CA CYS A 356 7.941 -7.045 -7.075 1.00 0.00 C ATOM 752 C CYS A 356 8.008 -8.495 -6.597 1.00 0.00 C ATOM 753 O CYS A 356 9.072 -9.036 -6.370 1.00 0.00 O ATOM 754 CB CYS A 356 7.692 -6.114 -5.887 1.00 0.00 C ATOM 755 SG CYS A 356 6.159 -5.205 -6.188 1.00 0.00 S ATOM 0 H CYS A 356 6.012 -6.386 -7.697 1.00 0.00 H new ATOM 0 HA CYS A 356 8.888 -6.786 -7.549 1.00 0.00 H new ATOM 0 HB2 CYS A 356 7.617 -6.689 -4.964 1.00 0.00 H new ATOM 0 HB3 CYS A 356 8.526 -5.422 -5.766 1.00 0.00 H new ATOM 760 N LEU A 357 6.879 -9.125 -6.438 1.00 0.00 N ATOM 761 CA LEU A 357 6.874 -10.539 -5.970 1.00 0.00 C ATOM 762 C LEU A 357 7.629 -11.414 -6.971 1.00 0.00 C ATOM 763 O LEU A 357 8.325 -12.339 -6.601 1.00 0.00 O ATOM 764 CB LEU A 357 5.429 -11.023 -5.846 1.00 0.00 C ATOM 765 CG LEU A 357 5.410 -12.432 -5.246 1.00 0.00 C ATOM 766 CD1 LEU A 357 5.856 -12.382 -3.783 1.00 0.00 C ATOM 767 CD2 LEU A 357 3.989 -12.997 -5.324 1.00 0.00 C ATOM 0 H LEU A 357 5.958 -8.722 -6.612 1.00 0.00 H new ATOM 0 HA LEU A 357 7.364 -10.605 -4.999 1.00 0.00 H new ATOM 0 HB2 LEU A 357 4.859 -10.340 -5.216 1.00 0.00 H new ATOM 0 HB3 LEU A 357 4.951 -11.027 -6.825 1.00 0.00 H new ATOM 0 HG LEU A 357 6.092 -13.070 -5.807 1.00 0.00 H new ATOM 0 HD11 LEU A 357 5.840 -13.388 -3.363 1.00 0.00 H new ATOM 0 HD12 LEU A 357 6.868 -11.981 -3.725 1.00 0.00 H new ATOM 0 HD13 LEU A 357 5.179 -11.742 -3.218 1.00 0.00 H new ATOM 0 HD21 LEU A 357 3.972 -14.000 -4.898 1.00 0.00 H new ATOM 0 HD22 LEU A 357 3.310 -12.353 -4.764 1.00 0.00 H new ATOM 0 HD23 LEU A 357 3.671 -13.040 -6.366 1.00 0.00 H new ATOM 779 N ALA A 358 7.498 -11.130 -8.237 1.00 0.00 N ATOM 780 CA ALA A 358 8.210 -11.946 -9.261 1.00 0.00 C ATOM 781 C ALA A 358 9.720 -11.819 -9.053 1.00 0.00 C ATOM 782 O ALA A 358 10.469 -12.742 -9.301 1.00 0.00 O ATOM 783 CB ALA A 358 7.842 -11.444 -10.659 1.00 0.00 C ATOM 0 H ALA A 358 6.929 -10.369 -8.607 1.00 0.00 H new ATOM 0 HA ALA A 358 7.917 -12.991 -9.162 1.00 0.00 H new ATOM 0 HB1 ALA A 358 8.362 -12.040 -11.408 1.00 0.00 H new ATOM 0 HB2 ALA A 358 6.766 -11.535 -10.806 1.00 0.00 H new ATOM 0 HB3 ALA A 358 8.135 -10.399 -10.759 1.00 0.00 H new ATOM 789 N GLN A 359 10.170 -10.682 -8.601 1.00 0.00 N ATOM 790 CA GLN A 359 11.631 -10.495 -8.377 1.00 0.00 C ATOM 791 C GLN A 359 12.130 -11.531 -7.367 1.00 0.00 C ATOM 792 O GLN A 359 13.240 -12.017 -7.457 1.00 0.00 O ATOM 793 CB GLN A 359 11.888 -9.088 -7.834 1.00 0.00 C ATOM 794 CG GLN A 359 11.499 -8.053 -8.890 1.00 0.00 C ATOM 795 CD GLN A 359 11.708 -6.646 -8.330 1.00 0.00 C ATOM 796 OE1 GLN A 359 11.835 -6.468 -7.134 1.00 0.00 O ATOM 797 NE2 GLN A 359 11.748 -5.630 -9.147 1.00 0.00 N ATOM 0 H GLN A 359 9.589 -9.874 -8.377 1.00 0.00 H new ATOM 0 HA GLN A 359 12.162 -10.623 -9.320 1.00 0.00 H new ATOM 0 HB2 GLN A 359 11.311 -8.928 -6.923 1.00 0.00 H new ATOM 0 HB3 GLN A 359 12.939 -8.975 -7.570 1.00 0.00 H new ATOM 0 HG2 GLN A 359 12.101 -8.191 -9.788 1.00 0.00 H new ATOM 0 HG3 GLN A 359 10.457 -8.189 -9.180 1.00 0.00 H new ATOM 0 HE21 GLN A 359 11.642 -5.778 -10.151 1.00 0.00 H new ATOM 0 HE22 GLN A 359 11.886 -4.687 -8.782 1.00 0.00 H new ATOM 806 N GLU A 360 11.318 -11.871 -6.405 1.00 0.00 N ATOM 807 CA GLU A 360 11.744 -12.874 -5.390 1.00 0.00 C ATOM 808 C GLU A 360 11.677 -14.277 -5.997 1.00 0.00 C ATOM 809 O GLU A 360 12.673 -14.705 -6.559 1.00 0.00 O ATOM 810 CB GLU A 360 10.816 -12.800 -4.180 1.00 0.00 C ATOM 811 CG GLU A 360 11.402 -13.645 -3.050 1.00 0.00 C ATOM 812 CD GLU A 360 12.691 -12.996 -2.542 1.00 0.00 C ATOM 813 OE1 GLU A 360 12.830 -11.794 -2.704 1.00 0.00 O ATOM 814 OE2 GLU A 360 13.517 -13.711 -1.999 1.00 0.00 O ATOM 815 OXT GLU A 360 10.633 -14.899 -5.890 1.00 0.00 O ATOM 0 H GLU A 360 10.377 -11.497 -6.278 1.00 0.00 H new ATOM 0 HA GLU A 360 12.767 -12.661 -5.078 1.00 0.00 H new ATOM 0 HB2 GLU A 360 10.702 -11.766 -3.856 1.00 0.00 H new ATOM 0 HB3 GLU A 360 9.823 -13.163 -4.445 1.00 0.00 H new ATOM 0 HG2 GLU A 360 10.682 -13.733 -2.237 1.00 0.00 H new ATOM 0 HG3 GLU A 360 11.607 -14.655 -3.405 1.00 0.00 H new TER 822 GLU A 360 HETATM 823 ZN ZN A 401 -6.157 3.874 -2.692 1.00 0.00 ZN HETATM 824 ZN ZN A 402 5.764 -3.178 -5.204 1.00 0.00 ZN