USER MOD reduce.3.24.130724 H: found=0, std=0, add=393, rem=0, adj=6 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 NoAdj-H: A 335 HIS HD1 : A 335 HIS ND1 : A 401 ZNZN :(H bumps) USER MOD Single : A 310 TYR OH : rot 180:sc= 0 USER MOD Single : A 317 SER OG : rot 180:sc= 0 USER MOD Single : A 319 ASN : amide:sc= -0.0935 X(o=-0.094,f=0) USER MOD Single : A 333 SER OG : rot 130:sc= 0 USER MOD Single : A 334 TYR OH : rot -90:sc= 0.14 USER MOD Single : A 336 THR OG1 : rot 112:sc= 0.895 USER MOD Single : A 344 HIS : no HD1:sc= 0.00694 K(o=0.0069,f=-0.49) USER MOD Single : A 348 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 355 LYS NZ :NH3+ -123:sc= 0.985 (180deg=-3.12!) USER MOD Single : A 359 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 306 3.304 15.637 -4.406 1.00 0.00 N ATOM 2 CA ALA A 306 2.123 16.030 -3.586 1.00 0.00 C ATOM 3 C ALA A 306 2.599 16.587 -2.243 1.00 0.00 C ATOM 4 O ALA A 306 3.744 16.435 -1.868 1.00 0.00 O ATOM 5 CB ALA A 306 1.239 14.804 -3.346 1.00 0.00 C ATOM 0 HA ALA A 306 1.550 16.793 -4.114 1.00 0.00 H new ATOM 0 HB1 ALA A 306 0.375 15.090 -2.746 1.00 0.00 H new ATOM 0 HB2 ALA A 306 0.901 14.406 -4.303 1.00 0.00 H new ATOM 0 HB3 ALA A 306 1.811 14.041 -2.818 1.00 0.00 H new ATOM 13 N VAL A 307 1.728 17.231 -1.515 1.00 0.00 N ATOM 14 CA VAL A 307 2.133 17.797 -0.199 1.00 0.00 C ATOM 15 C VAL A 307 2.610 16.667 0.716 1.00 0.00 C ATOM 16 O VAL A 307 3.601 16.790 1.407 1.00 0.00 O ATOM 17 CB VAL A 307 0.935 18.500 0.443 1.00 0.00 C ATOM 18 CG1 VAL A 307 1.289 18.911 1.874 1.00 0.00 C ATOM 19 CG2 VAL A 307 0.579 19.746 -0.372 1.00 0.00 C ATOM 0 H VAL A 307 0.754 17.389 -1.775 1.00 0.00 H new ATOM 0 HA VAL A 307 2.941 18.514 -0.344 1.00 0.00 H new ATOM 0 HB VAL A 307 0.083 17.821 0.461 1.00 0.00 H new ATOM 0 HG11 VAL A 307 0.435 19.412 2.331 1.00 0.00 H new ATOM 0 HG12 VAL A 307 1.543 18.024 2.455 1.00 0.00 H new ATOM 0 HG13 VAL A 307 2.141 19.590 1.857 1.00 0.00 H new ATOM 0 HG21 VAL A 307 -0.274 20.248 0.084 1.00 0.00 H new ATOM 0 HG22 VAL A 307 1.432 20.425 -0.390 1.00 0.00 H new ATOM 0 HG23 VAL A 307 0.326 19.454 -1.391 1.00 0.00 H new ATOM 29 N ASP A 308 1.913 15.564 0.724 1.00 0.00 N ATOM 30 CA ASP A 308 2.327 14.426 1.591 1.00 0.00 C ATOM 31 C ASP A 308 3.470 13.659 0.922 1.00 0.00 C ATOM 32 O ASP A 308 3.470 13.443 -0.273 1.00 0.00 O ATOM 33 CB ASP A 308 1.139 13.489 1.806 1.00 0.00 C ATOM 34 CG ASP A 308 0.080 14.194 2.654 1.00 0.00 C ATOM 35 OD1 ASP A 308 0.385 15.245 3.193 1.00 0.00 O ATOM 36 OD2 ASP A 308 -1.017 13.670 2.752 1.00 0.00 O ATOM 0 H ASP A 308 1.074 15.402 0.167 1.00 0.00 H new ATOM 0 HA ASP A 308 2.665 14.810 2.554 1.00 0.00 H new ATOM 0 HB2 ASP A 308 0.715 13.196 0.846 1.00 0.00 H new ATOM 0 HB3 ASP A 308 1.468 12.575 2.301 1.00 0.00 H new ATOM 41 N LEU A 309 4.445 13.247 1.685 1.00 0.00 N ATOM 42 CA LEU A 309 5.588 12.497 1.094 1.00 0.00 C ATOM 43 C LEU A 309 5.089 11.187 0.478 1.00 0.00 C ATOM 44 O LEU A 309 5.573 10.754 -0.549 1.00 0.00 O ATOM 45 CB LEU A 309 6.611 12.185 2.191 1.00 0.00 C ATOM 46 CG LEU A 309 7.065 13.486 2.857 1.00 0.00 C ATOM 47 CD1 LEU A 309 8.144 13.176 3.897 1.00 0.00 C ATOM 48 CD2 LEU A 309 7.640 14.430 1.799 1.00 0.00 C ATOM 0 H LEU A 309 4.499 13.398 2.692 1.00 0.00 H new ATOM 0 HA LEU A 309 6.053 13.104 0.317 1.00 0.00 H new ATOM 0 HB2 LEU A 309 6.171 11.519 2.933 1.00 0.00 H new ATOM 0 HB3 LEU A 309 7.469 11.665 1.765 1.00 0.00 H new ATOM 0 HG LEU A 309 6.212 13.960 3.343 1.00 0.00 H new ATOM 0 HD11 LEU A 309 8.468 14.102 4.372 1.00 0.00 H new ATOM 0 HD12 LEU A 309 7.738 12.503 4.653 1.00 0.00 H new ATOM 0 HD13 LEU A 309 8.995 12.702 3.408 1.00 0.00 H new ATOM 0 HD21 LEU A 309 7.963 15.356 2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 309 8.492 13.955 1.313 1.00 0.00 H new ATOM 0 HD23 LEU A 309 6.875 14.652 1.055 1.00 0.00 H new ATOM 60 N TYR A 310 4.129 10.551 1.100 1.00 0.00 N ATOM 61 CA TYR A 310 3.602 9.266 0.554 1.00 0.00 C ATOM 62 C TYR A 310 2.108 9.388 0.250 1.00 0.00 C ATOM 63 O TYR A 310 1.318 9.764 1.093 1.00 0.00 O ATOM 64 CB TYR A 310 3.814 8.151 1.580 1.00 0.00 C ATOM 65 CG TYR A 310 5.189 7.553 1.404 1.00 0.00 C ATOM 66 CD1 TYR A 310 6.307 8.180 1.969 1.00 0.00 C ATOM 67 CD2 TYR A 310 5.345 6.368 0.676 1.00 0.00 C ATOM 68 CE1 TYR A 310 7.580 7.620 1.805 1.00 0.00 C ATOM 69 CE2 TYR A 310 6.616 5.808 0.512 1.00 0.00 C ATOM 70 CZ TYR A 310 7.735 6.434 1.076 1.00 0.00 C ATOM 71 OH TYR A 310 8.989 5.883 0.915 1.00 0.00 O ATOM 0 H TYR A 310 3.688 10.867 1.963 1.00 0.00 H new ATOM 0 HA TYR A 310 4.136 9.033 -0.367 1.00 0.00 H new ATOM 0 HB2 TYR A 310 3.706 8.547 2.590 1.00 0.00 H new ATOM 0 HB3 TYR A 310 3.053 7.380 1.457 1.00 0.00 H new ATOM 0 HD1 TYR A 310 6.187 9.095 2.531 1.00 0.00 H new ATOM 0 HD2 TYR A 310 4.483 5.885 0.240 1.00 0.00 H new ATOM 0 HE1 TYR A 310 8.442 8.103 2.241 1.00 0.00 H new ATOM 0 HE2 TYR A 310 6.735 4.893 -0.049 1.00 0.00 H new ATOM 0 HH TYR A 310 8.920 5.062 0.385 1.00 0.00 H new ATOM 81 N VAL A 311 1.715 9.053 -0.949 1.00 0.00 N ATOM 82 CA VAL A 311 0.274 9.124 -1.318 1.00 0.00 C ATOM 83 C VAL A 311 -0.108 7.836 -2.048 1.00 0.00 C ATOM 84 O VAL A 311 0.740 7.125 -2.549 1.00 0.00 O ATOM 85 CB VAL A 311 0.029 10.328 -2.232 1.00 0.00 C ATOM 86 CG1 VAL A 311 0.622 11.583 -1.593 1.00 0.00 C ATOM 87 CG2 VAL A 311 0.693 10.081 -3.589 1.00 0.00 C ATOM 0 H VAL A 311 2.335 8.731 -1.693 1.00 0.00 H new ATOM 0 HA VAL A 311 -0.332 9.237 -0.419 1.00 0.00 H new ATOM 0 HB VAL A 311 -1.043 10.466 -2.372 1.00 0.00 H new ATOM 0 HG11 VAL A 311 0.447 12.440 -2.244 1.00 0.00 H new ATOM 0 HG12 VAL A 311 0.148 11.758 -0.627 1.00 0.00 H new ATOM 0 HG13 VAL A 311 1.694 11.447 -1.451 1.00 0.00 H new ATOM 0 HG21 VAL A 311 0.519 10.937 -4.240 1.00 0.00 H new ATOM 0 HG22 VAL A 311 1.765 9.943 -3.450 1.00 0.00 H new ATOM 0 HG23 VAL A 311 0.268 9.187 -4.045 1.00 0.00 H new ATOM 97 N CYS A 312 -1.373 7.522 -2.116 1.00 0.00 N ATOM 98 CA CYS A 312 -1.787 6.274 -2.817 1.00 0.00 C ATOM 99 C CYS A 312 -1.877 6.542 -4.320 1.00 0.00 C ATOM 100 O CYS A 312 -2.632 7.379 -4.767 1.00 0.00 O ATOM 101 CB CYS A 312 -3.151 5.823 -2.292 1.00 0.00 C ATOM 102 SG CYS A 312 -3.758 4.443 -3.293 1.00 0.00 S ATOM 0 H CYS A 312 -2.134 8.073 -1.719 1.00 0.00 H new ATOM 0 HA CYS A 312 -1.052 5.490 -2.632 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -3.069 5.520 -1.248 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -3.859 6.651 -2.329 1.00 0.00 H new ATOM 107 N LEU A 313 -1.110 5.840 -5.106 1.00 0.00 N ATOM 108 CA LEU A 313 -1.156 6.062 -6.576 1.00 0.00 C ATOM 109 C LEU A 313 -2.549 5.714 -7.106 1.00 0.00 C ATOM 110 O LEU A 313 -3.058 6.350 -8.007 1.00 0.00 O ATOM 111 CB LEU A 313 -0.113 5.171 -7.254 1.00 0.00 C ATOM 112 CG LEU A 313 1.292 5.704 -6.960 1.00 0.00 C ATOM 113 CD1 LEU A 313 1.670 5.411 -5.505 1.00 0.00 C ATOM 114 CD2 LEU A 313 2.298 5.021 -7.890 1.00 0.00 C ATOM 0 H LEU A 313 -0.455 5.123 -4.794 1.00 0.00 H new ATOM 0 HA LEU A 313 -0.940 7.108 -6.793 1.00 0.00 H new ATOM 0 HB2 LEU A 313 -0.206 4.147 -6.893 1.00 0.00 H new ATOM 0 HB3 LEU A 313 -0.285 5.147 -8.330 1.00 0.00 H new ATOM 0 HG LEU A 313 1.307 6.781 -7.124 1.00 0.00 H new ATOM 0 HD11 LEU A 313 2.671 5.794 -5.305 1.00 0.00 H new ATOM 0 HD12 LEU A 313 0.956 5.896 -4.839 1.00 0.00 H new ATOM 0 HD13 LEU A 313 1.652 4.335 -5.334 1.00 0.00 H new ATOM 0 HD21 LEU A 313 3.299 5.399 -7.683 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.275 3.944 -7.723 1.00 0.00 H new ATOM 0 HD23 LEU A 313 2.037 5.233 -8.927 1.00 0.00 H new ATOM 126 N LEU A 314 -3.164 4.704 -6.558 1.00 0.00 N ATOM 127 CA LEU A 314 -4.517 4.303 -7.030 1.00 0.00 C ATOM 128 C LEU A 314 -5.526 5.423 -6.760 1.00 0.00 C ATOM 129 O LEU A 314 -6.420 5.664 -7.546 1.00 0.00 O ATOM 130 CB LEU A 314 -4.943 3.041 -6.285 1.00 0.00 C ATOM 131 CG LEU A 314 -3.878 1.961 -6.473 1.00 0.00 C ATOM 132 CD1 LEU A 314 -4.312 0.688 -5.749 1.00 0.00 C ATOM 133 CD2 LEU A 314 -3.709 1.666 -7.964 1.00 0.00 C ATOM 0 H LEU A 314 -2.785 4.137 -5.800 1.00 0.00 H new ATOM 0 HA LEU A 314 -4.486 4.113 -8.103 1.00 0.00 H new ATOM 0 HB2 LEU A 314 -5.075 3.257 -5.225 1.00 0.00 H new ATOM 0 HB3 LEU A 314 -5.904 2.690 -6.661 1.00 0.00 H new ATOM 0 HG LEU A 314 -2.931 2.309 -6.062 1.00 0.00 H new ATOM 0 HD11 LEU A 314 -3.553 -0.083 -5.882 1.00 0.00 H new ATOM 0 HD12 LEU A 314 -4.434 0.897 -4.686 1.00 0.00 H new ATOM 0 HD13 LEU A 314 -5.259 0.340 -6.161 1.00 0.00 H new ATOM 0 HD21 LEU A 314 -2.950 0.896 -8.099 1.00 0.00 H new ATOM 0 HD22 LEU A 314 -4.656 1.318 -8.376 1.00 0.00 H new ATOM 0 HD23 LEU A 314 -3.401 2.574 -8.482 1.00 0.00 H new ATOM 145 N CYS A 315 -5.391 6.104 -5.654 1.00 0.00 N ATOM 146 CA CYS A 315 -6.345 7.208 -5.329 1.00 0.00 C ATOM 147 C CYS A 315 -5.565 8.496 -5.063 1.00 0.00 C ATOM 148 O CYS A 315 -5.817 9.524 -5.660 1.00 0.00 O ATOM 149 CB CYS A 315 -7.153 6.833 -4.086 1.00 0.00 C ATOM 150 SG CYS A 315 -7.392 5.037 -4.028 1.00 0.00 S ATOM 0 H CYS A 315 -4.661 5.945 -4.960 1.00 0.00 H new ATOM 0 HA CYS A 315 -7.022 7.362 -6.169 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -6.634 7.169 -3.188 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -8.119 7.337 -4.103 1.00 0.00 H new ATOM 155 N GLY A 316 -4.612 8.443 -4.176 1.00 0.00 N ATOM 156 CA GLY A 316 -3.802 9.655 -3.869 1.00 0.00 C ATOM 157 C GLY A 316 -4.504 10.506 -2.811 1.00 0.00 C ATOM 158 O GLY A 316 -4.674 11.698 -2.975 1.00 0.00 O ATOM 0 H GLY A 316 -4.358 7.608 -3.648 1.00 0.00 H new ATOM 0 HA2 GLY A 316 -2.815 9.361 -3.513 1.00 0.00 H new ATOM 0 HA3 GLY A 316 -3.652 10.240 -4.776 1.00 0.00 H new ATOM 162 N SER A 317 -4.908 9.904 -1.723 1.00 0.00 N ATOM 163 CA SER A 317 -5.594 10.680 -0.649 1.00 0.00 C ATOM 164 C SER A 317 -4.723 10.697 0.611 1.00 0.00 C ATOM 165 O SER A 317 -4.435 9.670 1.194 1.00 0.00 O ATOM 166 CB SER A 317 -6.936 10.023 -0.330 1.00 0.00 C ATOM 167 OG SER A 317 -7.642 10.828 0.606 1.00 0.00 O ATOM 0 H SER A 317 -4.792 8.909 -1.532 1.00 0.00 H new ATOM 0 HA SER A 317 -5.757 11.703 -0.988 1.00 0.00 H new ATOM 0 HB2 SER A 317 -7.522 9.906 -1.241 1.00 0.00 H new ATOM 0 HB3 SER A 317 -6.778 9.025 0.078 1.00 0.00 H new ATOM 0 HG SER A 317 -8.504 10.410 0.812 1.00 0.00 H new ATOM 173 N GLY A 318 -4.305 11.859 1.033 1.00 0.00 N ATOM 174 CA GLY A 318 -3.454 11.961 2.253 1.00 0.00 C ATOM 175 C GLY A 318 -4.219 11.448 3.479 1.00 0.00 C ATOM 176 O GLY A 318 -3.673 10.769 4.325 1.00 0.00 O ATOM 0 H GLY A 318 -4.518 12.749 0.582 1.00 0.00 H new ATOM 0 HA2 GLY A 318 -2.541 11.382 2.117 1.00 0.00 H new ATOM 0 HA3 GLY A 318 -3.154 12.997 2.410 1.00 0.00 H new ATOM 180 N ASN A 319 -5.478 11.772 3.585 1.00 0.00 N ATOM 181 CA ASN A 319 -6.276 11.309 4.759 1.00 0.00 C ATOM 182 C ASN A 319 -6.245 9.782 4.848 1.00 0.00 C ATOM 183 O ASN A 319 -6.228 9.210 5.920 1.00 0.00 O ATOM 184 CB ASN A 319 -7.725 11.769 4.600 1.00 0.00 C ATOM 185 CG ASN A 319 -8.515 11.396 5.854 1.00 0.00 C ATOM 186 OD1 ASN A 319 -8.579 12.161 6.797 1.00 0.00 O ATOM 187 ND2 ASN A 319 -9.116 10.238 5.909 1.00 0.00 N ATOM 0 H ASN A 319 -5.991 12.338 2.909 1.00 0.00 H new ATOM 0 HA ASN A 319 -5.847 11.732 5.667 1.00 0.00 H new ATOM 0 HB2 ASN A 319 -7.761 12.847 4.441 1.00 0.00 H new ATOM 0 HB3 ASN A 319 -8.172 11.302 3.722 1.00 0.00 H new ATOM 0 HD21 ASN A 319 -9.640 9.974 6.744 1.00 0.00 H new ATOM 0 HD22 ASN A 319 -9.062 9.597 5.117 1.00 0.00 H new ATOM 194 N ASP A 320 -6.257 9.123 3.728 1.00 0.00 N ATOM 195 CA ASP A 320 -6.252 7.635 3.722 1.00 0.00 C ATOM 196 C ASP A 320 -4.899 7.100 4.210 1.00 0.00 C ATOM 197 O ASP A 320 -4.714 5.908 4.359 1.00 0.00 O ATOM 198 CB ASP A 320 -6.529 7.144 2.306 1.00 0.00 C ATOM 199 CG ASP A 320 -7.944 7.553 1.893 1.00 0.00 C ATOM 200 OD1 ASP A 320 -8.688 7.992 2.755 1.00 0.00 O ATOM 201 OD2 ASP A 320 -8.261 7.421 0.722 1.00 0.00 O ATOM 0 H ASP A 320 -6.270 9.556 2.804 1.00 0.00 H new ATOM 0 HA ASP A 320 -7.026 7.269 4.397 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -5.800 7.566 1.614 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -6.423 6.060 2.258 1.00 0.00 H new ATOM 206 N GLU A 321 -3.950 7.964 4.454 1.00 0.00 N ATOM 207 CA GLU A 321 -2.612 7.495 4.923 1.00 0.00 C ATOM 208 C GLU A 321 -2.764 6.567 6.129 1.00 0.00 C ATOM 209 O GLU A 321 -1.909 5.748 6.398 1.00 0.00 O ATOM 210 CB GLU A 321 -1.760 8.700 5.317 1.00 0.00 C ATOM 211 CG GLU A 321 -1.155 9.325 4.062 1.00 0.00 C ATOM 212 CD GLU A 321 -0.324 10.547 4.452 1.00 0.00 C ATOM 213 OE1 GLU A 321 -0.403 10.951 5.600 1.00 0.00 O ATOM 214 OE2 GLU A 321 0.380 11.056 3.596 1.00 0.00 O ATOM 0 H GLU A 321 -4.043 8.974 4.349 1.00 0.00 H new ATOM 0 HA GLU A 321 -2.129 6.947 4.114 1.00 0.00 H new ATOM 0 HB2 GLU A 321 -2.370 9.434 5.844 1.00 0.00 H new ATOM 0 HB3 GLU A 321 -0.969 8.392 6.001 1.00 0.00 H new ATOM 0 HG2 GLU A 321 -0.530 8.597 3.545 1.00 0.00 H new ATOM 0 HG3 GLU A 321 -1.945 9.615 3.370 1.00 0.00 H new ATOM 221 N ASP A 322 -3.832 6.686 6.861 1.00 0.00 N ATOM 222 CA ASP A 322 -4.013 5.808 8.046 1.00 0.00 C ATOM 223 C ASP A 322 -3.959 4.336 7.619 1.00 0.00 C ATOM 224 O ASP A 322 -3.443 3.499 8.333 1.00 0.00 O ATOM 225 CB ASP A 322 -5.370 6.103 8.685 1.00 0.00 C ATOM 226 CG ASP A 322 -5.357 7.510 9.287 1.00 0.00 C ATOM 227 OD1 ASP A 322 -4.283 8.081 9.385 1.00 0.00 O ATOM 228 OD2 ASP A 322 -6.420 7.992 9.641 1.00 0.00 O ATOM 0 H ASP A 322 -4.586 7.351 6.691 1.00 0.00 H new ATOM 0 HA ASP A 322 -3.216 6.000 8.764 1.00 0.00 H new ATOM 0 HB2 ASP A 322 -6.160 6.023 7.939 1.00 0.00 H new ATOM 0 HB3 ASP A 322 -5.587 5.367 9.459 1.00 0.00 H new ATOM 233 N ARG A 323 -4.489 4.013 6.466 1.00 0.00 N ATOM 234 CA ARG A 323 -4.467 2.593 6.001 1.00 0.00 C ATOM 235 C ARG A 323 -3.617 2.446 4.735 1.00 0.00 C ATOM 236 O ARG A 323 -3.664 1.433 4.064 1.00 0.00 O ATOM 237 CB ARG A 323 -5.893 2.121 5.714 1.00 0.00 C ATOM 238 CG ARG A 323 -6.681 2.062 7.023 1.00 0.00 C ATOM 239 CD ARG A 323 -8.031 1.394 6.774 1.00 0.00 C ATOM 240 NE ARG A 323 -8.804 2.188 5.777 1.00 0.00 N ATOM 241 CZ ARG A 323 -9.273 3.361 6.100 1.00 0.00 C ATOM 242 NH1 ARG A 323 -9.066 3.841 7.296 1.00 0.00 N ATOM 243 NH2 ARG A 323 -9.952 4.056 5.228 1.00 0.00 N ATOM 0 H ARG A 323 -4.936 4.671 5.827 1.00 0.00 H new ATOM 0 HA ARG A 323 -4.027 1.981 6.789 1.00 0.00 H new ATOM 0 HB2 ARG A 323 -6.379 2.801 5.014 1.00 0.00 H new ATOM 0 HB3 ARG A 323 -5.875 1.138 5.243 1.00 0.00 H new ATOM 0 HG2 ARG A 323 -6.120 1.504 7.773 1.00 0.00 H new ATOM 0 HG3 ARG A 323 -6.828 3.068 7.417 1.00 0.00 H new ATOM 0 HD2 ARG A 323 -7.884 0.377 6.409 1.00 0.00 H new ATOM 0 HD3 ARG A 323 -8.589 1.320 7.707 1.00 0.00 H new ATOM 0 HE ARG A 323 -8.966 1.814 4.842 1.00 0.00 H new ATOM 0 HH11 ARG A 323 -8.537 3.298 7.979 1.00 0.00 H new ATOM 0 HH12 ARG A 323 -9.433 4.759 7.548 1.00 0.00 H new ATOM 0 HH21 ARG A 323 -10.116 3.681 4.294 1.00 0.00 H new ATOM 0 HH22 ARG A 323 -10.319 4.974 5.481 1.00 0.00 H new ATOM 257 N LEU A 324 -2.837 3.435 4.397 1.00 0.00 N ATOM 258 CA LEU A 324 -1.990 3.325 3.174 1.00 0.00 C ATOM 259 C LEU A 324 -0.837 2.359 3.446 1.00 0.00 C ATOM 260 O LEU A 324 -0.106 2.495 4.406 1.00 0.00 O ATOM 261 CB LEU A 324 -1.451 4.709 2.807 1.00 0.00 C ATOM 262 CG LEU A 324 -0.540 4.619 1.580 1.00 0.00 C ATOM 263 CD1 LEU A 324 -1.351 4.151 0.372 1.00 0.00 C ATOM 264 CD2 LEU A 324 0.045 6.004 1.288 1.00 0.00 C ATOM 0 H LEU A 324 -2.749 4.311 4.911 1.00 0.00 H new ATOM 0 HA LEU A 324 -2.582 2.945 2.341 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -2.280 5.387 2.603 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -0.898 5.126 3.649 1.00 0.00 H new ATOM 0 HG LEU A 324 0.264 3.909 1.774 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -0.701 4.088 -0.500 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -1.778 3.170 0.578 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -2.154 4.862 0.175 1.00 0.00 H new ATOM 0 HD21 LEU A 324 0.695 5.948 0.415 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -0.765 6.707 1.093 1.00 0.00 H new ATOM 0 HD23 LEU A 324 0.621 6.344 2.148 1.00 0.00 H new ATOM 276 N LEU A 325 -0.688 1.369 2.609 1.00 0.00 N ATOM 277 CA LEU A 325 0.395 0.370 2.811 1.00 0.00 C ATOM 278 C LEU A 325 1.549 0.663 1.847 1.00 0.00 C ATOM 279 O LEU A 325 1.354 0.806 0.657 1.00 0.00 O ATOM 280 CB LEU A 325 -0.177 -1.028 2.533 1.00 0.00 C ATOM 281 CG LEU A 325 0.754 -2.119 3.075 1.00 0.00 C ATOM 282 CD1 LEU A 325 -0.086 -3.335 3.480 1.00 0.00 C ATOM 283 CD2 LEU A 325 1.752 -2.537 1.990 1.00 0.00 C ATOM 0 H LEU A 325 -1.274 1.210 1.790 1.00 0.00 H new ATOM 0 HA LEU A 325 0.770 0.421 3.833 1.00 0.00 H new ATOM 0 HB2 LEU A 325 -1.160 -1.121 2.995 1.00 0.00 H new ATOM 0 HB3 LEU A 325 -0.315 -1.162 1.460 1.00 0.00 H new ATOM 0 HG LEU A 325 1.299 -1.735 3.937 1.00 0.00 H new ATOM 0 HD11 LEU A 325 0.568 -4.116 3.867 1.00 0.00 H new ATOM 0 HD12 LEU A 325 -0.799 -3.044 4.251 1.00 0.00 H new ATOM 0 HD13 LEU A 325 -0.625 -3.711 2.610 1.00 0.00 H new ATOM 0 HD21 LEU A 325 2.411 -3.312 2.381 1.00 0.00 H new ATOM 0 HD22 LEU A 325 1.210 -2.923 1.126 1.00 0.00 H new ATOM 0 HD23 LEU A 325 2.346 -1.674 1.690 1.00 0.00 H new ATOM 295 N LEU A 326 2.749 0.747 2.353 1.00 0.00 N ATOM 296 CA LEU A 326 3.915 1.025 1.473 1.00 0.00 C ATOM 297 C LEU A 326 4.538 -0.300 1.026 1.00 0.00 C ATOM 298 O LEU A 326 4.649 -1.235 1.794 1.00 0.00 O ATOM 299 CB LEU A 326 4.947 1.837 2.251 1.00 0.00 C ATOM 300 CG LEU A 326 5.365 1.063 3.500 1.00 0.00 C ATOM 301 CD1 LEU A 326 6.773 0.503 3.302 1.00 0.00 C ATOM 302 CD2 LEU A 326 5.353 2.001 4.708 1.00 0.00 C ATOM 0 H LEU A 326 2.971 0.634 3.342 1.00 0.00 H new ATOM 0 HA LEU A 326 3.592 1.588 0.597 1.00 0.00 H new ATOM 0 HB2 LEU A 326 5.817 2.036 1.625 1.00 0.00 H new ATOM 0 HB3 LEU A 326 4.529 2.804 2.532 1.00 0.00 H new ATOM 0 HG LEU A 326 4.668 0.243 3.671 1.00 0.00 H new ATOM 0 HD11 LEU A 326 7.073 -0.050 4.192 1.00 0.00 H new ATOM 0 HD12 LEU A 326 6.781 -0.165 2.440 1.00 0.00 H new ATOM 0 HD13 LEU A 326 7.470 1.323 3.132 1.00 0.00 H new ATOM 0 HD21 LEU A 326 5.651 1.450 5.600 1.00 0.00 H new ATOM 0 HD22 LEU A 326 6.050 2.821 4.539 1.00 0.00 H new ATOM 0 HD23 LEU A 326 4.349 2.401 4.848 1.00 0.00 H new ATOM 314 N CYS A 327 4.936 -0.394 -0.214 1.00 0.00 N ATOM 315 CA CYS A 327 5.540 -1.662 -0.709 1.00 0.00 C ATOM 316 C CYS A 327 7.059 -1.623 -0.539 1.00 0.00 C ATOM 317 O CYS A 327 7.747 -0.861 -1.189 1.00 0.00 O ATOM 318 CB CYS A 327 5.207 -1.834 -2.188 1.00 0.00 C ATOM 319 SG CYS A 327 6.089 -3.271 -2.842 1.00 0.00 S ATOM 0 H CYS A 327 4.869 0.353 -0.905 1.00 0.00 H new ATOM 0 HA CYS A 327 5.137 -2.496 -0.135 1.00 0.00 H new ATOM 0 HB2 CYS A 327 4.132 -1.964 -2.317 1.00 0.00 H new ATOM 0 HB3 CYS A 327 5.489 -0.938 -2.742 1.00 0.00 H new ATOM 324 N ASP A 328 7.588 -2.446 0.326 1.00 0.00 N ATOM 325 CA ASP A 328 9.064 -2.466 0.533 1.00 0.00 C ATOM 326 C ASP A 328 9.753 -3.021 -0.717 1.00 0.00 C ATOM 327 O ASP A 328 10.812 -2.569 -1.108 1.00 0.00 O ATOM 328 CB ASP A 328 9.398 -3.353 1.734 1.00 0.00 C ATOM 329 CG ASP A 328 8.836 -2.720 3.008 1.00 0.00 C ATOM 330 OD1 ASP A 328 8.467 -1.559 2.956 1.00 0.00 O ATOM 331 OD2 ASP A 328 8.786 -3.407 4.015 1.00 0.00 O ATOM 0 H ASP A 328 7.061 -3.106 0.898 1.00 0.00 H new ATOM 0 HA ASP A 328 9.416 -1.451 0.719 1.00 0.00 H new ATOM 0 HB2 ASP A 328 8.976 -4.348 1.593 1.00 0.00 H new ATOM 0 HB3 ASP A 328 10.478 -3.474 1.821 1.00 0.00 H new ATOM 336 N GLY A 329 9.165 -4.006 -1.341 1.00 0.00 N ATOM 337 CA GLY A 329 9.788 -4.603 -2.558 1.00 0.00 C ATOM 338 C GLY A 329 9.980 -3.530 -3.630 1.00 0.00 C ATOM 339 O GLY A 329 10.978 -3.500 -4.322 1.00 0.00 O ATOM 0 H GLY A 329 8.278 -4.424 -1.060 1.00 0.00 H new ATOM 0 HA2 GLY A 329 10.749 -5.049 -2.302 1.00 0.00 H new ATOM 0 HA3 GLY A 329 9.157 -5.404 -2.943 1.00 0.00 H new ATOM 343 N CYS A 330 9.032 -2.648 -3.773 1.00 0.00 N ATOM 344 CA CYS A 330 9.160 -1.577 -4.801 1.00 0.00 C ATOM 345 C CYS A 330 8.466 -0.310 -4.301 1.00 0.00 C ATOM 346 O CYS A 330 7.621 -0.359 -3.430 1.00 0.00 O ATOM 347 CB CYS A 330 8.512 -2.040 -6.108 1.00 0.00 C ATOM 348 SG CYS A 330 6.754 -1.606 -6.104 1.00 0.00 S ATOM 0 H CYS A 330 8.174 -2.622 -3.223 1.00 0.00 H new ATOM 0 HA CYS A 330 10.214 -1.366 -4.979 1.00 0.00 H new ATOM 0 HB2 CYS A 330 9.010 -1.573 -6.958 1.00 0.00 H new ATOM 0 HB3 CYS A 330 8.630 -3.118 -6.222 1.00 0.00 H new ATOM 353 N ASP A 331 8.814 0.824 -4.841 1.00 0.00 N ATOM 354 CA ASP A 331 8.172 2.087 -4.385 1.00 0.00 C ATOM 355 C ASP A 331 6.725 2.126 -4.873 1.00 0.00 C ATOM 356 O ASP A 331 6.416 2.712 -5.892 1.00 0.00 O ATOM 357 CB ASP A 331 8.936 3.283 -4.955 1.00 0.00 C ATOM 358 CG ASP A 331 8.391 4.576 -4.346 1.00 0.00 C ATOM 359 OD1 ASP A 331 7.552 4.484 -3.465 1.00 0.00 O ATOM 360 OD2 ASP A 331 8.820 5.636 -4.772 1.00 0.00 O ATOM 0 H ASP A 331 9.513 0.931 -5.576 1.00 0.00 H new ATOM 0 HA ASP A 331 8.190 2.132 -3.296 1.00 0.00 H new ATOM 0 HB2 ASP A 331 9.999 3.186 -4.736 1.00 0.00 H new ATOM 0 HB3 ASP A 331 8.835 3.309 -6.040 1.00 0.00 H new ATOM 365 N ASP A 332 5.833 1.512 -4.147 1.00 0.00 N ATOM 366 CA ASP A 332 4.403 1.515 -4.558 1.00 0.00 C ATOM 367 C ASP A 332 3.526 1.580 -3.308 1.00 0.00 C ATOM 368 O ASP A 332 3.689 0.800 -2.391 1.00 0.00 O ATOM 369 CB ASP A 332 4.089 0.237 -5.339 1.00 0.00 C ATOM 370 CG ASP A 332 2.665 0.313 -5.892 1.00 0.00 C ATOM 371 OD1 ASP A 332 2.049 1.355 -5.749 1.00 0.00 O ATOM 372 OD2 ASP A 332 2.215 -0.674 -6.452 1.00 0.00 O ATOM 0 H ASP A 332 6.034 1.007 -3.284 1.00 0.00 H new ATOM 0 HA ASP A 332 4.205 2.379 -5.193 1.00 0.00 H new ATOM 0 HB2 ASP A 332 4.801 0.113 -6.155 1.00 0.00 H new ATOM 0 HB3 ASP A 332 4.193 -0.633 -4.690 1.00 0.00 H new ATOM 377 N SER A 333 2.601 2.502 -3.261 1.00 0.00 N ATOM 378 CA SER A 333 1.721 2.613 -2.064 1.00 0.00 C ATOM 379 C SER A 333 0.258 2.440 -2.475 1.00 0.00 C ATOM 380 O SER A 333 -0.185 2.957 -3.482 1.00 0.00 O ATOM 381 CB SER A 333 1.903 3.990 -1.428 1.00 0.00 C ATOM 382 OG SER A 333 3.269 4.166 -1.074 1.00 0.00 O ATOM 0 H SER A 333 2.418 3.182 -3.999 1.00 0.00 H new ATOM 0 HA SER A 333 1.990 1.835 -1.349 1.00 0.00 H new ATOM 0 HB2 SER A 333 1.592 4.769 -2.124 1.00 0.00 H new ATOM 0 HB3 SER A 333 1.271 4.082 -0.544 1.00 0.00 H new ATOM 0 HG SER A 333 3.589 5.025 -1.422 1.00 0.00 H new ATOM 388 N TYR A 334 -0.498 1.727 -1.684 1.00 0.00 N ATOM 389 CA TYR A 334 -1.938 1.524 -2.001 1.00 0.00 C ATOM 390 C TYR A 334 -2.710 1.299 -0.701 1.00 0.00 C ATOM 391 O TYR A 334 -2.146 0.922 0.307 1.00 0.00 O ATOM 392 CB TYR A 334 -2.111 0.318 -2.926 1.00 0.00 C ATOM 393 CG TYR A 334 -1.205 -0.806 -2.488 1.00 0.00 C ATOM 394 CD1 TYR A 334 -1.450 -1.479 -1.287 1.00 0.00 C ATOM 395 CD2 TYR A 334 -0.125 -1.180 -3.293 1.00 0.00 C ATOM 396 CE1 TYR A 334 -0.611 -2.527 -0.888 1.00 0.00 C ATOM 397 CE2 TYR A 334 0.713 -2.229 -2.898 1.00 0.00 C ATOM 398 CZ TYR A 334 0.471 -2.902 -1.694 1.00 0.00 C ATOM 399 OH TYR A 334 1.296 -3.937 -1.303 1.00 0.00 O ATOM 0 H TYR A 334 -0.177 1.275 -0.828 1.00 0.00 H new ATOM 0 HA TYR A 334 -2.324 2.408 -2.508 1.00 0.00 H new ATOM 0 HB2 TYR A 334 -3.149 -0.015 -2.912 1.00 0.00 H new ATOM 0 HB3 TYR A 334 -1.881 0.602 -3.953 1.00 0.00 H new ATOM 0 HD1 TYR A 334 -2.286 -1.191 -0.667 1.00 0.00 H new ATOM 0 HD2 TYR A 334 0.063 -0.659 -4.220 1.00 0.00 H new ATOM 0 HE1 TYR A 334 -0.798 -3.046 0.041 1.00 0.00 H new ATOM 0 HE2 TYR A 334 1.546 -2.519 -3.521 1.00 0.00 H new ATOM 0 HH TYR A 334 2.037 -3.581 -0.770 1.00 0.00 H new ATOM 409 N HIS A 335 -3.991 1.538 -0.707 1.00 0.00 N ATOM 410 CA HIS A 335 -4.783 1.345 0.538 1.00 0.00 C ATOM 411 C HIS A 335 -5.123 -0.132 0.713 1.00 0.00 C ATOM 412 O HIS A 335 -5.193 -0.886 -0.239 1.00 0.00 O ATOM 413 CB HIS A 335 -6.069 2.165 0.460 1.00 0.00 C ATOM 414 CG HIS A 335 -5.713 3.615 0.319 1.00 0.00 C ATOM 415 ND1 HIS A 335 -6.154 4.391 -0.745 1.00 0.00 N ATOM 416 CD2 HIS A 335 -4.949 4.444 1.099 1.00 0.00 C ATOM 417 CE1 HIS A 335 -5.652 5.629 -0.572 1.00 0.00 C ATOM 418 NE2 HIS A 335 -4.913 5.711 0.534 1.00 0.00 N ATOM 0 H HIS A 335 -4.522 1.857 -1.517 1.00 0.00 H new ATOM 0 HA HIS A 335 -4.194 1.678 1.393 1.00 0.00 H new ATOM 0 HB2 HIS A 335 -6.672 1.841 -0.388 1.00 0.00 H new ATOM 0 HB3 HIS A 335 -6.670 2.010 1.356 1.00 0.00 H new ATOM 0 HD2 HIS A 335 -4.451 4.155 2.013 1.00 0.00 H new ATOM 0 HE1 HIS A 335 -5.827 6.454 -1.247 1.00 0.00 H new ATOM 0 HE2 HIS A 335 -4.424 6.532 0.890 1.00 0.00 H new ATOM 426 N THR A 336 -5.326 -0.549 1.929 1.00 0.00 N ATOM 427 CA THR A 336 -5.651 -1.972 2.193 1.00 0.00 C ATOM 428 C THR A 336 -7.024 -2.313 1.607 1.00 0.00 C ATOM 429 O THR A 336 -7.353 -3.467 1.419 1.00 0.00 O ATOM 430 CB THR A 336 -5.671 -2.194 3.707 1.00 0.00 C ATOM 431 OG1 THR A 336 -6.712 -1.415 4.283 1.00 0.00 O ATOM 432 CG2 THR A 336 -4.327 -1.777 4.307 1.00 0.00 C ATOM 0 H THR A 336 -5.280 0.043 2.758 1.00 0.00 H new ATOM 0 HA THR A 336 -4.902 -2.613 1.728 1.00 0.00 H new ATOM 0 HB THR A 336 -5.845 -3.249 3.917 1.00 0.00 H new ATOM 0 HG1 THR A 336 -7.413 -2.008 4.626 1.00 0.00 H new ATOM 0 HG21 THR A 336 -4.345 -1.936 5.385 1.00 0.00 H new ATOM 0 HG22 THR A 336 -3.530 -2.375 3.865 1.00 0.00 H new ATOM 0 HG23 THR A 336 -4.147 -0.722 4.099 1.00 0.00 H new ATOM 440 N PHE A 337 -7.832 -1.322 1.333 1.00 0.00 N ATOM 441 CA PHE A 337 -9.190 -1.595 0.779 1.00 0.00 C ATOM 442 C PHE A 337 -9.294 -1.132 -0.680 1.00 0.00 C ATOM 443 O PHE A 337 -10.358 -1.183 -1.265 1.00 0.00 O ATOM 444 CB PHE A 337 -10.230 -0.841 1.606 1.00 0.00 C ATOM 445 CG PHE A 337 -9.980 0.640 1.478 1.00 0.00 C ATOM 446 CD1 PHE A 337 -10.555 1.356 0.423 1.00 0.00 C ATOM 447 CD2 PHE A 337 -9.165 1.295 2.408 1.00 0.00 C ATOM 448 CE1 PHE A 337 -10.316 2.728 0.296 1.00 0.00 C ATOM 449 CE2 PHE A 337 -8.924 2.668 2.281 1.00 0.00 C ATOM 450 CZ PHE A 337 -9.500 3.386 1.226 1.00 0.00 C ATOM 0 H PHE A 337 -7.610 -0.336 1.469 1.00 0.00 H new ATOM 0 HA PHE A 337 -9.368 -2.670 0.821 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -11.235 -1.084 1.260 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -10.171 -1.144 2.651 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -11.184 0.849 -0.294 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -8.722 0.742 3.223 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -10.760 3.280 -0.519 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -8.293 3.174 2.997 1.00 0.00 H new ATOM 0 HZ PHE A 337 -9.316 4.446 1.129 1.00 0.00 H new ATOM 460 N CYS A 338 -8.219 -0.674 -1.272 1.00 0.00 N ATOM 461 CA CYS A 338 -8.301 -0.207 -2.693 1.00 0.00 C ATOM 462 C CYS A 338 -7.284 -0.954 -3.559 1.00 0.00 C ATOM 463 O CYS A 338 -6.772 -0.424 -4.524 1.00 0.00 O ATOM 464 CB CYS A 338 -8.039 1.305 -2.758 1.00 0.00 C ATOM 465 SG CYS A 338 -6.268 1.633 -2.953 1.00 0.00 S ATOM 0 H CYS A 338 -7.298 -0.603 -0.840 1.00 0.00 H new ATOM 0 HA CYS A 338 -9.300 -0.414 -3.075 1.00 0.00 H new ATOM 0 HB2 CYS A 338 -8.590 1.740 -3.592 1.00 0.00 H new ATOM 0 HB3 CYS A 338 -8.406 1.783 -1.850 1.00 0.00 H new ATOM 470 N LEU A 339 -7.001 -2.190 -3.234 1.00 0.00 N ATOM 471 CA LEU A 339 -6.030 -2.973 -4.057 1.00 0.00 C ATOM 472 C LEU A 339 -5.955 -4.418 -3.561 1.00 0.00 C ATOM 473 O LEU A 339 -5.957 -5.352 -4.337 1.00 0.00 O ATOM 474 CB LEU A 339 -4.637 -2.345 -3.959 1.00 0.00 C ATOM 475 CG LEU A 339 -3.689 -3.051 -4.936 1.00 0.00 C ATOM 476 CD1 LEU A 339 -4.074 -2.705 -6.378 1.00 0.00 C ATOM 477 CD2 LEU A 339 -2.254 -2.594 -4.671 1.00 0.00 C ATOM 0 H LEU A 339 -7.398 -2.689 -2.438 1.00 0.00 H new ATOM 0 HA LEU A 339 -6.371 -2.961 -5.092 1.00 0.00 H new ATOM 0 HB2 LEU A 339 -4.689 -1.281 -4.190 1.00 0.00 H new ATOM 0 HB3 LEU A 339 -4.258 -2.432 -2.941 1.00 0.00 H new ATOM 0 HG LEU A 339 -3.764 -4.129 -4.793 1.00 0.00 H new ATOM 0 HD11 LEU A 339 -3.396 -3.210 -7.067 1.00 0.00 H new ATOM 0 HD12 LEU A 339 -5.096 -3.031 -6.570 1.00 0.00 H new ATOM 0 HD13 LEU A 339 -4.004 -1.627 -6.525 1.00 0.00 H new ATOM 0 HD21 LEU A 339 -1.579 -3.095 -5.365 1.00 0.00 H new ATOM 0 HD22 LEU A 339 -2.184 -1.515 -4.811 1.00 0.00 H new ATOM 0 HD23 LEU A 339 -1.975 -2.846 -3.648 1.00 0.00 H new ATOM 489 N ILE A 340 -5.861 -4.603 -2.277 1.00 0.00 N ATOM 490 CA ILE A 340 -5.751 -5.976 -1.718 1.00 0.00 C ATOM 491 C ILE A 340 -7.031 -6.331 -0.949 1.00 0.00 C ATOM 492 O ILE A 340 -7.692 -5.464 -0.412 1.00 0.00 O ATOM 493 CB ILE A 340 -4.545 -5.995 -0.782 1.00 0.00 C ATOM 494 CG1 ILE A 340 -4.807 -5.057 0.394 1.00 0.00 C ATOM 495 CG2 ILE A 340 -3.305 -5.518 -1.542 1.00 0.00 C ATOM 496 CD1 ILE A 340 -3.554 -4.964 1.266 1.00 0.00 C ATOM 0 H ILE A 340 -5.856 -3.855 -1.584 1.00 0.00 H new ATOM 0 HA ILE A 340 -5.624 -6.709 -2.514 1.00 0.00 H new ATOM 0 HB ILE A 340 -4.382 -7.008 -0.415 1.00 0.00 H new ATOM 0 HG12 ILE A 340 -5.082 -4.068 0.029 1.00 0.00 H new ATOM 0 HG13 ILE A 340 -5.647 -5.424 0.984 1.00 0.00 H new ATOM 0 HG21 ILE A 340 -2.443 -5.531 -0.876 1.00 0.00 H new ATOM 0 HG22 ILE A 340 -3.120 -6.180 -2.388 1.00 0.00 H new ATOM 0 HG23 ILE A 340 -3.468 -4.503 -1.904 1.00 0.00 H new ATOM 0 HD11 ILE A 340 -3.743 -4.294 2.105 1.00 0.00 H new ATOM 0 HD12 ILE A 340 -3.299 -5.954 1.643 1.00 0.00 H new ATOM 0 HD13 ILE A 340 -2.726 -4.577 0.673 1.00 0.00 H new ATOM 508 N PRO A 341 -7.384 -7.600 -0.891 1.00 0.00 N ATOM 509 CA PRO A 341 -8.604 -8.051 -0.172 1.00 0.00 C ATOM 510 C PRO A 341 -8.762 -7.360 1.190 1.00 0.00 C ATOM 511 O PRO A 341 -9.808 -6.813 1.475 1.00 0.00 O ATOM 512 CB PRO A 341 -8.435 -9.568 -0.011 1.00 0.00 C ATOM 513 CG PRO A 341 -7.156 -9.945 -0.701 1.00 0.00 C ATOM 514 CD PRO A 341 -6.670 -8.730 -1.495 1.00 0.00 C ATOM 0 HA PRO A 341 -9.507 -7.795 -0.726 1.00 0.00 H new ATOM 0 HB2 PRO A 341 -8.399 -9.842 1.043 1.00 0.00 H new ATOM 0 HB3 PRO A 341 -9.280 -10.099 -0.450 1.00 0.00 H new ATOM 0 HG2 PRO A 341 -6.405 -10.249 0.028 1.00 0.00 H new ATOM 0 HG3 PRO A 341 -7.317 -10.794 -1.365 1.00 0.00 H new ATOM 0 HD2 PRO A 341 -5.590 -8.608 -1.415 1.00 0.00 H new ATOM 0 HD3 PRO A 341 -6.902 -8.828 -2.555 1.00 0.00 H new ATOM 522 N PRO A 342 -7.738 -7.353 2.022 1.00 0.00 N ATOM 523 CA PRO A 342 -7.791 -6.676 3.341 1.00 0.00 C ATOM 524 C PRO A 342 -8.664 -5.415 3.307 1.00 0.00 C ATOM 525 O PRO A 342 -8.956 -4.884 2.255 1.00 0.00 O ATOM 526 CB PRO A 342 -6.332 -6.318 3.597 1.00 0.00 C ATOM 527 CG PRO A 342 -5.531 -7.374 2.903 1.00 0.00 C ATOM 528 CD PRO A 342 -6.424 -7.998 1.825 1.00 0.00 C ATOM 0 HA PRO A 342 -8.233 -7.302 4.116 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -6.097 -5.328 3.207 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -6.114 -6.299 4.665 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -4.635 -6.943 2.456 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -5.200 -8.132 3.613 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -6.033 -7.808 0.825 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -6.490 -9.080 1.941 1.00 0.00 H new ATOM 536 N LEU A 343 -9.091 -4.933 4.445 1.00 0.00 N ATOM 537 CA LEU A 343 -9.960 -3.720 4.456 1.00 0.00 C ATOM 538 C LEU A 343 -9.533 -2.750 5.562 1.00 0.00 C ATOM 539 O LEU A 343 -8.382 -2.378 5.673 1.00 0.00 O ATOM 540 CB LEU A 343 -11.412 -4.144 4.695 1.00 0.00 C ATOM 541 CG LEU A 343 -11.887 -5.047 3.553 1.00 0.00 C ATOM 542 CD1 LEU A 343 -13.250 -5.643 3.910 1.00 0.00 C ATOM 543 CD2 LEU A 343 -12.021 -4.227 2.265 1.00 0.00 C ATOM 0 H LEU A 343 -8.877 -5.324 5.362 1.00 0.00 H new ATOM 0 HA LEU A 343 -9.864 -3.216 3.494 1.00 0.00 H new ATOM 0 HB2 LEU A 343 -11.494 -4.672 5.645 1.00 0.00 H new ATOM 0 HB3 LEU A 343 -12.050 -3.263 4.763 1.00 0.00 H new ATOM 0 HG LEU A 343 -11.161 -5.846 3.402 1.00 0.00 H new ATOM 0 HD11 LEU A 343 -13.590 -6.286 3.098 1.00 0.00 H new ATOM 0 HD12 LEU A 343 -13.162 -6.229 4.825 1.00 0.00 H new ATOM 0 HD13 LEU A 343 -13.970 -4.839 4.062 1.00 0.00 H new ATOM 0 HD21 LEU A 343 -12.359 -4.874 1.455 1.00 0.00 H new ATOM 0 HD22 LEU A 343 -12.745 -3.427 2.417 1.00 0.00 H new ATOM 0 HD23 LEU A 343 -11.054 -3.796 2.006 1.00 0.00 H new ATOM 555 N HIS A 344 -10.470 -2.324 6.368 1.00 0.00 N ATOM 556 CA HIS A 344 -10.156 -1.359 7.460 1.00 0.00 C ATOM 557 C HIS A 344 -8.986 -1.866 8.304 1.00 0.00 C ATOM 558 O HIS A 344 -8.159 -1.098 8.753 1.00 0.00 O ATOM 559 CB HIS A 344 -11.386 -1.187 8.353 1.00 0.00 C ATOM 560 CG HIS A 344 -12.502 -0.572 7.555 1.00 0.00 C ATOM 561 ND1 HIS A 344 -13.468 -1.341 6.918 1.00 0.00 N ATOM 562 CD2 HIS A 344 -12.821 0.735 7.277 1.00 0.00 C ATOM 563 CE1 HIS A 344 -14.312 -0.497 6.296 1.00 0.00 C ATOM 564 NE2 HIS A 344 -13.961 0.776 6.484 1.00 0.00 N ATOM 0 H HIS A 344 -11.449 -2.607 6.315 1.00 0.00 H new ATOM 0 HA HIS A 344 -9.881 -0.403 7.015 1.00 0.00 H new ATOM 0 HB2 HIS A 344 -11.698 -2.153 8.751 1.00 0.00 H new ATOM 0 HB3 HIS A 344 -11.143 -0.554 9.207 1.00 0.00 H new ATOM 0 HD2 HIS A 344 -12.270 1.598 7.622 1.00 0.00 H new ATOM 0 HE1 HIS A 344 -15.167 -0.812 5.717 1.00 0.00 H new ATOM 0 HE2 HIS A 344 -14.431 1.606 6.122 1.00 0.00 H new ATOM 573 N ASP A 345 -8.912 -3.144 8.535 1.00 0.00 N ATOM 574 CA ASP A 345 -7.800 -3.681 9.360 1.00 0.00 C ATOM 575 C ASP A 345 -6.555 -3.865 8.490 1.00 0.00 C ATOM 576 O ASP A 345 -6.627 -4.360 7.382 1.00 0.00 O ATOM 577 CB ASP A 345 -8.217 -5.027 9.951 1.00 0.00 C ATOM 578 CG ASP A 345 -9.350 -4.814 10.956 1.00 0.00 C ATOM 579 OD1 ASP A 345 -9.587 -3.675 11.321 1.00 0.00 O ATOM 580 OD2 ASP A 345 -9.962 -5.795 11.346 1.00 0.00 O ATOM 0 H ASP A 345 -9.573 -3.839 8.188 1.00 0.00 H new ATOM 0 HA ASP A 345 -7.573 -2.982 10.165 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -8.542 -5.700 9.157 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -7.366 -5.500 10.441 1.00 0.00 H new ATOM 585 N VAL A 346 -5.413 -3.469 8.984 1.00 0.00 N ATOM 586 CA VAL A 346 -4.166 -3.619 8.187 1.00 0.00 C ATOM 587 C VAL A 346 -3.589 -5.029 8.402 1.00 0.00 C ATOM 588 O VAL A 346 -3.447 -5.471 9.525 1.00 0.00 O ATOM 589 CB VAL A 346 -3.143 -2.578 8.648 1.00 0.00 C ATOM 590 CG1 VAL A 346 -1.889 -2.673 7.777 1.00 0.00 C ATOM 591 CG2 VAL A 346 -3.748 -1.179 8.519 1.00 0.00 C ATOM 0 H VAL A 346 -5.292 -3.048 9.905 1.00 0.00 H new ATOM 0 HA VAL A 346 -4.388 -3.472 7.130 1.00 0.00 H new ATOM 0 HB VAL A 346 -2.877 -2.766 9.688 1.00 0.00 H new ATOM 0 HG11 VAL A 346 -1.161 -1.932 8.106 1.00 0.00 H new ATOM 0 HG12 VAL A 346 -1.458 -3.670 7.867 1.00 0.00 H new ATOM 0 HG13 VAL A 346 -2.154 -2.485 6.736 1.00 0.00 H new ATOM 0 HG21 VAL A 346 -3.021 -0.436 8.847 1.00 0.00 H new ATOM 0 HG22 VAL A 346 -4.014 -0.992 7.479 1.00 0.00 H new ATOM 0 HG23 VAL A 346 -4.642 -1.110 9.139 1.00 0.00 H new ATOM 601 N PRO A 347 -3.257 -5.738 7.345 1.00 0.00 N ATOM 602 CA PRO A 347 -2.691 -7.114 7.453 1.00 0.00 C ATOM 603 C PRO A 347 -1.244 -7.108 7.959 1.00 0.00 C ATOM 604 O PRO A 347 -0.545 -6.119 7.852 1.00 0.00 O ATOM 605 CB PRO A 347 -2.761 -7.654 6.025 1.00 0.00 C ATOM 606 CG PRO A 347 -2.726 -6.449 5.148 1.00 0.00 C ATOM 607 CD PRO A 347 -3.375 -5.312 5.937 1.00 0.00 C ATOM 0 HA PRO A 347 -3.241 -7.722 8.171 1.00 0.00 H new ATOM 0 HB2 PRO A 347 -1.923 -8.319 5.814 1.00 0.00 H new ATOM 0 HB3 PRO A 347 -3.673 -8.230 5.866 1.00 0.00 H new ATOM 0 HG2 PRO A 347 -1.701 -6.197 4.878 1.00 0.00 H new ATOM 0 HG3 PRO A 347 -3.265 -6.631 4.218 1.00 0.00 H new ATOM 0 HD2 PRO A 347 -2.865 -4.364 5.763 1.00 0.00 H new ATOM 0 HD3 PRO A 347 -4.417 -5.171 5.649 1.00 0.00 H new ATOM 615 N LYS A 348 -0.789 -8.201 8.509 1.00 0.00 N ATOM 616 CA LYS A 348 0.612 -8.250 9.017 1.00 0.00 C ATOM 617 C LYS A 348 1.578 -8.562 7.880 1.00 0.00 C ATOM 618 O LYS A 348 1.208 -9.106 6.859 1.00 0.00 O ATOM 619 CB LYS A 348 0.741 -9.326 10.092 1.00 0.00 C ATOM 620 CG LYS A 348 0.049 -8.851 11.366 1.00 0.00 C ATOM 621 CD LYS A 348 0.252 -9.883 12.476 1.00 0.00 C ATOM 622 CE LYS A 348 -0.532 -9.458 13.720 1.00 0.00 C ATOM 623 NZ LYS A 348 -0.395 -10.502 14.774 1.00 0.00 N ATOM 0 H LYS A 348 -1.325 -9.060 8.628 1.00 0.00 H new ATOM 0 HA LYS A 348 0.858 -7.277 9.442 1.00 0.00 H new ATOM 0 HB2 LYS A 348 0.292 -10.257 9.746 1.00 0.00 H new ATOM 0 HB3 LYS A 348 1.792 -9.533 10.291 1.00 0.00 H new ATOM 0 HG2 LYS A 348 0.454 -7.887 11.674 1.00 0.00 H new ATOM 0 HG3 LYS A 348 -1.015 -8.706 11.181 1.00 0.00 H new ATOM 0 HD2 LYS A 348 -0.083 -10.864 12.140 1.00 0.00 H new ATOM 0 HD3 LYS A 348 1.312 -9.972 12.714 1.00 0.00 H new ATOM 0 HE2 LYS A 348 -0.159 -8.502 14.089 1.00 0.00 H new ATOM 0 HE3 LYS A 348 -1.583 -9.315 13.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 348 -0.928 -10.214 15.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 348 -0.771 -11.405 14.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 348 0.609 -10.617 15.020 1.00 0.00 H new ATOM 637 N GLY A 349 2.820 -8.219 8.060 1.00 0.00 N ATOM 638 CA GLY A 349 3.835 -8.486 7.002 1.00 0.00 C ATOM 639 C GLY A 349 3.828 -7.343 5.992 1.00 0.00 C ATOM 640 O GLY A 349 2.851 -6.635 5.846 1.00 0.00 O ATOM 0 H GLY A 349 3.180 -7.763 8.898 1.00 0.00 H new ATOM 0 HA2 GLY A 349 4.824 -8.585 7.449 1.00 0.00 H new ATOM 0 HA3 GLY A 349 3.615 -9.429 6.502 1.00 0.00 H new ATOM 644 N ASP A 350 4.905 -7.162 5.287 1.00 0.00 N ATOM 645 CA ASP A 350 4.956 -6.071 4.278 1.00 0.00 C ATOM 646 C ASP A 350 4.343 -6.578 2.975 1.00 0.00 C ATOM 647 O ASP A 350 4.863 -7.477 2.344 1.00 0.00 O ATOM 648 CB ASP A 350 6.411 -5.663 4.036 1.00 0.00 C ATOM 649 CG ASP A 350 6.454 -4.452 3.102 1.00 0.00 C ATOM 650 OD1 ASP A 350 6.309 -3.344 3.592 1.00 0.00 O ATOM 651 OD2 ASP A 350 6.629 -4.654 1.911 1.00 0.00 O ATOM 0 H ASP A 350 5.754 -7.722 5.365 1.00 0.00 H new ATOM 0 HA ASP A 350 4.399 -5.206 4.638 1.00 0.00 H new ATOM 0 HB2 ASP A 350 6.894 -5.422 4.983 1.00 0.00 H new ATOM 0 HB3 ASP A 350 6.964 -6.493 3.597 1.00 0.00 H new ATOM 656 N TRP A 351 3.239 -6.019 2.566 1.00 0.00 N ATOM 657 CA TRP A 351 2.602 -6.485 1.306 1.00 0.00 C ATOM 658 C TRP A 351 3.326 -5.871 0.112 1.00 0.00 C ATOM 659 O TRP A 351 3.696 -4.713 0.119 1.00 0.00 O ATOM 660 CB TRP A 351 1.125 -6.087 1.296 1.00 0.00 C ATOM 661 CG TRP A 351 0.387 -6.960 2.258 1.00 0.00 C ATOM 662 CD1 TRP A 351 0.569 -6.961 3.597 1.00 0.00 C ATOM 663 CD2 TRP A 351 -0.640 -7.956 1.982 1.00 0.00 C ATOM 664 NE1 TRP A 351 -0.275 -7.898 4.162 1.00 0.00 N ATOM 665 CE2 TRP A 351 -1.043 -8.537 3.208 1.00 0.00 C ATOM 666 CE3 TRP A 351 -1.253 -8.408 0.800 1.00 0.00 C ATOM 667 CZ2 TRP A 351 -2.021 -9.531 3.258 1.00 0.00 C ATOM 668 CZ3 TRP A 351 -2.237 -9.408 0.848 1.00 0.00 C ATOM 669 CH2 TRP A 351 -2.621 -9.968 2.075 1.00 0.00 C ATOM 0 H TRP A 351 2.753 -5.263 3.048 1.00 0.00 H new ATOM 0 HA TRP A 351 2.671 -7.571 1.241 1.00 0.00 H new ATOM 0 HB2 TRP A 351 1.014 -5.039 1.575 1.00 0.00 H new ATOM 0 HB3 TRP A 351 0.711 -6.195 0.293 1.00 0.00 H new ATOM 0 HD1 TRP A 351 1.261 -6.332 4.137 1.00 0.00 H new ATOM 0 HE1 TRP A 351 -0.325 -8.094 5.162 1.00 0.00 H new ATOM 0 HE3 TRP A 351 -0.965 -7.983 -0.150 1.00 0.00 H new ATOM 0 HZ2 TRP A 351 -2.312 -9.960 4.206 1.00 0.00 H new ATOM 0 HZ3 TRP A 351 -2.701 -9.748 -0.066 1.00 0.00 H new ATOM 0 HH2 TRP A 351 -3.380 -10.736 2.105 1.00 0.00 H new ATOM 680 N ARG A 352 3.544 -6.653 -0.904 1.00 0.00 N ATOM 681 CA ARG A 352 4.262 -6.155 -2.107 1.00 0.00 C ATOM 682 C ARG A 352 3.443 -6.460 -3.356 1.00 0.00 C ATOM 683 O ARG A 352 2.863 -7.519 -3.494 1.00 0.00 O ATOM 684 CB ARG A 352 5.626 -6.838 -2.190 1.00 0.00 C ATOM 685 CG ARG A 352 5.431 -8.351 -2.256 1.00 0.00 C ATOM 686 CD ARG A 352 6.754 -9.045 -1.937 1.00 0.00 C ATOM 687 NE ARG A 352 6.588 -10.518 -2.075 1.00 0.00 N ATOM 688 CZ ARG A 352 7.569 -11.317 -1.757 1.00 0.00 C ATOM 689 NH1 ARG A 352 8.699 -10.826 -1.326 1.00 0.00 N ATOM 690 NH2 ARG A 352 7.420 -12.609 -1.869 1.00 0.00 N ATOM 0 H ARG A 352 3.252 -7.629 -0.953 1.00 0.00 H new ATOM 0 HA ARG A 352 4.402 -5.076 -2.036 1.00 0.00 H new ATOM 0 HB2 ARG A 352 6.166 -6.491 -3.071 1.00 0.00 H new ATOM 0 HB3 ARG A 352 6.230 -6.575 -1.322 1.00 0.00 H new ATOM 0 HG2 ARG A 352 4.664 -8.662 -1.547 1.00 0.00 H new ATOM 0 HG3 ARG A 352 5.085 -8.642 -3.248 1.00 0.00 H new ATOM 0 HD2 ARG A 352 7.534 -8.692 -2.611 1.00 0.00 H new ATOM 0 HD3 ARG A 352 7.072 -8.797 -0.924 1.00 0.00 H new ATOM 0 HE ARG A 352 5.708 -10.902 -2.418 1.00 0.00 H new ATOM 0 HH11 ARG A 352 8.816 -9.817 -1.238 1.00 0.00 H new ATOM 0 HH12 ARG A 352 9.465 -11.452 -1.078 1.00 0.00 H new ATOM 0 HH21 ARG A 352 6.537 -12.993 -2.205 1.00 0.00 H new ATOM 0 HH22 ARG A 352 8.187 -13.234 -1.621 1.00 0.00 H new ATOM 704 N CYS A 353 3.381 -5.528 -4.262 1.00 0.00 N ATOM 705 CA CYS A 353 2.591 -5.739 -5.501 1.00 0.00 C ATOM 706 C CYS A 353 3.175 -6.936 -6.275 1.00 0.00 C ATOM 707 O CYS A 353 4.331 -7.272 -6.132 1.00 0.00 O ATOM 708 CB CYS A 353 2.640 -4.464 -6.352 1.00 0.00 C ATOM 709 SG CYS A 353 3.315 -3.092 -5.371 1.00 0.00 S ATOM 0 H CYS A 353 3.847 -4.623 -4.196 1.00 0.00 H new ATOM 0 HA CYS A 353 1.551 -5.955 -5.256 1.00 0.00 H new ATOM 0 HB2 CYS A 353 3.257 -4.629 -7.235 1.00 0.00 H new ATOM 0 HB3 CYS A 353 1.640 -4.213 -6.705 1.00 0.00 H new ATOM 714 N PRO A 354 2.361 -7.610 -7.049 1.00 0.00 N ATOM 715 CA PRO A 354 2.780 -8.826 -7.815 1.00 0.00 C ATOM 716 C PRO A 354 4.068 -8.642 -8.635 1.00 0.00 C ATOM 717 O PRO A 354 4.883 -9.539 -8.721 1.00 0.00 O ATOM 718 CB PRO A 354 1.597 -9.115 -8.752 1.00 0.00 C ATOM 719 CG PRO A 354 0.659 -7.955 -8.627 1.00 0.00 C ATOM 720 CD PRO A 354 0.952 -7.288 -7.287 1.00 0.00 C ATOM 0 HA PRO A 354 3.012 -9.638 -7.126 1.00 0.00 H new ATOM 0 HB2 PRO A 354 1.937 -9.229 -9.781 1.00 0.00 H new ATOM 0 HB3 PRO A 354 1.102 -10.046 -8.475 1.00 0.00 H new ATOM 0 HG2 PRO A 354 0.803 -7.252 -9.448 1.00 0.00 H new ATOM 0 HG3 PRO A 354 -0.377 -8.290 -8.673 1.00 0.00 H new ATOM 0 HD2 PRO A 354 0.787 -6.211 -7.329 1.00 0.00 H new ATOM 0 HD3 PRO A 354 0.312 -7.677 -6.496 1.00 0.00 H new ATOM 728 N LYS A 355 4.267 -7.505 -9.244 1.00 0.00 N ATOM 729 CA LYS A 355 5.509 -7.309 -10.054 1.00 0.00 C ATOM 730 C LYS A 355 6.746 -7.458 -9.166 1.00 0.00 C ATOM 731 O LYS A 355 7.761 -7.985 -9.578 1.00 0.00 O ATOM 732 CB LYS A 355 5.501 -5.915 -10.677 1.00 0.00 C ATOM 733 CG LYS A 355 5.375 -4.874 -9.570 1.00 0.00 C ATOM 734 CD LYS A 355 5.275 -3.478 -10.186 1.00 0.00 C ATOM 735 CE LYS A 355 5.399 -2.423 -9.086 1.00 0.00 C ATOM 736 NZ LYS A 355 4.140 -2.386 -8.289 1.00 0.00 N ATOM 0 H LYS A 355 3.631 -6.708 -9.218 1.00 0.00 H new ATOM 0 HA LYS A 355 5.539 -8.063 -10.840 1.00 0.00 H new ATOM 0 HB2 LYS A 355 6.417 -5.751 -11.244 1.00 0.00 H new ATOM 0 HB3 LYS A 355 4.671 -5.821 -11.378 1.00 0.00 H new ATOM 0 HG2 LYS A 355 4.493 -5.079 -8.963 1.00 0.00 H new ATOM 0 HG3 LYS A 355 6.238 -4.928 -8.906 1.00 0.00 H new ATOM 0 HD2 LYS A 355 6.062 -3.339 -10.928 1.00 0.00 H new ATOM 0 HD3 LYS A 355 4.324 -3.366 -10.706 1.00 0.00 H new ATOM 0 HE2 LYS A 355 6.245 -2.655 -8.439 1.00 0.00 H new ATOM 0 HE3 LYS A 355 5.593 -1.445 -9.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 355 3.746 -1.424 -8.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 355 3.451 -3.050 -8.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 355 4.343 -2.659 -7.306 1.00 0.00 H new ATOM 750 N CYS A 356 6.669 -6.994 -7.956 1.00 0.00 N ATOM 751 CA CYS A 356 7.834 -7.097 -7.031 1.00 0.00 C ATOM 752 C CYS A 356 8.042 -8.562 -6.649 1.00 0.00 C ATOM 753 O CYS A 356 9.154 -9.029 -6.510 1.00 0.00 O ATOM 754 CB CYS A 356 7.551 -6.258 -5.782 1.00 0.00 C ATOM 755 SG CYS A 356 6.029 -5.322 -6.062 1.00 0.00 S ATOM 0 H CYS A 356 5.844 -6.543 -7.561 1.00 0.00 H new ATOM 0 HA CYS A 356 8.737 -6.725 -7.516 1.00 0.00 H new ATOM 0 HB2 CYS A 356 7.446 -6.901 -4.908 1.00 0.00 H new ATOM 0 HB3 CYS A 356 8.382 -5.581 -5.582 1.00 0.00 H new ATOM 760 N LEU A 357 6.973 -9.293 -6.490 1.00 0.00 N ATOM 761 CA LEU A 357 7.096 -10.733 -6.128 1.00 0.00 C ATOM 762 C LEU A 357 7.915 -11.457 -7.198 1.00 0.00 C ATOM 763 O LEU A 357 8.701 -12.335 -6.904 1.00 0.00 O ATOM 764 CB LEU A 357 5.695 -11.349 -6.043 1.00 0.00 C ATOM 765 CG LEU A 357 5.793 -12.826 -5.646 1.00 0.00 C ATOM 766 CD1 LEU A 357 6.302 -12.943 -4.208 1.00 0.00 C ATOM 767 CD2 LEU A 357 4.407 -13.466 -5.744 1.00 0.00 C ATOM 0 H LEU A 357 6.017 -8.954 -6.596 1.00 0.00 H new ATOM 0 HA LEU A 357 7.597 -10.832 -5.165 1.00 0.00 H new ATOM 0 HB2 LEU A 357 5.095 -10.807 -5.312 1.00 0.00 H new ATOM 0 HB3 LEU A 357 5.189 -11.255 -7.004 1.00 0.00 H new ATOM 0 HG LEU A 357 6.485 -13.335 -6.316 1.00 0.00 H new ATOM 0 HD11 LEU A 357 6.370 -13.995 -3.931 1.00 0.00 H new ATOM 0 HD12 LEU A 357 7.287 -12.483 -4.132 1.00 0.00 H new ATOM 0 HD13 LEU A 357 5.612 -12.434 -3.535 1.00 0.00 H new ATOM 0 HD21 LEU A 357 4.471 -14.517 -5.463 1.00 0.00 H new ATOM 0 HD22 LEU A 357 3.720 -12.951 -5.072 1.00 0.00 H new ATOM 0 HD23 LEU A 357 4.041 -13.386 -6.768 1.00 0.00 H new ATOM 779 N ALA A 358 7.735 -11.095 -8.438 1.00 0.00 N ATOM 780 CA ALA A 358 8.501 -11.762 -9.529 1.00 0.00 C ATOM 781 C ALA A 358 9.996 -11.506 -9.338 1.00 0.00 C ATOM 782 O ALA A 358 10.824 -12.335 -9.661 1.00 0.00 O ATOM 783 CB ALA A 358 8.056 -11.200 -10.881 1.00 0.00 C ATOM 0 H ALA A 358 7.090 -10.366 -8.744 1.00 0.00 H new ATOM 0 HA ALA A 358 8.312 -12.835 -9.500 1.00 0.00 H new ATOM 0 HB1 ALA A 358 8.616 -11.687 -11.680 1.00 0.00 H new ATOM 0 HB2 ALA A 358 6.991 -11.385 -11.019 1.00 0.00 H new ATOM 0 HB3 ALA A 358 8.244 -10.127 -10.909 1.00 0.00 H new ATOM 789 N GLN A 359 10.349 -10.364 -8.816 1.00 0.00 N ATOM 790 CA GLN A 359 11.793 -10.056 -8.606 1.00 0.00 C ATOM 791 C GLN A 359 12.411 -11.110 -7.687 1.00 0.00 C ATOM 792 O GLN A 359 13.559 -11.478 -7.832 1.00 0.00 O ATOM 793 CB GLN A 359 11.932 -8.673 -7.965 1.00 0.00 C ATOM 794 CG GLN A 359 11.422 -7.606 -8.936 1.00 0.00 C ATOM 795 CD GLN A 359 11.517 -6.229 -8.277 1.00 0.00 C ATOM 796 OE1 GLN A 359 11.657 -6.127 -7.074 1.00 0.00 O ATOM 797 NE2 GLN A 359 11.445 -5.158 -9.019 1.00 0.00 N ATOM 0 H GLN A 359 9.702 -9.631 -8.526 1.00 0.00 H new ATOM 0 HA GLN A 359 12.310 -10.064 -9.566 1.00 0.00 H new ATOM 0 HB2 GLN A 359 11.366 -8.633 -7.034 1.00 0.00 H new ATOM 0 HB3 GLN A 359 12.975 -8.481 -7.712 1.00 0.00 H new ATOM 0 HG2 GLN A 359 12.010 -7.623 -9.853 1.00 0.00 H new ATOM 0 HG3 GLN A 359 10.390 -7.817 -9.215 1.00 0.00 H new ATOM 0 HE21 GLN A 359 11.328 -5.244 -10.029 1.00 0.00 H new ATOM 0 HE22 GLN A 359 11.506 -4.235 -8.589 1.00 0.00 H new ATOM 806 N GLU A 360 11.657 -11.599 -6.741 1.00 0.00 N ATOM 807 CA GLU A 360 12.200 -12.630 -5.812 1.00 0.00 C ATOM 808 C GLU A 360 13.618 -12.240 -5.391 1.00 0.00 C ATOM 809 O GLU A 360 14.553 -12.753 -5.984 1.00 0.00 O ATOM 810 CB GLU A 360 12.232 -13.985 -6.519 1.00 0.00 C ATOM 811 CG GLU A 360 12.668 -15.068 -5.530 1.00 0.00 C ATOM 812 CD GLU A 360 12.798 -16.405 -6.261 1.00 0.00 C ATOM 813 OE1 GLU A 360 12.575 -16.427 -7.460 1.00 0.00 O ATOM 814 OE2 GLU A 360 13.119 -17.386 -5.609 1.00 0.00 O ATOM 815 OXT GLU A 360 13.745 -11.436 -4.482 1.00 0.00 O ATOM 0 H GLU A 360 10.688 -11.329 -6.571 1.00 0.00 H new ATOM 0 HA GLU A 360 11.564 -12.696 -4.929 1.00 0.00 H new ATOM 0 HB2 GLU A 360 11.247 -14.220 -6.921 1.00 0.00 H new ATOM 0 HB3 GLU A 360 12.921 -13.950 -7.363 1.00 0.00 H new ATOM 0 HG2 GLU A 360 13.620 -14.797 -5.074 1.00 0.00 H new ATOM 0 HG3 GLU A 360 11.940 -15.152 -4.723 1.00 0.00 H new TER 822 GLU A 360 HETATM 823 ZN ZN A 401 -5.908 3.899 -2.674 1.00 0.00 ZN HETATM 824 ZN ZN A 402 5.590 -3.303 -5.079 1.00 0.00 ZN