USER MOD reduce.3.24.130724 H: found=0, std=0, add=393, rem=0, adj=5 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= -0.141 X(o=-0.14,f=0) USER MOD Single : A 333 SER OG : rot 180:sc= -1.1 USER MOD Single : A 334 TYR OH : rot 180:sc= 0 USER MOD Single : A 336 THR OG1 : rot -160:sc= 0 USER MOD Single : A 344 HIS : no HD1:sc= -0.0457 X(o=-0.046,f=0) USER MOD Single : A 348 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 355 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 359 GLN : amide:sc=-0.00741 K(o=-0.0074,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 306 0.569 17.076 -0.663 1.00 0.00 N ATOM 2 CA ALA A 306 1.208 18.296 -0.095 1.00 0.00 C ATOM 3 C ALA A 306 1.401 18.115 1.411 1.00 0.00 C ATOM 4 O ALA A 306 2.472 17.777 1.874 1.00 0.00 O ATOM 5 CB ALA A 306 0.310 19.507 -0.352 1.00 0.00 C ATOM 0 HA ALA A 306 2.177 18.454 -0.569 1.00 0.00 H new ATOM 0 HB1 ALA A 306 0.776 20.400 0.063 1.00 0.00 H new ATOM 0 HB2 ALA A 306 0.171 19.636 -1.425 1.00 0.00 H new ATOM 0 HB3 ALA A 306 -0.658 19.349 0.123 1.00 0.00 H new ATOM 13 N VAL A 307 0.372 18.338 2.183 1.00 0.00 N ATOM 14 CA VAL A 307 0.498 18.179 3.658 1.00 0.00 C ATOM 15 C VAL A 307 0.880 16.734 3.987 1.00 0.00 C ATOM 16 O VAL A 307 1.686 16.479 4.860 1.00 0.00 O ATOM 17 CB VAL A 307 -0.837 18.517 4.324 1.00 0.00 C ATOM 18 CG1 VAL A 307 -0.765 18.177 5.814 1.00 0.00 C ATOM 19 CG2 VAL A 307 -1.124 20.011 4.158 1.00 0.00 C ATOM 0 H VAL A 307 -0.551 18.624 1.855 1.00 0.00 H new ATOM 0 HA VAL A 307 1.271 18.852 4.030 1.00 0.00 H new ATOM 0 HB VAL A 307 -1.633 17.937 3.857 1.00 0.00 H new ATOM 0 HG11 VAL A 307 -1.716 18.418 6.289 1.00 0.00 H new ATOM 0 HG12 VAL A 307 -0.558 17.114 5.935 1.00 0.00 H new ATOM 0 HG13 VAL A 307 0.031 18.757 6.281 1.00 0.00 H new ATOM 0 HG21 VAL A 307 -2.075 20.254 4.632 1.00 0.00 H new ATOM 0 HG22 VAL A 307 -0.327 20.589 4.626 1.00 0.00 H new ATOM 0 HG23 VAL A 307 -1.174 20.256 3.097 1.00 0.00 H new ATOM 29 N ASP A 308 0.308 15.787 3.294 1.00 0.00 N ATOM 30 CA ASP A 308 0.641 14.360 3.570 1.00 0.00 C ATOM 31 C ASP A 308 1.915 13.978 2.812 1.00 0.00 C ATOM 32 O ASP A 308 1.952 13.985 1.597 1.00 0.00 O ATOM 33 CB ASP A 308 -0.515 13.469 3.109 1.00 0.00 C ATOM 34 CG ASP A 308 -0.239 12.021 3.521 1.00 0.00 C ATOM 35 OD1 ASP A 308 0.776 11.790 4.156 1.00 0.00 O ATOM 36 OD2 ASP A 308 -1.049 11.170 3.194 1.00 0.00 O ATOM 0 H ASP A 308 -0.374 15.939 2.551 1.00 0.00 H new ATOM 0 HA ASP A 308 0.801 14.223 4.640 1.00 0.00 H new ATOM 0 HB2 ASP A 308 -1.451 13.812 3.550 1.00 0.00 H new ATOM 0 HB3 ASP A 308 -0.630 13.535 2.027 1.00 0.00 H new ATOM 41 N LEU A 309 2.961 13.649 3.519 1.00 0.00 N ATOM 42 CA LEU A 309 4.232 13.270 2.841 1.00 0.00 C ATOM 43 C LEU A 309 4.005 12.028 1.976 1.00 0.00 C ATOM 44 O LEU A 309 4.589 11.884 0.920 1.00 0.00 O ATOM 45 CB LEU A 309 5.302 12.969 3.894 1.00 0.00 C ATOM 46 CG LEU A 309 5.496 14.189 4.797 1.00 0.00 C ATOM 47 CD1 LEU A 309 6.618 13.910 5.798 1.00 0.00 C ATOM 48 CD2 LEU A 309 5.870 15.404 3.943 1.00 0.00 C ATOM 0 H LEU A 309 2.990 13.626 4.538 1.00 0.00 H new ATOM 0 HA LEU A 309 4.563 14.094 2.209 1.00 0.00 H new ATOM 0 HB2 LEU A 309 5.006 12.106 4.491 1.00 0.00 H new ATOM 0 HB3 LEU A 309 6.243 12.712 3.407 1.00 0.00 H new ATOM 0 HG LEU A 309 4.569 14.392 5.334 1.00 0.00 H new ATOM 0 HD11 LEU A 309 6.756 14.779 6.441 1.00 0.00 H new ATOM 0 HD12 LEU A 309 6.355 13.046 6.408 1.00 0.00 H new ATOM 0 HD13 LEU A 309 7.544 13.706 5.260 1.00 0.00 H new ATOM 0 HD21 LEU A 309 6.008 16.273 4.587 1.00 0.00 H new ATOM 0 HD22 LEU A 309 6.796 15.200 3.406 1.00 0.00 H new ATOM 0 HD23 LEU A 309 5.072 15.605 3.228 1.00 0.00 H new ATOM 60 N TYR A 310 3.164 11.128 2.418 1.00 0.00 N ATOM 61 CA TYR A 310 2.901 9.894 1.626 1.00 0.00 C ATOM 62 C TYR A 310 1.450 9.871 1.146 1.00 0.00 C ATOM 63 O TYR A 310 0.526 10.080 1.904 1.00 0.00 O ATOM 64 CB TYR A 310 3.166 8.662 2.494 1.00 0.00 C ATOM 65 CG TYR A 310 4.622 8.279 2.393 1.00 0.00 C ATOM 66 CD1 TYR A 310 5.060 7.484 1.328 1.00 0.00 C ATOM 67 CD2 TYR A 310 5.535 8.718 3.360 1.00 0.00 C ATOM 68 CE1 TYR A 310 6.407 7.126 1.228 1.00 0.00 C ATOM 69 CE2 TYR A 310 6.884 8.359 3.261 1.00 0.00 C ATOM 70 CZ TYR A 310 7.321 7.563 2.194 1.00 0.00 C ATOM 71 OH TYR A 310 8.651 7.210 2.096 1.00 0.00 O ATOM 0 H TYR A 310 2.648 11.197 3.295 1.00 0.00 H new ATOM 0 HA TYR A 310 3.563 9.885 0.760 1.00 0.00 H new ATOM 0 HB2 TYR A 310 2.905 8.872 3.531 1.00 0.00 H new ATOM 0 HB3 TYR A 310 2.537 7.833 2.169 1.00 0.00 H new ATOM 0 HD1 TYR A 310 4.356 7.147 0.582 1.00 0.00 H new ATOM 0 HD2 TYR A 310 5.198 9.333 4.181 1.00 0.00 H new ATOM 0 HE1 TYR A 310 6.743 6.512 0.405 1.00 0.00 H new ATOM 0 HE2 TYR A 310 7.588 8.696 4.007 1.00 0.00 H new ATOM 0 HH TYR A 310 9.148 7.597 2.847 1.00 0.00 H new ATOM 81 N VAL A 311 1.251 9.605 -0.115 1.00 0.00 N ATOM 82 CA VAL A 311 -0.130 9.549 -0.669 1.00 0.00 C ATOM 83 C VAL A 311 -0.251 8.309 -1.557 1.00 0.00 C ATOM 84 O VAL A 311 0.706 7.876 -2.168 1.00 0.00 O ATOM 85 CB VAL A 311 -0.407 10.811 -1.490 1.00 0.00 C ATOM 86 CG1 VAL A 311 0.522 10.847 -2.705 1.00 0.00 C ATOM 87 CG2 VAL A 311 -1.863 10.812 -1.962 1.00 0.00 C ATOM 0 H VAL A 311 1.993 9.423 -0.791 1.00 0.00 H new ATOM 0 HA VAL A 311 -0.857 9.493 0.142 1.00 0.00 H new ATOM 0 HB VAL A 311 -0.228 11.689 -0.869 1.00 0.00 H new ATOM 0 HG11 VAL A 311 0.323 11.746 -3.288 1.00 0.00 H new ATOM 0 HG12 VAL A 311 1.559 10.854 -2.370 1.00 0.00 H new ATOM 0 HG13 VAL A 311 0.346 9.967 -3.324 1.00 0.00 H new ATOM 0 HG21 VAL A 311 -2.056 11.712 -2.546 1.00 0.00 H new ATOM 0 HG22 VAL A 311 -2.046 9.933 -2.580 1.00 0.00 H new ATOM 0 HG23 VAL A 311 -2.526 10.792 -1.097 1.00 0.00 H new ATOM 97 N CYS A 312 -1.416 7.730 -1.631 1.00 0.00 N ATOM 98 CA CYS A 312 -1.592 6.516 -2.475 1.00 0.00 C ATOM 99 C CYS A 312 -1.576 6.917 -3.950 1.00 0.00 C ATOM 100 O CYS A 312 -2.387 7.699 -4.398 1.00 0.00 O ATOM 101 CB CYS A 312 -2.933 5.869 -2.137 1.00 0.00 C ATOM 102 SG CYS A 312 -3.291 4.545 -3.316 1.00 0.00 S ATOM 0 H CYS A 312 -2.255 8.045 -1.143 1.00 0.00 H new ATOM 0 HA CYS A 312 -0.783 5.811 -2.284 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -2.908 5.469 -1.123 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -3.725 6.617 -2.165 1.00 0.00 H new ATOM 107 N LEU A 313 -0.653 6.392 -4.708 1.00 0.00 N ATOM 108 CA LEU A 313 -0.586 6.751 -6.149 1.00 0.00 C ATOM 109 C LEU A 313 -1.873 6.312 -6.851 1.00 0.00 C ATOM 110 O LEU A 313 -2.370 6.983 -7.734 1.00 0.00 O ATOM 111 CB LEU A 313 0.609 6.041 -6.787 1.00 0.00 C ATOM 112 CG LEU A 313 1.893 6.428 -6.049 1.00 0.00 C ATOM 113 CD1 LEU A 313 3.093 5.771 -6.733 1.00 0.00 C ATOM 114 CD2 LEU A 313 2.062 7.950 -6.082 1.00 0.00 C ATOM 0 H LEU A 313 0.056 5.731 -4.391 1.00 0.00 H new ATOM 0 HA LEU A 313 -0.472 7.830 -6.251 1.00 0.00 H new ATOM 0 HB2 LEU A 313 0.466 4.961 -6.747 1.00 0.00 H new ATOM 0 HB3 LEU A 313 0.687 6.314 -7.840 1.00 0.00 H new ATOM 0 HG LEU A 313 1.832 6.089 -5.015 1.00 0.00 H new ATOM 0 HD11 LEU A 313 4.007 6.047 -6.207 1.00 0.00 H new ATOM 0 HD12 LEU A 313 2.975 4.688 -6.713 1.00 0.00 H new ATOM 0 HD13 LEU A 313 3.153 6.110 -7.767 1.00 0.00 H new ATOM 0 HD21 LEU A 313 2.976 8.226 -5.557 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.122 8.287 -7.117 1.00 0.00 H new ATOM 0 HD23 LEU A 313 1.208 8.422 -5.596 1.00 0.00 H new ATOM 126 N LEU A 314 -2.413 5.188 -6.469 1.00 0.00 N ATOM 127 CA LEU A 314 -3.660 4.700 -7.115 1.00 0.00 C ATOM 128 C LEU A 314 -4.814 5.666 -6.835 1.00 0.00 C ATOM 129 O LEU A 314 -5.666 5.885 -7.672 1.00 0.00 O ATOM 130 CB LEU A 314 -4.006 3.322 -6.549 1.00 0.00 C ATOM 131 CG LEU A 314 -2.834 2.366 -6.767 1.00 0.00 C ATOM 132 CD1 LEU A 314 -3.213 0.978 -6.253 1.00 0.00 C ATOM 133 CD2 LEU A 314 -2.511 2.285 -8.261 1.00 0.00 C ATOM 0 H LEU A 314 -2.042 4.585 -5.734 1.00 0.00 H new ATOM 0 HA LEU A 314 -3.506 4.636 -8.192 1.00 0.00 H new ATOM 0 HB2 LEU A 314 -4.230 3.401 -5.485 1.00 0.00 H new ATOM 0 HB3 LEU A 314 -4.901 2.933 -7.035 1.00 0.00 H new ATOM 0 HG LEU A 314 -1.960 2.731 -6.227 1.00 0.00 H new ATOM 0 HD11 LEU A 314 -2.379 0.293 -6.407 1.00 0.00 H new ATOM 0 HD12 LEU A 314 -3.445 1.035 -5.189 1.00 0.00 H new ATOM 0 HD13 LEU A 314 -4.086 0.615 -6.796 1.00 0.00 H new ATOM 0 HD21 LEU A 314 -1.675 1.603 -8.416 1.00 0.00 H new ATOM 0 HD22 LEU A 314 -3.383 1.919 -8.802 1.00 0.00 H new ATOM 0 HD23 LEU A 314 -2.244 3.275 -8.630 1.00 0.00 H new ATOM 145 N CYS A 315 -4.856 6.232 -5.659 1.00 0.00 N ATOM 146 CA CYS A 315 -5.967 7.169 -5.319 1.00 0.00 C ATOM 147 C CYS A 315 -5.458 8.612 -5.299 1.00 0.00 C ATOM 148 O CYS A 315 -6.026 9.487 -5.924 1.00 0.00 O ATOM 149 CB CYS A 315 -6.526 6.799 -3.947 1.00 0.00 C ATOM 150 SG CYS A 315 -6.990 5.048 -3.947 1.00 0.00 S ATOM 0 H CYS A 315 -4.170 6.087 -4.919 1.00 0.00 H new ATOM 0 HA CYS A 315 -6.750 7.089 -6.073 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -5.782 6.991 -3.174 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -7.393 7.418 -3.715 1.00 0.00 H new ATOM 155 N GLY A 316 -4.396 8.870 -4.590 1.00 0.00 N ATOM 156 CA GLY A 316 -3.858 10.256 -4.536 1.00 0.00 C ATOM 157 C GLY A 316 -4.405 10.984 -3.304 1.00 0.00 C ATOM 158 O GLY A 316 -4.363 12.195 -3.224 1.00 0.00 O ATOM 0 H GLY A 316 -3.877 8.181 -4.046 1.00 0.00 H new ATOM 0 HA2 GLY A 316 -2.769 10.231 -4.500 1.00 0.00 H new ATOM 0 HA3 GLY A 316 -4.134 10.797 -5.441 1.00 0.00 H new ATOM 162 N SER A 317 -4.919 10.256 -2.344 1.00 0.00 N ATOM 163 CA SER A 317 -5.470 10.910 -1.120 1.00 0.00 C ATOM 164 C SER A 317 -4.655 10.490 0.108 1.00 0.00 C ATOM 165 O SER A 317 -4.156 9.387 0.189 1.00 0.00 O ATOM 166 CB SER A 317 -6.926 10.483 -0.931 1.00 0.00 C ATOM 167 OG SER A 317 -6.979 9.079 -0.717 1.00 0.00 O ATOM 0 H SER A 317 -4.980 9.238 -2.356 1.00 0.00 H new ATOM 0 HA SER A 317 -5.414 11.992 -1.235 1.00 0.00 H new ATOM 0 HB2 SER A 317 -7.364 11.009 -0.083 1.00 0.00 H new ATOM 0 HB3 SER A 317 -7.513 10.751 -1.810 1.00 0.00 H new ATOM 0 HG SER A 317 -7.911 8.802 -0.594 1.00 0.00 H new ATOM 173 N GLY A 318 -4.519 11.372 1.065 1.00 0.00 N ATOM 174 CA GLY A 318 -3.739 11.038 2.292 1.00 0.00 C ATOM 175 C GLY A 318 -4.677 10.517 3.387 1.00 0.00 C ATOM 176 O GLY A 318 -4.271 9.783 4.263 1.00 0.00 O ATOM 0 H GLY A 318 -4.916 12.311 1.048 1.00 0.00 H new ATOM 0 HA2 GLY A 318 -2.985 10.286 2.060 1.00 0.00 H new ATOM 0 HA3 GLY A 318 -3.208 11.922 2.647 1.00 0.00 H new ATOM 180 N ASN A 319 -5.928 10.880 3.354 1.00 0.00 N ATOM 181 CA ASN A 319 -6.859 10.382 4.408 1.00 0.00 C ATOM 182 C ASN A 319 -6.786 8.858 4.456 1.00 0.00 C ATOM 183 O ASN A 319 -6.818 8.252 5.508 1.00 0.00 O ATOM 184 CB ASN A 319 -8.289 10.812 4.075 1.00 0.00 C ATOM 185 CG ASN A 319 -9.222 10.387 5.209 1.00 0.00 C ATOM 186 OD1 ASN A 319 -9.423 11.122 6.157 1.00 0.00 O ATOM 187 ND2 ASN A 319 -9.796 9.216 5.156 1.00 0.00 N ATOM 0 H ASN A 319 -6.344 11.493 2.653 1.00 0.00 H new ATOM 0 HA ASN A 319 -6.574 10.797 5.375 1.00 0.00 H new ATOM 0 HB2 ASN A 319 -8.333 11.892 3.938 1.00 0.00 H new ATOM 0 HB3 ASN A 319 -8.608 10.358 3.137 1.00 0.00 H new ATOM 0 HD21 ASN A 319 -10.414 8.916 5.910 1.00 0.00 H new ATOM 0 HD22 ASN A 319 -9.627 8.601 4.360 1.00 0.00 H new ATOM 194 N ASP A 320 -6.677 8.241 3.317 1.00 0.00 N ATOM 195 CA ASP A 320 -6.587 6.760 3.262 1.00 0.00 C ATOM 196 C ASP A 320 -5.208 6.328 3.769 1.00 0.00 C ATOM 197 O ASP A 320 -4.911 5.155 3.885 1.00 0.00 O ATOM 198 CB ASP A 320 -6.783 6.305 1.819 1.00 0.00 C ATOM 199 CG ASP A 320 -8.221 6.597 1.384 1.00 0.00 C ATOM 200 OD1 ASP A 320 -9.029 6.904 2.245 1.00 0.00 O ATOM 201 OD2 ASP A 320 -8.489 6.508 0.197 1.00 0.00 O ATOM 0 H ASP A 320 -6.646 8.706 2.410 1.00 0.00 H new ATOM 0 HA ASP A 320 -7.357 6.308 3.887 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -6.081 6.822 1.165 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -6.574 5.239 1.731 1.00 0.00 H new ATOM 206 N GLU A 321 -4.361 7.279 4.057 1.00 0.00 N ATOM 207 CA GLU A 321 -2.989 6.958 4.544 1.00 0.00 C ATOM 208 C GLU A 321 -3.055 5.970 5.714 1.00 0.00 C ATOM 209 O GLU A 321 -2.106 5.263 5.987 1.00 0.00 O ATOM 210 CB GLU A 321 -2.294 8.248 4.995 1.00 0.00 C ATOM 211 CG GLU A 321 -0.893 7.930 5.519 1.00 0.00 C ATOM 212 CD GLU A 321 -0.228 9.218 6.010 1.00 0.00 C ATOM 213 OE1 GLU A 321 -0.874 10.251 5.961 1.00 0.00 O ATOM 214 OE2 GLU A 321 0.915 9.147 6.428 1.00 0.00 O ATOM 0 H GLU A 321 -4.564 8.275 3.975 1.00 0.00 H new ATOM 0 HA GLU A 321 -2.423 6.500 3.733 1.00 0.00 H new ATOM 0 HB2 GLU A 321 -2.230 8.947 4.161 1.00 0.00 H new ATOM 0 HB3 GLU A 321 -2.881 8.734 5.774 1.00 0.00 H new ATOM 0 HG2 GLU A 321 -0.953 7.206 6.332 1.00 0.00 H new ATOM 0 HG3 GLU A 321 -0.293 7.476 4.731 1.00 0.00 H new ATOM 221 N ASP A 322 -4.152 5.919 6.416 1.00 0.00 N ATOM 222 CA ASP A 322 -4.247 4.983 7.571 1.00 0.00 C ATOM 223 C ASP A 322 -3.970 3.544 7.115 1.00 0.00 C ATOM 224 O ASP A 322 -3.335 2.782 7.818 1.00 0.00 O ATOM 225 CB ASP A 322 -5.653 5.067 8.165 1.00 0.00 C ATOM 226 CG ASP A 322 -5.856 6.441 8.805 1.00 0.00 C ATOM 227 OD1 ASP A 322 -4.877 7.150 8.962 1.00 0.00 O ATOM 228 OD2 ASP A 322 -6.989 6.759 9.130 1.00 0.00 O ATOM 0 H ASP A 322 -4.984 6.482 6.241 1.00 0.00 H new ATOM 0 HA ASP A 322 -3.506 5.262 8.321 1.00 0.00 H new ATOM 0 HB2 ASP A 322 -6.398 4.903 7.387 1.00 0.00 H new ATOM 0 HB3 ASP A 322 -5.792 4.283 8.910 1.00 0.00 H new ATOM 233 N ARG A 323 -4.432 3.165 5.952 1.00 0.00 N ATOM 234 CA ARG A 323 -4.185 1.773 5.462 1.00 0.00 C ATOM 235 C ARG A 323 -3.234 1.790 4.262 1.00 0.00 C ATOM 236 O ARG A 323 -3.157 0.836 3.511 1.00 0.00 O ATOM 237 CB ARG A 323 -5.504 1.112 5.056 1.00 0.00 C ATOM 238 CG ARG A 323 -6.361 0.880 6.300 1.00 0.00 C ATOM 239 CD ARG A 323 -7.518 -0.060 5.956 1.00 0.00 C ATOM 240 NE ARG A 323 -8.513 -0.053 7.066 1.00 0.00 N ATOM 241 CZ ARG A 323 -8.206 -0.574 8.223 1.00 0.00 C ATOM 242 NH1 ARG A 323 -7.028 -1.102 8.410 1.00 0.00 N ATOM 243 NH2 ARG A 323 -9.079 -0.566 9.193 1.00 0.00 N ATOM 0 H ARG A 323 -4.970 3.758 5.319 1.00 0.00 H new ATOM 0 HA ARG A 323 -3.730 1.202 6.271 1.00 0.00 H new ATOM 0 HB2 ARG A 323 -6.037 1.745 4.347 1.00 0.00 H new ATOM 0 HB3 ARG A 323 -5.309 0.165 4.554 1.00 0.00 H new ATOM 0 HG2 ARG A 323 -5.754 0.450 7.097 1.00 0.00 H new ATOM 0 HG3 ARG A 323 -6.748 1.829 6.670 1.00 0.00 H new ATOM 0 HD2 ARG A 323 -7.992 0.255 5.027 1.00 0.00 H new ATOM 0 HD3 ARG A 323 -7.144 -1.071 5.796 1.00 0.00 H new ATOM 0 HE ARG A 323 -9.435 0.359 6.921 1.00 0.00 H new ATOM 0 HH11 ARG A 323 -6.346 -1.108 7.652 1.00 0.00 H new ATOM 0 HH12 ARG A 323 -6.789 -1.509 9.314 1.00 0.00 H new ATOM 0 HH21 ARG A 323 -10.000 -0.153 9.047 1.00 0.00 H new ATOM 0 HH22 ARG A 323 -8.840 -0.973 10.097 1.00 0.00 H new ATOM 257 N LEU A 324 -2.512 2.857 4.069 1.00 0.00 N ATOM 258 CA LEU A 324 -1.574 2.919 2.913 1.00 0.00 C ATOM 259 C LEU A 324 -0.257 2.234 3.282 1.00 0.00 C ATOM 260 O LEU A 324 0.387 2.579 4.252 1.00 0.00 O ATOM 261 CB LEU A 324 -1.316 4.383 2.558 1.00 0.00 C ATOM 262 CG LEU A 324 -0.327 4.473 1.399 1.00 0.00 C ATOM 263 CD1 LEU A 324 -0.893 3.731 0.191 1.00 0.00 C ATOM 264 CD2 LEU A 324 -0.107 5.944 1.034 1.00 0.00 C ATOM 0 H LEU A 324 -2.530 3.688 4.660 1.00 0.00 H new ATOM 0 HA LEU A 324 -2.011 2.407 2.056 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -2.252 4.870 2.286 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -0.921 4.912 3.425 1.00 0.00 H new ATOM 0 HG LEU A 324 0.621 4.023 1.692 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -0.188 3.794 -0.638 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -1.056 2.685 0.450 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -1.840 4.183 -0.103 1.00 0.00 H new ATOM 0 HD21 LEU A 324 0.599 6.012 0.206 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -1.056 6.392 0.739 1.00 0.00 H new ATOM 0 HD23 LEU A 324 0.293 6.477 1.897 1.00 0.00 H new ATOM 276 N LEU A 325 0.143 1.261 2.509 1.00 0.00 N ATOM 277 CA LEU A 325 1.411 0.543 2.802 1.00 0.00 C ATOM 278 C LEU A 325 2.483 0.967 1.799 1.00 0.00 C ATOM 279 O LEU A 325 2.225 1.086 0.618 1.00 0.00 O ATOM 280 CB LEU A 325 1.185 -0.965 2.667 1.00 0.00 C ATOM 281 CG LEU A 325 0.000 -1.393 3.531 1.00 0.00 C ATOM 282 CD1 LEU A 325 -0.226 -2.897 3.370 1.00 0.00 C ATOM 283 CD2 LEU A 325 0.301 -1.079 4.999 1.00 0.00 C ATOM 0 H LEU A 325 -0.358 0.933 1.684 1.00 0.00 H new ATOM 0 HA LEU A 325 1.733 0.785 3.815 1.00 0.00 H new ATOM 0 HB2 LEU A 325 0.997 -1.221 1.624 1.00 0.00 H new ATOM 0 HB3 LEU A 325 2.082 -1.505 2.971 1.00 0.00 H new ATOM 0 HG LEU A 325 -0.894 -0.853 3.219 1.00 0.00 H new ATOM 0 HD11 LEU A 325 -1.071 -3.206 3.985 1.00 0.00 H new ATOM 0 HD12 LEU A 325 -0.436 -3.123 2.325 1.00 0.00 H new ATOM 0 HD13 LEU A 325 0.668 -3.435 3.685 1.00 0.00 H new ATOM 0 HD21 LEU A 325 -0.544 -1.384 5.617 1.00 0.00 H new ATOM 0 HD22 LEU A 325 1.193 -1.621 5.311 1.00 0.00 H new ATOM 0 HD23 LEU A 325 0.468 -0.008 5.115 1.00 0.00 H new ATOM 295 N LEU A 326 3.688 1.176 2.250 1.00 0.00 N ATOM 296 CA LEU A 326 4.773 1.566 1.309 1.00 0.00 C ATOM 297 C LEU A 326 5.514 0.301 0.879 1.00 0.00 C ATOM 298 O LEU A 326 5.855 -0.536 1.691 1.00 0.00 O ATOM 299 CB LEU A 326 5.741 2.529 2.007 1.00 0.00 C ATOM 300 CG LEU A 326 6.853 2.952 1.039 1.00 0.00 C ATOM 301 CD1 LEU A 326 6.281 3.872 -0.041 1.00 0.00 C ATOM 302 CD2 LEU A 326 7.939 3.698 1.816 1.00 0.00 C ATOM 0 H LEU A 326 3.968 1.094 3.227 1.00 0.00 H new ATOM 0 HA LEU A 326 4.354 2.066 0.436 1.00 0.00 H new ATOM 0 HB2 LEU A 326 5.201 3.408 2.359 1.00 0.00 H new ATOM 0 HB3 LEU A 326 6.175 2.049 2.884 1.00 0.00 H new ATOM 0 HG LEU A 326 7.277 2.066 0.567 1.00 0.00 H new ATOM 0 HD11 LEU A 326 7.076 4.169 -0.725 1.00 0.00 H new ATOM 0 HD12 LEU A 326 5.504 3.344 -0.595 1.00 0.00 H new ATOM 0 HD13 LEU A 326 5.854 4.760 0.426 1.00 0.00 H new ATOM 0 HD21 LEU A 326 8.732 4.001 1.133 1.00 0.00 H new ATOM 0 HD22 LEU A 326 7.508 4.582 2.286 1.00 0.00 H new ATOM 0 HD23 LEU A 326 8.352 3.043 2.584 1.00 0.00 H new ATOM 314 N CYS A 327 5.754 0.143 -0.393 1.00 0.00 N ATOM 315 CA CYS A 327 6.455 -1.082 -0.861 1.00 0.00 C ATOM 316 C CYS A 327 7.960 -0.944 -0.637 1.00 0.00 C ATOM 317 O CYS A 327 8.620 -0.144 -1.267 1.00 0.00 O ATOM 318 CB CYS A 327 6.192 -1.288 -2.353 1.00 0.00 C ATOM 319 SG CYS A 327 7.185 -2.683 -2.935 1.00 0.00 S ATOM 0 H CYS A 327 5.496 0.806 -1.124 1.00 0.00 H new ATOM 0 HA CYS A 327 6.081 -1.936 -0.297 1.00 0.00 H new ATOM 0 HB2 CYS A 327 5.133 -1.481 -2.526 1.00 0.00 H new ATOM 0 HB3 CYS A 327 6.447 -0.386 -2.909 1.00 0.00 H new ATOM 324 N ASP A 328 8.510 -1.731 0.246 1.00 0.00 N ATOM 325 CA ASP A 328 9.975 -1.657 0.493 1.00 0.00 C ATOM 326 C ASP A 328 10.710 -2.079 -0.781 1.00 0.00 C ATOM 327 O ASP A 328 11.757 -1.558 -1.112 1.00 0.00 O ATOM 328 CB ASP A 328 10.352 -2.599 1.638 1.00 0.00 C ATOM 329 CG ASP A 328 9.727 -2.095 2.940 1.00 0.00 C ATOM 330 OD1 ASP A 328 9.267 -0.965 2.954 1.00 0.00 O ATOM 331 OD2 ASP A 328 9.719 -2.846 3.900 1.00 0.00 O ATOM 0 H ASP A 328 8.008 -2.421 0.806 1.00 0.00 H new ATOM 0 HA ASP A 328 10.254 -0.639 0.764 1.00 0.00 H new ATOM 0 HB2 ASP A 328 10.003 -3.609 1.422 1.00 0.00 H new ATOM 0 HB3 ASP A 328 11.436 -2.651 1.739 1.00 0.00 H new ATOM 336 N GLY A 329 10.164 -3.026 -1.495 1.00 0.00 N ATOM 337 CA GLY A 329 10.818 -3.497 -2.749 1.00 0.00 C ATOM 338 C GLY A 329 11.016 -2.319 -3.704 1.00 0.00 C ATOM 339 O GLY A 329 12.028 -2.207 -4.368 1.00 0.00 O ATOM 0 H GLY A 329 9.289 -3.496 -1.262 1.00 0.00 H new ATOM 0 HA2 GLY A 329 11.780 -3.956 -2.518 1.00 0.00 H new ATOM 0 HA3 GLY A 329 10.205 -4.263 -3.224 1.00 0.00 H new ATOM 343 N CYS A 330 10.058 -1.438 -3.777 1.00 0.00 N ATOM 344 CA CYS A 330 10.187 -0.262 -4.685 1.00 0.00 C ATOM 345 C CYS A 330 9.341 0.888 -4.139 1.00 0.00 C ATOM 346 O CYS A 330 8.427 0.684 -3.370 1.00 0.00 O ATOM 347 CB CYS A 330 9.705 -0.638 -6.088 1.00 0.00 C ATOM 348 SG CYS A 330 7.899 -0.756 -6.097 1.00 0.00 S ATOM 0 H CYS A 330 9.188 -1.481 -3.246 1.00 0.00 H new ATOM 0 HA CYS A 330 11.231 0.046 -4.739 1.00 0.00 H new ATOM 0 HB2 CYS A 330 10.034 0.110 -6.809 1.00 0.00 H new ATOM 0 HB3 CYS A 330 10.143 -1.589 -6.392 1.00 0.00 H new ATOM 353 N ASP A 331 9.635 2.097 -4.523 1.00 0.00 N ATOM 354 CA ASP A 331 8.842 3.247 -4.006 1.00 0.00 C ATOM 355 C ASP A 331 7.426 3.193 -4.580 1.00 0.00 C ATOM 356 O ASP A 331 7.131 3.798 -5.593 1.00 0.00 O ATOM 357 CB ASP A 331 9.512 4.558 -4.423 1.00 0.00 C ATOM 358 CG ASP A 331 8.799 5.733 -3.752 1.00 0.00 C ATOM 359 OD1 ASP A 331 7.920 5.483 -2.945 1.00 0.00 O ATOM 360 OD2 ASP A 331 9.146 6.863 -4.055 1.00 0.00 O ATOM 0 H ASP A 331 10.386 2.339 -5.169 1.00 0.00 H new ATOM 0 HA ASP A 331 8.794 3.193 -2.918 1.00 0.00 H new ATOM 0 HB2 ASP A 331 10.564 4.547 -4.139 1.00 0.00 H new ATOM 0 HB3 ASP A 331 9.476 4.668 -5.507 1.00 0.00 H new ATOM 365 N ASP A 332 6.544 2.478 -3.936 1.00 0.00 N ATOM 366 CA ASP A 332 5.143 2.389 -4.438 1.00 0.00 C ATOM 367 C ASP A 332 4.190 2.237 -3.251 1.00 0.00 C ATOM 368 O ASP A 332 4.317 1.321 -2.461 1.00 0.00 O ATOM 369 CB ASP A 332 5.008 1.177 -5.360 1.00 0.00 C ATOM 370 CG ASP A 332 3.619 1.174 -5.999 1.00 0.00 C ATOM 371 OD1 ASP A 332 2.892 2.131 -5.793 1.00 0.00 O ATOM 372 OD2 ASP A 332 3.305 0.213 -6.683 1.00 0.00 O ATOM 0 H ASP A 332 6.733 1.951 -3.083 1.00 0.00 H new ATOM 0 HA ASP A 332 4.895 3.294 -4.992 1.00 0.00 H new ATOM 0 HB2 ASP A 332 5.776 1.208 -6.133 1.00 0.00 H new ATOM 0 HB3 ASP A 332 5.162 0.258 -4.795 1.00 0.00 H new ATOM 377 N SER A 333 3.239 3.126 -3.114 1.00 0.00 N ATOM 378 CA SER A 333 2.284 3.028 -1.973 1.00 0.00 C ATOM 379 C SER A 333 0.866 2.766 -2.495 1.00 0.00 C ATOM 380 O SER A 333 0.425 3.361 -3.460 1.00 0.00 O ATOM 381 CB SER A 333 2.302 4.343 -1.194 1.00 0.00 C ATOM 382 OG SER A 333 3.639 4.651 -0.826 1.00 0.00 O ATOM 0 H SER A 333 3.084 3.914 -3.743 1.00 0.00 H new ATOM 0 HA SER A 333 2.581 2.205 -1.323 1.00 0.00 H new ATOM 0 HB2 SER A 333 1.886 5.146 -1.803 1.00 0.00 H new ATOM 0 HB3 SER A 333 1.677 4.261 -0.305 1.00 0.00 H new ATOM 0 HG SER A 333 3.655 5.495 -0.328 1.00 0.00 H new ATOM 388 N TYR A 334 0.149 1.882 -1.847 1.00 0.00 N ATOM 389 CA TYR A 334 -1.246 1.569 -2.278 1.00 0.00 C ATOM 390 C TYR A 334 -2.073 1.123 -1.067 1.00 0.00 C ATOM 391 O TYR A 334 -1.541 0.685 -0.067 1.00 0.00 O ATOM 392 CB TYR A 334 -1.224 0.452 -3.317 1.00 0.00 C ATOM 393 CG TYR A 334 -0.479 -0.730 -2.757 1.00 0.00 C ATOM 394 CD1 TYR A 334 0.914 -0.775 -2.847 1.00 0.00 C ATOM 395 CD2 TYR A 334 -1.177 -1.778 -2.151 1.00 0.00 C ATOM 396 CE1 TYR A 334 1.615 -1.870 -2.330 1.00 0.00 C ATOM 397 CE2 TYR A 334 -0.478 -2.874 -1.633 1.00 0.00 C ATOM 398 CZ TYR A 334 0.918 -2.921 -1.723 1.00 0.00 C ATOM 399 OH TYR A 334 1.608 -4.002 -1.212 1.00 0.00 O ATOM 0 H TYR A 334 0.474 1.361 -1.032 1.00 0.00 H new ATOM 0 HA TYR A 334 -1.695 2.461 -2.714 1.00 0.00 H new ATOM 0 HB2 TYR A 334 -2.242 0.164 -3.580 1.00 0.00 H new ATOM 0 HB3 TYR A 334 -0.744 0.799 -4.232 1.00 0.00 H new ATOM 0 HD1 TYR A 334 1.451 0.036 -3.316 1.00 0.00 H new ATOM 0 HD2 TYR A 334 -2.254 -1.742 -2.083 1.00 0.00 H new ATOM 0 HE1 TYR A 334 2.692 -1.904 -2.399 1.00 0.00 H new ATOM 0 HE2 TYR A 334 -1.016 -3.684 -1.163 1.00 0.00 H new ATOM 0 HH TYR A 334 0.974 -4.641 -0.825 1.00 0.00 H new ATOM 409 N HIS A 335 -3.372 1.230 -1.148 1.00 0.00 N ATOM 410 CA HIS A 335 -4.225 0.820 0.003 1.00 0.00 C ATOM 411 C HIS A 335 -4.522 -0.677 -0.066 1.00 0.00 C ATOM 412 O HIS A 335 -4.399 -1.305 -1.099 1.00 0.00 O ATOM 413 CB HIS A 335 -5.546 1.587 -0.034 1.00 0.00 C ATOM 414 CG HIS A 335 -5.272 3.060 0.029 1.00 0.00 C ATOM 415 ND1 HIS A 335 -5.782 3.943 -0.908 1.00 0.00 N ATOM 416 CD2 HIS A 335 -4.546 3.823 0.910 1.00 0.00 C ATOM 417 CE1 HIS A 335 -5.363 5.175 -0.574 1.00 0.00 C ATOM 418 NE2 HIS A 335 -4.606 5.156 0.524 1.00 0.00 N ATOM 0 H HIS A 335 -3.878 1.583 -1.960 1.00 0.00 H new ATOM 0 HA HIS A 335 -3.691 1.043 0.927 1.00 0.00 H new ATOM 0 HB2 HIS A 335 -6.093 1.347 -0.946 1.00 0.00 H new ATOM 0 HB3 HIS A 335 -6.176 1.288 0.804 1.00 0.00 H new ATOM 0 HD2 HIS A 335 -4.012 3.446 1.769 1.00 0.00 H new ATOM 0 HE1 HIS A 335 -5.609 6.070 -1.126 1.00 0.00 H new ATOM 0 HE2 HIS A 335 -4.164 5.952 0.983 1.00 0.00 H new ATOM 426 N THR A 336 -4.913 -1.249 1.039 1.00 0.00 N ATOM 427 CA THR A 336 -5.225 -2.700 1.073 1.00 0.00 C ATOM 428 C THR A 336 -6.546 -2.969 0.348 1.00 0.00 C ATOM 429 O THR A 336 -6.865 -4.096 0.034 1.00 0.00 O ATOM 430 CB THR A 336 -5.351 -3.137 2.533 1.00 0.00 C ATOM 431 OG1 THR A 336 -6.462 -2.483 3.128 1.00 0.00 O ATOM 432 CG2 THR A 336 -4.075 -2.765 3.287 1.00 0.00 C ATOM 0 H THR A 336 -5.030 -0.764 1.929 1.00 0.00 H new ATOM 0 HA THR A 336 -4.430 -3.258 0.578 1.00 0.00 H new ATOM 0 HB THR A 336 -5.498 -4.216 2.579 1.00 0.00 H new ATOM 0 HG1 THR A 336 -6.367 -2.499 4.103 1.00 0.00 H new ATOM 0 HG21 THR A 336 -4.164 -3.076 4.328 1.00 0.00 H new ATOM 0 HG22 THR A 336 -3.223 -3.267 2.830 1.00 0.00 H new ATOM 0 HG23 THR A 336 -3.927 -1.686 3.242 1.00 0.00 H new ATOM 440 N PHE A 337 -7.325 -1.947 0.096 1.00 0.00 N ATOM 441 CA PHE A 337 -8.637 -2.155 -0.587 1.00 0.00 C ATOM 442 C PHE A 337 -8.640 -1.529 -1.986 1.00 0.00 C ATOM 443 O PHE A 337 -9.648 -1.547 -2.664 1.00 0.00 O ATOM 444 CB PHE A 337 -9.744 -1.504 0.243 1.00 0.00 C ATOM 445 CG PHE A 337 -9.512 -0.015 0.293 1.00 0.00 C ATOM 446 CD1 PHE A 337 -10.042 0.809 -0.707 1.00 0.00 C ATOM 447 CD2 PHE A 337 -8.766 0.542 1.338 1.00 0.00 C ATOM 448 CE1 PHE A 337 -9.825 2.190 -0.662 1.00 0.00 C ATOM 449 CE2 PHE A 337 -8.549 1.923 1.384 1.00 0.00 C ATOM 450 CZ PHE A 337 -9.079 2.749 0.384 1.00 0.00 C ATOM 0 H PHE A 337 -7.109 -0.979 0.334 1.00 0.00 H new ATOM 0 HA PHE A 337 -8.805 -3.228 -0.683 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -10.718 -1.718 -0.196 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -9.751 -1.918 1.251 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -10.618 0.379 -1.513 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -8.358 -0.095 2.109 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -10.233 2.826 -1.434 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -7.973 2.353 2.190 1.00 0.00 H new ATOM 0 HZ PHE A 337 -8.913 3.816 0.419 1.00 0.00 H new ATOM 460 N CYS A 338 -7.541 -0.972 -2.424 1.00 0.00 N ATOM 461 CA CYS A 338 -7.522 -0.346 -3.783 1.00 0.00 C ATOM 462 C CYS A 338 -6.394 -0.949 -4.622 1.00 0.00 C ATOM 463 O CYS A 338 -5.773 -0.276 -5.420 1.00 0.00 O ATOM 464 CB CYS A 338 -7.329 1.169 -3.649 1.00 0.00 C ATOM 465 SG CYS A 338 -5.569 1.564 -3.512 1.00 0.00 S ATOM 0 H CYS A 338 -6.663 -0.923 -1.907 1.00 0.00 H new ATOM 0 HA CYS A 338 -8.471 -0.542 -4.282 1.00 0.00 H new ATOM 0 HB2 CYS A 338 -7.757 1.675 -4.514 1.00 0.00 H new ATOM 0 HB3 CYS A 338 -7.861 1.535 -2.771 1.00 0.00 H new ATOM 470 N LEU A 339 -6.139 -2.219 -4.455 1.00 0.00 N ATOM 471 CA LEU A 339 -5.064 -2.883 -5.250 1.00 0.00 C ATOM 472 C LEU A 339 -5.048 -4.379 -4.941 1.00 0.00 C ATOM 473 O LEU A 339 -4.971 -5.208 -5.827 1.00 0.00 O ATOM 474 CB LEU A 339 -3.702 -2.280 -4.890 1.00 0.00 C ATOM 475 CG LEU A 339 -2.617 -2.887 -5.787 1.00 0.00 C ATOM 476 CD1 LEU A 339 -2.819 -2.425 -7.233 1.00 0.00 C ATOM 477 CD2 LEU A 339 -1.241 -2.432 -5.298 1.00 0.00 C ATOM 0 H LEU A 339 -6.630 -2.828 -3.800 1.00 0.00 H new ATOM 0 HA LEU A 339 -5.260 -2.729 -6.311 1.00 0.00 H new ATOM 0 HB2 LEU A 339 -3.728 -1.198 -5.015 1.00 0.00 H new ATOM 0 HB3 LEU A 339 -3.472 -2.474 -3.842 1.00 0.00 H new ATOM 0 HG LEU A 339 -2.683 -3.974 -5.744 1.00 0.00 H new ATOM 0 HD11 LEU A 339 -2.045 -2.860 -7.865 1.00 0.00 H new ATOM 0 HD12 LEU A 339 -3.799 -2.748 -7.585 1.00 0.00 H new ATOM 0 HD13 LEU A 339 -2.757 -1.338 -7.280 1.00 0.00 H new ATOM 0 HD21 LEU A 339 -0.468 -2.863 -5.935 1.00 0.00 H new ATOM 0 HD22 LEU A 339 -1.181 -1.344 -5.340 1.00 0.00 H new ATOM 0 HD23 LEU A 339 -1.092 -2.764 -4.271 1.00 0.00 H new ATOM 489 N ILE A 340 -5.108 -4.725 -3.689 1.00 0.00 N ATOM 490 CA ILE A 340 -5.082 -6.157 -3.298 1.00 0.00 C ATOM 491 C ILE A 340 -6.448 -6.557 -2.725 1.00 0.00 C ATOM 492 O ILE A 340 -7.138 -5.743 -2.144 1.00 0.00 O ATOM 493 CB ILE A 340 -4.001 -6.331 -2.235 1.00 0.00 C ATOM 494 CG1 ILE A 340 -4.435 -5.615 -0.956 1.00 0.00 C ATOM 495 CG2 ILE A 340 -2.691 -5.720 -2.738 1.00 0.00 C ATOM 496 CD1 ILE A 340 -3.276 -5.592 0.041 1.00 0.00 C ATOM 0 H ILE A 340 -5.175 -4.069 -2.911 1.00 0.00 H new ATOM 0 HA ILE A 340 -4.869 -6.788 -4.161 1.00 0.00 H new ATOM 0 HB ILE A 340 -3.854 -7.392 -2.031 1.00 0.00 H new ATOM 0 HG12 ILE A 340 -4.749 -4.597 -1.186 1.00 0.00 H new ATOM 0 HG13 ILE A 340 -5.294 -6.122 -0.518 1.00 0.00 H new ATOM 0 HG21 ILE A 340 -1.917 -5.843 -1.980 1.00 0.00 H new ATOM 0 HG22 ILE A 340 -2.384 -6.222 -3.655 1.00 0.00 H new ATOM 0 HG23 ILE A 340 -2.838 -4.658 -2.938 1.00 0.00 H new ATOM 0 HD11 ILE A 340 -3.589 -5.081 0.951 1.00 0.00 H new ATOM 0 HD12 ILE A 340 -2.982 -6.614 0.281 1.00 0.00 H new ATOM 0 HD13 ILE A 340 -2.429 -5.065 -0.398 1.00 0.00 H new ATOM 508 N PRO A 341 -6.840 -7.803 -2.876 1.00 0.00 N ATOM 509 CA PRO A 341 -8.140 -8.288 -2.350 1.00 0.00 C ATOM 510 C PRO A 341 -8.391 -7.812 -0.910 1.00 0.00 C ATOM 511 O PRO A 341 -9.434 -7.260 -0.625 1.00 0.00 O ATOM 512 CB PRO A 341 -8.058 -9.819 -2.422 1.00 0.00 C ATOM 513 CG PRO A 341 -6.740 -10.164 -3.053 1.00 0.00 C ATOM 514 CD PRO A 341 -6.095 -8.869 -3.555 1.00 0.00 C ATOM 0 HA PRO A 341 -8.974 -7.895 -2.932 1.00 0.00 H new ATOM 0 HB2 PRO A 341 -8.134 -10.256 -1.426 1.00 0.00 H new ATOM 0 HB3 PRO A 341 -8.883 -10.221 -3.010 1.00 0.00 H new ATOM 0 HG2 PRO A 341 -6.090 -10.657 -2.330 1.00 0.00 H new ATOM 0 HG3 PRO A 341 -6.885 -10.861 -3.878 1.00 0.00 H new ATOM 0 HD2 PRO A 341 -5.034 -8.832 -3.308 1.00 0.00 H new ATOM 0 HD3 PRO A 341 -6.173 -8.780 -4.639 1.00 0.00 H new ATOM 522 N PRO A 342 -7.446 -7.997 -0.008 1.00 0.00 N ATOM 523 CA PRO A 342 -7.590 -7.544 1.398 1.00 0.00 C ATOM 524 C PRO A 342 -8.379 -6.233 1.512 1.00 0.00 C ATOM 525 O PRO A 342 -8.562 -5.522 0.546 1.00 0.00 O ATOM 526 CB PRO A 342 -6.146 -7.339 1.847 1.00 0.00 C ATOM 527 CG PRO A 342 -5.331 -8.298 1.040 1.00 0.00 C ATOM 528 CD PRO A 342 -6.146 -8.671 -0.203 1.00 0.00 C ATOM 0 HA PRO A 342 -8.144 -8.260 2.004 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -5.825 -6.312 1.676 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -6.036 -7.533 2.914 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -4.381 -7.846 0.753 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -5.097 -9.187 1.625 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -5.656 -8.332 -1.116 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -6.268 -9.751 -0.289 1.00 0.00 H new ATOM 536 N LEU A 343 -8.847 -5.913 2.687 1.00 0.00 N ATOM 537 CA LEU A 343 -9.628 -4.657 2.867 1.00 0.00 C ATOM 538 C LEU A 343 -9.120 -3.906 4.099 1.00 0.00 C ATOM 539 O LEU A 343 -9.202 -2.695 4.175 1.00 0.00 O ATOM 540 CB LEU A 343 -11.107 -4.999 3.065 1.00 0.00 C ATOM 541 CG LEU A 343 -11.623 -5.800 1.866 1.00 0.00 C ATOM 542 CD1 LEU A 343 -13.061 -6.246 2.134 1.00 0.00 C ATOM 543 CD2 LEU A 343 -11.597 -4.923 0.610 1.00 0.00 C ATOM 0 H LEU A 343 -8.722 -6.469 3.533 1.00 0.00 H new ATOM 0 HA LEU A 343 -9.509 -4.032 1.982 1.00 0.00 H new ATOM 0 HB2 LEU A 343 -11.236 -5.575 3.981 1.00 0.00 H new ATOM 0 HB3 LEU A 343 -11.688 -4.084 3.179 1.00 0.00 H new ATOM 0 HG LEU A 343 -10.987 -6.672 1.716 1.00 0.00 H new ATOM 0 HD11 LEU A 343 -13.430 -6.816 1.282 1.00 0.00 H new ATOM 0 HD12 LEU A 343 -13.088 -6.870 3.027 1.00 0.00 H new ATOM 0 HD13 LEU A 343 -13.692 -5.370 2.285 1.00 0.00 H new ATOM 0 HD21 LEU A 343 -11.965 -5.496 -0.241 1.00 0.00 H new ATOM 0 HD22 LEU A 343 -12.233 -4.051 0.762 1.00 0.00 H new ATOM 0 HD23 LEU A 343 -10.575 -4.598 0.414 1.00 0.00 H new ATOM 555 N HIS A 344 -8.602 -4.615 5.065 1.00 0.00 N ATOM 556 CA HIS A 344 -8.097 -3.947 6.298 1.00 0.00 C ATOM 557 C HIS A 344 -6.573 -4.059 6.354 1.00 0.00 C ATOM 558 O HIS A 344 -6.000 -5.056 5.962 1.00 0.00 O ATOM 559 CB HIS A 344 -8.701 -4.628 7.529 1.00 0.00 C ATOM 560 CG HIS A 344 -10.190 -4.412 7.541 1.00 0.00 C ATOM 561 ND1 HIS A 344 -11.039 -5.161 8.345 1.00 0.00 N ATOM 562 CD2 HIS A 344 -10.998 -3.537 6.856 1.00 0.00 C ATOM 563 CE1 HIS A 344 -12.294 -4.726 8.125 1.00 0.00 C ATOM 564 NE2 HIS A 344 -12.322 -3.741 7.228 1.00 0.00 N ATOM 0 H HIS A 344 -8.507 -5.630 5.053 1.00 0.00 H new ATOM 0 HA HIS A 344 -8.384 -2.895 6.283 1.00 0.00 H new ATOM 0 HB2 HIS A 344 -8.478 -5.695 7.514 1.00 0.00 H new ATOM 0 HB3 HIS A 344 -8.256 -4.222 8.438 1.00 0.00 H new ATOM 0 HD2 HIS A 344 -10.657 -2.804 6.140 1.00 0.00 H new ATOM 0 HE1 HIS A 344 -13.170 -5.126 8.615 1.00 0.00 H new ATOM 0 HE2 HIS A 344 -13.143 -3.241 6.886 1.00 0.00 H new ATOM 573 N ASP A 345 -5.911 -3.045 6.840 1.00 0.00 N ATOM 574 CA ASP A 345 -4.425 -3.100 6.918 1.00 0.00 C ATOM 575 C ASP A 345 -4.016 -3.849 8.184 1.00 0.00 C ATOM 576 O ASP A 345 -4.088 -3.325 9.279 1.00 0.00 O ATOM 577 CB ASP A 345 -3.860 -1.680 6.969 1.00 0.00 C ATOM 578 CG ASP A 345 -2.333 -1.739 6.918 1.00 0.00 C ATOM 579 OD1 ASP A 345 -1.806 -2.835 6.832 1.00 0.00 O ATOM 580 OD2 ASP A 345 -1.716 -0.686 6.965 1.00 0.00 O ATOM 0 H ASP A 345 -6.334 -2.183 7.185 1.00 0.00 H new ATOM 0 HA ASP A 345 -4.034 -3.615 6.040 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -4.241 -1.095 6.132 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -4.185 -1.180 7.881 1.00 0.00 H new ATOM 585 N VAL A 346 -3.586 -5.072 8.041 1.00 0.00 N ATOM 586 CA VAL A 346 -3.167 -5.868 9.225 1.00 0.00 C ATOM 587 C VAL A 346 -1.647 -6.086 9.175 1.00 0.00 C ATOM 588 O VAL A 346 -1.084 -6.265 8.115 1.00 0.00 O ATOM 589 CB VAL A 346 -3.888 -7.215 9.198 1.00 0.00 C ATOM 590 CG1 VAL A 346 -4.990 -7.224 10.260 1.00 0.00 C ATOM 591 CG2 VAL A 346 -4.516 -7.426 7.817 1.00 0.00 C ATOM 0 H VAL A 346 -3.507 -5.556 7.147 1.00 0.00 H new ATOM 0 HA VAL A 346 -3.423 -5.339 10.143 1.00 0.00 H new ATOM 0 HB VAL A 346 -3.175 -8.014 9.404 1.00 0.00 H new ATOM 0 HG11 VAL A 346 -5.505 -8.184 10.242 1.00 0.00 H new ATOM 0 HG12 VAL A 346 -4.548 -7.068 11.244 1.00 0.00 H new ATOM 0 HG13 VAL A 346 -5.703 -6.426 10.052 1.00 0.00 H new ATOM 0 HG21 VAL A 346 -5.031 -8.386 7.794 1.00 0.00 H new ATOM 0 HG22 VAL A 346 -5.229 -6.627 7.616 1.00 0.00 H new ATOM 0 HG23 VAL A 346 -3.735 -7.415 7.057 1.00 0.00 H new ATOM 601 N PRO A 347 -0.982 -6.070 10.307 1.00 0.00 N ATOM 602 CA PRO A 347 0.497 -6.268 10.367 1.00 0.00 C ATOM 603 C PRO A 347 0.922 -7.665 9.912 1.00 0.00 C ATOM 604 O PRO A 347 0.181 -8.620 10.031 1.00 0.00 O ATOM 605 CB PRO A 347 0.851 -6.069 11.841 1.00 0.00 C ATOM 606 CG PRO A 347 -0.424 -6.257 12.595 1.00 0.00 C ATOM 607 CD PRO A 347 -1.557 -5.868 11.646 1.00 0.00 C ATOM 0 HA PRO A 347 1.009 -5.575 9.700 1.00 0.00 H new ATOM 0 HB2 PRO A 347 1.605 -6.788 12.162 1.00 0.00 H new ATOM 0 HB3 PRO A 347 1.264 -5.075 12.013 1.00 0.00 H new ATOM 0 HG2 PRO A 347 -0.531 -7.291 12.922 1.00 0.00 H new ATOM 0 HG3 PRO A 347 -0.439 -5.636 13.491 1.00 0.00 H new ATOM 0 HD2 PRO A 347 -2.439 -6.490 11.800 1.00 0.00 H new ATOM 0 HD3 PRO A 347 -1.866 -4.834 11.796 1.00 0.00 H new ATOM 615 N LYS A 348 2.113 -7.790 9.396 1.00 0.00 N ATOM 616 CA LYS A 348 2.590 -9.124 8.940 1.00 0.00 C ATOM 617 C LYS A 348 4.065 -9.018 8.539 1.00 0.00 C ATOM 618 O LYS A 348 4.898 -8.577 9.304 1.00 0.00 O ATOM 619 CB LYS A 348 1.757 -9.579 7.739 1.00 0.00 C ATOM 620 CG LYS A 348 1.954 -11.081 7.511 1.00 0.00 C ATOM 621 CD LYS A 348 1.176 -11.513 6.266 1.00 0.00 C ATOM 622 CE LYS A 348 1.249 -13.035 6.120 1.00 0.00 C ATOM 623 NZ LYS A 348 0.838 -13.420 4.740 1.00 0.00 N ATOM 0 H LYS A 348 2.776 -7.025 9.271 1.00 0.00 H new ATOM 0 HA LYS A 348 2.483 -9.851 9.745 1.00 0.00 H new ATOM 0 HB2 LYS A 348 0.703 -9.363 7.913 1.00 0.00 H new ATOM 0 HB3 LYS A 348 2.053 -9.025 6.848 1.00 0.00 H new ATOM 0 HG2 LYS A 348 3.013 -11.305 7.387 1.00 0.00 H new ATOM 0 HG3 LYS A 348 1.609 -11.640 8.381 1.00 0.00 H new ATOM 0 HD2 LYS A 348 0.137 -11.194 6.345 1.00 0.00 H new ATOM 0 HD3 LYS A 348 1.591 -11.032 5.380 1.00 0.00 H new ATOM 0 HE2 LYS A 348 2.263 -13.382 6.320 1.00 0.00 H new ATOM 0 HE3 LYS A 348 0.598 -13.513 6.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 348 0.887 -14.454 4.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 348 -0.136 -13.101 4.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 348 1.476 -12.974 4.051 1.00 0.00 H new ATOM 637 N GLY A 349 4.389 -9.419 7.343 1.00 0.00 N ATOM 638 CA GLY A 349 5.805 -9.345 6.880 1.00 0.00 C ATOM 639 C GLY A 349 6.038 -8.020 6.154 1.00 0.00 C ATOM 640 O GLY A 349 5.224 -7.120 6.209 1.00 0.00 O ATOM 0 H GLY A 349 3.732 -9.797 6.661 1.00 0.00 H new ATOM 0 HA2 GLY A 349 6.481 -9.429 7.731 1.00 0.00 H new ATOM 0 HA3 GLY A 349 6.025 -10.180 6.214 1.00 0.00 H new ATOM 644 N ASP A 350 7.141 -7.895 5.465 1.00 0.00 N ATOM 645 CA ASP A 350 7.420 -6.634 4.730 1.00 0.00 C ATOM 646 C ASP A 350 6.339 -6.433 3.667 1.00 0.00 C ATOM 647 O ASP A 350 5.787 -7.383 3.149 1.00 0.00 O ATOM 648 CB ASP A 350 8.789 -6.733 4.058 1.00 0.00 C ATOM 649 CG ASP A 350 9.880 -6.801 5.129 1.00 0.00 C ATOM 650 OD1 ASP A 350 9.574 -6.519 6.276 1.00 0.00 O ATOM 651 OD2 ASP A 350 11.001 -7.133 4.784 1.00 0.00 O ATOM 0 H ASP A 350 7.859 -8.614 5.381 1.00 0.00 H new ATOM 0 HA ASP A 350 7.419 -5.791 5.420 1.00 0.00 H new ATOM 0 HB2 ASP A 350 8.831 -7.619 3.424 1.00 0.00 H new ATOM 0 HB3 ASP A 350 8.952 -5.870 3.412 1.00 0.00 H new ATOM 656 N TRP A 351 6.018 -5.210 3.347 1.00 0.00 N ATOM 657 CA TRP A 351 4.959 -4.975 2.328 1.00 0.00 C ATOM 658 C TRP A 351 5.584 -4.817 0.942 1.00 0.00 C ATOM 659 O TRP A 351 6.420 -3.965 0.716 1.00 0.00 O ATOM 660 CB TRP A 351 4.191 -3.699 2.682 1.00 0.00 C ATOM 661 CG TRP A 351 3.489 -3.885 3.987 1.00 0.00 C ATOM 662 CD1 TRP A 351 3.860 -3.318 5.157 1.00 0.00 C ATOM 663 CD2 TRP A 351 2.304 -4.682 4.274 1.00 0.00 C ATOM 664 NE1 TRP A 351 2.978 -3.715 6.145 1.00 0.00 N ATOM 665 CE2 TRP A 351 2.001 -4.556 5.650 1.00 0.00 C ATOM 666 CE3 TRP A 351 1.471 -5.494 3.483 1.00 0.00 C ATOM 667 CZ2 TRP A 351 0.910 -5.211 6.222 1.00 0.00 C ATOM 668 CZ3 TRP A 351 0.372 -6.154 4.055 1.00 0.00 C ATOM 669 CH2 TRP A 351 0.092 -6.014 5.422 1.00 0.00 C ATOM 0 H TRP A 351 6.439 -4.370 3.744 1.00 0.00 H new ATOM 0 HA TRP A 351 4.281 -5.829 2.318 1.00 0.00 H new ATOM 0 HB2 TRP A 351 4.877 -2.854 2.743 1.00 0.00 H new ATOM 0 HB3 TRP A 351 3.469 -3.467 1.899 1.00 0.00 H new ATOM 0 HD1 TRP A 351 4.707 -2.662 5.297 1.00 0.00 H new ATOM 0 HE1 TRP A 351 3.041 -3.422 7.120 1.00 0.00 H new ATOM 0 HE3 TRP A 351 1.678 -5.610 2.429 1.00 0.00 H new ATOM 0 HZ2 TRP A 351 0.699 -5.098 7.275 1.00 0.00 H new ATOM 0 HZ3 TRP A 351 -0.262 -6.774 3.438 1.00 0.00 H new ATOM 0 HH2 TRP A 351 -0.754 -6.526 5.856 1.00 0.00 H new ATOM 680 N ARG A 352 5.164 -5.626 0.008 1.00 0.00 N ATOM 681 CA ARG A 352 5.702 -5.530 -1.375 1.00 0.00 C ATOM 682 C ARG A 352 4.541 -5.455 -2.359 1.00 0.00 C ATOM 683 O ARG A 352 3.591 -6.207 -2.269 1.00 0.00 O ATOM 684 CB ARG A 352 6.544 -6.765 -1.696 1.00 0.00 C ATOM 685 CG ARG A 352 7.818 -6.759 -0.853 1.00 0.00 C ATOM 686 CD ARG A 352 8.715 -7.912 -1.301 1.00 0.00 C ATOM 687 NE ARG A 352 9.915 -7.981 -0.420 1.00 0.00 N ATOM 688 CZ ARG A 352 9.813 -8.475 0.784 1.00 0.00 C ATOM 689 NH1 ARG A 352 8.659 -8.909 1.215 1.00 0.00 N ATOM 690 NH2 ARG A 352 10.862 -8.535 1.556 1.00 0.00 N ATOM 0 H ARG A 352 4.465 -6.355 0.147 1.00 0.00 H new ATOM 0 HA ARG A 352 6.323 -4.638 -1.456 1.00 0.00 H new ATOM 0 HB2 ARG A 352 5.970 -7.670 -1.496 1.00 0.00 H new ATOM 0 HB3 ARG A 352 6.799 -6.777 -2.756 1.00 0.00 H new ATOM 0 HG2 ARG A 352 8.340 -5.809 -0.967 1.00 0.00 H new ATOM 0 HG3 ARG A 352 7.571 -6.862 0.204 1.00 0.00 H new ATOM 0 HD2 ARG A 352 8.165 -8.852 -1.258 1.00 0.00 H new ATOM 0 HD3 ARG A 352 9.020 -7.768 -2.338 1.00 0.00 H new ATOM 0 HE ARG A 352 10.816 -7.642 -0.758 1.00 0.00 H new ATOM 0 HH11 ARG A 352 7.838 -8.862 0.611 1.00 0.00 H new ATOM 0 HH12 ARG A 352 8.578 -9.295 2.156 1.00 0.00 H new ATOM 0 HH21 ARG A 352 11.763 -8.196 1.219 1.00 0.00 H new ATOM 0 HH22 ARG A 352 10.782 -8.921 2.497 1.00 0.00 H new ATOM 704 N CYS A 353 4.614 -4.572 -3.310 1.00 0.00 N ATOM 705 CA CYS A 353 3.521 -4.480 -4.304 1.00 0.00 C ATOM 706 C CYS A 353 3.508 -5.789 -5.109 1.00 0.00 C ATOM 707 O CYS A 353 4.525 -6.442 -5.233 1.00 0.00 O ATOM 708 CB CYS A 353 3.770 -3.276 -5.213 1.00 0.00 C ATOM 709 SG CYS A 353 5.305 -3.517 -6.136 1.00 0.00 S ATOM 0 H CYS A 353 5.381 -3.913 -3.440 1.00 0.00 H new ATOM 0 HA CYS A 353 2.554 -4.343 -3.820 1.00 0.00 H new ATOM 0 HB2 CYS A 353 2.935 -3.150 -5.903 1.00 0.00 H new ATOM 0 HB3 CYS A 353 3.832 -2.365 -4.618 1.00 0.00 H new ATOM 714 N PRO A 354 2.373 -6.201 -5.620 1.00 0.00 N ATOM 715 CA PRO A 354 2.266 -7.484 -6.378 1.00 0.00 C ATOM 716 C PRO A 354 3.367 -7.667 -7.433 1.00 0.00 C ATOM 717 O PRO A 354 3.895 -8.749 -7.599 1.00 0.00 O ATOM 718 CB PRO A 354 0.905 -7.391 -7.069 1.00 0.00 C ATOM 719 CG PRO A 354 0.099 -6.419 -6.272 1.00 0.00 C ATOM 720 CD PRO A 354 1.077 -5.505 -5.531 1.00 0.00 C ATOM 0 HA PRO A 354 2.374 -8.336 -5.706 1.00 0.00 H new ATOM 0 HB2 PRO A 354 1.014 -7.054 -8.100 1.00 0.00 H new ATOM 0 HB3 PRO A 354 0.418 -8.366 -7.102 1.00 0.00 H new ATOM 0 HG2 PRO A 354 -0.551 -5.836 -6.924 1.00 0.00 H new ATOM 0 HG3 PRO A 354 -0.545 -6.944 -5.566 1.00 0.00 H new ATOM 0 HD2 PRO A 354 1.124 -4.518 -5.991 1.00 0.00 H new ATOM 0 HD3 PRO A 354 0.775 -5.359 -4.494 1.00 0.00 H new ATOM 728 N LYS A 355 3.726 -6.635 -8.145 1.00 0.00 N ATOM 729 CA LYS A 355 4.795 -6.793 -9.175 1.00 0.00 C ATOM 730 C LYS A 355 6.126 -7.148 -8.508 1.00 0.00 C ATOM 731 O LYS A 355 6.873 -7.972 -8.996 1.00 0.00 O ATOM 732 CB LYS A 355 4.942 -5.497 -9.970 1.00 0.00 C ATOM 733 CG LYS A 355 5.134 -4.342 -8.999 1.00 0.00 C ATOM 734 CD LYS A 355 5.191 -3.023 -9.771 1.00 0.00 C ATOM 735 CE LYS A 355 5.585 -1.891 -8.821 1.00 0.00 C ATOM 736 NZ LYS A 355 6.057 -0.719 -9.613 1.00 0.00 N ATOM 0 H LYS A 355 3.332 -5.698 -8.061 1.00 0.00 H new ATOM 0 HA LYS A 355 4.516 -7.601 -9.852 1.00 0.00 H new ATOM 0 HB2 LYS A 355 5.793 -5.565 -10.648 1.00 0.00 H new ATOM 0 HB3 LYS A 355 4.058 -5.330 -10.585 1.00 0.00 H new ATOM 0 HG2 LYS A 355 4.315 -4.319 -8.280 1.00 0.00 H new ATOM 0 HG3 LYS A 355 6.053 -4.482 -8.430 1.00 0.00 H new ATOM 0 HD2 LYS A 355 5.913 -3.097 -10.585 1.00 0.00 H new ATOM 0 HD3 LYS A 355 4.222 -2.812 -10.223 1.00 0.00 H new ATOM 0 HE2 LYS A 355 4.733 -1.607 -8.204 1.00 0.00 H new ATOM 0 HE3 LYS A 355 6.371 -2.227 -8.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 355 6.325 0.051 -8.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 355 6.881 -0.995 -10.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 355 5.294 -0.394 -10.241 1.00 0.00 H new ATOM 750 N CYS A 356 6.431 -6.540 -7.394 1.00 0.00 N ATOM 751 CA CYS A 356 7.714 -6.857 -6.704 1.00 0.00 C ATOM 752 C CYS A 356 7.721 -8.334 -6.313 1.00 0.00 C ATOM 753 O CYS A 356 8.740 -8.995 -6.352 1.00 0.00 O ATOM 754 CB CYS A 356 7.855 -6.002 -5.442 1.00 0.00 C ATOM 755 SG CYS A 356 8.726 -4.463 -5.835 1.00 0.00 S ATOM 0 H CYS A 356 5.850 -5.840 -6.933 1.00 0.00 H new ATOM 0 HA CYS A 356 8.545 -6.644 -7.376 1.00 0.00 H new ATOM 0 HB2 CYS A 356 6.870 -5.778 -5.032 1.00 0.00 H new ATOM 0 HB3 CYS A 356 8.401 -6.554 -4.677 1.00 0.00 H new ATOM 760 N LEU A 357 6.589 -8.854 -5.928 1.00 0.00 N ATOM 761 CA LEU A 357 6.523 -10.285 -5.526 1.00 0.00 C ATOM 762 C LEU A 357 6.971 -11.166 -6.694 1.00 0.00 C ATOM 763 O LEU A 357 7.626 -12.173 -6.511 1.00 0.00 O ATOM 764 CB LEU A 357 5.084 -10.632 -5.139 1.00 0.00 C ATOM 765 CG LEU A 357 5.025 -12.059 -4.592 1.00 0.00 C ATOM 766 CD1 LEU A 357 5.737 -12.126 -3.238 1.00 0.00 C ATOM 767 CD2 LEU A 357 3.562 -12.472 -4.416 1.00 0.00 C ATOM 0 H LEU A 357 5.705 -8.348 -5.875 1.00 0.00 H new ATOM 0 HA LEU A 357 7.181 -10.459 -4.675 1.00 0.00 H new ATOM 0 HB2 LEU A 357 4.720 -9.930 -4.389 1.00 0.00 H new ATOM 0 HB3 LEU A 357 4.431 -10.538 -6.007 1.00 0.00 H new ATOM 0 HG LEU A 357 5.518 -12.734 -5.291 1.00 0.00 H new ATOM 0 HD11 LEU A 357 5.692 -13.145 -2.853 1.00 0.00 H new ATOM 0 HD12 LEU A 357 6.779 -11.830 -3.360 1.00 0.00 H new ATOM 0 HD13 LEU A 357 5.248 -11.451 -2.536 1.00 0.00 H new ATOM 0 HD21 LEU A 357 3.515 -13.489 -4.026 1.00 0.00 H new ATOM 0 HD22 LEU A 357 3.074 -11.793 -3.717 1.00 0.00 H new ATOM 0 HD23 LEU A 357 3.053 -12.429 -5.379 1.00 0.00 H new ATOM 779 N ALA A 358 6.623 -10.793 -7.894 1.00 0.00 N ATOM 780 CA ALA A 358 7.027 -11.604 -9.076 1.00 0.00 C ATOM 781 C ALA A 358 8.551 -11.602 -9.206 1.00 0.00 C ATOM 782 O ALA A 358 9.146 -12.555 -9.668 1.00 0.00 O ATOM 783 CB ALA A 358 6.406 -11.007 -10.341 1.00 0.00 C ATOM 0 H ALA A 358 6.075 -9.960 -8.107 1.00 0.00 H new ATOM 0 HA ALA A 358 6.677 -12.628 -8.947 1.00 0.00 H new ATOM 0 HB1 ALA A 358 6.702 -11.600 -11.206 1.00 0.00 H new ATOM 0 HB2 ALA A 358 5.320 -11.013 -10.251 1.00 0.00 H new ATOM 0 HB3 ALA A 358 6.754 -9.982 -10.468 1.00 0.00 H new ATOM 789 N GLN A 359 9.189 -10.536 -8.805 1.00 0.00 N ATOM 790 CA GLN A 359 10.675 -10.472 -8.911 1.00 0.00 C ATOM 791 C GLN A 359 11.295 -11.620 -8.113 1.00 0.00 C ATOM 792 O GLN A 359 12.309 -12.174 -8.490 1.00 0.00 O ATOM 793 CB GLN A 359 11.170 -9.136 -8.351 1.00 0.00 C ATOM 794 CG GLN A 359 10.643 -7.992 -9.219 1.00 0.00 C ATOM 795 CD GLN A 359 11.097 -6.654 -8.631 1.00 0.00 C ATOM 796 OE1 GLN A 359 11.508 -6.588 -7.489 1.00 0.00 O ATOM 797 NE2 GLN A 359 11.040 -5.578 -9.368 1.00 0.00 N ATOM 0 H GLN A 359 8.746 -9.707 -8.409 1.00 0.00 H new ATOM 0 HA GLN A 359 10.967 -10.558 -9.957 1.00 0.00 H new ATOM 0 HB2 GLN A 359 10.830 -9.012 -7.323 1.00 0.00 H new ATOM 0 HB3 GLN A 359 12.260 -9.119 -8.331 1.00 0.00 H new ATOM 0 HG2 GLN A 359 11.011 -8.096 -10.240 1.00 0.00 H new ATOM 0 HG3 GLN A 359 9.555 -8.030 -9.267 1.00 0.00 H new ATOM 0 HE21 GLN A 359 10.695 -5.634 -10.326 1.00 0.00 H new ATOM 0 HE22 GLN A 359 11.340 -4.681 -8.986 1.00 0.00 H new ATOM 806 N GLU A 360 10.696 -11.982 -7.012 1.00 0.00 N ATOM 807 CA GLU A 360 11.253 -13.093 -6.192 1.00 0.00 C ATOM 808 C GLU A 360 10.741 -14.430 -6.730 1.00 0.00 C ATOM 809 O GLU A 360 11.307 -14.912 -7.698 1.00 0.00 O ATOM 810 CB GLU A 360 10.811 -12.925 -4.737 1.00 0.00 C ATOM 811 CG GLU A 360 11.500 -13.981 -3.869 1.00 0.00 C ATOM 812 CD GLU A 360 10.983 -13.878 -2.433 1.00 0.00 C ATOM 813 OE1 GLU A 360 10.128 -13.044 -2.190 1.00 0.00 O ATOM 814 OE2 GLU A 360 11.452 -14.638 -1.601 1.00 0.00 O ATOM 815 OXT GLU A 360 9.792 -14.949 -6.166 1.00 0.00 O ATOM 0 H GLU A 360 9.845 -11.556 -6.645 1.00 0.00 H new ATOM 0 HA GLU A 360 12.342 -13.073 -6.245 1.00 0.00 H new ATOM 0 HB2 GLU A 360 11.064 -11.926 -4.382 1.00 0.00 H new ATOM 0 HB3 GLU A 360 9.728 -13.026 -4.661 1.00 0.00 H new ATOM 0 HG2 GLU A 360 11.305 -14.977 -4.266 1.00 0.00 H new ATOM 0 HG3 GLU A 360 12.580 -13.835 -3.889 1.00 0.00 H new TER 822 GLU A 360 HETATM 823 ZN ZN A 401 -5.410 3.770 -2.866 1.00 0.00 ZN HETATM 824 ZN ZN A 402 7.278 -2.790 -5.224 1.00 0.00 ZN