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= -0.215 X(o=-0.22,f=0) USER MOD Single : A 333 SER OG : rot 178:sc= 0.125 USER MOD Single : A 334 TYR OH : rot 30:sc= -0.312 USER MOD Single : A 336 THR OG1 : rot 179:sc= -0.943! USER MOD Single : A 344 HIS : no HD1:sc= -0.601 K(o=-0.6,f=0) USER MOD Single : A 348 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0155) USER MOD Single : A 355 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 359 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 306 -1.790 15.164 -0.590 1.00 0.00 N ATOM 2 CA ALA A 306 -0.419 15.547 -1.029 1.00 0.00 C ATOM 3 C ALA A 306 0.361 16.106 0.163 1.00 0.00 C ATOM 4 O ALA A 306 1.571 16.019 0.222 1.00 0.00 O ATOM 5 CB ALA A 306 -0.513 16.613 -2.122 1.00 0.00 C ATOM 0 HA ALA A 306 0.096 14.669 -1.420 1.00 0.00 H new ATOM 0 HB1 ALA A 306 0.490 16.894 -2.444 1.00 0.00 H new ATOM 0 HB2 ALA A 306 -1.068 16.215 -2.971 1.00 0.00 H new ATOM 0 HB3 ALA A 306 -1.028 17.491 -1.731 1.00 0.00 H new ATOM 13 N VAL A 307 -0.324 16.678 1.116 1.00 0.00 N ATOM 14 CA VAL A 307 0.379 17.241 2.303 1.00 0.00 C ATOM 15 C VAL A 307 1.132 16.123 3.027 1.00 0.00 C ATOM 16 O VAL A 307 2.231 16.312 3.508 1.00 0.00 O ATOM 17 CB VAL A 307 -0.645 17.865 3.253 1.00 0.00 C ATOM 18 CG1 VAL A 307 0.049 18.279 4.552 1.00 0.00 C ATOM 19 CG2 VAL A 307 -1.267 19.097 2.593 1.00 0.00 C ATOM 0 H VAL A 307 -1.339 16.779 1.124 1.00 0.00 H new ATOM 0 HA VAL A 307 1.086 18.004 1.979 1.00 0.00 H new ATOM 0 HB VAL A 307 -1.426 17.137 3.474 1.00 0.00 H new ATOM 0 HG11 VAL A 307 -0.681 18.724 5.229 1.00 0.00 H new ATOM 0 HG12 VAL A 307 0.493 17.402 5.023 1.00 0.00 H new ATOM 0 HG13 VAL A 307 0.830 19.007 4.331 1.00 0.00 H new ATOM 0 HG21 VAL A 307 -1.997 19.542 3.269 1.00 0.00 H new ATOM 0 HG22 VAL A 307 -0.486 19.824 2.372 1.00 0.00 H new ATOM 0 HG23 VAL A 307 -1.762 18.803 1.667 1.00 0.00 H new ATOM 29 N ASP A 308 0.549 14.958 3.108 1.00 0.00 N ATOM 30 CA ASP A 308 1.232 13.830 3.802 1.00 0.00 C ATOM 31 C ASP A 308 2.501 13.452 3.033 1.00 0.00 C ATOM 32 O ASP A 308 2.548 13.522 1.821 1.00 0.00 O ATOM 33 CB ASP A 308 0.293 12.623 3.862 1.00 0.00 C ATOM 34 CG ASP A 308 -0.897 12.948 4.767 1.00 0.00 C ATOM 35 OD1 ASP A 308 -0.832 13.950 5.461 1.00 0.00 O ATOM 36 OD2 ASP A 308 -1.851 12.189 4.753 1.00 0.00 O ATOM 0 H ASP A 308 -0.370 14.739 2.724 1.00 0.00 H new ATOM 0 HA ASP A 308 1.497 14.134 4.815 1.00 0.00 H new ATOM 0 HB2 ASP A 308 -0.056 12.370 2.861 1.00 0.00 H new ATOM 0 HB3 ASP A 308 0.826 11.752 4.243 1.00 0.00 H new ATOM 41 N LEU A 309 3.530 13.056 3.730 1.00 0.00 N ATOM 42 CA LEU A 309 4.797 12.679 3.041 1.00 0.00 C ATOM 43 C LEU A 309 4.528 11.536 2.060 1.00 0.00 C ATOM 44 O LEU A 309 5.111 11.474 0.995 1.00 0.00 O ATOM 45 CB LEU A 309 5.824 12.224 4.082 1.00 0.00 C ATOM 46 CG LEU A 309 6.042 13.337 5.109 1.00 0.00 C ATOM 47 CD1 LEU A 309 7.120 12.907 6.105 1.00 0.00 C ATOM 48 CD2 LEU A 309 6.495 14.612 4.393 1.00 0.00 C ATOM 0 H LEU A 309 3.549 12.977 4.747 1.00 0.00 H new ATOM 0 HA LEU A 309 5.184 13.540 2.496 1.00 0.00 H new ATOM 0 HB2 LEU A 309 5.476 11.319 4.580 1.00 0.00 H new ATOM 0 HB3 LEU A 309 6.766 11.976 3.594 1.00 0.00 H new ATOM 0 HG LEU A 309 5.109 13.528 5.639 1.00 0.00 H new ATOM 0 HD11 LEU A 309 7.276 13.699 6.837 1.00 0.00 H new ATOM 0 HD12 LEU A 309 6.802 11.998 6.616 1.00 0.00 H new ATOM 0 HD13 LEU A 309 8.052 12.716 5.573 1.00 0.00 H new ATOM 0 HD21 LEU A 309 6.650 15.405 5.125 1.00 0.00 H new ATOM 0 HD22 LEU A 309 7.428 14.420 3.863 1.00 0.00 H new ATOM 0 HD23 LEU A 309 5.730 14.921 3.681 1.00 0.00 H new ATOM 60 N TYR A 310 3.652 10.631 2.411 1.00 0.00 N ATOM 61 CA TYR A 310 3.346 9.489 1.504 1.00 0.00 C ATOM 62 C TYR A 310 1.865 9.509 1.120 1.00 0.00 C ATOM 63 O TYR A 310 0.998 9.695 1.952 1.00 0.00 O ATOM 64 CB TYR A 310 3.667 8.172 2.213 1.00 0.00 C ATOM 65 CG TYR A 310 4.858 7.522 1.549 1.00 0.00 C ATOM 66 CD1 TYR A 310 6.155 7.848 1.959 1.00 0.00 C ATOM 67 CD2 TYR A 310 4.661 6.593 0.520 1.00 0.00 C ATOM 68 CE1 TYR A 310 7.256 7.245 1.341 1.00 0.00 C ATOM 69 CE2 TYR A 310 5.763 5.989 -0.097 1.00 0.00 C ATOM 70 CZ TYR A 310 7.060 6.314 0.312 1.00 0.00 C ATOM 71 OH TYR A 310 8.146 5.719 -0.296 1.00 0.00 O ATOM 0 H TYR A 310 3.135 10.635 3.290 1.00 0.00 H new ATOM 0 HA TYR A 310 3.953 9.578 0.603 1.00 0.00 H new ATOM 0 HB2 TYR A 310 3.879 8.356 3.266 1.00 0.00 H new ATOM 0 HB3 TYR A 310 2.806 7.505 2.173 1.00 0.00 H new ATOM 0 HD1 TYR A 310 6.307 8.565 2.752 1.00 0.00 H new ATOM 0 HD2 TYR A 310 3.660 6.343 0.203 1.00 0.00 H new ATOM 0 HE1 TYR A 310 8.257 7.497 1.657 1.00 0.00 H new ATOM 0 HE2 TYR A 310 5.611 5.271 -0.890 1.00 0.00 H new ATOM 0 HH TYR A 310 7.834 5.098 -0.988 1.00 0.00 H new ATOM 81 N VAL A 311 1.572 9.310 -0.138 1.00 0.00 N ATOM 82 CA VAL A 311 0.152 9.305 -0.590 1.00 0.00 C ATOM 83 C VAL A 311 -0.102 8.042 -1.416 1.00 0.00 C ATOM 84 O VAL A 311 0.819 7.411 -1.897 1.00 0.00 O ATOM 85 CB VAL A 311 -0.119 10.542 -1.449 1.00 0.00 C ATOM 86 CG1 VAL A 311 0.264 11.800 -0.668 1.00 0.00 C ATOM 87 CG2 VAL A 311 0.710 10.466 -2.732 1.00 0.00 C ATOM 0 H VAL A 311 2.259 9.150 -0.874 1.00 0.00 H new ATOM 0 HA VAL A 311 -0.510 9.320 0.276 1.00 0.00 H new ATOM 0 HB VAL A 311 -1.178 10.581 -1.704 1.00 0.00 H new ATOM 0 HG11 VAL A 311 0.071 12.681 -1.280 1.00 0.00 H new ATOM 0 HG12 VAL A 311 -0.328 11.856 0.245 1.00 0.00 H new ATOM 0 HG13 VAL A 311 1.323 11.761 -0.412 1.00 0.00 H new ATOM 0 HG21 VAL A 311 0.516 11.348 -3.343 1.00 0.00 H new ATOM 0 HG22 VAL A 311 1.769 10.426 -2.479 1.00 0.00 H new ATOM 0 HG23 VAL A 311 0.436 9.570 -3.290 1.00 0.00 H new ATOM 97 N CYS A 312 -1.337 7.661 -1.580 1.00 0.00 N ATOM 98 CA CYS A 312 -1.636 6.434 -2.371 1.00 0.00 C ATOM 99 C CYS A 312 -1.490 6.741 -3.862 1.00 0.00 C ATOM 100 O CYS A 312 -2.179 7.577 -4.403 1.00 0.00 O ATOM 101 CB CYS A 312 -3.068 5.981 -2.082 1.00 0.00 C ATOM 102 SG CYS A 312 -3.531 4.660 -3.227 1.00 0.00 S ATOM 0 H CYS A 312 -2.152 8.144 -1.202 1.00 0.00 H new ATOM 0 HA CYS A 312 -0.940 5.642 -2.093 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -3.148 5.629 -1.054 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -3.754 6.822 -2.185 1.00 0.00 H new ATOM 107 N LEU A 313 -0.591 6.076 -4.529 1.00 0.00 N ATOM 108 CA LEU A 313 -0.401 6.339 -5.983 1.00 0.00 C ATOM 109 C LEU A 313 -1.702 6.046 -6.735 1.00 0.00 C ATOM 110 O LEU A 313 -2.059 6.737 -7.669 1.00 0.00 O ATOM 111 CB LEU A 313 0.714 5.438 -6.519 1.00 0.00 C ATOM 112 CG LEU A 313 1.006 5.797 -7.977 1.00 0.00 C ATOM 113 CD1 LEU A 313 1.637 7.190 -8.053 1.00 0.00 C ATOM 114 CD2 LEU A 313 1.973 4.768 -8.567 1.00 0.00 C ATOM 0 H LEU A 313 0.020 5.362 -4.132 1.00 0.00 H new ATOM 0 HA LEU A 313 -0.129 7.384 -6.130 1.00 0.00 H new ATOM 0 HB2 LEU A 313 1.614 5.559 -5.917 1.00 0.00 H new ATOM 0 HB3 LEU A 313 0.418 4.392 -6.444 1.00 0.00 H new ATOM 0 HG LEU A 313 0.074 5.794 -8.543 1.00 0.00 H new ATOM 0 HD11 LEU A 313 1.843 7.440 -9.094 1.00 0.00 H new ATOM 0 HD12 LEU A 313 0.950 7.924 -7.632 1.00 0.00 H new ATOM 0 HD13 LEU A 313 2.568 7.199 -7.487 1.00 0.00 H new ATOM 0 HD21 LEU A 313 2.184 5.021 -9.606 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.902 4.773 -7.997 1.00 0.00 H new ATOM 0 HD23 LEU A 313 1.523 3.776 -8.519 1.00 0.00 H new ATOM 126 N LEU A 314 -2.408 5.020 -6.345 1.00 0.00 N ATOM 127 CA LEU A 314 -3.677 4.673 -7.043 1.00 0.00 C ATOM 128 C LEU A 314 -4.707 5.794 -6.874 1.00 0.00 C ATOM 129 O LEU A 314 -5.451 6.101 -7.783 1.00 0.00 O ATOM 130 CB LEU A 314 -4.233 3.378 -6.448 1.00 0.00 C ATOM 131 CG LEU A 314 -3.195 2.262 -6.586 1.00 0.00 C ATOM 132 CD1 LEU A 314 -3.772 0.959 -6.031 1.00 0.00 C ATOM 133 CD2 LEU A 314 -2.839 2.072 -8.062 1.00 0.00 C ATOM 0 H LEU A 314 -2.159 4.405 -5.570 1.00 0.00 H new ATOM 0 HA LEU A 314 -3.475 4.543 -8.106 1.00 0.00 H new ATOM 0 HB2 LEU A 314 -4.484 3.527 -5.398 1.00 0.00 H new ATOM 0 HB3 LEU A 314 -5.154 3.097 -6.959 1.00 0.00 H new ATOM 0 HG LEU A 314 -2.298 2.531 -6.028 1.00 0.00 H new ATOM 0 HD11 LEU A 314 -3.034 0.163 -6.129 1.00 0.00 H new ATOM 0 HD12 LEU A 314 -4.025 1.092 -4.979 1.00 0.00 H new ATOM 0 HD13 LEU A 314 -4.669 0.692 -6.589 1.00 0.00 H new ATOM 0 HD21 LEU A 314 -2.100 1.277 -8.159 1.00 0.00 H new ATOM 0 HD22 LEU A 314 -3.736 1.804 -8.621 1.00 0.00 H new ATOM 0 HD23 LEU A 314 -2.428 3.000 -8.459 1.00 0.00 H new ATOM 145 N CYS A 315 -4.761 6.402 -5.719 1.00 0.00 N ATOM 146 CA CYS A 315 -5.752 7.498 -5.493 1.00 0.00 C ATOM 147 C CYS A 315 -5.024 8.825 -5.277 1.00 0.00 C ATOM 148 O CYS A 315 -5.289 9.807 -5.943 1.00 0.00 O ATOM 149 CB CYS A 315 -6.590 7.181 -4.253 1.00 0.00 C ATOM 150 SG CYS A 315 -7.038 5.425 -4.245 1.00 0.00 S ATOM 0 H CYS A 315 -4.162 6.188 -4.921 1.00 0.00 H new ATOM 0 HA CYS A 315 -6.398 7.577 -6.367 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -6.029 7.426 -3.351 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -7.490 7.795 -4.245 1.00 0.00 H new ATOM 155 N GLY A 316 -4.113 8.861 -4.347 1.00 0.00 N ATOM 156 CA GLY A 316 -3.367 10.121 -4.076 1.00 0.00 C ATOM 157 C GLY A 316 -4.029 10.870 -2.919 1.00 0.00 C ATOM 158 O GLY A 316 -4.236 12.066 -2.978 1.00 0.00 O ATOM 0 H GLY A 316 -3.851 8.069 -3.760 1.00 0.00 H new ATOM 0 HA2 GLY A 316 -2.329 9.895 -3.830 1.00 0.00 H new ATOM 0 HA3 GLY A 316 -3.354 10.747 -4.968 1.00 0.00 H new ATOM 162 N SER A 317 -4.368 10.171 -1.869 1.00 0.00 N ATOM 163 CA SER A 317 -5.021 10.823 -0.706 1.00 0.00 C ATOM 164 C SER A 317 -4.080 10.788 0.502 1.00 0.00 C ATOM 165 O SER A 317 -3.292 9.877 0.664 1.00 0.00 O ATOM 166 CB SER A 317 -6.302 10.065 -0.372 1.00 0.00 C ATOM 167 OG SER A 317 -7.198 10.145 -1.473 1.00 0.00 O ATOM 0 H SER A 317 -4.217 9.167 -1.770 1.00 0.00 H new ATOM 0 HA SER A 317 -5.253 11.860 -0.949 1.00 0.00 H new ATOM 0 HB2 SER A 317 -6.074 9.023 -0.150 1.00 0.00 H new ATOM 0 HB3 SER A 317 -6.765 10.487 0.520 1.00 0.00 H new ATOM 0 HG SER A 317 -8.021 9.657 -1.261 1.00 0.00 H new ATOM 173 N GLY A 318 -4.156 11.778 1.350 1.00 0.00 N ATOM 174 CA GLY A 318 -3.268 11.813 2.548 1.00 0.00 C ATOM 175 C GLY A 318 -4.009 11.240 3.761 1.00 0.00 C ATOM 176 O GLY A 318 -3.506 10.384 4.456 1.00 0.00 O ATOM 0 H GLY A 318 -4.797 12.567 1.264 1.00 0.00 H new ATOM 0 HA2 GLY A 318 -2.363 11.236 2.358 1.00 0.00 H new ATOM 0 HA3 GLY A 318 -2.957 12.838 2.751 1.00 0.00 H new ATOM 180 N ASN A 319 -5.201 11.700 4.022 1.00 0.00 N ATOM 181 CA ASN A 319 -5.959 11.168 5.191 1.00 0.00 C ATOM 182 C ASN A 319 -5.994 9.642 5.122 1.00 0.00 C ATOM 183 O ASN A 319 -5.929 8.960 6.124 1.00 0.00 O ATOM 184 CB ASN A 319 -7.390 11.706 5.160 1.00 0.00 C ATOM 185 CG ASN A 319 -8.140 11.221 6.401 1.00 0.00 C ATOM 186 OD1 ASN A 319 -8.151 11.885 7.418 1.00 0.00 O ATOM 187 ND2 ASN A 319 -8.762 10.074 6.360 1.00 0.00 N ATOM 0 H ASN A 319 -5.682 12.418 3.480 1.00 0.00 H new ATOM 0 HA ASN A 319 -5.470 11.483 6.113 1.00 0.00 H new ATOM 0 HB2 ASN A 319 -7.380 12.796 5.130 1.00 0.00 H new ATOM 0 HB3 ASN A 319 -7.899 11.366 4.258 1.00 0.00 H new ATOM 0 HD21 ASN A 319 -9.259 9.734 7.183 1.00 0.00 H new ATOM 0 HD22 ASN A 319 -8.751 9.518 5.505 1.00 0.00 H new ATOM 194 N ASP A 320 -6.097 9.107 3.942 1.00 0.00 N ATOM 195 CA ASP A 320 -6.137 7.632 3.783 1.00 0.00 C ATOM 196 C ASP A 320 -4.801 7.034 4.231 1.00 0.00 C ATOM 197 O ASP A 320 -4.624 5.831 4.252 1.00 0.00 O ATOM 198 CB ASP A 320 -6.398 7.288 2.319 1.00 0.00 C ATOM 199 CG ASP A 320 -7.760 7.845 1.899 1.00 0.00 C ATOM 200 OD1 ASP A 320 -8.545 8.161 2.777 1.00 0.00 O ATOM 201 OD2 ASP A 320 -7.993 7.945 0.706 1.00 0.00 O ATOM 0 H ASP A 320 -6.156 9.635 3.071 1.00 0.00 H new ATOM 0 HA ASP A 320 -6.937 7.217 4.397 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -5.612 7.707 1.690 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -6.376 6.207 2.179 1.00 0.00 H new ATOM 206 N GLU A 321 -3.853 7.863 4.577 1.00 0.00 N ATOM 207 CA GLU A 321 -2.523 7.343 5.006 1.00 0.00 C ATOM 208 C GLU A 321 -2.710 6.271 6.081 1.00 0.00 C ATOM 209 O GLU A 321 -1.917 5.359 6.203 1.00 0.00 O ATOM 210 CB GLU A 321 -1.684 8.491 5.575 1.00 0.00 C ATOM 211 CG GLU A 321 -0.299 7.973 5.962 1.00 0.00 C ATOM 212 CD GLU A 321 0.506 9.101 6.611 1.00 0.00 C ATOM 213 OE1 GLU A 321 -0.039 10.183 6.755 1.00 0.00 O ATOM 214 OE2 GLU A 321 1.654 8.863 6.953 1.00 0.00 O ATOM 0 H GLU A 321 -3.943 8.879 4.581 1.00 0.00 H new ATOM 0 HA GLU A 321 -2.013 6.908 4.146 1.00 0.00 H new ATOM 0 HB2 GLU A 321 -1.592 9.288 4.837 1.00 0.00 H new ATOM 0 HB3 GLU A 321 -2.179 8.919 6.446 1.00 0.00 H new ATOM 0 HG2 GLU A 321 -0.393 7.135 6.653 1.00 0.00 H new ATOM 0 HG3 GLU A 321 0.222 7.602 5.079 1.00 0.00 H new ATOM 221 N ASP A 322 -3.752 6.364 6.857 1.00 0.00 N ATOM 222 CA ASP A 322 -3.982 5.341 7.912 1.00 0.00 C ATOM 223 C ASP A 322 -4.091 3.953 7.269 1.00 0.00 C ATOM 224 O ASP A 322 -3.635 2.968 7.815 1.00 0.00 O ATOM 225 CB ASP A 322 -5.281 5.665 8.651 1.00 0.00 C ATOM 226 CG ASP A 322 -5.107 6.962 9.442 1.00 0.00 C ATOM 227 OD1 ASP A 322 -3.981 7.414 9.563 1.00 0.00 O ATOM 228 OD2 ASP A 322 -6.105 7.482 9.915 1.00 0.00 O ATOM 0 H ASP A 322 -4.453 7.103 6.806 1.00 0.00 H new ATOM 0 HA ASP A 322 -3.148 5.347 8.614 1.00 0.00 H new ATOM 0 HB2 ASP A 322 -6.101 5.767 7.940 1.00 0.00 H new ATOM 0 HB3 ASP A 322 -5.543 4.848 9.324 1.00 0.00 H new ATOM 233 N ARG A 323 -4.696 3.869 6.114 1.00 0.00 N ATOM 234 CA ARG A 323 -4.843 2.549 5.435 1.00 0.00 C ATOM 235 C ARG A 323 -3.878 2.451 4.250 1.00 0.00 C ATOM 236 O ARG A 323 -3.960 1.539 3.452 1.00 0.00 O ATOM 237 CB ARG A 323 -6.278 2.391 4.922 1.00 0.00 C ATOM 238 CG ARG A 323 -7.267 2.424 6.093 1.00 0.00 C ATOM 239 CD ARG A 323 -7.253 1.079 6.825 1.00 0.00 C ATOM 240 NE ARG A 323 -8.383 1.033 7.795 1.00 0.00 N ATOM 241 CZ ARG A 323 -8.273 1.623 8.954 1.00 0.00 C ATOM 242 NH1 ARG A 323 -7.174 2.255 9.262 1.00 0.00 N ATOM 243 NH2 ARG A 323 -9.262 1.582 9.804 1.00 0.00 N ATOM 0 H ARG A 323 -5.096 4.661 5.610 1.00 0.00 H new ATOM 0 HA ARG A 323 -4.615 1.761 6.153 1.00 0.00 H new ATOM 0 HB2 ARG A 323 -6.510 3.190 4.218 1.00 0.00 H new ATOM 0 HB3 ARG A 323 -6.376 1.450 4.380 1.00 0.00 H new ATOM 0 HG2 ARG A 323 -7.002 3.226 6.782 1.00 0.00 H new ATOM 0 HG3 ARG A 323 -8.271 2.638 5.727 1.00 0.00 H new ATOM 0 HD2 ARG A 323 -7.340 0.262 6.109 1.00 0.00 H new ATOM 0 HD3 ARG A 323 -6.305 0.946 7.347 1.00 0.00 H new ATOM 0 HE ARG A 323 -9.243 0.540 7.553 1.00 0.00 H new ATOM 0 HH11 ARG A 323 -6.401 2.288 8.597 1.00 0.00 H new ATOM 0 HH12 ARG A 323 -7.088 2.716 10.168 1.00 0.00 H new ATOM 0 HH21 ARG A 323 -10.122 1.089 9.563 1.00 0.00 H new ATOM 0 HH22 ARG A 323 -9.176 2.043 10.710 1.00 0.00 H new ATOM 257 N LEU A 324 -2.967 3.376 4.121 1.00 0.00 N ATOM 258 CA LEU A 324 -2.014 3.314 2.978 1.00 0.00 C ATOM 259 C LEU A 324 -0.917 2.296 3.276 1.00 0.00 C ATOM 260 O LEU A 324 -0.219 2.385 4.266 1.00 0.00 O ATOM 261 CB LEU A 324 -1.395 4.697 2.758 1.00 0.00 C ATOM 262 CG LEU A 324 -0.411 4.653 1.587 1.00 0.00 C ATOM 263 CD1 LEU A 324 -0.507 5.961 0.798 1.00 0.00 C ATOM 264 CD2 LEU A 324 1.019 4.492 2.117 1.00 0.00 C ATOM 0 H LEU A 324 -2.842 4.167 4.753 1.00 0.00 H new ATOM 0 HA LEU A 324 -2.546 3.008 2.077 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -2.179 5.427 2.557 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -0.881 5.022 3.663 1.00 0.00 H new ATOM 0 HG LEU A 324 -0.657 3.810 0.942 1.00 0.00 H new ATOM 0 HD11 LEU A 324 0.193 5.934 -0.037 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -1.521 6.083 0.418 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -0.261 6.799 1.451 1.00 0.00 H new ATOM 0 HD21 LEU A 324 1.716 4.461 1.280 1.00 0.00 H new ATOM 0 HD22 LEU A 324 1.265 5.335 2.763 1.00 0.00 H new ATOM 0 HD23 LEU A 324 1.094 3.565 2.686 1.00 0.00 H new ATOM 276 N LEU A 325 -0.762 1.330 2.416 1.00 0.00 N ATOM 277 CA LEU A 325 0.286 0.298 2.628 1.00 0.00 C ATOM 278 C LEU A 325 1.439 0.574 1.661 1.00 0.00 C ATOM 279 O LEU A 325 1.253 0.628 0.462 1.00 0.00 O ATOM 280 CB LEU A 325 -0.315 -1.083 2.350 1.00 0.00 C ATOM 281 CG LEU A 325 0.641 -2.175 2.829 1.00 0.00 C ATOM 282 CD1 LEU A 325 0.783 -2.101 4.352 1.00 0.00 C ATOM 283 CD2 LEU A 325 0.076 -3.544 2.442 1.00 0.00 C ATOM 0 H LEU A 325 -1.320 1.211 1.571 1.00 0.00 H new ATOM 0 HA LEU A 325 0.655 0.327 3.653 1.00 0.00 H new ATOM 0 HB2 LEU A 325 -1.275 -1.180 2.858 1.00 0.00 H new ATOM 0 HB3 LEU A 325 -0.506 -1.198 1.283 1.00 0.00 H new ATOM 0 HG LEU A 325 1.617 -2.033 2.365 1.00 0.00 H new ATOM 0 HD11 LEU A 325 1.465 -2.880 4.692 1.00 0.00 H new ATOM 0 HD12 LEU A 325 1.178 -1.125 4.634 1.00 0.00 H new ATOM 0 HD13 LEU A 325 -0.193 -2.245 4.816 1.00 0.00 H new ATOM 0 HD21 LEU A 325 0.754 -4.327 2.781 1.00 0.00 H new ATOM 0 HD22 LEU A 325 -0.899 -3.681 2.910 1.00 0.00 H new ATOM 0 HD23 LEU A 325 -0.030 -3.601 1.359 1.00 0.00 H new ATOM 295 N LEU A 326 2.625 0.765 2.169 1.00 0.00 N ATOM 296 CA LEU A 326 3.777 1.054 1.278 1.00 0.00 C ATOM 297 C LEU A 326 4.509 -0.243 0.933 1.00 0.00 C ATOM 298 O LEU A 326 4.722 -1.091 1.777 1.00 0.00 O ATOM 299 CB LEU A 326 4.736 2.002 1.996 1.00 0.00 C ATOM 300 CG LEU A 326 5.191 1.369 3.310 1.00 0.00 C ATOM 301 CD1 LEU A 326 6.616 0.836 3.152 1.00 0.00 C ATOM 302 CD2 LEU A 326 5.161 2.422 4.419 1.00 0.00 C ATOM 0 H LEU A 326 2.844 0.733 3.165 1.00 0.00 H new ATOM 0 HA LEU A 326 3.417 1.514 0.358 1.00 0.00 H new ATOM 0 HB2 LEU A 326 5.598 2.212 1.363 1.00 0.00 H new ATOM 0 HB3 LEU A 326 4.244 2.955 2.190 1.00 0.00 H new ATOM 0 HG LEU A 326 4.523 0.548 3.569 1.00 0.00 H new ATOM 0 HD11 LEU A 326 6.941 0.384 4.089 1.00 0.00 H new ATOM 0 HD12 LEU A 326 6.639 0.087 2.361 1.00 0.00 H new ATOM 0 HD13 LEU A 326 7.285 1.657 2.893 1.00 0.00 H new ATOM 0 HD21 LEU A 326 5.485 1.972 5.357 1.00 0.00 H new ATOM 0 HD22 LEU A 326 5.830 3.243 4.160 1.00 0.00 H new ATOM 0 HD23 LEU A 326 4.146 2.803 4.531 1.00 0.00 H new ATOM 314 N CYS A 327 4.903 -0.401 -0.300 1.00 0.00 N ATOM 315 CA CYS A 327 5.629 -1.636 -0.696 1.00 0.00 C ATOM 316 C CYS A 327 7.132 -1.397 -0.568 1.00 0.00 C ATOM 317 O CYS A 327 7.711 -0.636 -1.316 1.00 0.00 O ATOM 318 CB CYS A 327 5.302 -1.986 -2.147 1.00 0.00 C ATOM 319 SG CYS A 327 6.455 -3.257 -2.719 1.00 0.00 S ATOM 0 H CYS A 327 4.753 0.274 -1.050 1.00 0.00 H new ATOM 0 HA CYS A 327 5.324 -2.457 -0.047 1.00 0.00 H new ATOM 0 HB2 CYS A 327 4.276 -2.345 -2.226 1.00 0.00 H new ATOM 0 HB3 CYS A 327 5.378 -1.098 -2.775 1.00 0.00 H new ATOM 324 N ASP A 328 7.766 -2.042 0.374 1.00 0.00 N ATOM 325 CA ASP A 328 9.234 -1.855 0.557 1.00 0.00 C ATOM 326 C ASP A 328 9.976 -2.294 -0.707 1.00 0.00 C ATOM 327 O ASP A 328 10.980 -1.720 -1.080 1.00 0.00 O ATOM 328 CB ASP A 328 9.711 -2.696 1.742 1.00 0.00 C ATOM 329 CG ASP A 328 9.102 -2.149 3.035 1.00 0.00 C ATOM 330 OD1 ASP A 328 8.567 -1.053 2.997 1.00 0.00 O ATOM 331 OD2 ASP A 328 9.180 -2.835 4.040 1.00 0.00 O ATOM 0 H ASP A 328 7.329 -2.692 1.027 1.00 0.00 H new ATOM 0 HA ASP A 328 9.439 -0.802 0.748 1.00 0.00 H new ATOM 0 HB2 ASP A 328 9.420 -3.737 1.603 1.00 0.00 H new ATOM 0 HB3 ASP A 328 10.799 -2.674 1.802 1.00 0.00 H new ATOM 336 N GLY A 329 9.495 -3.311 -1.367 1.00 0.00 N ATOM 337 CA GLY A 329 10.180 -3.790 -2.601 1.00 0.00 C ATOM 338 C GLY A 329 10.400 -2.614 -3.554 1.00 0.00 C ATOM 339 O GLY A 329 11.392 -2.545 -4.251 1.00 0.00 O ATOM 0 H GLY A 329 8.657 -3.831 -1.106 1.00 0.00 H new ATOM 0 HA2 GLY A 329 11.136 -4.247 -2.345 1.00 0.00 H new ATOM 0 HA3 GLY A 329 9.579 -4.558 -3.088 1.00 0.00 H new ATOM 343 N CYS A 330 9.484 -1.689 -3.585 1.00 0.00 N ATOM 344 CA CYS A 330 9.643 -0.515 -4.490 1.00 0.00 C ATOM 345 C CYS A 330 8.956 0.706 -3.871 1.00 0.00 C ATOM 346 O CYS A 330 8.820 0.811 -2.670 1.00 0.00 O ATOM 347 CB CYS A 330 9.012 -0.825 -5.850 1.00 0.00 C ATOM 348 SG CYS A 330 7.226 -1.052 -5.656 1.00 0.00 S ATOM 0 H CYS A 330 8.632 -1.693 -3.024 1.00 0.00 H new ATOM 0 HA CYS A 330 10.704 -0.304 -4.625 1.00 0.00 H new ATOM 0 HB2 CYS A 330 9.211 -0.012 -6.548 1.00 0.00 H new ATOM 0 HB3 CYS A 330 9.459 -1.725 -6.273 1.00 0.00 H new ATOM 353 N ASP A 331 8.531 1.632 -4.682 1.00 0.00 N ATOM 354 CA ASP A 331 7.855 2.847 -4.149 1.00 0.00 C ATOM 355 C ASP A 331 6.350 2.746 -4.408 1.00 0.00 C ATOM 356 O ASP A 331 5.654 3.740 -4.470 1.00 0.00 O ATOM 357 CB ASP A 331 8.411 4.089 -4.848 1.00 0.00 C ATOM 358 CG ASP A 331 9.880 4.277 -4.465 1.00 0.00 C ATOM 359 OD1 ASP A 331 10.316 3.625 -3.530 1.00 0.00 O ATOM 360 OD2 ASP A 331 10.543 5.070 -5.112 1.00 0.00 O ATOM 0 H ASP A 331 8.623 1.600 -5.697 1.00 0.00 H new ATOM 0 HA ASP A 331 8.036 2.923 -3.077 1.00 0.00 H new ATOM 0 HB2 ASP A 331 8.317 3.984 -5.929 1.00 0.00 H new ATOM 0 HB3 ASP A 331 7.834 4.969 -4.562 1.00 0.00 H new ATOM 365 N ASP A 332 5.845 1.555 -4.581 1.00 0.00 N ATOM 366 CA ASP A 332 4.388 1.397 -4.862 1.00 0.00 C ATOM 367 C ASP A 332 3.577 1.528 -3.569 1.00 0.00 C ATOM 368 O ASP A 332 3.765 0.784 -2.627 1.00 0.00 O ATOM 369 CB ASP A 332 4.136 0.021 -5.482 1.00 0.00 C ATOM 370 CG ASP A 332 2.668 -0.089 -5.902 1.00 0.00 C ATOM 371 OD1 ASP A 332 1.967 0.902 -5.795 1.00 0.00 O ATOM 372 OD2 ASP A 332 2.273 -1.164 -6.324 1.00 0.00 O ATOM 0 H ASP A 332 6.377 0.685 -4.540 1.00 0.00 H new ATOM 0 HA ASP A 332 4.076 2.179 -5.555 1.00 0.00 H new ATOM 0 HB2 ASP A 332 4.784 -0.125 -6.346 1.00 0.00 H new ATOM 0 HB3 ASP A 332 4.380 -0.763 -4.765 1.00 0.00 H new ATOM 377 N SER A 333 2.666 2.467 -3.528 1.00 0.00 N ATOM 378 CA SER A 333 1.824 2.652 -2.310 1.00 0.00 C ATOM 379 C SER A 333 0.351 2.468 -2.684 1.00 0.00 C ATOM 380 O SER A 333 -0.095 2.915 -3.722 1.00 0.00 O ATOM 381 CB SER A 333 2.035 4.062 -1.758 1.00 0.00 C ATOM 382 OG SER A 333 3.406 4.235 -1.422 1.00 0.00 O ATOM 0 H SER A 333 2.469 3.116 -4.290 1.00 0.00 H new ATOM 0 HA SER A 333 2.105 1.919 -1.554 1.00 0.00 H new ATOM 0 HB2 SER A 333 1.734 4.803 -2.498 1.00 0.00 H new ATOM 0 HB3 SER A 333 1.411 4.218 -0.878 1.00 0.00 H new ATOM 0 HG SER A 333 3.550 5.147 -1.094 1.00 0.00 H new ATOM 388 N TYR A 334 -0.408 1.811 -1.848 1.00 0.00 N ATOM 389 CA TYR A 334 -1.850 1.595 -2.160 1.00 0.00 C ATOM 390 C TYR A 334 -2.644 1.405 -0.867 1.00 0.00 C ATOM 391 O TYR A 334 -2.101 1.050 0.160 1.00 0.00 O ATOM 392 CB TYR A 334 -2.000 0.356 -3.040 1.00 0.00 C ATOM 393 CG TYR A 334 -1.220 -0.783 -2.435 1.00 0.00 C ATOM 394 CD1 TYR A 334 0.171 -0.816 -2.568 1.00 0.00 C ATOM 395 CD2 TYR A 334 -1.883 -1.806 -1.748 1.00 0.00 C ATOM 396 CE1 TYR A 334 0.903 -1.872 -2.013 1.00 0.00 C ATOM 397 CE2 TYR A 334 -1.152 -2.863 -1.192 1.00 0.00 C ATOM 398 CZ TYR A 334 0.242 -2.897 -1.325 1.00 0.00 C ATOM 399 OH TYR A 334 0.963 -3.938 -0.778 1.00 0.00 O ATOM 0 H TYR A 334 -0.092 1.415 -0.963 1.00 0.00 H new ATOM 0 HA TYR A 334 -2.236 2.467 -2.688 1.00 0.00 H new ATOM 0 HB2 TYR A 334 -3.052 0.085 -3.129 1.00 0.00 H new ATOM 0 HB3 TYR A 334 -1.638 0.565 -4.047 1.00 0.00 H new ATOM 0 HD1 TYR A 334 0.681 -0.026 -3.099 1.00 0.00 H new ATOM 0 HD2 TYR A 334 -2.958 -1.780 -1.647 1.00 0.00 H new ATOM 0 HE1 TYR A 334 1.978 -1.896 -2.115 1.00 0.00 H new ATOM 0 HE2 TYR A 334 -1.663 -3.652 -0.661 1.00 0.00 H new ATOM 0 HH TYR A 334 1.855 -3.621 -0.526 1.00 0.00 H new ATOM 409 N HIS A 335 -3.930 1.630 -0.910 1.00 0.00 N ATOM 410 CA HIS A 335 -4.757 1.452 0.315 1.00 0.00 C ATOM 411 C HIS A 335 -5.127 -0.022 0.460 1.00 0.00 C ATOM 412 O HIS A 335 -5.110 -0.775 -0.494 1.00 0.00 O ATOM 413 CB HIS A 335 -6.034 2.287 0.217 1.00 0.00 C ATOM 414 CG HIS A 335 -5.680 3.745 0.141 1.00 0.00 C ATOM 415 ND1 HIS A 335 -6.119 4.565 -0.892 1.00 0.00 N ATOM 416 CD2 HIS A 335 -4.934 4.549 0.967 1.00 0.00 C ATOM 417 CE1 HIS A 335 -5.637 5.800 -0.657 1.00 0.00 C ATOM 418 NE2 HIS A 335 -4.909 5.841 0.458 1.00 0.00 N ATOM 0 H HIS A 335 -4.442 1.929 -1.740 1.00 0.00 H new ATOM 0 HA HIS A 335 -4.185 1.780 1.183 1.00 0.00 H new ATOM 0 HB2 HIS A 335 -6.604 1.995 -0.665 1.00 0.00 H new ATOM 0 HB3 HIS A 335 -6.669 2.102 1.083 1.00 0.00 H new ATOM 0 HD2 HIS A 335 -4.442 4.226 1.873 1.00 0.00 H new ATOM 0 HE1 HIS A 335 -5.818 6.653 -1.294 1.00 0.00 H new ATOM 0 HE2 HIS A 335 -4.433 6.651 0.855 1.00 0.00 H new ATOM 426 N THR A 336 -5.449 -0.441 1.648 1.00 0.00 N ATOM 427 CA THR A 336 -5.807 -1.865 1.869 1.00 0.00 C ATOM 428 C THR A 336 -7.136 -2.198 1.185 1.00 0.00 C ATOM 429 O THR A 336 -7.437 -3.349 0.943 1.00 0.00 O ATOM 430 CB THR A 336 -5.938 -2.109 3.373 1.00 0.00 C ATOM 431 OG1 THR A 336 -7.013 -1.334 3.884 1.00 0.00 O ATOM 432 CG2 THR A 336 -4.638 -1.707 4.072 1.00 0.00 C ATOM 0 H THR A 336 -5.480 0.146 2.481 1.00 0.00 H new ATOM 0 HA THR A 336 -5.029 -2.500 1.445 1.00 0.00 H new ATOM 0 HB THR A 336 -6.133 -3.166 3.555 1.00 0.00 H new ATOM 0 HG1 THR A 336 -7.106 -1.498 4.846 1.00 0.00 H new ATOM 0 HG21 THR A 336 -4.732 -1.881 5.144 1.00 0.00 H new ATOM 0 HG22 THR A 336 -3.814 -2.303 3.679 1.00 0.00 H new ATOM 0 HG23 THR A 336 -4.440 -0.650 3.892 1.00 0.00 H new ATOM 440 N PHE A 337 -7.943 -1.210 0.890 1.00 0.00 N ATOM 441 CA PHE A 337 -9.263 -1.489 0.248 1.00 0.00 C ATOM 442 C PHE A 337 -9.330 -0.930 -1.179 1.00 0.00 C ATOM 443 O PHE A 337 -10.341 -1.057 -1.840 1.00 0.00 O ATOM 444 CB PHE A 337 -10.368 -0.845 1.085 1.00 0.00 C ATOM 445 CG PHE A 337 -10.101 0.634 1.203 1.00 0.00 C ATOM 446 CD1 PHE A 337 -10.611 1.516 0.245 1.00 0.00 C ATOM 447 CD2 PHE A 337 -9.340 1.124 2.271 1.00 0.00 C ATOM 448 CE1 PHE A 337 -10.360 2.888 0.352 1.00 0.00 C ATOM 449 CE2 PHE A 337 -9.090 2.496 2.380 1.00 0.00 C ATOM 450 CZ PHE A 337 -9.600 3.378 1.420 1.00 0.00 C ATOM 0 H PHE A 337 -7.745 -0.225 1.066 1.00 0.00 H new ATOM 0 HA PHE A 337 -9.393 -2.570 0.196 1.00 0.00 H new ATOM 0 HB2 PHE A 337 -11.339 -1.016 0.620 1.00 0.00 H new ATOM 0 HB3 PHE A 337 -10.404 -1.301 2.075 1.00 0.00 H new ATOM 0 HD1 PHE A 337 -11.199 1.138 -0.578 1.00 0.00 H new ATOM 0 HD2 PHE A 337 -8.946 0.443 3.011 1.00 0.00 H new ATOM 0 HE1 PHE A 337 -10.752 3.569 -0.389 1.00 0.00 H new ATOM 0 HE2 PHE A 337 -8.504 2.875 3.204 1.00 0.00 H new ATOM 0 HZ PHE A 337 -9.407 4.437 1.504 1.00 0.00 H new ATOM 460 N CYS A 338 -8.280 -0.319 -1.667 1.00 0.00 N ATOM 461 CA CYS A 338 -8.325 0.232 -3.060 1.00 0.00 C ATOM 462 C CYS A 338 -7.350 -0.540 -3.946 1.00 0.00 C ATOM 463 O CYS A 338 -6.802 -0.014 -4.894 1.00 0.00 O ATOM 464 CB CYS A 338 -7.964 1.722 -3.053 1.00 0.00 C ATOM 465 SG CYS A 338 -6.175 1.935 -3.231 1.00 0.00 S ATOM 0 H CYS A 338 -7.401 -0.178 -1.169 1.00 0.00 H new ATOM 0 HA CYS A 338 -9.335 0.122 -3.455 1.00 0.00 H new ATOM 0 HB2 CYS A 338 -8.481 2.232 -3.866 1.00 0.00 H new ATOM 0 HB3 CYS A 338 -8.301 2.181 -2.123 1.00 0.00 H new ATOM 470 N LEU A 339 -7.141 -1.791 -3.646 1.00 0.00 N ATOM 471 CA LEU A 339 -6.212 -2.617 -4.467 1.00 0.00 C ATOM 472 C LEU A 339 -6.257 -4.063 -3.976 1.00 0.00 C ATOM 473 O LEU A 339 -6.354 -4.994 -4.752 1.00 0.00 O ATOM 474 CB LEU A 339 -4.785 -2.081 -4.334 1.00 0.00 C ATOM 475 CG LEU A 339 -3.861 -2.835 -5.297 1.00 0.00 C ATOM 476 CD1 LEU A 339 -4.127 -2.387 -6.738 1.00 0.00 C ATOM 477 CD2 LEU A 339 -2.403 -2.539 -4.936 1.00 0.00 C ATOM 0 H LEU A 339 -7.576 -2.280 -2.863 1.00 0.00 H new ATOM 0 HA LEU A 339 -6.517 -2.572 -5.513 1.00 0.00 H new ATOM 0 HB2 LEU A 339 -4.764 -1.014 -4.555 1.00 0.00 H new ATOM 0 HB3 LEU A 339 -4.435 -2.201 -3.309 1.00 0.00 H new ATOM 0 HG LEU A 339 -4.054 -3.905 -5.213 1.00 0.00 H new ATOM 0 HD11 LEU A 339 -3.466 -2.928 -7.415 1.00 0.00 H new ATOM 0 HD12 LEU A 339 -5.164 -2.597 -6.999 1.00 0.00 H new ATOM 0 HD13 LEU A 339 -3.940 -1.317 -6.827 1.00 0.00 H new ATOM 0 HD21 LEU A 339 -1.743 -3.074 -5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 339 -2.218 -1.468 -5.017 1.00 0.00 H new ATOM 0 HD23 LEU A 339 -2.208 -2.864 -3.914 1.00 0.00 H new ATOM 489 N ILE A 340 -6.181 -4.254 -2.690 1.00 0.00 N ATOM 490 CA ILE A 340 -6.207 -5.625 -2.126 1.00 0.00 C ATOM 491 C ILE A 340 -7.511 -5.834 -1.345 1.00 0.00 C ATOM 492 O ILE A 340 -8.043 -4.908 -0.768 1.00 0.00 O ATOM 493 CB ILE A 340 -5.009 -5.779 -1.194 1.00 0.00 C ATOM 494 CG1 ILE A 340 -5.222 -4.920 0.053 1.00 0.00 C ATOM 495 CG2 ILE A 340 -3.741 -5.317 -1.916 1.00 0.00 C ATOM 496 CD1 ILE A 340 -3.938 -4.900 0.885 1.00 0.00 C ATOM 0 H ILE A 340 -6.101 -3.507 -2.000 1.00 0.00 H new ATOM 0 HA ILE A 340 -6.156 -6.366 -2.923 1.00 0.00 H new ATOM 0 HB ILE A 340 -4.905 -6.825 -0.904 1.00 0.00 H new ATOM 0 HG12 ILE A 340 -5.498 -3.905 -0.234 1.00 0.00 H new ATOM 0 HG13 ILE A 340 -6.046 -5.318 0.646 1.00 0.00 H new ATOM 0 HG21 ILE A 340 -2.884 -5.426 -1.252 1.00 0.00 H new ATOM 0 HG22 ILE A 340 -3.588 -5.924 -2.808 1.00 0.00 H new ATOM 0 HG23 ILE A 340 -3.846 -4.271 -2.203 1.00 0.00 H new ATOM 0 HD11 ILE A 340 -4.090 -4.288 1.774 1.00 0.00 H new ATOM 0 HD12 ILE A 340 -3.682 -5.917 1.184 1.00 0.00 H new ATOM 0 HD13 ILE A 340 -3.126 -4.482 0.291 1.00 0.00 H new ATOM 508 N PRO A 341 -8.022 -7.045 -1.318 1.00 0.00 N ATOM 509 CA PRO A 341 -9.275 -7.356 -0.585 1.00 0.00 C ATOM 510 C PRO A 341 -9.278 -6.774 0.838 1.00 0.00 C ATOM 511 O PRO A 341 -10.219 -6.111 1.225 1.00 0.00 O ATOM 512 CB PRO A 341 -9.357 -8.888 -0.551 1.00 0.00 C ATOM 513 CG PRO A 341 -8.186 -9.415 -1.328 1.00 0.00 C ATOM 514 CD PRO A 341 -7.464 -8.232 -1.977 1.00 0.00 C ATOM 0 HA PRO A 341 -10.136 -6.908 -1.081 1.00 0.00 H new ATOM 0 HB2 PRO A 341 -9.331 -9.251 0.476 1.00 0.00 H new ATOM 0 HB3 PRO A 341 -10.294 -9.232 -0.988 1.00 0.00 H new ATOM 0 HG2 PRO A 341 -7.508 -9.958 -0.670 1.00 0.00 H new ATOM 0 HG3 PRO A 341 -8.522 -10.118 -2.090 1.00 0.00 H new ATOM 0 HD2 PRO A 341 -6.386 -8.297 -1.829 1.00 0.00 H new ATOM 0 HD3 PRO A 341 -7.637 -8.205 -3.053 1.00 0.00 H new ATOM 522 N PRO A 342 -8.238 -7.001 1.615 1.00 0.00 N ATOM 523 CA PRO A 342 -8.146 -6.466 2.997 1.00 0.00 C ATOM 524 C PRO A 342 -8.811 -5.093 3.146 1.00 0.00 C ATOM 525 O PRO A 342 -9.046 -4.397 2.181 1.00 0.00 O ATOM 526 CB PRO A 342 -6.642 -6.361 3.224 1.00 0.00 C ATOM 527 CG PRO A 342 -6.039 -7.454 2.402 1.00 0.00 C ATOM 528 CD PRO A 342 -7.037 -7.796 1.288 1.00 0.00 C ATOM 0 HA PRO A 342 -8.662 -7.101 3.717 1.00 0.00 H new ATOM 0 HB2 PRO A 342 -6.266 -5.385 2.917 1.00 0.00 H new ATOM 0 HB3 PRO A 342 -6.395 -6.481 4.279 1.00 0.00 H new ATOM 0 HG2 PRO A 342 -5.086 -7.135 1.979 1.00 0.00 H new ATOM 0 HG3 PRO A 342 -5.837 -8.330 3.018 1.00 0.00 H new ATOM 0 HD2 PRO A 342 -6.642 -7.534 0.306 1.00 0.00 H new ATOM 0 HD3 PRO A 342 -7.260 -8.863 1.268 1.00 0.00 H new ATOM 536 N LEU A 343 -9.115 -4.704 4.355 1.00 0.00 N ATOM 537 CA LEU A 343 -9.764 -3.383 4.584 1.00 0.00 C ATOM 538 C LEU A 343 -8.957 -2.591 5.612 1.00 0.00 C ATOM 539 O LEU A 343 -8.837 -1.385 5.527 1.00 0.00 O ATOM 540 CB LEU A 343 -11.181 -3.596 5.118 1.00 0.00 C ATOM 541 CG LEU A 343 -11.980 -4.463 4.142 1.00 0.00 C ATOM 542 CD1 LEU A 343 -13.383 -4.701 4.701 1.00 0.00 C ATOM 543 CD2 LEU A 343 -12.089 -3.747 2.794 1.00 0.00 C ATOM 0 H LEU A 343 -8.940 -5.249 5.199 1.00 0.00 H new ATOM 0 HA LEU A 343 -9.804 -2.833 3.644 1.00 0.00 H new ATOM 0 HB2 LEU A 343 -11.142 -4.075 6.096 1.00 0.00 H new ATOM 0 HB3 LEU A 343 -11.676 -2.635 5.254 1.00 0.00 H new ATOM 0 HG LEU A 343 -11.472 -5.418 4.009 1.00 0.00 H new ATOM 0 HD11 LEU A 343 -13.952 -5.318 4.006 1.00 0.00 H new ATOM 0 HD12 LEU A 343 -13.310 -5.210 5.662 1.00 0.00 H new ATOM 0 HD13 LEU A 343 -13.889 -3.745 4.834 1.00 0.00 H new ATOM 0 HD21 LEU A 343 -12.658 -4.364 2.099 1.00 0.00 H new ATOM 0 HD22 LEU A 343 -12.596 -2.792 2.929 1.00 0.00 H new ATOM 0 HD23 LEU A 343 -11.091 -3.574 2.392 1.00 0.00 H new ATOM 555 N HIS A 344 -8.407 -3.266 6.584 1.00 0.00 N ATOM 556 CA HIS A 344 -7.610 -2.565 7.629 1.00 0.00 C ATOM 557 C HIS A 344 -6.141 -2.963 7.492 1.00 0.00 C ATOM 558 O HIS A 344 -5.823 -4.059 7.075 1.00 0.00 O ATOM 559 CB HIS A 344 -8.121 -2.964 9.015 1.00 0.00 C ATOM 560 CG HIS A 344 -9.545 -2.509 9.172 1.00 0.00 C ATOM 561 ND1 HIS A 344 -10.340 -2.914 10.235 1.00 0.00 N ATOM 562 CD2 HIS A 344 -10.335 -1.685 8.407 1.00 0.00 C ATOM 563 CE1 HIS A 344 -11.548 -2.339 10.083 1.00 0.00 C ATOM 564 NE2 HIS A 344 -11.595 -1.582 8.985 1.00 0.00 N ATOM 0 H HIS A 344 -8.476 -4.277 6.699 1.00 0.00 H new ATOM 0 HA HIS A 344 -7.710 -1.487 7.504 1.00 0.00 H new ATOM 0 HB2 HIS A 344 -8.057 -4.045 9.141 1.00 0.00 H new ATOM 0 HB3 HIS A 344 -7.497 -2.515 9.788 1.00 0.00 H new ATOM 0 HD2 HIS A 344 -10.025 -1.193 7.497 1.00 0.00 H new ATOM 0 HE1 HIS A 344 -12.375 -2.474 10.764 1.00 0.00 H new ATOM 0 HE2 HIS A 344 -12.389 -1.041 8.642 1.00 0.00 H new ATOM 573 N ASP A 345 -5.244 -2.082 7.831 1.00 0.00 N ATOM 574 CA ASP A 345 -3.799 -2.415 7.709 1.00 0.00 C ATOM 575 C ASP A 345 -3.346 -3.198 8.944 1.00 0.00 C ATOM 576 O ASP A 345 -3.256 -2.666 10.032 1.00 0.00 O ATOM 577 CB ASP A 345 -2.986 -1.124 7.598 1.00 0.00 C ATOM 578 CG ASP A 345 -1.518 -1.465 7.340 1.00 0.00 C ATOM 579 OD1 ASP A 345 -1.225 -2.635 7.155 1.00 0.00 O ATOM 580 OD2 ASP A 345 -0.710 -0.551 7.333 1.00 0.00 O ATOM 0 H ASP A 345 -5.448 -1.148 8.186 1.00 0.00 H new ATOM 0 HA ASP A 345 -3.642 -3.022 6.818 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -3.374 -0.506 6.788 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -3.079 -0.543 8.516 1.00 0.00 H new ATOM 585 N VAL A 346 -3.055 -4.458 8.772 1.00 0.00 N ATOM 586 CA VAL A 346 -2.599 -5.293 9.918 1.00 0.00 C ATOM 587 C VAL A 346 -1.117 -5.635 9.722 1.00 0.00 C ATOM 588 O VAL A 346 -0.667 -5.813 8.608 1.00 0.00 O ATOM 589 CB VAL A 346 -3.421 -6.582 9.970 1.00 0.00 C ATOM 590 CG1 VAL A 346 -4.470 -6.475 11.080 1.00 0.00 C ATOM 591 CG2 VAL A 346 -4.123 -6.792 8.626 1.00 0.00 C ATOM 0 H VAL A 346 -3.114 -4.948 7.879 1.00 0.00 H new ATOM 0 HA VAL A 346 -2.732 -4.747 10.852 1.00 0.00 H new ATOM 0 HB VAL A 346 -2.761 -7.426 10.173 1.00 0.00 H new ATOM 0 HG11 VAL A 346 -5.056 -7.394 11.117 1.00 0.00 H new ATOM 0 HG12 VAL A 346 -3.972 -6.323 12.038 1.00 0.00 H new ATOM 0 HG13 VAL A 346 -5.130 -5.632 10.877 1.00 0.00 H new ATOM 0 HG21 VAL A 346 -4.709 -7.710 8.661 1.00 0.00 H new ATOM 0 HG22 VAL A 346 -4.782 -5.948 8.424 1.00 0.00 H new ATOM 0 HG23 VAL A 346 -3.378 -6.868 7.834 1.00 0.00 H new ATOM 601 N PRO A 347 -0.353 -5.713 10.786 1.00 0.00 N ATOM 602 CA PRO A 347 1.102 -6.024 10.690 1.00 0.00 C ATOM 603 C PRO A 347 1.364 -7.363 10.001 1.00 0.00 C ATOM 604 O PRO A 347 0.695 -8.346 10.250 1.00 0.00 O ATOM 605 CB PRO A 347 1.587 -6.077 12.141 1.00 0.00 C ATOM 606 CG PRO A 347 0.359 -6.139 12.991 1.00 0.00 C ATOM 607 CD PRO A 347 -0.780 -5.526 12.178 1.00 0.00 C ATOM 0 HA PRO A 347 1.622 -5.276 10.092 1.00 0.00 H new ATOM 0 HB2 PRO A 347 2.220 -6.949 12.308 1.00 0.00 H new ATOM 0 HB3 PRO A 347 2.184 -5.198 12.384 1.00 0.00 H new ATOM 0 HG2 PRO A 347 0.129 -7.170 13.261 1.00 0.00 H new ATOM 0 HG3 PRO A 347 0.506 -5.591 13.922 1.00 0.00 H new ATOM 0 HD2 PRO A 347 -1.728 -6.026 12.377 1.00 0.00 H new ATOM 0 HD3 PRO A 347 -0.920 -4.471 12.416 1.00 0.00 H new ATOM 615 N LYS A 348 2.346 -7.407 9.146 1.00 0.00 N ATOM 616 CA LYS A 348 2.675 -8.675 8.441 1.00 0.00 C ATOM 617 C LYS A 348 4.139 -8.655 8.023 1.00 0.00 C ATOM 618 O LYS A 348 4.867 -7.725 8.305 1.00 0.00 O ATOM 619 CB LYS A 348 1.805 -8.825 7.189 1.00 0.00 C ATOM 620 CG LYS A 348 0.361 -9.116 7.591 1.00 0.00 C ATOM 621 CD LYS A 348 -0.468 -9.412 6.341 1.00 0.00 C ATOM 622 CE LYS A 348 -1.935 -9.594 6.731 1.00 0.00 C ATOM 623 NZ LYS A 348 -2.119 -10.932 7.361 1.00 0.00 N ATOM 0 H LYS A 348 2.939 -6.613 8.904 1.00 0.00 H new ATOM 0 HA LYS A 348 2.487 -9.511 9.114 1.00 0.00 H new ATOM 0 HB2 LYS A 348 1.849 -7.913 6.594 1.00 0.00 H new ATOM 0 HB3 LYS A 348 2.187 -9.632 6.564 1.00 0.00 H new ATOM 0 HG2 LYS A 348 0.327 -9.966 8.273 1.00 0.00 H new ATOM 0 HG3 LYS A 348 -0.058 -8.263 8.124 1.00 0.00 H new ATOM 0 HD2 LYS A 348 -0.370 -8.596 5.625 1.00 0.00 H new ATOM 0 HD3 LYS A 348 -0.097 -10.312 5.851 1.00 0.00 H new ATOM 0 HE2 LYS A 348 -2.238 -8.809 7.424 1.00 0.00 H new ATOM 0 HE3 LYS A 348 -2.570 -9.504 5.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 348 -3.131 -11.098 7.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 348 -1.751 -11.668 6.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 348 -1.604 -10.964 8.264 1.00 0.00 H new ATOM 637 N GLY A 349 4.569 -9.671 7.336 1.00 0.00 N ATOM 638 CA GLY A 349 5.985 -9.714 6.875 1.00 0.00 C ATOM 639 C GLY A 349 6.251 -8.491 6.000 1.00 0.00 C ATOM 640 O GLY A 349 5.618 -7.464 6.148 1.00 0.00 O ATOM 0 H GLY A 349 4.002 -10.477 7.072 1.00 0.00 H new ATOM 0 HA2 GLY A 349 6.661 -9.721 7.730 1.00 0.00 H new ATOM 0 HA3 GLY A 349 6.172 -10.629 6.313 1.00 0.00 H new ATOM 644 N ASP A 350 7.168 -8.586 5.082 1.00 0.00 N ATOM 645 CA ASP A 350 7.446 -7.420 4.203 1.00 0.00 C ATOM 646 C ASP A 350 6.354 -7.339 3.136 1.00 0.00 C ATOM 647 O ASP A 350 6.234 -8.207 2.294 1.00 0.00 O ATOM 648 CB ASP A 350 8.808 -7.597 3.530 1.00 0.00 C ATOM 649 CG ASP A 350 9.148 -6.338 2.731 1.00 0.00 C ATOM 650 OD1 ASP A 350 8.388 -5.387 2.811 1.00 0.00 O ATOM 651 OD2 ASP A 350 10.162 -6.346 2.053 1.00 0.00 O ATOM 0 H ASP A 350 7.734 -9.415 4.903 1.00 0.00 H new ATOM 0 HA ASP A 350 7.458 -6.504 4.794 1.00 0.00 H new ATOM 0 HB2 ASP A 350 9.576 -7.782 4.281 1.00 0.00 H new ATOM 0 HB3 ASP A 350 8.790 -8.465 2.871 1.00 0.00 H new ATOM 656 N TRP A 351 5.551 -6.311 3.165 1.00 0.00 N ATOM 657 CA TRP A 351 4.468 -6.195 2.151 1.00 0.00 C ATOM 658 C TRP A 351 5.090 -5.883 0.793 1.00 0.00 C ATOM 659 O TRP A 351 5.799 -4.909 0.637 1.00 0.00 O ATOM 660 CB TRP A 351 3.516 -5.062 2.544 1.00 0.00 C ATOM 661 CG TRP A 351 4.067 -4.336 3.729 1.00 0.00 C ATOM 662 CD1 TRP A 351 5.105 -3.470 3.693 1.00 0.00 C ATOM 663 CD2 TRP A 351 3.630 -4.394 5.118 1.00 0.00 C ATOM 664 NE1 TRP A 351 5.334 -2.993 4.971 1.00 0.00 N ATOM 665 CE2 TRP A 351 4.450 -3.533 5.885 1.00 0.00 C ATOM 666 CE3 TRP A 351 2.611 -5.103 5.780 1.00 0.00 C ATOM 667 CZ2 TRP A 351 4.267 -3.380 7.259 1.00 0.00 C ATOM 668 CZ3 TRP A 351 2.424 -4.951 7.164 1.00 0.00 C ATOM 669 CH2 TRP A 351 3.251 -4.091 7.902 1.00 0.00 C ATOM 0 H TRP A 351 5.598 -5.551 3.843 1.00 0.00 H new ATOM 0 HA TRP A 351 3.913 -7.132 2.099 1.00 0.00 H new ATOM 0 HB2 TRP A 351 3.389 -4.373 1.709 1.00 0.00 H new ATOM 0 HB3 TRP A 351 2.531 -5.465 2.777 1.00 0.00 H new ATOM 0 HD1 TRP A 351 5.664 -3.196 2.811 1.00 0.00 H new ATOM 0 HE1 TRP A 351 6.066 -2.324 5.209 1.00 0.00 H new ATOM 0 HE3 TRP A 351 1.969 -5.768 5.221 1.00 0.00 H new ATOM 0 HZ2 TRP A 351 4.906 -2.716 7.822 1.00 0.00 H new ATOM 0 HZ3 TRP A 351 1.639 -5.500 7.663 1.00 0.00 H new ATOM 0 HH2 TRP A 351 3.102 -3.979 8.966 1.00 0.00 H new ATOM 680 N ARG A 352 4.834 -6.704 -0.189 1.00 0.00 N ATOM 681 CA ARG A 352 5.415 -6.458 -1.537 1.00 0.00 C ATOM 682 C ARG A 352 4.326 -6.508 -2.602 1.00 0.00 C ATOM 683 O ARG A 352 3.496 -7.396 -2.618 1.00 0.00 O ATOM 684 CB ARG A 352 6.470 -7.519 -1.839 1.00 0.00 C ATOM 685 CG ARG A 352 7.666 -7.325 -0.908 1.00 0.00 C ATOM 686 CD ARG A 352 8.778 -8.290 -1.310 1.00 0.00 C ATOM 687 NE ARG A 352 9.918 -8.163 -0.359 1.00 0.00 N ATOM 688 CZ ARG A 352 10.913 -9.004 -0.416 1.00 0.00 C ATOM 689 NH1 ARG A 352 10.910 -9.958 -1.307 1.00 0.00 N ATOM 690 NH2 ARG A 352 11.911 -8.893 0.417 1.00 0.00 N ATOM 0 H ARG A 352 4.247 -7.535 -0.115 1.00 0.00 H new ATOM 0 HA ARG A 352 5.873 -5.469 -1.547 1.00 0.00 H new ATOM 0 HB2 ARG A 352 6.049 -8.515 -1.705 1.00 0.00 H new ATOM 0 HB3 ARG A 352 6.789 -7.445 -2.879 1.00 0.00 H new ATOM 0 HG2 ARG A 352 8.023 -6.297 -0.965 1.00 0.00 H new ATOM 0 HG3 ARG A 352 7.370 -7.503 0.126 1.00 0.00 H new ATOM 0 HD2 ARG A 352 8.403 -9.313 -1.309 1.00 0.00 H new ATOM 0 HD3 ARG A 352 9.112 -8.074 -2.325 1.00 0.00 H new ATOM 0 HE ARG A 352 9.920 -7.418 0.337 1.00 0.00 H new ATOM 0 HH11 ARG A 352 10.130 -10.045 -1.958 1.00 0.00 H new ATOM 0 HH12 ARG A 352 11.688 -10.616 -1.352 1.00 0.00 H new ATOM 0 HH21 ARG A 352 11.913 -8.148 1.114 1.00 0.00 H new ATOM 0 HH22 ARG A 352 12.689 -9.551 0.372 1.00 0.00 H new ATOM 704 N CYS A 353 4.339 -5.573 -3.509 1.00 0.00 N ATOM 705 CA CYS A 353 3.328 -5.575 -4.590 1.00 0.00 C ATOM 706 C CYS A 353 3.600 -6.795 -5.485 1.00 0.00 C ATOM 707 O CYS A 353 4.719 -7.262 -5.563 1.00 0.00 O ATOM 708 CB CYS A 353 3.440 -4.271 -5.384 1.00 0.00 C ATOM 709 SG CYS A 353 5.072 -4.159 -6.153 1.00 0.00 S ATOM 0 H CYS A 353 5.011 -4.806 -3.545 1.00 0.00 H new ATOM 0 HA CYS A 353 2.317 -5.640 -4.188 1.00 0.00 H new ATOM 0 HB2 CYS A 353 2.664 -4.233 -6.149 1.00 0.00 H new ATOM 0 HB3 CYS A 353 3.280 -3.418 -4.724 1.00 0.00 H new ATOM 714 N PRO A 354 2.594 -7.337 -6.131 1.00 0.00 N ATOM 715 CA PRO A 354 2.767 -8.548 -6.987 1.00 0.00 C ATOM 716 C PRO A 354 3.967 -8.456 -7.940 1.00 0.00 C ATOM 717 O PRO A 354 4.681 -9.421 -8.131 1.00 0.00 O ATOM 718 CB PRO A 354 1.471 -8.612 -7.798 1.00 0.00 C ATOM 719 CG PRO A 354 0.450 -7.859 -7.010 1.00 0.00 C ATOM 720 CD PRO A 354 1.196 -6.869 -6.113 1.00 0.00 C ATOM 0 HA PRO A 354 2.959 -9.428 -6.374 1.00 0.00 H new ATOM 0 HB2 PRO A 354 1.607 -8.168 -8.784 1.00 0.00 H new ATOM 0 HB3 PRO A 354 1.159 -9.645 -7.953 1.00 0.00 H new ATOM 0 HG2 PRO A 354 -0.235 -7.332 -7.675 1.00 0.00 H new ATOM 0 HG3 PRO A 354 -0.151 -8.542 -6.410 1.00 0.00 H new ATOM 0 HD2 PRO A 354 1.113 -5.850 -6.491 1.00 0.00 H new ATOM 0 HD3 PRO A 354 0.791 -6.867 -5.101 1.00 0.00 H new ATOM 728 N LYS A 355 4.209 -7.319 -8.531 1.00 0.00 N ATOM 729 CA LYS A 355 5.374 -7.213 -9.457 1.00 0.00 C ATOM 730 C LYS A 355 6.679 -7.406 -8.680 1.00 0.00 C ATOM 731 O LYS A 355 7.601 -8.044 -9.148 1.00 0.00 O ATOM 732 CB LYS A 355 5.374 -5.845 -10.138 1.00 0.00 C ATOM 733 CG LYS A 355 5.290 -4.763 -9.073 1.00 0.00 C ATOM 734 CD LYS A 355 5.209 -3.389 -9.739 1.00 0.00 C ATOM 735 CE LYS A 355 5.347 -2.296 -8.677 1.00 0.00 C ATOM 736 NZ LYS A 355 5.670 -1.000 -9.338 1.00 0.00 N ATOM 0 H LYS A 355 3.659 -6.468 -8.416 1.00 0.00 H new ATOM 0 HA LYS A 355 5.294 -7.990 -10.217 1.00 0.00 H new ATOM 0 HB2 LYS A 355 6.280 -5.720 -10.732 1.00 0.00 H new ATOM 0 HB3 LYS A 355 4.530 -5.765 -10.823 1.00 0.00 H new ATOM 0 HG2 LYS A 355 4.414 -4.925 -8.444 1.00 0.00 H new ATOM 0 HG3 LYS A 355 6.163 -4.811 -8.422 1.00 0.00 H new ATOM 0 HD2 LYS A 355 5.998 -3.288 -10.484 1.00 0.00 H new ATOM 0 HD3 LYS A 355 4.259 -3.283 -10.263 1.00 0.00 H new ATOM 0 HE2 LYS A 355 4.421 -2.206 -8.110 1.00 0.00 H new ATOM 0 HE3 LYS A 355 6.131 -2.560 -7.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 355 5.764 -0.256 -8.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 355 6.565 -1.090 -9.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 355 4.907 -0.747 -9.998 1.00 0.00 H new ATOM 750 N CYS A 356 6.765 -6.869 -7.493 1.00 0.00 N ATOM 751 CA CYS A 356 8.013 -7.037 -6.693 1.00 0.00 C ATOM 752 C CYS A 356 8.232 -8.523 -6.416 1.00 0.00 C ATOM 753 O CYS A 356 9.347 -9.006 -6.400 1.00 0.00 O ATOM 754 CB CYS A 356 7.882 -6.291 -5.360 1.00 0.00 C ATOM 755 SG CYS A 356 8.542 -4.613 -5.525 1.00 0.00 S ATOM 0 H CYS A 356 6.029 -6.324 -7.044 1.00 0.00 H new ATOM 0 HA CYS A 356 8.857 -6.632 -7.251 1.00 0.00 H new ATOM 0 HB2 CYS A 356 6.836 -6.251 -5.057 1.00 0.00 H new ATOM 0 HB3 CYS A 356 8.420 -6.828 -4.579 1.00 0.00 H new ATOM 760 N LEU A 357 7.173 -9.249 -6.191 1.00 0.00 N ATOM 761 CA LEU A 357 7.310 -10.705 -5.907 1.00 0.00 C ATOM 762 C LEU A 357 7.966 -11.401 -7.101 1.00 0.00 C ATOM 763 O LEU A 357 8.768 -12.300 -6.945 1.00 0.00 O ATOM 764 CB LEU A 357 5.923 -11.300 -5.659 1.00 0.00 C ATOM 765 CG LEU A 357 6.059 -12.764 -5.234 1.00 0.00 C ATOM 766 CD1 LEU A 357 6.697 -12.843 -3.844 1.00 0.00 C ATOM 767 CD2 LEU A 357 4.671 -13.408 -5.191 1.00 0.00 C ATOM 0 H LEU A 357 6.216 -8.896 -6.191 1.00 0.00 H new ATOM 0 HA LEU A 357 7.932 -10.851 -5.024 1.00 0.00 H new ATOM 0 HB2 LEU A 357 5.406 -10.733 -4.885 1.00 0.00 H new ATOM 0 HB3 LEU A 357 5.319 -11.228 -6.563 1.00 0.00 H new ATOM 0 HG LEU A 357 6.689 -13.291 -5.950 1.00 0.00 H new ATOM 0 HD11 LEU A 357 6.792 -13.887 -3.546 1.00 0.00 H new ATOM 0 HD12 LEU A 357 7.684 -12.382 -3.870 1.00 0.00 H new ATOM 0 HD13 LEU A 357 6.070 -12.316 -3.125 1.00 0.00 H new ATOM 0 HD21 LEU A 357 4.763 -14.451 -4.889 1.00 0.00 H new ATOM 0 HD22 LEU A 357 4.045 -12.876 -4.474 1.00 0.00 H new ATOM 0 HD23 LEU A 357 4.215 -13.356 -6.180 1.00 0.00 H new ATOM 779 N ALA A 358 7.631 -10.992 -8.294 1.00 0.00 N ATOM 780 CA ALA A 358 8.235 -11.628 -9.497 1.00 0.00 C ATOM 781 C ALA A 358 9.742 -11.369 -9.508 1.00 0.00 C ATOM 782 O ALA A 358 10.521 -12.189 -9.953 1.00 0.00 O ATOM 783 CB ALA A 358 7.607 -11.035 -10.759 1.00 0.00 C ATOM 0 H ALA A 358 6.965 -10.244 -8.487 1.00 0.00 H new ATOM 0 HA ALA A 358 8.050 -12.702 -9.470 1.00 0.00 H new ATOM 0 HB1 ALA A 358 8.050 -11.501 -11.639 1.00 0.00 H new ATOM 0 HB2 ALA A 358 6.533 -11.220 -10.752 1.00 0.00 H new ATOM 0 HB3 ALA A 358 7.790 -9.961 -10.786 1.00 0.00 H new ATOM 789 N GLN A 359 10.160 -10.233 -9.021 1.00 0.00 N ATOM 790 CA GLN A 359 11.616 -9.919 -9.003 1.00 0.00 C ATOM 791 C GLN A 359 12.357 -10.973 -8.178 1.00 0.00 C ATOM 792 O GLN A 359 13.477 -11.337 -8.479 1.00 0.00 O ATOM 793 CB GLN A 359 11.832 -8.538 -8.379 1.00 0.00 C ATOM 794 CG GLN A 359 11.190 -7.471 -9.266 1.00 0.00 C ATOM 795 CD GLN A 359 11.360 -6.097 -8.618 1.00 0.00 C ATOM 796 OE1 GLN A 359 11.676 -5.999 -7.448 1.00 0.00 O ATOM 797 NE2 GLN A 359 11.162 -5.023 -9.332 1.00 0.00 N ATOM 0 H GLN A 359 9.555 -9.508 -8.634 1.00 0.00 H new ATOM 0 HA GLN A 359 12.000 -9.922 -10.023 1.00 0.00 H new ATOM 0 HB2 GLN A 359 11.396 -8.506 -7.380 1.00 0.00 H new ATOM 0 HB3 GLN A 359 12.898 -8.340 -8.268 1.00 0.00 H new ATOM 0 HG2 GLN A 359 11.652 -7.478 -10.253 1.00 0.00 H new ATOM 0 HG3 GLN A 359 10.131 -7.689 -9.407 1.00 0.00 H new ATOM 0 HE21 GLN A 359 10.897 -5.105 -10.314 1.00 0.00 H new ATOM 0 HE22 GLN A 359 11.272 -4.102 -8.909 1.00 0.00 H new ATOM 806 N GLU A 360 11.740 -11.467 -7.141 1.00 0.00 N ATOM 807 CA GLU A 360 12.408 -12.497 -6.297 1.00 0.00 C ATOM 808 C GLU A 360 12.396 -13.842 -7.026 1.00 0.00 C ATOM 809 O GLU A 360 11.338 -14.443 -7.102 1.00 0.00 O ATOM 810 CB GLU A 360 11.665 -12.631 -4.971 1.00 0.00 C ATOM 811 CG GLU A 360 12.493 -13.496 -4.022 1.00 0.00 C ATOM 812 CD GLU A 360 13.771 -12.751 -3.634 1.00 0.00 C ATOM 813 OE1 GLU A 360 13.765 -11.532 -3.697 1.00 0.00 O ATOM 814 OE2 GLU A 360 14.735 -13.412 -3.283 1.00 0.00 O ATOM 815 OXT GLU A 360 13.446 -14.247 -7.497 1.00 0.00 O ATOM 0 H GLU A 360 10.802 -11.202 -6.841 1.00 0.00 H new ATOM 0 HA GLU A 360 13.438 -12.196 -6.107 1.00 0.00 H new ATOM 0 HB2 GLU A 360 11.496 -11.647 -4.533 1.00 0.00 H new ATOM 0 HB3 GLU A 360 10.685 -13.081 -5.132 1.00 0.00 H new ATOM 0 HG2 GLU A 360 11.913 -13.733 -3.130 1.00 0.00 H new ATOM 0 HG3 GLU A 360 12.743 -14.443 -4.501 1.00 0.00 H new TER 822 GLU A 360 HETATM 823 ZN ZN A 401 -5.737 4.161 -2.820 1.00 0.00 ZN HETATM 824 ZN ZN A 402 6.804 -3.211 -4.985 1.00 0.00 ZN