USER MOD reduce.3.24.130724 H: found=0, std=0, add=792, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 793 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 300 HIS : no HE2:sc= -1.32! C(o=-0.73!,f=-10!) USER MOD Set 1.2: A 364 THR OG1 : rot -93:sc= 0.588 USER MOD Set 2.1: A 362 CYS SG : rot 118:sc= 1.17 USER MOD Set 2.2: A 371 CYS SG : rot 180:sc= 1.01 USER MOD Set 3.1: A 338 CYS SG : rot -107:sc= 2.43 USER MOD Set 3.2: A 342 THR OG1 : rot -173:sc= 2.13 USER MOD Set 4.1: A 307 CYS SG : rot 12:sc= 1.91 USER MOD Set 4.2: A 310 THR OG1 : rot -87:sc= 1.14 USER MOD Set 4.3: A 325 GLN :FLIP amide:sc= 0.281 F(o=1.9,f=3.6) USER MOD Set 4.4: A 343 THR OG1 : rot 180:sc= 0.283 USER MOD Single : A 279 MET CE :methyl -159:sc= -0.119 (180deg=-0.62) USER MOD Single : A 281 ASN : amide:sc= -0.0249 K(o=-0.025,f=-0.92) USER MOD Single : A 286 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 287 ASN :FLIP amide:sc= -0.149 F(o=-1.5,f=-0.15) USER MOD Single : A 289 SER OG : rot 180:sc= 0 USER MOD Single : A 290 TYR OH : rot 180:sc= 0 USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 SER OG : rot 22:sc= 0.379 USER MOD Single : A 302 TYR OH : rot -91:sc= 0.707 USER MOD Single : A 304 LYS NZ :NH3+ -107:sc= -0.514 (180deg=-2.62!) USER MOD Single : A 311 SER OG : rot 26:sc= -0.981 USER MOD Single : A 318 GLN : amide:sc= -0.0714 X(o=-0.071,f=0) USER MOD Single : A 321 THR OG1 : rot 180:sc= -2.41! USER MOD Single : A 326 THR OG1 : rot 9:sc= -1.04 USER MOD Single : A 330 ASN :FLIP amide:sc= 0.0808 F(o=-1.9!,f=0.081) USER MOD Single : A 335 HIS :FLIP no HE2:sc= 0.106 F(o=-0.56,f=0.11) USER MOD Single : A 341 HIS : no HE2:sc= 1.16 K(o=1.2,f=-4.9!) USER MOD Single : A 347 GLN : amide:sc= -5.13! C(o=-5.1!,f=-7.9!) USER MOD Single : A 349 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 352 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 358 GLN :FLIP amide:sc= -0.0938 F(o=-2.3,f=-0.094) USER MOD Single : A 359 CYS SG : rot -69:sc= 1.11 USER MOD Single : A 360 THR OG1 : rot 180:sc= -0.173 USER MOD Single : A 366 SER OG : rot 180:sc= 0 USER MOD Single : A 374 LYS NZ :NH3+ -163:sc= -0.372 (180deg=-1.46!) USER MOD ----------------------------------------------------------------- ATOM 86 N MET A 279 14.599 -7.409 5.756 1.00 1.31 N ATOM 87 CA MET A 279 13.296 -6.810 5.568 1.00 1.10 C ATOM 88 C MET A 279 12.976 -5.880 6.725 1.00 0.93 C ATOM 89 O MET A 279 12.996 -6.285 7.887 1.00 1.07 O ATOM 90 CB MET A 279 12.237 -7.901 5.436 1.00 1.39 C ATOM 91 CG MET A 279 12.327 -8.670 4.126 1.00 1.65 C ATOM 92 SD MET A 279 11.141 -10.024 4.018 1.00 2.18 S ATOM 93 CE MET A 279 11.709 -11.085 5.347 1.00 2.66 C ATOM 0 HA MET A 279 13.300 -6.222 4.651 1.00 1.10 H new ATOM 0 HB2 MET A 279 12.339 -8.599 6.267 1.00 1.39 H new ATOM 0 HB3 MET A 279 11.248 -7.450 5.518 1.00 1.39 H new ATOM 0 HG2 MET A 279 12.162 -7.983 3.296 1.00 1.65 H new ATOM 0 HG3 MET A 279 13.335 -9.068 4.014 1.00 1.65 H new ATOM 0 HE1 MET A 279 11.344 -12.099 5.184 1.00 2.66 H new ATOM 0 HE2 MET A 279 12.799 -11.090 5.368 1.00 2.66 H new ATOM 0 HE3 MET A 279 11.330 -10.712 6.298 1.00 2.66 H new ATOM 103 N VAL A 280 12.702 -4.632 6.393 1.00 0.76 N ATOM 104 CA VAL A 280 12.452 -3.608 7.384 1.00 0.74 C ATOM 105 C VAL A 280 10.971 -3.290 7.482 1.00 0.70 C ATOM 106 O VAL A 280 10.271 -3.155 6.467 1.00 0.67 O ATOM 107 CB VAL A 280 13.230 -2.312 7.077 1.00 0.81 C ATOM 108 CG1 VAL A 280 12.977 -1.278 8.163 1.00 1.05 C ATOM 109 CG2 VAL A 280 14.718 -2.594 6.935 1.00 1.12 C ATOM 0 H VAL A 280 12.647 -4.302 5.429 1.00 0.76 H new ATOM 0 HA VAL A 280 12.799 -4.006 8.338 1.00 0.74 H new ATOM 0 HB VAL A 280 12.874 -1.912 6.128 1.00 0.81 H new ATOM 0 HG11 VAL A 280 13.532 -0.368 7.935 1.00 1.05 H new ATOM 0 HG12 VAL A 280 11.912 -1.052 8.209 1.00 1.05 H new ATOM 0 HG13 VAL A 280 13.306 -1.672 9.124 1.00 1.05 H new ATOM 0 HG21 VAL A 280 15.245 -1.665 6.719 1.00 1.12 H new ATOM 0 HG22 VAL A 280 15.098 -3.019 7.864 1.00 1.12 H new ATOM 0 HG23 VAL A 280 14.878 -3.300 6.120 1.00 1.12 H new ATOM 119 N ASN A 281 10.509 -3.179 8.712 1.00 0.81 N ATOM 120 CA ASN A 281 9.131 -2.819 8.987 1.00 0.93 C ATOM 121 C ASN A 281 9.027 -1.311 9.076 1.00 0.99 C ATOM 122 O ASN A 281 9.678 -0.685 9.914 1.00 1.10 O ATOM 123 CB ASN A 281 8.647 -3.462 10.291 1.00 1.15 C ATOM 124 CG ASN A 281 8.403 -4.953 10.152 1.00 1.53 C ATOM 125 OD1 ASN A 281 7.969 -5.431 9.102 1.00 2.16 O ATOM 126 ND2 ASN A 281 8.696 -5.706 11.202 1.00 1.69 N ATOM 0 H ASN A 281 11.075 -3.335 9.546 1.00 0.81 H new ATOM 0 HA ASN A 281 8.497 -3.187 8.180 1.00 0.93 H new ATOM 0 HB2 ASN A 281 9.387 -3.290 11.073 1.00 1.15 H new ATOM 0 HB3 ASN A 281 7.726 -2.975 10.611 1.00 1.15 H new ATOM 0 HD21 ASN A 281 8.564 -6.716 11.158 1.00 1.69 H new ATOM 0 HD22 ASN A 281 9.053 -5.275 12.055 1.00 1.69 H new ATOM 133 N LEU A 282 8.223 -0.725 8.207 1.00 1.02 N ATOM 134 CA LEU A 282 8.152 0.720 8.117 1.00 1.17 C ATOM 135 C LEU A 282 7.165 1.272 9.139 1.00 1.50 C ATOM 136 O LEU A 282 6.015 0.832 9.217 1.00 1.60 O ATOM 137 CB LEU A 282 7.763 1.131 6.693 1.00 1.26 C ATOM 138 CG LEU A 282 7.834 2.629 6.390 1.00 1.63 C ATOM 139 CD1 LEU A 282 9.209 3.185 6.725 1.00 2.23 C ATOM 140 CD2 LEU A 282 7.507 2.882 4.928 1.00 2.25 C ATOM 0 H LEU A 282 7.614 -1.224 7.558 1.00 1.02 H new ATOM 0 HA LEU A 282 9.132 1.141 8.343 1.00 1.17 H new ATOM 0 HB2 LEU A 282 8.414 0.607 5.993 1.00 1.26 H new ATOM 0 HB3 LEU A 282 6.746 0.788 6.501 1.00 1.26 H new ATOM 0 HG LEU A 282 7.099 3.140 7.012 1.00 1.63 H new ATOM 0 HD11 LEU A 282 9.235 4.251 6.501 1.00 2.23 H new ATOM 0 HD12 LEU A 282 9.415 3.032 7.784 1.00 2.23 H new ATOM 0 HD13 LEU A 282 9.964 2.671 6.130 1.00 2.23 H new ATOM 0 HD21 LEU A 282 7.560 3.951 4.723 1.00 2.25 H new ATOM 0 HD22 LEU A 282 8.224 2.356 4.298 1.00 2.25 H new ATOM 0 HD23 LEU A 282 6.501 2.521 4.712 1.00 2.25 H new ATOM 152 N ALA A 283 7.637 2.223 9.931 1.00 1.76 N ATOM 153 CA ALA A 283 6.827 2.849 10.965 1.00 2.22 C ATOM 154 C ALA A 283 6.533 4.297 10.606 1.00 2.03 C ATOM 155 O ALA A 283 5.891 5.028 11.363 1.00 2.38 O ATOM 156 CB ALA A 283 7.550 2.780 12.297 1.00 2.73 C ATOM 0 H ALA A 283 8.590 2.582 9.875 1.00 1.76 H new ATOM 0 HA ALA A 283 5.881 2.312 11.042 1.00 2.22 H new ATOM 0 HB1 ALA A 283 6.939 3.250 13.067 1.00 2.73 H new ATOM 0 HB2 ALA A 283 7.728 1.737 12.561 1.00 2.73 H new ATOM 0 HB3 ALA A 283 8.503 3.303 12.221 1.00 2.73 H new ATOM 162 N PHE A 284 7.003 4.697 9.439 1.00 1.59 N ATOM 163 CA PHE A 284 6.814 6.055 8.966 1.00 1.53 C ATOM 164 C PHE A 284 5.718 6.094 7.915 1.00 1.13 C ATOM 165 O PHE A 284 5.754 5.351 6.937 1.00 1.03 O ATOM 166 CB PHE A 284 8.125 6.594 8.380 1.00 1.81 C ATOM 167 CG PHE A 284 7.996 7.939 7.718 1.00 2.26 C ATOM 168 CD1 PHE A 284 7.924 9.095 8.475 1.00 2.47 C ATOM 169 CD2 PHE A 284 7.951 8.044 6.335 1.00 2.90 C ATOM 170 CE1 PHE A 284 7.805 10.332 7.869 1.00 3.09 C ATOM 171 CE2 PHE A 284 7.832 9.278 5.723 1.00 3.64 C ATOM 172 CZ PHE A 284 7.758 10.423 6.491 1.00 3.67 C ATOM 0 H PHE A 284 7.521 4.096 8.798 1.00 1.59 H new ATOM 0 HA PHE A 284 6.518 6.683 9.806 1.00 1.53 H new ATOM 0 HB2 PHE A 284 8.865 6.663 9.177 1.00 1.81 H new ATOM 0 HB3 PHE A 284 8.506 5.878 7.652 1.00 1.81 H new ATOM 0 HD1 PHE A 284 7.961 9.030 9.552 1.00 2.47 H new ATOM 0 HD2 PHE A 284 8.010 7.151 5.730 1.00 2.90 H new ATOM 0 HE1 PHE A 284 7.749 11.226 8.472 1.00 3.09 H new ATOM 0 HE2 PHE A 284 7.797 9.346 4.646 1.00 3.64 H new ATOM 0 HZ PHE A 284 7.664 11.388 6.016 1.00 3.67 H new ATOM 182 N VAL A 285 4.760 6.985 8.113 1.00 1.30 N ATOM 183 CA VAL A 285 3.619 7.089 7.224 1.00 1.38 C ATOM 184 C VAL A 285 3.613 8.443 6.517 1.00 1.22 C ATOM 185 O VAL A 285 3.900 9.478 7.121 1.00 1.39 O ATOM 186 CB VAL A 285 2.296 6.878 7.998 1.00 2.05 C ATOM 187 CG1 VAL A 285 2.143 7.906 9.107 1.00 2.59 C ATOM 188 CG2 VAL A 285 1.106 6.919 7.059 1.00 2.69 C ATOM 0 H VAL A 285 4.752 7.649 8.887 1.00 1.30 H new ATOM 0 HA VAL A 285 3.702 6.305 6.472 1.00 1.38 H new ATOM 0 HB VAL A 285 2.332 5.890 8.457 1.00 2.05 H new ATOM 0 HG11 VAL A 285 1.205 7.735 9.635 1.00 2.59 H new ATOM 0 HG12 VAL A 285 2.975 7.814 9.806 1.00 2.59 H new ATOM 0 HG13 VAL A 285 2.140 8.908 8.677 1.00 2.59 H new ATOM 0 HG21 VAL A 285 0.188 6.768 7.628 1.00 2.69 H new ATOM 0 HG22 VAL A 285 1.069 7.888 6.561 1.00 2.69 H new ATOM 0 HG23 VAL A 285 1.204 6.131 6.313 1.00 2.69 H new ATOM 198 N LYS A 286 3.309 8.425 5.228 1.00 1.31 N ATOM 199 CA LYS A 286 3.296 9.636 4.424 1.00 1.26 C ATOM 200 C LYS A 286 2.209 9.535 3.350 1.00 1.13 C ATOM 201 O LYS A 286 2.337 10.050 2.242 1.00 1.17 O ATOM 202 CB LYS A 286 4.686 9.847 3.802 1.00 1.49 C ATOM 203 CG LYS A 286 4.831 11.124 3.003 1.00 1.93 C ATOM 204 CD LYS A 286 4.426 12.334 3.826 1.00 2.42 C ATOM 205 CE LYS A 286 4.347 13.588 2.979 1.00 3.19 C ATOM 206 NZ LYS A 286 3.952 14.771 3.786 1.00 3.44 N ATOM 0 H LYS A 286 3.066 7.578 4.714 1.00 1.31 H new ATOM 0 HA LYS A 286 3.066 10.498 5.050 1.00 1.26 H new ATOM 0 HB2 LYS A 286 5.430 9.846 4.599 1.00 1.49 H new ATOM 0 HB3 LYS A 286 4.912 9.000 3.154 1.00 1.49 H new ATOM 0 HG2 LYS A 286 5.864 11.234 2.673 1.00 1.93 H new ATOM 0 HG3 LYS A 286 4.214 11.067 2.106 1.00 1.93 H new ATOM 0 HD2 LYS A 286 3.459 12.149 4.293 1.00 2.42 H new ATOM 0 HD3 LYS A 286 5.145 12.484 4.631 1.00 2.42 H new ATOM 0 HE2 LYS A 286 5.314 13.773 2.511 1.00 3.19 H new ATOM 0 HE3 LYS A 286 3.627 13.439 2.174 1.00 3.19 H new ATOM 0 HZ1 LYS A 286 3.908 15.610 3.173 1.00 3.44 H new ATOM 0 HZ2 LYS A 286 3.018 14.604 4.212 1.00 3.44 H new ATOM 0 HZ3 LYS A 286 4.653 14.928 4.538 1.00 3.44 H new ATOM 220 N ASN A 287 1.126 8.865 3.686 1.00 1.17 N ATOM 221 CA ASN A 287 0.053 8.663 2.723 1.00 1.09 C ATOM 222 C ASN A 287 -1.206 9.365 3.193 1.00 1.11 C ATOM 223 O ASN A 287 -1.356 9.652 4.382 1.00 1.23 O ATOM 224 CB ASN A 287 -0.200 7.160 2.463 1.00 1.09 C ATOM 225 CG ASN A 287 -1.093 6.450 3.483 1.00 1.11 C ATOM 226 OD1 ASN A 287 -1.091 6.887 4.732 1.00 1.17 O flip ATOM 227 ND2 ASN A 287 -1.786 5.496 3.138 1.00 1.26 N flip ATOM 0 H ASN A 287 0.962 8.454 4.605 1.00 1.17 H new ATOM 0 HA ASN A 287 0.357 9.101 1.772 1.00 1.09 H new ATOM 0 HB2 ASN A 287 -0.650 7.052 1.476 1.00 1.09 H new ATOM 0 HB3 ASN A 287 0.762 6.649 2.432 1.00 1.09 H new ATOM 0 HD21 ASN A 287 -1.770 5.178 2.169 1.00 1.26 H new ATOM 0 HD22 ASN A 287 -2.377 5.022 3.821 1.00 1.26 H new ATOM 234 N ASP A 288 -2.076 9.687 2.260 1.00 1.04 N ATOM 235 CA ASP A 288 -3.343 10.310 2.589 1.00 1.09 C ATOM 236 C ASP A 288 -4.471 9.562 1.909 1.00 0.97 C ATOM 237 O ASP A 288 -4.359 9.168 0.748 1.00 0.86 O ATOM 238 CB ASP A 288 -3.350 11.793 2.186 1.00 1.20 C ATOM 239 CG ASP A 288 -3.071 12.025 0.710 1.00 1.62 C ATOM 240 OD1 ASP A 288 -4.020 12.356 -0.033 1.00 2.36 O ATOM 241 OD2 ASP A 288 -1.908 11.845 0.285 1.00 1.76 O ATOM 0 H ASP A 288 -1.929 9.527 1.263 1.00 1.04 H new ATOM 0 HA ASP A 288 -3.486 10.262 3.668 1.00 1.09 H new ATOM 0 HB2 ASP A 288 -4.320 12.224 2.436 1.00 1.20 H new ATOM 0 HB3 ASP A 288 -2.603 12.325 2.776 1.00 1.20 H new ATOM 246 N SER A 289 -5.551 9.346 2.636 1.00 1.02 N ATOM 247 CA SER A 289 -6.676 8.611 2.101 1.00 0.94 C ATOM 248 C SER A 289 -7.839 9.539 1.814 1.00 1.05 C ATOM 249 O SER A 289 -8.060 10.517 2.534 1.00 1.23 O ATOM 250 CB SER A 289 -7.098 7.518 3.088 1.00 1.03 C ATOM 251 OG SER A 289 -7.255 8.039 4.400 1.00 1.42 O ATOM 0 H SER A 289 -5.671 9.669 3.596 1.00 1.02 H new ATOM 0 HA SER A 289 -6.374 8.147 1.162 1.00 0.94 H new ATOM 0 HB2 SER A 289 -8.035 7.069 2.758 1.00 1.03 H new ATOM 0 HB3 SER A 289 -6.351 6.725 3.097 1.00 1.03 H new ATOM 0 HG SER A 289 -7.526 7.319 5.007 1.00 1.42 H new ATOM 257 N TYR A 290 -8.584 9.212 0.774 1.00 0.98 N ATOM 258 CA TYR A 290 -9.772 9.968 0.400 1.00 1.15 C ATOM 259 C TYR A 290 -10.934 9.018 0.230 1.00 1.07 C ATOM 260 O TYR A 290 -10.778 7.938 -0.319 1.00 0.92 O ATOM 261 CB TYR A 290 -9.574 10.748 -0.904 1.00 1.28 C ATOM 262 CG TYR A 290 -8.860 12.073 -0.753 1.00 1.44 C ATOM 263 CD1 TYR A 290 -8.546 12.575 0.496 1.00 1.83 C ATOM 264 CD2 TYR A 290 -8.517 12.827 -1.866 1.00 1.76 C ATOM 265 CE1 TYR A 290 -7.905 13.788 0.640 1.00 2.48 C ATOM 266 CE2 TYR A 290 -7.873 14.044 -1.733 1.00 2.20 C ATOM 267 CZ TYR A 290 -7.573 14.520 -0.476 1.00 2.56 C ATOM 268 OH TYR A 290 -6.936 15.733 -0.332 1.00 3.25 O ATOM 0 H TYR A 290 -8.386 8.418 0.165 1.00 0.98 H new ATOM 0 HA TYR A 290 -9.969 10.687 1.195 1.00 1.15 H new ATOM 0 HB2 TYR A 290 -9.011 10.126 -1.600 1.00 1.28 H new ATOM 0 HB3 TYR A 290 -10.550 10.927 -1.354 1.00 1.28 H new ATOM 0 HD1 TYR A 290 -8.808 12.007 1.376 1.00 1.83 H new ATOM 0 HD2 TYR A 290 -8.757 12.458 -2.852 1.00 1.76 H new ATOM 0 HE1 TYR A 290 -7.665 14.161 1.625 1.00 2.48 H new ATOM 0 HE2 TYR A 290 -7.607 14.617 -2.609 1.00 2.20 H new ATOM 0 HH TYR A 290 -6.771 16.123 -1.216 1.00 3.25 H new ATOM 278 N GLU A 291 -12.092 9.425 0.682 1.00 1.23 N ATOM 279 CA GLU A 291 -13.254 8.567 0.633 1.00 1.20 C ATOM 280 C GLU A 291 -14.289 9.137 -0.310 1.00 1.30 C ATOM 281 O GLU A 291 -14.953 10.133 -0.014 1.00 1.51 O ATOM 282 CB GLU A 291 -13.804 8.363 2.036 1.00 1.33 C ATOM 283 CG GLU A 291 -12.850 7.555 2.894 1.00 1.29 C ATOM 284 CD GLU A 291 -13.228 7.550 4.359 1.00 1.48 C ATOM 285 OE1 GLU A 291 -12.550 8.246 5.149 1.00 1.75 O ATOM 286 OE2 GLU A 291 -14.196 6.861 4.737 1.00 1.50 O ATOM 0 H GLU A 291 -12.258 10.345 1.089 1.00 1.23 H new ATOM 0 HA GLU A 291 -12.971 7.589 0.244 1.00 1.20 H new ATOM 0 HB2 GLU A 291 -13.983 9.332 2.502 1.00 1.33 H new ATOM 0 HB3 GLU A 291 -14.766 7.853 1.980 1.00 1.33 H new ATOM 0 HG2 GLU A 291 -12.823 6.528 2.529 1.00 1.29 H new ATOM 0 HG3 GLU A 291 -11.843 7.959 2.786 1.00 1.29 H new ATOM 293 N LYS A 292 -14.412 8.487 -1.451 1.00 1.22 N ATOM 294 CA LYS A 292 -15.218 8.995 -2.545 1.00 1.37 C ATOM 295 C LYS A 292 -16.329 8.012 -2.863 1.00 1.44 C ATOM 296 O LYS A 292 -16.073 6.866 -3.226 1.00 1.37 O ATOM 297 CB LYS A 292 -14.328 9.227 -3.771 1.00 1.38 C ATOM 298 CG LYS A 292 -15.048 9.832 -4.965 1.00 1.71 C ATOM 299 CD LYS A 292 -14.079 10.137 -6.101 1.00 1.63 C ATOM 300 CE LYS A 292 -13.428 8.872 -6.645 1.00 2.40 C ATOM 301 NZ LYS A 292 -12.414 9.172 -7.691 1.00 2.97 N ATOM 0 H LYS A 292 -13.958 7.595 -1.646 1.00 1.22 H new ATOM 0 HA LYS A 292 -15.671 9.944 -2.259 1.00 1.37 H new ATOM 0 HB2 LYS A 292 -13.505 9.883 -3.488 1.00 1.38 H new ATOM 0 HB3 LYS A 292 -13.889 8.276 -4.071 1.00 1.38 H new ATOM 0 HG2 LYS A 292 -15.817 9.144 -5.315 1.00 1.71 H new ATOM 0 HG3 LYS A 292 -15.555 10.748 -4.661 1.00 1.71 H new ATOM 0 HD2 LYS A 292 -14.610 10.647 -6.905 1.00 1.63 H new ATOM 0 HD3 LYS A 292 -13.307 10.820 -5.746 1.00 1.63 H new ATOM 0 HE2 LYS A 292 -12.955 8.327 -5.828 1.00 2.40 H new ATOM 0 HE3 LYS A 292 -14.196 8.219 -7.061 1.00 2.40 H new ATOM 0 HZ1 LYS A 292 -11.996 8.284 -8.034 1.00 2.97 H new ATOM 0 HZ2 LYS A 292 -12.869 9.669 -8.483 1.00 2.97 H new ATOM 0 HZ3 LYS A 292 -11.667 9.773 -7.288 1.00 2.97 H new ATOM 315 N GLY A 293 -17.559 8.471 -2.727 1.00 1.62 N ATOM 316 CA GLY A 293 -18.693 7.595 -2.905 1.00 1.74 C ATOM 317 C GLY A 293 -19.088 6.939 -1.596 1.00 1.68 C ATOM 318 O GLY A 293 -18.404 7.116 -0.586 1.00 1.58 O ATOM 0 H GLY A 293 -17.793 9.436 -2.496 1.00 1.62 H new ATOM 0 HA2 GLY A 293 -19.536 8.162 -3.300 1.00 1.74 H new ATOM 0 HA3 GLY A 293 -18.452 6.828 -3.641 1.00 1.74 H new ATOM 322 N PRO A 294 -20.195 6.191 -1.573 1.00 1.87 N ATOM 323 CA PRO A 294 -20.686 5.548 -0.350 1.00 1.90 C ATOM 324 C PRO A 294 -19.808 4.387 0.124 1.00 1.70 C ATOM 325 O PRO A 294 -19.775 4.077 1.315 1.00 1.75 O ATOM 326 CB PRO A 294 -22.074 5.039 -0.746 1.00 2.19 C ATOM 327 CG PRO A 294 -22.014 4.868 -2.224 1.00 2.44 C ATOM 328 CD PRO A 294 -21.067 5.922 -2.731 1.00 2.18 C ATOM 0 HA PRO A 294 -20.688 6.246 0.487 1.00 1.90 H new ATOM 0 HB2 PRO A 294 -22.306 4.097 -0.249 1.00 2.19 H new ATOM 0 HB3 PRO A 294 -22.851 5.749 -0.462 1.00 2.19 H new ATOM 0 HG2 PRO A 294 -21.662 3.870 -2.486 1.00 2.44 H new ATOM 0 HG3 PRO A 294 -23.002 4.985 -2.670 1.00 2.44 H new ATOM 0 HD2 PRO A 294 -20.496 5.568 -3.589 1.00 2.18 H new ATOM 0 HD3 PRO A 294 -21.599 6.819 -3.049 1.00 2.18 H new ATOM 336 N ASP A 295 -19.103 3.746 -0.806 1.00 1.64 N ATOM 337 CA ASP A 295 -18.360 2.533 -0.483 1.00 1.65 C ATOM 338 C ASP A 295 -16.868 2.673 -0.756 1.00 1.41 C ATOM 339 O ASP A 295 -16.051 1.945 -0.193 1.00 1.47 O ATOM 340 CB ASP A 295 -18.899 1.368 -1.310 1.00 2.02 C ATOM 341 CG ASP A 295 -18.274 0.056 -0.928 1.00 2.30 C ATOM 342 OD1 ASP A 295 -17.424 -0.442 -1.692 1.00 2.45 O ATOM 343 OD2 ASP A 295 -18.627 -0.467 0.148 1.00 2.60 O ATOM 0 H ASP A 295 -19.031 4.043 -1.779 1.00 1.64 H new ATOM 0 HA ASP A 295 -18.493 2.351 0.584 1.00 1.65 H new ATOM 0 HB2 ASP A 295 -19.979 1.304 -1.181 1.00 2.02 H new ATOM 0 HB3 ASP A 295 -18.715 1.561 -2.367 1.00 2.02 H new ATOM 348 N SER A 296 -16.505 3.623 -1.592 1.00 1.29 N ATOM 349 CA SER A 296 -15.172 3.627 -2.153 1.00 1.13 C ATOM 350 C SER A 296 -14.264 4.630 -1.468 1.00 0.97 C ATOM 351 O SER A 296 -14.691 5.689 -1.014 1.00 1.04 O ATOM 352 CB SER A 296 -15.247 3.902 -3.652 1.00 1.27 C ATOM 353 OG SER A 296 -14.010 3.630 -4.296 1.00 1.59 O ATOM 0 H SER A 296 -17.104 4.391 -1.894 1.00 1.29 H new ATOM 0 HA SER A 296 -14.735 2.642 -1.985 1.00 1.13 H new ATOM 0 HB2 SER A 296 -16.032 3.289 -4.096 1.00 1.27 H new ATOM 0 HB3 SER A 296 -15.523 4.943 -3.818 1.00 1.27 H new ATOM 0 HG SER A 296 -13.483 3.015 -3.745 1.00 1.59 H new ATOM 359 N VAL A 297 -13.001 4.258 -1.402 1.00 0.82 N ATOM 360 CA VAL A 297 -11.984 5.058 -0.769 1.00 0.74 C ATOM 361 C VAL A 297 -10.678 4.955 -1.560 1.00 0.63 C ATOM 362 O VAL A 297 -10.098 3.881 -1.696 1.00 0.60 O ATOM 363 CB VAL A 297 -11.787 4.615 0.695 1.00 0.79 C ATOM 364 CG1 VAL A 297 -11.617 3.107 0.803 1.00 1.03 C ATOM 365 CG2 VAL A 297 -10.606 5.331 1.336 1.00 1.12 C ATOM 0 H VAL A 297 -12.653 3.382 -1.792 1.00 0.82 H new ATOM 0 HA VAL A 297 -12.299 6.101 -0.761 1.00 0.74 H new ATOM 0 HB VAL A 297 -12.690 4.893 1.239 1.00 0.79 H new ATOM 0 HG11 VAL A 297 -11.480 2.830 1.848 1.00 1.03 H new ATOM 0 HG12 VAL A 297 -12.505 2.612 0.409 1.00 1.03 H new ATOM 0 HG13 VAL A 297 -10.744 2.797 0.229 1.00 1.03 H new ATOM 0 HG21 VAL A 297 -10.494 4.997 2.367 1.00 1.12 H new ATOM 0 HG22 VAL A 297 -9.697 5.103 0.780 1.00 1.12 H new ATOM 0 HG23 VAL A 297 -10.781 6.407 1.320 1.00 1.12 H new ATOM 375 N VAL A 298 -10.248 6.067 -2.120 1.00 0.70 N ATOM 376 CA VAL A 298 -9.031 6.108 -2.903 1.00 0.65 C ATOM 377 C VAL A 298 -7.908 6.735 -2.088 1.00 0.62 C ATOM 378 O VAL A 298 -8.032 7.845 -1.576 1.00 0.73 O ATOM 379 CB VAL A 298 -9.231 6.860 -4.242 1.00 0.78 C ATOM 380 CG1 VAL A 298 -10.133 8.070 -4.065 1.00 0.96 C ATOM 381 CG2 VAL A 298 -7.899 7.276 -4.843 1.00 0.81 C ATOM 0 H VAL A 298 -10.730 6.963 -2.046 1.00 0.70 H new ATOM 0 HA VAL A 298 -8.757 5.083 -3.152 1.00 0.65 H new ATOM 0 HB VAL A 298 -9.717 6.171 -4.932 1.00 0.78 H new ATOM 0 HG11 VAL A 298 -10.254 8.577 -5.022 1.00 0.96 H new ATOM 0 HG12 VAL A 298 -11.108 7.747 -3.700 1.00 0.96 H new ATOM 0 HG13 VAL A 298 -9.685 8.756 -3.346 1.00 0.96 H new ATOM 0 HG21 VAL A 298 -8.072 7.802 -5.782 1.00 0.81 H new ATOM 0 HG22 VAL A 298 -7.377 7.935 -4.149 1.00 0.81 H new ATOM 0 HG23 VAL A 298 -7.291 6.390 -5.029 1.00 0.81 H new ATOM 391 N VAL A 299 -6.824 5.999 -1.952 1.00 0.55 N ATOM 392 CA VAL A 299 -5.723 6.422 -1.116 1.00 0.59 C ATOM 393 C VAL A 299 -4.497 6.749 -1.954 1.00 0.60 C ATOM 394 O VAL A 299 -4.266 6.154 -3.005 1.00 0.60 O ATOM 395 CB VAL A 299 -5.400 5.357 -0.055 1.00 0.64 C ATOM 396 CG1 VAL A 299 -4.286 5.831 0.863 1.00 0.75 C ATOM 397 CG2 VAL A 299 -6.656 5.034 0.738 1.00 0.67 C ATOM 0 H VAL A 299 -6.683 5.100 -2.413 1.00 0.55 H new ATOM 0 HA VAL A 299 -6.024 7.332 -0.597 1.00 0.59 H new ATOM 0 HB VAL A 299 -5.054 4.452 -0.553 1.00 0.64 H new ATOM 0 HG11 VAL A 299 -4.074 5.062 1.606 1.00 0.75 H new ATOM 0 HG12 VAL A 299 -3.388 6.025 0.276 1.00 0.75 H new ATOM 0 HG13 VAL A 299 -4.595 6.747 1.367 1.00 0.75 H new ATOM 0 HG21 VAL A 299 -6.427 4.279 1.490 1.00 0.67 H new ATOM 0 HG22 VAL A 299 -7.019 5.937 1.229 1.00 0.67 H new ATOM 0 HG23 VAL A 299 -7.424 4.654 0.064 1.00 0.67 H new ATOM 407 N HIS A 300 -3.732 7.707 -1.475 1.00 0.68 N ATOM 408 CA HIS A 300 -2.616 8.268 -2.210 1.00 0.75 C ATOM 409 C HIS A 300 -1.321 8.037 -1.433 1.00 0.78 C ATOM 410 O HIS A 300 -1.147 8.571 -0.337 1.00 0.87 O ATOM 411 CB HIS A 300 -2.908 9.759 -2.395 1.00 0.93 C ATOM 412 CG HIS A 300 -1.925 10.521 -3.215 1.00 1.23 C ATOM 413 ND1 HIS A 300 -2.081 10.731 -4.566 1.00 1.90 N ATOM 414 CD2 HIS A 300 -0.822 11.203 -2.853 1.00 2.16 C ATOM 415 CE1 HIS A 300 -1.117 11.513 -5.000 1.00 2.59 C ATOM 416 NE2 HIS A 300 -0.335 11.818 -3.979 1.00 2.80 N ATOM 0 H HIS A 300 -3.868 8.123 -0.554 1.00 0.68 H new ATOM 0 HA HIS A 300 -2.493 7.794 -3.184 1.00 0.75 H new ATOM 0 HB2 HIS A 300 -3.891 9.862 -2.854 1.00 0.93 H new ATOM 0 HB3 HIS A 300 -2.966 10.222 -1.410 1.00 0.93 H new ATOM 0 HD1 HIS A 300 -2.828 10.341 -5.141 1.00 1.90 H new ATOM 0 HD2 HIS A 300 -0.399 11.256 -1.861 1.00 2.16 H new ATOM 0 HE1 HIS A 300 -0.986 11.849 -6.018 1.00 2.59 H new ATOM 425 N VAL A 301 -0.423 7.233 -1.993 1.00 0.81 N ATOM 426 CA VAL A 301 0.768 6.815 -1.278 1.00 0.91 C ATOM 427 C VAL A 301 2.042 7.439 -1.846 1.00 0.94 C ATOM 428 O VAL A 301 2.134 7.749 -3.038 1.00 0.89 O ATOM 429 CB VAL A 301 0.901 5.276 -1.270 1.00 0.99 C ATOM 430 CG1 VAL A 301 -0.367 4.645 -0.725 1.00 1.11 C ATOM 431 CG2 VAL A 301 1.209 4.734 -2.659 1.00 1.29 C ATOM 0 H VAL A 301 -0.501 6.860 -2.939 1.00 0.81 H new ATOM 0 HA VAL A 301 0.650 7.172 -0.255 1.00 0.91 H new ATOM 0 HB VAL A 301 1.737 5.015 -0.621 1.00 0.99 H new ATOM 0 HG11 VAL A 301 -0.262 3.560 -0.724 1.00 1.11 H new ATOM 0 HG12 VAL A 301 -0.538 4.994 0.293 1.00 1.11 H new ATOM 0 HG13 VAL A 301 -1.213 4.927 -1.352 1.00 1.11 H new ATOM 0 HG21 VAL A 301 1.296 3.648 -2.615 1.00 1.29 H new ATOM 0 HG22 VAL A 301 0.405 5.006 -3.342 1.00 1.29 H new ATOM 0 HG23 VAL A 301 2.147 5.159 -3.015 1.00 1.29 H new ATOM 441 N TYR A 302 3.009 7.628 -0.960 1.00 1.09 N ATOM 442 CA TYR A 302 4.312 8.171 -1.305 1.00 1.18 C ATOM 443 C TYR A 302 5.189 7.096 -1.949 1.00 1.28 C ATOM 444 O TYR A 302 5.689 6.196 -1.279 1.00 1.61 O ATOM 445 CB TYR A 302 4.980 8.728 -0.032 1.00 1.54 C ATOM 446 CG TYR A 302 5.071 7.722 1.106 1.00 2.55 C ATOM 447 CD1 TYR A 302 3.943 7.390 1.834 1.00 2.70 C ATOM 448 CD2 TYR A 302 6.267 7.090 1.433 1.00 3.50 C ATOM 449 CE1 TYR A 302 3.988 6.464 2.854 1.00 3.77 C ATOM 450 CE2 TYR A 302 6.325 6.162 2.461 1.00 4.60 C ATOM 451 CZ TYR A 302 5.178 5.851 3.166 1.00 4.73 C ATOM 452 OH TYR A 302 5.209 4.927 4.181 1.00 5.84 O ATOM 0 H TYR A 302 2.908 7.405 0.030 1.00 1.09 H new ATOM 0 HA TYR A 302 4.188 8.977 -2.028 1.00 1.18 H new ATOM 0 HB2 TYR A 302 5.984 9.072 -0.281 1.00 1.54 H new ATOM 0 HB3 TYR A 302 4.420 9.599 0.309 1.00 1.54 H new ATOM 0 HD1 TYR A 302 3.004 7.868 1.598 1.00 2.70 H new ATOM 0 HD2 TYR A 302 7.163 7.326 0.878 1.00 3.50 H new ATOM 0 HE1 TYR A 302 3.092 6.221 3.406 1.00 3.77 H new ATOM 0 HE2 TYR A 302 7.261 5.685 2.710 1.00 4.60 H new ATOM 0 HH TYR A 302 5.427 5.375 5.025 1.00 5.84 H new ATOM 462 N VAL A 303 5.349 7.162 -3.257 1.00 1.15 N ATOM 463 CA VAL A 303 6.201 6.220 -3.951 1.00 1.35 C ATOM 464 C VAL A 303 7.374 6.929 -4.607 1.00 1.25 C ATOM 465 O VAL A 303 7.203 7.772 -5.486 1.00 1.26 O ATOM 466 CB VAL A 303 5.392 5.429 -4.987 1.00 1.59 C ATOM 467 CG1 VAL A 303 6.295 4.597 -5.869 1.00 2.15 C ATOM 468 CG2 VAL A 303 4.370 4.551 -4.280 1.00 1.71 C ATOM 0 H VAL A 303 4.902 7.855 -3.857 1.00 1.15 H new ATOM 0 HA VAL A 303 6.602 5.518 -3.219 1.00 1.35 H new ATOM 0 HB VAL A 303 4.868 6.136 -5.630 1.00 1.59 H new ATOM 0 HG11 VAL A 303 5.692 4.048 -6.592 1.00 2.15 H new ATOM 0 HG12 VAL A 303 6.990 5.250 -6.397 1.00 2.15 H new ATOM 0 HG13 VAL A 303 6.855 3.892 -5.254 1.00 2.15 H new ATOM 0 HG21 VAL A 303 3.798 3.991 -5.020 1.00 1.71 H new ATOM 0 HG22 VAL A 303 4.884 3.856 -3.617 1.00 1.71 H new ATOM 0 HG23 VAL A 303 3.695 5.177 -3.696 1.00 1.71 H new ATOM 478 N LYS A 304 8.564 6.591 -4.145 1.00 1.30 N ATOM 479 CA LYS A 304 9.785 7.196 -4.630 1.00 1.28 C ATOM 480 C LYS A 304 10.949 6.217 -4.572 1.00 1.18 C ATOM 481 O LYS A 304 11.036 5.406 -3.654 1.00 1.14 O ATOM 482 CB LYS A 304 10.128 8.417 -3.790 1.00 1.42 C ATOM 483 CG LYS A 304 9.947 8.196 -2.294 1.00 1.50 C ATOM 484 CD LYS A 304 10.264 9.443 -1.476 1.00 1.79 C ATOM 485 CE LYS A 304 11.756 9.589 -1.181 1.00 2.16 C ATOM 486 NZ LYS A 304 12.558 9.876 -2.398 1.00 2.50 N ATOM 0 H LYS A 304 8.708 5.887 -3.421 1.00 1.30 H new ATOM 0 HA LYS A 304 9.621 7.486 -5.668 1.00 1.28 H new ATOM 0 HB2 LYS A 304 11.162 8.703 -3.984 1.00 1.42 H new ATOM 0 HB3 LYS A 304 9.502 9.252 -4.104 1.00 1.42 H new ATOM 0 HG2 LYS A 304 8.920 7.888 -2.097 1.00 1.50 H new ATOM 0 HG3 LYS A 304 10.592 7.379 -1.970 1.00 1.50 H new ATOM 0 HD2 LYS A 304 9.916 10.324 -2.015 1.00 1.79 H new ATOM 0 HD3 LYS A 304 9.714 9.406 -0.536 1.00 1.79 H new ATOM 0 HE2 LYS A 304 11.902 10.391 -0.458 1.00 2.16 H new ATOM 0 HE3 LYS A 304 12.122 8.672 -0.718 1.00 2.16 H new ATOM 0 HZ1 LYS A 304 13.101 9.030 -2.663 1.00 2.50 H new ATOM 0 HZ2 LYS A 304 11.923 10.138 -3.179 1.00 2.50 H new ATOM 0 HZ3 LYS A 304 13.212 10.661 -2.205 1.00 2.50 H new ATOM 500 N GLU A 305 11.839 6.330 -5.558 1.00 1.19 N ATOM 501 CA GLU A 305 13.089 5.559 -5.620 1.00 1.12 C ATOM 502 C GLU A 305 12.860 4.067 -5.375 1.00 1.04 C ATOM 503 O GLU A 305 13.704 3.379 -4.793 1.00 0.96 O ATOM 504 CB GLU A 305 14.095 6.123 -4.613 1.00 1.11 C ATOM 505 CG GLU A 305 14.221 7.632 -4.702 1.00 1.21 C ATOM 506 CD GLU A 305 15.247 8.224 -3.757 1.00 1.72 C ATOM 507 OE1 GLU A 305 16.414 8.376 -4.169 1.00 1.89 O ATOM 508 OE2 GLU A 305 14.900 8.496 -2.588 1.00 2.36 O ATOM 0 H GLU A 305 11.715 6.965 -6.346 1.00 1.19 H new ATOM 0 HA GLU A 305 13.491 5.656 -6.628 1.00 1.12 H new ATOM 0 HB2 GLU A 305 13.789 5.846 -3.604 1.00 1.11 H new ATOM 0 HB3 GLU A 305 15.071 5.669 -4.786 1.00 1.11 H new ATOM 0 HG2 GLU A 305 14.485 7.904 -5.724 1.00 1.21 H new ATOM 0 HG3 GLU A 305 13.249 8.080 -4.493 1.00 1.21 H new ATOM 515 N ILE A 306 11.729 3.573 -5.847 1.00 1.10 N ATOM 516 CA ILE A 306 11.366 2.176 -5.665 1.00 1.06 C ATOM 517 C ILE A 306 12.174 1.277 -6.593 1.00 1.05 C ATOM 518 O ILE A 306 12.349 1.583 -7.774 1.00 1.20 O ATOM 519 CB ILE A 306 9.864 1.947 -5.944 1.00 1.24 C ATOM 520 CG1 ILE A 306 9.003 2.892 -5.099 1.00 1.44 C ATOM 521 CG2 ILE A 306 9.481 0.494 -5.675 1.00 1.16 C ATOM 522 CD1 ILE A 306 9.092 2.655 -3.606 1.00 2.04 C ATOM 0 H ILE A 306 11.041 4.122 -6.363 1.00 1.10 H new ATOM 0 HA ILE A 306 11.584 1.924 -4.627 1.00 1.06 H new ATOM 0 HB ILE A 306 9.679 2.164 -6.996 1.00 1.24 H new ATOM 0 HG12 ILE A 306 9.300 3.920 -5.309 1.00 1.44 H new ATOM 0 HG13 ILE A 306 7.963 2.791 -5.409 1.00 1.44 H new ATOM 0 HG21 ILE A 306 8.419 0.354 -5.878 1.00 1.16 H new ATOM 0 HG22 ILE A 306 10.063 -0.162 -6.322 1.00 1.16 H new ATOM 0 HG23 ILE A 306 9.687 0.251 -4.633 1.00 1.16 H new ATOM 0 HD11 ILE A 306 8.452 3.367 -3.086 1.00 2.04 H new ATOM 0 HD12 ILE A 306 8.766 1.640 -3.379 1.00 2.04 H new ATOM 0 HD13 ILE A 306 10.123 2.787 -3.278 1.00 2.04 H new ATOM 534 N CYS A 307 12.682 0.182 -6.054 1.00 0.95 N ATOM 535 CA CYS A 307 13.298 -0.845 -6.868 1.00 1.01 C ATOM 536 C CYS A 307 12.198 -1.682 -7.505 1.00 1.13 C ATOM 537 O CYS A 307 11.729 -2.668 -6.932 1.00 1.12 O ATOM 538 CB CYS A 307 14.229 -1.718 -6.016 1.00 0.92 C ATOM 539 SG CYS A 307 15.013 -3.083 -6.909 1.00 1.21 S ATOM 0 H CYS A 307 12.679 -0.017 -5.054 1.00 0.95 H new ATOM 0 HA CYS A 307 13.904 -0.387 -7.650 1.00 1.01 H new ATOM 0 HB2 CYS A 307 15.008 -1.086 -5.590 1.00 0.92 H new ATOM 0 HB3 CYS A 307 13.659 -2.127 -5.182 1.00 0.92 H new ATOM 0 HG CYS A 307 14.834 -2.925 -8.187 1.00 1.21 H new ATOM 545 N ARG A 308 11.793 -1.263 -8.692 1.00 1.28 N ATOM 546 CA ARG A 308 10.697 -1.891 -9.420 1.00 1.44 C ATOM 547 C ARG A 308 11.025 -3.337 -9.770 1.00 1.49 C ATOM 548 O ARG A 308 10.142 -4.133 -10.098 1.00 1.59 O ATOM 549 CB ARG A 308 10.399 -1.086 -10.683 1.00 1.61 C ATOM 550 CG ARG A 308 10.100 0.379 -10.400 1.00 1.63 C ATOM 551 CD ARG A 308 8.797 0.557 -9.637 1.00 1.84 C ATOM 552 NE ARG A 308 7.649 0.065 -10.394 1.00 2.52 N ATOM 553 CZ ARG A 308 6.502 0.728 -10.528 1.00 3.04 C ATOM 554 NH1 ARG A 308 6.337 1.915 -9.952 1.00 3.09 N ATOM 555 NH2 ARG A 308 5.523 0.192 -11.246 1.00 3.90 N ATOM 0 H ARG A 308 12.215 -0.474 -9.182 1.00 1.28 H new ATOM 0 HA ARG A 308 9.813 -1.901 -8.782 1.00 1.44 H new ATOM 0 HB2 ARG A 308 11.252 -1.153 -11.359 1.00 1.61 H new ATOM 0 HB3 ARG A 308 9.548 -1.531 -11.198 1.00 1.61 H new ATOM 0 HG2 ARG A 308 10.919 0.812 -9.825 1.00 1.63 H new ATOM 0 HG3 ARG A 308 10.047 0.927 -11.341 1.00 1.63 H new ATOM 0 HD2 ARG A 308 8.858 0.028 -8.686 1.00 1.84 H new ATOM 0 HD3 ARG A 308 8.653 1.612 -9.406 1.00 1.84 H new ATOM 0 HE ARG A 308 7.731 -0.844 -10.849 1.00 2.52 H new ATOM 0 HH11 ARG A 308 7.092 2.325 -9.402 1.00 3.09 H new ATOM 0 HH12 ARG A 308 5.455 2.416 -10.060 1.00 3.09 H new ATOM 0 HH21 ARG A 308 5.654 -0.718 -11.688 1.00 3.90 H new ATOM 0 HH22 ARG A 308 4.640 0.690 -11.356 1.00 3.90 H new ATOM 569 N ASP A 309 12.308 -3.656 -9.718 1.00 1.45 N ATOM 570 CA ASP A 309 12.800 -4.990 -10.011 1.00 1.55 C ATOM 571 C ASP A 309 12.267 -5.996 -9.004 1.00 1.49 C ATOM 572 O ASP A 309 12.066 -7.165 -9.324 1.00 1.62 O ATOM 573 CB ASP A 309 14.327 -4.996 -9.945 1.00 1.55 C ATOM 574 CG ASP A 309 14.945 -3.770 -10.583 1.00 2.10 C ATOM 575 OD1 ASP A 309 15.241 -3.807 -11.796 1.00 2.26 O ATOM 576 OD2 ASP A 309 15.123 -2.757 -9.870 1.00 2.70 O ATOM 0 H ASP A 309 13.041 -2.992 -9.470 1.00 1.45 H new ATOM 0 HA ASP A 309 12.460 -5.268 -11.008 1.00 1.55 H new ATOM 0 HB2 ASP A 309 14.641 -5.055 -8.903 1.00 1.55 H new ATOM 0 HB3 ASP A 309 14.704 -5.889 -10.443 1.00 1.55 H new ATOM 581 N THR A 310 12.035 -5.531 -7.787 1.00 1.33 N ATOM 582 CA THR A 310 11.733 -6.418 -6.677 1.00 1.31 C ATOM 583 C THR A 310 10.395 -6.085 -6.033 1.00 1.27 C ATOM 584 O THR A 310 9.934 -6.781 -5.129 1.00 1.29 O ATOM 585 CB THR A 310 12.852 -6.325 -5.632 1.00 1.23 C ATOM 586 OG1 THR A 310 13.033 -4.961 -5.223 1.00 1.08 O ATOM 587 CG2 THR A 310 14.136 -6.842 -6.230 1.00 1.33 C ATOM 0 H THR A 310 12.050 -4.541 -7.543 1.00 1.33 H new ATOM 0 HA THR A 310 11.667 -7.434 -7.066 1.00 1.31 H new ATOM 0 HB THR A 310 12.580 -6.924 -4.763 1.00 1.23 H new ATOM 0 HG1 THR A 310 13.662 -4.518 -5.830 1.00 1.08 H new ATOM 0 HG21 THR A 310 14.934 -6.777 -5.490 1.00 1.33 H new ATOM 0 HG22 THR A 310 14.004 -7.881 -6.532 1.00 1.33 H new ATOM 0 HG23 THR A 310 14.399 -6.242 -7.101 1.00 1.33 H new ATOM 595 N SER A 311 9.777 -5.025 -6.519 1.00 1.27 N ATOM 596 CA SER A 311 8.548 -4.518 -5.940 1.00 1.27 C ATOM 597 C SER A 311 7.365 -5.446 -6.218 1.00 1.42 C ATOM 598 O SER A 311 7.011 -5.699 -7.373 1.00 1.63 O ATOM 599 CB SER A 311 8.284 -3.115 -6.482 1.00 1.31 C ATOM 600 OG SER A 311 8.222 -3.117 -7.898 1.00 1.60 O ATOM 0 H SER A 311 10.111 -4.493 -7.323 1.00 1.27 H new ATOM 0 HA SER A 311 8.663 -4.474 -4.857 1.00 1.27 H new ATOM 0 HB2 SER A 311 7.347 -2.735 -6.075 1.00 1.31 H new ATOM 0 HB3 SER A 311 9.073 -2.440 -6.151 1.00 1.31 H new ATOM 0 HG SER A 311 7.947 -4.004 -8.212 1.00 1.60 H new ATOM 606 N ARG A 312 6.761 -5.950 -5.149 1.00 1.32 N ATOM 607 CA ARG A 312 5.623 -6.852 -5.253 1.00 1.44 C ATOM 608 C ARG A 312 4.497 -6.372 -4.345 1.00 1.34 C ATOM 609 O ARG A 312 4.745 -5.888 -3.241 1.00 1.20 O ATOM 610 CB ARG A 312 6.023 -8.270 -4.837 1.00 1.50 C ATOM 611 CG ARG A 312 7.278 -8.795 -5.514 1.00 1.95 C ATOM 612 CD ARG A 312 7.676 -10.143 -4.940 1.00 2.00 C ATOM 613 NE ARG A 312 8.987 -10.584 -5.415 1.00 2.30 N ATOM 614 CZ ARG A 312 9.337 -11.862 -5.558 1.00 2.65 C ATOM 615 NH1 ARG A 312 8.461 -12.829 -5.311 1.00 2.66 N ATOM 616 NH2 ARG A 312 10.567 -12.178 -5.943 1.00 3.37 N ATOM 0 H ARG A 312 7.045 -5.746 -4.191 1.00 1.32 H new ATOM 0 HA ARG A 312 5.287 -6.861 -6.290 1.00 1.44 H new ATOM 0 HB2 ARG A 312 6.172 -8.290 -3.757 1.00 1.50 H new ATOM 0 HB3 ARG A 312 5.197 -8.946 -5.057 1.00 1.50 H new ATOM 0 HG2 ARG A 312 7.107 -8.888 -6.586 1.00 1.95 H new ATOM 0 HG3 ARG A 312 8.093 -8.083 -5.382 1.00 1.95 H new ATOM 0 HD2 ARG A 312 7.688 -10.083 -3.852 1.00 2.00 H new ATOM 0 HD3 ARG A 312 6.926 -10.886 -5.210 1.00 2.00 H new ATOM 0 HE ARG A 312 9.676 -9.870 -5.651 1.00 2.30 H new ATOM 0 HH11 ARG A 312 7.515 -12.595 -5.010 1.00 2.66 H new ATOM 0 HH12 ARG A 312 8.734 -13.805 -5.422 1.00 2.66 H new ATOM 0 HH21 ARG A 312 11.248 -11.442 -6.130 1.00 3.37 H new ATOM 0 HH22 ARG A 312 10.832 -13.157 -6.051 1.00 3.37 H new ATOM 630 N VAL A 313 3.264 -6.493 -4.809 1.00 1.45 N ATOM 631 CA VAL A 313 2.114 -6.164 -3.982 1.00 1.38 C ATOM 632 C VAL A 313 1.298 -7.421 -3.708 1.00 1.41 C ATOM 633 O VAL A 313 0.859 -8.101 -4.636 1.00 1.57 O ATOM 634 CB VAL A 313 1.216 -5.111 -4.660 1.00 1.52 C ATOM 635 CG1 VAL A 313 0.090 -4.680 -3.727 1.00 2.19 C ATOM 636 CG2 VAL A 313 2.043 -3.915 -5.103 1.00 2.08 C ATOM 0 H VAL A 313 3.034 -6.815 -5.749 1.00 1.45 H new ATOM 0 HA VAL A 313 2.484 -5.748 -3.045 1.00 1.38 H new ATOM 0 HB VAL A 313 0.765 -5.560 -5.545 1.00 1.52 H new ATOM 0 HG11 VAL A 313 -0.531 -3.936 -4.226 1.00 2.19 H new ATOM 0 HG12 VAL A 313 -0.519 -5.546 -3.467 1.00 2.19 H new ATOM 0 HG13 VAL A 313 0.514 -4.249 -2.820 1.00 2.19 H new ATOM 0 HG21 VAL A 313 1.394 -3.181 -5.580 1.00 2.08 H new ATOM 0 HG22 VAL A 313 2.525 -3.464 -4.235 1.00 2.08 H new ATOM 0 HG23 VAL A 313 2.804 -4.241 -5.812 1.00 2.08 H new ATOM 646 N LEU A 314 1.099 -7.729 -2.437 1.00 1.29 N ATOM 647 CA LEU A 314 0.341 -8.906 -2.052 1.00 1.32 C ATOM 648 C LEU A 314 -0.949 -8.491 -1.365 1.00 1.22 C ATOM 649 O LEU A 314 -0.930 -7.990 -0.244 1.00 1.08 O ATOM 650 CB LEU A 314 1.172 -9.788 -1.115 1.00 1.27 C ATOM 651 CG LEU A 314 2.513 -10.257 -1.683 1.00 1.78 C ATOM 652 CD1 LEU A 314 3.290 -11.031 -0.632 1.00 2.52 C ATOM 653 CD2 LEU A 314 2.298 -11.108 -2.926 1.00 2.19 C ATOM 0 H LEU A 314 1.453 -7.179 -1.654 1.00 1.29 H new ATOM 0 HA LEU A 314 0.099 -9.476 -2.949 1.00 1.32 H new ATOM 0 HB2 LEU A 314 1.359 -9.237 -0.193 1.00 1.27 H new ATOM 0 HB3 LEU A 314 0.582 -10.665 -0.848 1.00 1.27 H new ATOM 0 HG LEU A 314 3.095 -9.380 -1.966 1.00 1.78 H new ATOM 0 HD11 LEU A 314 4.242 -11.358 -1.051 1.00 2.52 H new ATOM 0 HD12 LEU A 314 3.474 -10.390 0.230 1.00 2.52 H new ATOM 0 HD13 LEU A 314 2.713 -11.901 -0.320 1.00 2.52 H new ATOM 0 HD21 LEU A 314 3.263 -11.433 -3.316 1.00 2.19 H new ATOM 0 HD22 LEU A 314 1.698 -11.981 -2.670 1.00 2.19 H new ATOM 0 HD23 LEU A 314 1.779 -10.521 -3.684 1.00 2.19 H new ATOM 665 N PHE A 315 -2.064 -8.700 -2.040 1.00 1.33 N ATOM 666 CA PHE A 315 -3.361 -8.329 -1.498 1.00 1.27 C ATOM 667 C PHE A 315 -4.126 -9.560 -1.042 1.00 1.31 C ATOM 668 O PHE A 315 -3.921 -10.658 -1.563 1.00 1.53 O ATOM 669 CB PHE A 315 -4.180 -7.551 -2.535 1.00 1.50 C ATOM 670 CG PHE A 315 -4.327 -8.251 -3.860 1.00 2.05 C ATOM 671 CD1 PHE A 315 -5.407 -9.086 -4.102 1.00 2.71 C ATOM 672 CD2 PHE A 315 -3.385 -8.077 -4.862 1.00 2.17 C ATOM 673 CE1 PHE A 315 -5.543 -9.732 -5.317 1.00 3.52 C ATOM 674 CE2 PHE A 315 -3.516 -8.720 -6.077 1.00 2.87 C ATOM 675 CZ PHE A 315 -4.601 -9.540 -6.309 1.00 3.57 C ATOM 0 H PHE A 315 -2.099 -9.125 -2.966 1.00 1.33 H new ATOM 0 HA PHE A 315 -3.193 -7.686 -0.634 1.00 1.27 H new ATOM 0 HB2 PHE A 315 -5.172 -7.358 -2.127 1.00 1.50 H new ATOM 0 HB3 PHE A 315 -3.709 -6.582 -2.700 1.00 1.50 H new ATOM 0 HD1 PHE A 315 -6.151 -9.234 -3.333 1.00 2.71 H new ATOM 0 HD2 PHE A 315 -2.537 -7.430 -4.690 1.00 2.17 H new ATOM 0 HE1 PHE A 315 -6.385 -10.386 -5.490 1.00 3.52 H new ATOM 0 HE2 PHE A 315 -2.770 -8.581 -6.845 1.00 2.87 H new ATOM 0 HZ PHE A 315 -4.714 -10.031 -7.264 1.00 3.57 H new ATOM 685 N ARG A 316 -4.989 -9.375 -0.061 1.00 1.15 N ATOM 686 CA ARG A 316 -5.835 -10.445 0.422 1.00 1.21 C ATOM 687 C ARG A 316 -7.250 -9.924 0.650 1.00 1.16 C ATOM 688 O ARG A 316 -7.571 -8.802 0.254 1.00 1.21 O ATOM 689 CB ARG A 316 -5.261 -11.061 1.709 1.00 1.21 C ATOM 690 CG ARG A 316 -5.517 -10.253 2.977 1.00 1.14 C ATOM 691 CD ARG A 316 -4.896 -10.920 4.197 1.00 1.43 C ATOM 692 NE ARG A 316 -5.510 -12.216 4.488 1.00 1.68 N ATOM 693 CZ ARG A 316 -5.560 -12.769 5.702 1.00 2.43 C ATOM 694 NH1 ARG A 316 -5.019 -12.149 6.748 1.00 2.93 N ATOM 695 NH2 ARG A 316 -6.148 -13.949 5.870 1.00 3.21 N ATOM 0 H ARG A 316 -5.122 -8.485 0.419 1.00 1.15 H new ATOM 0 HA ARG A 316 -5.870 -11.231 -0.332 1.00 1.21 H new ATOM 0 HB2 ARG A 316 -5.685 -12.057 1.838 1.00 1.21 H new ATOM 0 HB3 ARG A 316 -4.185 -11.186 1.586 1.00 1.21 H new ATOM 0 HG2 ARG A 316 -5.106 -9.250 2.860 1.00 1.14 H new ATOM 0 HG3 ARG A 316 -6.591 -10.142 3.129 1.00 1.14 H new ATOM 0 HD2 ARG A 316 -3.827 -11.055 4.031 1.00 1.43 H new ATOM 0 HD3 ARG A 316 -5.004 -10.266 5.062 1.00 1.43 H new ATOM 0 HE ARG A 316 -5.927 -12.731 3.712 1.00 1.68 H new ATOM 0 HH11 ARG A 316 -4.562 -11.245 6.625 1.00 2.93 H new ATOM 0 HH12 ARG A 316 -5.061 -12.578 7.673 1.00 2.93 H new ATOM 0 HH21 ARG A 316 -6.561 -14.431 5.072 1.00 3.21 H new ATOM 0 HH22 ARG A 316 -6.187 -14.372 6.797 1.00 3.21 H new ATOM 709 N GLU A 317 -8.078 -10.741 1.285 1.00 1.20 N ATOM 710 CA GLU A 317 -9.484 -10.426 1.519 1.00 1.25 C ATOM 711 C GLU A 317 -9.708 -9.030 2.114 1.00 1.23 C ATOM 712 O GLU A 317 -10.605 -8.312 1.677 1.00 1.41 O ATOM 713 CB GLU A 317 -10.105 -11.476 2.440 1.00 1.33 C ATOM 714 CG GLU A 317 -9.215 -11.865 3.611 1.00 1.39 C ATOM 715 CD GLU A 317 -8.396 -13.108 3.334 1.00 1.65 C ATOM 716 OE1 GLU A 317 -8.735 -14.179 3.872 1.00 2.05 O ATOM 717 OE2 GLU A 317 -7.403 -13.014 2.588 1.00 1.96 O ATOM 0 H GLU A 317 -7.793 -11.648 1.656 1.00 1.20 H new ATOM 0 HA GLU A 317 -9.968 -10.435 0.542 1.00 1.25 H new ATOM 0 HB2 GLU A 317 -11.051 -11.095 2.825 1.00 1.33 H new ATOM 0 HB3 GLU A 317 -10.334 -12.368 1.857 1.00 1.33 H new ATOM 0 HG2 GLU A 317 -8.545 -11.037 3.843 1.00 1.39 H new ATOM 0 HG3 GLU A 317 -9.834 -12.031 4.493 1.00 1.39 H new ATOM 724 N GLN A 318 -8.911 -8.643 3.108 1.00 1.19 N ATOM 725 CA GLN A 318 -9.178 -7.399 3.833 1.00 1.34 C ATOM 726 C GLN A 318 -8.033 -6.395 3.731 1.00 1.29 C ATOM 727 O GLN A 318 -8.225 -5.204 3.969 1.00 1.53 O ATOM 728 CB GLN A 318 -9.437 -7.689 5.312 1.00 1.58 C ATOM 729 CG GLN A 318 -10.409 -8.827 5.565 1.00 1.91 C ATOM 730 CD GLN A 318 -10.646 -9.063 7.040 1.00 2.21 C ATOM 731 OE1 GLN A 318 -9.937 -9.836 7.678 1.00 2.72 O ATOM 732 NE2 GLN A 318 -11.647 -8.398 7.591 1.00 2.17 N ATOM 0 H GLN A 318 -8.091 -9.159 3.426 1.00 1.19 H new ATOM 0 HA GLN A 318 -10.059 -6.959 3.365 1.00 1.34 H new ATOM 0 HB2 GLN A 318 -8.489 -7.923 5.796 1.00 1.58 H new ATOM 0 HB3 GLN A 318 -9.822 -6.786 5.785 1.00 1.58 H new ATOM 0 HG2 GLN A 318 -11.359 -8.606 5.078 1.00 1.91 H new ATOM 0 HG3 GLN A 318 -10.023 -9.739 5.111 1.00 1.91 H new ATOM 0 HE21 GLN A 318 -12.212 -7.765 7.025 1.00 2.17 H new ATOM 0 HE22 GLN A 318 -11.854 -8.518 8.582 1.00 2.17 H new ATOM 741 N ASP A 319 -6.850 -6.859 3.378 1.00 1.12 N ATOM 742 CA ASP A 319 -5.669 -6.010 3.459 1.00 1.13 C ATOM 743 C ASP A 319 -4.657 -6.347 2.380 1.00 1.00 C ATOM 744 O ASP A 319 -4.825 -7.315 1.641 1.00 1.00 O ATOM 745 CB ASP A 319 -5.023 -6.131 4.841 1.00 1.20 C ATOM 746 CG ASP A 319 -4.747 -7.564 5.250 1.00 1.13 C ATOM 747 OD1 ASP A 319 -3.629 -8.055 4.988 1.00 1.13 O ATOM 748 OD2 ASP A 319 -5.646 -8.212 5.820 1.00 1.25 O ATOM 0 H ASP A 319 -6.678 -7.805 3.037 1.00 1.12 H new ATOM 0 HA ASP A 319 -5.993 -4.981 3.300 1.00 1.13 H new ATOM 0 HB2 ASP A 319 -4.087 -5.572 4.847 1.00 1.20 H new ATOM 0 HB3 ASP A 319 -5.676 -5.668 5.581 1.00 1.20 H new ATOM 753 N PHE A 320 -3.616 -5.532 2.286 1.00 0.99 N ATOM 754 CA PHE A 320 -2.570 -5.734 1.294 1.00 0.94 C ATOM 755 C PHE A 320 -1.208 -5.299 1.821 1.00 0.83 C ATOM 756 O PHE A 320 -1.092 -4.334 2.580 1.00 0.93 O ATOM 757 CB PHE A 320 -2.902 -4.996 -0.012 1.00 1.21 C ATOM 758 CG PHE A 320 -3.321 -3.560 0.164 1.00 1.43 C ATOM 759 CD1 PHE A 320 -2.377 -2.544 0.208 1.00 1.43 C ATOM 760 CD2 PHE A 320 -4.661 -3.225 0.271 1.00 1.74 C ATOM 761 CE1 PHE A 320 -2.763 -1.227 0.355 1.00 1.73 C ATOM 762 CE2 PHE A 320 -5.053 -1.909 0.421 1.00 2.02 C ATOM 763 CZ PHE A 320 -4.104 -0.907 0.463 1.00 2.01 C ATOM 0 H PHE A 320 -3.473 -4.721 2.888 1.00 0.99 H new ATOM 0 HA PHE A 320 -2.522 -6.803 1.085 1.00 0.94 H new ATOM 0 HB2 PHE A 320 -2.029 -5.028 -0.663 1.00 1.21 H new ATOM 0 HB3 PHE A 320 -3.701 -5.533 -0.524 1.00 1.21 H new ATOM 0 HD1 PHE A 320 -1.328 -2.787 0.126 1.00 1.43 H new ATOM 0 HD2 PHE A 320 -5.409 -4.003 0.237 1.00 1.74 H new ATOM 0 HE1 PHE A 320 -2.018 -0.446 0.386 1.00 1.73 H new ATOM 0 HE2 PHE A 320 -6.101 -1.664 0.505 1.00 2.02 H new ATOM 0 HZ PHE A 320 -4.408 0.123 0.580 1.00 2.01 H new ATOM 773 N THR A 321 -0.187 -6.028 1.411 1.00 0.74 N ATOM 774 CA THR A 321 1.181 -5.755 1.812 1.00 0.66 C ATOM 775 C THR A 321 2.007 -5.373 0.598 1.00 0.77 C ATOM 776 O THR A 321 1.963 -6.047 -0.432 1.00 0.92 O ATOM 777 CB THR A 321 1.829 -6.985 2.479 1.00 0.64 C ATOM 778 OG1 THR A 321 1.014 -7.458 3.555 1.00 0.68 O ATOM 779 CG2 THR A 321 3.225 -6.666 2.984 1.00 0.70 C ATOM 0 H THR A 321 -0.283 -6.830 0.788 1.00 0.74 H new ATOM 0 HA THR A 321 1.156 -4.936 2.531 1.00 0.66 H new ATOM 0 HB THR A 321 1.911 -7.768 1.725 1.00 0.64 H new ATOM 0 HG1 THR A 321 1.438 -8.240 3.967 1.00 0.68 H new ATOM 0 HG21 THR A 321 3.655 -7.553 3.449 1.00 0.70 H new ATOM 0 HG22 THR A 321 3.852 -6.354 2.149 1.00 0.70 H new ATOM 0 HG23 THR A 321 3.172 -5.862 3.718 1.00 0.70 H new ATOM 787 N LEU A 322 2.742 -4.287 0.714 1.00 0.78 N ATOM 788 CA LEU A 322 3.649 -3.876 -0.339 1.00 0.90 C ATOM 789 C LEU A 322 5.071 -4.218 0.066 1.00 0.80 C ATOM 790 O LEU A 322 5.603 -3.651 1.019 1.00 0.71 O ATOM 791 CB LEU A 322 3.536 -2.372 -0.622 1.00 1.06 C ATOM 792 CG LEU A 322 2.204 -1.893 -1.213 1.00 1.30 C ATOM 793 CD1 LEU A 322 1.112 -1.853 -0.153 1.00 1.80 C ATOM 794 CD2 LEU A 322 2.371 -0.521 -1.849 1.00 1.75 C ATOM 0 H LEU A 322 2.730 -3.672 1.527 1.00 0.78 H new ATOM 0 HA LEU A 322 3.381 -4.408 -1.252 1.00 0.90 H new ATOM 0 HB2 LEU A 322 3.711 -1.834 0.310 1.00 1.06 H new ATOM 0 HB3 LEU A 322 4.336 -2.091 -1.307 1.00 1.06 H new ATOM 0 HG LEU A 322 1.902 -2.605 -1.981 1.00 1.30 H new ATOM 0 HD11 LEU A 322 0.181 -1.510 -0.603 1.00 1.80 H new ATOM 0 HD12 LEU A 322 0.969 -2.852 0.260 1.00 1.80 H new ATOM 0 HD13 LEU A 322 1.404 -1.169 0.644 1.00 1.80 H new ATOM 0 HD21 LEU A 322 1.418 -0.194 -2.264 1.00 1.75 H new ATOM 0 HD22 LEU A 322 2.702 0.192 -1.094 1.00 1.75 H new ATOM 0 HD23 LEU A 322 3.113 -0.577 -2.645 1.00 1.75 H new ATOM 806 N ILE A 323 5.674 -5.150 -0.648 1.00 0.86 N ATOM 807 CA ILE A 323 7.033 -5.564 -0.356 1.00 0.83 C ATOM 808 C ILE A 323 7.940 -5.164 -1.513 1.00 0.89 C ATOM 809 O ILE A 323 7.767 -5.609 -2.647 1.00 1.07 O ATOM 810 CB ILE A 323 7.111 -7.091 -0.046 1.00 0.94 C ATOM 811 CG1 ILE A 323 8.547 -7.542 0.289 1.00 0.97 C ATOM 812 CG2 ILE A 323 6.528 -7.924 -1.184 1.00 1.11 C ATOM 813 CD1 ILE A 323 9.437 -7.819 -0.914 1.00 1.11 C ATOM 0 H ILE A 323 5.243 -5.635 -1.435 1.00 0.86 H new ATOM 0 HA ILE A 323 7.378 -5.055 0.544 1.00 0.83 H new ATOM 0 HB ILE A 323 6.502 -7.262 0.841 1.00 0.94 H new ATOM 0 HG12 ILE A 323 9.019 -6.773 0.900 1.00 0.97 H new ATOM 0 HG13 ILE A 323 8.494 -8.445 0.897 1.00 0.97 H new ATOM 0 HG21 ILE A 323 6.599 -8.982 -0.934 1.00 1.11 H new ATOM 0 HG22 ILE A 323 5.482 -7.656 -1.332 1.00 1.11 H new ATOM 0 HG23 ILE A 323 7.086 -7.730 -2.100 1.00 1.11 H new ATOM 0 HD11 ILE A 323 10.424 -8.129 -0.572 1.00 1.11 H new ATOM 0 HD12 ILE A 323 8.996 -8.612 -1.518 1.00 1.11 H new ATOM 0 HD13 ILE A 323 9.529 -6.914 -1.515 1.00 1.11 H new ATOM 825 N PHE A 324 8.884 -4.289 -1.226 1.00 0.77 N ATOM 826 CA PHE A 324 9.771 -3.766 -2.254 1.00 0.83 C ATOM 827 C PHE A 324 11.059 -3.249 -1.650 1.00 0.71 C ATOM 828 O PHE A 324 11.199 -3.154 -0.433 1.00 0.64 O ATOM 829 CB PHE A 324 9.088 -2.633 -3.036 1.00 0.92 C ATOM 830 CG PHE A 324 8.450 -1.588 -2.165 1.00 0.87 C ATOM 831 CD1 PHE A 324 7.090 -1.627 -1.905 1.00 1.04 C ATOM 832 CD2 PHE A 324 9.207 -0.570 -1.604 1.00 0.86 C ATOM 833 CE1 PHE A 324 6.496 -0.669 -1.103 1.00 1.12 C ATOM 834 CE2 PHE A 324 8.619 0.388 -0.802 1.00 0.91 C ATOM 835 CZ PHE A 324 7.263 0.338 -0.550 1.00 1.01 C ATOM 0 H PHE A 324 9.059 -3.923 -0.290 1.00 0.77 H new ATOM 0 HA PHE A 324 10.002 -4.586 -2.934 1.00 0.83 H new ATOM 0 HB2 PHE A 324 9.825 -2.154 -3.680 1.00 0.92 H new ATOM 0 HB3 PHE A 324 8.327 -3.062 -3.688 1.00 0.92 H new ATOM 0 HD1 PHE A 324 6.487 -2.414 -2.333 1.00 1.04 H new ATOM 0 HD2 PHE A 324 10.269 -0.526 -1.797 1.00 0.86 H new ATOM 0 HE1 PHE A 324 5.434 -0.708 -0.910 1.00 1.12 H new ATOM 0 HE2 PHE A 324 9.220 1.176 -0.372 1.00 0.91 H new ATOM 0 HZ PHE A 324 6.802 1.085 0.079 1.00 1.01 H new ATOM 845 N GLN A 325 11.992 -2.911 -2.513 1.00 0.74 N ATOM 846 CA GLN A 325 13.221 -2.275 -2.091 1.00 0.65 C ATOM 847 C GLN A 325 13.216 -0.840 -2.575 1.00 0.64 C ATOM 848 O GLN A 325 12.516 -0.510 -3.531 1.00 0.75 O ATOM 849 CB GLN A 325 14.439 -3.025 -2.627 1.00 0.75 C ATOM 850 CG GLN A 325 14.616 -4.404 -2.017 1.00 0.92 C ATOM 851 CD GLN A 325 15.812 -5.141 -2.581 1.00 1.34 C ATOM 852 OE1 GLN A 325 16.112 -4.900 -3.847 1.00 1.61 O flip ATOM 853 NE2 GLN A 325 16.453 -5.926 -1.890 1.00 1.62 N flip ATOM 0 H GLN A 325 11.922 -3.067 -3.518 1.00 0.74 H new ATOM 0 HA GLN A 325 13.284 -2.294 -1.003 1.00 0.65 H new ATOM 0 HB2 GLN A 325 14.348 -3.124 -3.709 1.00 0.75 H new ATOM 0 HB3 GLN A 325 15.334 -2.433 -2.435 1.00 0.75 H new ATOM 0 HG2 GLN A 325 14.729 -4.308 -0.937 1.00 0.92 H new ATOM 0 HG3 GLN A 325 13.716 -4.993 -2.192 1.00 0.92 H new ATOM 0 HE21 GLN A 325 16.188 -6.083 -0.918 1.00 1.62 H new ATOM 0 HE22 GLN A 325 17.251 -6.422 -2.288 1.00 1.62 H new ATOM 862 N THR A 326 13.952 0.013 -1.904 1.00 0.59 N ATOM 863 CA THR A 326 14.000 1.408 -2.231 1.00 0.67 C ATOM 864 C THR A 326 15.393 1.926 -1.910 1.00 0.65 C ATOM 865 O THR A 326 16.094 1.318 -1.102 1.00 0.74 O ATOM 866 CB THR A 326 12.925 2.151 -1.409 1.00 0.78 C ATOM 867 OG1 THR A 326 11.628 1.879 -1.949 1.00 1.31 O ATOM 868 CG2 THR A 326 13.182 3.638 -1.369 1.00 0.99 C ATOM 0 H THR A 326 14.537 -0.249 -1.110 1.00 0.59 H new ATOM 0 HA THR A 326 13.797 1.573 -3.289 1.00 0.67 H new ATOM 0 HB THR A 326 12.971 1.787 -0.383 1.00 0.78 H new ATOM 0 HG1 THR A 326 11.698 1.177 -2.630 1.00 1.31 H new ATOM 0 HG21 THR A 326 12.404 4.126 -0.781 1.00 0.99 H new ATOM 0 HG22 THR A 326 14.154 3.827 -0.913 1.00 0.99 H new ATOM 0 HG23 THR A 326 13.174 4.036 -2.384 1.00 0.99 H new ATOM 876 N ARG A 327 15.821 3.005 -2.549 1.00 0.67 N ATOM 877 CA ARG A 327 17.084 3.596 -2.166 1.00 0.69 C ATOM 878 C ARG A 327 16.797 4.913 -1.476 1.00 0.80 C ATOM 879 O ARG A 327 16.307 5.862 -2.084 1.00 0.89 O ATOM 880 CB ARG A 327 18.045 3.777 -3.359 1.00 0.73 C ATOM 881 CG ARG A 327 17.567 4.731 -4.444 1.00 0.86 C ATOM 882 CD ARG A 327 16.645 4.053 -5.447 1.00 1.01 C ATOM 883 NE ARG A 327 17.303 2.963 -6.164 1.00 1.68 N ATOM 884 CZ ARG A 327 16.659 2.102 -6.953 1.00 2.11 C ATOM 885 NH1 ARG A 327 15.347 2.203 -7.122 1.00 2.04 N ATOM 886 NH2 ARG A 327 17.324 1.140 -7.577 1.00 3.04 N ATOM 0 H ARG A 327 15.328 3.473 -3.310 1.00 0.67 H new ATOM 0 HA ARG A 327 17.599 2.919 -1.484 1.00 0.69 H new ATOM 0 HB2 ARG A 327 19.003 4.134 -2.981 1.00 0.73 H new ATOM 0 HB3 ARG A 327 18.224 2.801 -3.810 1.00 0.73 H new ATOM 0 HG2 ARG A 327 17.044 5.569 -3.983 1.00 0.86 H new ATOM 0 HG3 ARG A 327 18.430 5.143 -4.968 1.00 0.86 H new ATOM 0 HD2 ARG A 327 15.770 3.665 -4.926 1.00 1.01 H new ATOM 0 HD3 ARG A 327 16.288 4.792 -6.164 1.00 1.01 H new ATOM 0 HE ARG A 327 18.311 2.855 -6.055 1.00 1.68 H new ATOM 0 HH11 ARG A 327 14.827 2.941 -6.648 1.00 2.04 H new ATOM 0 HH12 ARG A 327 14.858 1.542 -7.726 1.00 2.04 H new ATOM 0 HH21 ARG A 327 18.333 1.056 -7.455 1.00 3.04 H new ATOM 0 HH22 ARG A 327 16.827 0.484 -8.179 1.00 3.04 H new ATOM 900 N ASP A 328 17.079 4.953 -0.196 1.00 0.90 N ATOM 901 CA ASP A 328 16.780 6.080 0.614 1.00 1.08 C ATOM 902 C ASP A 328 18.029 6.903 0.841 1.00 1.06 C ATOM 903 O ASP A 328 18.854 6.563 1.680 1.00 1.06 O ATOM 904 CB ASP A 328 16.232 5.583 1.946 1.00 1.37 C ATOM 905 CG ASP A 328 16.664 4.162 2.283 1.00 2.25 C ATOM 906 OD1 ASP A 328 15.783 3.320 2.578 1.00 2.82 O ATOM 907 OD2 ASP A 328 17.875 3.883 2.240 1.00 2.55 O ATOM 0 H ASP A 328 17.528 4.187 0.307 1.00 0.90 H new ATOM 0 HA ASP A 328 16.041 6.709 0.118 1.00 1.08 H new ATOM 0 HB2 ASP A 328 16.562 6.253 2.740 1.00 1.37 H new ATOM 0 HB3 ASP A 328 15.143 5.628 1.923 1.00 1.37 H new ATOM 912 N GLY A 329 18.151 8.003 0.106 1.00 1.15 N ATOM 913 CA GLY A 329 19.341 8.834 0.197 1.00 1.22 C ATOM 914 C GLY A 329 19.631 9.263 1.621 1.00 1.34 C ATOM 915 O GLY A 329 20.789 9.334 2.036 1.00 1.36 O ATOM 0 H GLY A 329 17.447 8.336 -0.553 1.00 1.15 H new ATOM 0 HA2 GLY A 329 20.196 8.285 -0.197 1.00 1.22 H new ATOM 0 HA3 GLY A 329 19.214 9.718 -0.428 1.00 1.22 H new ATOM 919 N ASN A 330 18.571 9.510 2.375 1.00 1.49 N ATOM 920 CA ASN A 330 18.688 9.914 3.772 1.00 1.69 C ATOM 921 C ASN A 330 19.262 8.775 4.605 1.00 1.61 C ATOM 922 O ASN A 330 20.189 8.968 5.387 1.00 1.71 O ATOM 923 CB ASN A 330 17.306 10.291 4.312 1.00 1.90 C ATOM 924 CG ASN A 330 16.318 10.492 3.186 1.00 2.26 C ATOM 925 OD1 ASN A 330 15.808 9.389 2.665 1.00 3.04 O flip ATOM 926 ND2 ASN A 330 16.042 11.615 2.766 1.00 2.01 N flip ATOM 0 H ASN A 330 17.610 9.437 2.041 1.00 1.49 H new ATOM 0 HA ASN A 330 19.357 10.772 3.836 1.00 1.69 H new ATOM 0 HB2 ASN A 330 16.947 9.508 4.979 1.00 1.90 H new ATOM 0 HB3 ASN A 330 17.380 11.204 4.903 1.00 1.90 H new ATOM 0 HD21 ASN A 330 16.460 12.438 3.199 1.00 2.01 H new ATOM 0 HD22 ASN A 330 15.395 11.723 1.985 1.00 2.01 H new ATOM 933 N PHE A 331 18.710 7.584 4.417 1.00 1.48 N ATOM 934 CA PHE A 331 19.110 6.421 5.189 1.00 1.47 C ATOM 935 C PHE A 331 20.457 5.876 4.734 1.00 1.31 C ATOM 936 O PHE A 331 21.316 5.590 5.559 1.00 1.42 O ATOM 937 CB PHE A 331 18.044 5.330 5.117 1.00 1.46 C ATOM 938 CG PHE A 331 16.845 5.589 5.988 1.00 1.64 C ATOM 939 CD1 PHE A 331 16.369 4.618 6.855 1.00 1.90 C ATOM 940 CD2 PHE A 331 16.196 6.811 5.941 1.00 2.14 C ATOM 941 CE1 PHE A 331 15.271 4.861 7.658 1.00 2.38 C ATOM 942 CE2 PHE A 331 15.097 7.061 6.739 1.00 2.84 C ATOM 943 CZ PHE A 331 14.622 6.050 7.595 1.00 2.87 C ATOM 0 H PHE A 331 17.979 7.400 3.730 1.00 1.48 H new ATOM 0 HA PHE A 331 19.215 6.742 6.225 1.00 1.47 H new ATOM 0 HB2 PHE A 331 17.714 5.226 4.083 1.00 1.46 H new ATOM 0 HB3 PHE A 331 18.492 4.379 5.406 1.00 1.46 H new ATOM 0 HD1 PHE A 331 16.863 3.659 6.904 1.00 1.90 H new ATOM 0 HD2 PHE A 331 16.554 7.579 5.271 1.00 2.14 H new ATOM 0 HE1 PHE A 331 14.927 4.098 8.341 1.00 2.38 H new ATOM 0 HE2 PHE A 331 14.607 8.023 6.706 1.00 2.84 H new ATOM 0 HZ PHE A 331 13.744 6.221 8.200 1.00 2.87 H new ATOM 953 N LEU A 332 20.646 5.735 3.423 1.00 1.12 N ATOM 954 CA LEU A 332 21.876 5.149 2.896 1.00 1.03 C ATOM 955 C LEU A 332 23.087 6.017 3.215 1.00 1.14 C ATOM 956 O LEU A 332 24.187 5.503 3.400 1.00 1.18 O ATOM 957 CB LEU A 332 21.776 4.848 1.384 1.00 0.98 C ATOM 958 CG LEU A 332 21.488 6.025 0.438 1.00 1.09 C ATOM 959 CD1 LEU A 332 22.742 6.842 0.155 1.00 1.65 C ATOM 960 CD2 LEU A 332 20.894 5.511 -0.864 1.00 1.46 C ATOM 0 H LEU A 332 19.970 6.016 2.713 1.00 1.12 H new ATOM 0 HA LEU A 332 22.014 4.192 3.400 1.00 1.03 H new ATOM 0 HB2 LEU A 332 22.713 4.388 1.071 1.00 0.98 H new ATOM 0 HB3 LEU A 332 20.992 4.104 1.241 1.00 0.98 H new ATOM 0 HG LEU A 332 20.771 6.681 0.931 1.00 1.09 H new ATOM 0 HD11 LEU A 332 22.497 7.664 -0.517 1.00 1.65 H new ATOM 0 HD12 LEU A 332 23.134 7.242 1.090 1.00 1.65 H new ATOM 0 HD13 LEU A 332 23.494 6.205 -0.311 1.00 1.65 H new ATOM 0 HD21 LEU A 332 20.693 6.351 -1.529 1.00 1.46 H new ATOM 0 HD22 LEU A 332 21.599 4.831 -1.342 1.00 1.46 H new ATOM 0 HD23 LEU A 332 19.964 4.982 -0.656 1.00 1.46 H new ATOM 972 N ARG A 333 22.896 7.331 3.292 1.00 1.24 N ATOM 973 CA ARG A 333 23.983 8.217 3.668 1.00 1.42 C ATOM 974 C ARG A 333 24.397 7.941 5.117 1.00 1.57 C ATOM 975 O ARG A 333 25.546 8.158 5.503 1.00 1.69 O ATOM 976 CB ARG A 333 23.560 9.676 3.482 1.00 1.58 C ATOM 977 CG ARG A 333 22.885 10.289 4.688 1.00 1.77 C ATOM 978 CD ARG A 333 22.322 11.659 4.352 1.00 1.94 C ATOM 979 NE ARG A 333 23.351 12.566 3.839 1.00 2.17 N ATOM 980 CZ ARG A 333 23.580 13.791 4.311 1.00 2.53 C ATOM 981 NH1 ARG A 333 22.857 14.275 5.319 1.00 2.82 N ATOM 982 NH2 ARG A 333 24.532 14.535 3.762 1.00 2.93 N ATOM 0 H ARG A 333 22.009 7.797 3.101 1.00 1.24 H new ATOM 0 HA ARG A 333 24.843 8.031 3.024 1.00 1.42 H new ATOM 0 HB2 ARG A 333 24.441 10.268 3.234 1.00 1.58 H new ATOM 0 HB3 ARG A 333 22.883 9.740 2.630 1.00 1.58 H new ATOM 0 HG2 ARG A 333 22.083 9.636 5.033 1.00 1.77 H new ATOM 0 HG3 ARG A 333 23.600 10.375 5.506 1.00 1.77 H new ATOM 0 HD2 ARG A 333 21.530 11.553 3.611 1.00 1.94 H new ATOM 0 HD3 ARG A 333 21.868 12.093 5.243 1.00 1.94 H new ATOM 0 HE ARG A 333 23.932 12.238 3.068 1.00 2.17 H new ATOM 0 HH11 ARG A 333 22.120 13.707 5.737 1.00 2.82 H new ATOM 0 HH12 ARG A 333 23.040 15.214 5.673 1.00 2.82 H new ATOM 0 HH21 ARG A 333 25.082 14.168 2.985 1.00 2.93 H new ATOM 0 HH22 ARG A 333 24.714 15.474 4.117 1.00 2.93 H new ATOM 996 N LEU A 334 23.442 7.461 5.908 1.00 1.62 N ATOM 997 CA LEU A 334 23.700 7.055 7.287 1.00 1.83 C ATOM 998 C LEU A 334 24.114 5.583 7.358 1.00 1.77 C ATOM 999 O LEU A 334 24.700 5.142 8.345 1.00 1.95 O ATOM 1000 CB LEU A 334 22.446 7.253 8.146 1.00 1.98 C ATOM 1001 CG LEU A 334 21.788 8.630 8.049 1.00 2.10 C ATOM 1002 CD1 LEU A 334 20.564 8.698 8.951 1.00 2.43 C ATOM 1003 CD2 LEU A 334 22.783 9.724 8.407 1.00 2.23 C ATOM 0 H LEU A 334 22.472 7.343 5.614 1.00 1.62 H new ATOM 0 HA LEU A 334 24.512 7.676 7.665 1.00 1.83 H new ATOM 0 HB2 LEU A 334 21.712 6.499 7.864 1.00 1.98 H new ATOM 0 HB3 LEU A 334 22.708 7.068 9.188 1.00 1.98 H new ATOM 0 HG LEU A 334 21.465 8.788 7.020 1.00 2.10 H new ATOM 0 HD11 LEU A 334 20.107 9.684 8.871 1.00 2.43 H new ATOM 0 HD12 LEU A 334 19.844 7.939 8.645 1.00 2.43 H new ATOM 0 HD13 LEU A 334 20.863 8.520 9.984 1.00 2.43 H new ATOM 0 HD21 LEU A 334 22.297 10.697 8.332 1.00 2.23 H new ATOM 0 HD22 LEU A 334 23.138 9.573 9.426 1.00 2.23 H new ATOM 0 HD23 LEU A 334 23.628 9.687 7.719 1.00 2.23 H new ATOM 1015 N HIS A 335 23.796 4.825 6.314 1.00 1.57 N ATOM 1016 CA HIS A 335 24.042 3.385 6.301 1.00 1.57 C ATOM 1017 C HIS A 335 24.611 2.965 4.958 1.00 1.42 C ATOM 1018 O HIS A 335 23.852 2.705 4.024 1.00 1.25 O ATOM 1019 CB HIS A 335 22.752 2.577 6.526 1.00 1.57 C ATOM 1020 CG HIS A 335 22.008 2.874 7.793 1.00 2.04 C ATOM 1021 ND1 HIS A 335 21.091 3.827 8.078 1.00 2.46 N flip ATOM 1022 CD2 HIS A 335 22.126 2.112 8.932 1.00 2.70 C flip ATOM 1023 CE1 HIS A 335 20.673 3.624 9.369 1.00 2.90 C flip ATOM 1024 NE2 HIS A 335 21.316 2.581 9.860 1.00 3.03 N flip ATOM 0 H HIS A 335 23.366 5.184 5.462 1.00 1.57 H new ATOM 0 HA HIS A 335 24.743 3.181 7.110 1.00 1.57 H new ATOM 0 HB2 HIS A 335 22.083 2.755 5.684 1.00 1.57 H new ATOM 0 HB3 HIS A 335 23.004 1.516 6.515 1.00 1.57 H new ATOM 0 HD1 HIS A 335 20.769 4.562 7.448 1.00 2.46 H new ATOM 0 HD2 HIS A 335 22.781 1.261 9.048 1.00 2.70 H new ATOM 0 HE1 HIS A 335 19.941 4.218 9.895 1.00 2.90 H new ATOM 1033 N PRO A 336 25.938 2.901 4.822 1.00 1.54 N ATOM 1034 CA PRO A 336 26.555 2.421 3.589 1.00 1.50 C ATOM 1035 C PRO A 336 26.106 0.996 3.286 1.00 1.49 C ATOM 1036 O PRO A 336 26.222 0.105 4.129 1.00 1.64 O ATOM 1037 CB PRO A 336 28.056 2.468 3.890 1.00 1.74 C ATOM 1038 CG PRO A 336 28.191 3.425 5.023 1.00 1.98 C ATOM 1039 CD PRO A 336 26.937 3.276 5.835 1.00 1.78 C ATOM 0 HA PRO A 336 26.283 3.016 2.717 1.00 1.50 H new ATOM 0 HB2 PRO A 336 28.436 1.482 4.158 1.00 1.74 H new ATOM 0 HB3 PRO A 336 28.623 2.802 3.021 1.00 1.74 H new ATOM 0 HG2 PRO A 336 29.074 3.200 5.622 1.00 1.98 H new ATOM 0 HG3 PRO A 336 28.303 4.447 4.661 1.00 1.98 H new ATOM 0 HD2 PRO A 336 27.041 2.510 6.604 1.00 1.78 H new ATOM 0 HD3 PRO A 336 26.671 4.203 6.342 1.00 1.78 H new ATOM 1047 N GLY A 337 25.578 0.789 2.093 1.00 1.38 N ATOM 1048 CA GLY A 337 25.061 -0.510 1.735 1.00 1.46 C ATOM 1049 C GLY A 337 23.545 -0.559 1.781 1.00 1.34 C ATOM 1050 O GLY A 337 22.941 -1.512 1.283 1.00 1.40 O ATOM 0 H GLY A 337 25.498 1.499 1.365 1.00 1.38 H new ATOM 0 HA2 GLY A 337 25.400 -0.770 0.732 1.00 1.46 H new ATOM 0 HA3 GLY A 337 25.467 -1.260 2.414 1.00 1.46 H new ATOM 1054 N CYS A 338 22.928 0.462 2.379 1.00 1.24 N ATOM 1055 CA CYS A 338 21.474 0.532 2.446 1.00 1.18 C ATOM 1056 C CYS A 338 20.902 0.707 1.045 1.00 1.13 C ATOM 1057 O CYS A 338 21.474 1.415 0.211 1.00 1.14 O ATOM 1058 CB CYS A 338 21.030 1.687 3.350 1.00 1.22 C ATOM 1059 SG CYS A 338 19.263 1.697 3.747 1.00 1.51 S ATOM 0 H CYS A 338 23.412 1.245 2.820 1.00 1.24 H new ATOM 0 HA CYS A 338 21.097 -0.398 2.872 1.00 1.18 H new ATOM 0 HB2 CYS A 338 21.598 1.642 4.279 1.00 1.22 H new ATOM 0 HB3 CYS A 338 21.285 2.629 2.865 1.00 1.22 H new ATOM 0 HG CYS A 338 18.675 2.651 3.087 1.00 1.51 H new ATOM 1065 N GLY A 339 19.782 0.052 0.790 1.00 1.14 N ATOM 1066 CA GLY A 339 19.202 0.057 -0.535 1.00 1.19 C ATOM 1067 C GLY A 339 19.217 -1.329 -1.150 1.00 1.24 C ATOM 1068 O GLY A 339 18.209 -2.025 -1.124 1.00 1.20 O ATOM 0 H GLY A 339 19.261 -0.487 1.482 1.00 1.14 H new ATOM 0 HA2 GLY A 339 18.177 0.423 -0.484 1.00 1.19 H new ATOM 0 HA3 GLY A 339 19.755 0.746 -1.173 1.00 1.19 H new ATOM 1072 N PRO A 340 20.364 -1.767 -1.702 1.00 1.40 N ATOM 1073 CA PRO A 340 20.500 -3.103 -2.299 1.00 1.55 C ATOM 1074 C PRO A 340 20.289 -4.231 -1.289 1.00 1.50 C ATOM 1075 O PRO A 340 19.895 -5.336 -1.657 1.00 1.61 O ATOM 1076 CB PRO A 340 21.943 -3.126 -2.819 1.00 1.80 C ATOM 1077 CG PRO A 340 22.344 -1.693 -2.918 1.00 1.74 C ATOM 1078 CD PRO A 340 21.608 -0.988 -1.819 1.00 1.53 C ATOM 0 HA PRO A 340 19.748 -3.268 -3.070 1.00 1.55 H new ATOM 0 HB2 PRO A 340 22.598 -3.672 -2.140 1.00 1.80 H new ATOM 0 HB3 PRO A 340 22.005 -3.620 -3.788 1.00 1.80 H new ATOM 0 HG2 PRO A 340 23.422 -1.579 -2.803 1.00 1.74 H new ATOM 0 HG3 PRO A 340 22.082 -1.280 -3.892 1.00 1.74 H new ATOM 0 HD2 PRO A 340 22.175 -0.990 -0.888 1.00 1.53 H new ATOM 0 HD3 PRO A 340 21.410 0.054 -2.070 1.00 1.53 H new ATOM 1086 N HIS A 341 20.590 -3.962 -0.022 1.00 1.42 N ATOM 1087 CA HIS A 341 20.383 -4.955 1.034 1.00 1.48 C ATOM 1088 C HIS A 341 19.137 -4.644 1.849 1.00 1.23 C ATOM 1089 O HIS A 341 18.746 -5.421 2.717 1.00 1.29 O ATOM 1090 CB HIS A 341 21.589 -5.010 1.972 1.00 1.76 C ATOM 1091 CG HIS A 341 22.890 -5.166 1.261 1.00 1.97 C ATOM 1092 ND1 HIS A 341 23.631 -4.089 0.840 1.00 2.03 N ATOM 1093 CD2 HIS A 341 23.562 -6.268 0.859 1.00 2.67 C ATOM 1094 CE1 HIS A 341 24.698 -4.515 0.203 1.00 2.64 C ATOM 1095 NE2 HIS A 341 24.687 -5.835 0.201 1.00 3.12 N ATOM 0 H HIS A 341 20.975 -3.074 0.299 1.00 1.42 H new ATOM 0 HA HIS A 341 20.256 -5.921 0.545 1.00 1.48 H new ATOM 0 HB2 HIS A 341 21.617 -4.098 2.568 1.00 1.76 H new ATOM 0 HB3 HIS A 341 21.462 -5.841 2.666 1.00 1.76 H new ATOM 0 HD1 HIS A 341 23.390 -3.110 0.997 1.00 2.03 H new ATOM 0 HD2 HIS A 341 23.270 -7.294 1.024 1.00 2.67 H new ATOM 0 HE1 HIS A 341 25.457 -3.890 -0.244 1.00 2.64 H new ATOM 1104 N THR A 342 18.517 -3.515 1.574 1.00 1.02 N ATOM 1105 CA THR A 342 17.387 -3.077 2.367 1.00 0.85 C ATOM 1106 C THR A 342 16.071 -3.351 1.647 1.00 0.77 C ATOM 1107 O THR A 342 15.790 -2.775 0.597 1.00 0.87 O ATOM 1108 CB THR A 342 17.493 -1.577 2.688 1.00 0.85 C ATOM 1109 OG1 THR A 342 18.844 -1.255 3.051 1.00 0.95 O ATOM 1110 CG2 THR A 342 16.567 -1.205 3.832 1.00 0.94 C ATOM 0 H THR A 342 18.774 -2.887 0.812 1.00 1.02 H new ATOM 0 HA THR A 342 17.403 -3.644 3.298 1.00 0.85 H new ATOM 0 HB THR A 342 17.201 -1.014 1.801 1.00 0.85 H new ATOM 0 HG1 THR A 342 18.886 -0.328 3.366 1.00 0.95 H new ATOM 0 HG21 THR A 342 16.658 -0.139 4.042 1.00 0.94 H new ATOM 0 HG22 THR A 342 15.538 -1.434 3.556 1.00 0.94 H new ATOM 0 HG23 THR A 342 16.839 -1.775 4.720 1.00 0.94 H new ATOM 1118 N THR A 343 15.270 -4.234 2.218 1.00 0.75 N ATOM 1119 CA THR A 343 13.957 -4.530 1.679 1.00 0.69 C ATOM 1120 C THR A 343 12.879 -4.073 2.652 1.00 0.62 C ATOM 1121 O THR A 343 12.936 -4.384 3.831 1.00 0.70 O ATOM 1122 CB THR A 343 13.780 -6.028 1.394 1.00 0.86 C ATOM 1123 OG1 THR A 343 14.920 -6.545 0.692 1.00 1.07 O ATOM 1124 CG2 THR A 343 12.524 -6.249 0.572 1.00 0.90 C ATOM 0 H THR A 343 15.509 -4.760 3.059 1.00 0.75 H new ATOM 0 HA THR A 343 13.863 -3.991 0.736 1.00 0.69 H new ATOM 0 HB THR A 343 13.688 -6.556 2.343 1.00 0.86 H new ATOM 0 HG1 THR A 343 14.792 -7.501 0.519 1.00 1.07 H new ATOM 0 HG21 THR A 343 12.403 -7.314 0.372 1.00 0.90 H new ATOM 0 HG22 THR A 343 11.659 -5.882 1.124 1.00 0.90 H new ATOM 0 HG23 THR A 343 12.607 -5.710 -0.372 1.00 0.90 H new ATOM 1132 N PHE A 344 11.910 -3.333 2.160 1.00 0.56 N ATOM 1133 CA PHE A 344 10.867 -2.775 3.004 1.00 0.56 C ATOM 1134 C PHE A 344 9.523 -3.405 2.716 1.00 0.55 C ATOM 1135 O PHE A 344 9.271 -3.907 1.619 1.00 0.66 O ATOM 1136 CB PHE A 344 10.767 -1.270 2.782 1.00 0.67 C ATOM 1137 CG PHE A 344 11.616 -0.440 3.700 1.00 0.75 C ATOM 1138 CD1 PHE A 344 12.971 -0.280 3.465 1.00 0.78 C ATOM 1139 CD2 PHE A 344 11.049 0.202 4.789 1.00 1.38 C ATOM 1140 CE1 PHE A 344 13.743 0.502 4.301 1.00 1.11 C ATOM 1141 CE2 PHE A 344 11.817 0.982 5.630 1.00 1.80 C ATOM 1142 CZ PHE A 344 13.166 1.134 5.384 1.00 1.59 C ATOM 0 H PHE A 344 11.819 -3.100 1.171 1.00 0.56 H new ATOM 0 HA PHE A 344 11.134 -2.986 4.040 1.00 0.56 H new ATOM 0 HB2 PHE A 344 11.048 -1.050 1.752 1.00 0.67 H new ATOM 0 HB3 PHE A 344 9.726 -0.968 2.900 1.00 0.67 H new ATOM 0 HD1 PHE A 344 13.429 -0.772 2.619 1.00 0.78 H new ATOM 0 HD2 PHE A 344 9.992 0.091 4.982 1.00 1.38 H new ATOM 0 HE1 PHE A 344 14.799 0.619 4.107 1.00 1.11 H new ATOM 0 HE2 PHE A 344 11.363 1.472 6.479 1.00 1.80 H new ATOM 0 HZ PHE A 344 13.769 1.746 6.038 1.00 1.59 H new ATOM 1152 N ARG A 345 8.668 -3.370 3.719 1.00 0.52 N ATOM 1153 CA ARG A 345 7.315 -3.870 3.590 1.00 0.53 C ATOM 1154 C ARG A 345 6.338 -2.939 4.295 1.00 0.60 C ATOM 1155 O ARG A 345 6.564 -2.532 5.439 1.00 0.71 O ATOM 1156 CB ARG A 345 7.227 -5.273 4.177 1.00 0.63 C ATOM 1157 CG ARG A 345 7.860 -5.378 5.553 1.00 0.97 C ATOM 1158 CD ARG A 345 8.797 -6.562 5.633 1.00 1.13 C ATOM 1159 NE ARG A 345 8.116 -7.826 5.345 1.00 1.56 N ATOM 1160 CZ ARG A 345 8.369 -8.978 5.971 1.00 2.17 C ATOM 1161 NH1 ARG A 345 9.234 -9.024 6.976 1.00 2.72 N ATOM 1162 NH2 ARG A 345 7.726 -10.084 5.612 1.00 2.72 N ATOM 0 H ARG A 345 8.891 -2.996 4.642 1.00 0.52 H new ATOM 0 HA ARG A 345 7.050 -3.910 2.533 1.00 0.53 H new ATOM 0 HB2 ARG A 345 6.180 -5.570 4.241 1.00 0.63 H new ATOM 0 HB3 ARG A 345 7.717 -5.975 3.503 1.00 0.63 H new ATOM 0 HG2 ARG A 345 8.407 -4.462 5.776 1.00 0.97 H new ATOM 0 HG3 ARG A 345 7.081 -5.476 6.309 1.00 0.97 H new ATOM 0 HD2 ARG A 345 9.616 -6.423 4.927 1.00 1.13 H new ATOM 0 HD3 ARG A 345 9.238 -6.607 6.629 1.00 1.13 H new ATOM 0 HE ARG A 345 7.401 -7.826 4.618 1.00 1.56 H new ATOM 0 HH11 ARG A 345 9.712 -8.175 7.277 1.00 2.72 H new ATOM 0 HH12 ARG A 345 9.421 -9.909 7.448 1.00 2.72 H new ATOM 0 HH21 ARG A 345 7.039 -10.053 4.858 1.00 2.72 H new ATOM 0 HH22 ARG A 345 7.919 -10.964 6.090 1.00 2.72 H new ATOM 1176 N TRP A 346 5.270 -2.587 3.607 1.00 0.68 N ATOM 1177 CA TRP A 346 4.237 -1.756 4.187 1.00 0.87 C ATOM 1178 C TRP A 346 2.899 -2.466 4.090 1.00 0.83 C ATOM 1179 O TRP A 346 2.530 -2.971 3.031 1.00 0.82 O ATOM 1180 CB TRP A 346 4.171 -0.398 3.493 1.00 1.20 C ATOM 1181 CG TRP A 346 3.087 0.479 4.037 1.00 1.26 C ATOM 1182 CD1 TRP A 346 1.791 0.517 3.621 1.00 1.31 C ATOM 1183 CD2 TRP A 346 3.195 1.426 5.105 1.00 1.83 C ATOM 1184 NE1 TRP A 346 1.088 1.439 4.354 1.00 1.85 N ATOM 1185 CE2 TRP A 346 1.927 2.011 5.271 1.00 2.27 C ATOM 1186 CE3 TRP A 346 4.237 1.838 5.936 1.00 2.19 C ATOM 1187 CZ2 TRP A 346 1.674 2.989 6.230 1.00 3.10 C ATOM 1188 CZ3 TRP A 346 3.987 2.809 6.889 1.00 3.00 C ATOM 1189 CH2 TRP A 346 2.714 3.374 7.028 1.00 3.46 C ATOM 0 H TRP A 346 5.096 -2.866 2.641 1.00 0.68 H new ATOM 0 HA TRP A 346 4.478 -1.582 5.236 1.00 0.87 H new ATOM 0 HB2 TRP A 346 5.130 0.108 3.602 1.00 1.20 H new ATOM 0 HB3 TRP A 346 4.009 -0.548 2.426 1.00 1.20 H new ATOM 0 HD1 TRP A 346 1.377 -0.090 2.830 1.00 1.31 H new ATOM 0 HE1 TRP A 346 0.100 1.662 4.235 1.00 1.85 H new ATOM 0 HE3 TRP A 346 5.222 1.406 5.837 1.00 2.19 H new ATOM 0 HZ2 TRP A 346 0.693 3.427 6.339 1.00 3.10 H new ATOM 0 HZ3 TRP A 346 4.787 3.136 7.536 1.00 3.00 H new ATOM 0 HH2 TRP A 346 2.550 4.130 7.782 1.00 3.46 H new ATOM 1200 N GLN A 347 2.184 -2.514 5.191 1.00 0.92 N ATOM 1201 CA GLN A 347 0.967 -3.292 5.259 1.00 0.94 C ATOM 1202 C GLN A 347 -0.201 -2.410 5.698 1.00 1.23 C ATOM 1203 O GLN A 347 -0.193 -1.845 6.791 1.00 1.48 O ATOM 1204 CB GLN A 347 1.182 -4.463 6.223 1.00 0.98 C ATOM 1205 CG GLN A 347 0.363 -5.708 5.913 1.00 1.10 C ATOM 1206 CD GLN A 347 -1.118 -5.522 6.139 1.00 1.34 C ATOM 1207 OE1 GLN A 347 -1.613 -5.755 7.233 1.00 1.68 O ATOM 1208 NE2 GLN A 347 -1.833 -5.120 5.103 1.00 1.83 N ATOM 0 H GLN A 347 2.424 -2.023 6.052 1.00 0.92 H new ATOM 0 HA GLN A 347 0.721 -3.689 4.274 1.00 0.94 H new ATOM 0 HB2 GLN A 347 2.239 -4.730 6.217 1.00 0.98 H new ATOM 0 HB3 GLN A 347 0.943 -4.131 7.233 1.00 0.98 H new ATOM 0 HG2 GLN A 347 0.531 -5.996 4.875 1.00 1.10 H new ATOM 0 HG3 GLN A 347 0.717 -6.531 6.534 1.00 1.10 H new ATOM 0 HE21 GLN A 347 -1.377 -4.937 4.209 1.00 1.83 H new ATOM 0 HE22 GLN A 347 -2.841 -4.992 5.197 1.00 1.83 H new ATOM 1217 N VAL A 348 -1.190 -2.280 4.826 1.00 1.29 N ATOM 1218 CA VAL A 348 -2.403 -1.537 5.137 1.00 1.62 C ATOM 1219 C VAL A 348 -3.572 -2.489 5.326 1.00 1.60 C ATOM 1220 O VAL A 348 -3.837 -3.329 4.463 1.00 1.47 O ATOM 1221 CB VAL A 348 -2.751 -0.522 4.025 1.00 1.87 C ATOM 1222 CG1 VAL A 348 -4.237 -0.201 4.030 1.00 2.19 C ATOM 1223 CG2 VAL A 348 -1.944 0.749 4.203 1.00 2.07 C ATOM 0 H VAL A 348 -1.175 -2.683 3.889 1.00 1.29 H new ATOM 0 HA VAL A 348 -2.219 -0.989 6.061 1.00 1.62 H new ATOM 0 HB VAL A 348 -2.500 -0.971 3.064 1.00 1.87 H new ATOM 0 HG11 VAL A 348 -4.457 0.515 3.239 1.00 2.19 H new ATOM 0 HG12 VAL A 348 -4.807 -1.115 3.861 1.00 2.19 H new ATOM 0 HG13 VAL A 348 -4.514 0.227 4.994 1.00 2.19 H new ATOM 0 HG21 VAL A 348 -2.199 1.455 3.413 1.00 2.07 H new ATOM 0 HG22 VAL A 348 -2.171 1.192 5.173 1.00 2.07 H new ATOM 0 HG23 VAL A 348 -0.881 0.515 4.151 1.00 2.07 H new ATOM 1233 N LYS A 349 -4.269 -2.359 6.445 1.00 1.80 N ATOM 1234 CA LYS A 349 -5.408 -3.215 6.721 1.00 1.85 C ATOM 1235 C LYS A 349 -6.699 -2.433 6.629 1.00 2.22 C ATOM 1236 O LYS A 349 -6.881 -1.425 7.308 1.00 2.63 O ATOM 1237 CB LYS A 349 -5.308 -3.853 8.100 1.00 2.07 C ATOM 1238 CG LYS A 349 -3.966 -4.490 8.370 1.00 2.07 C ATOM 1239 CD LYS A 349 -4.063 -5.589 9.415 1.00 2.29 C ATOM 1240 CE LYS A 349 -4.772 -6.810 8.851 1.00 2.67 C ATOM 1241 NZ LYS A 349 -4.879 -7.905 9.844 1.00 3.18 N ATOM 0 H LYS A 349 -4.066 -1.672 7.172 1.00 1.80 H new ATOM 0 HA LYS A 349 -5.404 -4.005 5.970 1.00 1.85 H new ATOM 0 HB2 LYS A 349 -5.501 -3.094 8.858 1.00 2.07 H new ATOM 0 HB3 LYS A 349 -6.087 -4.609 8.200 1.00 2.07 H new ATOM 0 HG2 LYS A 349 -3.567 -4.903 7.444 1.00 2.07 H new ATOM 0 HG3 LYS A 349 -3.263 -3.728 8.708 1.00 2.07 H new ATOM 0 HD2 LYS A 349 -3.064 -5.866 9.751 1.00 2.29 H new ATOM 0 HD3 LYS A 349 -4.602 -5.221 10.288 1.00 2.29 H new ATOM 0 HE2 LYS A 349 -5.770 -6.526 8.517 1.00 2.67 H new ATOM 0 HE3 LYS A 349 -4.232 -7.168 7.974 1.00 2.67 H new ATOM 0 HZ1 LYS A 349 -5.369 -8.716 9.415 1.00 3.18 H new ATOM 0 HZ2 LYS A 349 -3.927 -8.195 10.145 1.00 3.18 H new ATOM 0 HZ3 LYS A 349 -5.417 -7.573 10.670 1.00 3.18 H new ATOM 1255 N LEU A 350 -7.592 -2.907 5.789 1.00 2.25 N ATOM 1256 CA LEU A 350 -8.901 -2.301 5.652 1.00 2.70 C ATOM 1257 C LEU A 350 -9.915 -3.119 6.433 1.00 2.71 C ATOM 1258 O LEU A 350 -9.934 -4.346 6.353 1.00 2.61 O ATOM 1259 CB LEU A 350 -9.297 -2.201 4.177 1.00 3.11 C ATOM 1260 CG LEU A 350 -8.360 -1.346 3.319 1.00 3.82 C ATOM 1261 CD1 LEU A 350 -8.809 -1.354 1.868 1.00 4.37 C ATOM 1262 CD2 LEU A 350 -8.300 0.079 3.847 1.00 4.52 C ATOM 0 H LEU A 350 -7.436 -3.715 5.186 1.00 2.25 H new ATOM 0 HA LEU A 350 -8.875 -1.289 6.055 1.00 2.70 H new ATOM 0 HB2 LEU A 350 -9.336 -3.206 3.757 1.00 3.11 H new ATOM 0 HB3 LEU A 350 -10.304 -1.789 4.112 1.00 3.11 H new ATOM 0 HG LEU A 350 -7.360 -1.776 3.374 1.00 3.82 H new ATOM 0 HD11 LEU A 350 -8.131 -0.741 1.274 1.00 4.37 H new ATOM 0 HD12 LEU A 350 -8.800 -2.376 1.490 1.00 4.37 H new ATOM 0 HD13 LEU A 350 -9.819 -0.950 1.797 1.00 4.37 H new ATOM 0 HD21 LEU A 350 -7.629 0.670 3.224 1.00 4.52 H new ATOM 0 HD22 LEU A 350 -9.297 0.518 3.824 1.00 4.52 H new ATOM 0 HD23 LEU A 350 -7.930 0.072 4.872 1.00 4.52 H new ATOM 1274 N ARG A 351 -10.751 -2.439 7.196 1.00 3.14 N ATOM 1275 CA ARG A 351 -11.659 -3.120 8.095 1.00 3.36 C ATOM 1276 C ARG A 351 -12.947 -3.499 7.375 1.00 3.30 C ATOM 1277 O ARG A 351 -13.409 -2.778 6.484 1.00 3.63 O ATOM 1278 CB ARG A 351 -11.949 -2.255 9.330 1.00 4.12 C ATOM 1279 CG ARG A 351 -10.784 -2.171 10.316 1.00 4.71 C ATOM 1280 CD ARG A 351 -9.630 -1.319 9.795 1.00 5.40 C ATOM 1281 NE ARG A 351 -9.973 0.103 9.741 1.00 5.87 N ATOM 1282 CZ ARG A 351 -9.245 1.032 9.112 1.00 6.64 C ATOM 1283 NH1 ARG A 351 -8.136 0.692 8.462 1.00 7.03 N ATOM 1284 NH2 ARG A 351 -9.626 2.302 9.144 1.00 7.28 N ATOM 0 H ARG A 351 -10.819 -1.421 7.210 1.00 3.14 H new ATOM 0 HA ARG A 351 -11.182 -4.040 8.434 1.00 3.36 H new ATOM 0 HB2 ARG A 351 -12.209 -1.248 9.003 1.00 4.12 H new ATOM 0 HB3 ARG A 351 -12.821 -2.657 9.846 1.00 4.12 H new ATOM 0 HG2 ARG A 351 -11.141 -1.755 11.258 1.00 4.71 H new ATOM 0 HG3 ARG A 351 -10.420 -3.176 10.529 1.00 4.71 H new ATOM 0 HD2 ARG A 351 -8.760 -1.457 10.437 1.00 5.40 H new ATOM 0 HD3 ARG A 351 -9.349 -1.661 8.799 1.00 5.40 H new ATOM 0 HE ARG A 351 -10.824 0.406 10.215 1.00 5.87 H new ATOM 0 HH11 ARG A 351 -7.836 -0.283 8.441 1.00 7.03 H new ATOM 0 HH12 ARG A 351 -7.586 1.406 7.984 1.00 7.03 H new ATOM 0 HH21 ARG A 351 -10.472 2.568 9.647 1.00 7.28 H new ATOM 0 HH22 ARG A 351 -9.073 3.013 8.665 1.00 7.28 H new ATOM 1298 N ASN A 352 -13.496 -4.651 7.758 1.00 3.11 N ATOM 1299 CA ASN A 352 -14.693 -5.217 7.135 1.00 3.07 C ATOM 1300 C ASN A 352 -14.415 -5.626 5.691 1.00 2.54 C ATOM 1301 O ASN A 352 -15.288 -5.523 4.831 1.00 2.97 O ATOM 1302 CB ASN A 352 -15.885 -4.247 7.204 1.00 3.40 C ATOM 1303 CG ASN A 352 -16.345 -3.992 8.625 1.00 3.96 C ATOM 1304 OD1 ASN A 352 -15.938 -3.019 9.261 1.00 4.25 O ATOM 1305 ND2 ASN A 352 -17.199 -4.867 9.135 1.00 4.59 N ATOM 0 H ASN A 352 -13.120 -5.222 8.515 1.00 3.11 H new ATOM 0 HA ASN A 352 -14.961 -6.109 7.701 1.00 3.07 H new ATOM 0 HB2 ASN A 352 -15.606 -3.301 6.741 1.00 3.40 H new ATOM 0 HB3 ASN A 352 -16.714 -4.654 6.625 1.00 3.40 H new ATOM 0 HD21 ASN A 352 -17.544 -4.748 10.088 1.00 4.59 H new ATOM 0 HD22 ASN A 352 -17.512 -5.660 8.575 1.00 4.59 H new ATOM 1312 N LEU A 353 -13.177 -6.076 5.455 1.00 1.99 N ATOM 1313 CA LEU A 353 -12.713 -6.628 4.166 1.00 1.68 C ATOM 1314 C LEU A 353 -12.984 -5.720 2.958 1.00 1.33 C ATOM 1315 O LEU A 353 -13.501 -4.607 3.082 1.00 1.33 O ATOM 1316 CB LEU A 353 -13.276 -8.041 3.908 1.00 1.81 C ATOM 1317 CG LEU A 353 -14.792 -8.170 3.744 1.00 2.28 C ATOM 1318 CD1 LEU A 353 -15.118 -8.964 2.490 1.00 2.69 C ATOM 1319 CD2 LEU A 353 -15.402 -8.844 4.966 1.00 2.93 C ATOM 0 H LEU A 353 -12.449 -6.068 6.169 1.00 1.99 H new ATOM 0 HA LEU A 353 -11.630 -6.690 4.269 1.00 1.68 H new ATOM 0 HB2 LEU A 353 -12.804 -8.434 3.007 1.00 1.81 H new ATOM 0 HB3 LEU A 353 -12.970 -8.683 4.734 1.00 1.81 H new ATOM 0 HG LEU A 353 -15.218 -7.171 3.648 1.00 2.28 H new ATOM 0 HD11 LEU A 353 -16.200 -9.049 2.384 1.00 2.69 H new ATOM 0 HD12 LEU A 353 -14.707 -8.453 1.619 1.00 2.69 H new ATOM 0 HD13 LEU A 353 -14.681 -9.960 2.566 1.00 2.69 H new ATOM 0 HD21 LEU A 353 -16.481 -8.929 4.834 1.00 2.93 H new ATOM 0 HD22 LEU A 353 -14.972 -9.838 5.086 1.00 2.93 H new ATOM 0 HD23 LEU A 353 -15.190 -8.248 5.854 1.00 2.93 H new ATOM 1331 N ILE A 354 -12.563 -6.204 1.794 1.00 1.20 N ATOM 1332 CA ILE A 354 -12.721 -5.499 0.530 1.00 1.07 C ATOM 1333 C ILE A 354 -12.946 -6.484 -0.610 1.00 1.07 C ATOM 1334 O ILE A 354 -12.844 -7.694 -0.422 1.00 1.21 O ATOM 1335 CB ILE A 354 -11.479 -4.648 0.201 1.00 1.13 C ATOM 1336 CG1 ILE A 354 -10.195 -5.357 0.655 1.00 1.28 C ATOM 1337 CG2 ILE A 354 -11.605 -3.269 0.820 1.00 1.20 C ATOM 1338 CD1 ILE A 354 -8.923 -4.625 0.282 1.00 1.55 C ATOM 0 H ILE A 354 -12.098 -7.107 1.702 1.00 1.20 H new ATOM 0 HA ILE A 354 -13.587 -4.845 0.636 1.00 1.07 H new ATOM 0 HB ILE A 354 -11.417 -4.524 -0.880 1.00 1.13 H new ATOM 0 HG12 ILE A 354 -10.225 -5.484 1.737 1.00 1.28 H new ATOM 0 HG13 ILE A 354 -10.169 -6.355 0.218 1.00 1.28 H new ATOM 0 HG21 ILE A 354 -10.720 -2.680 0.579 1.00 1.20 H new ATOM 0 HG22 ILE A 354 -12.491 -2.772 0.424 1.00 1.20 H new ATOM 0 HG23 ILE A 354 -11.695 -3.363 1.902 1.00 1.20 H new ATOM 0 HD11 ILE A 354 -8.061 -5.189 0.637 1.00 1.55 H new ATOM 0 HD12 ILE A 354 -8.867 -4.521 -0.802 1.00 1.55 H new ATOM 0 HD13 ILE A 354 -8.924 -3.636 0.741 1.00 1.55 H new ATOM 1350 N GLU A 355 -13.262 -5.954 -1.789 1.00 1.08 N ATOM 1351 CA GLU A 355 -13.440 -6.781 -2.987 1.00 1.20 C ATOM 1352 C GLU A 355 -12.187 -6.708 -3.855 1.00 1.23 C ATOM 1353 O GLU A 355 -12.111 -5.868 -4.747 1.00 1.21 O ATOM 1354 CB GLU A 355 -14.622 -6.283 -3.826 1.00 1.26 C ATOM 1355 CG GLU A 355 -15.694 -5.548 -3.040 1.00 1.69 C ATOM 1356 CD GLU A 355 -16.372 -6.428 -2.017 1.00 2.01 C ATOM 1357 OE1 GLU A 355 -16.288 -6.112 -0.814 1.00 2.64 O ATOM 1358 OE2 GLU A 355 -16.968 -7.441 -2.414 1.00 2.22 O ATOM 0 H GLU A 355 -13.401 -4.955 -1.944 1.00 1.08 H new ATOM 0 HA GLU A 355 -13.627 -7.804 -2.660 1.00 1.20 H new ATOM 0 HB2 GLU A 355 -14.244 -5.621 -4.605 1.00 1.26 H new ATOM 0 HB3 GLU A 355 -15.079 -7.136 -4.327 1.00 1.26 H new ATOM 0 HG2 GLU A 355 -15.247 -4.691 -2.537 1.00 1.69 H new ATOM 0 HG3 GLU A 355 -16.442 -5.158 -3.730 1.00 1.69 H new ATOM 1365 N PRO A 356 -11.200 -7.591 -3.630 1.00 1.37 N ATOM 1366 CA PRO A 356 -9.884 -7.507 -4.286 1.00 1.47 C ATOM 1367 C PRO A 356 -9.980 -7.444 -5.810 1.00 1.50 C ATOM 1368 O PRO A 356 -9.245 -6.708 -6.461 1.00 1.55 O ATOM 1369 CB PRO A 356 -9.179 -8.793 -3.851 1.00 1.66 C ATOM 1370 CG PRO A 356 -9.858 -9.193 -2.588 1.00 1.62 C ATOM 1371 CD PRO A 356 -11.290 -8.770 -2.743 1.00 1.50 C ATOM 0 HA PRO A 356 -9.357 -6.596 -4.002 1.00 1.47 H new ATOM 0 HB2 PRO A 356 -9.269 -9.569 -4.611 1.00 1.66 H new ATOM 0 HB3 PRO A 356 -8.114 -8.625 -3.691 1.00 1.66 H new ATOM 0 HG2 PRO A 356 -9.783 -10.268 -2.427 1.00 1.62 H new ATOM 0 HG3 PRO A 356 -9.398 -8.709 -1.726 1.00 1.62 H new ATOM 0 HD2 PRO A 356 -11.898 -9.560 -3.184 1.00 1.50 H new ATOM 0 HD3 PRO A 356 -11.742 -8.518 -1.783 1.00 1.50 H new ATOM 1379 N GLU A 357 -10.922 -8.184 -6.365 1.00 1.52 N ATOM 1380 CA GLU A 357 -11.065 -8.299 -7.808 1.00 1.66 C ATOM 1381 C GLU A 357 -11.415 -6.963 -8.431 1.00 1.62 C ATOM 1382 O GLU A 357 -10.984 -6.633 -9.531 1.00 1.77 O ATOM 1383 CB GLU A 357 -12.173 -9.291 -8.104 1.00 1.77 C ATOM 1384 CG GLU A 357 -12.056 -10.548 -7.290 1.00 2.05 C ATOM 1385 CD GLU A 357 -13.131 -11.561 -7.615 1.00 2.54 C ATOM 1386 OE1 GLU A 357 -14.239 -11.463 -7.051 1.00 3.12 O ATOM 1387 OE2 GLU A 357 -12.871 -12.456 -8.444 1.00 2.79 O ATOM 0 H GLU A 357 -11.607 -8.720 -5.833 1.00 1.52 H new ATOM 0 HA GLU A 357 -10.118 -8.635 -8.231 1.00 1.66 H new ATOM 0 HB2 GLU A 357 -13.137 -8.823 -7.906 1.00 1.77 H new ATOM 0 HB3 GLU A 357 -12.154 -9.546 -9.164 1.00 1.77 H new ATOM 0 HG2 GLU A 357 -11.077 -10.996 -7.462 1.00 2.05 H new ATOM 0 HG3 GLU A 357 -12.110 -10.296 -6.231 1.00 2.05 H new ATOM 1394 N GLN A 358 -12.189 -6.201 -7.696 1.00 1.48 N ATOM 1395 CA GLN A 358 -12.766 -4.970 -8.220 1.00 1.50 C ATOM 1396 C GLN A 358 -11.853 -3.754 -8.049 1.00 1.42 C ATOM 1397 O GLN A 358 -12.191 -2.669 -8.520 1.00 1.51 O ATOM 1398 CB GLN A 358 -14.113 -4.691 -7.550 1.00 1.48 C ATOM 1399 CG GLN A 358 -15.102 -5.838 -7.665 1.00 1.58 C ATOM 1400 CD GLN A 358 -16.524 -5.414 -7.346 1.00 1.78 C ATOM 1401 OE1 GLN A 358 -16.940 -5.597 -6.102 1.00 1.94 O flip ATOM 1402 NE2 GLN A 358 -17.254 -4.949 -8.221 1.00 2.20 N flip ATOM 0 H GLN A 358 -12.439 -6.406 -6.729 1.00 1.48 H new ATOM 0 HA GLN A 358 -12.898 -5.126 -9.291 1.00 1.50 H new ATOM 0 HB2 GLN A 358 -13.946 -4.472 -6.495 1.00 1.48 H new ATOM 0 HB3 GLN A 358 -14.552 -3.798 -7.995 1.00 1.48 H new ATOM 0 HG2 GLN A 358 -15.066 -6.245 -8.676 1.00 1.58 H new ATOM 0 HG3 GLN A 358 -14.805 -6.639 -6.988 1.00 1.58 H new ATOM 0 HE21 GLN A 358 -16.898 -4.823 -9.168 1.00 2.20 H new ATOM 0 HE22 GLN A 358 -18.215 -4.690 -7.999 1.00 2.20 H new ATOM 1411 N CYS A 359 -10.713 -3.899 -7.376 1.00 1.30 N ATOM 1412 CA CYS A 359 -9.878 -2.732 -7.118 1.00 1.23 C ATOM 1413 C CYS A 359 -9.037 -2.353 -8.308 1.00 1.25 C ATOM 1414 O CYS A 359 -8.745 -3.173 -9.180 1.00 1.37 O ATOM 1415 CB CYS A 359 -8.992 -2.921 -5.905 1.00 1.22 C ATOM 1416 SG CYS A 359 -7.851 -4.321 -5.964 1.00 1.97 S ATOM 0 H CYS A 359 -10.356 -4.782 -7.011 1.00 1.30 H new ATOM 0 HA CYS A 359 -10.571 -1.915 -6.917 1.00 1.23 H new ATOM 0 HB2 CYS A 359 -8.411 -2.011 -5.760 1.00 1.22 H new ATOM 0 HB3 CYS A 359 -9.630 -3.035 -5.029 1.00 1.22 H new ATOM 0 HG CYS A 359 -8.523 -5.432 -5.895 1.00 1.97 H new ATOM 1422 N THR A 360 -8.662 -1.094 -8.327 1.00 1.18 N ATOM 1423 CA THR A 360 -7.874 -0.557 -9.414 1.00 1.25 C ATOM 1424 C THR A 360 -6.843 0.421 -8.867 1.00 1.16 C ATOM 1425 O THR A 360 -6.895 0.798 -7.694 1.00 1.05 O ATOM 1426 CB THR A 360 -8.772 0.135 -10.461 1.00 1.32 C ATOM 1427 OG1 THR A 360 -7.988 0.613 -11.563 1.00 1.42 O ATOM 1428 CG2 THR A 360 -9.538 1.286 -9.828 1.00 1.24 C ATOM 0 H THR A 360 -8.892 -0.419 -7.598 1.00 1.18 H new ATOM 0 HA THR A 360 -7.359 -1.380 -9.909 1.00 1.25 H new ATOM 0 HB THR A 360 -9.486 -0.599 -10.834 1.00 1.32 H new ATOM 0 HG1 THR A 360 -8.574 1.047 -12.217 1.00 1.42 H new ATOM 0 HG21 THR A 360 -10.166 1.763 -10.581 1.00 1.24 H new ATOM 0 HG22 THR A 360 -10.164 0.906 -9.021 1.00 1.24 H new ATOM 0 HG23 THR A 360 -8.834 2.016 -9.428 1.00 1.24 H new ATOM 1436 N PHE A 361 -5.927 0.844 -9.717 1.00 1.24 N ATOM 1437 CA PHE A 361 -4.862 1.736 -9.306 1.00 1.20 C ATOM 1438 C PHE A 361 -4.833 2.966 -10.198 1.00 1.27 C ATOM 1439 O PHE A 361 -5.409 2.977 -11.288 1.00 1.41 O ATOM 1440 CB PHE A 361 -3.505 1.021 -9.326 1.00 1.32 C ATOM 1441 CG PHE A 361 -3.196 0.313 -10.618 1.00 1.65 C ATOM 1442 CD1 PHE A 361 -2.542 0.970 -11.647 1.00 2.30 C ATOM 1443 CD2 PHE A 361 -3.553 -1.015 -10.798 1.00 1.69 C ATOM 1444 CE1 PHE A 361 -2.251 0.319 -12.831 1.00 3.04 C ATOM 1445 CE2 PHE A 361 -3.267 -1.671 -11.979 1.00 2.28 C ATOM 1446 CZ PHE A 361 -2.615 -1.003 -12.997 1.00 3.01 C ATOM 0 H PHE A 361 -5.900 0.582 -10.702 1.00 1.24 H new ATOM 0 HA PHE A 361 -5.057 2.052 -8.281 1.00 1.20 H new ATOM 0 HB2 PHE A 361 -2.720 1.751 -9.129 1.00 1.32 H new ATOM 0 HB3 PHE A 361 -3.478 0.296 -8.513 1.00 1.32 H new ATOM 0 HD1 PHE A 361 -2.256 2.004 -11.523 1.00 2.30 H new ATOM 0 HD2 PHE A 361 -4.061 -1.543 -10.004 1.00 1.69 H new ATOM 0 HE1 PHE A 361 -1.740 0.843 -13.625 1.00 3.04 H new ATOM 0 HE2 PHE A 361 -3.553 -2.705 -12.106 1.00 2.28 H new ATOM 0 HZ PHE A 361 -2.390 -1.514 -13.922 1.00 3.01 H new ATOM 1456 N CYS A 362 -4.154 3.991 -9.731 1.00 1.21 N ATOM 1457 CA CYS A 362 -4.127 5.276 -10.393 1.00 1.30 C ATOM 1458 C CYS A 362 -2.763 5.924 -10.194 1.00 1.28 C ATOM 1459 O CYS A 362 -2.153 5.783 -9.139 1.00 1.10 O ATOM 1460 CB CYS A 362 -5.245 6.154 -9.822 1.00 1.25 C ATOM 1461 SG CYS A 362 -6.900 5.685 -10.383 1.00 1.74 S ATOM 0 H CYS A 362 -3.601 3.955 -8.875 1.00 1.21 H new ATOM 0 HA CYS A 362 -4.291 5.154 -11.464 1.00 1.30 H new ATOM 0 HB2 CYS A 362 -5.213 6.105 -8.734 1.00 1.25 H new ATOM 0 HB3 CYS A 362 -5.058 7.191 -10.100 1.00 1.25 H new ATOM 0 HG CYS A 362 -7.616 5.316 -9.362 1.00 1.74 H new ATOM 1467 N PHE A 363 -2.258 6.600 -11.205 1.00 1.51 N ATOM 1468 CA PHE A 363 -0.932 7.176 -11.112 1.00 1.52 C ATOM 1469 C PHE A 363 -0.940 8.675 -11.372 1.00 1.64 C ATOM 1470 O PHE A 363 -1.268 9.128 -12.468 1.00 1.92 O ATOM 1471 CB PHE A 363 0.016 6.488 -12.096 1.00 1.77 C ATOM 1472 CG PHE A 363 0.250 5.032 -11.808 1.00 1.76 C ATOM 1473 CD1 PHE A 363 0.436 4.585 -10.508 1.00 1.56 C ATOM 1474 CD2 PHE A 363 0.297 4.112 -12.842 1.00 2.03 C ATOM 1475 CE1 PHE A 363 0.662 3.248 -10.246 1.00 1.66 C ATOM 1476 CE2 PHE A 363 0.521 2.775 -12.587 1.00 2.11 C ATOM 1477 CZ PHE A 363 0.703 2.341 -11.286 1.00 1.94 C ATOM 0 H PHE A 363 -2.738 6.763 -12.090 1.00 1.51 H new ATOM 0 HA PHE A 363 -0.583 7.016 -10.092 1.00 1.52 H new ATOM 0 HB2 PHE A 363 -0.389 6.587 -13.103 1.00 1.77 H new ATOM 0 HB3 PHE A 363 0.974 7.008 -12.085 1.00 1.77 H new ATOM 0 HD1 PHE A 363 0.404 5.291 -9.691 1.00 1.56 H new ATOM 0 HD2 PHE A 363 0.157 4.445 -13.860 1.00 2.03 H new ATOM 0 HE1 PHE A 363 0.806 2.913 -9.230 1.00 1.66 H new ATOM 0 HE2 PHE A 363 0.554 2.068 -13.402 1.00 2.11 H new ATOM 0 HZ PHE A 363 0.877 1.294 -11.084 1.00 1.94 H new ATOM 1487 N THR A 364 -0.581 9.442 -10.355 1.00 1.49 N ATOM 1488 CA THR A 364 -0.288 10.846 -10.534 1.00 1.63 C ATOM 1489 C THR A 364 1.134 11.009 -11.062 1.00 1.61 C ATOM 1490 O THR A 364 1.799 10.010 -11.358 1.00 1.61 O ATOM 1491 CB THR A 364 -0.507 11.626 -9.226 1.00 1.53 C ATOM 1492 OG1 THR A 364 -0.184 10.807 -8.096 1.00 1.24 O ATOM 1493 CG2 THR A 364 -1.949 12.062 -9.124 1.00 1.76 C ATOM 0 H THR A 364 -0.487 9.110 -9.395 1.00 1.49 H new ATOM 0 HA THR A 364 -0.975 11.265 -11.269 1.00 1.63 H new ATOM 0 HB THR A 364 0.143 12.501 -9.233 1.00 1.53 H new ATOM 0 HG1 THR A 364 -0.992 10.352 -7.780 1.00 1.24 H new ATOM 0 HG21 THR A 364 -2.098 12.614 -8.196 1.00 1.76 H new ATOM 0 HG22 THR A 364 -2.196 12.703 -9.970 1.00 1.76 H new ATOM 0 HG23 THR A 364 -2.596 11.185 -9.132 1.00 1.76 H new ATOM 1501 N ALA A 365 1.596 12.243 -11.206 1.00 1.71 N ATOM 1502 CA ALA A 365 2.853 12.505 -11.900 1.00 1.80 C ATOM 1503 C ALA A 365 4.036 11.822 -11.224 1.00 1.56 C ATOM 1504 O ALA A 365 4.899 11.246 -11.892 1.00 1.77 O ATOM 1505 CB ALA A 365 3.100 14.002 -11.986 1.00 1.94 C ATOM 0 H ALA A 365 1.124 13.076 -10.854 1.00 1.71 H new ATOM 0 HA ALA A 365 2.763 12.089 -12.903 1.00 1.80 H new ATOM 0 HB1 ALA A 365 4.040 14.186 -12.506 1.00 1.94 H new ATOM 0 HB2 ALA A 365 2.284 14.474 -12.533 1.00 1.94 H new ATOM 0 HB3 ALA A 365 3.153 14.420 -10.981 1.00 1.94 H new ATOM 1511 N SER A 366 4.076 11.892 -9.905 1.00 1.27 N ATOM 1512 CA SER A 366 5.174 11.316 -9.150 1.00 1.26 C ATOM 1513 C SER A 366 4.688 10.318 -8.103 1.00 1.17 C ATOM 1514 O SER A 366 5.461 9.511 -7.589 1.00 1.40 O ATOM 1515 CB SER A 366 5.912 12.443 -8.454 1.00 1.31 C ATOM 1516 OG SER A 366 6.450 13.360 -9.394 1.00 1.69 O ATOM 0 H SER A 366 3.360 12.342 -9.335 1.00 1.27 H new ATOM 0 HA SER A 366 5.824 10.779 -9.841 1.00 1.26 H new ATOM 0 HB2 SER A 366 5.233 12.965 -7.780 1.00 1.31 H new ATOM 0 HB3 SER A 366 6.715 12.032 -7.842 1.00 1.31 H new ATOM 0 HG SER A 366 6.919 14.078 -8.919 1.00 1.69 H new ATOM 1522 N ARG A 367 3.404 10.375 -7.805 1.00 0.97 N ATOM 1523 CA ARG A 367 2.851 9.674 -6.652 1.00 0.91 C ATOM 1524 C ARG A 367 1.836 8.617 -7.089 1.00 0.83 C ATOM 1525 O ARG A 367 1.407 8.601 -8.242 1.00 0.94 O ATOM 1526 CB ARG A 367 2.221 10.704 -5.712 1.00 1.05 C ATOM 1527 CG ARG A 367 3.153 11.879 -5.426 1.00 1.34 C ATOM 1528 CD ARG A 367 2.451 13.010 -4.695 1.00 2.29 C ATOM 1529 NE ARG A 367 3.291 14.204 -4.595 1.00 3.00 N ATOM 1530 CZ ARG A 367 3.100 15.192 -3.718 1.00 3.86 C ATOM 1531 NH1 ARG A 367 2.117 15.129 -2.828 1.00 4.18 N ATOM 1532 NH2 ARG A 367 3.905 16.244 -3.723 1.00 4.70 N ATOM 0 H ARG A 367 2.718 10.901 -8.346 1.00 0.97 H new ATOM 0 HA ARG A 367 3.646 9.146 -6.125 1.00 0.91 H new ATOM 0 HB2 ARG A 367 1.296 11.076 -6.153 1.00 1.05 H new ATOM 0 HB3 ARG A 367 1.954 10.219 -4.773 1.00 1.05 H new ATOM 0 HG2 ARG A 367 3.997 11.533 -4.829 1.00 1.34 H new ATOM 0 HG3 ARG A 367 3.559 12.254 -6.365 1.00 1.34 H new ATOM 0 HD2 ARG A 367 1.527 13.260 -5.216 1.00 2.29 H new ATOM 0 HD3 ARG A 367 2.173 12.678 -3.695 1.00 2.29 H new ATOM 0 HE ARG A 367 4.077 14.287 -5.240 1.00 3.00 H new ATOM 0 HH11 ARG A 367 1.497 14.319 -2.809 1.00 4.18 H new ATOM 0 HH12 ARG A 367 1.981 15.891 -2.163 1.00 4.18 H new ATOM 0 HH21 ARG A 367 4.669 16.298 -4.396 1.00 4.70 H new ATOM 0 HH22 ARG A 367 3.761 17.000 -3.054 1.00 4.70 H new ATOM 1546 N ILE A 368 1.485 7.709 -6.183 1.00 0.81 N ATOM 1547 CA ILE A 368 0.583 6.613 -6.520 1.00 0.84 C ATOM 1548 C ILE A 368 -0.772 6.748 -5.832 1.00 0.76 C ATOM 1549 O ILE A 368 -0.857 6.994 -4.630 1.00 0.80 O ATOM 1550 CB ILE A 368 1.199 5.246 -6.163 1.00 0.96 C ATOM 1551 CG1 ILE A 368 2.314 4.902 -7.158 1.00 1.12 C ATOM 1552 CG2 ILE A 368 0.130 4.156 -6.141 1.00 1.04 C ATOM 1553 CD1 ILE A 368 2.795 3.465 -7.078 1.00 1.92 C ATOM 0 H ILE A 368 1.809 7.710 -5.216 1.00 0.81 H new ATOM 0 HA ILE A 368 0.430 6.669 -7.598 1.00 0.84 H new ATOM 0 HB ILE A 368 1.629 5.305 -5.163 1.00 0.96 H new ATOM 0 HG12 ILE A 368 1.957 5.099 -8.169 1.00 1.12 H new ATOM 0 HG13 ILE A 368 3.160 5.567 -6.983 1.00 1.12 H new ATOM 0 HG21 ILE A 368 0.589 3.201 -5.887 1.00 1.04 H new ATOM 0 HG22 ILE A 368 -0.627 4.404 -5.397 1.00 1.04 H new ATOM 0 HG23 ILE A 368 -0.337 4.084 -7.123 1.00 1.04 H new ATOM 0 HD11 ILE A 368 3.583 3.304 -7.814 1.00 1.92 H new ATOM 0 HD12 ILE A 368 3.185 3.267 -6.079 1.00 1.92 H new ATOM 0 HD13 ILE A 368 1.963 2.791 -7.283 1.00 1.92 H new ATOM 1565 N ASP A 369 -1.820 6.603 -6.625 1.00 0.78 N ATOM 1566 CA ASP A 369 -3.193 6.599 -6.140 1.00 0.73 C ATOM 1567 C ASP A 369 -3.787 5.197 -6.268 1.00 0.75 C ATOM 1568 O ASP A 369 -3.483 4.482 -7.216 1.00 0.87 O ATOM 1569 CB ASP A 369 -4.029 7.596 -6.940 1.00 0.87 C ATOM 1570 CG ASP A 369 -3.622 9.032 -6.685 1.00 1.23 C ATOM 1571 OD1 ASP A 369 -2.711 9.531 -7.379 1.00 1.66 O ATOM 1572 OD2 ASP A 369 -4.214 9.674 -5.791 1.00 1.58 O ATOM 0 H ASP A 369 -1.742 6.483 -7.635 1.00 0.78 H new ATOM 0 HA ASP A 369 -3.201 6.892 -5.090 1.00 0.73 H new ATOM 0 HB2 ASP A 369 -3.930 7.377 -8.003 1.00 0.87 H new ATOM 0 HB3 ASP A 369 -5.081 7.469 -6.685 1.00 0.87 H new ATOM 1577 N ILE A 370 -4.591 4.775 -5.309 1.00 0.66 N ATOM 1578 CA ILE A 370 -5.256 3.481 -5.409 1.00 0.70 C ATOM 1579 C ILE A 370 -6.737 3.602 -5.066 1.00 0.65 C ATOM 1580 O ILE A 370 -7.091 4.190 -4.046 1.00 0.60 O ATOM 1581 CB ILE A 370 -4.628 2.437 -4.463 1.00 0.74 C ATOM 1582 CG1 ILE A 370 -3.103 2.411 -4.615 1.00 0.83 C ATOM 1583 CG2 ILE A 370 -5.214 1.059 -4.743 1.00 0.84 C ATOM 1584 CD1 ILE A 370 -2.408 1.470 -3.654 1.00 1.38 C ATOM 0 H ILE A 370 -4.800 5.300 -4.460 1.00 0.66 H new ATOM 0 HA ILE A 370 -5.133 3.151 -6.441 1.00 0.70 H new ATOM 0 HB ILE A 370 -4.861 2.717 -3.436 1.00 0.74 H new ATOM 0 HG12 ILE A 370 -2.854 2.121 -5.636 1.00 0.83 H new ATOM 0 HG13 ILE A 370 -2.715 3.419 -4.466 1.00 0.83 H new ATOM 0 HG21 ILE A 370 -4.764 0.329 -4.070 1.00 0.84 H new ATOM 0 HG22 ILE A 370 -6.292 1.083 -4.584 1.00 0.84 H new ATOM 0 HG23 ILE A 370 -5.005 0.778 -5.775 1.00 0.84 H new ATOM 0 HD11 ILE A 370 -1.332 1.507 -3.823 1.00 1.38 H new ATOM 0 HD12 ILE A 370 -2.625 1.771 -2.629 1.00 1.38 H new ATOM 0 HD13 ILE A 370 -2.766 0.453 -3.817 1.00 1.38 H new ATOM 1596 N CYS A 371 -7.598 3.029 -5.898 1.00 0.74 N ATOM 1597 CA CYS A 371 -9.033 3.067 -5.644 1.00 0.75 C ATOM 1598 C CYS A 371 -9.495 1.775 -4.967 1.00 0.77 C ATOM 1599 O CYS A 371 -9.475 0.685 -5.572 1.00 0.92 O ATOM 1600 CB CYS A 371 -9.810 3.300 -6.940 1.00 0.92 C ATOM 1601 SG CYS A 371 -9.189 4.676 -7.935 1.00 1.75 S ATOM 0 H CYS A 371 -7.330 2.535 -6.749 1.00 0.74 H new ATOM 0 HA CYS A 371 -9.235 3.901 -4.971 1.00 0.75 H new ATOM 0 HB2 CYS A 371 -9.779 2.390 -7.539 1.00 0.92 H new ATOM 0 HB3 CYS A 371 -10.856 3.485 -6.696 1.00 0.92 H new ATOM 0 HG CYS A 371 -9.909 4.793 -9.011 1.00 1.75 H new ATOM 1607 N LEU A 372 -9.896 1.910 -3.704 1.00 0.69 N ATOM 1608 CA LEU A 372 -10.306 0.784 -2.877 1.00 0.77 C ATOM 1609 C LEU A 372 -11.829 0.737 -2.713 1.00 0.79 C ATOM 1610 O LEU A 372 -12.470 1.757 -2.463 1.00 0.78 O ATOM 1611 CB LEU A 372 -9.625 0.869 -1.508 1.00 0.80 C ATOM 1612 CG LEU A 372 -8.095 0.935 -1.552 1.00 1.20 C ATOM 1613 CD1 LEU A 372 -7.533 1.248 -0.174 1.00 1.87 C ATOM 1614 CD2 LEU A 372 -7.516 -0.372 -2.079 1.00 2.07 C ATOM 0 H LEU A 372 -9.945 2.810 -3.226 1.00 0.69 H new ATOM 0 HA LEU A 372 -9.998 -0.135 -3.376 1.00 0.77 H new ATOM 0 HB2 LEU A 372 -9.997 1.751 -0.987 1.00 0.80 H new ATOM 0 HB3 LEU A 372 -9.920 0.002 -0.917 1.00 0.80 H new ATOM 0 HG LEU A 372 -7.808 1.737 -2.232 1.00 1.20 H new ATOM 0 HD11 LEU A 372 -6.445 1.291 -0.226 1.00 1.87 H new ATOM 0 HD12 LEU A 372 -7.918 2.209 0.166 1.00 1.87 H new ATOM 0 HD13 LEU A 372 -7.833 0.469 0.527 1.00 1.87 H new ATOM 0 HD21 LEU A 372 -6.428 -0.305 -2.103 1.00 2.07 H new ATOM 0 HD22 LEU A 372 -7.815 -1.192 -1.426 1.00 2.07 H new ATOM 0 HD23 LEU A 372 -7.890 -0.556 -3.086 1.00 2.07 H new ATOM 1626 N ARG A 373 -12.395 -0.450 -2.901 1.00 0.99 N ATOM 1627 CA ARG A 373 -13.845 -0.658 -2.794 1.00 1.11 C ATOM 1628 C ARG A 373 -14.167 -1.839 -1.867 1.00 1.06 C ATOM 1629 O ARG A 373 -13.412 -2.813 -1.812 1.00 1.26 O ATOM 1630 CB ARG A 373 -14.453 -0.891 -4.187 1.00 1.68 C ATOM 1631 CG ARG A 373 -14.034 -2.194 -4.867 1.00 2.22 C ATOM 1632 CD ARG A 373 -12.522 -2.303 -5.039 1.00 2.59 C ATOM 1633 NE ARG A 373 -11.955 -3.363 -4.200 1.00 3.77 N ATOM 1634 CZ ARG A 373 -10.872 -3.242 -3.420 1.00 4.77 C ATOM 1635 NH1 ARG A 373 -10.179 -2.111 -3.385 1.00 4.88 N ATOM 1636 NH2 ARG A 373 -10.458 -4.276 -2.701 1.00 5.90 N ATOM 0 H ARG A 373 -11.870 -1.294 -3.131 1.00 0.99 H new ATOM 0 HA ARG A 373 -14.286 0.240 -2.362 1.00 1.11 H new ATOM 0 HB2 ARG A 373 -15.539 -0.878 -4.099 1.00 1.68 H new ATOM 0 HB3 ARG A 373 -14.175 -0.057 -4.832 1.00 1.68 H new ATOM 0 HG2 ARG A 373 -14.391 -3.039 -4.278 1.00 2.22 H new ATOM 0 HG3 ARG A 373 -14.513 -2.261 -5.844 1.00 2.22 H new ATOM 0 HD2 ARG A 373 -12.288 -2.503 -6.085 1.00 2.59 H new ATOM 0 HD3 ARG A 373 -12.057 -1.350 -4.785 1.00 2.59 H new ATOM 0 HE ARG A 373 -12.424 -4.269 -4.211 1.00 3.77 H new ATOM 0 HH11 ARG A 373 -10.468 -1.318 -3.957 1.00 4.88 H new ATOM 0 HH12 ARG A 373 -9.357 -2.035 -2.786 1.00 4.88 H new ATOM 0 HH21 ARG A 373 -10.963 -5.161 -2.742 1.00 5.90 H new ATOM 0 HH22 ARG A 373 -9.634 -4.187 -2.107 1.00 5.90 H new ATOM 1650 N LYS A 374 -15.278 -1.757 -1.144 1.00 1.08 N ATOM 1651 CA LYS A 374 -15.638 -2.783 -0.170 1.00 1.35 C ATOM 1652 C LYS A 374 -17.144 -3.052 -0.152 1.00 1.76 C ATOM 1653 O LYS A 374 -17.773 -3.069 0.910 1.00 2.36 O ATOM 1654 CB LYS A 374 -15.159 -2.380 1.226 1.00 2.07 C ATOM 1655 CG LYS A 374 -15.510 -0.946 1.601 1.00 2.64 C ATOM 1656 CD LYS A 374 -16.165 -0.845 2.974 1.00 3.16 C ATOM 1657 CE LYS A 374 -15.218 -1.227 4.106 1.00 3.82 C ATOM 1658 NZ LYS A 374 -15.013 -2.697 4.209 1.00 4.43 N ATOM 0 H LYS A 374 -15.947 -0.990 -1.213 1.00 1.08 H new ATOM 0 HA LYS A 374 -15.142 -3.706 -0.470 1.00 1.35 H new ATOM 0 HB2 LYS A 374 -15.597 -3.056 1.960 1.00 2.07 H new ATOM 0 HB3 LYS A 374 -14.078 -2.507 1.281 1.00 2.07 H new ATOM 0 HG2 LYS A 374 -14.605 -0.339 1.588 1.00 2.64 H new ATOM 0 HG3 LYS A 374 -16.182 -0.532 0.850 1.00 2.64 H new ATOM 0 HD2 LYS A 374 -16.518 0.174 3.130 1.00 3.16 H new ATOM 0 HD3 LYS A 374 -17.040 -1.494 3.003 1.00 3.16 H new ATOM 0 HE2 LYS A 374 -14.256 -0.740 3.950 1.00 3.82 H new ATOM 0 HE3 LYS A 374 -15.615 -0.852 5.049 1.00 3.82 H new ATOM 0 HZ1 LYS A 374 -14.611 -2.927 5.140 1.00 4.43 H new ATOM 0 HZ2 LYS A 374 -15.925 -3.183 4.096 1.00 4.43 H new ATOM 0 HZ3 LYS A 374 -14.360 -3.010 3.463 1.00 4.43 H new