USER MOD reduce.3.24.130724 H: found=0, std=0, add=792, rem=0, adj=29 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 279 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 343 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 307 CYS SG : rot -163:sc= 1.01 USER MOD Set 2.2: A 310 THR OG1 : rot -77:sc= 1.33 USER MOD Set 2.3: A 325 GLN :FLIP amide:sc= 1.04 F(o=-0.075!,f=3.4) USER MOD Single : A 281 ASN : amide:sc= -0.0132 K(o=-0.013,f=-0.7) USER MOD Single : A 286 LYS NZ :NH3+ 170:sc=-0.00609 (180deg=-0.136) USER MOD Single : A 287 ASN : amide:sc= 0.941 K(o=0.94,f=0) 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+ -145:sc= -1.82! (180deg=-4.01!) USER MOD Single : A 296 SER OG : rot 180:sc= 0 USER MOD Single : A 300 HIS : no HE2:sc= -0.223 K(o=-0.22,f=-5.3!) USER MOD Single : A 302 TYR OH : rot 33:sc= 1.29 USER MOD Single : A 304 LYS NZ :NH3+ -101:sc= 1.25 (180deg=-0.705) USER MOD Single : A 311 SER OG : rot 26:sc= -0.609 USER MOD Single : A 318 GLN :FLIP amide:sc=-0.00189 F(o=-1.6,f=-0.0019) USER MOD Single : A 321 THR OG1 : rot 180:sc= -0.347 USER MOD Single : A 326 THR OG1 : rot 18:sc= 0.0685 USER MOD Single : A 330 ASN :FLIP amide:sc= -0.853 F(o=-3.3!,f=-0.85) USER MOD Single : A 335 HIS :FLIP no HE2:sc= 0.18 F(o=-0.89,f=0.18) USER MOD Single : A 338 CYS SG : rot -76:sc= 1.01 USER MOD Single : A 341 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 342 THR OG1 : rot 180:sc= 0.268 USER MOD Single : A 347 GLN : amide:sc= -3.26! C(o=-3.3!,f=-3.9!) USER MOD Single : A 349 LYS NZ :NH3+ 153:sc= 0.179 (180deg=-0.912) USER MOD Single : A 352 ASN : amide:sc= 0 X(o=0,f=-0.0099) USER MOD Single : A 358 GLN :FLIP amide:sc=-0.00763 F(o=-2.4,f=-0.0076) USER MOD Single : A 359 CYS SG : rot 49:sc= 2.04 USER MOD Single : A 360 THR OG1 : rot 180:sc= -0.275 USER MOD Single : A 362 CYS SG : rot 180:sc= -0.0856 USER MOD Single : A 364 THR OG1 : rot -100:sc= 0.592 USER MOD Single : A 366 SER OG : rot 180:sc= 0 USER MOD Single : A 371 CYS SG : rot 180:sc= 0 USER MOD Single : A 374 LYS NZ :NH3+ -179:sc= 1.21 (180deg=1.17) USER MOD ----------------------------------------------------------------- ATOM 86 N MET A 279 16.883 -3.590 5.877 1.00 1.31 N ATOM 87 CA MET A 279 15.647 -4.317 5.730 1.00 1.10 C ATOM 88 C MET A 279 14.606 -3.789 6.701 1.00 0.93 C ATOM 89 O MET A 279 14.697 -4.001 7.910 1.00 1.07 O ATOM 90 CB MET A 279 15.983 -5.757 6.016 1.00 1.39 C ATOM 91 CG MET A 279 15.189 -6.751 5.207 1.00 1.65 C ATOM 92 SD MET A 279 15.623 -8.460 5.596 1.00 2.18 S ATOM 93 CE MET A 279 14.584 -9.341 4.434 1.00 2.66 C ATOM 0 HA MET A 279 15.224 -4.206 4.732 1.00 1.10 H new ATOM 0 HB2 MET A 279 17.044 -5.915 5.825 1.00 1.39 H new ATOM 0 HB3 MET A 279 15.817 -5.953 7.075 1.00 1.39 H new ATOM 0 HG2 MET A 279 14.126 -6.598 5.391 1.00 1.65 H new ATOM 0 HG3 MET A 279 15.358 -6.569 4.146 1.00 1.65 H new ATOM 0 HE1 MET A 279 14.737 -10.414 4.550 1.00 2.66 H new ATOM 0 HE2 MET A 279 13.538 -9.101 4.626 1.00 2.66 H new ATOM 0 HE3 MET A 279 14.843 -9.045 3.417 1.00 2.66 H new ATOM 103 N VAL A 280 13.617 -3.101 6.157 1.00 0.76 N ATOM 104 CA VAL A 280 12.731 -2.292 6.965 1.00 0.74 C ATOM 105 C VAL A 280 11.258 -2.629 6.806 1.00 0.70 C ATOM 106 O VAL A 280 10.755 -2.847 5.703 1.00 0.67 O ATOM 107 CB VAL A 280 12.956 -0.805 6.667 1.00 0.81 C ATOM 108 CG1 VAL A 280 11.887 0.044 7.338 1.00 1.05 C ATOM 109 CG2 VAL A 280 14.332 -0.399 7.135 1.00 1.12 C ATOM 0 H VAL A 280 13.410 -3.089 5.158 1.00 0.76 H new ATOM 0 HA VAL A 280 12.985 -2.520 8.000 1.00 0.74 H new ATOM 0 HB VAL A 280 12.885 -0.643 5.591 1.00 0.81 H new ATOM 0 HG11 VAL A 280 12.064 1.096 7.114 1.00 1.05 H new ATOM 0 HG12 VAL A 280 10.905 -0.246 6.965 1.00 1.05 H new ATOM 0 HG13 VAL A 280 11.925 -0.109 8.417 1.00 1.05 H new ATOM 0 HG21 VAL A 280 14.491 0.658 6.923 1.00 1.12 H new ATOM 0 HG22 VAL A 280 14.417 -0.571 8.208 1.00 1.12 H new ATOM 0 HG23 VAL A 280 15.083 -0.991 6.613 1.00 1.12 H new ATOM 119 N ASN A 281 10.592 -2.671 7.943 1.00 0.81 N ATOM 120 CA ASN A 281 9.147 -2.728 8.003 1.00 0.93 C ATOM 121 C ASN A 281 8.651 -1.311 8.248 1.00 0.99 C ATOM 122 O ASN A 281 8.985 -0.711 9.266 1.00 1.10 O ATOM 123 CB ASN A 281 8.692 -3.640 9.144 1.00 1.15 C ATOM 124 CG ASN A 281 9.198 -5.063 9.014 1.00 1.53 C ATOM 125 OD1 ASN A 281 8.543 -5.922 8.422 1.00 2.16 O ATOM 126 ND2 ASN A 281 10.370 -5.324 9.574 1.00 1.69 N ATOM 0 H ASN A 281 11.043 -2.666 8.858 1.00 0.81 H new ATOM 0 HA ASN A 281 8.744 -3.131 7.074 1.00 0.93 H new ATOM 0 HB2 ASN A 281 9.037 -3.225 10.091 1.00 1.15 H new ATOM 0 HB3 ASN A 281 7.603 -3.651 9.178 1.00 1.15 H new ATOM 0 HD21 ASN A 281 10.761 -6.265 9.524 1.00 1.69 H new ATOM 0 HD22 ASN A 281 10.881 -4.584 10.055 1.00 1.69 H new ATOM 133 N LEU A 282 7.871 -0.770 7.334 1.00 1.02 N ATOM 134 CA LEU A 282 7.521 0.639 7.407 1.00 1.17 C ATOM 135 C LEU A 282 6.324 0.858 8.312 1.00 1.50 C ATOM 136 O LEU A 282 5.278 0.228 8.156 1.00 1.60 O ATOM 137 CB LEU A 282 7.247 1.192 6.009 1.00 1.26 C ATOM 138 CG LEU A 282 7.074 2.708 5.925 1.00 1.63 C ATOM 139 CD1 LEU A 282 8.335 3.416 6.397 1.00 2.23 C ATOM 140 CD2 LEU A 282 6.737 3.116 4.501 1.00 2.25 C ATOM 0 H LEU A 282 7.471 -1.273 6.542 1.00 1.02 H new ATOM 0 HA LEU A 282 8.367 1.177 7.835 1.00 1.17 H new ATOM 0 HB2 LEU A 282 8.068 0.900 5.354 1.00 1.26 H new ATOM 0 HB3 LEU A 282 6.346 0.719 5.620 1.00 1.26 H new ATOM 0 HG LEU A 282 6.252 3.002 6.578 1.00 1.63 H new ATOM 0 HD11 LEU A 282 8.193 4.495 6.330 1.00 2.23 H new ATOM 0 HD12 LEU A 282 8.541 3.141 7.431 1.00 2.23 H new ATOM 0 HD13 LEU A 282 9.175 3.121 5.768 1.00 2.23 H new ATOM 0 HD21 LEU A 282 6.616 4.198 4.452 1.00 2.25 H new ATOM 0 HD22 LEU A 282 7.544 2.810 3.834 1.00 2.25 H new ATOM 0 HD23 LEU A 282 5.810 2.633 4.194 1.00 2.25 H new ATOM 152 N ALA A 283 6.503 1.755 9.264 1.00 1.76 N ATOM 153 CA ALA A 283 5.467 2.087 10.220 1.00 2.22 C ATOM 154 C ALA A 283 4.627 3.249 9.728 1.00 2.03 C ATOM 155 O ALA A 283 3.418 3.299 9.956 1.00 2.38 O ATOM 156 CB ALA A 283 6.094 2.457 11.548 1.00 2.73 C ATOM 0 H ALA A 283 7.372 2.273 9.395 1.00 1.76 H new ATOM 0 HA ALA A 283 4.825 1.214 10.340 1.00 2.22 H new ATOM 0 HB1 ALA A 283 5.310 2.706 12.264 1.00 2.73 H new ATOM 0 HB2 ALA A 283 6.674 1.614 11.924 1.00 2.73 H new ATOM 0 HB3 ALA A 283 6.749 3.318 11.414 1.00 2.73 H new ATOM 162 N PHE A 284 5.284 4.179 9.055 1.00 1.59 N ATOM 163 CA PHE A 284 4.663 5.434 8.683 1.00 1.53 C ATOM 164 C PHE A 284 5.074 5.856 7.280 1.00 1.13 C ATOM 165 O PHE A 284 6.259 5.871 6.951 1.00 1.03 O ATOM 166 CB PHE A 284 5.063 6.510 9.690 1.00 1.81 C ATOM 167 CG PHE A 284 4.212 6.537 10.930 1.00 2.26 C ATOM 168 CD1 PHE A 284 3.013 7.235 10.946 1.00 2.47 C ATOM 169 CD2 PHE A 284 4.610 5.869 12.076 1.00 2.90 C ATOM 170 CE1 PHE A 284 2.228 7.261 12.083 1.00 3.09 C ATOM 171 CE2 PHE A 284 3.829 5.893 13.215 1.00 3.64 C ATOM 172 CZ PHE A 284 2.636 6.589 13.219 1.00 3.67 C ATOM 0 H PHE A 284 6.254 4.085 8.755 1.00 1.59 H new ATOM 0 HA PHE A 284 3.581 5.304 8.690 1.00 1.53 H new ATOM 0 HB2 PHE A 284 6.102 6.354 9.979 1.00 1.81 H new ATOM 0 HB3 PHE A 284 5.010 7.485 9.205 1.00 1.81 H new ATOM 0 HD1 PHE A 284 2.690 7.763 10.061 1.00 2.47 H new ATOM 0 HD2 PHE A 284 5.542 5.323 12.079 1.00 2.90 H new ATOM 0 HE1 PHE A 284 1.296 7.806 12.084 1.00 3.09 H new ATOM 0 HE2 PHE A 284 4.151 5.368 14.102 1.00 3.64 H new ATOM 0 HZ PHE A 284 2.023 6.608 14.108 1.00 3.67 H new ATOM 182 N VAL A 285 4.093 6.201 6.461 1.00 1.30 N ATOM 183 CA VAL A 285 4.357 6.637 5.100 1.00 1.38 C ATOM 184 C VAL A 285 3.460 7.819 4.753 1.00 1.22 C ATOM 185 O VAL A 285 2.353 7.943 5.282 1.00 1.39 O ATOM 186 CB VAL A 285 4.128 5.490 4.081 1.00 2.05 C ATOM 187 CG1 VAL A 285 2.654 5.135 3.967 1.00 2.59 C ATOM 188 CG2 VAL A 285 4.702 5.849 2.718 1.00 2.69 C ATOM 0 H VAL A 285 3.106 6.187 6.716 1.00 1.30 H new ATOM 0 HA VAL A 285 5.403 6.938 5.041 1.00 1.38 H new ATOM 0 HB VAL A 285 4.655 4.611 4.453 1.00 2.05 H new ATOM 0 HG11 VAL A 285 2.529 4.328 3.245 1.00 2.59 H new ATOM 0 HG12 VAL A 285 2.281 4.813 4.939 1.00 2.59 H new ATOM 0 HG13 VAL A 285 2.094 6.009 3.635 1.00 2.59 H new ATOM 0 HG21 VAL A 285 4.528 5.028 2.022 1.00 2.69 H new ATOM 0 HG22 VAL A 285 4.216 6.750 2.344 1.00 2.69 H new ATOM 0 HG23 VAL A 285 5.774 6.026 2.810 1.00 2.69 H new ATOM 198 N LYS A 286 3.954 8.696 3.891 1.00 1.31 N ATOM 199 CA LYS A 286 3.172 9.825 3.410 1.00 1.26 C ATOM 200 C LYS A 286 1.946 9.316 2.684 1.00 1.13 C ATOM 201 O LYS A 286 2.071 8.738 1.617 1.00 1.17 O ATOM 202 CB LYS A 286 3.998 10.663 2.435 1.00 1.49 C ATOM 203 CG LYS A 286 3.601 12.121 2.393 1.00 1.93 C ATOM 204 CD LYS A 286 4.588 12.949 1.587 1.00 2.42 C ATOM 205 CE LYS A 286 4.138 14.396 1.474 1.00 3.19 C ATOM 206 NZ LYS A 286 4.030 15.056 2.801 1.00 3.44 N ATOM 0 H LYS A 286 4.898 8.646 3.509 1.00 1.31 H new ATOM 0 HA LYS A 286 2.882 10.437 4.264 1.00 1.26 H new ATOM 0 HB2 LYS A 286 5.050 10.591 2.710 1.00 1.49 H new ATOM 0 HB3 LYS A 286 3.900 10.241 1.435 1.00 1.49 H new ATOM 0 HG2 LYS A 286 2.606 12.215 1.958 1.00 1.93 H new ATOM 0 HG3 LYS A 286 3.542 12.512 3.409 1.00 1.93 H new ATOM 0 HD2 LYS A 286 5.570 12.908 2.059 1.00 2.42 H new ATOM 0 HD3 LYS A 286 4.695 12.521 0.590 1.00 2.42 H new ATOM 0 HE2 LYS A 286 4.844 14.947 0.853 1.00 3.19 H new ATOM 0 HE3 LYS A 286 3.172 14.436 0.971 1.00 3.19 H new ATOM 0 HZ1 LYS A 286 3.887 16.078 2.670 1.00 3.44 H new ATOM 0 HZ2 LYS A 286 3.223 14.658 3.322 1.00 3.44 H new ATOM 0 HZ3 LYS A 286 4.904 14.895 3.341 1.00 3.44 H new ATOM 220 N ASN A 287 0.774 9.473 3.263 1.00 1.17 N ATOM 221 CA ASN A 287 -0.434 9.071 2.571 1.00 1.09 C ATOM 222 C ASN A 287 -1.650 9.794 3.125 1.00 1.11 C ATOM 223 O ASN A 287 -1.643 10.273 4.262 1.00 1.23 O ATOM 224 CB ASN A 287 -0.617 7.557 2.679 1.00 1.09 C ATOM 225 CG ASN A 287 -1.200 7.122 4.013 1.00 1.11 C ATOM 226 OD1 ASN A 287 -2.371 6.757 4.103 1.00 1.17 O ATOM 227 ND2 ASN A 287 -0.400 7.210 5.067 1.00 1.26 N ATOM 0 H ASN A 287 0.632 9.868 4.193 1.00 1.17 H new ATOM 0 HA ASN A 287 -0.335 9.344 1.520 1.00 1.09 H new ATOM 0 HB2 ASN A 287 -1.271 7.218 1.875 1.00 1.09 H new ATOM 0 HB3 ASN A 287 0.347 7.069 2.534 1.00 1.09 H new ATOM 0 HD21 ASN A 287 -0.750 6.971 5.995 1.00 1.26 H new ATOM 0 HD22 ASN A 287 0.566 7.517 4.950 1.00 1.26 H new ATOM 234 N ASP A 288 -2.672 9.904 2.298 1.00 1.04 N ATOM 235 CA ASP A 288 -3.971 10.389 2.725 1.00 1.09 C ATOM 236 C ASP A 288 -5.058 9.597 2.020 1.00 0.97 C ATOM 237 O ASP A 288 -4.934 9.272 0.836 1.00 0.86 O ATOM 238 CB ASP A 288 -4.144 11.896 2.472 1.00 1.20 C ATOM 239 CG ASP A 288 -3.784 12.340 1.066 1.00 1.62 C ATOM 240 OD1 ASP A 288 -4.524 11.980 0.125 1.00 2.36 O ATOM 241 OD2 ASP A 288 -2.754 13.023 0.885 1.00 1.76 O ATOM 0 H ASP A 288 -2.625 9.659 1.309 1.00 1.04 H new ATOM 0 HA ASP A 288 -4.049 10.244 3.802 1.00 1.09 H new ATOM 0 HB2 ASP A 288 -5.180 12.169 2.672 1.00 1.20 H new ATOM 0 HB3 ASP A 288 -3.526 12.445 3.183 1.00 1.20 H new ATOM 246 N SER A 289 -6.107 9.269 2.750 1.00 1.02 N ATOM 247 CA SER A 289 -7.155 8.418 2.223 1.00 0.94 C ATOM 248 C SER A 289 -8.424 9.211 1.959 1.00 1.05 C ATOM 249 O SER A 289 -8.743 10.148 2.693 1.00 1.23 O ATOM 250 CB SER A 289 -7.439 7.288 3.215 1.00 1.03 C ATOM 251 OG SER A 289 -7.624 7.795 4.528 1.00 1.42 O ATOM 0 H SER A 289 -6.256 9.579 3.710 1.00 1.02 H new ATOM 0 HA SER A 289 -6.818 7.999 1.275 1.00 0.94 H new ATOM 0 HB2 SER A 289 -8.330 6.742 2.904 1.00 1.03 H new ATOM 0 HB3 SER A 289 -6.612 6.578 3.209 1.00 1.03 H new ATOM 0 HG SER A 289 -7.806 7.053 5.142 1.00 1.42 H new ATOM 257 N TYR A 290 -9.156 8.818 0.926 1.00 0.98 N ATOM 258 CA TYR A 290 -10.440 9.440 0.619 1.00 1.15 C ATOM 259 C TYR A 290 -11.505 8.384 0.464 1.00 1.07 C ATOM 260 O TYR A 290 -11.292 7.376 -0.197 1.00 0.92 O ATOM 261 CB TYR A 290 -10.421 10.239 -0.686 1.00 1.28 C ATOM 262 CG TYR A 290 -9.688 11.562 -0.657 1.00 1.44 C ATOM 263 CD1 TYR A 290 -9.117 12.048 0.503 1.00 1.83 C ATOM 264 CD2 TYR A 290 -9.574 12.322 -1.814 1.00 1.76 C ATOM 265 CE1 TYR A 290 -8.446 13.255 0.518 1.00 2.48 C ATOM 266 CE2 TYR A 290 -8.909 13.529 -1.810 1.00 2.20 C ATOM 267 CZ TYR A 290 -8.347 13.992 -0.644 1.00 2.56 C ATOM 268 OH TYR A 290 -7.685 15.197 -0.642 1.00 3.25 O ATOM 0 H TYR A 290 -8.884 8.072 0.286 1.00 0.98 H new ATOM 0 HA TYR A 290 -10.647 10.114 1.450 1.00 1.15 H new ATOM 0 HB2 TYR A 290 -9.972 9.617 -1.460 1.00 1.28 H new ATOM 0 HB3 TYR A 290 -11.452 10.427 -0.986 1.00 1.28 H new ATOM 0 HD1 TYR A 290 -9.197 11.474 1.414 1.00 1.83 H new ATOM 0 HD2 TYR A 290 -10.014 11.961 -2.732 1.00 1.76 H new ATOM 0 HE1 TYR A 290 -8.002 13.619 1.433 1.00 2.48 H new ATOM 0 HE2 TYR A 290 -8.830 14.108 -2.718 1.00 2.20 H new ATOM 0 HH TYR A 290 -7.708 15.584 -1.542 1.00 3.25 H new ATOM 278 N GLU A 291 -12.655 8.633 1.038 1.00 1.23 N ATOM 279 CA GLU A 291 -13.800 7.769 0.821 1.00 1.20 C ATOM 280 C GLU A 291 -14.758 8.438 -0.138 1.00 1.30 C ATOM 281 O GLU A 291 -15.513 9.341 0.235 1.00 1.51 O ATOM 282 CB GLU A 291 -14.509 7.399 2.124 1.00 1.33 C ATOM 283 CG GLU A 291 -13.822 6.269 2.876 1.00 1.29 C ATOM 284 CD GLU A 291 -14.714 5.633 3.924 1.00 1.48 C ATOM 285 OE1 GLU A 291 -14.768 6.156 5.062 1.00 1.75 O ATOM 286 OE2 GLU A 291 -15.370 4.613 3.619 1.00 1.50 O ATOM 0 H GLU A 291 -12.828 9.424 1.659 1.00 1.23 H new ATOM 0 HA GLU A 291 -13.439 6.835 0.390 1.00 1.20 H new ATOM 0 HB2 GLU A 291 -14.558 8.278 2.766 1.00 1.33 H new ATOM 0 HB3 GLU A 291 -15.536 7.109 1.902 1.00 1.33 H new ATOM 0 HG2 GLU A 291 -13.504 5.506 2.165 1.00 1.29 H new ATOM 0 HG3 GLU A 291 -12.922 6.653 3.356 1.00 1.29 H new ATOM 293 N LYS A 292 -14.704 8.003 -1.381 1.00 1.22 N ATOM 294 CA LYS A 292 -15.527 8.587 -2.423 1.00 1.37 C ATOM 295 C LYS A 292 -16.629 7.618 -2.798 1.00 1.44 C ATOM 296 O LYS A 292 -16.367 6.525 -3.300 1.00 1.37 O ATOM 297 CB LYS A 292 -14.676 8.929 -3.649 1.00 1.38 C ATOM 298 CG LYS A 292 -13.569 9.932 -3.360 1.00 1.71 C ATOM 299 CD LYS A 292 -12.748 10.257 -4.602 1.00 1.63 C ATOM 300 CE LYS A 292 -13.472 11.208 -5.550 1.00 2.40 C ATOM 301 NZ LYS A 292 -14.646 10.579 -6.213 1.00 2.97 N ATOM 0 H LYS A 292 -14.098 7.245 -1.695 1.00 1.22 H new ATOM 0 HA LYS A 292 -15.973 9.510 -2.051 1.00 1.37 H new ATOM 0 HB2 LYS A 292 -14.232 8.013 -4.040 1.00 1.38 H new ATOM 0 HB3 LYS A 292 -15.323 9.329 -4.430 1.00 1.38 H new ATOM 0 HG2 LYS A 292 -14.006 10.849 -2.965 1.00 1.71 H new ATOM 0 HG3 LYS A 292 -12.912 9.533 -2.587 1.00 1.71 H new ATOM 0 HD2 LYS A 292 -11.800 10.702 -4.300 1.00 1.63 H new ATOM 0 HD3 LYS A 292 -12.513 9.333 -5.130 1.00 1.63 H new ATOM 0 HE2 LYS A 292 -13.802 12.086 -4.995 1.00 2.40 H new ATOM 0 HE3 LYS A 292 -12.774 11.556 -6.311 1.00 2.40 H new ATOM 0 HZ1 LYS A 292 -14.737 10.948 -7.181 1.00 2.97 H new ATOM 0 HZ2 LYS A 292 -14.515 9.548 -6.246 1.00 2.97 H new ATOM 0 HZ3 LYS A 292 -15.508 10.801 -5.676 1.00 2.97 H new ATOM 315 N GLY A 293 -17.860 8.037 -2.579 1.00 1.62 N ATOM 316 CA GLY A 293 -18.980 7.143 -2.746 1.00 1.74 C ATOM 317 C GLY A 293 -19.145 6.248 -1.533 1.00 1.68 C ATOM 318 O GLY A 293 -18.221 6.117 -0.730 1.00 1.58 O ATOM 0 H GLY A 293 -18.105 8.983 -2.288 1.00 1.62 H new ATOM 0 HA2 GLY A 293 -19.891 7.721 -2.903 1.00 1.74 H new ATOM 0 HA3 GLY A 293 -18.833 6.532 -3.636 1.00 1.74 H new ATOM 322 N PRO A 294 -20.307 5.615 -1.367 1.00 1.87 N ATOM 323 CA PRO A 294 -20.576 4.745 -0.215 1.00 1.90 C ATOM 324 C PRO A 294 -19.763 3.450 -0.245 1.00 1.70 C ATOM 325 O PRO A 294 -19.620 2.770 0.771 1.00 1.75 O ATOM 326 CB PRO A 294 -22.070 4.441 -0.340 1.00 2.19 C ATOM 327 CG PRO A 294 -22.377 4.615 -1.788 1.00 2.44 C ATOM 328 CD PRO A 294 -21.460 5.697 -2.281 1.00 2.18 C ATOM 0 HA PRO A 294 -20.299 5.225 0.723 1.00 1.90 H new ATOM 0 HB2 PRO A 294 -22.296 3.428 -0.007 1.00 2.19 H new ATOM 0 HB3 PRO A 294 -22.664 5.118 0.274 1.00 2.19 H new ATOM 0 HG2 PRO A 294 -22.214 3.687 -2.335 1.00 2.44 H new ATOM 0 HG3 PRO A 294 -23.421 4.892 -1.934 1.00 2.44 H new ATOM 0 HD2 PRO A 294 -21.164 5.531 -3.317 1.00 2.18 H new ATOM 0 HD3 PRO A 294 -21.936 6.677 -2.239 1.00 2.18 H new ATOM 336 N ASP A 295 -19.212 3.126 -1.408 1.00 1.64 N ATOM 337 CA ASP A 295 -18.578 1.833 -1.615 1.00 1.65 C ATOM 338 C ASP A 295 -17.072 1.983 -1.660 1.00 1.41 C ATOM 339 O ASP A 295 -16.326 1.118 -1.212 1.00 1.47 O ATOM 340 CB ASP A 295 -19.039 1.256 -2.952 1.00 2.02 C ATOM 341 CG ASP A 295 -18.945 -0.247 -3.024 1.00 2.30 C ATOM 342 OD1 ASP A 295 -17.817 -0.754 -3.196 1.00 2.45 O ATOM 343 OD2 ASP A 295 -19.983 -0.925 -2.871 1.00 2.60 O ATOM 0 H ASP A 295 -19.192 3.741 -2.221 1.00 1.64 H new ATOM 0 HA ASP A 295 -18.855 1.175 -0.792 1.00 1.65 H new ATOM 0 HB2 ASP A 295 -20.071 1.556 -3.131 1.00 2.02 H new ATOM 0 HB3 ASP A 295 -18.438 1.688 -3.752 1.00 2.02 H new ATOM 348 N SER A 296 -16.627 3.114 -2.162 1.00 1.29 N ATOM 349 CA SER A 296 -15.267 3.229 -2.619 1.00 1.13 C ATOM 350 C SER A 296 -14.436 4.146 -1.746 1.00 0.97 C ATOM 351 O SER A 296 -14.921 5.115 -1.166 1.00 1.04 O ATOM 352 CB SER A 296 -15.279 3.717 -4.062 1.00 1.27 C ATOM 353 OG SER A 296 -14.037 3.479 -4.704 1.00 1.59 O ATOM 0 H SER A 296 -17.187 3.961 -2.262 1.00 1.29 H new ATOM 0 HA SER A 296 -14.798 2.247 -2.557 1.00 1.13 H new ATOM 0 HB2 SER A 296 -16.075 3.213 -4.610 1.00 1.27 H new ATOM 0 HB3 SER A 296 -15.502 4.784 -4.084 1.00 1.27 H new ATOM 0 HG SER A 296 -14.079 3.802 -5.628 1.00 1.59 H new ATOM 359 N VAL A 297 -13.171 3.796 -1.652 1.00 0.82 N ATOM 360 CA VAL A 297 -12.206 4.560 -0.913 1.00 0.74 C ATOM 361 C VAL A 297 -10.853 4.495 -1.615 1.00 0.63 C ATOM 362 O VAL A 297 -10.248 3.433 -1.736 1.00 0.60 O ATOM 363 CB VAL A 297 -12.120 4.054 0.541 1.00 0.79 C ATOM 364 CG1 VAL A 297 -11.928 2.543 0.596 1.00 1.03 C ATOM 365 CG2 VAL A 297 -11.014 4.768 1.306 1.00 1.12 C ATOM 0 H VAL A 297 -12.786 2.962 -2.094 1.00 0.82 H new ATOM 0 HA VAL A 297 -12.519 5.604 -0.876 1.00 0.74 H new ATOM 0 HB VAL A 297 -13.070 4.286 1.023 1.00 0.79 H new ATOM 0 HG11 VAL A 297 -11.872 2.221 1.636 1.00 1.03 H new ATOM 0 HG12 VAL A 297 -12.770 2.051 0.109 1.00 1.03 H new ATOM 0 HG13 VAL A 297 -11.005 2.275 0.082 1.00 1.03 H new ATOM 0 HG21 VAL A 297 -10.977 4.391 2.328 1.00 1.12 H new ATOM 0 HG22 VAL A 297 -10.057 4.586 0.817 1.00 1.12 H new ATOM 0 HG23 VAL A 297 -11.215 5.839 1.322 1.00 1.12 H new ATOM 375 N VAL A 298 -10.400 5.632 -2.100 1.00 0.70 N ATOM 376 CA VAL A 298 -9.157 5.695 -2.848 1.00 0.65 C ATOM 377 C VAL A 298 -8.110 6.459 -2.057 1.00 0.62 C ATOM 378 O VAL A 298 -8.318 7.602 -1.648 1.00 0.73 O ATOM 379 CB VAL A 298 -9.351 6.311 -4.257 1.00 0.78 C ATOM 380 CG1 VAL A 298 -10.157 7.598 -4.190 1.00 0.96 C ATOM 381 CG2 VAL A 298 -8.017 6.541 -4.957 1.00 0.81 C ATOM 0 H VAL A 298 -10.874 6.529 -1.990 1.00 0.70 H new ATOM 0 HA VAL A 298 -8.809 4.673 -2.999 1.00 0.65 H new ATOM 0 HB VAL A 298 -9.915 5.591 -4.850 1.00 0.78 H new ATOM 0 HG11 VAL A 298 -10.276 8.006 -5.194 1.00 0.96 H new ATOM 0 HG12 VAL A 298 -11.139 7.391 -3.764 1.00 0.96 H new ATOM 0 HG13 VAL A 298 -9.635 8.322 -3.564 1.00 0.96 H new ATOM 0 HG21 VAL A 298 -8.193 6.974 -5.942 1.00 0.81 H new ATOM 0 HG22 VAL A 298 -7.408 7.223 -4.364 1.00 0.81 H new ATOM 0 HG23 VAL A 298 -7.495 5.590 -5.066 1.00 0.81 H new ATOM 391 N VAL A 299 -6.993 5.807 -1.826 1.00 0.55 N ATOM 392 CA VAL A 299 -5.945 6.360 -0.999 1.00 0.59 C ATOM 393 C VAL A 299 -4.728 6.689 -1.838 1.00 0.60 C ATOM 394 O VAL A 299 -4.446 6.014 -2.826 1.00 0.60 O ATOM 395 CB VAL A 299 -5.562 5.383 0.126 1.00 0.64 C ATOM 396 CG1 VAL A 299 -4.528 6.000 1.051 1.00 0.75 C ATOM 397 CG2 VAL A 299 -6.806 4.963 0.893 1.00 0.67 C ATOM 0 H VAL A 299 -6.786 4.883 -2.204 1.00 0.55 H new ATOM 0 HA VAL A 299 -6.320 7.278 -0.546 1.00 0.59 H new ATOM 0 HB VAL A 299 -5.114 4.494 -0.318 1.00 0.64 H new ATOM 0 HG11 VAL A 299 -4.274 5.290 1.838 1.00 0.75 H new ATOM 0 HG12 VAL A 299 -3.632 6.247 0.482 1.00 0.75 H new ATOM 0 HG13 VAL A 299 -4.935 6.907 1.498 1.00 0.75 H new ATOM 0 HG21 VAL A 299 -6.527 4.271 1.688 1.00 0.67 H new ATOM 0 HG22 VAL A 299 -7.280 5.843 1.328 1.00 0.67 H new ATOM 0 HG23 VAL A 299 -7.504 4.473 0.214 1.00 0.67 H new ATOM 407 N HIS A 300 -4.025 7.736 -1.454 1.00 0.68 N ATOM 408 CA HIS A 300 -2.859 8.176 -2.198 1.00 0.75 C ATOM 409 C HIS A 300 -1.643 8.099 -1.298 1.00 0.78 C ATOM 410 O HIS A 300 -1.556 8.824 -0.306 1.00 0.87 O ATOM 411 CB HIS A 300 -3.029 9.623 -2.688 1.00 0.93 C ATOM 412 CG HIS A 300 -4.448 10.020 -2.971 1.00 1.23 C ATOM 413 ND1 HIS A 300 -5.203 10.766 -2.092 1.00 1.90 N ATOM 414 CD2 HIS A 300 -5.252 9.766 -4.029 1.00 2.16 C ATOM 415 CE1 HIS A 300 -6.405 10.950 -2.595 1.00 2.59 C ATOM 416 NE2 HIS A 300 -6.463 10.357 -3.769 1.00 2.80 N ATOM 0 H HIS A 300 -4.240 8.299 -0.631 1.00 0.68 H new ATOM 0 HA HIS A 300 -2.736 7.529 -3.066 1.00 0.75 H new ATOM 0 HB2 HIS A 300 -2.619 10.298 -1.937 1.00 0.93 H new ATOM 0 HB3 HIS A 300 -2.439 9.758 -3.595 1.00 0.93 H new ATOM 0 HD1 HIS A 300 -4.880 11.120 -1.192 1.00 1.90 H new ATOM 0 HD2 HIS A 300 -4.990 9.203 -4.913 1.00 2.16 H new ATOM 0 HE1 HIS A 300 -7.209 11.496 -2.124 1.00 2.59 H new ATOM 425 N VAL A 301 -0.725 7.212 -1.624 1.00 0.81 N ATOM 426 CA VAL A 301 0.513 7.111 -0.884 1.00 0.91 C ATOM 427 C VAL A 301 1.606 7.874 -1.625 1.00 0.94 C ATOM 428 O VAL A 301 1.753 7.755 -2.845 1.00 0.89 O ATOM 429 CB VAL A 301 0.933 5.640 -0.650 1.00 0.99 C ATOM 430 CG1 VAL A 301 -0.174 4.886 0.064 1.00 1.11 C ATOM 431 CG2 VAL A 301 1.288 4.940 -1.953 1.00 1.29 C ATOM 0 H VAL A 301 -0.814 6.552 -2.396 1.00 0.81 H new ATOM 0 HA VAL A 301 0.360 7.553 0.100 1.00 0.91 H new ATOM 0 HB VAL A 301 1.826 5.647 -0.025 1.00 0.99 H new ATOM 0 HG11 VAL A 301 0.134 3.852 0.223 1.00 1.11 H new ATOM 0 HG12 VAL A 301 -0.373 5.357 1.026 1.00 1.11 H new ATOM 0 HG13 VAL A 301 -1.079 4.906 -0.544 1.00 1.11 H new ATOM 0 HG21 VAL A 301 1.577 3.910 -1.745 1.00 1.29 H new ATOM 0 HG22 VAL A 301 0.424 4.947 -2.617 1.00 1.29 H new ATOM 0 HG23 VAL A 301 2.118 5.461 -2.431 1.00 1.29 H new ATOM 441 N TYR A 302 2.350 8.684 -0.904 1.00 1.09 N ATOM 442 CA TYR A 302 3.343 9.519 -1.512 1.00 1.18 C ATOM 443 C TYR A 302 4.694 8.849 -1.379 1.00 1.28 C ATOM 444 O TYR A 302 5.341 8.929 -0.338 1.00 1.61 O ATOM 445 CB TYR A 302 3.326 10.886 -0.825 1.00 1.54 C ATOM 446 CG TYR A 302 2.020 11.634 -0.997 1.00 2.55 C ATOM 447 CD1 TYR A 302 0.889 11.233 -0.307 1.00 2.70 C ATOM 448 CD2 TYR A 302 1.911 12.726 -1.849 1.00 3.50 C ATOM 449 CE1 TYR A 302 -0.314 11.888 -0.455 1.00 3.77 C ATOM 450 CE2 TYR A 302 0.708 13.394 -2.004 1.00 4.60 C ATOM 451 CZ TYR A 302 -0.402 12.966 -1.305 1.00 4.73 C ATOM 452 OH TYR A 302 -1.605 13.617 -1.447 1.00 5.84 O ATOM 0 H TYR A 302 2.280 8.777 0.109 1.00 1.09 H new ATOM 0 HA TYR A 302 3.135 9.664 -2.572 1.00 1.18 H new ATOM 0 HB2 TYR A 302 3.521 10.751 0.239 1.00 1.54 H new ATOM 0 HB3 TYR A 302 4.139 11.494 -1.223 1.00 1.54 H new ATOM 0 HD1 TYR A 302 0.951 10.388 0.362 1.00 2.70 H new ATOM 0 HD2 TYR A 302 2.779 13.059 -2.399 1.00 3.50 H new ATOM 0 HE1 TYR A 302 -1.183 11.557 0.093 1.00 3.77 H new ATOM 0 HE2 TYR A 302 0.639 14.244 -2.667 1.00 4.60 H new ATOM 0 HH TYR A 302 -2.094 13.589 -0.598 1.00 5.84 H new ATOM 462 N VAL A 303 5.120 8.200 -2.447 1.00 1.15 N ATOM 463 CA VAL A 303 6.373 7.465 -2.429 1.00 1.35 C ATOM 464 C VAL A 303 7.201 7.814 -3.648 1.00 1.25 C ATOM 465 O VAL A 303 6.726 7.736 -4.777 1.00 1.26 O ATOM 466 CB VAL A 303 6.157 5.938 -2.388 1.00 1.59 C ATOM 467 CG1 VAL A 303 7.452 5.240 -2.012 1.00 2.15 C ATOM 468 CG2 VAL A 303 5.048 5.558 -1.417 1.00 1.71 C ATOM 0 H VAL A 303 4.620 8.166 -3.335 1.00 1.15 H new ATOM 0 HA VAL A 303 6.897 7.757 -1.519 1.00 1.35 H new ATOM 0 HB VAL A 303 5.851 5.613 -3.382 1.00 1.59 H new ATOM 0 HG11 VAL A 303 7.290 4.162 -1.985 1.00 2.15 H new ATOM 0 HG12 VAL A 303 8.219 5.474 -2.750 1.00 2.15 H new ATOM 0 HG13 VAL A 303 7.778 5.582 -1.030 1.00 2.15 H new ATOM 0 HG21 VAL A 303 4.923 4.475 -1.413 1.00 1.71 H new ATOM 0 HG22 VAL A 303 5.310 5.896 -0.415 1.00 1.71 H new ATOM 0 HG23 VAL A 303 4.116 6.030 -1.727 1.00 1.71 H new ATOM 478 N LYS A 304 8.427 8.220 -3.400 1.00 1.30 N ATOM 479 CA LYS A 304 9.353 8.564 -4.454 1.00 1.28 C ATOM 480 C LYS A 304 10.595 7.693 -4.354 1.00 1.18 C ATOM 481 O LYS A 304 10.809 7.035 -3.334 1.00 1.14 O ATOM 482 CB LYS A 304 9.729 10.036 -4.350 1.00 1.42 C ATOM 483 CG LYS A 304 10.223 10.437 -2.968 1.00 1.50 C ATOM 484 CD LYS A 304 10.542 11.920 -2.889 1.00 1.79 C ATOM 485 CE LYS A 304 11.098 12.288 -1.525 1.00 2.16 C ATOM 486 NZ LYS A 304 12.433 11.680 -1.295 1.00 2.50 N ATOM 0 H LYS A 304 8.809 8.321 -2.460 1.00 1.30 H new ATOM 0 HA LYS A 304 8.880 8.390 -5.420 1.00 1.28 H new ATOM 0 HB2 LYS A 304 10.504 10.258 -5.083 1.00 1.42 H new ATOM 0 HB3 LYS A 304 8.862 10.644 -4.608 1.00 1.42 H new ATOM 0 HG2 LYS A 304 9.465 10.189 -2.225 1.00 1.50 H new ATOM 0 HG3 LYS A 304 11.114 9.860 -2.719 1.00 1.50 H new ATOM 0 HD2 LYS A 304 11.265 12.181 -3.662 1.00 1.79 H new ATOM 0 HD3 LYS A 304 9.640 12.500 -3.086 1.00 1.79 H new ATOM 0 HE2 LYS A 304 11.173 13.372 -1.443 1.00 2.16 H new ATOM 0 HE3 LYS A 304 10.408 11.956 -0.749 1.00 2.16 H new ATOM 0 HZ1 LYS A 304 12.332 10.839 -0.691 1.00 2.50 H new ATOM 0 HZ2 LYS A 304 12.850 11.403 -2.207 1.00 2.50 H new ATOM 0 HZ3 LYS A 304 13.053 12.371 -0.826 1.00 2.50 H new ATOM 500 N GLU A 305 11.414 7.708 -5.405 1.00 1.19 N ATOM 501 CA GLU A 305 12.611 6.882 -5.476 1.00 1.12 C ATOM 502 C GLU A 305 12.296 5.414 -5.203 1.00 1.04 C ATOM 503 O GLU A 305 12.955 4.761 -4.392 1.00 0.96 O ATOM 504 CB GLU A 305 13.685 7.392 -4.517 1.00 1.11 C ATOM 505 CG GLU A 305 14.302 8.712 -4.948 1.00 1.21 C ATOM 506 CD GLU A 305 13.469 9.918 -4.568 1.00 1.72 C ATOM 507 OE1 GLU A 305 12.834 10.514 -5.464 1.00 1.89 O ATOM 508 OE2 GLU A 305 13.427 10.265 -3.369 1.00 2.36 O ATOM 0 H GLU A 305 11.264 8.293 -6.227 1.00 1.19 H new ATOM 0 HA GLU A 305 12.998 6.954 -6.493 1.00 1.12 H new ATOM 0 HB2 GLU A 305 13.249 7.510 -3.525 1.00 1.11 H new ATOM 0 HB3 GLU A 305 14.472 6.642 -4.432 1.00 1.11 H new ATOM 0 HG2 GLU A 305 15.291 8.806 -4.499 1.00 1.21 H new ATOM 0 HG3 GLU A 305 14.443 8.703 -6.029 1.00 1.21 H new ATOM 515 N ILE A 306 11.286 4.905 -5.898 1.00 1.10 N ATOM 516 CA ILE A 306 10.862 3.519 -5.746 1.00 1.06 C ATOM 517 C ILE A 306 11.649 2.608 -6.678 1.00 1.05 C ATOM 518 O ILE A 306 11.853 2.929 -7.850 1.00 1.20 O ATOM 519 CB ILE A 306 9.360 3.343 -6.065 1.00 1.24 C ATOM 520 CG1 ILE A 306 8.521 4.380 -5.319 1.00 1.44 C ATOM 521 CG2 ILE A 306 8.901 1.932 -5.709 1.00 1.16 C ATOM 522 CD1 ILE A 306 7.050 4.335 -5.677 1.00 2.04 C ATOM 0 H ILE A 306 10.742 5.436 -6.578 1.00 1.10 H new ATOM 0 HA ILE A 306 11.047 3.250 -4.706 1.00 1.06 H new ATOM 0 HB ILE A 306 9.219 3.496 -7.135 1.00 1.24 H new ATOM 0 HG12 ILE A 306 8.631 4.222 -4.246 1.00 1.44 H new ATOM 0 HG13 ILE A 306 8.910 5.375 -5.536 1.00 1.44 H new ATOM 0 HG21 ILE A 306 7.841 1.825 -5.940 1.00 1.16 H new ATOM 0 HG22 ILE A 306 9.473 1.206 -6.287 1.00 1.16 H new ATOM 0 HG23 ILE A 306 9.060 1.755 -4.645 1.00 1.16 H new ATOM 0 HD11 ILE A 306 6.514 5.097 -5.111 1.00 2.04 H new ATOM 0 HD12 ILE A 306 6.929 4.523 -6.744 1.00 2.04 H new ATOM 0 HD13 ILE A 306 6.646 3.352 -5.434 1.00 2.04 H new ATOM 534 N CYS A 307 12.087 1.475 -6.160 1.00 0.95 N ATOM 535 CA CYS A 307 12.694 0.451 -6.983 1.00 1.01 C ATOM 536 C CYS A 307 11.590 -0.374 -7.636 1.00 1.13 C ATOM 537 O CYS A 307 11.104 -1.355 -7.071 1.00 1.12 O ATOM 538 CB CYS A 307 13.608 -0.436 -6.136 1.00 0.92 C ATOM 539 SG CYS A 307 14.390 -1.789 -7.042 1.00 1.21 S ATOM 0 H CYS A 307 12.032 1.242 -5.168 1.00 0.95 H new ATOM 0 HA CYS A 307 13.304 0.913 -7.759 1.00 1.01 H new ATOM 0 HB2 CYS A 307 14.386 0.185 -5.693 1.00 0.92 H new ATOM 0 HB3 CYS A 307 13.027 -0.854 -5.314 1.00 0.92 H new ATOM 0 HG CYS A 307 14.846 -2.668 -6.200 1.00 1.21 H new ATOM 545 N ARG A 308 11.192 0.052 -8.827 1.00 1.28 N ATOM 546 CA ARG A 308 10.121 -0.594 -9.578 1.00 1.44 C ATOM 547 C ARG A 308 10.464 -2.030 -9.941 1.00 1.49 C ATOM 548 O ARG A 308 9.578 -2.836 -10.226 1.00 1.59 O ATOM 549 CB ARG A 308 9.825 0.213 -10.833 1.00 1.61 C ATOM 550 CG ARG A 308 9.234 1.575 -10.526 1.00 1.63 C ATOM 551 CD ARG A 308 7.910 1.435 -9.799 1.00 1.84 C ATOM 552 NE ARG A 308 6.973 0.596 -10.543 1.00 2.52 N ATOM 553 CZ ARG A 308 5.805 0.166 -10.073 1.00 3.04 C ATOM 554 NH1 ARG A 308 5.407 0.496 -8.851 1.00 3.09 N ATOM 555 NH2 ARG A 308 5.036 -0.603 -10.832 1.00 3.90 N ATOM 0 H ARG A 308 11.602 0.856 -9.301 1.00 1.28 H new ATOM 0 HA ARG A 308 9.236 -0.627 -8.943 1.00 1.44 H new ATOM 0 HB2 ARG A 308 10.745 0.341 -11.403 1.00 1.61 H new ATOM 0 HB3 ARG A 308 9.133 -0.345 -11.464 1.00 1.61 H new ATOM 0 HG2 ARG A 308 9.931 2.150 -9.915 1.00 1.63 H new ATOM 0 HG3 ARG A 308 9.089 2.131 -11.452 1.00 1.63 H new ATOM 0 HD2 ARG A 308 8.080 1.004 -8.812 1.00 1.84 H new ATOM 0 HD3 ARG A 308 7.473 2.422 -9.645 1.00 1.84 H new ATOM 0 HE ARG A 308 7.233 0.320 -11.490 1.00 2.52 H new ATOM 0 HH11 ARG A 308 5.998 1.084 -8.264 1.00 3.09 H new ATOM 0 HH12 ARG A 308 4.510 0.162 -8.499 1.00 3.09 H new ATOM 0 HH21 ARG A 308 5.341 -0.862 -11.770 1.00 3.90 H new ATOM 0 HH22 ARG A 308 4.139 -0.936 -10.477 1.00 3.90 H new ATOM 569 N ASP A 309 11.751 -2.343 -9.919 1.00 1.45 N ATOM 570 CA ASP A 309 12.224 -3.686 -10.228 1.00 1.55 C ATOM 571 C ASP A 309 11.702 -4.694 -9.217 1.00 1.49 C ATOM 572 O ASP A 309 11.474 -5.858 -9.543 1.00 1.62 O ATOM 573 CB ASP A 309 13.753 -3.717 -10.215 1.00 1.55 C ATOM 574 CG ASP A 309 14.314 -5.054 -10.647 1.00 2.10 C ATOM 575 OD1 ASP A 309 14.296 -5.341 -11.864 1.00 2.26 O ATOM 576 OD2 ASP A 309 14.790 -5.813 -9.778 1.00 2.70 O ATOM 0 H ASP A 309 12.492 -1.681 -9.689 1.00 1.45 H new ATOM 0 HA ASP A 309 11.853 -3.952 -11.218 1.00 1.55 H new ATOM 0 HB2 ASP A 309 14.134 -2.938 -10.875 1.00 1.55 H new ATOM 0 HB3 ASP A 309 14.108 -3.486 -9.211 1.00 1.55 H new ATOM 581 N THR A 310 11.507 -4.237 -7.991 1.00 1.33 N ATOM 582 CA THR A 310 11.231 -5.136 -6.889 1.00 1.31 C ATOM 583 C THR A 310 9.920 -4.798 -6.201 1.00 1.27 C ATOM 584 O THR A 310 9.501 -5.474 -5.264 1.00 1.29 O ATOM 585 CB THR A 310 12.387 -5.079 -5.889 1.00 1.23 C ATOM 586 OG1 THR A 310 12.609 -3.723 -5.463 1.00 1.08 O ATOM 587 CG2 THR A 310 13.629 -5.611 -6.555 1.00 1.33 C ATOM 0 H THR A 310 11.535 -3.250 -7.737 1.00 1.33 H new ATOM 0 HA THR A 310 11.136 -6.147 -7.286 1.00 1.31 H new ATOM 0 HB THR A 310 12.143 -5.683 -5.015 1.00 1.23 H new ATOM 0 HG1 THR A 310 13.083 -3.232 -6.167 1.00 1.08 H new ATOM 0 HG21 THR A 310 14.462 -5.576 -5.853 1.00 1.33 H new ATOM 0 HG22 THR A 310 13.461 -6.642 -6.868 1.00 1.33 H new ATOM 0 HG23 THR A 310 13.864 -5.001 -7.427 1.00 1.33 H new ATOM 595 N SER A 311 9.282 -3.744 -6.678 1.00 1.27 N ATOM 596 CA SER A 311 8.027 -3.291 -6.114 1.00 1.27 C ATOM 597 C SER A 311 6.901 -4.273 -6.444 1.00 1.42 C ATOM 598 O SER A 311 6.544 -4.463 -7.611 1.00 1.63 O ATOM 599 CB SER A 311 7.719 -1.886 -6.631 1.00 1.31 C ATOM 600 OG SER A 311 7.620 -1.869 -8.043 1.00 1.60 O ATOM 0 H SER A 311 9.617 -3.183 -7.461 1.00 1.27 H new ATOM 0 HA SER A 311 8.109 -3.250 -5.028 1.00 1.27 H new ATOM 0 HB2 SER A 311 6.785 -1.532 -6.194 1.00 1.31 H new ATOM 0 HB3 SER A 311 8.502 -1.198 -6.311 1.00 1.31 H new ATOM 0 HG SER A 311 7.358 -2.757 -8.363 1.00 1.60 H new ATOM 606 N ARG A 312 6.361 -4.897 -5.406 1.00 1.32 N ATOM 607 CA ARG A 312 5.393 -5.972 -5.553 1.00 1.44 C ATOM 608 C ARG A 312 4.241 -5.797 -4.561 1.00 1.34 C ATOM 609 O ARG A 312 4.404 -5.163 -3.516 1.00 1.20 O ATOM 610 CB ARG A 312 6.109 -7.298 -5.305 1.00 1.50 C ATOM 611 CG ARG A 312 5.247 -8.533 -5.469 1.00 1.95 C ATOM 612 CD ARG A 312 5.972 -9.759 -4.947 1.00 2.00 C ATOM 613 NE ARG A 312 7.234 -9.981 -5.649 1.00 2.30 N ATOM 614 CZ ARG A 312 8.419 -10.047 -5.041 1.00 2.65 C ATOM 615 NH1 ARG A 312 8.496 -9.922 -3.721 1.00 2.66 N ATOM 616 NH2 ARG A 312 9.521 -10.229 -5.755 1.00 3.37 N ATOM 0 H ARG A 312 6.583 -4.670 -4.437 1.00 1.32 H new ATOM 0 HA ARG A 312 4.972 -5.956 -6.558 1.00 1.44 H new ATOM 0 HB2 ARG A 312 6.955 -7.370 -5.989 1.00 1.50 H new ATOM 0 HB3 ARG A 312 6.517 -7.290 -4.294 1.00 1.50 H new ATOM 0 HG2 ARG A 312 4.308 -8.402 -4.932 1.00 1.95 H new ATOM 0 HG3 ARG A 312 4.996 -8.672 -6.521 1.00 1.95 H new ATOM 0 HD2 ARG A 312 6.165 -9.641 -3.881 1.00 2.00 H new ATOM 0 HD3 ARG A 312 5.334 -10.635 -5.061 1.00 2.00 H new ATOM 0 HE ARG A 312 7.207 -10.092 -6.663 1.00 2.30 H new ATOM 0 HH11 ARG A 312 7.649 -9.776 -3.172 1.00 2.66 H new ATOM 0 HH12 ARG A 312 9.402 -9.973 -3.256 1.00 2.66 H new ATOM 0 HH21 ARG A 312 9.462 -10.319 -6.769 1.00 3.37 H new ATOM 0 HH22 ARG A 312 10.427 -10.279 -5.290 1.00 3.37 H new ATOM 630 N VAL A 313 3.081 -6.362 -4.885 1.00 1.45 N ATOM 631 CA VAL A 313 1.903 -6.237 -4.035 1.00 1.38 C ATOM 632 C VAL A 313 1.407 -7.606 -3.565 1.00 1.41 C ATOM 633 O VAL A 313 1.275 -8.535 -4.363 1.00 1.57 O ATOM 634 CB VAL A 313 0.750 -5.514 -4.772 1.00 1.52 C ATOM 635 CG1 VAL A 313 -0.458 -5.345 -3.859 1.00 2.19 C ATOM 636 CG2 VAL A 313 1.212 -4.164 -5.302 1.00 2.08 C ATOM 0 H VAL A 313 2.933 -6.911 -5.732 1.00 1.45 H new ATOM 0 HA VAL A 313 2.204 -5.646 -3.170 1.00 1.38 H new ATOM 0 HB VAL A 313 0.452 -6.132 -5.619 1.00 1.52 H new ATOM 0 HG11 VAL A 313 -1.254 -4.834 -4.400 1.00 2.19 H new ATOM 0 HG12 VAL A 313 -0.809 -6.325 -3.535 1.00 2.19 H new ATOM 0 HG13 VAL A 313 -0.175 -4.755 -2.987 1.00 2.19 H new ATOM 0 HG21 VAL A 313 0.386 -3.673 -5.816 1.00 2.08 H new ATOM 0 HG22 VAL A 313 1.544 -3.541 -4.471 1.00 2.08 H new ATOM 0 HG23 VAL A 313 2.038 -4.310 -5.998 1.00 2.08 H new ATOM 646 N LEU A 314 1.160 -7.720 -2.266 1.00 1.29 N ATOM 647 CA LEU A 314 0.549 -8.912 -1.686 1.00 1.32 C ATOM 648 C LEU A 314 -0.710 -8.508 -0.925 1.00 1.22 C ATOM 649 O LEU A 314 -0.628 -7.819 0.087 1.00 1.08 O ATOM 650 CB LEU A 314 1.528 -9.608 -0.733 1.00 1.27 C ATOM 651 CG LEU A 314 2.789 -10.181 -1.381 1.00 1.78 C ATOM 652 CD1 LEU A 314 3.784 -10.616 -0.318 1.00 2.52 C ATOM 653 CD2 LEU A 314 2.431 -11.356 -2.273 1.00 2.19 C ATOM 0 H LEU A 314 1.376 -6.992 -1.586 1.00 1.29 H new ATOM 0 HA LEU A 314 0.292 -9.606 -2.486 1.00 1.32 H new ATOM 0 HB2 LEU A 314 1.828 -8.895 0.035 1.00 1.27 H new ATOM 0 HB3 LEU A 314 1.001 -10.418 -0.228 1.00 1.27 H new ATOM 0 HG LEU A 314 3.250 -9.403 -1.989 1.00 1.78 H new ATOM 0 HD11 LEU A 314 4.675 -11.021 -0.798 1.00 2.52 H new ATOM 0 HD12 LEU A 314 4.060 -9.758 0.295 1.00 2.52 H new ATOM 0 HD13 LEU A 314 3.332 -11.381 0.312 1.00 2.52 H new ATOM 0 HD21 LEU A 314 3.337 -11.756 -2.729 1.00 2.19 H new ATOM 0 HD22 LEU A 314 1.952 -12.133 -1.677 1.00 2.19 H new ATOM 0 HD23 LEU A 314 1.747 -11.024 -3.054 1.00 2.19 H new ATOM 665 N PHE A 315 -1.871 -8.930 -1.397 1.00 1.33 N ATOM 666 CA PHE A 315 -3.126 -8.462 -0.820 1.00 1.27 C ATOM 667 C PHE A 315 -4.049 -9.615 -0.446 1.00 1.31 C ATOM 668 O PHE A 315 -3.995 -10.692 -1.040 1.00 1.53 O ATOM 669 CB PHE A 315 -3.843 -7.516 -1.792 1.00 1.50 C ATOM 670 CG PHE A 315 -4.158 -8.126 -3.135 1.00 2.05 C ATOM 671 CD1 PHE A 315 -5.365 -8.771 -3.352 1.00 2.71 C ATOM 672 CD2 PHE A 315 -3.250 -8.046 -4.179 1.00 2.17 C ATOM 673 CE1 PHE A 315 -5.660 -9.326 -4.582 1.00 3.52 C ATOM 674 CE2 PHE A 315 -3.540 -8.599 -5.413 1.00 2.87 C ATOM 675 CZ PHE A 315 -4.748 -9.239 -5.614 1.00 3.57 C ATOM 0 H PHE A 315 -1.974 -9.588 -2.169 1.00 1.33 H new ATOM 0 HA PHE A 315 -2.878 -7.924 0.095 1.00 1.27 H new ATOM 0 HB2 PHE A 315 -4.772 -7.178 -1.333 1.00 1.50 H new ATOM 0 HB3 PHE A 315 -3.223 -6.632 -1.944 1.00 1.50 H new ATOM 0 HD1 PHE A 315 -6.084 -8.841 -2.549 1.00 2.71 H new ATOM 0 HD2 PHE A 315 -2.305 -7.546 -4.027 1.00 2.17 H new ATOM 0 HE1 PHE A 315 -6.604 -9.828 -4.736 1.00 3.52 H new ATOM 0 HE2 PHE A 315 -2.823 -8.531 -6.218 1.00 2.87 H new ATOM 0 HZ PHE A 315 -4.978 -9.670 -6.577 1.00 3.57 H new ATOM 685 N ARG A 316 -4.884 -9.379 0.552 1.00 1.15 N ATOM 686 CA ARG A 316 -5.907 -10.326 0.945 1.00 1.21 C ATOM 687 C ARG A 316 -7.217 -9.587 1.222 1.00 1.16 C ATOM 688 O ARG A 316 -7.333 -8.405 0.900 1.00 1.21 O ATOM 689 CB ARG A 316 -5.457 -11.149 2.157 1.00 1.21 C ATOM 690 CG ARG A 316 -4.884 -10.324 3.293 1.00 1.14 C ATOM 691 CD ARG A 316 -4.632 -11.185 4.522 1.00 1.43 C ATOM 692 NE ARG A 316 -5.861 -11.803 5.029 1.00 1.68 N ATOM 693 CZ ARG A 316 -5.997 -12.277 6.268 1.00 2.43 C ATOM 694 NH1 ARG A 316 -4.974 -12.243 7.110 1.00 2.93 N ATOM 695 NH2 ARG A 316 -7.155 -12.795 6.661 1.00 3.21 N ATOM 0 H ARG A 316 -4.870 -8.526 1.110 1.00 1.15 H new ATOM 0 HA ARG A 316 -6.074 -11.027 0.127 1.00 1.21 H new ATOM 0 HB2 ARG A 316 -6.308 -11.719 2.531 1.00 1.21 H new ATOM 0 HB3 ARG A 316 -4.707 -11.871 1.833 1.00 1.21 H new ATOM 0 HG2 ARG A 316 -3.952 -9.858 2.974 1.00 1.14 H new ATOM 0 HG3 ARG A 316 -5.573 -9.518 3.545 1.00 1.14 H new ATOM 0 HD2 ARG A 316 -3.911 -11.964 4.275 1.00 1.43 H new ATOM 0 HD3 ARG A 316 -4.185 -10.574 5.306 1.00 1.43 H new ATOM 0 HE ARG A 316 -6.659 -11.875 4.397 1.00 1.68 H new ATOM 0 HH11 ARG A 316 -4.080 -11.854 6.811 1.00 2.93 H new ATOM 0 HH12 ARG A 316 -5.081 -12.606 8.057 1.00 2.93 H new ATOM 0 HH21 ARG A 316 -7.943 -12.831 6.015 1.00 3.21 H new ATOM 0 HH22 ARG A 316 -7.256 -13.157 7.609 1.00 3.21 H new ATOM 709 N GLU A 317 -8.182 -10.295 1.811 1.00 1.20 N ATOM 710 CA GLU A 317 -9.557 -9.810 2.004 1.00 1.25 C ATOM 711 C GLU A 317 -9.673 -8.308 2.319 1.00 1.23 C ATOM 712 O GLU A 317 -10.226 -7.548 1.518 1.00 1.41 O ATOM 713 CB GLU A 317 -10.246 -10.636 3.094 1.00 1.33 C ATOM 714 CG GLU A 317 -9.432 -10.798 4.372 1.00 1.39 C ATOM 715 CD GLU A 317 -10.144 -11.635 5.411 1.00 1.65 C ATOM 716 OE1 GLU A 317 -11.132 -11.152 6.005 1.00 2.05 O ATOM 717 OE2 GLU A 317 -9.724 -12.787 5.638 1.00 1.96 O ATOM 0 H GLU A 317 -8.032 -11.236 2.174 1.00 1.20 H new ATOM 0 HA GLU A 317 -10.057 -9.940 1.045 1.00 1.25 H new ATOM 0 HB2 GLU A 317 -11.198 -10.166 3.341 1.00 1.33 H new ATOM 0 HB3 GLU A 317 -10.473 -11.625 2.695 1.00 1.33 H new ATOM 0 HG2 GLU A 317 -8.474 -11.260 4.133 1.00 1.39 H new ATOM 0 HG3 GLU A 317 -9.216 -9.814 4.789 1.00 1.39 H new ATOM 724 N GLN A 318 -9.206 -7.883 3.489 1.00 1.19 N ATOM 725 CA GLN A 318 -9.327 -6.478 3.872 1.00 1.34 C ATOM 726 C GLN A 318 -7.980 -5.835 4.183 1.00 1.29 C ATOM 727 O GLN A 318 -7.929 -4.737 4.730 1.00 1.53 O ATOM 728 CB GLN A 318 -10.279 -6.312 5.060 1.00 1.58 C ATOM 729 CG GLN A 318 -9.923 -7.147 6.276 1.00 1.91 C ATOM 730 CD GLN A 318 -10.903 -6.957 7.423 1.00 2.21 C ATOM 731 OE1 GLN A 318 -12.158 -6.668 7.103 1.00 2.72 O flip ATOM 732 NE2 GLN A 318 -10.534 -7.067 8.592 1.00 2.17 N flip ATOM 0 H GLN A 318 -8.748 -8.478 4.179 1.00 1.19 H new ATOM 0 HA GLN A 318 -9.742 -5.959 3.008 1.00 1.34 H new ATOM 0 HB2 GLN A 318 -10.298 -5.261 5.350 1.00 1.58 H new ATOM 0 HB3 GLN A 318 -11.288 -6.572 4.740 1.00 1.58 H new ATOM 0 HG2 GLN A 318 -9.898 -8.200 5.995 1.00 1.91 H new ATOM 0 HG3 GLN A 318 -8.920 -6.883 6.612 1.00 1.91 H new ATOM 0 HE21 GLN A 318 -9.561 -7.290 8.801 1.00 2.17 H new ATOM 0 HE22 GLN A 318 -11.201 -6.935 9.352 1.00 2.17 H new ATOM 741 N ASP A 319 -6.888 -6.499 3.846 1.00 1.12 N ATOM 742 CA ASP A 319 -5.572 -5.955 4.154 1.00 1.13 C ATOM 743 C ASP A 319 -4.533 -6.371 3.135 1.00 1.00 C ATOM 744 O ASP A 319 -4.714 -7.343 2.404 1.00 1.00 O ATOM 745 CB ASP A 319 -5.121 -6.353 5.561 1.00 1.20 C ATOM 746 CG ASP A 319 -5.132 -7.842 5.828 1.00 1.13 C ATOM 747 OD1 ASP A 319 -4.053 -8.463 5.785 1.00 1.13 O ATOM 748 OD2 ASP A 319 -6.212 -8.386 6.143 1.00 1.25 O ATOM 0 H ASP A 319 -6.882 -7.400 3.368 1.00 1.12 H new ATOM 0 HA ASP A 319 -5.665 -4.870 4.112 1.00 1.13 H new ATOM 0 HB2 ASP A 319 -4.112 -5.975 5.725 1.00 1.20 H new ATOM 0 HB3 ASP A 319 -5.768 -5.862 6.288 1.00 1.20 H new ATOM 753 N PHE A 320 -3.446 -5.613 3.080 1.00 0.99 N ATOM 754 CA PHE A 320 -2.391 -5.877 2.109 1.00 0.94 C ATOM 755 C PHE A 320 -1.009 -5.498 2.622 1.00 0.83 C ATOM 756 O PHE A 320 -0.861 -4.654 3.509 1.00 0.93 O ATOM 757 CB PHE A 320 -2.670 -5.171 0.774 1.00 1.21 C ATOM 758 CG PHE A 320 -3.048 -3.715 0.871 1.00 1.43 C ATOM 759 CD1 PHE A 320 -2.136 -2.753 1.293 1.00 1.43 C ATOM 760 CD2 PHE A 320 -4.318 -3.305 0.496 1.00 1.74 C ATOM 761 CE1 PHE A 320 -2.488 -1.418 1.340 1.00 1.73 C ATOM 762 CE2 PHE A 320 -4.676 -1.971 0.547 1.00 2.02 C ATOM 763 CZ PHE A 320 -3.760 -1.027 0.969 1.00 2.01 C ATOM 0 H PHE A 320 -3.271 -4.815 3.692 1.00 0.99 H new ATOM 0 HA PHE A 320 -2.394 -6.955 1.947 1.00 0.94 H new ATOM 0 HB2 PHE A 320 -1.783 -5.256 0.147 1.00 1.21 H new ATOM 0 HB3 PHE A 320 -3.473 -5.703 0.264 1.00 1.21 H new ATOM 0 HD1 PHE A 320 -1.141 -3.053 1.587 1.00 1.43 H new ATOM 0 HD2 PHE A 320 -5.037 -4.037 0.160 1.00 1.74 H new ATOM 0 HE1 PHE A 320 -1.770 -0.681 1.666 1.00 1.73 H new ATOM 0 HE2 PHE A 320 -5.671 -1.667 0.257 1.00 2.02 H new ATOM 0 HZ PHE A 320 -4.038 0.016 1.009 1.00 2.01 H new ATOM 773 N THR A 321 -0.009 -6.145 2.047 1.00 0.74 N ATOM 774 CA THR A 321 1.383 -5.824 2.299 1.00 0.66 C ATOM 775 C THR A 321 2.058 -5.391 1.001 1.00 0.77 C ATOM 776 O THR A 321 1.993 -6.086 -0.017 1.00 0.92 O ATOM 777 CB THR A 321 2.149 -7.021 2.895 1.00 0.64 C ATOM 778 OG1 THR A 321 1.487 -7.503 4.070 1.00 0.68 O ATOM 779 CG2 THR A 321 3.575 -6.638 3.230 1.00 0.70 C ATOM 0 H THR A 321 -0.143 -6.912 1.388 1.00 0.74 H new ATOM 0 HA THR A 321 1.406 -5.011 3.025 1.00 0.66 H new ATOM 0 HB THR A 321 2.169 -7.813 2.147 1.00 0.64 H new ATOM 0 HG1 THR A 321 1.984 -8.264 4.436 1.00 0.68 H new ATOM 0 HG21 THR A 321 4.094 -7.500 3.649 1.00 0.70 H new ATOM 0 HG22 THR A 321 4.086 -6.311 2.325 1.00 0.70 H new ATOM 0 HG23 THR A 321 3.572 -5.827 3.958 1.00 0.70 H new ATOM 787 N LEU A 322 2.685 -4.235 1.043 1.00 0.78 N ATOM 788 CA LEU A 322 3.381 -3.692 -0.107 1.00 0.90 C ATOM 789 C LEU A 322 4.878 -3.866 0.084 1.00 0.80 C ATOM 790 O LEU A 322 5.462 -3.292 1.002 1.00 0.71 O ATOM 791 CB LEU A 322 3.037 -2.210 -0.279 1.00 1.06 C ATOM 792 CG LEU A 322 1.544 -1.898 -0.406 1.00 1.30 C ATOM 793 CD1 LEU A 322 1.318 -0.397 -0.464 1.00 1.80 C ATOM 794 CD2 LEU A 322 0.960 -2.570 -1.640 1.00 1.75 C ATOM 0 H LEU A 322 2.727 -3.645 1.874 1.00 0.78 H new ATOM 0 HA LEU A 322 3.069 -4.225 -1.005 1.00 0.90 H new ATOM 0 HB2 LEU A 322 3.436 -1.660 0.573 1.00 1.06 H new ATOM 0 HB3 LEU A 322 3.547 -1.836 -1.167 1.00 1.06 H new ATOM 0 HG LEU A 322 1.035 -2.292 0.474 1.00 1.30 H new ATOM 0 HD11 LEU A 322 0.251 -0.193 -0.554 1.00 1.80 H new ATOM 0 HD12 LEU A 322 1.700 0.064 0.447 1.00 1.80 H new ATOM 0 HD13 LEU A 322 1.841 0.017 -1.326 1.00 1.80 H new ATOM 0 HD21 LEU A 322 -0.102 -2.337 -1.713 1.00 1.75 H new ATOM 0 HD22 LEU A 322 1.474 -2.206 -2.530 1.00 1.75 H new ATOM 0 HD23 LEU A 322 1.090 -3.649 -1.562 1.00 1.75 H new ATOM 806 N ILE A 323 5.496 -4.668 -0.765 1.00 0.86 N ATOM 807 CA ILE A 323 6.914 -4.956 -0.631 1.00 0.83 C ATOM 808 C ILE A 323 7.698 -4.346 -1.788 1.00 0.89 C ATOM 809 O ILE A 323 7.417 -4.610 -2.955 1.00 1.07 O ATOM 810 CB ILE A 323 7.177 -6.482 -0.522 1.00 0.94 C ATOM 811 CG1 ILE A 323 8.681 -6.767 -0.496 1.00 0.97 C ATOM 812 CG2 ILE A 323 6.492 -7.250 -1.652 1.00 1.11 C ATOM 813 CD1 ILE A 323 9.020 -8.216 -0.222 1.00 1.11 C ATOM 0 H ILE A 323 5.041 -5.130 -1.552 1.00 0.86 H new ATOM 0 HA ILE A 323 7.261 -4.499 0.296 1.00 0.83 H new ATOM 0 HB ILE A 323 6.745 -6.830 0.416 1.00 0.94 H new ATOM 0 HG12 ILE A 323 9.114 -6.476 -1.453 1.00 0.97 H new ATOM 0 HG13 ILE A 323 9.147 -6.143 0.267 1.00 0.97 H new ATOM 0 HG21 ILE A 323 6.697 -8.315 -1.545 1.00 1.11 H new ATOM 0 HG22 ILE A 323 5.416 -7.081 -1.607 1.00 1.11 H new ATOM 0 HG23 ILE A 323 6.874 -6.902 -2.612 1.00 1.11 H new ATOM 0 HD11 ILE A 323 10.103 -8.342 -0.219 1.00 1.11 H new ATOM 0 HD12 ILE A 323 8.618 -8.507 0.749 1.00 1.11 H new ATOM 0 HD13 ILE A 323 8.584 -8.845 -0.998 1.00 1.11 H new ATOM 825 N PHE A 324 8.667 -3.506 -1.454 1.00 0.77 N ATOM 826 CA PHE A 324 9.447 -2.793 -2.458 1.00 0.83 C ATOM 827 C PHE A 324 10.787 -2.348 -1.891 1.00 0.71 C ATOM 828 O PHE A 324 11.060 -2.512 -0.707 1.00 0.64 O ATOM 829 CB PHE A 324 8.677 -1.566 -2.984 1.00 0.92 C ATOM 830 CG PHE A 324 7.945 -0.786 -1.917 1.00 0.87 C ATOM 831 CD1 PHE A 324 6.562 -0.834 -1.836 1.00 1.04 C ATOM 832 CD2 PHE A 324 8.637 -0.010 -0.997 1.00 0.86 C ATOM 833 CE1 PHE A 324 5.885 -0.126 -0.861 1.00 1.12 C ATOM 834 CE2 PHE A 324 7.965 0.700 -0.019 1.00 0.91 C ATOM 835 CZ PHE A 324 6.586 0.641 0.050 1.00 1.01 C ATOM 0 H PHE A 324 8.933 -3.300 -0.491 1.00 0.77 H new ATOM 0 HA PHE A 324 9.624 -3.481 -3.285 1.00 0.83 H new ATOM 0 HB2 PHE A 324 9.378 -0.900 -3.487 1.00 0.92 H new ATOM 0 HB3 PHE A 324 7.958 -1.897 -3.733 1.00 0.92 H new ATOM 0 HD1 PHE A 324 6.007 -1.432 -2.543 1.00 1.04 H new ATOM 0 HD2 PHE A 324 9.715 0.040 -1.046 1.00 0.86 H new ATOM 0 HE1 PHE A 324 4.807 -0.172 -0.811 1.00 1.12 H new ATOM 0 HE2 PHE A 324 8.517 1.300 0.690 1.00 0.91 H new ATOM 0 HZ PHE A 324 6.058 1.193 0.814 1.00 1.01 H new ATOM 845 N GLN A 325 11.626 -1.809 -2.754 1.00 0.74 N ATOM 846 CA GLN A 325 12.873 -1.193 -2.336 1.00 0.65 C ATOM 847 C GLN A 325 12.835 0.285 -2.707 1.00 0.64 C ATOM 848 O GLN A 325 12.113 0.673 -3.626 1.00 0.75 O ATOM 849 CB GLN A 325 14.069 -1.878 -2.997 1.00 0.75 C ATOM 850 CG GLN A 325 14.474 -3.199 -2.355 1.00 0.92 C ATOM 851 CD GLN A 325 15.490 -3.958 -3.194 1.00 1.34 C ATOM 852 OE1 GLN A 325 15.407 -3.800 -4.504 1.00 1.61 O flip ATOM 853 NE2 GLN A 325 16.337 -4.685 -2.677 1.00 1.62 N flip ATOM 0 H GLN A 325 11.465 -1.785 -3.761 1.00 0.74 H new ATOM 0 HA GLN A 325 12.986 -1.302 -1.257 1.00 0.65 H new ATOM 0 HB2 GLN A 325 13.836 -2.055 -4.047 1.00 0.75 H new ATOM 0 HB3 GLN A 325 14.921 -1.199 -2.970 1.00 0.75 H new ATOM 0 HG2 GLN A 325 14.892 -3.008 -1.367 1.00 0.92 H new ATOM 0 HG3 GLN A 325 13.588 -3.818 -2.212 1.00 0.92 H new ATOM 0 HE21 GLN A 325 16.373 -4.784 -1.662 1.00 1.62 H new ATOM 0 HE22 GLN A 325 17.003 -5.188 -3.263 1.00 1.62 H new ATOM 862 N THR A 326 13.587 1.101 -1.991 1.00 0.59 N ATOM 863 CA THR A 326 13.627 2.526 -2.226 1.00 0.67 C ATOM 864 C THR A 326 15.045 3.028 -1.968 1.00 0.65 C ATOM 865 O THR A 326 15.794 2.389 -1.237 1.00 0.74 O ATOM 866 CB THR A 326 12.609 3.232 -1.298 1.00 0.78 C ATOM 867 OG1 THR A 326 11.297 3.167 -1.866 1.00 1.31 O ATOM 868 CG2 THR A 326 12.988 4.673 -1.018 1.00 0.99 C ATOM 0 H THR A 326 14.188 0.789 -1.228 1.00 0.59 H new ATOM 0 HA THR A 326 13.357 2.749 -3.258 1.00 0.67 H new ATOM 0 HB THR A 326 12.620 2.704 -0.344 1.00 0.78 H new ATOM 0 HG1 THR A 326 11.271 2.466 -2.550 1.00 1.31 H new ATOM 0 HG21 THR A 326 12.243 5.124 -0.363 1.00 0.99 H new ATOM 0 HG22 THR A 326 13.964 4.705 -0.534 1.00 0.99 H new ATOM 0 HG23 THR A 326 13.030 5.227 -1.956 1.00 0.99 H new ATOM 876 N ARG A 327 15.427 4.144 -2.574 1.00 0.67 N ATOM 877 CA ARG A 327 16.757 4.690 -2.348 1.00 0.69 C ATOM 878 C ARG A 327 16.680 6.120 -1.824 1.00 0.80 C ATOM 879 O ARG A 327 16.171 7.020 -2.493 1.00 0.89 O ATOM 880 CB ARG A 327 17.635 4.622 -3.612 1.00 0.73 C ATOM 881 CG ARG A 327 17.189 5.500 -4.781 1.00 0.86 C ATOM 882 CD ARG A 327 15.965 4.956 -5.506 1.00 1.01 C ATOM 883 NE ARG A 327 16.179 3.616 -6.037 1.00 1.68 N ATOM 884 CZ ARG A 327 15.653 3.175 -7.175 1.00 2.11 C ATOM 885 NH1 ARG A 327 14.837 3.948 -7.882 1.00 2.04 N ATOM 886 NH2 ARG A 327 15.942 1.956 -7.605 1.00 3.04 N ATOM 0 H ARG A 327 14.845 4.682 -3.216 1.00 0.67 H new ATOM 0 HA ARG A 327 17.231 4.067 -1.589 1.00 0.69 H new ATOM 0 HB2 ARG A 327 18.653 4.902 -3.340 1.00 0.73 H new ATOM 0 HB3 ARG A 327 17.669 3.587 -3.952 1.00 0.73 H new ATOM 0 HG2 ARG A 327 16.969 6.502 -4.412 1.00 0.86 H new ATOM 0 HG3 ARG A 327 18.011 5.595 -5.490 1.00 0.86 H new ATOM 0 HD2 ARG A 327 15.118 4.940 -4.820 1.00 1.01 H new ATOM 0 HD3 ARG A 327 15.702 5.629 -6.322 1.00 1.01 H new ATOM 0 HE ARG A 327 16.768 2.978 -5.503 1.00 1.68 H new ATOM 0 HH11 ARG A 327 14.611 4.886 -7.552 1.00 2.04 H new ATOM 0 HH12 ARG A 327 14.437 3.603 -8.755 1.00 2.04 H new ATOM 0 HH21 ARG A 327 16.567 1.359 -7.063 1.00 3.04 H new ATOM 0 HH22 ARG A 327 15.540 1.614 -8.478 1.00 3.04 H new ATOM 900 N ASP A 328 17.171 6.322 -0.612 1.00 0.90 N ATOM 901 CA ASP A 328 17.227 7.653 -0.025 1.00 1.08 C ATOM 902 C ASP A 328 18.640 7.945 0.444 1.00 1.06 C ATOM 903 O ASP A 328 19.178 7.261 1.320 1.00 1.06 O ATOM 904 CB ASP A 328 16.235 7.796 1.127 1.00 1.37 C ATOM 905 CG ASP A 328 16.037 9.245 1.537 1.00 2.25 C ATOM 906 OD1 ASP A 328 14.910 9.608 1.933 1.00 2.82 O ATOM 907 OD2 ASP A 328 17.008 10.031 1.464 1.00 2.55 O ATOM 0 H ASP A 328 17.537 5.581 -0.014 1.00 0.90 H new ATOM 0 HA ASP A 328 16.946 8.379 -0.788 1.00 1.08 H new ATOM 0 HB2 ASP A 328 15.276 7.369 0.834 1.00 1.37 H new ATOM 0 HB3 ASP A 328 16.590 7.223 1.984 1.00 1.37 H new ATOM 912 N GLY A 329 19.221 8.978 -0.157 1.00 1.15 N ATOM 913 CA GLY A 329 20.619 9.303 0.037 1.00 1.22 C ATOM 914 C GLY A 329 21.019 9.502 1.483 1.00 1.34 C ATOM 915 O GLY A 329 22.113 9.110 1.877 1.00 1.36 O ATOM 0 H GLY A 329 18.732 9.610 -0.791 1.00 1.15 H new ATOM 0 HA2 GLY A 329 21.228 8.505 -0.389 1.00 1.22 H new ATOM 0 HA3 GLY A 329 20.849 10.212 -0.519 1.00 1.22 H new ATOM 919 N ASN A 330 20.146 10.097 2.284 1.00 1.49 N ATOM 920 CA ASN A 330 20.510 10.405 3.670 1.00 1.69 C ATOM 921 C ASN A 330 20.668 9.116 4.485 1.00 1.61 C ATOM 922 O ASN A 330 21.594 8.987 5.281 1.00 1.71 O ATOM 923 CB ASN A 330 19.488 11.338 4.348 1.00 1.90 C ATOM 924 CG ASN A 330 18.268 10.601 4.860 1.00 2.26 C ATOM 925 OD1 ASN A 330 17.645 9.828 3.993 1.00 3.04 O flip ATOM 926 ND2 ASN A 330 17.861 10.765 6.012 1.00 2.01 N flip ATOM 0 H ASN A 330 19.202 10.373 2.013 1.00 1.49 H new ATOM 0 HA ASN A 330 21.464 10.931 3.639 1.00 1.69 H new ATOM 0 HB2 ASN A 330 19.970 11.854 5.178 1.00 1.90 H new ATOM 0 HB3 ASN A 330 19.173 12.102 3.637 1.00 1.90 H new ATOM 0 HD21 ASN A 330 18.373 11.372 6.652 1.00 2.01 H new ATOM 0 HD22 ASN A 330 17.012 10.294 6.325 1.00 2.01 H new ATOM 933 N PHE A 331 19.764 8.164 4.274 1.00 1.48 N ATOM 934 CA PHE A 331 19.783 6.912 4.999 1.00 1.47 C ATOM 935 C PHE A 331 20.914 6.032 4.505 1.00 1.31 C ATOM 936 O PHE A 331 21.679 5.491 5.298 1.00 1.42 O ATOM 937 CB PHE A 331 18.448 6.183 4.854 1.00 1.46 C ATOM 938 CG PHE A 331 17.282 6.893 5.481 1.00 1.64 C ATOM 939 CD1 PHE A 331 17.349 7.339 6.789 1.00 1.90 C ATOM 940 CD2 PHE A 331 16.116 7.104 4.764 1.00 2.14 C ATOM 941 CE1 PHE A 331 16.275 7.983 7.373 1.00 2.38 C ATOM 942 CE2 PHE A 331 15.039 7.750 5.341 1.00 2.84 C ATOM 943 CZ PHE A 331 15.119 8.189 6.648 1.00 2.87 C ATOM 0 H PHE A 331 19.004 8.244 3.598 1.00 1.48 H new ATOM 0 HA PHE A 331 19.944 7.132 6.054 1.00 1.47 H new ATOM 0 HB2 PHE A 331 18.241 6.036 3.794 1.00 1.46 H new ATOM 0 HB3 PHE A 331 18.538 5.193 5.301 1.00 1.46 H new ATOM 0 HD1 PHE A 331 18.252 7.182 7.361 1.00 1.90 H new ATOM 0 HD2 PHE A 331 16.048 6.760 3.743 1.00 2.14 H new ATOM 0 HE1 PHE A 331 16.340 8.325 8.395 1.00 2.38 H new ATOM 0 HE2 PHE A 331 14.136 7.911 4.771 1.00 2.84 H new ATOM 0 HZ PHE A 331 14.278 8.693 7.102 1.00 2.87 H new ATOM 953 N LEU A 332 21.029 5.913 3.186 1.00 1.12 N ATOM 954 CA LEU A 332 22.055 5.050 2.596 1.00 1.03 C ATOM 955 C LEU A 332 23.447 5.531 2.988 1.00 1.14 C ATOM 956 O LEU A 332 24.371 4.735 3.154 1.00 1.18 O ATOM 957 CB LEU A 332 21.908 4.937 1.061 1.00 0.98 C ATOM 958 CG LEU A 332 22.074 6.222 0.228 1.00 1.09 C ATOM 959 CD1 LEU A 332 23.544 6.562 0.010 1.00 1.65 C ATOM 960 CD2 LEU A 332 21.373 6.074 -1.115 1.00 1.46 C ATOM 0 H LEU A 332 20.435 6.394 2.511 1.00 1.12 H new ATOM 0 HA LEU A 332 21.913 4.047 2.997 1.00 1.03 H new ATOM 0 HB2 LEU A 332 22.640 4.211 0.707 1.00 0.98 H new ATOM 0 HB3 LEU A 332 20.922 4.525 0.848 1.00 0.98 H new ATOM 0 HG LEU A 332 21.617 7.039 0.787 1.00 1.09 H new ATOM 0 HD11 LEU A 332 23.623 7.474 -0.581 1.00 1.65 H new ATOM 0 HD12 LEU A 332 24.030 6.712 0.974 1.00 1.65 H new ATOM 0 HD13 LEU A 332 24.032 5.743 -0.519 1.00 1.65 H new ATOM 0 HD21 LEU A 332 21.498 6.989 -1.694 1.00 1.46 H new ATOM 0 HD22 LEU A 332 21.807 5.237 -1.662 1.00 1.46 H new ATOM 0 HD23 LEU A 332 20.311 5.890 -0.953 1.00 1.46 H new ATOM 972 N ARG A 333 23.571 6.843 3.160 1.00 1.24 N ATOM 973 CA ARG A 333 24.822 7.463 3.570 1.00 1.42 C ATOM 974 C ARG A 333 25.236 6.962 4.953 1.00 1.57 C ATOM 975 O ARG A 333 26.423 6.813 5.250 1.00 1.69 O ATOM 976 CB ARG A 333 24.652 8.988 3.571 1.00 1.58 C ATOM 977 CG ARG A 333 24.626 9.615 4.952 1.00 1.77 C ATOM 978 CD ARG A 333 24.289 11.090 4.877 1.00 1.94 C ATOM 979 NE ARG A 333 25.240 11.839 4.057 1.00 2.17 N ATOM 980 CZ ARG A 333 25.743 13.024 4.393 1.00 2.53 C ATOM 981 NH1 ARG A 333 25.471 13.561 5.577 1.00 2.82 N ATOM 982 NH2 ARG A 333 26.534 13.665 3.545 1.00 2.93 N ATOM 0 H ARG A 333 22.807 7.504 3.019 1.00 1.24 H new ATOM 0 HA ARG A 333 25.610 7.193 2.867 1.00 1.42 H new ATOM 0 HB2 ARG A 333 25.466 9.432 2.999 1.00 1.58 H new ATOM 0 HB3 ARG A 333 23.726 9.238 3.054 1.00 1.58 H new ATOM 0 HG2 ARG A 333 23.892 9.102 5.573 1.00 1.77 H new ATOM 0 HG3 ARG A 333 25.596 9.485 5.432 1.00 1.77 H new ATOM 0 HD2 ARG A 333 23.286 11.210 4.467 1.00 1.94 H new ATOM 0 HD3 ARG A 333 24.274 11.508 5.884 1.00 1.94 H new ATOM 0 HE ARG A 333 25.536 11.427 3.172 1.00 2.17 H new ATOM 0 HH11 ARG A 333 24.872 13.064 6.237 1.00 2.82 H new ATOM 0 HH12 ARG A 333 25.861 14.470 5.826 1.00 2.82 H new ATOM 0 HH21 ARG A 333 26.754 13.250 2.640 1.00 2.93 H new ATOM 0 HH22 ARG A 333 26.922 14.574 3.797 1.00 2.93 H new ATOM 996 N LEU A 334 24.243 6.699 5.789 1.00 1.62 N ATOM 997 CA LEU A 334 24.475 6.234 7.147 1.00 1.83 C ATOM 998 C LEU A 334 24.798 4.742 7.191 1.00 1.77 C ATOM 999 O LEU A 334 25.401 4.265 8.152 1.00 1.95 O ATOM 1000 CB LEU A 334 23.243 6.505 8.017 1.00 1.98 C ATOM 1001 CG LEU A 334 22.792 7.966 8.093 1.00 2.10 C ATOM 1002 CD1 LEU A 334 21.514 8.086 8.907 1.00 2.43 C ATOM 1003 CD2 LEU A 334 23.884 8.834 8.696 1.00 2.23 C ATOM 0 H LEU A 334 23.258 6.802 5.546 1.00 1.62 H new ATOM 0 HA LEU A 334 25.334 6.783 7.532 1.00 1.83 H new ATOM 0 HB2 LEU A 334 22.414 5.907 7.637 1.00 1.98 H new ATOM 0 HB3 LEU A 334 23.451 6.155 9.028 1.00 1.98 H new ATOM 0 HG LEU A 334 22.594 8.315 7.080 1.00 2.10 H new ATOM 0 HD11 LEU A 334 21.207 9.131 8.951 1.00 2.43 H new ATOM 0 HD12 LEU A 334 20.727 7.496 8.437 1.00 2.43 H new ATOM 0 HD13 LEU A 334 21.690 7.717 9.917 1.00 2.43 H new ATOM 0 HD21 LEU A 334 23.543 9.868 8.741 1.00 2.23 H new ATOM 0 HD22 LEU A 334 24.113 8.483 9.702 1.00 2.23 H new ATOM 0 HD23 LEU A 334 24.780 8.774 8.078 1.00 2.23 H new ATOM 1015 N HIS A 335 24.407 3.995 6.160 1.00 1.57 N ATOM 1016 CA HIS A 335 24.553 2.535 6.204 1.00 1.57 C ATOM 1017 C HIS A 335 25.170 1.995 4.926 1.00 1.42 C ATOM 1018 O HIS A 335 24.455 1.672 3.980 1.00 1.25 O ATOM 1019 CB HIS A 335 23.207 1.826 6.416 1.00 1.57 C ATOM 1020 CG HIS A 335 22.319 2.481 7.425 1.00 2.04 C ATOM 1021 ND1 HIS A 335 21.318 3.370 7.262 1.00 2.46 N flip ATOM 1022 CD2 HIS A 335 22.419 2.263 8.777 1.00 2.70 C flip ATOM 1023 CE1 HIS A 335 20.835 3.677 8.504 1.00 2.90 C flip ATOM 1024 NE2 HIS A 335 21.516 2.991 9.404 1.00 3.03 N flip ATOM 0 H HIS A 335 23.996 4.362 5.302 1.00 1.57 H new ATOM 0 HA HIS A 335 25.209 2.331 7.050 1.00 1.57 H new ATOM 0 HB2 HIS A 335 22.681 1.778 5.463 1.00 1.57 H new ATOM 0 HB3 HIS A 335 23.396 0.799 6.728 1.00 1.57 H new ATOM 0 HD1 HIS A 335 20.983 3.745 6.375 1.00 2.46 H new ATOM 0 HD2 HIS A 335 23.126 1.599 9.252 1.00 2.70 H new ATOM 0 HE1 HIS A 335 20.030 4.366 8.714 1.00 2.90 H new ATOM 1033 N PRO A 336 26.497 1.897 4.867 1.00 1.54 N ATOM 1034 CA PRO A 336 27.162 1.212 3.767 1.00 1.50 C ATOM 1035 C PRO A 336 26.833 -0.277 3.792 1.00 1.49 C ATOM 1036 O PRO A 336 27.007 -0.942 4.816 1.00 1.64 O ATOM 1037 CB PRO A 336 28.657 1.445 4.031 1.00 1.74 C ATOM 1038 CG PRO A 336 28.716 2.538 5.046 1.00 1.98 C ATOM 1039 CD PRO A 336 27.450 2.431 5.845 1.00 1.78 C ATOM 0 HA PRO A 336 26.850 1.579 2.789 1.00 1.50 H new ATOM 0 HB2 PRO A 336 29.136 0.539 4.402 1.00 1.74 H new ATOM 0 HB3 PRO A 336 29.177 1.730 3.117 1.00 1.74 H new ATOM 0 HG2 PRO A 336 29.591 2.429 5.686 1.00 1.98 H new ATOM 0 HG3 PRO A 336 28.792 3.513 4.565 1.00 1.98 H new ATOM 0 HD2 PRO A 336 27.566 1.767 6.701 1.00 1.78 H new ATOM 0 HD3 PRO A 336 27.133 3.399 6.233 1.00 1.78 H new ATOM 1047 N GLY A 337 26.346 -0.799 2.680 1.00 1.38 N ATOM 1048 CA GLY A 337 26.029 -2.210 2.616 1.00 1.46 C ATOM 1049 C GLY A 337 24.536 -2.485 2.671 1.00 1.34 C ATOM 1050 O GLY A 337 24.105 -3.620 2.463 1.00 1.40 O ATOM 0 H GLY A 337 26.165 -0.275 1.824 1.00 1.38 H new ATOM 0 HA2 GLY A 337 26.436 -2.627 1.695 1.00 1.46 H new ATOM 0 HA3 GLY A 337 26.519 -2.725 3.443 1.00 1.46 H new ATOM 1054 N CYS A 338 23.739 -1.465 2.966 1.00 1.24 N ATOM 1055 CA CYS A 338 22.293 -1.605 2.886 1.00 1.18 C ATOM 1056 C CYS A 338 21.901 -1.684 1.420 1.00 1.13 C ATOM 1057 O CYS A 338 22.506 -1.023 0.579 1.00 1.14 O ATOM 1058 CB CYS A 338 21.593 -0.426 3.577 1.00 1.22 C ATOM 1059 SG CYS A 338 21.850 1.174 2.781 1.00 1.51 S ATOM 0 H CYS A 338 24.065 -0.544 3.259 1.00 1.24 H new ATOM 0 HA CYS A 338 21.980 -2.514 3.400 1.00 1.18 H new ATOM 0 HB2 CYS A 338 20.523 -0.629 3.617 1.00 1.22 H new ATOM 0 HB3 CYS A 338 21.945 -0.365 4.607 1.00 1.22 H new ATOM 0 HG CYS A 338 23.047 1.605 3.049 1.00 1.51 H new ATOM 1065 N GLY A 339 20.918 -2.508 1.109 1.00 1.14 N ATOM 1066 CA GLY A 339 20.552 -2.703 -0.276 1.00 1.19 C ATOM 1067 C GLY A 339 20.379 -4.164 -0.644 1.00 1.24 C ATOM 1068 O GLY A 339 19.260 -4.607 -0.891 1.00 1.20 O ATOM 0 H GLY A 339 20.370 -3.042 1.783 1.00 1.14 H new ATOM 0 HA2 GLY A 339 19.623 -2.171 -0.479 1.00 1.19 H new ATOM 0 HA3 GLY A 339 21.318 -2.262 -0.914 1.00 1.19 H new ATOM 1072 N PRO A 340 21.475 -4.943 -0.694 1.00 1.40 N ATOM 1073 CA PRO A 340 21.433 -6.360 -1.084 1.00 1.55 C ATOM 1074 C PRO A 340 20.547 -7.201 -0.167 1.00 1.50 C ATOM 1075 O PRO A 340 20.023 -8.239 -0.571 1.00 1.61 O ATOM 1076 CB PRO A 340 22.895 -6.817 -0.981 1.00 1.80 C ATOM 1077 CG PRO A 340 23.568 -5.794 -0.134 1.00 1.74 C ATOM 1078 CD PRO A 340 22.849 -4.504 -0.396 1.00 1.53 C ATOM 0 HA PRO A 340 21.005 -6.483 -2.079 1.00 1.55 H new ATOM 0 HB2 PRO A 340 22.967 -7.808 -0.532 1.00 1.80 H new ATOM 0 HB3 PRO A 340 23.358 -6.879 -1.966 1.00 1.80 H new ATOM 0 HG2 PRO A 340 23.514 -6.064 0.921 1.00 1.74 H new ATOM 0 HG3 PRO A 340 24.625 -5.711 -0.388 1.00 1.74 H new ATOM 0 HD2 PRO A 340 22.882 -3.841 0.469 1.00 1.53 H new ATOM 0 HD3 PRO A 340 23.289 -3.960 -1.232 1.00 1.53 H new ATOM 1086 N HIS A 341 20.380 -6.753 1.070 1.00 1.42 N ATOM 1087 CA HIS A 341 19.536 -7.466 2.016 1.00 1.48 C ATOM 1088 C HIS A 341 18.361 -6.603 2.455 1.00 1.23 C ATOM 1089 O HIS A 341 17.564 -7.011 3.290 1.00 1.29 O ATOM 1090 CB HIS A 341 20.344 -7.941 3.229 1.00 1.76 C ATOM 1091 CG HIS A 341 21.040 -6.851 3.991 1.00 1.97 C ATOM 1092 ND1 HIS A 341 22.344 -6.490 3.751 1.00 2.03 N ATOM 1093 CD2 HIS A 341 20.612 -6.058 5.002 1.00 2.67 C ATOM 1094 CE1 HIS A 341 22.690 -5.522 4.578 1.00 2.64 C ATOM 1095 NE2 HIS A 341 21.659 -5.240 5.353 1.00 3.12 N ATOM 0 H HIS A 341 20.814 -5.907 1.439 1.00 1.42 H new ATOM 0 HA HIS A 341 19.140 -8.347 1.510 1.00 1.48 H new ATOM 0 HB2 HIS A 341 19.675 -8.469 3.908 1.00 1.76 H new ATOM 0 HB3 HIS A 341 21.089 -8.661 2.891 1.00 1.76 H new ATOM 0 HD2 HIS A 341 19.629 -6.067 5.450 1.00 2.67 H new ATOM 0 HE1 HIS A 341 23.656 -5.040 4.615 1.00 2.64 H new ATOM 0 HE2 HIS A 341 21.642 -4.534 6.089 1.00 3.12 H new ATOM 1104 N THR A 342 18.276 -5.401 1.911 1.00 1.02 N ATOM 1105 CA THR A 342 17.147 -4.532 2.192 1.00 0.85 C ATOM 1106 C THR A 342 15.930 -4.873 1.354 1.00 0.77 C ATOM 1107 O THR A 342 16.000 -4.928 0.128 1.00 0.87 O ATOM 1108 CB THR A 342 17.463 -3.060 1.917 1.00 0.85 C ATOM 1109 OG1 THR A 342 18.548 -2.613 2.740 1.00 0.95 O ATOM 1110 CG2 THR A 342 16.227 -2.207 2.154 1.00 0.94 C ATOM 0 H THR A 342 18.970 -5.007 1.276 1.00 1.02 H new ATOM 0 HA THR A 342 16.940 -4.690 3.250 1.00 0.85 H new ATOM 0 HB THR A 342 17.764 -2.958 0.874 1.00 0.85 H new ATOM 0 HG1 THR A 342 18.737 -1.671 2.549 1.00 0.95 H new ATOM 0 HG21 THR A 342 16.463 -1.162 1.956 1.00 0.94 H new ATOM 0 HG22 THR A 342 15.428 -2.531 1.488 1.00 0.94 H new ATOM 0 HG23 THR A 342 15.903 -2.316 3.189 1.00 0.94 H new ATOM 1118 N THR A 343 14.828 -5.116 2.026 1.00 0.75 N ATOM 1119 CA THR A 343 13.535 -4.998 1.408 1.00 0.69 C ATOM 1120 C THR A 343 12.605 -4.225 2.339 1.00 0.62 C ATOM 1121 O THR A 343 12.557 -4.494 3.544 1.00 0.70 O ATOM 1122 CB THR A 343 12.915 -6.352 1.043 1.00 0.86 C ATOM 1123 OG1 THR A 343 13.868 -7.410 1.232 1.00 1.07 O ATOM 1124 CG2 THR A 343 12.463 -6.328 -0.407 1.00 0.90 C ATOM 0 H THR A 343 14.806 -5.398 3.006 1.00 0.75 H new ATOM 0 HA THR A 343 13.669 -4.461 0.469 1.00 0.69 H new ATOM 0 HB THR A 343 12.059 -6.532 1.693 1.00 0.86 H new ATOM 0 HG1 THR A 343 13.456 -8.267 0.996 1.00 1.07 H new ATOM 0 HG21 THR A 343 12.022 -7.290 -0.667 1.00 0.90 H new ATOM 0 HG22 THR A 343 11.722 -5.541 -0.544 1.00 0.90 H new ATOM 0 HG23 THR A 343 13.320 -6.136 -1.052 1.00 0.90 H new ATOM 1132 N PHE A 344 11.930 -3.228 1.795 1.00 0.56 N ATOM 1133 CA PHE A 344 10.958 -2.453 2.550 1.00 0.56 C ATOM 1134 C PHE A 344 9.580 -3.055 2.382 1.00 0.55 C ATOM 1135 O PHE A 344 9.226 -3.540 1.308 1.00 0.66 O ATOM 1136 CB PHE A 344 10.940 -0.997 2.079 1.00 0.67 C ATOM 1137 CG PHE A 344 11.858 -0.078 2.836 1.00 0.75 C ATOM 1138 CD1 PHE A 344 13.221 -0.310 2.882 1.00 0.78 C ATOM 1139 CD2 PHE A 344 11.349 1.030 3.494 1.00 1.38 C ATOM 1140 CE1 PHE A 344 14.059 0.544 3.573 1.00 1.11 C ATOM 1141 CE2 PHE A 344 12.184 1.887 4.187 1.00 1.80 C ATOM 1142 CZ PHE A 344 13.541 1.643 4.225 1.00 1.59 C ATOM 0 H PHE A 344 12.038 -2.933 0.825 1.00 0.56 H new ATOM 0 HA PHE A 344 11.243 -2.476 3.602 1.00 0.56 H new ATOM 0 HB2 PHE A 344 11.210 -0.968 1.023 1.00 0.67 H new ATOM 0 HB3 PHE A 344 9.922 -0.617 2.159 1.00 0.67 H new ATOM 0 HD1 PHE A 344 13.634 -1.168 2.372 1.00 0.78 H new ATOM 0 HD2 PHE A 344 10.287 1.227 3.465 1.00 1.38 H new ATOM 0 HE1 PHE A 344 15.121 0.350 3.602 1.00 1.11 H new ATOM 0 HE2 PHE A 344 11.774 2.746 4.698 1.00 1.80 H new ATOM 0 HZ PHE A 344 14.196 2.311 4.764 1.00 1.59 H new ATOM 1152 N ARG A 345 8.816 -3.038 3.451 1.00 0.52 N ATOM 1153 CA ARG A 345 7.491 -3.617 3.441 1.00 0.53 C ATOM 1154 C ARG A 345 6.519 -2.761 4.234 1.00 0.60 C ATOM 1155 O ARG A 345 6.805 -2.351 5.360 1.00 0.71 O ATOM 1156 CB ARG A 345 7.541 -5.034 4.007 1.00 0.63 C ATOM 1157 CG ARG A 345 8.333 -5.134 5.298 1.00 0.97 C ATOM 1158 CD ARG A 345 9.387 -6.222 5.214 1.00 1.13 C ATOM 1159 NE ARG A 345 8.792 -7.537 4.970 1.00 1.56 N ATOM 1160 CZ ARG A 345 9.373 -8.498 4.259 1.00 2.17 C ATOM 1161 NH1 ARG A 345 10.566 -8.295 3.709 1.00 2.72 N ATOM 1162 NH2 ARG A 345 8.760 -9.661 4.096 1.00 2.72 N ATOM 0 H ARG A 345 9.091 -2.627 4.343 1.00 0.52 H new ATOM 0 HA ARG A 345 7.137 -3.658 2.411 1.00 0.53 H new ATOM 0 HB2 ARG A 345 6.524 -5.384 4.184 1.00 0.63 H new ATOM 0 HB3 ARG A 345 7.982 -5.699 3.265 1.00 0.63 H new ATOM 0 HG2 ARG A 345 8.811 -4.177 5.509 1.00 0.97 H new ATOM 0 HG3 ARG A 345 7.657 -5.343 6.127 1.00 0.97 H new ATOM 0 HD2 ARG A 345 10.089 -5.987 4.414 1.00 1.13 H new ATOM 0 HD3 ARG A 345 9.958 -6.248 6.142 1.00 1.13 H new ATOM 0 HE ARG A 345 7.874 -7.728 5.371 1.00 1.56 H new ATOM 0 HH11 ARG A 345 11.039 -7.399 3.832 1.00 2.72 H new ATOM 0 HH12 ARG A 345 11.009 -9.035 3.164 1.00 2.72 H new ATOM 0 HH21 ARG A 345 7.844 -9.818 4.516 1.00 2.72 H new ATOM 0 HH22 ARG A 345 9.204 -10.400 3.551 1.00 2.72 H new ATOM 1176 N TRP A 346 5.383 -2.486 3.631 1.00 0.68 N ATOM 1177 CA TRP A 346 4.320 -1.759 4.290 1.00 0.87 C ATOM 1178 C TRP A 346 3.102 -2.654 4.397 1.00 0.83 C ATOM 1179 O TRP A 346 2.701 -3.279 3.428 1.00 0.82 O ATOM 1180 CB TRP A 346 3.965 -0.477 3.534 1.00 1.20 C ATOM 1181 CG TRP A 346 2.727 0.187 4.063 1.00 1.26 C ATOM 1182 CD1 TRP A 346 1.443 -0.092 3.705 1.00 1.31 C ATOM 1183 CD2 TRP A 346 2.651 1.219 5.053 1.00 1.83 C ATOM 1184 NE1 TRP A 346 0.573 0.708 4.399 1.00 1.85 N ATOM 1185 CE2 TRP A 346 1.287 1.522 5.233 1.00 2.27 C ATOM 1186 CE3 TRP A 346 3.596 1.916 5.802 1.00 2.19 C ATOM 1187 CZ2 TRP A 346 0.850 2.491 6.131 1.00 3.10 C ATOM 1188 CZ3 TRP A 346 3.161 2.877 6.693 1.00 3.00 C ATOM 1189 CH2 TRP A 346 1.799 3.156 6.852 1.00 3.46 C ATOM 0 H TRP A 346 5.170 -2.760 2.672 1.00 0.68 H new ATOM 0 HA TRP A 346 4.661 -1.470 5.284 1.00 0.87 H new ATOM 0 HB2 TRP A 346 4.801 0.220 3.597 1.00 1.20 H new ATOM 0 HB3 TRP A 346 3.824 -0.710 2.479 1.00 1.20 H new ATOM 0 HD1 TRP A 346 1.152 -0.837 2.979 1.00 1.31 H new ATOM 0 HE1 TRP A 346 -0.443 0.698 4.308 1.00 1.85 H new ATOM 0 HE3 TRP A 346 4.650 1.709 5.688 1.00 2.19 H new ATOM 0 HZ2 TRP A 346 -0.201 2.709 6.253 1.00 3.10 H new ATOM 0 HZ3 TRP A 346 3.886 3.424 7.278 1.00 3.00 H new ATOM 0 HH2 TRP A 346 1.493 3.913 7.559 1.00 3.46 H new ATOM 1200 N GLN A 347 2.524 -2.718 5.568 1.00 0.92 N ATOM 1201 CA GLN A 347 1.394 -3.586 5.798 1.00 0.94 C ATOM 1202 C GLN A 347 0.243 -2.751 6.312 1.00 1.23 C ATOM 1203 O GLN A 347 0.370 -2.075 7.335 1.00 1.48 O ATOM 1204 CB GLN A 347 1.773 -4.683 6.803 1.00 0.98 C ATOM 1205 CG GLN A 347 0.780 -5.843 6.902 1.00 1.10 C ATOM 1206 CD GLN A 347 -0.579 -5.467 7.477 1.00 1.34 C ATOM 1207 OE1 GLN A 347 -1.592 -6.061 7.120 1.00 1.68 O ATOM 1208 NE2 GLN A 347 -0.612 -4.502 8.383 1.00 1.83 N ATOM 0 H GLN A 347 2.817 -2.178 6.382 1.00 0.92 H new ATOM 0 HA GLN A 347 1.096 -4.074 4.870 1.00 0.94 H new ATOM 0 HB2 GLN A 347 2.749 -5.083 6.530 1.00 0.98 H new ATOM 0 HB3 GLN A 347 1.879 -4.230 7.789 1.00 0.98 H new ATOM 0 HG2 GLN A 347 0.635 -6.266 5.908 1.00 1.10 H new ATOM 0 HG3 GLN A 347 1.217 -6.627 7.521 1.00 1.10 H new ATOM 0 HE21 GLN A 347 0.250 -4.029 8.656 1.00 1.83 H new ATOM 0 HE22 GLN A 347 -1.499 -4.231 8.808 1.00 1.83 H new ATOM 1217 N VAL A 348 -0.867 -2.769 5.603 1.00 1.29 N ATOM 1218 CA VAL A 348 -2.042 -2.089 6.077 1.00 1.62 C ATOM 1219 C VAL A 348 -3.236 -3.021 6.173 1.00 1.60 C ATOM 1220 O VAL A 348 -3.458 -3.854 5.297 1.00 1.47 O ATOM 1221 CB VAL A 348 -2.379 -0.848 5.228 1.00 1.87 C ATOM 1222 CG1 VAL A 348 -3.724 -0.965 4.519 1.00 2.19 C ATOM 1223 CG2 VAL A 348 -2.353 0.344 6.147 1.00 2.07 C ATOM 0 H VAL A 348 -0.975 -3.243 4.706 1.00 1.29 H new ATOM 0 HA VAL A 348 -1.810 -1.742 7.084 1.00 1.62 H new ATOM 0 HB VAL A 348 -1.641 -0.745 4.432 1.00 1.87 H new ATOM 0 HG11 VAL A 348 -3.908 -0.062 3.936 1.00 2.19 H new ATOM 0 HG12 VAL A 348 -3.711 -1.829 3.855 1.00 2.19 H new ATOM 0 HG13 VAL A 348 -4.516 -1.087 5.258 1.00 2.19 H new ATOM 0 HG21 VAL A 348 -2.588 1.245 5.581 1.00 2.07 H new ATOM 0 HG22 VAL A 348 -3.091 0.210 6.938 1.00 2.07 H new ATOM 0 HG23 VAL A 348 -1.361 0.441 6.589 1.00 2.07 H new ATOM 1233 N LYS A 349 -3.980 -2.884 7.261 1.00 1.80 N ATOM 1234 CA LYS A 349 -5.260 -3.552 7.399 1.00 1.85 C ATOM 1235 C LYS A 349 -6.373 -2.525 7.316 1.00 2.22 C ATOM 1236 O LYS A 349 -6.505 -1.661 8.184 1.00 2.63 O ATOM 1237 CB LYS A 349 -5.357 -4.328 8.715 1.00 2.07 C ATOM 1238 CG LYS A 349 -4.418 -5.521 8.790 1.00 2.07 C ATOM 1239 CD LYS A 349 -4.673 -6.361 10.033 1.00 2.29 C ATOM 1240 CE LYS A 349 -6.040 -7.034 9.996 1.00 2.67 C ATOM 1241 NZ LYS A 349 -6.148 -8.048 8.909 1.00 3.18 N ATOM 0 H LYS A 349 -3.715 -2.313 8.063 1.00 1.80 H new ATOM 0 HA LYS A 349 -5.358 -4.273 6.588 1.00 1.85 H new ATOM 0 HB2 LYS A 349 -5.139 -3.652 9.542 1.00 2.07 H new ATOM 0 HB3 LYS A 349 -6.382 -4.674 8.848 1.00 2.07 H new ATOM 0 HG2 LYS A 349 -4.543 -6.139 7.901 1.00 2.07 H new ATOM 0 HG3 LYS A 349 -3.385 -5.172 8.792 1.00 2.07 H new ATOM 0 HD2 LYS A 349 -3.897 -7.121 10.123 1.00 2.29 H new ATOM 0 HD3 LYS A 349 -4.604 -5.729 10.918 1.00 2.29 H new ATOM 0 HE2 LYS A 349 -6.231 -7.513 10.956 1.00 2.67 H new ATOM 0 HE3 LYS A 349 -6.811 -6.276 9.859 1.00 2.67 H new ATOM 0 HZ1 LYS A 349 -6.848 -8.770 9.176 1.00 3.18 H new ATOM 0 HZ2 LYS A 349 -6.449 -7.583 8.029 1.00 3.18 H new ATOM 0 HZ3 LYS A 349 -5.223 -8.500 8.763 1.00 3.18 H new ATOM 1255 N LEU A 350 -7.152 -2.610 6.258 1.00 2.25 N ATOM 1256 CA LEU A 350 -8.247 -1.686 6.032 1.00 2.70 C ATOM 1257 C LEU A 350 -9.472 -2.137 6.805 1.00 2.71 C ATOM 1258 O LEU A 350 -9.643 -3.325 7.081 1.00 2.61 O ATOM 1259 CB LEU A 350 -8.577 -1.597 4.539 1.00 3.11 C ATOM 1260 CG LEU A 350 -7.467 -1.020 3.658 1.00 3.82 C ATOM 1261 CD1 LEU A 350 -7.870 -1.077 2.195 1.00 4.37 C ATOM 1262 CD2 LEU A 350 -7.150 0.413 4.066 1.00 4.52 C ATOM 0 H LEU A 350 -7.046 -3.318 5.532 1.00 2.25 H new ATOM 0 HA LEU A 350 -7.945 -0.698 6.381 1.00 2.70 H new ATOM 0 HB2 LEU A 350 -8.823 -2.596 4.178 1.00 3.11 H new ATOM 0 HB3 LEU A 350 -9.471 -0.985 4.417 1.00 3.11 H new ATOM 0 HG LEU A 350 -6.570 -1.623 3.795 1.00 3.82 H new ATOM 0 HD11 LEU A 350 -7.070 -0.663 1.581 1.00 4.37 H new ATOM 0 HD12 LEU A 350 -8.049 -2.113 1.907 1.00 4.37 H new ATOM 0 HD13 LEU A 350 -8.780 -0.496 2.045 1.00 4.37 H new ATOM 0 HD21 LEU A 350 -6.358 0.806 3.428 1.00 4.52 H new ATOM 0 HD22 LEU A 350 -8.043 1.028 3.957 1.00 4.52 H new ATOM 0 HD23 LEU A 350 -6.821 0.431 5.105 1.00 4.52 H new ATOM 1274 N ARG A 351 -10.310 -1.190 7.175 1.00 3.14 N ATOM 1275 CA ARG A 351 -11.541 -1.520 7.855 1.00 3.36 C ATOM 1276 C ARG A 351 -12.613 -1.850 6.837 1.00 3.30 C ATOM 1277 O ARG A 351 -12.872 -1.061 5.922 1.00 3.63 O ATOM 1278 CB ARG A 351 -11.999 -0.374 8.756 1.00 4.12 C ATOM 1279 CG ARG A 351 -11.225 -0.286 10.056 1.00 4.71 C ATOM 1280 CD ARG A 351 -11.819 0.765 10.975 1.00 5.40 C ATOM 1281 NE ARG A 351 -11.278 0.678 12.330 1.00 5.87 N ATOM 1282 CZ ARG A 351 -12.031 0.558 13.425 1.00 6.64 C ATOM 1283 NH1 ARG A 351 -13.354 0.479 13.324 1.00 7.03 N ATOM 1284 NH2 ARG A 351 -11.459 0.494 14.617 1.00 7.28 N ATOM 0 H ARG A 351 -10.161 -0.193 7.017 1.00 3.14 H new ATOM 0 HA ARG A 351 -11.363 -2.390 8.488 1.00 3.36 H new ATOM 0 HB2 ARG A 351 -11.896 0.567 8.216 1.00 4.12 H new ATOM 0 HB3 ARG A 351 -13.058 -0.499 8.980 1.00 4.12 H new ATOM 0 HG2 ARG A 351 -11.233 -1.256 10.554 1.00 4.71 H new ATOM 0 HG3 ARG A 351 -10.183 -0.044 9.847 1.00 4.71 H new ATOM 0 HD2 ARG A 351 -11.620 1.756 10.568 1.00 5.40 H new ATOM 0 HD3 ARG A 351 -12.902 0.646 11.009 1.00 5.40 H new ATOM 0 HE ARG A 351 -10.265 0.711 12.445 1.00 5.87 H new ATOM 0 HH11 ARG A 351 -13.798 0.510 12.406 1.00 7.03 H new ATOM 0 HH12 ARG A 351 -13.925 0.387 14.164 1.00 7.03 H new ATOM 0 HH21 ARG A 351 -10.443 0.536 14.698 1.00 7.28 H new ATOM 0 HH22 ARG A 351 -12.034 0.402 15.454 1.00 7.28 H new ATOM 1298 N ASN A 352 -13.205 -3.035 7.006 1.00 3.11 N ATOM 1299 CA ASN A 352 -14.244 -3.554 6.119 1.00 3.07 C ATOM 1300 C ASN A 352 -13.639 -4.070 4.818 1.00 2.54 C ATOM 1301 O ASN A 352 -13.076 -3.314 4.027 1.00 2.97 O ATOM 1302 CB ASN A 352 -15.327 -2.505 5.847 1.00 3.40 C ATOM 1303 CG ASN A 352 -16.005 -2.040 7.122 1.00 3.96 C ATOM 1304 OD1 ASN A 352 -15.623 -1.034 7.717 1.00 4.25 O ATOM 1305 ND2 ASN A 352 -17.005 -2.785 7.566 1.00 4.59 N ATOM 0 H ASN A 352 -12.972 -3.667 7.772 1.00 3.11 H new ATOM 0 HA ASN A 352 -14.723 -4.392 6.625 1.00 3.07 H new ATOM 0 HB2 ASN A 352 -14.882 -1.648 5.340 1.00 3.40 H new ATOM 0 HB3 ASN A 352 -16.074 -2.922 5.171 1.00 3.40 H new ATOM 0 HD21 ASN A 352 -17.486 -2.531 8.429 1.00 4.59 H new ATOM 0 HD22 ASN A 352 -17.294 -3.613 7.045 1.00 4.59 H new ATOM 1312 N LEU A 353 -13.739 -5.388 4.640 1.00 1.99 N ATOM 1313 CA LEU A 353 -13.209 -6.086 3.470 1.00 1.68 C ATOM 1314 C LEU A 353 -13.607 -5.417 2.154 1.00 1.33 C ATOM 1315 O LEU A 353 -14.694 -4.851 2.029 1.00 1.33 O ATOM 1316 CB LEU A 353 -13.686 -7.547 3.451 1.00 1.81 C ATOM 1317 CG LEU A 353 -15.177 -7.774 3.139 1.00 2.28 C ATOM 1318 CD1 LEU A 353 -15.441 -9.248 2.870 1.00 2.69 C ATOM 1319 CD2 LEU A 353 -16.062 -7.292 4.280 1.00 2.93 C ATOM 0 H LEU A 353 -14.195 -6.006 5.311 1.00 1.99 H new ATOM 0 HA LEU A 353 -12.123 -6.045 3.555 1.00 1.68 H new ATOM 0 HB2 LEU A 353 -13.096 -8.090 2.713 1.00 1.81 H new ATOM 0 HB3 LEU A 353 -13.468 -7.991 4.423 1.00 1.81 H new ATOM 0 HG LEU A 353 -15.422 -7.194 2.249 1.00 2.28 H new ATOM 0 HD11 LEU A 353 -16.499 -9.394 2.651 1.00 2.69 H new ATOM 0 HD12 LEU A 353 -14.845 -9.575 2.018 1.00 2.69 H new ATOM 0 HD13 LEU A 353 -15.168 -9.833 3.749 1.00 2.69 H new ATOM 0 HD21 LEU A 353 -17.108 -7.467 4.028 1.00 2.93 H new ATOM 0 HD22 LEU A 353 -15.812 -7.838 5.190 1.00 2.93 H new ATOM 0 HD23 LEU A 353 -15.901 -6.226 4.440 1.00 2.93 H new ATOM 1331 N ILE A 354 -12.726 -5.528 1.168 1.00 1.20 N ATOM 1332 CA ILE A 354 -12.971 -4.965 -0.151 1.00 1.07 C ATOM 1333 C ILE A 354 -13.086 -6.069 -1.181 1.00 1.07 C ATOM 1334 O ILE A 354 -12.811 -7.234 -0.886 1.00 1.21 O ATOM 1335 CB ILE A 354 -11.858 -3.985 -0.610 1.00 1.13 C ATOM 1336 CG1 ILE A 354 -10.447 -4.495 -0.255 1.00 1.28 C ATOM 1337 CG2 ILE A 354 -12.109 -2.603 -0.040 1.00 1.20 C ATOM 1338 CD1 ILE A 354 -10.010 -4.211 1.172 1.00 1.55 C ATOM 0 H ILE A 354 -11.830 -6.006 1.259 1.00 1.20 H new ATOM 0 HA ILE A 354 -13.904 -4.406 -0.071 1.00 1.07 H new ATOM 0 HB ILE A 354 -11.897 -3.924 -1.698 1.00 1.13 H new ATOM 0 HG12 ILE A 354 -10.411 -5.571 -0.424 1.00 1.28 H new ATOM 0 HG13 ILE A 354 -9.729 -4.041 -0.938 1.00 1.28 H new ATOM 0 HG21 ILE A 354 -11.322 -1.925 -0.369 1.00 1.20 H new ATOM 0 HG22 ILE A 354 -13.074 -2.235 -0.389 1.00 1.20 H new ATOM 0 HG23 ILE A 354 -12.112 -2.654 1.049 1.00 1.20 H new ATOM 0 HD11 ILE A 354 -9.006 -4.605 1.330 1.00 1.55 H new ATOM 0 HD12 ILE A 354 -10.008 -3.135 1.345 1.00 1.55 H new ATOM 0 HD13 ILE A 354 -10.701 -4.689 1.866 1.00 1.55 H new ATOM 1350 N GLU A 355 -13.503 -5.702 -2.384 1.00 1.08 N ATOM 1351 CA GLU A 355 -13.617 -6.657 -3.479 1.00 1.20 C ATOM 1352 C GLU A 355 -12.434 -6.467 -4.417 1.00 1.23 C ATOM 1353 O GLU A 355 -12.524 -5.702 -5.378 1.00 1.21 O ATOM 1354 CB GLU A 355 -14.925 -6.455 -4.251 1.00 1.26 C ATOM 1355 CG GLU A 355 -16.164 -6.365 -3.372 1.00 1.69 C ATOM 1356 CD GLU A 355 -16.643 -7.718 -2.884 1.00 2.01 C ATOM 1357 OE1 GLU A 355 -16.281 -8.102 -1.751 1.00 2.64 O ATOM 1358 OE2 GLU A 355 -17.364 -8.410 -3.629 1.00 2.22 O ATOM 0 H GLU A 355 -13.769 -4.748 -2.628 1.00 1.08 H new ATOM 0 HA GLU A 355 -13.619 -7.667 -3.070 1.00 1.20 H new ATOM 0 HB2 GLU A 355 -14.847 -5.543 -4.843 1.00 1.26 H new ATOM 0 HB3 GLU A 355 -15.050 -7.280 -4.952 1.00 1.26 H new ATOM 0 HG2 GLU A 355 -15.948 -5.731 -2.512 1.00 1.69 H new ATOM 0 HG3 GLU A 355 -16.965 -5.882 -3.931 1.00 1.69 H new ATOM 1365 N PRO A 356 -11.314 -7.164 -4.155 1.00 1.37 N ATOM 1366 CA PRO A 356 -10.035 -6.925 -4.836 1.00 1.47 C ATOM 1367 C PRO A 356 -10.153 -6.973 -6.353 1.00 1.50 C ATOM 1368 O PRO A 356 -9.511 -6.194 -7.054 1.00 1.55 O ATOM 1369 CB PRO A 356 -9.126 -8.056 -4.335 1.00 1.66 C ATOM 1370 CG PRO A 356 -10.037 -9.047 -3.696 1.00 1.62 C ATOM 1371 CD PRO A 356 -11.206 -8.262 -3.185 1.00 1.50 C ATOM 0 HA PRO A 356 -9.654 -5.928 -4.615 1.00 1.47 H new ATOM 0 HB2 PRO A 356 -8.571 -8.507 -5.158 1.00 1.66 H new ATOM 0 HB3 PRO A 356 -8.391 -7.682 -3.622 1.00 1.66 H new ATOM 0 HG2 PRO A 356 -10.358 -9.802 -4.414 1.00 1.62 H new ATOM 0 HG3 PRO A 356 -9.534 -9.572 -2.884 1.00 1.62 H new ATOM 0 HD2 PRO A 356 -12.114 -8.864 -3.154 1.00 1.50 H new ATOM 0 HD3 PRO A 356 -11.034 -7.892 -2.174 1.00 1.50 H new ATOM 1379 N GLU A 357 -11.000 -7.863 -6.849 1.00 1.52 N ATOM 1380 CA GLU A 357 -11.171 -8.036 -8.283 1.00 1.66 C ATOM 1381 C GLU A 357 -11.778 -6.799 -8.931 1.00 1.62 C ATOM 1382 O GLU A 357 -11.560 -6.533 -10.113 1.00 1.77 O ATOM 1383 CB GLU A 357 -12.030 -9.259 -8.565 1.00 1.77 C ATOM 1384 CG GLU A 357 -11.339 -10.546 -8.170 1.00 2.05 C ATOM 1385 CD GLU A 357 -10.215 -10.928 -9.112 1.00 2.54 C ATOM 1386 OE1 GLU A 357 -9.085 -10.429 -8.932 1.00 3.12 O ATOM 1387 OE2 GLU A 357 -10.458 -11.733 -10.032 1.00 2.79 O ATOM 0 H GLU A 357 -11.580 -8.477 -6.278 1.00 1.52 H new ATOM 0 HA GLU A 357 -10.184 -8.184 -8.721 1.00 1.66 H new ATOM 0 HB2 GLU A 357 -12.971 -9.173 -8.022 1.00 1.77 H new ATOM 0 HB3 GLU A 357 -12.276 -9.291 -9.626 1.00 1.77 H new ATOM 0 HG2 GLU A 357 -10.941 -10.443 -7.161 1.00 2.05 H new ATOM 0 HG3 GLU A 357 -12.072 -11.352 -8.142 1.00 2.05 H new ATOM 1394 N GLN A 358 -12.529 -6.035 -8.155 1.00 1.48 N ATOM 1395 CA GLN A 358 -13.139 -4.820 -8.665 1.00 1.50 C ATOM 1396 C GLN A 358 -12.200 -3.641 -8.477 1.00 1.42 C ATOM 1397 O GLN A 358 -12.280 -2.648 -9.197 1.00 1.51 O ATOM 1398 CB GLN A 358 -14.464 -4.527 -7.956 1.00 1.48 C ATOM 1399 CG GLN A 358 -15.459 -5.670 -8.007 1.00 1.58 C ATOM 1400 CD GLN A 358 -16.865 -5.223 -7.667 1.00 1.78 C ATOM 1401 OE1 GLN A 358 -17.230 -5.324 -6.400 1.00 1.94 O flip ATOM 1402 NE2 GLN A 358 -17.619 -4.792 -8.537 1.00 2.20 N flip ATOM 0 H GLN A 358 -12.730 -6.234 -7.175 1.00 1.48 H new ATOM 0 HA GLN A 358 -13.335 -4.968 -9.727 1.00 1.50 H new ATOM 0 HB2 GLN A 358 -14.260 -4.283 -6.913 1.00 1.48 H new ATOM 0 HB3 GLN A 358 -14.918 -3.644 -8.407 1.00 1.48 H new ATOM 0 HG2 GLN A 358 -15.451 -6.111 -9.004 1.00 1.58 H new ATOM 0 HG3 GLN A 358 -15.150 -6.450 -7.311 1.00 1.58 H new ATOM 0 HE21 GLN A 358 -17.299 -4.730 -9.504 1.00 2.20 H new ATOM 0 HE22 GLN A 358 -18.564 -4.497 -8.292 1.00 2.20 H new ATOM 1411 N CYS A 359 -11.293 -3.764 -7.517 1.00 1.30 N ATOM 1412 CA CYS A 359 -10.446 -2.675 -7.145 1.00 1.23 C ATOM 1413 C CYS A 359 -9.216 -2.620 -8.029 1.00 1.25 C ATOM 1414 O CYS A 359 -8.784 -3.629 -8.585 1.00 1.37 O ATOM 1415 CB CYS A 359 -10.061 -2.834 -5.696 1.00 1.22 C ATOM 1416 SG CYS A 359 -11.450 -3.168 -4.587 1.00 1.97 S ATOM 0 H CYS A 359 -11.136 -4.621 -6.987 1.00 1.30 H new ATOM 0 HA CYS A 359 -10.982 -1.735 -7.278 1.00 1.23 H new ATOM 0 HB2 CYS A 359 -9.340 -3.647 -5.611 1.00 1.22 H new ATOM 0 HB3 CYS A 359 -9.557 -1.926 -5.365 1.00 1.22 H new ATOM 0 HG CYS A 359 -12.176 -4.128 -5.078 1.00 1.97 H new ATOM 1422 N THR A 360 -8.666 -1.432 -8.163 1.00 1.18 N ATOM 1423 CA THR A 360 -7.561 -1.212 -9.069 1.00 1.25 C ATOM 1424 C THR A 360 -6.580 -0.226 -8.452 1.00 1.16 C ATOM 1425 O THR A 360 -6.857 0.360 -7.402 1.00 1.05 O ATOM 1426 CB THR A 360 -8.083 -0.683 -10.426 1.00 1.32 C ATOM 1427 OG1 THR A 360 -7.002 -0.456 -11.340 1.00 1.42 O ATOM 1428 CG2 THR A 360 -8.880 0.596 -10.224 1.00 1.24 C ATOM 0 H THR A 360 -8.968 -0.601 -7.654 1.00 1.18 H new ATOM 0 HA THR A 360 -7.046 -2.157 -9.244 1.00 1.25 H new ATOM 0 HB THR A 360 -8.737 -1.442 -10.856 1.00 1.32 H new ATOM 0 HG1 THR A 360 -7.357 -0.124 -12.191 1.00 1.42 H new ATOM 0 HG21 THR A 360 -9.241 0.956 -11.188 1.00 1.24 H new ATOM 0 HG22 THR A 360 -9.729 0.396 -9.570 1.00 1.24 H new ATOM 0 HG23 THR A 360 -8.242 1.354 -9.769 1.00 1.24 H new ATOM 1436 N PHE A 361 -5.453 -0.030 -9.104 1.00 1.24 N ATOM 1437 CA PHE A 361 -4.473 0.924 -8.637 1.00 1.20 C ATOM 1438 C PHE A 361 -4.148 1.910 -9.742 1.00 1.27 C ATOM 1439 O PHE A 361 -4.306 1.616 -10.927 1.00 1.41 O ATOM 1440 CB PHE A 361 -3.202 0.243 -8.117 1.00 1.32 C ATOM 1441 CG PHE A 361 -2.567 -0.732 -9.071 1.00 1.65 C ATOM 1442 CD1 PHE A 361 -1.623 -0.303 -9.991 1.00 2.30 C ATOM 1443 CD2 PHE A 361 -2.919 -2.071 -9.054 1.00 1.69 C ATOM 1444 CE1 PHE A 361 -1.042 -1.192 -10.873 1.00 3.04 C ATOM 1445 CE2 PHE A 361 -2.340 -2.965 -9.933 1.00 2.28 C ATOM 1446 CZ PHE A 361 -1.390 -2.541 -10.820 1.00 3.01 C ATOM 0 H PHE A 361 -5.194 -0.520 -9.960 1.00 1.24 H new ATOM 0 HA PHE A 361 -4.906 1.462 -7.793 1.00 1.20 H new ATOM 0 HB2 PHE A 361 -2.471 1.013 -7.868 1.00 1.32 H new ATOM 0 HB3 PHE A 361 -3.441 -0.281 -7.192 1.00 1.32 H new ATOM 0 HD1 PHE A 361 -1.339 0.739 -10.018 1.00 2.30 H new ATOM 0 HD2 PHE A 361 -3.655 -2.420 -8.345 1.00 1.69 H new ATOM 0 HE1 PHE A 361 -0.322 -0.845 -11.600 1.00 3.04 H new ATOM 0 HE2 PHE A 361 -2.639 -4.003 -9.920 1.00 2.28 H new ATOM 0 HZ PHE A 361 -0.910 -3.250 -11.478 1.00 3.01 H new ATOM 1456 N CYS A 362 -3.684 3.064 -9.336 1.00 1.21 N ATOM 1457 CA CYS A 362 -3.569 4.208 -10.206 1.00 1.30 C ATOM 1458 C CYS A 362 -2.233 4.908 -9.987 1.00 1.28 C ATOM 1459 O CYS A 362 -1.720 4.945 -8.872 1.00 1.10 O ATOM 1460 CB CYS A 362 -4.736 5.151 -9.917 1.00 1.25 C ATOM 1461 SG CYS A 362 -4.676 6.722 -10.809 1.00 1.74 S ATOM 0 H CYS A 362 -3.372 3.239 -8.381 1.00 1.21 H new ATOM 0 HA CYS A 362 -3.606 3.893 -11.249 1.00 1.30 H new ATOM 0 HB2 CYS A 362 -5.667 4.642 -10.167 1.00 1.25 H new ATOM 0 HB3 CYS A 362 -4.763 5.357 -8.847 1.00 1.25 H new ATOM 0 HG CYS A 362 -5.712 7.441 -10.492 1.00 1.74 H new ATOM 1467 N PHE A 363 -1.657 5.444 -11.045 1.00 1.51 N ATOM 1468 CA PHE A 363 -0.362 6.092 -10.940 1.00 1.52 C ATOM 1469 C PHE A 363 -0.448 7.553 -11.352 1.00 1.64 C ATOM 1470 O PHE A 363 -0.739 7.862 -12.509 1.00 1.92 O ATOM 1471 CB PHE A 363 0.678 5.383 -11.818 1.00 1.77 C ATOM 1472 CG PHE A 363 1.172 4.063 -11.286 1.00 1.76 C ATOM 1473 CD1 PHE A 363 0.571 3.453 -10.197 1.00 1.56 C ATOM 1474 CD2 PHE A 363 2.248 3.429 -11.885 1.00 2.03 C ATOM 1475 CE1 PHE A 363 1.027 2.243 -9.718 1.00 1.66 C ATOM 1476 CE2 PHE A 363 2.711 2.218 -11.410 1.00 2.11 C ATOM 1477 CZ PHE A 363 2.099 1.625 -10.327 1.00 1.94 C ATOM 0 H PHE A 363 -2.061 5.445 -11.982 1.00 1.51 H new ATOM 0 HA PHE A 363 -0.053 6.032 -9.896 1.00 1.52 H new ATOM 0 HB2 PHE A 363 0.246 5.220 -12.806 1.00 1.77 H new ATOM 0 HB3 PHE A 363 1.533 6.047 -11.949 1.00 1.77 H new ATOM 0 HD1 PHE A 363 -0.268 3.933 -9.715 1.00 1.56 H new ATOM 0 HD2 PHE A 363 2.731 3.888 -12.735 1.00 2.03 H new ATOM 0 HE1 PHE A 363 0.546 1.781 -8.869 1.00 1.66 H new ATOM 0 HE2 PHE A 363 3.552 1.736 -11.887 1.00 2.11 H new ATOM 0 HZ PHE A 363 2.459 0.677 -9.955 1.00 1.94 H new ATOM 1487 N THR A 364 -0.206 8.444 -10.407 1.00 1.49 N ATOM 1488 CA THR A 364 -0.040 9.844 -10.723 1.00 1.63 C ATOM 1489 C THR A 364 1.404 10.108 -11.127 1.00 1.61 C ATOM 1490 O THR A 364 2.194 9.169 -11.254 1.00 1.61 O ATOM 1491 CB THR A 364 -0.475 10.758 -9.559 1.00 1.53 C ATOM 1492 OG1 THR A 364 -0.053 10.220 -8.303 1.00 1.24 O ATOM 1493 CG2 THR A 364 -1.977 10.921 -9.554 1.00 1.76 C ATOM 0 H THR A 364 -0.121 8.219 -9.416 1.00 1.49 H new ATOM 0 HA THR A 364 -0.693 10.085 -11.562 1.00 1.63 H new ATOM 0 HB THR A 364 -0.004 11.730 -9.702 1.00 1.53 H new ATOM 0 HG1 THR A 364 -0.808 9.769 -7.870 1.00 1.24 H new ATOM 0 HG21 THR A 364 -2.270 11.568 -8.727 1.00 1.76 H new ATOM 0 HG22 THR A 364 -2.298 11.367 -10.495 1.00 1.76 H new ATOM 0 HG23 THR A 364 -2.448 9.945 -9.435 1.00 1.76 H new ATOM 1501 N ALA A 365 1.747 11.363 -11.350 1.00 1.71 N ATOM 1502 CA ALA A 365 3.047 11.701 -11.916 1.00 1.80 C ATOM 1503 C ALA A 365 4.187 11.264 -11.004 1.00 1.56 C ATOM 1504 O ALA A 365 5.184 10.706 -11.465 1.00 1.77 O ATOM 1505 CB ALA A 365 3.127 13.196 -12.176 1.00 1.94 C ATOM 0 H ALA A 365 1.149 12.165 -11.150 1.00 1.71 H new ATOM 0 HA ALA A 365 3.152 11.164 -12.858 1.00 1.80 H new ATOM 0 HB1 ALA A 365 4.102 13.440 -12.599 1.00 1.94 H new ATOM 0 HB2 ALA A 365 2.344 13.486 -12.877 1.00 1.94 H new ATOM 0 HB3 ALA A 365 2.993 13.736 -11.239 1.00 1.94 H new ATOM 1511 N SER A 366 4.029 11.505 -9.714 1.00 1.27 N ATOM 1512 CA SER A 366 5.063 11.173 -8.749 1.00 1.26 C ATOM 1513 C SER A 366 4.551 10.247 -7.652 1.00 1.17 C ATOM 1514 O SER A 366 5.335 9.645 -6.919 1.00 1.40 O ATOM 1515 CB SER A 366 5.561 12.458 -8.110 1.00 1.31 C ATOM 1516 OG SER A 366 6.189 13.304 -9.060 1.00 1.69 O ATOM 0 H SER A 366 3.194 11.930 -9.310 1.00 1.27 H new ATOM 0 HA SER A 366 5.863 10.654 -9.278 1.00 1.26 H new ATOM 0 HB2 SER A 366 4.725 12.984 -7.650 1.00 1.31 H new ATOM 0 HB3 SER A 366 6.265 12.220 -7.313 1.00 1.31 H new ATOM 0 HG SER A 366 6.496 14.122 -8.617 1.00 1.69 H new ATOM 1522 N ARG A 367 3.239 10.147 -7.526 1.00 0.97 N ATOM 1523 CA ARG A 367 2.643 9.458 -6.385 1.00 0.91 C ATOM 1524 C ARG A 367 1.841 8.237 -6.805 1.00 0.83 C ATOM 1525 O ARG A 367 1.554 8.031 -7.985 1.00 0.94 O ATOM 1526 CB ARG A 367 1.756 10.407 -5.581 1.00 1.05 C ATOM 1527 CG ARG A 367 2.452 11.692 -5.170 1.00 1.34 C ATOM 1528 CD ARG A 367 3.811 11.436 -4.537 1.00 2.29 C ATOM 1529 NE ARG A 367 4.467 12.688 -4.169 1.00 3.00 N ATOM 1530 CZ ARG A 367 5.485 12.788 -3.318 1.00 3.86 C ATOM 1531 NH1 ARG A 367 6.039 11.701 -2.789 1.00 4.18 N ATOM 1532 NH2 ARG A 367 5.966 13.982 -3.012 1.00 4.70 N ATOM 0 H ARG A 367 2.567 10.529 -8.192 1.00 0.97 H new ATOM 0 HA ARG A 367 3.467 9.117 -5.759 1.00 0.91 H new ATOM 0 HB2 ARG A 367 0.875 10.655 -6.172 1.00 1.05 H new ATOM 0 HB3 ARG A 367 1.405 9.892 -4.687 1.00 1.05 H new ATOM 0 HG2 ARG A 367 2.576 12.331 -6.044 1.00 1.34 H new ATOM 0 HG3 ARG A 367 1.822 12.234 -4.465 1.00 1.34 H new ATOM 0 HD2 ARG A 367 3.691 10.812 -3.652 1.00 2.29 H new ATOM 0 HD3 ARG A 367 4.441 10.883 -5.234 1.00 2.29 H new ATOM 0 HE ARG A 367 4.120 13.547 -4.595 1.00 3.00 H new ATOM 0 HH11 ARG A 367 5.684 10.777 -3.034 1.00 4.18 H new ATOM 0 HH12 ARG A 367 6.819 11.791 -2.138 1.00 4.18 H new ATOM 0 HH21 ARG A 367 5.557 14.819 -3.428 1.00 4.70 H new ATOM 0 HH22 ARG A 367 6.746 14.066 -2.360 1.00 4.70 H new ATOM 1546 N ILE A 368 1.516 7.416 -5.824 1.00 0.81 N ATOM 1547 CA ILE A 368 0.749 6.211 -6.058 1.00 0.84 C ATOM 1548 C ILE A 368 -0.687 6.366 -5.554 1.00 0.76 C ATOM 1549 O ILE A 368 -0.916 6.681 -4.384 1.00 0.80 O ATOM 1550 CB ILE A 368 1.399 5.001 -5.359 1.00 0.96 C ATOM 1551 CG1 ILE A 368 2.762 4.680 -5.984 1.00 1.12 C ATOM 1552 CG2 ILE A 368 0.470 3.795 -5.413 1.00 1.04 C ATOM 1553 CD1 ILE A 368 2.711 4.414 -7.475 1.00 1.92 C ATOM 0 H ILE A 368 1.775 7.566 -4.849 1.00 0.81 H new ATOM 0 HA ILE A 368 0.734 6.042 -7.135 1.00 0.84 H new ATOM 0 HB ILE A 368 1.566 5.253 -4.312 1.00 0.96 H new ATOM 0 HG12 ILE A 368 3.441 5.512 -5.797 1.00 1.12 H new ATOM 0 HG13 ILE A 368 3.183 3.807 -5.484 1.00 1.12 H new ATOM 0 HG21 ILE A 368 0.943 2.949 -4.915 1.00 1.04 H new ATOM 0 HG22 ILE A 368 -0.467 4.034 -4.910 1.00 1.04 H new ATOM 0 HG23 ILE A 368 0.268 3.538 -6.453 1.00 1.04 H new ATOM 0 HD11 ILE A 368 3.714 4.195 -7.840 1.00 1.92 H new ATOM 0 HD12 ILE A 368 2.060 3.562 -7.671 1.00 1.92 H new ATOM 0 HD13 ILE A 368 2.322 5.293 -7.988 1.00 1.92 H new ATOM 1565 N ASP A 369 -1.640 6.137 -6.442 1.00 0.78 N ATOM 1566 CA ASP A 369 -3.058 6.204 -6.109 1.00 0.73 C ATOM 1567 C ASP A 369 -3.648 4.797 -6.092 1.00 0.75 C ATOM 1568 O ASP A 369 -3.318 3.978 -6.939 1.00 0.87 O ATOM 1569 CB ASP A 369 -3.802 7.060 -7.141 1.00 0.87 C ATOM 1570 CG ASP A 369 -3.467 8.540 -7.058 1.00 1.23 C ATOM 1571 OD1 ASP A 369 -2.277 8.900 -7.161 1.00 1.66 O ATOM 1572 OD2 ASP A 369 -4.405 9.354 -6.922 1.00 1.58 O ATOM 0 H ASP A 369 -1.455 5.899 -7.416 1.00 0.78 H new ATOM 0 HA ASP A 369 -3.169 6.657 -5.124 1.00 0.73 H new ATOM 0 HB2 ASP A 369 -3.564 6.698 -8.141 1.00 0.87 H new ATOM 0 HB3 ASP A 369 -4.875 6.931 -7.002 1.00 0.87 H new ATOM 1577 N ILE A 370 -4.488 4.480 -5.121 1.00 0.66 N ATOM 1578 CA ILE A 370 -5.131 3.167 -5.109 1.00 0.70 C ATOM 1579 C ILE A 370 -6.624 3.275 -4.826 1.00 0.65 C ATOM 1580 O ILE A 370 -7.021 3.880 -3.834 1.00 0.60 O ATOM 1581 CB ILE A 370 -4.517 2.227 -4.051 1.00 0.74 C ATOM 1582 CG1 ILE A 370 -2.986 2.261 -4.106 1.00 0.83 C ATOM 1583 CG2 ILE A 370 -5.022 0.806 -4.264 1.00 0.84 C ATOM 1584 CD1 ILE A 370 -2.316 1.435 -3.025 1.00 1.38 C ATOM 0 H ILE A 370 -4.740 5.094 -4.346 1.00 0.66 H new ATOM 0 HA ILE A 370 -4.967 2.753 -6.104 1.00 0.70 H new ATOM 0 HB ILE A 370 -4.826 2.572 -3.064 1.00 0.74 H new ATOM 0 HG12 ILE A 370 -2.659 1.900 -5.081 1.00 0.83 H new ATOM 0 HG13 ILE A 370 -2.652 3.295 -4.020 1.00 0.83 H new ATOM 0 HG21 ILE A 370 -4.584 0.148 -3.513 1.00 0.84 H new ATOM 0 HG22 ILE A 370 -6.108 0.788 -4.173 1.00 0.84 H new ATOM 0 HG23 ILE A 370 -4.736 0.463 -5.258 1.00 0.84 H new ATOM 0 HD11 ILE A 370 -1.233 1.509 -3.129 1.00 1.38 H new ATOM 0 HD12 ILE A 370 -2.613 1.809 -2.045 1.00 1.38 H new ATOM 0 HD13 ILE A 370 -2.620 0.393 -3.123 1.00 1.38 H new ATOM 1596 N CYS A 371 -7.440 2.658 -5.670 1.00 0.74 N ATOM 1597 CA CYS A 371 -8.885 2.676 -5.490 1.00 0.75 C ATOM 1598 C CYS A 371 -9.389 1.360 -4.897 1.00 0.77 C ATOM 1599 O CYS A 371 -9.412 0.323 -5.574 1.00 0.92 O ATOM 1600 CB CYS A 371 -9.580 2.952 -6.825 1.00 0.92 C ATOM 1601 SG CYS A 371 -11.388 2.884 -6.754 1.00 1.75 S ATOM 0 H CYS A 371 -7.124 2.137 -6.488 1.00 0.74 H new ATOM 0 HA CYS A 371 -9.125 3.475 -4.789 1.00 0.75 H new ATOM 0 HB2 CYS A 371 -9.279 3.937 -7.181 1.00 0.92 H new ATOM 0 HB3 CYS A 371 -9.230 2.227 -7.560 1.00 0.92 H new ATOM 0 HG CYS A 371 -11.878 3.133 -7.932 1.00 1.75 H new ATOM 1607 N LEU A 372 -9.799 1.420 -3.631 1.00 0.69 N ATOM 1608 CA LEU A 372 -10.349 0.267 -2.922 1.00 0.77 C ATOM 1609 C LEU A 372 -11.867 0.374 -2.866 1.00 0.79 C ATOM 1610 O LEU A 372 -12.412 1.439 -2.583 1.00 0.78 O ATOM 1611 CB LEU A 372 -9.789 0.161 -1.492 1.00 0.80 C ATOM 1612 CG LEU A 372 -8.281 -0.105 -1.365 1.00 1.20 C ATOM 1613 CD1 LEU A 372 -7.846 -1.228 -2.296 1.00 1.87 C ATOM 1614 CD2 LEU A 372 -7.477 1.161 -1.628 1.00 2.07 C ATOM 0 H LEU A 372 -9.759 2.270 -3.068 1.00 0.69 H new ATOM 0 HA LEU A 372 -10.058 -0.631 -3.467 1.00 0.77 H new ATOM 0 HB2 LEU A 372 -10.017 1.088 -0.966 1.00 0.80 H new ATOM 0 HB3 LEU A 372 -10.321 -0.638 -0.975 1.00 0.80 H new ATOM 0 HG LEU A 372 -8.083 -0.420 -0.341 1.00 1.20 H new ATOM 0 HD11 LEU A 372 -6.775 -1.397 -2.187 1.00 1.87 H new ATOM 0 HD12 LEU A 372 -8.385 -2.141 -2.042 1.00 1.87 H new ATOM 0 HD13 LEU A 372 -8.067 -0.952 -3.327 1.00 1.87 H new ATOM 0 HD21 LEU A 372 -6.413 0.943 -1.531 1.00 2.07 H new ATOM 0 HD22 LEU A 372 -7.684 1.520 -2.636 1.00 2.07 H new ATOM 0 HD23 LEU A 372 -7.758 1.927 -0.905 1.00 2.07 H new ATOM 1626 N ARG A 373 -12.552 -0.713 -3.170 1.00 0.99 N ATOM 1627 CA ARG A 373 -14.009 -0.704 -3.231 1.00 1.11 C ATOM 1628 C ARG A 373 -14.590 -1.805 -2.355 1.00 1.06 C ATOM 1629 O ARG A 373 -14.300 -2.986 -2.559 1.00 1.26 O ATOM 1630 CB ARG A 373 -14.453 -0.895 -4.675 1.00 1.68 C ATOM 1631 CG ARG A 373 -13.698 0.003 -5.635 1.00 2.22 C ATOM 1632 CD ARG A 373 -13.325 -0.738 -6.901 1.00 2.59 C ATOM 1633 NE ARG A 373 -14.485 -0.956 -7.765 1.00 3.77 N ATOM 1634 CZ ARG A 373 -14.613 -0.425 -8.981 1.00 4.77 C ATOM 1635 NH1 ARG A 373 -13.646 0.332 -9.484 1.00 4.88 N ATOM 1636 NH2 ARG A 373 -15.706 -0.644 -9.699 1.00 5.90 N ATOM 0 H ARG A 373 -12.126 -1.616 -3.379 1.00 0.99 H new ATOM 0 HA ARG A 373 -14.374 0.254 -2.860 1.00 1.11 H new ATOM 0 HB2 ARG A 373 -14.305 -1.936 -4.963 1.00 1.68 H new ATOM 0 HB3 ARG A 373 -15.521 -0.691 -4.754 1.00 1.68 H new ATOM 0 HG2 ARG A 373 -14.311 0.869 -5.885 1.00 2.22 H new ATOM 0 HG3 ARG A 373 -12.796 0.379 -5.152 1.00 2.22 H new ATOM 0 HD2 ARG A 373 -12.569 -0.171 -7.444 1.00 2.59 H new ATOM 0 HD3 ARG A 373 -12.879 -1.698 -6.642 1.00 2.59 H new ATOM 0 HE ARG A 373 -15.239 -1.548 -7.417 1.00 3.77 H new ATOM 0 HH11 ARG A 373 -12.802 0.509 -8.940 1.00 4.88 H new ATOM 0 HH12 ARG A 373 -13.747 0.737 -10.415 1.00 4.88 H new ATOM 0 HH21 ARG A 373 -16.457 -1.222 -9.322 1.00 5.90 H new ATOM 0 HH22 ARG A 373 -15.796 -0.234 -10.629 1.00 5.90 H new ATOM 1650 N LYS A 374 -15.402 -1.414 -1.384 1.00 1.08 N ATOM 1651 CA LYS A 374 -15.985 -2.365 -0.453 1.00 1.35 C ATOM 1652 C LYS A 374 -17.483 -2.507 -0.698 1.00 1.76 C ATOM 1653 O LYS A 374 -18.299 -1.807 -0.098 1.00 2.36 O ATOM 1654 CB LYS A 374 -15.683 -1.968 1.003 1.00 2.07 C ATOM 1655 CG LYS A 374 -16.026 -0.523 1.357 1.00 2.64 C ATOM 1656 CD LYS A 374 -15.672 -0.205 2.801 1.00 3.16 C ATOM 1657 CE LYS A 374 -16.086 1.209 3.196 1.00 3.82 C ATOM 1658 NZ LYS A 374 -15.377 2.253 2.406 1.00 4.43 N ATOM 0 H LYS A 374 -15.671 -0.444 -1.221 1.00 1.08 H new ATOM 0 HA LYS A 374 -15.527 -3.339 -0.625 1.00 1.35 H new ATOM 0 HB2 LYS A 374 -16.236 -2.631 1.668 1.00 2.07 H new ATOM 0 HB3 LYS A 374 -14.623 -2.133 1.197 1.00 2.07 H new ATOM 0 HG2 LYS A 374 -15.489 0.153 0.692 1.00 2.64 H new ATOM 0 HG3 LYS A 374 -17.090 -0.350 1.195 1.00 2.64 H new ATOM 0 HD2 LYS A 374 -16.161 -0.923 3.460 1.00 3.16 H new ATOM 0 HD3 LYS A 374 -14.598 -0.321 2.944 1.00 3.16 H new ATOM 0 HE2 LYS A 374 -17.161 1.321 3.058 1.00 3.82 H new ATOM 0 HE3 LYS A 374 -15.884 1.360 4.256 1.00 3.82 H new ATOM 0 HZ1 LYS A 374 -15.681 3.195 2.724 1.00 4.43 H new ATOM 0 HZ2 LYS A 374 -14.351 2.155 2.544 1.00 4.43 H new ATOM 0 HZ3 LYS A 374 -15.603 2.139 1.397 1.00 4.43 H new