USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 802 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 401 ASN : amide:sc= -0.0747 K(o=-0.49,f=-1.3) USER MOD Set 1.2: A 416 MET CE :methyl 159:sc= -0.414 (180deg=-1.2) USER MOD Set 2.1: A 396 HIS : no HD1:sc= -2.31 K(o=-4.1,f=-7.5!) USER MOD Set 2.2: A 399 LYS NZ :NH3+ 149:sc= -1.75! (180deg=-3.23!) USER MOD Single : A 340 TYR OH : rot 117:sc= 0.108 USER MOD Single : A 342 TYR OH : rot 122:sc= -0.361! USER MOD Single : A 343 GLN : amide:sc= -1.54! K(o=-1.5!,f=-0.041) USER MOD Single : A 346 SER OG : rot -26:sc= 0.175 USER MOD Single : A 348 SER OG : rot 180:sc= 0.115 USER MOD Single : A 350 TYR OH : rot 180:sc= 0 USER MOD Single : A 352 ASN : amide:sc= -0.0185 X(o=-0.019,f=0) USER MOD Single : A 359 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 361 SER OG : rot 180:sc= 0 USER MOD Single : A 362 LYS NZ :NH3+ 156:sc= 0.0597 (180deg=0) USER MOD Single : A 370 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= -0.259 K(o=-0.26,f=-1.2!) USER MOD Single : A 379 HIS : no HD1:sc= -0.614 K(o=-0.61,f=0) USER MOD Single : A 380 LYS NZ :NH3+ 159:sc= 0.173 (180deg=0.0656) USER MOD Single : A 386 THR OG1 : rot -130:sc= -2.13! USER MOD Single : A 387 TYR OH : rot 180:sc=-0.00109 USER MOD Single : A 389 LYS NZ :NH3+ 161:sc= 1.15 (180deg=0.763) USER MOD Single : A 390 MET CE :methyl -158:sc= -6.32! (180deg=-6.51!) USER MOD Single : A 391 SER OG : rot 180:sc= 0 USER MOD Single : A 397 TYR OH : rot 71:sc= -1.86! USER MOD Single : A 398 TYR OH : rot -18:sc= 0.259 USER MOD Single : A 405 LYS NZ :NH3+ 170:sc= 1.21 (180deg=1.01) USER MOD Single : A 409 GLN : amide:sc= -4.62! C(o=-4.6!,f=-2.9!) USER MOD Single : A 417 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.0019) USER MOD Single : A 418 THR OG1 : rot -70:sc= 1.32 USER MOD Single : A 423 MET CE :methyl 151:sc= -0.225 (180deg=-1) USER MOD Single : A 424 SER OG : rot -57:sc= 0.417 USER MOD Single : A 427 THR OG1 : rot 150:sc= -1.61! USER MOD ----------------------------------------------------------------- ATOM 56 N ARG A 335 -8.374 -2.600 6.441 1.00 0.40 N ATOM 57 CA ARG A 335 -7.186 -1.924 5.941 1.00 0.32 C ATOM 58 C ARG A 335 -7.302 -1.778 4.432 1.00 0.28 C ATOM 59 O ARG A 335 -7.711 -2.720 3.751 1.00 0.42 O ATOM 60 CB ARG A 335 -5.910 -2.721 6.260 1.00 0.37 C ATOM 61 CG ARG A 335 -5.901 -3.381 7.632 1.00 0.56 C ATOM 62 CD ARG A 335 -5.157 -2.565 8.681 1.00 0.93 C ATOM 63 NE ARG A 335 -5.833 -1.314 9.010 1.00 1.32 N ATOM 64 CZ ARG A 335 -6.258 -0.991 10.232 1.00 2.05 C ATOM 65 NH1 ARG A 335 -6.099 -1.834 11.246 1.00 2.81 N ATOM 66 NH2 ARG A 335 -6.840 0.182 10.445 1.00 2.51 N ATOM 0 HA ARG A 335 -7.117 -0.950 6.426 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.779 -3.491 5.500 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -5.052 -2.052 6.187 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -6.929 -3.535 7.961 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -5.441 -4.366 7.552 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -5.046 -3.161 9.587 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -4.153 -2.345 8.319 1.00 0.93 H new ATOM 0 HE ARG A 335 -5.990 -0.644 8.257 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -5.649 -2.736 11.093 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -6.427 -1.579 12.178 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -6.963 0.838 9.674 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -7.165 0.428 11.380 1.00 2.51 H new ATOM 80 N LEU A 336 -6.977 -0.597 3.926 1.00 0.23 N ATOM 81 CA LEU A 336 -6.840 -0.394 2.489 1.00 0.28 C ATOM 82 C LEU A 336 -5.543 -1.036 2.032 1.00 0.14 C ATOM 83 O LEU A 336 -4.824 -1.591 2.851 1.00 0.20 O ATOM 84 CB LEU A 336 -6.808 1.099 2.129 1.00 0.48 C ATOM 85 CG LEU A 336 -8.100 1.895 2.343 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.468 2.614 1.068 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.239 1.008 2.786 1.00 0.67 C ATOM 0 H LEU A 336 -6.803 0.236 4.488 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.700 -0.845 1.994 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -6.019 1.571 2.714 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.525 1.188 1.080 1.00 0.48 H new ATOM 0 HG LEU A 336 -7.922 2.620 3.137 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.387 3.180 1.222 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.664 3.296 0.790 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.619 1.886 0.271 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -10.136 1.611 2.927 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.427 0.250 2.026 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -8.977 0.522 3.726 1.00 0.67 H new ATOM 99 N LEU A 337 -5.226 -0.954 0.758 1.00 0.15 N ATOM 100 CA LEU A 337 -3.981 -1.524 0.271 1.00 0.12 C ATOM 101 C LEU A 337 -2.789 -0.791 0.893 1.00 0.11 C ATOM 102 O LEU A 337 -1.878 -1.424 1.419 1.00 0.12 O ATOM 103 CB LEU A 337 -3.954 -1.483 -1.264 1.00 0.14 C ATOM 104 CG LEU A 337 -2.734 -2.089 -1.954 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.652 -1.055 -2.081 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.218 -3.302 -1.203 1.00 0.15 C ATOM 0 H LEU A 337 -5.802 -0.505 0.046 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.910 -2.569 0.572 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.841 -1.998 -1.632 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -4.037 -0.442 -1.576 1.00 0.14 H new ATOM 0 HG LEU A 337 -3.036 -2.418 -2.948 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.785 -1.494 -2.574 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -2.019 -0.215 -2.672 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.366 -0.704 -1.090 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.350 -3.709 -1.721 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -1.933 -3.010 -0.192 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -3.000 -4.060 -1.155 1.00 0.15 H new ATOM 118 N TRP A 338 -2.822 0.536 0.892 1.00 0.12 N ATOM 119 CA TRP A 338 -1.762 1.318 1.538 1.00 0.14 C ATOM 120 C TRP A 338 -1.851 1.166 3.056 1.00 0.14 C ATOM 121 O TRP A 338 -0.839 1.165 3.757 1.00 0.17 O ATOM 122 CB TRP A 338 -1.850 2.805 1.151 1.00 0.16 C ATOM 123 CG TRP A 338 -3.117 3.469 1.591 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.230 3.658 0.840 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.405 4.025 2.877 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.194 4.281 1.571 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.718 4.518 2.827 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.688 4.148 4.067 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.330 5.119 3.916 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.298 4.745 5.149 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.611 5.224 5.065 1.00 0.21 C ATOM 0 H TRP A 338 -3.559 1.092 0.458 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.802 0.936 1.192 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.003 3.335 1.586 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.760 2.895 0.068 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.336 3.357 -0.192 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.124 4.531 1.234 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.674 3.782 4.139 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.342 5.491 3.854 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -2.754 4.845 6.077 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.062 5.686 5.931 1.00 0.21 H new ATOM 142 N ASP A 339 -3.074 1.024 3.549 1.00 0.14 N ATOM 143 CA ASP A 339 -3.324 0.870 4.980 1.00 0.17 C ATOM 144 C ASP A 339 -2.755 -0.464 5.432 1.00 0.16 C ATOM 145 O ASP A 339 -2.302 -0.637 6.564 1.00 0.23 O ATOM 146 CB ASP A 339 -4.831 0.927 5.241 1.00 0.23 C ATOM 147 CG ASP A 339 -5.180 1.290 6.666 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.611 2.272 7.179 1.00 0.86 O ATOM 149 OD2 ASP A 339 -5.979 0.571 7.293 1.00 1.15 O ATOM 0 H ASP A 339 -3.917 1.012 2.975 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.844 1.674 5.539 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.282 1.656 4.567 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.270 -0.042 5.003 1.00 0.23 H new ATOM 154 N TYR A 340 -2.781 -1.393 4.501 1.00 0.11 N ATOM 155 CA TYR A 340 -2.232 -2.716 4.676 1.00 0.10 C ATOM 156 C TYR A 340 -0.704 -2.676 4.661 1.00 0.08 C ATOM 157 O TYR A 340 -0.056 -3.287 5.510 1.00 0.09 O ATOM 158 CB TYR A 340 -2.745 -3.598 3.547 1.00 0.11 C ATOM 159 CG TYR A 340 -2.545 -5.052 3.797 1.00 0.12 C ATOM 160 CD1 TYR A 340 -3.038 -5.636 4.946 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.861 -5.838 2.892 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.854 -6.969 5.195 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.672 -7.177 3.126 1.00 0.14 C ATOM 164 CZ TYR A 340 -2.169 -7.745 4.285 1.00 0.16 C ATOM 165 OH TYR A 340 -1.978 -9.085 4.539 1.00 0.20 O ATOM 0 H TYR A 340 -3.195 -1.244 3.581 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.544 -3.117 5.640 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.807 -3.405 3.399 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.239 -3.323 2.622 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.578 -5.031 5.660 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.470 -5.394 1.989 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -3.244 -7.411 6.100 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.138 -7.784 2.409 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.439 -9.616 3.856 1.00 0.20 H new ATOM 175 N VAL A 341 -0.127 -1.944 3.704 1.00 0.08 N ATOM 176 CA VAL A 341 1.332 -1.913 3.559 1.00 0.07 C ATOM 177 C VAL A 341 1.983 -1.328 4.804 1.00 0.08 C ATOM 178 O VAL A 341 3.059 -1.751 5.187 1.00 0.08 O ATOM 179 CB VAL A 341 1.831 -1.129 2.308 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.032 -1.481 1.075 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.844 0.373 2.518 1.00 0.09 C ATOM 0 H VAL A 341 -0.636 -1.374 3.029 1.00 0.08 H new ATOM 0 HA VAL A 341 1.628 -2.953 3.422 1.00 0.07 H new ATOM 0 HB VAL A 341 2.864 -1.441 2.154 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.409 -0.915 0.223 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.127 -2.548 0.872 1.00 0.07 H new ATOM 0 HG13 VAL A 341 -0.017 -1.235 1.239 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.201 0.864 1.613 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.835 0.718 2.744 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.506 0.619 3.349 1.00 0.09 H new ATOM 191 N TYR A 342 1.321 -0.361 5.432 1.00 0.08 N ATOM 192 CA TYR A 342 1.815 0.209 6.691 1.00 0.10 C ATOM 193 C TYR A 342 1.984 -0.867 7.756 1.00 0.11 C ATOM 194 O TYR A 342 2.975 -0.882 8.487 1.00 0.14 O ATOM 195 CB TYR A 342 0.874 1.283 7.237 1.00 0.11 C ATOM 196 CG TYR A 342 1.166 2.683 6.758 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.286 3.369 7.210 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.313 3.332 5.884 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.545 4.663 6.800 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.571 4.619 5.467 1.00 0.19 C ATOM 201 CZ TYR A 342 1.688 5.280 5.926 1.00 0.17 C ATOM 202 OH TYR A 342 1.938 6.570 5.519 1.00 0.21 O ATOM 0 H TYR A 342 0.447 0.045 5.097 1.00 0.08 H new ATOM 0 HA TYR A 342 2.781 0.659 6.463 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.148 1.025 6.960 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.922 1.269 8.326 1.00 0.11 H new ATOM 0 HD1 TYR A 342 2.966 2.883 7.894 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.568 2.822 5.523 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.417 5.185 7.166 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.103 5.110 4.780 1.00 0.19 H new ATOM 0 HH TYR A 342 2.020 6.595 4.543 1.00 0.21 H new ATOM 212 N GLN A 343 1.022 -1.777 7.832 1.00 0.12 N ATOM 213 CA GLN A 343 1.047 -2.824 8.835 1.00 0.18 C ATOM 214 C GLN A 343 2.173 -3.789 8.507 1.00 0.18 C ATOM 215 O GLN A 343 2.847 -4.320 9.388 1.00 0.25 O ATOM 216 CB GLN A 343 -0.315 -3.538 8.874 1.00 0.28 C ATOM 217 CG GLN A 343 -0.369 -4.858 8.132 1.00 0.55 C ATOM 218 CD GLN A 343 -0.276 -6.045 9.067 1.00 0.99 C ATOM 219 OE1 GLN A 343 -1.290 -6.585 9.508 1.00 1.40 O ATOM 220 NE2 GLN A 343 0.937 -6.436 9.413 1.00 1.15 N ATOM 0 H GLN A 343 0.215 -1.808 7.209 1.00 0.12 H new ATOM 0 HA GLN A 343 1.228 -2.401 9.823 1.00 0.18 H new ATOM 0 HB2 GLN A 343 -0.587 -3.713 9.915 1.00 0.28 H new ATOM 0 HB3 GLN A 343 -1.069 -2.872 8.455 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.298 -4.916 7.565 1.00 0.55 H new ATOM 0 HG3 GLN A 343 0.447 -4.901 7.411 1.00 0.55 H new ATOM 0 HE21 GLN A 343 1.755 -5.964 9.027 1.00 1.15 H new ATOM 0 HE22 GLN A 343 1.056 -7.210 10.067 1.00 1.15 H new ATOM 229 N LEU A 344 2.371 -3.991 7.216 1.00 0.15 N ATOM 230 CA LEU A 344 3.405 -4.873 6.722 1.00 0.16 C ATOM 231 C LEU A 344 4.779 -4.224 6.881 1.00 0.18 C ATOM 232 O LEU A 344 5.782 -4.892 7.110 1.00 0.27 O ATOM 233 CB LEU A 344 3.126 -5.166 5.252 1.00 0.13 C ATOM 234 CG LEU A 344 1.723 -5.702 4.964 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.483 -5.768 3.478 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.521 -7.072 5.579 1.00 0.18 C ATOM 0 H LEU A 344 1.818 -3.547 6.483 1.00 0.15 H new ATOM 0 HA LEU A 344 3.404 -5.801 7.293 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.276 -4.252 4.678 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.858 -5.890 4.894 1.00 0.13 H new ATOM 0 HG LEU A 344 1.006 -5.016 5.414 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.480 -6.151 3.288 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.577 -4.770 3.050 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.218 -6.430 3.020 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.514 -7.426 5.357 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.250 -7.768 5.164 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.653 -7.009 6.659 1.00 0.18 H new ATOM 248 N LEU A 345 4.779 -2.905 6.775 1.00 0.12 N ATOM 249 CA LEU A 345 5.985 -2.083 6.844 1.00 0.13 C ATOM 250 C LEU A 345 6.588 -2.096 8.246 1.00 0.19 C ATOM 251 O LEU A 345 7.794 -1.916 8.420 1.00 0.29 O ATOM 252 CB LEU A 345 5.636 -0.638 6.443 1.00 0.10 C ATOM 253 CG LEU A 345 6.130 -0.164 5.066 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.401 -1.333 4.144 1.00 0.12 C ATOM 255 CD2 LEU A 345 5.116 0.781 4.428 1.00 0.10 C ATOM 0 H LEU A 345 3.927 -2.362 6.636 1.00 0.12 H new ATOM 0 HA LEU A 345 6.724 -2.496 6.157 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.552 -0.530 6.471 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.043 0.033 7.200 1.00 0.10 H new ATOM 0 HG LEU A 345 7.067 0.372 5.219 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.749 -0.963 3.180 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.166 -1.974 4.584 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.484 -1.906 4.004 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.483 1.106 3.454 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.165 0.263 4.303 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.974 1.650 5.070 1.00 0.10 H new ATOM 267 N SER A 346 5.742 -2.304 9.242 1.00 0.25 N ATOM 268 CA SER A 346 6.171 -2.230 10.628 1.00 0.33 C ATOM 269 C SER A 346 6.505 -3.615 11.189 1.00 0.30 C ATOM 270 O SER A 346 7.024 -3.731 12.304 1.00 0.53 O ATOM 271 CB SER A 346 5.080 -1.560 11.469 1.00 0.51 C ATOM 272 OG SER A 346 5.534 -1.264 12.782 1.00 1.43 O ATOM 0 H SER A 346 4.754 -2.525 9.116 1.00 0.25 H new ATOM 0 HA SER A 346 7.082 -1.632 10.673 1.00 0.33 H new ATOM 0 HB2 SER A 346 4.757 -0.641 10.980 1.00 0.51 H new ATOM 0 HB3 SER A 346 4.210 -2.214 11.524 1.00 0.51 H new ATOM 0 HG SER A 346 6.257 -1.880 13.025 1.00 1.43 H new ATOM 278 N ASP A 347 6.231 -4.664 10.424 1.00 0.32 N ATOM 279 CA ASP A 347 6.451 -6.020 10.914 1.00 0.32 C ATOM 280 C ASP A 347 7.439 -6.772 10.028 1.00 0.30 C ATOM 281 O ASP A 347 7.444 -6.634 8.806 1.00 0.30 O ATOM 282 CB ASP A 347 5.133 -6.778 11.005 1.00 0.35 C ATOM 283 CG ASP A 347 5.177 -7.864 12.054 1.00 0.49 C ATOM 284 OD1 ASP A 347 6.006 -8.781 11.931 1.00 0.58 O ATOM 285 OD2 ASP A 347 4.385 -7.800 13.015 1.00 0.67 O ATOM 0 H ASP A 347 5.861 -4.605 9.475 1.00 0.32 H new ATOM 0 HA ASP A 347 6.881 -5.949 11.913 1.00 0.32 H new ATOM 0 HB2 ASP A 347 4.329 -6.080 11.239 1.00 0.35 H new ATOM 0 HB3 ASP A 347 4.901 -7.219 10.036 1.00 0.35 H new ATOM 290 N SER A 348 8.256 -7.592 10.668 1.00 0.34 N ATOM 291 CA SER A 348 9.436 -8.166 10.056 1.00 0.35 C ATOM 292 C SER A 348 9.142 -9.290 9.076 1.00 0.31 C ATOM 293 O SER A 348 9.820 -9.422 8.063 1.00 0.32 O ATOM 294 CB SER A 348 10.352 -8.665 11.155 1.00 0.46 C ATOM 295 OG SER A 348 9.603 -9.037 12.299 1.00 1.53 O ATOM 0 H SER A 348 8.115 -7.879 11.637 1.00 0.34 H new ATOM 0 HA SER A 348 9.908 -7.380 9.467 1.00 0.35 H new ATOM 0 HB2 SER A 348 10.927 -9.519 10.797 1.00 0.46 H new ATOM 0 HB3 SER A 348 11.068 -7.887 11.420 1.00 0.46 H new ATOM 0 HG SER A 348 10.211 -9.358 12.998 1.00 1.53 H new ATOM 301 N ARG A 349 8.156 -10.113 9.370 1.00 0.33 N ATOM 302 CA ARG A 349 7.857 -11.246 8.500 1.00 0.35 C ATOM 303 C ARG A 349 7.454 -10.773 7.100 1.00 0.29 C ATOM 304 O ARG A 349 7.529 -11.532 6.137 1.00 0.34 O ATOM 305 CB ARG A 349 6.762 -12.131 9.095 1.00 0.42 C ATOM 306 CG ARG A 349 5.406 -11.474 9.114 1.00 0.55 C ATOM 307 CD ARG A 349 5.012 -11.043 10.508 1.00 0.59 C ATOM 308 NE ARG A 349 4.850 -12.172 11.418 1.00 1.23 N ATOM 309 CZ ARG A 349 4.725 -12.050 12.737 1.00 1.67 C ATOM 310 NH1 ARG A 349 4.832 -10.860 13.315 1.00 1.93 N ATOM 311 NH2 ARG A 349 4.522 -13.130 13.478 1.00 2.56 N ATOM 0 H ARG A 349 7.554 -10.027 10.189 1.00 0.33 H new ATOM 0 HA ARG A 349 8.767 -11.840 8.416 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.701 -13.056 8.522 1.00 0.42 H new ATOM 0 HB3 ARG A 349 7.039 -12.404 10.113 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.413 -10.607 8.453 1.00 0.55 H new ATOM 0 HG3 ARG A 349 4.661 -12.167 8.723 1.00 0.55 H new ATOM 0 HD2 ARG A 349 5.770 -10.368 10.904 1.00 0.59 H new ATOM 0 HD3 ARG A 349 4.079 -10.482 10.461 1.00 0.59 H new ATOM 0 HE ARG A 349 4.831 -13.111 11.019 1.00 1.23 H new ATOM 0 HH11 ARG A 349 5.011 -10.032 12.747 1.00 1.93 H new ATOM 0 HH12 ARG A 349 4.735 -10.774 14.327 1.00 1.93 H new ATOM 0 HH21 ARG A 349 4.463 -14.048 13.037 1.00 2.56 H new ATOM 0 HH22 ARG A 349 4.425 -13.044 14.490 1.00 2.56 H new ATOM 325 N TYR A 350 7.065 -9.504 6.988 1.00 0.22 N ATOM 326 CA TYR A 350 6.622 -8.958 5.713 1.00 0.17 C ATOM 327 C TYR A 350 7.713 -8.115 5.075 1.00 0.16 C ATOM 328 O TYR A 350 7.599 -7.716 3.920 1.00 0.15 O ATOM 329 CB TYR A 350 5.388 -8.086 5.900 1.00 0.17 C ATOM 330 CG TYR A 350 4.336 -8.690 6.782 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.648 -9.827 6.399 1.00 0.24 C ATOM 332 CD2 TYR A 350 4.017 -8.107 7.993 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.672 -10.369 7.195 1.00 0.29 C ATOM 334 CE2 TYR A 350 3.044 -8.640 8.802 1.00 0.28 C ATOM 335 CZ TYR A 350 2.368 -9.775 8.403 1.00 0.31 C ATOM 336 OH TYR A 350 1.393 -10.318 9.214 1.00 0.39 O ATOM 0 H TYR A 350 7.049 -8.840 7.762 1.00 0.22 H new ATOM 0 HA TYR A 350 6.385 -9.801 5.065 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.694 -7.129 6.322 1.00 0.17 H new ATOM 0 HB3 TYR A 350 4.952 -7.879 4.923 1.00 0.17 H new ATOM 0 HD1 TYR A 350 3.884 -10.297 5.455 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.542 -7.217 8.309 1.00 0.23 H new ATOM 0 HE1 TYR A 350 2.144 -11.256 6.878 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.809 -8.173 9.747 1.00 0.28 H new ATOM 0 HH TYR A 350 1.305 -9.778 10.027 1.00 0.39 H new ATOM 346 N GLU A 351 8.772 -7.859 5.833 1.00 0.18 N ATOM 347 CA GLU A 351 9.849 -6.972 5.384 1.00 0.21 C ATOM 348 C GLU A 351 10.558 -7.529 4.145 1.00 0.21 C ATOM 349 O GLU A 351 11.334 -6.827 3.493 1.00 0.24 O ATOM 350 CB GLU A 351 10.862 -6.736 6.507 1.00 0.28 C ATOM 351 CG GLU A 351 11.843 -7.876 6.689 1.00 0.48 C ATOM 352 CD GLU A 351 12.892 -7.589 7.738 1.00 0.99 C ATOM 353 OE1 GLU A 351 13.135 -6.400 8.038 1.00 1.05 O ATOM 354 OE2 GLU A 351 13.506 -8.551 8.244 1.00 1.78 O ATOM 0 H GLU A 351 8.912 -8.252 6.764 1.00 0.18 H new ATOM 0 HA GLU A 351 9.393 -6.020 5.113 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.416 -5.821 6.299 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.325 -6.577 7.442 1.00 0.28 H new ATOM 0 HG2 GLU A 351 11.297 -8.778 6.966 1.00 0.48 H new ATOM 0 HG3 GLU A 351 12.334 -8.081 5.738 1.00 0.48 H new ATOM 361 N ASN A 352 10.291 -8.789 3.823 1.00 0.19 N ATOM 362 CA ASN A 352 10.877 -9.414 2.649 1.00 0.21 C ATOM 363 C ASN A 352 9.930 -9.281 1.460 1.00 0.16 C ATOM 364 O ASN A 352 10.279 -9.614 0.332 1.00 0.18 O ATOM 365 CB ASN A 352 11.174 -10.886 2.922 1.00 0.27 C ATOM 366 CG ASN A 352 12.220 -11.454 1.984 1.00 1.03 C ATOM 367 OD1 ASN A 352 13.416 -11.371 2.252 1.00 1.83 O ATOM 368 ND2 ASN A 352 11.779 -12.039 0.882 1.00 1.62 N ATOM 0 H ASN A 352 9.672 -9.396 4.360 1.00 0.19 H new ATOM 0 HA ASN A 352 11.814 -8.909 2.415 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.515 -10.999 3.951 1.00 0.27 H new ATOM 0 HB3 ASN A 352 10.254 -11.462 2.826 1.00 0.27 H new ATOM 0 HD21 ASN A 352 12.441 -12.442 0.219 1.00 1.62 H new ATOM 0 HD22 ASN A 352 10.777 -12.087 0.696 1.00 1.62 H new ATOM 375 N PHE A 353 8.722 -8.807 1.729 1.00 0.13 N ATOM 376 CA PHE A 353 7.743 -8.532 0.689 1.00 0.10 C ATOM 377 C PHE A 353 7.632 -7.032 0.458 1.00 0.08 C ATOM 378 O PHE A 353 7.304 -6.579 -0.633 1.00 0.07 O ATOM 379 CB PHE A 353 6.373 -9.067 1.087 1.00 0.09 C ATOM 380 CG PHE A 353 6.353 -10.522 1.433 1.00 0.12 C ATOM 381 CD1 PHE A 353 7.086 -11.437 0.703 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.603 -10.971 2.502 1.00 0.13 C ATOM 383 CE1 PHE A 353 7.071 -12.775 1.028 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.583 -12.308 2.838 1.00 0.17 C ATOM 385 CZ PHE A 353 6.319 -13.212 2.097 1.00 0.18 C ATOM 0 H PHE A 353 8.394 -8.603 2.673 1.00 0.13 H new ATOM 0 HA PHE A 353 8.074 -9.026 -0.225 1.00 0.10 H new ATOM 0 HB2 PHE A 353 6.009 -8.498 1.942 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.676 -8.892 0.267 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.679 -11.099 -0.134 1.00 0.17 H new ATOM 0 HD2 PHE A 353 5.025 -10.266 3.082 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.647 -13.480 0.447 1.00 0.19 H new ATOM 0 HE2 PHE A 353 4.994 -12.647 3.677 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.305 -14.261 2.355 1.00 0.18 H new ATOM 395 N ILE A 354 7.923 -6.276 1.498 1.00 0.08 N ATOM 396 CA ILE A 354 7.797 -4.830 1.477 1.00 0.07 C ATOM 397 C ILE A 354 8.504 -4.272 2.702 1.00 0.08 C ATOM 398 O ILE A 354 8.572 -4.937 3.731 1.00 0.10 O ATOM 399 CB ILE A 354 6.311 -4.408 1.482 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.139 -2.936 1.111 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.681 -4.690 2.839 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.695 -2.480 1.124 1.00 0.07 C ATOM 0 H ILE A 354 8.256 -6.649 2.387 1.00 0.08 H new ATOM 0 HA ILE A 354 8.250 -4.437 0.567 1.00 0.07 H new ATOM 0 HB ILE A 354 5.799 -5.001 0.724 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.712 -2.324 1.807 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.557 -2.767 0.119 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.634 -4.386 2.824 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.747 -5.756 3.056 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.210 -4.130 3.609 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.644 -1.426 0.852 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.121 -3.068 0.408 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.279 -2.617 2.122 1.00 0.07 H new ATOM 414 N ARG A 355 9.049 -3.080 2.598 1.00 0.09 N ATOM 415 CA ARG A 355 9.799 -2.518 3.711 1.00 0.11 C ATOM 416 C ARG A 355 9.955 -1.018 3.567 1.00 0.10 C ATOM 417 O ARG A 355 9.959 -0.488 2.459 1.00 0.14 O ATOM 418 CB ARG A 355 11.188 -3.153 3.791 1.00 0.16 C ATOM 419 CG ARG A 355 12.117 -2.697 2.681 1.00 0.22 C ATOM 420 CD ARG A 355 13.492 -3.310 2.819 1.00 0.25 C ATOM 421 NE ARG A 355 14.432 -2.761 1.848 1.00 0.98 N ATOM 422 CZ ARG A 355 15.373 -3.474 1.237 1.00 1.40 C ATOM 423 NH1 ARG A 355 15.471 -4.781 1.454 1.00 1.43 N ATOM 424 NH2 ARG A 355 16.219 -2.878 0.411 1.00 2.08 N ATOM 0 H ARG A 355 8.992 -2.486 1.771 1.00 0.09 H new ATOM 0 HA ARG A 355 9.240 -2.731 4.622 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.637 -2.911 4.754 1.00 0.16 H new ATOM 0 HB3 ARG A 355 11.088 -4.238 3.750 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.692 -2.969 1.715 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.199 -1.610 2.698 1.00 0.22 H new ATOM 0 HD2 ARG A 355 13.868 -3.135 3.827 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.423 -4.390 2.687 1.00 0.25 H new ATOM 0 HE ARG A 355 14.363 -1.768 1.624 1.00 0.98 H new ATOM 0 HH11 ARG A 355 14.822 -5.242 2.092 1.00 1.43 H new ATOM 0 HH12 ARG A 355 16.195 -5.323 0.983 1.00 1.43 H new ATOM 0 HH21 ARG A 355 16.148 -1.874 0.245 1.00 2.08 H new ATOM 0 HH22 ARG A 355 16.942 -3.423 -0.059 1.00 2.08 H new ATOM 438 N TRP A 356 10.066 -0.347 4.698 1.00 0.10 N ATOM 439 CA TRP A 356 10.421 1.059 4.718 1.00 0.09 C ATOM 440 C TRP A 356 11.845 1.255 4.221 1.00 0.09 C ATOM 441 O TRP A 356 12.764 0.565 4.660 1.00 0.14 O ATOM 442 CB TRP A 356 10.353 1.614 6.134 1.00 0.10 C ATOM 443 CG TRP A 356 8.981 1.793 6.699 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.477 1.208 7.822 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.946 2.633 6.188 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.207 1.656 8.058 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.854 2.522 7.064 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.834 3.467 5.079 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.678 3.218 6.872 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.662 4.160 4.885 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.594 4.037 5.776 1.00 0.13 C ATOM 0 H TRP A 356 9.914 -0.756 5.620 1.00 0.10 H new ATOM 0 HA TRP A 356 9.713 1.580 4.073 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.912 0.948 6.792 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.861 2.578 6.150 1.00 0.10 H new ATOM 0 HD1 TRP A 356 9.005 0.494 8.437 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.620 1.387 8.847 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.653 3.568 4.383 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.852 3.121 7.561 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.566 4.811 4.028 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.687 4.596 5.599 1.00 0.13 H new ATOM 462 N GLU A 357 12.016 2.192 3.311 1.00 0.10 N ATOM 463 CA GLU A 357 13.337 2.652 2.928 1.00 0.12 C ATOM 464 C GLU A 357 13.692 3.857 3.782 1.00 0.14 C ATOM 465 O GLU A 357 14.807 3.985 4.287 1.00 0.21 O ATOM 466 CB GLU A 357 13.368 3.021 1.452 1.00 0.16 C ATOM 467 CG GLU A 357 13.219 1.828 0.528 1.00 0.25 C ATOM 468 CD GLU A 357 14.406 0.889 0.588 1.00 0.36 C ATOM 469 OE1 GLU A 357 15.429 1.179 -0.067 1.00 0.78 O ATOM 470 OE2 GLU A 357 14.322 -0.141 1.285 1.00 0.61 O ATOM 0 H GLU A 357 11.251 2.653 2.819 1.00 0.10 H new ATOM 0 HA GLU A 357 14.064 1.856 3.087 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.568 3.732 1.246 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.308 3.526 1.231 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.314 1.280 0.792 1.00 0.25 H new ATOM 0 HG3 GLU A 357 13.091 2.180 -0.496 1.00 0.25 H new ATOM 477 N ASP A 358 12.704 4.725 3.951 1.00 0.14 N ATOM 478 CA ASP A 358 12.814 5.891 4.815 1.00 0.16 C ATOM 479 C ASP A 358 11.495 6.113 5.528 1.00 0.16 C ATOM 480 O ASP A 358 10.634 6.848 5.046 1.00 0.20 O ATOM 481 CB ASP A 358 13.193 7.146 4.021 1.00 0.20 C ATOM 482 CG ASP A 358 14.670 7.208 3.689 1.00 0.92 C ATOM 483 OD1 ASP A 358 15.487 7.394 4.618 1.00 1.46 O ATOM 484 OD2 ASP A 358 15.022 7.086 2.502 1.00 1.33 O ATOM 0 H ASP A 358 11.798 4.639 3.489 1.00 0.14 H new ATOM 0 HA ASP A 358 13.605 5.705 5.541 1.00 0.16 H new ATOM 0 HB2 ASP A 358 12.616 7.173 3.097 1.00 0.20 H new ATOM 0 HB3 ASP A 358 12.917 8.031 4.595 1.00 0.20 H new ATOM 489 N LYS A 359 11.339 5.443 6.662 1.00 0.15 N ATOM 490 CA LYS A 359 10.153 5.515 7.484 1.00 0.17 C ATOM 491 C LYS A 359 9.675 6.942 7.722 1.00 0.19 C ATOM 492 O LYS A 359 8.488 7.241 7.588 1.00 0.23 O ATOM 493 CB LYS A 359 10.505 4.864 8.802 1.00 0.23 C ATOM 494 CG LYS A 359 9.339 4.669 9.727 1.00 0.29 C ATOM 495 CD LYS A 359 9.626 3.561 10.706 1.00 0.38 C ATOM 496 CE LYS A 359 10.279 2.403 10.006 1.00 0.91 C ATOM 497 NZ LYS A 359 10.568 1.269 10.922 1.00 1.50 N ATOM 0 H LYS A 359 12.055 4.821 7.039 1.00 0.15 H new ATOM 0 HA LYS A 359 9.333 5.009 6.975 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.962 3.895 8.604 1.00 0.23 H new ATOM 0 HB3 LYS A 359 11.255 5.474 9.306 1.00 0.23 H new ATOM 0 HG2 LYS A 359 9.135 5.595 10.265 1.00 0.29 H new ATOM 0 HG3 LYS A 359 8.445 4.431 9.151 1.00 0.29 H new ATOM 0 HD2 LYS A 359 10.276 3.928 11.501 1.00 0.38 H new ATOM 0 HD3 LYS A 359 8.699 3.234 11.178 1.00 0.38 H new ATOM 0 HE2 LYS A 359 9.631 2.058 9.201 1.00 0.91 H new ATOM 0 HE3 LYS A 359 11.208 2.739 9.546 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 11.018 0.498 10.389 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 11.209 1.587 11.677 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 9.680 0.927 11.342 1.00 1.50 H new ATOM 511 N GLU A 360 10.606 7.819 8.057 1.00 0.21 N ATOM 512 CA GLU A 360 10.272 9.182 8.431 1.00 0.27 C ATOM 513 C GLU A 360 9.885 10.032 7.226 1.00 0.24 C ATOM 514 O GLU A 360 9.301 11.102 7.380 1.00 0.37 O ATOM 515 CB GLU A 360 11.430 9.804 9.192 1.00 0.41 C ATOM 516 CG GLU A 360 11.741 9.061 10.480 1.00 0.63 C ATOM 517 CD GLU A 360 13.021 9.530 11.135 1.00 1.75 C ATOM 518 OE1 GLU A 360 13.023 10.631 11.725 1.00 1.97 O ATOM 519 OE2 GLU A 360 14.030 8.799 11.067 1.00 2.67 O ATOM 0 H GLU A 360 11.604 7.609 8.077 1.00 0.21 H new ATOM 0 HA GLU A 360 9.396 9.148 9.079 1.00 0.27 H new ATOM 0 HB2 GLU A 360 12.316 9.812 8.557 1.00 0.41 H new ATOM 0 HB3 GLU A 360 11.194 10.843 9.423 1.00 0.41 H new ATOM 0 HG2 GLU A 360 10.913 9.191 11.177 1.00 0.63 H new ATOM 0 HG3 GLU A 360 11.816 7.994 10.269 1.00 0.63 H new ATOM 526 N SER A 361 10.203 9.556 6.031 1.00 0.19 N ATOM 527 CA SER A 361 9.761 10.210 4.812 1.00 0.21 C ATOM 528 C SER A 361 8.632 9.403 4.176 1.00 0.19 C ATOM 529 O SER A 361 8.165 9.710 3.077 1.00 0.24 O ATOM 530 CB SER A 361 10.929 10.339 3.835 1.00 0.26 C ATOM 531 OG SER A 361 12.028 11.004 4.434 1.00 0.31 O ATOM 0 H SER A 361 10.766 8.719 5.881 1.00 0.19 H new ATOM 0 HA SER A 361 9.394 11.208 5.053 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.238 9.349 3.501 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.607 10.888 2.950 1.00 0.26 H new ATOM 0 HG SER A 361 12.762 11.071 3.788 1.00 0.31 H new ATOM 537 N LYS A 362 8.210 8.364 4.902 1.00 0.15 N ATOM 538 CA LYS A 362 7.208 7.408 4.434 1.00 0.14 C ATOM 539 C LYS A 362 7.575 6.831 3.072 1.00 0.12 C ATOM 540 O LYS A 362 6.735 6.710 2.186 1.00 0.15 O ATOM 541 CB LYS A 362 5.802 8.015 4.411 1.00 0.20 C ATOM 542 CG LYS A 362 5.060 7.883 5.736 1.00 0.48 C ATOM 543 CD LYS A 362 5.701 8.730 6.813 1.00 0.48 C ATOM 544 CE LYS A 362 5.061 8.518 8.178 1.00 0.51 C ATOM 545 NZ LYS A 362 5.463 7.229 8.802 1.00 1.23 N ATOM 0 H LYS A 362 8.559 8.163 5.839 1.00 0.15 H new ATOM 0 HA LYS A 362 7.198 6.588 5.152 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.875 9.070 4.148 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.219 7.531 3.628 1.00 0.20 H new ATOM 0 HG2 LYS A 362 4.021 8.184 5.604 1.00 0.48 H new ATOM 0 HG3 LYS A 362 5.052 6.839 6.048 1.00 0.48 H new ATOM 0 HD2 LYS A 362 6.763 8.494 6.873 1.00 0.48 H new ATOM 0 HD3 LYS A 362 5.623 9.782 6.538 1.00 0.48 H new ATOM 0 HE2 LYS A 362 5.340 9.340 8.838 1.00 0.51 H new ATOM 0 HE3 LYS A 362 3.976 8.545 8.075 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 5.359 7.296 9.835 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 4.857 6.465 8.442 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 6.455 7.024 8.567 1.00 1.23 H new ATOM 559 N ILE A 363 8.837 6.464 2.925 1.00 0.09 N ATOM 560 CA ILE A 363 9.316 5.821 1.717 1.00 0.09 C ATOM 561 C ILE A 363 9.424 4.329 1.952 1.00 0.08 C ATOM 562 O ILE A 363 9.988 3.901 2.957 1.00 0.10 O ATOM 563 CB ILE A 363 10.697 6.362 1.301 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.603 7.850 0.968 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.242 5.568 0.121 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.944 8.539 0.886 1.00 0.46 C ATOM 0 H ILE A 363 9.554 6.603 3.637 1.00 0.09 H new ATOM 0 HA ILE A 363 8.606 6.033 0.917 1.00 0.09 H new ATOM 0 HB ILE A 363 11.389 6.245 2.135 1.00 0.10 H new ATOM 0 HG12 ILE A 363 10.085 7.968 0.016 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.996 8.345 1.726 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.218 5.961 -0.162 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.341 4.520 0.402 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.557 5.654 -0.723 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.798 9.592 0.646 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.457 8.453 1.844 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.547 8.070 0.108 1.00 0.46 H new ATOM 578 N PHE A 364 8.904 3.542 1.033 1.00 0.09 N ATOM 579 CA PHE A 364 8.913 2.108 1.187 1.00 0.09 C ATOM 580 C PHE A 364 9.192 1.447 -0.154 1.00 0.10 C ATOM 581 O PHE A 364 8.817 1.960 -1.207 1.00 0.13 O ATOM 582 CB PHE A 364 7.582 1.622 1.780 1.00 0.09 C ATOM 583 CG PHE A 364 6.438 1.578 0.816 1.00 0.08 C ATOM 584 CD1 PHE A 364 6.202 0.454 0.046 1.00 0.12 C ATOM 585 CD2 PHE A 364 5.589 2.654 0.704 1.00 0.13 C ATOM 586 CE1 PHE A 364 5.137 0.409 -0.828 1.00 0.12 C ATOM 587 CE2 PHE A 364 4.519 2.622 -0.171 1.00 0.14 C ATOM 588 CZ PHE A 364 4.291 1.492 -0.936 1.00 0.08 C ATOM 0 H PHE A 364 8.470 3.875 0.172 1.00 0.09 H new ATOM 0 HA PHE A 364 9.706 1.828 1.880 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.728 0.624 2.192 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.312 2.274 2.611 1.00 0.09 H new ATOM 0 HD1 PHE A 364 6.860 -0.398 0.130 1.00 0.12 H new ATOM 0 HD2 PHE A 364 5.760 3.534 1.306 1.00 0.13 H new ATOM 0 HE1 PHE A 364 4.966 -0.473 -1.427 1.00 0.12 H new ATOM 0 HE2 PHE A 364 3.864 3.476 -0.257 1.00 0.14 H new ATOM 0 HZ PHE A 364 3.453 1.458 -1.616 1.00 0.08 H new ATOM 598 N ARG A 365 9.888 0.335 -0.105 1.00 0.10 N ATOM 599 CA ARG A 365 10.163 -0.459 -1.279 1.00 0.12 C ATOM 600 C ARG A 365 9.390 -1.764 -1.186 1.00 0.11 C ATOM 601 O ARG A 365 9.466 -2.454 -0.168 1.00 0.18 O ATOM 602 CB ARG A 365 11.659 -0.757 -1.335 1.00 0.17 C ATOM 603 CG ARG A 365 12.071 -1.706 -2.442 1.00 0.17 C ATOM 604 CD ARG A 365 12.449 -0.975 -3.705 1.00 0.31 C ATOM 605 NE ARG A 365 13.680 -1.515 -4.281 1.00 0.77 N ATOM 606 CZ ARG A 365 14.899 -1.032 -4.034 1.00 0.63 C ATOM 607 NH1 ARG A 365 15.060 0.005 -3.227 1.00 1.48 N ATOM 608 NH2 ARG A 365 15.958 -1.599 -4.593 1.00 0.99 N ATOM 0 H ARG A 365 10.281 -0.046 0.756 1.00 0.10 H new ATOM 0 HA ARG A 365 9.862 0.081 -2.177 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.199 0.182 -1.459 1.00 0.17 H new ATOM 0 HB3 ARG A 365 11.968 -1.179 -0.379 1.00 0.17 H new ATOM 0 HG2 ARG A 365 12.915 -2.309 -2.106 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.252 -2.393 -2.653 1.00 0.17 H new ATOM 0 HD2 ARG A 365 11.639 -1.055 -4.431 1.00 0.31 H new ATOM 0 HD3 ARG A 365 12.580 0.085 -3.489 1.00 0.31 H new ATOM 0 HE ARG A 365 13.602 -2.312 -4.912 1.00 0.77 H new ATOM 0 HH11 ARG A 365 14.249 0.441 -2.789 1.00 1.48 H new ATOM 0 HH12 ARG A 365 15.995 0.368 -3.043 1.00 1.48 H new ATOM 0 HH21 ARG A 365 15.840 -2.402 -5.210 1.00 0.99 H new ATOM 0 HH22 ARG A 365 16.891 -1.232 -4.406 1.00 0.99 H new ATOM 622 N ILE A 366 8.635 -2.104 -2.215 1.00 0.07 N ATOM 623 CA ILE A 366 8.048 -3.413 -2.270 1.00 0.06 C ATOM 624 C ILE A 366 9.138 -4.405 -2.617 1.00 0.07 C ATOM 625 O ILE A 366 9.664 -4.428 -3.725 1.00 0.10 O ATOM 626 CB ILE A 366 6.874 -3.476 -3.261 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.674 -2.740 -2.653 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.522 -4.922 -3.598 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.562 -2.454 -3.629 1.00 0.09 C ATOM 0 H ILE A 366 8.421 -1.498 -3.007 1.00 0.07 H new ATOM 0 HA ILE A 366 7.623 -3.664 -1.298 1.00 0.06 H new ATOM 0 HB ILE A 366 7.158 -2.990 -4.195 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.276 -3.335 -1.831 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.019 -1.798 -2.227 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.689 -4.939 -4.301 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.386 -5.411 -4.048 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.239 -5.449 -2.687 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.754 -1.932 -3.117 1.00 0.09 H new ATOM 0 HD12 ILE A 366 4.940 -1.831 -4.439 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.186 -3.392 -4.038 1.00 0.09 H new ATOM 641 N VAL A 367 9.506 -5.171 -1.625 1.00 0.07 N ATOM 642 CA VAL A 367 10.646 -6.064 -1.712 1.00 0.08 C ATOM 643 C VAL A 367 10.300 -7.302 -2.529 1.00 0.09 C ATOM 644 O VAL A 367 11.045 -7.706 -3.423 1.00 0.12 O ATOM 645 CB VAL A 367 11.104 -6.458 -0.300 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.258 -7.436 -0.353 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.487 -5.215 0.485 1.00 0.10 C ATOM 0 H VAL A 367 9.025 -5.198 -0.726 1.00 0.07 H new ATOM 0 HA VAL A 367 11.461 -5.546 -2.217 1.00 0.08 H new ATOM 0 HB VAL A 367 10.276 -6.954 0.206 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.561 -7.697 0.661 1.00 0.12 H new ATOM 0 HG12 VAL A 367 11.947 -8.337 -0.882 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.098 -6.979 -0.876 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.811 -5.502 1.485 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.300 -4.698 -0.025 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.625 -4.551 0.559 1.00 0.10 H new ATOM 657 N ASP A 368 9.162 -7.884 -2.218 1.00 0.08 N ATOM 658 CA ASP A 368 8.631 -9.003 -2.967 1.00 0.09 C ATOM 659 C ASP A 368 7.149 -8.792 -3.182 1.00 0.08 C ATOM 660 O ASP A 368 6.325 -9.144 -2.344 1.00 0.09 O ATOM 661 CB ASP A 368 8.890 -10.322 -2.247 1.00 0.12 C ATOM 662 CG ASP A 368 8.286 -11.518 -2.963 1.00 0.22 C ATOM 663 OD1 ASP A 368 7.857 -11.367 -4.123 1.00 0.45 O ATOM 664 OD2 ASP A 368 8.240 -12.619 -2.376 1.00 0.78 O ATOM 0 H ASP A 368 8.576 -7.593 -1.435 1.00 0.08 H new ATOM 0 HA ASP A 368 9.136 -9.057 -3.932 1.00 0.09 H new ATOM 0 HB2 ASP A 368 9.965 -10.470 -2.148 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.481 -10.265 -1.238 1.00 0.12 H new ATOM 669 N PRO A 369 6.816 -8.183 -4.312 1.00 0.09 N ATOM 670 CA PRO A 369 5.443 -7.857 -4.688 1.00 0.10 C ATOM 671 C PRO A 369 4.571 -9.090 -4.804 1.00 0.12 C ATOM 672 O PRO A 369 3.371 -9.034 -4.565 1.00 0.14 O ATOM 673 CB PRO A 369 5.596 -7.176 -6.050 1.00 0.12 C ATOM 674 CG PRO A 369 6.937 -7.581 -6.539 1.00 0.12 C ATOM 675 CD PRO A 369 7.777 -7.757 -5.321 1.00 0.10 C ATOM 0 HA PRO A 369 4.953 -7.233 -3.941 1.00 0.10 H new ATOM 0 HB2 PRO A 369 4.813 -7.493 -6.739 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.521 -6.092 -5.959 1.00 0.12 H new ATOM 0 HG2 PRO A 369 6.881 -8.506 -7.113 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.358 -6.822 -7.198 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.557 -8.503 -5.474 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.274 -6.829 -5.037 1.00 0.10 H new ATOM 683 N ASN A 370 5.188 -10.202 -5.152 1.00 0.13 N ATOM 684 CA ASN A 370 4.482 -11.465 -5.258 1.00 0.17 C ATOM 685 C ASN A 370 4.119 -11.942 -3.868 1.00 0.17 C ATOM 686 O ASN A 370 2.998 -12.378 -3.601 1.00 0.21 O ATOM 687 CB ASN A 370 5.378 -12.485 -5.932 1.00 0.21 C ATOM 688 CG ASN A 370 4.599 -13.644 -6.512 1.00 0.36 C ATOM 689 OD1 ASN A 370 4.163 -13.607 -7.661 1.00 0.62 O ATOM 690 ND2 ASN A 370 4.432 -14.688 -5.723 1.00 0.59 N ATOM 0 H ASN A 370 6.183 -10.257 -5.368 1.00 0.13 H new ATOM 0 HA ASN A 370 3.575 -11.338 -5.849 1.00 0.17 H new ATOM 0 HB2 ASN A 370 5.945 -11.998 -6.726 1.00 0.21 H new ATOM 0 HB3 ASN A 370 6.101 -12.863 -5.209 1.00 0.21 H new ATOM 0 HD21 ASN A 370 3.925 -15.506 -6.060 1.00 0.59 H new ATOM 0 HD22 ASN A 370 4.810 -14.677 -4.776 1.00 0.59 H new ATOM 697 N GLY A 371 5.093 -11.829 -2.988 1.00 0.16 N ATOM 698 CA GLY A 371 4.889 -12.142 -1.593 1.00 0.19 C ATOM 699 C GLY A 371 3.909 -11.190 -0.949 1.00 0.13 C ATOM 700 O GLY A 371 3.109 -11.579 -0.098 1.00 0.13 O ATOM 0 H GLY A 371 6.038 -11.521 -3.218 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.521 -13.164 -1.498 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.842 -12.096 -1.066 1.00 0.19 H new ATOM 704 N LEU A 372 3.964 -9.943 -1.384 1.00 0.10 N ATOM 705 CA LEU A 372 3.176 -8.884 -0.778 1.00 0.08 C ATOM 706 C LEU A 372 1.737 -8.993 -1.250 1.00 0.11 C ATOM 707 O LEU A 372 0.795 -8.797 -0.487 1.00 0.13 O ATOM 708 CB LEU A 372 3.767 -7.515 -1.143 1.00 0.08 C ATOM 709 CG LEU A 372 3.577 -6.404 -0.102 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.158 -5.867 -0.101 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.915 -6.920 1.280 1.00 0.09 C ATOM 0 H LEU A 372 4.551 -9.638 -2.160 1.00 0.10 H new ATOM 0 HA LEU A 372 3.199 -8.986 0.307 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.835 -7.638 -1.324 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.321 -7.187 -2.082 1.00 0.08 H new ATOM 0 HG LEU A 372 4.250 -5.590 -0.371 1.00 0.08 H new ATOM 0 HD11 LEU A 372 2.066 -5.083 0.650 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.923 -5.458 -1.084 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.464 -6.674 0.131 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.776 -6.123 2.010 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.260 -7.756 1.527 1.00 0.09 H new ATOM 0 HD23 LEU A 372 4.952 -7.254 1.300 1.00 0.09 H new ATOM 723 N ALA A 373 1.584 -9.319 -2.523 1.00 0.12 N ATOM 724 CA ALA A 373 0.274 -9.477 -3.123 1.00 0.15 C ATOM 725 C ALA A 373 -0.460 -10.639 -2.483 1.00 0.14 C ATOM 726 O ALA A 373 -1.659 -10.553 -2.225 1.00 0.16 O ATOM 727 CB ALA A 373 0.410 -9.684 -4.616 1.00 0.20 C ATOM 0 H ALA A 373 2.361 -9.480 -3.164 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.307 -8.571 -2.951 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.579 -9.802 -5.059 1.00 0.20 H new ATOM 0 HB2 ALA A 373 0.905 -8.820 -5.059 1.00 0.20 H new ATOM 0 HB3 ALA A 373 1.002 -10.579 -4.807 1.00 0.20 H new ATOM 733 N ARG A 374 0.273 -11.715 -2.200 1.00 0.14 N ATOM 734 CA ARG A 374 -0.305 -12.874 -1.538 1.00 0.17 C ATOM 735 C ARG A 374 -0.903 -12.452 -0.198 1.00 0.14 C ATOM 736 O ARG A 374 -1.912 -12.992 0.236 1.00 0.16 O ATOM 737 CB ARG A 374 0.743 -13.986 -1.365 1.00 0.24 C ATOM 738 CG ARG A 374 1.229 -14.174 0.053 1.00 0.28 C ATOM 739 CD ARG A 374 2.178 -15.356 0.173 1.00 0.47 C ATOM 740 NE ARG A 374 3.404 -15.180 -0.610 1.00 1.44 N ATOM 741 CZ ARG A 374 4.617 -15.544 -0.189 1.00 2.04 C ATOM 742 NH1 ARG A 374 4.773 -16.089 1.011 1.00 2.01 N ATOM 743 NH2 ARG A 374 5.675 -15.370 -0.971 1.00 3.03 N ATOM 0 H ARG A 374 1.265 -11.804 -2.420 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.103 -13.281 -2.159 1.00 0.17 H new ATOM 0 HB2 ARG A 374 0.318 -14.926 -1.718 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.599 -13.764 -2.002 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.734 -13.268 0.387 1.00 0.28 H new ATOM 0 HG3 ARG A 374 0.375 -14.325 0.713 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.439 -15.502 1.221 1.00 0.47 H new ATOM 0 HD3 ARG A 374 1.668 -16.261 -0.157 1.00 0.47 H new ATOM 0 HE ARG A 374 3.326 -14.753 -1.533 1.00 1.44 H new ATOM 0 HH11 ARG A 374 3.964 -16.231 1.616 1.00 2.01 H new ATOM 0 HH12 ARG A 374 5.702 -16.366 1.329 1.00 2.01 H new ATOM 0 HH21 ARG A 374 5.562 -14.957 -1.897 1.00 3.03 H new ATOM 0 HH22 ARG A 374 6.601 -15.649 -0.646 1.00 3.03 H new ATOM 757 N LEU A 375 -0.286 -11.453 0.432 1.00 0.13 N ATOM 758 CA LEU A 375 -0.813 -10.864 1.660 1.00 0.15 C ATOM 759 C LEU A 375 -2.106 -10.115 1.358 1.00 0.16 C ATOM 760 O LEU A 375 -3.111 -10.286 2.042 1.00 0.18 O ATOM 761 CB LEU A 375 0.202 -9.881 2.254 1.00 0.17 C ATOM 762 CG LEU A 375 1.263 -10.433 3.208 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.712 -11.825 2.825 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.453 -9.497 3.209 1.00 0.15 C ATOM 0 H LEU A 375 0.585 -11.033 0.108 1.00 0.13 H new ATOM 0 HA LEU A 375 -1.005 -11.664 2.375 1.00 0.15 H new ATOM 0 HB2 LEU A 375 0.718 -9.393 1.427 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.353 -9.107 2.784 1.00 0.17 H new ATOM 0 HG LEU A 375 0.821 -10.499 4.202 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.465 -12.172 3.533 1.00 0.29 H new ATOM 0 HD12 LEU A 375 0.857 -12.501 2.844 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.138 -11.807 1.822 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.217 -9.880 3.886 1.00 0.15 H new ATOM 0 HD22 LEU A 375 2.863 -9.428 2.201 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.138 -8.508 3.541 1.00 0.15 H new ATOM 776 N TRP A 376 -2.057 -9.287 0.320 1.00 0.16 N ATOM 777 CA TRP A 376 -3.196 -8.465 -0.082 1.00 0.18 C ATOM 778 C TRP A 376 -4.409 -9.339 -0.388 1.00 0.20 C ATOM 779 O TRP A 376 -5.510 -9.087 0.099 1.00 0.25 O ATOM 780 CB TRP A 376 -2.816 -7.619 -1.304 1.00 0.19 C ATOM 781 CG TRP A 376 -3.842 -6.593 -1.699 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.235 -6.282 -2.971 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.596 -5.736 -0.828 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.181 -5.286 -2.942 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.422 -4.936 -1.642 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.655 -5.567 0.559 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.296 -3.989 -1.113 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.517 -4.622 1.080 1.00 0.22 C ATOM 789 CH2 TRP A 376 -6.328 -3.846 0.243 1.00 0.24 C ATOM 0 H TRP A 376 -1.231 -9.166 -0.265 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.461 -7.800 0.740 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -1.874 -7.111 -1.099 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.642 -8.284 -2.150 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -3.857 -6.751 -3.868 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.631 -4.874 -3.759 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -4.037 -6.165 1.212 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.926 -3.390 -1.754 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.566 -4.479 2.149 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.994 -3.118 0.681 1.00 0.24 H new ATOM 800 N GLY A 377 -4.197 -10.378 -1.181 1.00 0.21 N ATOM 801 CA GLY A 377 -5.265 -11.303 -1.495 1.00 0.27 C ATOM 802 C GLY A 377 -5.679 -12.123 -0.294 1.00 0.30 C ATOM 803 O GLY A 377 -6.835 -12.515 -0.182 1.00 0.38 O ATOM 0 H GLY A 377 -3.300 -10.598 -1.614 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.126 -10.749 -1.869 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -4.943 -11.970 -2.295 1.00 0.27 H new ATOM 807 N ASN A 378 -4.729 -12.390 0.594 1.00 0.27 N ATOM 808 CA ASN A 378 -5.009 -13.084 1.847 1.00 0.30 C ATOM 809 C ASN A 378 -5.977 -12.282 2.708 1.00 0.30 C ATOM 810 O ASN A 378 -6.916 -12.826 3.285 1.00 0.35 O ATOM 811 CB ASN A 378 -3.719 -13.331 2.610 1.00 0.32 C ATOM 812 CG ASN A 378 -3.231 -14.753 2.470 1.00 0.38 C ATOM 813 OD1 ASN A 378 -4.018 -15.692 2.344 1.00 0.76 O ATOM 814 ND2 ASN A 378 -1.927 -14.910 2.466 1.00 0.42 N ATOM 0 H ASN A 378 -3.750 -12.134 0.468 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.472 -14.042 1.609 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.950 -12.648 2.249 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.875 -13.105 3.665 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.526 -15.841 2.355 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -1.316 -14.101 2.574 1.00 0.42 H new ATOM 821 N HIS A 379 -5.738 -10.978 2.772 1.00 0.28 N ATOM 822 CA HIS A 379 -6.568 -10.062 3.545 1.00 0.30 C ATOM 823 C HIS A 379 -7.982 -9.973 2.967 1.00 0.32 C ATOM 824 O HIS A 379 -8.960 -9.917 3.714 1.00 0.38 O ATOM 825 CB HIS A 379 -5.897 -8.676 3.579 1.00 0.28 C ATOM 826 CG HIS A 379 -6.710 -7.573 4.197 1.00 0.32 C ATOM 827 ND1 HIS A 379 -6.740 -7.368 5.556 1.00 0.43 N ATOM 828 CD2 HIS A 379 -7.451 -6.615 3.591 1.00 0.31 C ATOM 829 CE1 HIS A 379 -7.487 -6.294 5.742 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.943 -5.803 4.578 1.00 0.38 N ATOM 0 H HIS A 379 -4.962 -10.525 2.289 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.661 -10.441 4.563 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.958 -8.761 4.126 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.646 -8.389 2.558 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.622 -6.511 2.530 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -7.704 -5.865 6.709 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -8.539 -4.985 4.453 1.00 0.38 H new ATOM 838 N LYS A 380 -8.090 -9.982 1.641 1.00 0.32 N ATOM 839 CA LYS A 380 -9.380 -9.771 0.986 1.00 0.36 C ATOM 840 C LYS A 380 -10.036 -11.080 0.543 1.00 0.41 C ATOM 841 O LYS A 380 -11.146 -11.075 0.015 1.00 0.45 O ATOM 842 CB LYS A 380 -9.202 -8.878 -0.240 1.00 0.36 C ATOM 843 CG LYS A 380 -8.609 -7.515 0.060 1.00 0.38 C ATOM 844 CD LYS A 380 -7.628 -7.114 -1.020 1.00 0.63 C ATOM 845 CE LYS A 380 -8.264 -7.052 -2.396 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.911 -5.739 -2.664 1.00 0.77 N ATOM 0 H LYS A 380 -7.308 -10.132 1.003 1.00 0.32 H new ATOM 0 HA LYS A 380 -10.030 -9.297 1.721 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.561 -9.390 -0.958 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -10.171 -8.742 -0.719 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -9.405 -6.773 0.130 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -8.106 -7.536 1.027 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -7.204 -6.140 -0.776 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -6.803 -7.826 -1.038 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.503 -7.240 -3.154 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -9.007 -7.845 -2.486 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -9.011 -5.604 -3.690 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -9.851 -5.718 -2.219 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -8.324 -4.976 -2.271 1.00 0.77 H new ATOM 943 N THR A 386 -3.422 -10.408 -7.677 1.00 0.23 N ATOM 944 CA THR A 386 -2.055 -10.401 -8.137 1.00 0.24 C ATOM 945 C THR A 386 -1.402 -9.112 -7.674 1.00 0.16 C ATOM 946 O THR A 386 -2.060 -8.288 -7.026 1.00 0.18 O ATOM 947 CB THR A 386 -1.963 -10.488 -9.675 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.514 -9.308 -10.261 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.716 -11.697 -10.194 1.00 0.44 C ATOM 0 HA THR A 386 -1.548 -11.274 -7.725 1.00 0.24 H new ATOM 0 HB THR A 386 -0.912 -10.583 -9.947 1.00 0.33 H new ATOM 0 HG1 THR A 386 -3.156 -9.558 -10.958 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.636 -11.736 -11.280 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.288 -12.603 -9.766 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.766 -11.622 -9.910 1.00 0.44 H new ATOM 957 N TYR A 387 -0.135 -8.915 -7.994 1.00 0.16 N ATOM 958 CA TYR A 387 0.495 -7.635 -7.710 1.00 0.13 C ATOM 959 C TYR A 387 -0.139 -6.559 -8.584 1.00 0.14 C ATOM 960 O TYR A 387 -0.168 -5.385 -8.221 1.00 0.17 O ATOM 961 CB TYR A 387 2.003 -7.667 -7.936 1.00 0.15 C ATOM 962 CG TYR A 387 2.612 -6.328 -7.629 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.543 -5.810 -6.344 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.193 -5.553 -8.623 1.00 0.14 C ATOM 965 CE1 TYR A 387 3.043 -4.572 -6.053 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.692 -4.300 -8.339 1.00 0.14 C ATOM 967 CZ TYR A 387 3.614 -3.811 -7.053 1.00 0.12 C ATOM 968 OH TYR A 387 4.105 -2.560 -6.769 1.00 0.13 O ATOM 0 H TYR A 387 0.467 -9.606 -8.440 1.00 0.16 H new ATOM 0 HA TYR A 387 0.334 -7.411 -6.656 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.455 -8.432 -7.304 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.216 -7.941 -8.969 1.00 0.15 H new ATOM 0 HD1 TYR A 387 2.086 -6.395 -5.560 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.255 -5.936 -9.631 1.00 0.14 H new ATOM 0 HE1 TYR A 387 2.992 -4.190 -5.044 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.142 -3.705 -9.120 1.00 0.14 H new ATOM 0 HH TYR A 387 4.473 -2.160 -7.584 1.00 0.13 H new ATOM 978 N GLU A 388 -0.677 -6.978 -9.724 1.00 0.17 N ATOM 979 CA GLU A 388 -1.385 -6.066 -10.614 1.00 0.24 C ATOM 980 C GLU A 388 -2.544 -5.419 -9.870 1.00 0.25 C ATOM 981 O GLU A 388 -2.731 -4.206 -9.931 1.00 0.31 O ATOM 982 CB GLU A 388 -1.925 -6.801 -11.841 1.00 0.30 C ATOM 983 CG GLU A 388 -2.689 -5.906 -12.792 1.00 0.44 C ATOM 984 CD GLU A 388 -3.914 -6.578 -13.376 1.00 1.53 C ATOM 985 OE1 GLU A 388 -3.759 -7.368 -14.330 1.00 1.96 O ATOM 986 OE2 GLU A 388 -5.036 -6.329 -12.884 1.00 2.21 O ATOM 0 H GLU A 388 -0.636 -7.943 -10.053 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.681 -5.303 -10.946 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -1.093 -7.260 -12.375 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.578 -7.610 -11.512 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -2.993 -5.001 -12.266 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -2.029 -5.597 -13.602 1.00 0.44 H new ATOM 993 N LYS A 389 -3.301 -6.241 -9.149 1.00 0.23 N ATOM 994 CA LYS A 389 -4.444 -5.764 -8.375 1.00 0.28 C ATOM 995 C LYS A 389 -3.996 -4.765 -7.313 1.00 0.28 C ATOM 996 O LYS A 389 -4.731 -3.850 -6.949 1.00 0.40 O ATOM 997 CB LYS A 389 -5.184 -6.934 -7.721 1.00 0.32 C ATOM 998 CG LYS A 389 -6.098 -7.694 -8.671 1.00 0.45 C ATOM 999 CD LYS A 389 -5.329 -8.360 -9.799 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.262 -8.878 -10.877 1.00 0.46 C ATOM 1001 NZ LYS A 389 -6.935 -7.777 -11.616 1.00 1.39 N ATOM 0 H LYS A 389 -3.142 -7.247 -9.084 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.128 -5.262 -9.059 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.452 -7.626 -7.305 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.776 -6.556 -6.887 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.650 -8.451 -8.114 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.834 -7.008 -9.091 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -4.629 -7.647 -10.234 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.738 -9.185 -9.401 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -5.698 -9.492 -11.579 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -7.015 -9.522 -10.424 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -7.297 -8.137 -12.522 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -7.726 -7.411 -11.049 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -6.254 -7.012 -11.795 1.00 1.39 H new ATOM 1015 N MET A 390 -2.778 -4.950 -6.827 1.00 0.19 N ATOM 1016 CA MET A 390 -2.181 -4.029 -5.873 1.00 0.17 C ATOM 1017 C MET A 390 -1.757 -2.751 -6.578 1.00 0.16 C ATOM 1018 O MET A 390 -1.997 -1.649 -6.089 1.00 0.17 O ATOM 1019 CB MET A 390 -0.973 -4.678 -5.211 1.00 0.15 C ATOM 1020 CG MET A 390 -0.312 -3.803 -4.163 1.00 0.14 C ATOM 1021 SD MET A 390 0.993 -4.672 -3.283 1.00 0.18 S ATOM 1022 CE MET A 390 0.077 -6.087 -2.688 1.00 1.57 C ATOM 0 H MET A 390 -2.180 -5.736 -7.080 1.00 0.19 H new ATOM 0 HA MET A 390 -2.919 -3.785 -5.109 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.283 -5.615 -4.747 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.240 -4.929 -5.978 1.00 0.15 H new ATOM 0 HG2 MET A 390 0.102 -2.915 -4.641 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.063 -3.460 -3.451 1.00 0.14 H new ATOM 0 HE1 MET A 390 0.590 -6.517 -1.828 1.00 1.57 H new ATOM 0 HE2 MET A 390 -0.925 -5.774 -2.394 1.00 1.57 H new ATOM 0 HE3 MET A 390 0.006 -6.834 -3.479 1.00 1.57 H new ATOM 1032 N SER A 391 -1.123 -2.916 -7.732 1.00 0.15 N ATOM 1033 CA SER A 391 -0.685 -1.790 -8.539 1.00 0.17 C ATOM 1034 C SER A 391 -1.868 -0.886 -8.881 1.00 0.19 C ATOM 1035 O SER A 391 -1.745 0.332 -8.832 1.00 0.21 O ATOM 1036 CB SER A 391 0.008 -2.286 -9.819 1.00 0.23 C ATOM 1037 OG SER A 391 0.479 -1.206 -10.612 1.00 1.02 O ATOM 0 H SER A 391 -0.900 -3.828 -8.131 1.00 0.15 H new ATOM 0 HA SER A 391 0.034 -1.208 -7.963 1.00 0.17 H new ATOM 0 HB2 SER A 391 0.843 -2.934 -9.553 1.00 0.23 H new ATOM 0 HB3 SER A 391 -0.690 -2.888 -10.401 1.00 0.23 H new ATOM 0 HG SER A 391 0.915 -1.557 -11.416 1.00 1.02 H new ATOM 1043 N ARG A 392 -3.014 -1.492 -9.208 1.00 0.21 N ATOM 1044 CA ARG A 392 -4.245 -0.742 -9.480 1.00 0.26 C ATOM 1045 C ARG A 392 -4.518 0.245 -8.366 1.00 0.22 C ATOM 1046 O ARG A 392 -4.652 1.449 -8.598 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.438 -1.681 -9.579 1.00 0.38 C ATOM 1048 CG ARG A 392 -5.271 -2.784 -10.588 1.00 1.12 C ATOM 1049 CD ARG A 392 -5.341 -2.257 -12.011 1.00 2.05 C ATOM 1050 NE ARG A 392 -5.451 -3.335 -12.992 1.00 2.61 N ATOM 1051 CZ ARG A 392 -5.991 -3.186 -14.201 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -6.454 -2.004 -14.591 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -6.071 -4.223 -15.022 1.00 4.06 N ATOM 0 H ARG A 392 -3.115 -2.504 -9.291 1.00 0.21 H new ATOM 0 HA ARG A 392 -4.107 -0.217 -10.425 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.620 -2.124 -8.600 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -6.324 -1.100 -9.836 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -4.313 -3.280 -10.430 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -6.047 -3.535 -10.439 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -6.198 -1.590 -12.108 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -4.450 -1.665 -12.222 1.00 2.05 H new ATOM 0 HE ARG A 392 -5.093 -4.255 -12.736 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -6.398 -1.202 -13.963 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -6.866 -1.898 -15.518 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -5.719 -5.134 -14.728 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -6.484 -4.110 -15.948 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.601 -0.296 -7.158 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.802 0.502 -5.961 1.00 0.17 C ATOM 1069 C ALA A 393 -3.756 1.603 -5.862 1.00 0.12 C ATOM 1070 O ALA A 393 -4.080 2.748 -5.565 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.763 -0.382 -4.725 1.00 0.20 C ATOM 0 H ALA A 393 -4.531 -1.298 -6.983 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.784 0.972 -6.023 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -4.915 0.229 -3.835 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.551 -1.132 -4.789 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.794 -0.878 -4.663 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.507 1.265 -6.169 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.409 2.214 -6.045 1.00 0.10 C ATOM 1079 C LEU A 394 -1.589 3.356 -7.026 1.00 0.11 C ATOM 1080 O LEU A 394 -1.419 4.522 -6.681 1.00 0.12 O ATOM 1081 CB LEU A 394 -0.076 1.511 -6.296 1.00 0.11 C ATOM 1082 CG LEU A 394 0.276 0.428 -5.281 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.464 -0.384 -5.757 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.573 1.059 -3.938 1.00 0.13 C ATOM 0 H LEU A 394 -2.232 0.342 -6.505 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.409 2.619 -5.033 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.098 1.064 -7.290 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.718 2.258 -6.300 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.576 -0.244 -5.176 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.699 -1.151 -5.019 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.223 -0.858 -6.709 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.325 0.272 -5.886 1.00 0.13 H new ATOM 0 HD21 LEU A 394 0.824 0.280 -3.218 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.413 1.746 -4.037 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.304 1.606 -3.591 1.00 0.13 H new ATOM 1096 N ARG A 395 -1.960 3.006 -8.242 1.00 0.12 N ATOM 1097 CA ARG A 395 -2.168 3.981 -9.297 1.00 0.14 C ATOM 1098 C ARG A 395 -3.300 4.932 -8.936 1.00 0.14 C ATOM 1099 O ARG A 395 -3.275 6.107 -9.300 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.477 3.262 -10.604 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.404 2.262 -10.991 1.00 0.33 C ATOM 1102 CD ARG A 395 -0.153 2.948 -11.517 1.00 0.52 C ATOM 1103 NE ARG A 395 -0.417 3.727 -12.724 1.00 1.30 N ATOM 1104 CZ ARG A 395 0.511 4.040 -13.628 1.00 1.72 C ATOM 1105 NH1 ARG A 395 1.740 3.558 -13.526 1.00 1.66 N ATOM 1106 NH2 ARG A 395 0.202 4.822 -14.650 1.00 2.64 N ATOM 0 H ARG A 395 -2.126 2.041 -8.527 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.258 4.569 -9.417 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.433 2.746 -10.513 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.587 3.997 -11.401 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -1.147 1.652 -10.125 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.795 1.586 -11.752 1.00 0.33 H new ATOM 0 HD2 ARG A 395 0.252 3.603 -10.745 1.00 0.52 H new ATOM 0 HD3 ARG A 395 0.608 2.198 -11.730 1.00 0.52 H new ATOM 0 HE ARG A 395 -1.370 4.052 -12.885 1.00 1.30 H new ATOM 0 HH11 ARG A 395 1.983 2.941 -12.751 1.00 1.66 H new ATOM 0 HH12 ARG A 395 2.443 3.803 -14.223 1.00 1.66 H new ATOM 0 HH21 ARG A 395 -0.746 5.185 -14.746 1.00 2.64 H new ATOM 0 HH22 ARG A 395 0.912 5.062 -15.342 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.292 4.425 -8.212 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.401 5.254 -7.769 1.00 0.13 C ATOM 1122 C HIS A 396 -4.960 6.129 -6.599 1.00 0.11 C ATOM 1123 O HIS A 396 -5.380 7.278 -6.473 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.614 4.393 -7.403 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.913 5.126 -7.522 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -8.095 6.107 -8.468 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -9.048 4.989 -6.803 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.332 6.540 -8.303 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -9.949 5.893 -7.306 1.00 0.26 N ATOM 0 H HIS A 396 -4.349 3.449 -7.922 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.705 5.907 -8.587 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.638 3.516 -8.050 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.500 4.032 -6.381 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.214 4.300 -5.988 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.788 7.318 -8.897 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.905 6.043 -6.983 1.00 0.26 H new ATOM 1137 N TYR A 397 -4.060 5.592 -5.787 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.523 6.305 -4.632 1.00 0.10 C ATOM 1139 C TYR A 397 -2.797 7.576 -5.038 1.00 0.09 C ATOM 1140 O TYR A 397 -2.855 8.580 -4.334 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.565 5.409 -3.849 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.259 4.280 -3.156 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.631 4.299 -3.002 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.551 3.205 -2.651 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.287 3.283 -2.367 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -3.199 2.181 -2.001 1.00 0.24 C ATOM 1147 CZ TYR A 397 -4.568 2.222 -1.865 1.00 0.24 C ATOM 1148 OH TYR A 397 -5.204 1.225 -1.184 1.00 0.30 O ATOM 0 H TYR A 397 -3.681 4.653 -5.908 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.371 6.579 -4.004 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -1.815 5.005 -4.529 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -2.034 6.010 -3.111 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.196 5.133 -3.391 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.478 3.169 -2.768 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.361 3.312 -2.260 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -2.637 1.350 -1.600 1.00 0.24 H new ATOM 0 HH TYR A 397 -5.739 0.692 -1.808 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.113 7.525 -6.167 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.317 8.653 -6.622 1.00 0.12 C ATOM 1160 C TYR A 398 -2.196 9.883 -6.832 1.00 0.14 C ATOM 1161 O TYR A 398 -1.836 10.998 -6.457 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.603 8.318 -7.933 1.00 0.14 C ATOM 1163 CG TYR A 398 0.243 7.054 -7.916 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.830 6.569 -6.747 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.463 6.348 -9.093 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.600 5.422 -6.758 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.229 5.206 -9.108 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.796 4.748 -7.942 1.00 0.14 C ATOM 1169 OH TYR A 398 2.559 3.609 -7.959 1.00 0.18 O ATOM 0 H TYR A 398 -2.092 6.715 -6.786 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.575 8.867 -5.852 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.352 8.222 -8.719 1.00 0.14 H new ATOM 0 HB3 TYR A 398 0.037 9.158 -8.203 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.680 7.099 -5.818 1.00 0.11 H new ATOM 0 HD2 TYR A 398 0.024 6.703 -10.014 1.00 0.15 H new ATOM 0 HE1 TYR A 398 2.045 5.057 -5.844 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.385 4.670 -10.033 1.00 0.16 H new ATOM 0 HH TYR A 398 3.111 3.573 -7.150 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.355 9.660 -7.436 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.300 10.737 -7.703 1.00 0.19 C ATOM 1181 C LYS A 399 -4.955 11.233 -6.431 1.00 0.19 C ATOM 1182 O LYS A 399 -5.195 12.430 -6.269 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.380 10.290 -8.671 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.898 10.152 -10.106 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.628 8.705 -10.465 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.900 7.885 -10.367 1.00 0.32 C ATOM 1187 NZ LYS A 399 -5.682 6.459 -10.723 1.00 0.71 N ATOM 0 H LYS A 399 -3.665 8.741 -7.751 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.728 11.551 -8.148 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.780 9.332 -8.338 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -6.201 11.006 -8.641 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.647 10.562 -10.783 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -3.989 10.738 -10.243 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -4.227 8.644 -11.477 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.871 8.294 -9.797 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -6.292 7.948 -9.352 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.655 8.310 -11.028 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -6.339 5.862 -10.182 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -5.851 6.326 -11.741 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -4.703 6.190 -10.496 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.247 10.311 -5.529 1.00 0.17 N ATOM 1202 CA LEU A 400 -5.950 10.642 -4.306 1.00 0.18 C ATOM 1203 C LEU A 400 -4.982 11.108 -3.228 1.00 0.18 C ATOM 1204 O LEU A 400 -5.303 11.100 -2.041 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.763 9.435 -3.854 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.620 8.834 -4.964 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.253 7.544 -4.508 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.681 9.822 -5.421 1.00 0.21 C ATOM 0 H LEU A 400 -5.006 9.324 -5.624 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.632 11.471 -4.493 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -6.085 8.671 -3.474 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.408 9.729 -3.026 1.00 0.18 H new ATOM 0 HG LEU A 400 -6.973 8.615 -5.813 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.860 7.132 -5.314 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.473 6.831 -4.240 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -8.884 7.735 -3.640 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -9.280 9.372 -6.213 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.325 10.079 -4.580 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -8.200 10.724 -5.798 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.794 11.518 -3.671 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.796 12.145 -2.801 1.00 0.20 C ATOM 1222 C ASN A 401 -2.326 11.209 -1.699 1.00 0.17 C ATOM 1223 O ASN A 401 -2.091 11.627 -0.568 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.365 13.418 -2.180 1.00 0.27 C ATOM 1225 CG ASN A 401 -2.734 14.668 -2.746 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -1.667 15.100 -2.304 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -3.404 15.278 -3.703 1.00 1.21 N ATOM 0 H ASN A 401 -3.495 11.426 -4.642 1.00 0.18 H new ATOM 0 HA ASN A 401 -1.934 12.388 -3.423 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.442 13.450 -2.347 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -3.210 13.393 -1.101 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -3.043 16.142 -4.107 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -4.283 14.886 -4.040 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.183 9.947 -2.037 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.848 8.934 -1.063 1.00 0.10 C ATOM 1236 C ILE A 402 -0.405 8.491 -1.176 1.00 0.09 C ATOM 1237 O ILE A 402 0.398 8.724 -0.276 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.785 7.748 -1.271 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.201 8.222 -1.020 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.432 6.582 -0.368 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.241 7.287 -1.539 1.00 0.13 C ATOM 0 H ILE A 402 -2.295 9.596 -2.988 1.00 0.11 H new ATOM 0 HA ILE A 402 -1.969 9.351 -0.063 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.685 7.382 -2.293 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.346 8.356 0.052 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.337 9.199 -1.485 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.124 5.759 -0.549 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.414 6.253 -0.579 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.504 6.894 0.674 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.231 7.689 -1.325 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.121 7.172 -2.616 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.131 6.316 -1.056 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.077 7.851 -2.276 1.00 0.07 N ATOM 1254 CA ILE A 403 1.272 7.404 -2.505 1.00 0.07 C ATOM 1255 C ILE A 403 1.784 8.022 -3.788 1.00 0.08 C ATOM 1256 O ILE A 403 1.001 8.468 -4.617 1.00 0.10 O ATOM 1257 CB ILE A 403 1.363 5.865 -2.596 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.708 5.200 -1.388 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.810 5.418 -2.707 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.822 3.695 -1.420 1.00 0.11 C ATOM 0 H ILE A 403 -0.731 7.629 -3.027 1.00 0.07 H new ATOM 0 HA ILE A 403 1.883 7.718 -1.659 1.00 0.07 H new ATOM 0 HB ILE A 403 0.826 5.557 -3.493 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.171 5.576 -0.476 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.345 5.480 -1.350 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.851 4.331 -2.770 1.00 0.14 H new ATOM 0 HG22 ILE A 403 3.257 5.850 -3.602 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.362 5.752 -1.829 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.339 3.275 -0.538 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.335 3.312 -2.317 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.874 3.410 -1.429 1.00 0.11 H new ATOM 1272 N ARG A 404 3.086 8.090 -3.930 1.00 0.10 N ATOM 1273 CA ARG A 404 3.688 8.605 -5.136 1.00 0.13 C ATOM 1274 C ARG A 404 4.745 7.639 -5.627 1.00 0.14 C ATOM 1275 O ARG A 404 5.186 6.753 -4.891 1.00 0.16 O ATOM 1276 CB ARG A 404 4.309 9.963 -4.867 1.00 0.17 C ATOM 1277 CG ARG A 404 5.696 9.864 -4.303 1.00 0.25 C ATOM 1278 CD ARG A 404 6.178 11.197 -3.781 1.00 0.36 C ATOM 1279 NE ARG A 404 5.729 11.450 -2.411 1.00 1.14 N ATOM 1280 CZ ARG A 404 5.475 12.666 -1.919 1.00 1.56 C ATOM 1281 NH1 ARG A 404 5.497 13.729 -2.715 1.00 1.63 N ATOM 1282 NH2 ARG A 404 5.176 12.811 -0.631 1.00 2.39 N ATOM 0 H ARG A 404 3.754 7.792 -3.219 1.00 0.10 H new ATOM 0 HA ARG A 404 2.920 8.716 -5.902 1.00 0.13 H new ATOM 0 HB2 ARG A 404 4.338 10.535 -5.795 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.677 10.516 -4.172 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.711 9.130 -3.497 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.378 9.506 -5.074 1.00 0.25 H new ATOM 0 HD2 ARG A 404 7.267 11.226 -3.816 1.00 0.36 H new ATOM 0 HD3 ARG A 404 5.817 11.993 -4.433 1.00 0.36 H new ATOM 0 HE ARG A 404 5.602 10.648 -1.793 1.00 1.14 H new ATOM 0 HH11 ARG A 404 5.708 13.619 -3.707 1.00 1.63 H new ATOM 0 HH12 ARG A 404 5.302 14.655 -2.335 1.00 1.63 H new ATOM 0 HH21 ARG A 404 5.141 11.995 -0.021 1.00 2.39 H new ATOM 0 HH22 ARG A 404 4.982 13.739 -0.254 1.00 2.39 H new ATOM 1296 N LYS A 405 5.160 7.829 -6.856 1.00 0.17 N ATOM 1297 CA LYS A 405 6.132 6.953 -7.458 1.00 0.19 C ATOM 1298 C LYS A 405 7.429 7.704 -7.700 1.00 0.22 C ATOM 1299 O LYS A 405 7.421 8.805 -8.246 1.00 0.27 O ATOM 1300 CB LYS A 405 5.585 6.401 -8.765 1.00 0.22 C ATOM 1301 CG LYS A 405 6.376 5.219 -9.273 1.00 0.34 C ATOM 1302 CD LYS A 405 6.563 4.202 -8.191 1.00 0.29 C ATOM 1303 CE LYS A 405 7.141 2.937 -8.750 1.00 0.23 C ATOM 1304 NZ LYS A 405 8.377 3.176 -9.540 1.00 1.08 N ATOM 0 H LYS A 405 4.838 8.585 -7.460 1.00 0.17 H new ATOM 0 HA LYS A 405 6.335 6.122 -6.783 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.546 6.104 -8.623 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.591 7.189 -9.519 1.00 0.22 H new ATOM 0 HG2 LYS A 405 5.859 4.766 -10.119 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.348 5.554 -9.635 1.00 0.34 H new ATOM 0 HD2 LYS A 405 7.223 4.600 -7.420 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.606 3.991 -7.713 1.00 0.29 H new ATOM 0 HE2 LYS A 405 7.363 2.251 -7.933 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.398 2.450 -9.382 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 8.829 2.266 -9.761 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 8.134 3.666 -10.425 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 9.034 3.764 -8.988 1.00 1.08 H new ATOM 1318 N GLU A 406 8.534 7.101 -7.299 1.00 0.23 N ATOM 1319 CA GLU A 406 9.834 7.737 -7.396 1.00 0.28 C ATOM 1320 C GLU A 406 10.387 7.671 -8.814 1.00 0.34 C ATOM 1321 O GLU A 406 9.902 6.917 -9.657 1.00 0.43 O ATOM 1322 CB GLU A 406 10.813 7.070 -6.426 1.00 0.29 C ATOM 1323 CG GLU A 406 10.589 5.592 -6.270 1.00 0.63 C ATOM 1324 CD GLU A 406 10.785 4.825 -7.557 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.640 5.228 -8.363 1.00 2.32 O ATOM 1326 OE2 GLU A 406 10.104 3.804 -7.761 1.00 2.42 O ATOM 0 H GLU A 406 8.555 6.163 -6.900 1.00 0.23 H new ATOM 0 HA GLU A 406 9.712 8.788 -7.132 1.00 0.28 H new ATOM 0 HB2 GLU A 406 11.831 7.240 -6.776 1.00 0.29 H new ATOM 0 HB3 GLU A 406 10.727 7.548 -5.450 1.00 0.29 H new ATOM 0 HG2 GLU A 406 11.273 5.204 -5.515 1.00 0.63 H new ATOM 0 HG3 GLU A 406 9.577 5.420 -5.902 1.00 0.63 H new ATOM 1333 N PRO A 407 11.361 8.530 -9.089 1.00 0.41 N ATOM 1334 CA PRO A 407 12.170 8.482 -10.294 1.00 0.51 C ATOM 1335 C PRO A 407 13.204 7.347 -10.279 1.00 0.52 C ATOM 1336 O PRO A 407 14.102 7.341 -9.433 1.00 0.54 O ATOM 1337 CB PRO A 407 12.861 9.844 -10.337 1.00 0.61 C ATOM 1338 CG PRO A 407 12.715 10.448 -8.982 1.00 0.58 C ATOM 1339 CD PRO A 407 11.772 9.592 -8.182 1.00 0.45 C ATOM 0 HA PRO A 407 11.555 8.282 -11.171 1.00 0.51 H new ATOM 0 HB2 PRO A 407 13.913 9.735 -10.599 1.00 0.61 H new ATOM 0 HB3 PRO A 407 12.408 10.483 -11.095 1.00 0.61 H new ATOM 0 HG2 PRO A 407 13.684 10.509 -8.487 1.00 0.58 H new ATOM 0 HG3 PRO A 407 12.331 11.465 -9.059 1.00 0.58 H new ATOM 0 HD2 PRO A 407 12.262 9.187 -7.297 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.914 10.168 -7.835 1.00 0.45 H new ATOM 1347 N GLY A 408 13.082 6.388 -11.192 1.00 0.54 N ATOM 1348 CA GLY A 408 14.188 5.472 -11.439 1.00 0.58 C ATOM 1349 C GLY A 408 14.044 4.081 -10.837 1.00 0.58 C ATOM 1350 O GLY A 408 14.468 3.098 -11.451 1.00 0.86 O ATOM 0 H GLY A 408 12.250 6.227 -11.760 1.00 0.54 H new ATOM 0 HA2 GLY A 408 14.316 5.369 -12.517 1.00 0.58 H new ATOM 0 HA3 GLY A 408 15.102 5.922 -11.051 1.00 0.58 H new ATOM 1354 N GLN A 409 13.468 3.974 -9.648 1.00 0.47 N ATOM 1355 CA GLN A 409 13.382 2.684 -8.969 1.00 0.51 C ATOM 1356 C GLN A 409 12.162 1.909 -9.470 1.00 0.48 C ATOM 1357 O GLN A 409 11.361 2.431 -10.248 1.00 0.61 O ATOM 1358 CB GLN A 409 13.328 2.852 -7.443 1.00 0.63 C ATOM 1359 CG GLN A 409 14.106 4.058 -6.922 1.00 0.45 C ATOM 1360 CD GLN A 409 14.524 3.919 -5.470 1.00 0.71 C ATOM 1361 OE1 GLN A 409 14.628 4.909 -4.749 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.786 2.695 -5.035 1.00 0.45 N ATOM 0 H GLN A 409 13.057 4.754 -9.136 1.00 0.47 H new ATOM 0 HA GLN A 409 14.283 2.118 -9.203 1.00 0.51 H new ATOM 0 HB2 GLN A 409 12.287 2.944 -7.135 1.00 0.63 H new ATOM 0 HB3 GLN A 409 13.721 1.950 -6.974 1.00 0.63 H new ATOM 0 HG2 GLN A 409 14.995 4.202 -7.537 1.00 0.45 H new ATOM 0 HG3 GLN A 409 13.493 4.953 -7.033 1.00 0.45 H new ATOM 0 HE21 GLN A 409 14.688 1.898 -5.664 1.00 0.45 H new ATOM 0 HE22 GLN A 409 15.086 2.550 -4.071 1.00 0.45 H new ATOM 1371 N ARG A 410 12.023 0.666 -9.041 1.00 0.41 N ATOM 1372 CA ARG A 410 10.952 -0.189 -9.530 1.00 0.39 C ATOM 1373 C ARG A 410 9.773 -0.194 -8.581 1.00 0.31 C ATOM 1374 O ARG A 410 8.704 0.325 -8.894 1.00 0.42 O ATOM 1375 CB ARG A 410 11.467 -1.614 -9.701 1.00 0.47 C ATOM 1376 CG ARG A 410 12.823 -1.698 -10.369 1.00 0.86 C ATOM 1377 CD ARG A 410 13.855 -2.287 -9.423 1.00 1.11 C ATOM 1378 NE ARG A 410 14.144 -1.420 -8.272 1.00 1.27 N ATOM 1379 CZ ARG A 410 15.101 -0.491 -8.270 1.00 2.04 C ATOM 1380 NH1 ARG A 410 15.729 -0.175 -9.395 1.00 2.65 N ATOM 1381 NH2 ARG A 410 15.409 0.135 -7.143 1.00 2.43 N ATOM 0 H ARG A 410 12.637 0.226 -8.356 1.00 0.41 H new ATOM 0 HA ARG A 410 10.619 0.206 -10.490 1.00 0.39 H new ATOM 0 HB2 ARG A 410 11.525 -2.089 -8.722 1.00 0.47 H new ATOM 0 HB3 ARG A 410 10.747 -2.182 -10.289 1.00 0.47 H new ATOM 0 HG2 ARG A 410 12.754 -2.312 -11.267 1.00 0.86 H new ATOM 0 HG3 ARG A 410 13.139 -0.704 -10.686 1.00 0.86 H new ATOM 0 HD2 ARG A 410 13.500 -3.252 -9.063 1.00 1.11 H new ATOM 0 HD3 ARG A 410 14.778 -2.472 -9.972 1.00 1.11 H new ATOM 0 HE ARG A 410 13.582 -1.535 -7.429 1.00 1.27 H new ATOM 0 HH11 ARG A 410 15.481 -0.643 -10.267 1.00 2.65 H new ATOM 0 HH12 ARG A 410 16.460 0.536 -9.388 1.00 2.65 H new ATOM 0 HH21 ARG A 410 14.915 -0.094 -6.281 1.00 2.43 H new ATOM 0 HH22 ARG A 410 16.140 0.846 -7.138 1.00 2.43 H new ATOM 1395 N LEU A 411 9.984 -0.783 -7.425 1.00 0.21 N ATOM 1396 CA LEU A 411 8.929 -0.977 -6.452 1.00 0.14 C ATOM 1397 C LEU A 411 9.081 -0.021 -5.295 1.00 0.11 C ATOM 1398 O LEU A 411 8.732 -0.332 -4.163 1.00 0.12 O ATOM 1399 CB LEU A 411 8.951 -2.418 -5.979 1.00 0.11 C ATOM 1400 CG LEU A 411 8.605 -3.412 -7.077 1.00 0.11 C ATOM 1401 CD1 LEU A 411 8.876 -4.833 -6.636 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.154 -3.230 -7.465 1.00 0.16 C ATOM 0 H LEU A 411 10.893 -1.142 -7.132 1.00 0.21 H new ATOM 0 HA LEU A 411 7.965 -0.769 -6.917 1.00 0.14 H new ATOM 0 HB2 LEU A 411 9.941 -2.650 -5.586 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.246 -2.535 -5.156 1.00 0.11 H new ATOM 0 HG LEU A 411 9.238 -3.222 -7.944 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.619 -5.520 -7.443 1.00 0.15 H new ATOM 0 HD12 LEU A 411 9.932 -4.942 -6.389 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.273 -5.063 -5.758 1.00 0.15 H new ATOM 0 HD21 LEU A 411 6.896 -3.939 -8.252 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.520 -3.406 -6.596 1.00 0.16 H new ATOM 0 HD23 LEU A 411 6.999 -2.214 -7.827 1.00 0.16 H new ATOM 1414 N LEU A 412 9.635 1.129 -5.583 1.00 0.13 N ATOM 1415 CA LEU A 412 9.822 2.140 -4.571 1.00 0.11 C ATOM 1416 C LEU A 412 8.635 3.092 -4.600 1.00 0.10 C ATOM 1417 O LEU A 412 8.216 3.542 -5.665 1.00 0.11 O ATOM 1418 CB LEU A 412 11.115 2.896 -4.843 1.00 0.13 C ATOM 1419 CG LEU A 412 11.793 3.570 -3.656 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.837 4.425 -2.857 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.434 2.531 -2.779 1.00 0.16 C ATOM 0 H LEU A 412 9.966 1.390 -6.512 1.00 0.13 H new ATOM 0 HA LEU A 412 9.888 1.678 -3.586 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.826 2.199 -5.287 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.908 3.660 -5.592 1.00 0.13 H new ATOM 0 HG LEU A 412 12.560 4.238 -4.048 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.369 4.883 -2.023 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.425 5.205 -3.497 1.00 0.13 H new ATOM 0 HD13 LEU A 412 10.027 3.804 -2.474 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.917 3.018 -1.932 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.672 1.842 -2.415 1.00 0.16 H new ATOM 0 HD23 LEU A 412 13.178 1.979 -3.353 1.00 0.16 H new ATOM 1433 N PHE A 413 8.089 3.389 -3.442 1.00 0.10 N ATOM 1434 CA PHE A 413 6.975 4.304 -3.349 1.00 0.11 C ATOM 1435 C PHE A 413 7.144 5.179 -2.122 1.00 0.12 C ATOM 1436 O PHE A 413 7.615 4.717 -1.084 1.00 0.19 O ATOM 1437 CB PHE A 413 5.651 3.548 -3.263 1.00 0.12 C ATOM 1438 CG PHE A 413 5.439 2.556 -4.367 1.00 0.10 C ATOM 1439 CD1 PHE A 413 5.924 1.266 -4.248 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.763 2.909 -5.518 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.740 0.343 -5.256 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.575 1.991 -6.531 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.065 0.705 -6.400 1.00 0.11 C ATOM 0 H PHE A 413 8.400 3.008 -2.548 1.00 0.10 H new ATOM 0 HA PHE A 413 6.958 4.922 -4.247 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.604 3.027 -2.307 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.833 4.268 -3.274 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.455 0.977 -3.353 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.378 3.912 -5.626 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.124 -0.661 -5.148 1.00 0.11 H new ATOM 0 HE2 PHE A 413 4.045 2.278 -7.427 1.00 0.11 H new ATOM 0 HZ PHE A 413 4.919 -0.014 -7.193 1.00 0.11 H new ATOM 1453 N ARG A 414 6.787 6.439 -2.234 1.00 0.10 N ATOM 1454 CA ARG A 414 6.808 7.311 -1.105 1.00 0.12 C ATOM 1455 C ARG A 414 5.413 7.815 -0.841 1.00 0.11 C ATOM 1456 O ARG A 414 4.739 8.314 -1.742 1.00 0.15 O ATOM 1457 CB ARG A 414 7.762 8.472 -1.328 1.00 0.20 C ATOM 1458 CG ARG A 414 7.532 9.587 -0.345 1.00 0.35 C ATOM 1459 CD ARG A 414 8.711 10.518 -0.240 1.00 0.37 C ATOM 1460 NE ARG A 414 8.596 11.420 0.906 1.00 1.21 N ATOM 1461 CZ ARG A 414 8.978 12.695 0.890 1.00 1.46 C ATOM 1462 NH1 ARG A 414 9.441 13.239 -0.226 1.00 1.06 N ATOM 1463 NH2 ARG A 414 8.879 13.436 1.985 1.00 2.58 N ATOM 0 H ARG A 414 6.479 6.874 -3.104 1.00 0.10 H new ATOM 0 HA ARG A 414 7.164 6.756 -0.237 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.790 8.119 -1.242 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.640 8.852 -2.342 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.651 10.155 -0.644 1.00 0.35 H new ATOM 0 HG3 ARG A 414 7.320 9.163 0.637 1.00 0.35 H new ATOM 0 HD2 ARG A 414 9.627 9.934 -0.152 1.00 0.37 H new ATOM 0 HD3 ARG A 414 8.793 11.104 -1.156 1.00 0.37 H new ATOM 0 HE ARG A 414 8.199 11.049 1.769 1.00 1.21 H new ATOM 0 HH11 ARG A 414 9.506 12.680 -1.077 1.00 1.06 H new ATOM 0 HH12 ARG A 414 9.733 14.216 -0.234 1.00 1.06 H new ATOM 0 HH21 ARG A 414 8.509 13.029 2.844 1.00 2.58 H new ATOM 0 HH22 ARG A 414 9.173 14.413 1.968 1.00 2.58 H new ATOM 1477 N PHE A 415 4.987 7.671 0.386 1.00 0.10 N ATOM 1478 CA PHE A 415 3.674 8.127 0.791 1.00 0.09 C ATOM 1479 C PHE A 415 3.592 9.644 0.677 1.00 0.11 C ATOM 1480 O PHE A 415 4.345 10.380 1.319 1.00 0.14 O ATOM 1481 CB PHE A 415 3.364 7.676 2.219 1.00 0.10 C ATOM 1482 CG PHE A 415 2.711 6.330 2.324 1.00 0.10 C ATOM 1483 CD1 PHE A 415 1.329 6.217 2.282 1.00 0.11 C ATOM 1484 CD2 PHE A 415 3.470 5.187 2.489 1.00 0.10 C ATOM 1485 CE1 PHE A 415 0.719 4.986 2.397 1.00 0.13 C ATOM 1486 CE2 PHE A 415 2.872 3.955 2.604 1.00 0.11 C ATOM 1487 CZ PHE A 415 1.493 3.851 2.555 1.00 0.12 C ATOM 0 H PHE A 415 5.532 7.238 1.132 1.00 0.10 H new ATOM 0 HA PHE A 415 2.930 7.685 0.128 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.292 7.660 2.790 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.715 8.417 2.687 1.00 0.10 H new ATOM 0 HD1 PHE A 415 0.724 7.103 2.158 1.00 0.11 H new ATOM 0 HD2 PHE A 415 4.547 5.263 2.528 1.00 0.10 H new ATOM 0 HE1 PHE A 415 -0.358 4.909 2.364 1.00 0.13 H new ATOM 0 HE2 PHE A 415 3.477 3.070 2.732 1.00 0.11 H new ATOM 0 HZ PHE A 415 1.021 2.883 2.640 1.00 0.12 H new ATOM 1497 N MET A 416 2.714 10.089 -0.206 1.00 0.11 N ATOM 1498 CA MET A 416 2.445 11.507 -0.401 1.00 0.15 C ATOM 1499 C MET A 416 1.880 12.127 0.873 1.00 0.17 C ATOM 1500 O MET A 416 2.119 13.300 1.167 1.00 0.23 O ATOM 1501 CB MET A 416 1.459 11.704 -1.552 1.00 0.15 C ATOM 1502 CG MET A 416 1.974 11.236 -2.892 1.00 0.24 C ATOM 1503 SD MET A 416 0.877 11.671 -4.257 1.00 1.41 S ATOM 1504 CE MET A 416 0.844 13.456 -4.114 1.00 1.47 C ATOM 0 H MET A 416 2.165 9.477 -0.810 1.00 0.11 H new ATOM 0 HA MET A 416 3.385 12.003 -0.645 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.537 11.169 -1.322 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.205 12.762 -1.622 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.957 11.671 -3.070 1.00 0.24 H new ATOM 0 HG3 MET A 416 2.104 10.154 -2.868 1.00 0.24 H new ATOM 0 HE1 MET A 416 0.537 13.892 -5.065 1.00 1.47 H new ATOM 0 HE2 MET A 416 0.137 13.746 -3.337 1.00 1.47 H new ATOM 0 HE3 MET A 416 1.838 13.819 -3.853 1.00 1.47 H new ATOM 1514 N LYS A 417 1.137 11.322 1.615 1.00 0.16 N ATOM 1515 CA LYS A 417 0.552 11.734 2.880 1.00 0.21 C ATOM 1516 C LYS A 417 0.721 10.630 3.908 1.00 0.21 C ATOM 1517 O LYS A 417 1.250 9.561 3.607 1.00 0.22 O ATOM 1518 CB LYS A 417 -0.943 12.011 2.724 1.00 0.29 C ATOM 1519 CG LYS A 417 -1.299 13.345 2.104 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.807 13.512 2.080 1.00 0.54 C ATOM 1521 CE LYS A 417 -3.229 14.805 1.416 1.00 0.84 C ATOM 1522 NZ LYS A 417 -2.897 15.993 2.248 1.00 1.36 N ATOM 0 H LYS A 417 0.922 10.359 1.355 1.00 0.16 H new ATOM 0 HA LYS A 417 1.060 12.642 3.203 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.379 11.219 2.115 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.410 11.951 3.707 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.843 14.155 2.673 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -0.901 13.404 1.091 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -3.256 12.671 1.551 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -3.190 13.488 3.100 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -2.737 14.892 0.447 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -4.302 14.783 1.228 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -3.218 16.856 1.765 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -3.372 15.915 3.170 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -1.868 16.039 2.392 1.00 1.36 H new ATOM 1536 N THR A 418 0.270 10.898 5.117 1.00 0.24 N ATOM 1537 CA THR A 418 0.196 9.880 6.139 1.00 0.24 C ATOM 1538 C THR A 418 -1.256 9.481 6.366 1.00 0.26 C ATOM 1539 O THR A 418 -2.159 10.252 6.050 1.00 0.28 O ATOM 1540 CB THR A 418 0.835 10.360 7.448 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.281 11.621 7.854 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.331 10.485 7.259 1.00 0.22 C ATOM 0 H THR A 418 -0.052 11.819 5.414 1.00 0.24 H new ATOM 0 HA THR A 418 0.756 9.009 5.799 1.00 0.24 H new ATOM 0 HB THR A 418 0.625 9.631 8.231 1.00 0.26 H new ATOM 0 HG1 THR A 418 0.577 12.322 7.236 1.00 0.35 H new ATOM 0 HG21 THR A 418 2.788 10.826 8.188 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.746 9.515 6.986 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.539 11.204 6.467 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.496 8.278 6.908 1.00 0.25 N ATOM 1551 CA PRO A 419 -2.840 7.687 7.004 1.00 0.28 C ATOM 1552 C PRO A 419 -3.903 8.638 7.547 1.00 0.31 C ATOM 1553 O PRO A 419 -5.027 8.664 7.047 1.00 0.33 O ATOM 1554 CB PRO A 419 -2.619 6.508 7.945 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.222 6.096 7.654 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.472 7.380 7.472 1.00 0.25 C ATOM 0 HA PRO A 419 -3.231 7.415 6.023 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -2.744 6.797 8.988 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.325 5.701 7.751 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -0.805 5.507 8.471 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.171 5.478 6.758 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.079 7.757 8.416 1.00 0.25 H new ATOM 0 HD3 PRO A 419 0.377 7.261 6.799 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.542 9.426 8.542 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.465 10.403 9.121 1.00 0.42 C ATOM 1566 C ASP A 420 -4.911 11.412 8.067 1.00 0.43 C ATOM 1567 O ASP A 420 -6.102 11.686 7.911 1.00 0.48 O ATOM 1568 CB ASP A 420 -3.790 11.133 10.285 1.00 0.49 C ATOM 1569 CG ASP A 420 -4.638 12.258 10.852 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -4.578 13.386 10.315 1.00 0.72 O ATOM 1571 OD2 ASP A 420 -5.389 12.014 11.820 1.00 0.74 O ATOM 0 H ASP A 420 -2.617 9.414 8.971 1.00 0.35 H new ATOM 0 HA ASP A 420 -5.343 9.873 9.489 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -3.570 10.417 11.077 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -2.836 11.539 9.948 1.00 0.49 H new ATOM 1576 N GLU A 421 -3.941 11.931 7.329 1.00 0.42 N ATOM 1577 CA GLU A 421 -4.189 12.905 6.283 1.00 0.45 C ATOM 1578 C GLU A 421 -4.964 12.273 5.133 1.00 0.42 C ATOM 1579 O GLU A 421 -5.807 12.911 4.502 1.00 0.49 O ATOM 1580 CB GLU A 421 -2.853 13.421 5.766 1.00 0.49 C ATOM 1581 CG GLU A 421 -1.963 13.997 6.846 1.00 0.81 C ATOM 1582 CD GLU A 421 -0.625 14.437 6.305 1.00 1.60 C ATOM 1583 OE1 GLU A 421 0.242 13.569 6.077 1.00 2.21 O ATOM 1584 OE2 GLU A 421 -0.442 15.654 6.095 1.00 2.17 O ATOM 0 H GLU A 421 -2.957 11.686 7.441 1.00 0.42 H new ATOM 0 HA GLU A 421 -4.781 13.724 6.692 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -2.326 12.606 5.270 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -3.037 14.187 5.012 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -2.462 14.847 7.311 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -1.811 13.251 7.626 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.666 11.010 4.877 1.00 0.34 N ATOM 1592 CA ILE A 422 -5.243 10.295 3.753 1.00 0.33 C ATOM 1593 C ILE A 422 -6.697 9.905 4.021 1.00 0.36 C ATOM 1594 O ILE A 422 -7.562 10.038 3.153 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.427 9.028 3.441 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -2.964 9.383 3.190 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -5.009 8.316 2.243 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.099 8.191 2.848 1.00 0.27 C ATOM 0 H ILE A 422 -4.021 10.455 5.439 1.00 0.34 H new ATOM 0 HA ILE A 422 -5.216 10.968 2.896 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.476 8.361 4.302 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -2.909 10.106 2.376 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.560 9.871 4.077 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.424 7.421 2.032 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -6.040 8.033 2.453 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -4.984 8.979 1.378 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.073 8.521 2.683 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.122 7.476 3.671 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.477 7.715 1.943 1.00 0.27 H new ATOM 1610 N MET A 423 -6.971 9.447 5.233 1.00 0.42 N ATOM 1611 CA MET A 423 -8.302 8.985 5.593 1.00 0.51 C ATOM 1612 C MET A 423 -9.247 10.148 5.842 1.00 0.58 C ATOM 1613 O MET A 423 -10.387 9.966 6.267 1.00 0.71 O ATOM 1614 CB MET A 423 -8.238 8.081 6.813 1.00 0.58 C ATOM 1615 CG MET A 423 -7.496 6.797 6.533 1.00 0.58 C ATOM 1616 SD MET A 423 -7.945 5.468 7.667 1.00 0.90 S ATOM 1617 CE MET A 423 -9.674 5.239 7.255 1.00 2.01 C ATOM 0 H MET A 423 -6.286 9.385 5.986 1.00 0.42 H new ATOM 0 HA MET A 423 -8.694 8.414 4.752 1.00 0.51 H new ATOM 0 HB2 MET A 423 -7.748 8.611 7.630 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.250 7.849 7.145 1.00 0.58 H new ATOM 0 HG2 MET A 423 -7.701 6.480 5.510 1.00 0.58 H new ATOM 0 HG3 MET A 423 -6.424 6.980 6.602 1.00 0.58 H new ATOM 0 HE1 MET A 423 -9.959 4.204 7.442 1.00 2.01 H new ATOM 0 HE2 MET A 423 -10.285 5.900 7.869 1.00 2.01 H new ATOM 0 HE3 MET A 423 -9.831 5.474 6.202 1.00 2.01 H new ATOM 1627 N SER A 424 -8.765 11.333 5.540 1.00 0.59 N ATOM 1628 CA SER A 424 -9.541 12.553 5.700 1.00 0.72 C ATOM 1629 C SER A 424 -10.396 12.814 4.454 1.00 0.67 C ATOM 1630 O SER A 424 -10.571 13.959 4.029 1.00 1.09 O ATOM 1631 CB SER A 424 -8.599 13.732 5.974 1.00 0.92 C ATOM 1632 OG SER A 424 -9.317 14.912 6.297 1.00 1.57 O ATOM 0 H SER A 424 -7.824 11.483 5.176 1.00 0.59 H new ATOM 0 HA SER A 424 -10.215 12.439 6.549 1.00 0.72 H new ATOM 0 HB2 SER A 424 -7.927 13.478 6.794 1.00 0.92 H new ATOM 0 HB3 SER A 424 -7.977 13.913 5.097 1.00 0.92 H new ATOM 0 HG SER A 424 -9.935 15.129 5.568 1.00 1.57 H new ATOM 1638 N GLY A 425 -10.920 11.744 3.862 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.816 11.888 2.730 1.00 0.42 C ATOM 1640 C GLY A 425 -11.254 11.327 1.436 1.00 0.37 C ATOM 1641 O GLY A 425 -12.004 11.034 0.509 1.00 0.50 O ATOM 0 H GLY A 425 -10.740 10.781 4.146 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.757 11.386 2.956 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -12.044 12.945 2.590 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.941 11.174 1.360 1.00 0.38 N ATOM 1646 CA ARG A 426 -9.306 10.679 0.146 1.00 0.36 C ATOM 1647 C ARG A 426 -9.588 9.186 -0.046 1.00 0.33 C ATOM 1648 O ARG A 426 -9.866 8.728 -1.153 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.802 10.957 0.213 1.00 0.39 C ATOM 1650 CG ARG A 426 -7.458 12.425 0.326 1.00 0.56 C ATOM 1651 CD ARG A 426 -7.533 13.115 -1.022 1.00 0.92 C ATOM 1652 NE ARG A 426 -8.912 13.271 -1.504 1.00 1.37 N ATOM 1653 CZ ARG A 426 -9.234 13.706 -2.725 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -8.286 14.093 -3.568 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -10.507 13.788 -3.086 1.00 2.67 N ATOM 0 H ARG A 426 -9.295 11.384 2.121 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.722 11.199 -0.717 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -7.382 10.428 1.068 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -7.326 10.549 -0.679 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -8.143 12.908 1.023 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -6.455 12.535 0.738 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -7.065 14.097 -0.949 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -6.960 12.542 -1.751 1.00 0.92 H new ATOM 0 HE ARG A 426 -9.671 13.032 -0.866 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -7.307 14.059 -3.285 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -8.536 14.425 -4.500 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -11.241 13.519 -2.431 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -10.752 14.120 -4.019 1.00 2.67 H new ATOM 1669 N THR A 427 -9.527 8.445 1.046 1.00 0.33 N ATOM 1670 CA THR A 427 -9.816 7.005 1.042 1.00 0.37 C ATOM 1671 C THR A 427 -11.290 6.720 1.129 1.00 0.43 C ATOM 1672 O THR A 427 -11.750 5.627 0.805 1.00 0.58 O ATOM 1673 CB THR A 427 -9.134 6.337 2.225 1.00 0.63 C ATOM 1674 OG1 THR A 427 -9.553 6.956 3.448 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.666 6.498 2.077 1.00 0.41 C ATOM 0 H THR A 427 -9.277 8.815 1.963 1.00 0.33 H new ATOM 0 HA THR A 427 -9.439 6.610 0.099 1.00 0.37 H new ATOM 0 HB THR A 427 -9.402 5.281 2.252 1.00 0.63 H new ATOM 0 HG1 THR A 427 -9.532 6.296 4.172 1.00 1.24 H new ATOM 0 HG21 THR A 427 -7.161 6.024 2.919 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.340 6.030 1.148 1.00 0.41 H new ATOM 0 HG23 THR A 427 -7.417 7.559 2.055 1.00 0.41 H new ATOM 1683 N ASP A 428 -12.001 7.712 1.595 1.00 0.45 N ATOM 1684 CA ASP A 428 -13.459 7.641 1.734 1.00 0.62 C ATOM 1685 C ASP A 428 -14.112 7.092 0.466 1.00 0.61 C ATOM 1686 O ASP A 428 -15.076 6.327 0.531 1.00 0.78 O ATOM 1687 CB ASP A 428 -14.014 9.032 2.058 1.00 0.74 C ATOM 1688 CG ASP A 428 -15.524 9.123 1.945 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -16.219 8.807 2.932 1.00 1.63 O ATOM 1690 OD2 ASP A 428 -16.020 9.537 0.874 1.00 1.75 O ATOM 0 H ASP A 428 -11.599 8.601 1.894 1.00 0.45 H new ATOM 0 HA ASP A 428 -13.693 6.958 2.550 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -13.716 9.306 3.070 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -13.563 9.760 1.384 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.572 7.480 -0.682 1.00 0.54 N ATOM 1696 CA ARG A 429 -14.043 6.969 -1.962 1.00 0.65 C ATOM 1697 C ARG A 429 -13.433 5.613 -2.277 1.00 0.55 C ATOM 1698 O ARG A 429 -14.116 4.705 -2.738 1.00 0.66 O ATOM 1699 CB ARG A 429 -13.770 7.953 -3.090 1.00 0.81 C ATOM 1700 CG ARG A 429 -12.532 8.773 -2.872 1.00 0.98 C ATOM 1701 CD ARG A 429 -12.427 9.905 -3.876 1.00 1.12 C ATOM 1702 NE ARG A 429 -13.479 10.902 -3.673 1.00 1.64 N ATOM 1703 CZ ARG A 429 -13.917 11.731 -4.617 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -13.441 11.642 -5.850 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -14.849 12.629 -4.333 1.00 3.05 N ATOM 0 H ARG A 429 -12.805 8.149 -0.753 1.00 0.54 H new ATOM 0 HA ARG A 429 -15.123 6.843 -1.879 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -13.674 7.404 -4.027 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -14.626 8.620 -3.197 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -12.539 9.182 -1.862 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -11.653 8.133 -2.951 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -11.451 10.382 -3.788 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -12.495 9.503 -4.887 1.00 1.12 H new ATOM 0 HE ARG A 429 -13.904 10.965 -2.748 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -12.739 10.938 -6.076 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -13.777 12.278 -6.574 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -15.232 12.686 -3.389 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -15.183 13.264 -5.058 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.152 5.486 -1.981 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.373 4.282 -2.266 1.00 0.36 C ATOM 1721 C LEU A 430 -12.032 3.021 -1.748 1.00 0.39 C ATOM 1722 O LEU A 430 -12.048 1.990 -2.416 1.00 0.45 O ATOM 1723 CB LEU A 430 -10.019 4.402 -1.610 1.00 0.31 C ATOM 1724 CG LEU A 430 -8.962 5.115 -2.419 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -7.790 5.411 -1.528 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -8.523 4.260 -3.592 1.00 0.56 C ATOM 0 H LEU A 430 -11.611 6.223 -1.530 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.294 4.204 -3.350 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -10.140 4.926 -0.662 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.658 3.400 -1.377 1.00 0.31 H new ATOM 0 HG LEU A 430 -9.372 6.045 -2.813 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -7.019 5.926 -2.100 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -8.112 6.044 -0.701 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.387 4.478 -1.135 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -7.761 4.790 -4.164 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.112 3.320 -3.223 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -9.380 4.054 -4.233 1.00 0.56 H new