USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=21 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= -1.19! K(o=-2.3!,f=-5.3) USER MOD Set 1.2: A 417 LYS NZ :NH3+ -122:sc= -1.1 (180deg=-3.54!) USER MOD Set 2.1: A 396 HIS : no HD1:sc= -2.44! C(o=-3.9!,f=-12!) USER MOD Set 2.2: A 399 LYS NZ :NH3+ 151:sc= -1.41! (180deg=-3.86!) USER MOD Single : A 340 TYR OH : rot 118:sc= -0.321 USER MOD Single : A 342 TYR OH : rot 117:sc= -1.3! USER MOD Single : A 343 GLN : amide:sc= -1.6! K(o=-1.6!,f=-0.11) USER MOD Single : A 346 SER OG : rot 180:sc= 0 USER MOD Single : A 348 SER OG : rot 91:sc= 1.15 USER MOD Single : A 350 TYR OH : rot 180:sc= 0 USER MOD Single : A 352 ASN : amide:sc=-0.000427 X(o=-0.00043,f=-0.00014) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 370 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= -0.254 K(o=-0.25,f=-1.6!) USER MOD Single : A 379 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 380 LYS NZ :NH3+ -129:sc= 0.0814 (180deg=0) USER MOD Single : A 386 THR OG1 : rot -151:sc= -1.34 USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 390 MET CE :methyl -169:sc= -0.469 (180deg=-0.808) USER MOD Single : A 391 SER OG : rot 108:sc= -1.66! USER MOD Single : A 397 TYR OH : rot 92:sc= -0.562 USER MOD Single : A 398 TYR OH : rot -35:sc= 0.948 USER MOD Single : A 405 LYS NZ :NH3+ 132:sc= -0.066 (180deg=-0.444) USER MOD Single : A 409 GLN : amide:sc= -3.95 K(o=-3.9,f=-7.7!) USER MOD Single : A 416 MET CE :methyl 156:sc= -0.336 (180deg=-1.19) USER MOD Single : A 418 THR OG1 : rot -70:sc= 1.13 USER MOD Single : A 423 MET CE :methyl -178:sc= -0.357 (180deg=-0.366) USER MOD Single : A 424 SER OG : rot -117:sc= 1.21 USER MOD Single : A 427 THR OG1 : rot -43:sc= -0.695! USER MOD ----------------------------------------------------------------- ATOM 56 N ARG A 335 -7.985 -3.180 6.401 1.00 0.40 N ATOM 57 CA ARG A 335 -6.896 -2.320 5.968 1.00 0.32 C ATOM 58 C ARG A 335 -7.038 -2.035 4.482 1.00 0.28 C ATOM 59 O ARG A 335 -7.251 -2.953 3.689 1.00 0.42 O ATOM 60 CB ARG A 335 -5.532 -2.978 6.202 1.00 0.37 C ATOM 61 CG ARG A 335 -5.373 -3.642 7.558 1.00 0.56 C ATOM 62 CD ARG A 335 -4.762 -2.712 8.591 1.00 0.93 C ATOM 63 NE ARG A 335 -5.667 -1.636 8.986 1.00 1.32 N ATOM 64 CZ ARG A 335 -6.073 -1.432 10.238 1.00 2.05 C ATOM 65 NH1 ARG A 335 -5.621 -2.205 11.218 1.00 2.81 N ATOM 66 NH2 ARG A 335 -6.913 -0.444 10.518 1.00 2.51 N ATOM 0 HA ARG A 335 -6.948 -1.400 6.550 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.366 -3.724 5.425 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.755 -2.222 6.089 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -6.347 -3.981 7.910 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -4.746 -4.527 7.454 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -4.483 -3.289 9.473 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -3.845 -2.281 8.189 1.00 0.93 H new ATOM 0 HE ARG A 335 -6.008 -1.004 8.261 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -4.962 -2.956 11.013 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -5.933 -2.048 12.176 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -7.251 0.164 9.772 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -7.220 -0.293 11.479 1.00 2.51 H new ATOM 80 N LEU A 336 -6.955 -0.766 4.113 1.00 0.23 N ATOM 81 CA LEU A 336 -6.818 -0.389 2.705 1.00 0.28 C ATOM 82 C LEU A 336 -5.506 -0.917 2.162 1.00 0.14 C ATOM 83 O LEU A 336 -4.727 -1.478 2.909 1.00 0.20 O ATOM 84 CB LEU A 336 -6.860 1.128 2.529 1.00 0.48 C ATOM 85 CG LEU A 336 -8.237 1.768 2.641 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.554 2.509 1.365 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.290 0.718 2.916 1.00 0.67 C ATOM 0 H LEU A 336 -6.979 0.021 4.762 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.654 -0.823 2.157 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -6.208 1.580 3.276 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.444 1.374 1.552 1.00 0.48 H new ATOM 0 HG LEU A 336 -8.235 2.472 3.473 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.540 2.967 1.446 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.806 3.284 1.199 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.545 1.811 0.527 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -10.267 1.194 2.993 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.302 -0.007 2.102 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -9.060 0.209 3.852 1.00 0.67 H new ATOM 99 N LEU A 337 -5.233 -0.727 0.886 1.00 0.15 N ATOM 100 CA LEU A 337 -4.007 -1.267 0.321 1.00 0.12 C ATOM 101 C LEU A 337 -2.799 -0.550 0.920 1.00 0.11 C ATOM 102 O LEU A 337 -1.855 -1.191 1.375 1.00 0.12 O ATOM 103 CB LEU A 337 -4.036 -1.158 -1.208 1.00 0.14 C ATOM 104 CG LEU A 337 -2.892 -1.827 -1.968 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.763 -0.854 -2.174 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.391 -3.062 -1.238 1.00 0.15 C ATOM 0 H LEU A 337 -5.826 -0.216 0.232 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.925 -2.325 0.572 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.974 -1.585 -1.561 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -4.048 -0.101 -1.473 1.00 0.14 H new ATOM 0 HG LEU A 337 -3.275 -2.141 -2.939 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.955 -1.344 -2.717 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -2.120 0.001 -2.748 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.396 -0.513 -1.206 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.577 -3.515 -1.805 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -2.031 -2.779 -0.249 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -3.205 -3.780 -1.136 1.00 0.15 H new ATOM 118 N TRP A 338 -2.859 0.772 0.973 1.00 0.12 N ATOM 119 CA TRP A 338 -1.800 1.555 1.612 1.00 0.14 C ATOM 120 C TRP A 338 -1.821 1.337 3.127 1.00 0.14 C ATOM 121 O TRP A 338 -0.785 1.334 3.786 1.00 0.17 O ATOM 122 CB TRP A 338 -1.953 3.053 1.277 1.00 0.16 C ATOM 123 CG TRP A 338 -3.243 3.664 1.739 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.365 3.861 0.994 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.544 4.162 3.046 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.342 4.443 1.756 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.867 4.634 3.019 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.829 4.244 4.237 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.484 5.183 4.136 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.441 4.788 5.344 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.761 5.250 5.287 1.00 0.21 C ATOM 0 H TRP A 338 -3.622 1.327 0.585 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.838 1.217 1.226 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.125 3.600 1.727 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.870 3.182 0.198 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.469 3.596 -0.048 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.276 4.694 1.431 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.811 3.887 4.292 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.501 5.544 4.093 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -2.893 4.859 6.272 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.215 5.668 6.174 1.00 0.21 H new ATOM 142 N ASP A 339 -3.016 1.134 3.661 1.00 0.14 N ATOM 143 CA ASP A 339 -3.209 0.926 5.093 1.00 0.17 C ATOM 144 C ASP A 339 -2.694 -0.451 5.487 1.00 0.16 C ATOM 145 O ASP A 339 -2.264 -0.689 6.615 1.00 0.23 O ATOM 146 CB ASP A 339 -4.697 1.100 5.422 1.00 0.23 C ATOM 147 CG ASP A 339 -5.026 0.909 6.885 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.262 1.417 7.732 1.00 0.86 O ATOM 149 OD2 ASP A 339 -6.018 0.218 7.199 1.00 1.15 O ATOM 0 H ASP A 339 -3.879 1.108 3.118 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.644 1.660 5.667 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.013 2.097 5.116 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.275 0.388 4.833 1.00 0.23 H new ATOM 154 N TYR A 340 -2.725 -1.340 4.517 1.00 0.11 N ATOM 155 CA TYR A 340 -2.194 -2.676 4.653 1.00 0.10 C ATOM 156 C TYR A 340 -0.671 -2.656 4.649 1.00 0.08 C ATOM 157 O TYR A 340 -0.036 -3.279 5.500 1.00 0.09 O ATOM 158 CB TYR A 340 -2.707 -3.536 3.508 1.00 0.11 C ATOM 159 CG TYR A 340 -2.509 -4.996 3.742 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.950 -5.576 4.915 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.881 -5.791 2.803 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.774 -6.913 5.152 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.700 -7.136 3.027 1.00 0.14 C ATOM 164 CZ TYR A 340 -2.149 -7.696 4.208 1.00 0.16 C ATOM 165 OH TYR A 340 -1.974 -9.037 4.452 1.00 0.20 O ATOM 0 H TYR A 340 -3.126 -1.150 3.599 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.524 -3.094 5.604 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.769 -3.338 3.359 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.197 -3.249 2.588 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.442 -4.965 5.658 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.528 -5.351 1.882 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -3.124 -7.351 6.075 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.211 -7.750 2.285 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.462 -9.558 3.780 1.00 0.20 H new ATOM 175 N VAL A 341 -0.083 -1.931 3.693 1.00 0.08 N ATOM 176 CA VAL A 341 1.371 -1.897 3.568 1.00 0.07 C ATOM 177 C VAL A 341 2.000 -1.326 4.828 1.00 0.08 C ATOM 178 O VAL A 341 3.077 -1.739 5.212 1.00 0.08 O ATOM 179 CB VAL A 341 1.872 -1.093 2.336 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.076 -1.429 1.095 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.877 0.405 2.574 1.00 0.09 C ATOM 0 H VAL A 341 -0.585 -1.369 3.006 1.00 0.08 H new ATOM 0 HA VAL A 341 1.680 -2.932 3.423 1.00 0.07 H new ATOM 0 HB VAL A 341 2.907 -1.397 2.178 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.453 -0.849 0.253 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.175 -2.492 0.876 1.00 0.07 H new ATOM 0 HG13 VAL A 341 0.026 -1.188 1.260 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.236 0.914 1.680 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.865 0.741 2.801 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.533 0.638 3.412 1.00 0.09 H new ATOM 191 N TYR A 342 1.316 -0.384 5.468 1.00 0.08 N ATOM 192 CA TYR A 342 1.788 0.167 6.744 1.00 0.10 C ATOM 193 C TYR A 342 1.964 -0.929 7.789 1.00 0.11 C ATOM 194 O TYR A 342 2.938 -0.929 8.538 1.00 0.14 O ATOM 195 CB TYR A 342 0.826 1.217 7.306 1.00 0.11 C ATOM 196 CG TYR A 342 1.084 2.630 6.843 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.226 3.314 7.243 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.176 3.293 6.035 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.456 4.617 6.840 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.401 4.590 5.629 1.00 0.19 C ATOM 201 CZ TYR A 342 1.542 5.247 6.031 1.00 0.17 C ATOM 202 OH TYR A 342 1.764 6.544 5.630 1.00 0.21 O ATOM 0 H TYR A 342 0.439 0.015 5.132 1.00 0.08 H new ATOM 0 HA TYR A 342 2.749 0.637 6.533 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.192 0.940 7.030 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.880 1.192 8.394 1.00 0.11 H new ATOM 0 HD1 TYR A 342 2.946 2.820 7.879 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.723 2.785 5.718 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.348 5.135 7.159 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.317 5.091 4.996 1.00 0.19 H new ATOM 0 HH TYR A 342 1.857 6.574 4.655 1.00 0.21 H new ATOM 212 N GLN A 343 1.027 -1.873 7.828 1.00 0.12 N ATOM 213 CA GLN A 343 1.065 -2.934 8.814 1.00 0.18 C ATOM 214 C GLN A 343 2.201 -3.879 8.469 1.00 0.18 C ATOM 215 O GLN A 343 2.877 -4.423 9.344 1.00 0.25 O ATOM 216 CB GLN A 343 -0.287 -3.668 8.844 1.00 0.28 C ATOM 217 CG GLN A 343 -0.314 -5.000 8.121 1.00 0.55 C ATOM 218 CD GLN A 343 -0.209 -6.179 9.072 1.00 0.99 C ATOM 219 OE1 GLN A 343 -1.220 -6.738 9.500 1.00 1.40 O ATOM 220 NE2 GLN A 343 1.007 -6.542 9.439 1.00 1.15 N ATOM 0 H GLN A 343 0.236 -1.919 7.186 1.00 0.12 H new ATOM 0 HA GLN A 343 1.240 -2.523 9.808 1.00 0.18 H new ATOM 0 HB2 GLN A 343 -0.571 -3.831 9.884 1.00 0.28 H new ATOM 0 HB3 GLN A 343 -1.045 -3.019 8.405 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.238 -5.080 7.548 1.00 0.55 H new ATOM 0 HG3 GLN A 343 0.508 -5.039 7.407 1.00 0.55 H new ATOM 0 HE21 GLN A 343 1.820 -6.055 9.063 1.00 1.15 H new ATOM 0 HE22 GLN A 343 1.133 -7.310 10.099 1.00 1.15 H new ATOM 229 N LEU A 344 2.410 -4.049 7.176 1.00 0.15 N ATOM 230 CA LEU A 344 3.460 -4.900 6.670 1.00 0.16 C ATOM 231 C LEU A 344 4.816 -4.224 6.859 1.00 0.18 C ATOM 232 O LEU A 344 5.819 -4.865 7.147 1.00 0.27 O ATOM 233 CB LEU A 344 3.190 -5.171 5.194 1.00 0.13 C ATOM 234 CG LEU A 344 1.789 -5.706 4.894 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.546 -5.738 3.405 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.603 -7.090 5.479 1.00 0.18 C ATOM 0 H LEU A 344 1.853 -3.598 6.450 1.00 0.15 H new ATOM 0 HA LEU A 344 3.478 -5.844 7.215 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.340 -4.248 4.635 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.925 -5.888 4.829 1.00 0.13 H new ATOM 0 HG LEU A 344 1.065 -5.035 5.357 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.545 -6.121 3.208 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.635 -4.730 3.000 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.282 -6.386 2.930 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.599 -7.449 5.252 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.337 -7.769 5.047 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.738 -7.049 6.560 1.00 0.18 H new ATOM 248 N LEU A 345 4.801 -2.910 6.708 1.00 0.12 N ATOM 249 CA LEU A 345 5.969 -2.054 6.897 1.00 0.13 C ATOM 250 C LEU A 345 6.402 -2.051 8.361 1.00 0.19 C ATOM 251 O LEU A 345 7.566 -1.801 8.684 1.00 0.29 O ATOM 252 CB LEU A 345 5.622 -0.622 6.460 1.00 0.10 C ATOM 253 CG LEU A 345 6.113 -0.178 5.070 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.420 -1.363 4.174 1.00 0.12 C ATOM 255 CD2 LEU A 345 5.082 0.731 4.405 1.00 0.10 C ATOM 0 H LEU A 345 3.961 -2.394 6.445 1.00 0.12 H new ATOM 0 HA LEU A 345 6.791 -2.439 6.293 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.538 -0.513 6.487 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.031 0.066 7.200 1.00 0.10 H new ATOM 0 HG LEU A 345 7.040 0.377 5.214 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.763 -1.006 3.203 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.198 -1.973 4.632 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.519 -1.963 4.042 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.445 1.036 3.423 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.141 0.193 4.293 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.923 1.614 5.023 1.00 0.10 H new ATOM 267 N SER A 346 5.453 -2.333 9.237 1.00 0.25 N ATOM 268 CA SER A 346 5.689 -2.297 10.670 1.00 0.33 C ATOM 269 C SER A 346 6.209 -3.639 11.182 1.00 0.30 C ATOM 270 O SER A 346 6.743 -3.718 12.287 1.00 0.53 O ATOM 271 CB SER A 346 4.388 -1.922 11.393 1.00 0.51 C ATOM 272 OG SER A 346 4.578 -1.785 12.794 1.00 1.43 O ATOM 0 H SER A 346 4.501 -2.592 8.977 1.00 0.25 H new ATOM 0 HA SER A 346 6.452 -1.546 10.875 1.00 0.33 H new ATOM 0 HB2 SER A 346 4.004 -0.987 10.986 1.00 0.51 H new ATOM 0 HB3 SER A 346 3.634 -2.686 11.202 1.00 0.51 H new ATOM 0 HG SER A 346 3.728 -1.545 13.217 1.00 1.43 H new ATOM 278 N ASP A 347 6.071 -4.688 10.381 1.00 0.32 N ATOM 279 CA ASP A 347 6.441 -6.027 10.829 1.00 0.32 C ATOM 280 C ASP A 347 7.503 -6.632 9.918 1.00 0.30 C ATOM 281 O ASP A 347 7.387 -6.597 8.694 1.00 0.30 O ATOM 282 CB ASP A 347 5.209 -6.935 10.877 1.00 0.35 C ATOM 283 CG ASP A 347 5.444 -8.192 11.691 1.00 0.49 C ATOM 284 OD1 ASP A 347 6.466 -8.876 11.471 1.00 0.58 O ATOM 285 OD2 ASP A 347 4.591 -8.515 12.550 1.00 0.67 O ATOM 0 H ASP A 347 5.710 -4.641 9.428 1.00 0.32 H new ATOM 0 HA ASP A 347 6.857 -5.944 11.833 1.00 0.32 H new ATOM 0 HB2 ASP A 347 4.371 -6.382 11.302 1.00 0.35 H new ATOM 0 HB3 ASP A 347 4.926 -7.212 9.861 1.00 0.35 H new ATOM 290 N SER A 348 8.518 -7.221 10.530 1.00 0.34 N ATOM 291 CA SER A 348 9.681 -7.707 9.807 1.00 0.35 C ATOM 292 C SER A 348 9.384 -8.990 9.037 1.00 0.31 C ATOM 293 O SER A 348 10.125 -9.351 8.125 1.00 0.32 O ATOM 294 CB SER A 348 10.836 -7.940 10.776 1.00 0.46 C ATOM 295 OG SER A 348 11.995 -8.414 10.113 1.00 1.53 O ATOM 0 H SER A 348 8.559 -7.375 11.538 1.00 0.34 H new ATOM 0 HA SER A 348 9.957 -6.943 9.080 1.00 0.35 H new ATOM 0 HB2 SER A 348 11.069 -7.009 11.294 1.00 0.46 H new ATOM 0 HB3 SER A 348 10.533 -8.660 11.536 1.00 0.46 H new ATOM 0 HG SER A 348 12.556 -7.654 9.851 1.00 1.53 H new ATOM 301 N ARG A 349 8.307 -9.687 9.384 1.00 0.33 N ATOM 302 CA ARG A 349 7.996 -10.928 8.687 1.00 0.35 C ATOM 303 C ARG A 349 7.592 -10.640 7.246 1.00 0.29 C ATOM 304 O ARG A 349 7.620 -11.521 6.388 1.00 0.34 O ATOM 305 CB ARG A 349 6.906 -11.726 9.391 1.00 0.42 C ATOM 306 CG ARG A 349 5.516 -11.185 9.189 1.00 0.55 C ATOM 307 CD ARG A 349 4.802 -11.076 10.506 1.00 0.59 C ATOM 308 NE ARG A 349 4.543 -12.371 11.124 1.00 1.23 N ATOM 309 CZ ARG A 349 4.057 -12.513 12.354 1.00 1.67 C ATOM 310 NH1 ARG A 349 3.826 -11.444 13.109 1.00 1.93 N ATOM 311 NH2 ARG A 349 3.816 -13.722 12.838 1.00 2.56 N ATOM 0 H ARG A 349 7.653 -9.424 10.121 1.00 0.33 H new ATOM 0 HA ARG A 349 8.900 -11.537 8.693 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.938 -12.756 9.035 1.00 0.42 H new ATOM 0 HB3 ARG A 349 7.122 -11.751 10.459 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.565 -10.206 8.712 1.00 0.55 H new ATOM 0 HG3 ARG A 349 4.958 -11.838 8.518 1.00 0.55 H new ATOM 0 HD2 ARG A 349 5.398 -10.468 11.187 1.00 0.59 H new ATOM 0 HD3 ARG A 349 3.856 -10.555 10.358 1.00 0.59 H new ATOM 0 HE ARG A 349 4.745 -13.213 10.584 1.00 1.23 H new ATOM 0 HH11 ARG A 349 4.021 -10.511 12.746 1.00 1.93 H new ATOM 0 HH12 ARG A 349 3.453 -11.556 14.052 1.00 1.93 H new ATOM 0 HH21 ARG A 349 4.003 -14.546 12.267 1.00 2.56 H new ATOM 0 HH22 ARG A 349 3.443 -13.829 13.781 1.00 2.56 H new ATOM 325 N TYR A 350 7.229 -9.389 6.982 1.00 0.22 N ATOM 326 CA TYR A 350 6.825 -8.984 5.650 1.00 0.17 C ATOM 327 C TYR A 350 7.893 -8.130 5.001 1.00 0.16 C ATOM 328 O TYR A 350 7.740 -7.716 3.857 1.00 0.15 O ATOM 329 CB TYR A 350 5.538 -8.179 5.700 1.00 0.17 C ATOM 330 CG TYR A 350 4.473 -8.769 6.572 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.861 -9.968 6.245 1.00 0.24 C ATOM 332 CD2 TYR A 350 4.054 -8.105 7.708 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.862 -10.489 7.027 1.00 0.29 C ATOM 334 CE2 TYR A 350 3.061 -8.617 8.502 1.00 0.28 C ATOM 335 CZ TYR A 350 2.459 -9.812 8.161 1.00 0.31 C ATOM 336 OH TYR A 350 1.457 -10.326 8.952 1.00 0.39 O ATOM 0 H TYR A 350 7.208 -8.642 7.676 1.00 0.22 H new ATOM 0 HA TYR A 350 6.672 -9.892 5.067 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.766 -7.174 6.055 1.00 0.17 H new ATOM 0 HB3 TYR A 350 5.147 -8.078 4.687 1.00 0.17 H new ATOM 0 HD1 TYR A 350 4.176 -10.501 5.360 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.517 -7.166 7.975 1.00 0.23 H new ATOM 0 HE1 TYR A 350 2.393 -11.424 6.757 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.751 -8.088 9.391 1.00 0.28 H new ATOM 0 HH TYR A 350 1.298 -9.725 9.710 1.00 0.39 H new ATOM 346 N GLU A 351 8.981 -7.874 5.722 1.00 0.18 N ATOM 347 CA GLU A 351 10.016 -6.969 5.224 1.00 0.21 C ATOM 348 C GLU A 351 10.742 -7.570 4.019 1.00 0.21 C ATOM 349 O GLU A 351 11.543 -6.906 3.362 1.00 0.24 O ATOM 350 CB GLU A 351 11.003 -6.580 6.332 1.00 0.28 C ATOM 351 CG GLU A 351 12.064 -7.617 6.627 1.00 0.48 C ATOM 352 CD GLU A 351 13.208 -7.036 7.432 1.00 0.99 C ATOM 353 OE1 GLU A 351 12.971 -6.601 8.576 1.00 1.78 O ATOM 354 OE2 GLU A 351 14.342 -6.975 6.915 1.00 1.05 O ATOM 0 H GLU A 351 9.169 -8.274 6.641 1.00 0.18 H new ATOM 0 HA GLU A 351 9.522 -6.056 4.893 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.494 -5.648 6.052 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.443 -6.383 7.246 1.00 0.28 H new ATOM 0 HG2 GLU A 351 11.619 -8.447 7.175 1.00 0.48 H new ATOM 0 HG3 GLU A 351 12.447 -8.022 5.690 1.00 0.48 H new ATOM 361 N ASN A 352 10.444 -8.828 3.721 1.00 0.19 N ATOM 362 CA ASN A 352 10.965 -9.477 2.527 1.00 0.21 C ATOM 363 C ASN A 352 10.011 -9.252 1.356 1.00 0.16 C ATOM 364 O ASN A 352 10.370 -9.456 0.205 1.00 0.18 O ATOM 365 CB ASN A 352 11.155 -10.972 2.771 1.00 0.27 C ATOM 366 CG ASN A 352 11.916 -11.662 1.654 1.00 1.03 C ATOM 367 OD1 ASN A 352 13.147 -11.692 1.651 1.00 1.83 O ATOM 368 ND2 ASN A 352 11.190 -12.236 0.707 1.00 1.62 N ATOM 0 H ASN A 352 9.842 -9.420 4.293 1.00 0.19 H new ATOM 0 HA ASN A 352 11.934 -9.041 2.286 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.689 -11.116 3.710 1.00 0.27 H new ATOM 0 HB3 ASN A 352 10.179 -11.443 2.883 1.00 0.27 H new ATOM 0 HD21 ASN A 352 11.649 -12.726 -0.061 1.00 1.62 H new ATOM 0 HD22 ASN A 352 10.172 -12.189 0.746 1.00 1.62 H new ATOM 375 N PHE A 353 8.785 -8.840 1.661 1.00 0.13 N ATOM 376 CA PHE A 353 7.798 -8.531 0.635 1.00 0.10 C ATOM 377 C PHE A 353 7.695 -7.025 0.424 1.00 0.08 C ATOM 378 O PHE A 353 7.374 -6.557 -0.665 1.00 0.07 O ATOM 379 CB PHE A 353 6.424 -9.061 1.032 1.00 0.09 C ATOM 380 CG PHE A 353 6.395 -10.523 1.359 1.00 0.12 C ATOM 381 CD1 PHE A 353 7.101 -11.439 0.600 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.668 -10.977 2.442 1.00 0.13 C ATOM 383 CE1 PHE A 353 7.079 -12.782 0.912 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.644 -12.317 2.764 1.00 0.17 C ATOM 385 CZ PHE A 353 6.350 -13.222 1.997 1.00 0.18 C ATOM 0 H PHE A 353 8.451 -8.712 2.616 1.00 0.13 H new ATOM 0 HA PHE A 353 8.123 -9.010 -0.289 1.00 0.10 H new ATOM 0 HB2 PHE A 353 6.068 -8.501 1.896 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.725 -8.869 0.218 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.677 -11.098 -0.248 1.00 0.17 H new ATOM 0 HD2 PHE A 353 5.112 -10.274 3.044 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.631 -13.487 0.308 1.00 0.19 H new ATOM 0 HE2 PHE A 353 5.074 -12.658 3.615 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.332 -14.273 2.246 1.00 0.18 H new ATOM 395 N ILE A 354 7.983 -6.278 1.471 1.00 0.08 N ATOM 396 CA ILE A 354 7.840 -4.830 1.466 1.00 0.07 C ATOM 397 C ILE A 354 8.534 -4.270 2.700 1.00 0.08 C ATOM 398 O ILE A 354 8.615 -4.944 3.723 1.00 0.10 O ATOM 399 CB ILE A 354 6.348 -4.425 1.464 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.162 -2.954 1.090 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.718 -4.709 2.819 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.710 -2.514 1.082 1.00 0.07 C ATOM 0 H ILE A 354 8.324 -6.657 2.354 1.00 0.08 H new ATOM 0 HA ILE A 354 8.297 -4.424 0.563 1.00 0.07 H new ATOM 0 HB ILE A 354 5.846 -5.026 0.706 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.718 -2.335 1.794 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.592 -2.780 0.104 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.668 -4.418 2.800 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.796 -5.773 3.040 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.239 -4.139 3.589 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.651 -1.460 0.809 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.154 -3.109 0.358 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.281 -2.656 2.074 1.00 0.07 H new ATOM 414 N ARG A 355 9.052 -3.063 2.610 1.00 0.09 N ATOM 415 CA ARG A 355 9.808 -2.496 3.718 1.00 0.11 C ATOM 416 C ARG A 355 9.923 -0.988 3.594 1.00 0.10 C ATOM 417 O ARG A 355 9.874 -0.438 2.497 1.00 0.14 O ATOM 418 CB ARG A 355 11.215 -3.090 3.739 1.00 0.16 C ATOM 419 CG ARG A 355 12.089 -2.554 2.622 1.00 0.22 C ATOM 420 CD ARG A 355 13.472 -3.157 2.643 1.00 0.25 C ATOM 421 NE ARG A 355 14.376 -2.447 1.748 1.00 0.98 N ATOM 422 CZ ARG A 355 15.345 -3.021 1.043 1.00 1.40 C ATOM 423 NH1 ARG A 355 15.547 -4.334 1.118 1.00 1.43 N ATOM 424 NH2 ARG A 355 16.111 -2.274 0.257 1.00 2.08 N ATOM 0 H ARG A 355 8.968 -2.458 1.793 1.00 0.09 H new ATOM 0 HA ARG A 355 9.277 -2.736 4.639 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.683 -2.872 4.699 1.00 0.16 H new ATOM 0 HB3 ARG A 355 11.149 -4.175 3.656 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.618 -2.763 1.662 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.165 -1.470 2.710 1.00 0.22 H new ATOM 0 HD2 ARG A 355 13.867 -3.129 3.658 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.418 -4.206 2.351 1.00 0.25 H new ATOM 0 HE ARG A 355 14.257 -1.438 1.656 1.00 0.98 H new ATOM 0 HH11 ARG A 355 14.956 -4.907 1.720 1.00 1.43 H new ATOM 0 HH12 ARG A 355 16.293 -4.767 0.574 1.00 1.43 H new ATOM 0 HH21 ARG A 355 15.953 -1.268 0.198 1.00 2.08 H new ATOM 0 HH22 ARG A 355 16.857 -2.706 -0.288 1.00 2.08 H new ATOM 438 N TRP A 356 10.070 -0.328 4.727 1.00 0.10 N ATOM 439 CA TRP A 356 10.418 1.079 4.747 1.00 0.09 C ATOM 440 C TRP A 356 11.849 1.270 4.260 1.00 0.09 C ATOM 441 O TRP A 356 12.773 0.616 4.750 1.00 0.14 O ATOM 442 CB TRP A 356 10.333 1.650 6.158 1.00 0.10 C ATOM 443 CG TRP A 356 8.953 1.815 6.712 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.467 1.266 7.864 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.895 2.613 6.170 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.177 1.683 8.076 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.803 2.505 7.050 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.762 3.407 5.029 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.604 3.166 6.830 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.568 4.063 4.808 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.502 3.942 5.705 1.00 0.13 C ATOM 0 H TRP A 356 9.953 -0.747 5.650 1.00 0.10 H new ATOM 0 HA TRP A 356 9.712 1.596 4.097 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.897 1.000 6.827 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.826 2.622 6.167 1.00 0.10 H new ATOM 0 HD1 TRP A 356 9.017 0.601 8.513 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.592 1.422 8.870 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.580 3.506 4.331 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.779 3.073 7.521 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.455 4.679 3.928 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.581 4.470 5.507 1.00 0.13 H new ATOM 462 N GLU A 357 12.026 2.156 3.300 1.00 0.10 N ATOM 463 CA GLU A 357 13.354 2.608 2.923 1.00 0.12 C ATOM 464 C GLU A 357 13.688 3.824 3.765 1.00 0.14 C ATOM 465 O GLU A 357 14.765 3.929 4.354 1.00 0.21 O ATOM 466 CB GLU A 357 13.408 2.957 1.439 1.00 0.16 C ATOM 467 CG GLU A 357 13.203 1.761 0.527 1.00 0.25 C ATOM 468 CD GLU A 357 14.354 0.774 0.563 1.00 0.36 C ATOM 469 OE1 GLU A 357 14.603 0.185 1.635 1.00 0.61 O ATOM 470 OE2 GLU A 357 15.027 0.600 -0.468 1.00 0.78 O ATOM 0 H GLU A 357 11.267 2.579 2.765 1.00 0.10 H new ATOM 0 HA GLU A 357 14.080 1.814 3.097 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.645 3.704 1.222 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.373 3.413 1.216 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.285 1.248 0.813 1.00 0.25 H new ATOM 0 HG3 GLU A 357 13.067 2.112 -0.496 1.00 0.25 H new ATOM 477 N ASP A 358 12.714 4.715 3.849 1.00 0.14 N ATOM 478 CA ASP A 358 12.801 5.906 4.675 1.00 0.16 C ATOM 479 C ASP A 358 11.491 6.069 5.426 1.00 0.16 C ATOM 480 O ASP A 358 10.616 6.829 5.014 1.00 0.20 O ATOM 481 CB ASP A 358 13.073 7.152 3.825 1.00 0.20 C ATOM 482 CG ASP A 358 14.408 7.106 3.106 1.00 0.92 C ATOM 483 OD1 ASP A 358 15.432 7.468 3.723 1.00 1.46 O ATOM 484 OD2 ASP A 358 14.441 6.707 1.923 1.00 1.33 O ATOM 0 H ASP A 358 11.833 4.630 3.341 1.00 0.14 H new ATOM 0 HA ASP A 358 13.630 5.795 5.375 1.00 0.16 H new ATOM 0 HB2 ASP A 358 12.276 7.264 3.090 1.00 0.20 H new ATOM 0 HB3 ASP A 358 13.043 8.034 4.465 1.00 0.20 H new ATOM 489 N LYS A 359 11.368 5.329 6.519 1.00 0.15 N ATOM 490 CA LYS A 359 10.136 5.261 7.301 1.00 0.17 C ATOM 491 C LYS A 359 9.582 6.634 7.644 1.00 0.19 C ATOM 492 O LYS A 359 8.397 6.901 7.456 1.00 0.23 O ATOM 493 CB LYS A 359 10.392 4.489 8.589 1.00 0.23 C ATOM 494 CG LYS A 359 9.171 4.377 9.485 1.00 0.29 C ATOM 495 CD LYS A 359 9.361 3.305 10.540 1.00 0.38 C ATOM 496 CE LYS A 359 8.085 3.057 11.320 1.00 0.91 C ATOM 497 NZ LYS A 359 8.271 2.004 12.351 1.00 1.50 N ATOM 0 H LYS A 359 12.123 4.754 6.893 1.00 0.15 H new ATOM 0 HA LYS A 359 9.394 4.752 6.686 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.741 3.487 8.339 1.00 0.23 H new ATOM 0 HB3 LYS A 359 11.194 4.978 9.142 1.00 0.23 H new ATOM 0 HG2 LYS A 359 8.982 5.336 9.967 1.00 0.29 H new ATOM 0 HG3 LYS A 359 8.294 4.145 8.881 1.00 0.29 H new ATOM 0 HD2 LYS A 359 9.683 2.379 10.064 1.00 0.38 H new ATOM 0 HD3 LYS A 359 10.154 3.604 11.225 1.00 0.38 H new ATOM 0 HE2 LYS A 359 7.764 3.983 11.798 1.00 0.91 H new ATOM 0 HE3 LYS A 359 7.291 2.760 10.635 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 7.379 1.860 12.865 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 8.553 1.115 11.892 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 9.012 2.299 13.019 1.00 1.50 H new ATOM 511 N GLU A 360 10.443 7.497 8.142 1.00 0.21 N ATOM 512 CA GLU A 360 10.023 8.799 8.629 1.00 0.27 C ATOM 513 C GLU A 360 9.690 9.755 7.484 1.00 0.24 C ATOM 514 O GLU A 360 9.049 10.785 7.691 1.00 0.37 O ATOM 515 CB GLU A 360 11.097 9.361 9.544 1.00 0.41 C ATOM 516 CG GLU A 360 11.425 8.406 10.681 1.00 0.63 C ATOM 517 CD GLU A 360 12.445 8.956 11.647 1.00 1.75 C ATOM 518 OE1 GLU A 360 12.047 9.617 12.628 1.00 1.97 O ATOM 519 OE2 GLU A 360 13.655 8.744 11.419 1.00 2.67 O ATOM 0 H GLU A 360 11.445 7.321 8.221 1.00 0.21 H new ATOM 0 HA GLU A 360 9.102 8.682 9.200 1.00 0.27 H new ATOM 0 HB2 GLU A 360 11.999 9.561 8.966 1.00 0.41 H new ATOM 0 HB3 GLU A 360 10.763 10.314 9.954 1.00 0.41 H new ATOM 0 HG2 GLU A 360 10.510 8.171 11.224 1.00 0.63 H new ATOM 0 HG3 GLU A 360 11.797 7.470 10.264 1.00 0.63 H new ATOM 526 N SER A 361 10.102 9.399 6.276 1.00 0.19 N ATOM 527 CA SER A 361 9.725 10.147 5.091 1.00 0.21 C ATOM 528 C SER A 361 8.616 9.401 4.354 1.00 0.19 C ATOM 529 O SER A 361 8.222 9.769 3.244 1.00 0.24 O ATOM 530 CB SER A 361 10.947 10.335 4.191 1.00 0.26 C ATOM 531 OG SER A 361 12.033 10.871 4.932 1.00 0.31 O ATOM 0 H SER A 361 10.700 8.593 6.093 1.00 0.19 H new ATOM 0 HA SER A 361 9.354 11.132 5.376 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.234 9.379 3.754 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.699 11.002 3.365 1.00 0.26 H new ATOM 0 HG SER A 361 12.808 10.984 4.342 1.00 0.31 H new ATOM 537 N LYS A 362 8.121 8.351 5.017 1.00 0.15 N ATOM 538 CA LYS A 362 7.095 7.463 4.483 1.00 0.14 C ATOM 539 C LYS A 362 7.459 6.924 3.110 1.00 0.12 C ATOM 540 O LYS A 362 6.626 6.840 2.215 1.00 0.15 O ATOM 541 CB LYS A 362 5.728 8.141 4.464 1.00 0.20 C ATOM 542 CG LYS A 362 4.925 7.875 5.723 1.00 0.48 C ATOM 543 CD LYS A 362 5.600 8.465 6.945 1.00 0.48 C ATOM 544 CE LYS A 362 4.972 7.967 8.232 1.00 0.51 C ATOM 545 NZ LYS A 362 5.614 8.576 9.427 1.00 1.23 N ATOM 0 H LYS A 362 8.430 8.094 5.954 1.00 0.15 H new ATOM 0 HA LYS A 362 7.037 6.608 5.156 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.862 9.216 4.344 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.165 7.791 3.598 1.00 0.20 H new ATOM 0 HG2 LYS A 362 3.927 8.300 5.616 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.801 6.800 5.857 1.00 0.48 H new ATOM 0 HD2 LYS A 362 6.659 8.208 6.934 1.00 0.48 H new ATOM 0 HD3 LYS A 362 5.535 9.552 6.906 1.00 0.48 H new ATOM 0 HE2 LYS A 362 3.907 8.200 8.232 1.00 0.51 H new ATOM 0 HE3 LYS A 362 5.060 6.882 8.284 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 5.159 8.212 10.289 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 6.625 8.332 9.440 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 5.508 9.610 9.389 1.00 1.23 H new ATOM 559 N ILE A 363 8.707 6.537 2.964 1.00 0.09 N ATOM 560 CA ILE A 363 9.178 5.929 1.740 1.00 0.09 C ATOM 561 C ILE A 363 9.374 4.444 1.958 1.00 0.08 C ATOM 562 O ILE A 363 10.105 4.041 2.861 1.00 0.10 O ATOM 563 CB ILE A 363 10.508 6.549 1.280 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.309 8.027 0.946 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.056 5.781 0.083 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.588 8.832 0.943 1.00 0.46 C ATOM 0 H ILE A 363 9.420 6.634 3.686 1.00 0.09 H new ATOM 0 HA ILE A 363 8.430 6.105 0.967 1.00 0.09 H new ATOM 0 HB ILE A 363 11.236 6.480 2.088 1.00 0.10 H new ATOM 0 HG12 ILE A 363 9.838 8.108 -0.034 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.619 8.463 1.668 1.00 0.16 H new ATOM 0 HG21 ILE A 363 11.998 6.228 -0.236 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.224 4.741 0.364 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.339 5.824 -0.736 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.364 9.870 0.698 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.050 8.784 1.929 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.273 8.423 0.200 1.00 0.46 H new ATOM 578 N PHE A 364 8.738 3.634 1.139 1.00 0.09 N ATOM 579 CA PHE A 364 8.855 2.203 1.278 1.00 0.09 C ATOM 580 C PHE A 364 9.191 1.592 -0.063 1.00 0.10 C ATOM 581 O PHE A 364 8.956 2.184 -1.117 1.00 0.13 O ATOM 582 CB PHE A 364 7.569 1.575 1.843 1.00 0.09 C ATOM 583 CG PHE A 364 6.419 1.504 0.882 1.00 0.08 C ATOM 584 CD1 PHE A 364 6.386 0.540 -0.116 1.00 0.12 C ATOM 585 CD2 PHE A 364 5.362 2.382 0.998 1.00 0.13 C ATOM 586 CE1 PHE A 364 5.314 0.464 -0.983 1.00 0.12 C ATOM 587 CE2 PHE A 364 4.287 2.314 0.133 1.00 0.14 C ATOM 588 CZ PHE A 364 4.263 1.354 -0.858 1.00 0.08 C ATOM 0 H PHE A 364 8.138 3.942 0.374 1.00 0.09 H new ATOM 0 HA PHE A 364 9.655 1.996 1.988 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.797 0.566 2.188 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.257 2.147 2.717 1.00 0.09 H new ATOM 0 HD1 PHE A 364 7.206 -0.156 -0.215 1.00 0.12 H new ATOM 0 HD2 PHE A 364 5.375 3.132 1.775 1.00 0.13 H new ATOM 0 HE1 PHE A 364 5.296 -0.289 -1.757 1.00 0.12 H new ATOM 0 HE2 PHE A 364 3.467 3.010 0.232 1.00 0.14 H new ATOM 0 HZ PHE A 364 3.424 1.298 -1.536 1.00 0.08 H new ATOM 598 N ARG A 365 9.756 0.421 -0.009 1.00 0.10 N ATOM 599 CA ARG A 365 10.029 -0.353 -1.182 1.00 0.12 C ATOM 600 C ARG A 365 9.260 -1.657 -1.115 1.00 0.11 C ATOM 601 O ARG A 365 9.198 -2.281 -0.056 1.00 0.18 O ATOM 602 CB ARG A 365 11.510 -0.653 -1.230 1.00 0.17 C ATOM 603 CG ARG A 365 11.899 -1.534 -2.381 1.00 0.17 C ATOM 604 CD ARG A 365 12.640 -0.751 -3.435 1.00 0.31 C ATOM 605 NE ARG A 365 13.913 -0.244 -2.908 1.00 0.77 N ATOM 606 CZ ARG A 365 14.991 0.034 -3.634 1.00 0.63 C ATOM 607 NH1 ARG A 365 14.974 -0.103 -4.950 1.00 1.48 N ATOM 608 NH2 ARG A 365 16.083 0.482 -3.029 1.00 0.99 N ATOM 0 H ARG A 365 10.043 -0.027 0.861 1.00 0.10 H new ATOM 0 HA ARG A 365 9.728 0.201 -2.071 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.062 0.285 -1.296 1.00 0.17 H new ATOM 0 HB3 ARG A 365 11.807 -1.133 -0.297 1.00 0.17 H new ATOM 0 HG2 ARG A 365 12.525 -2.351 -2.023 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.007 -1.984 -2.817 1.00 0.17 H new ATOM 0 HD2 ARG A 365 12.827 -1.385 -4.302 1.00 0.31 H new ATOM 0 HD3 ARG A 365 12.025 0.082 -3.776 1.00 0.31 H new ATOM 0 HE ARG A 365 13.975 -0.093 -1.901 1.00 0.77 H new ATOM 0 HH11 ARG A 365 14.127 -0.425 -5.418 1.00 1.48 H new ATOM 0 HH12 ARG A 365 15.808 0.114 -5.496 1.00 1.48 H new ATOM 0 HH21 ARG A 365 16.089 0.610 -2.017 1.00 0.99 H new ATOM 0 HH22 ARG A 365 16.916 0.699 -3.576 1.00 0.99 H new ATOM 622 N ILE A 366 8.672 -2.072 -2.219 1.00 0.07 N ATOM 623 CA ILE A 366 8.095 -3.382 -2.281 1.00 0.06 C ATOM 624 C ILE A 366 9.200 -4.350 -2.626 1.00 0.07 C ATOM 625 O ILE A 366 9.776 -4.314 -3.708 1.00 0.10 O ATOM 626 CB ILE A 366 6.928 -3.458 -3.276 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.711 -2.769 -2.659 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.619 -4.907 -3.639 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.617 -2.473 -3.643 1.00 0.09 C ATOM 0 H ILE A 366 8.586 -1.521 -3.073 1.00 0.07 H new ATOM 0 HA ILE A 366 7.661 -3.641 -1.315 1.00 0.06 H new ATOM 0 HB ILE A 366 7.199 -2.947 -4.200 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.312 -3.400 -1.865 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.030 -1.836 -2.194 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.789 -4.936 -4.345 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.498 -5.364 -4.094 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.349 -5.458 -2.738 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.789 -1.984 -3.130 1.00 0.09 H new ATOM 0 HD12 ILE A 366 4.998 -1.816 -4.424 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.268 -3.404 -4.090 1.00 0.09 H new ATOM 641 N VAL A 367 9.533 -5.159 -1.661 1.00 0.07 N ATOM 642 CA VAL A 367 10.703 -6.006 -1.749 1.00 0.08 C ATOM 643 C VAL A 367 10.402 -7.267 -2.543 1.00 0.09 C ATOM 644 O VAL A 367 11.174 -7.671 -3.419 1.00 0.12 O ATOM 645 CB VAL A 367 11.205 -6.334 -0.342 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.382 -7.280 -0.386 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.570 -5.044 0.372 1.00 0.10 C ATOM 0 H VAL A 367 9.008 -5.255 -0.792 1.00 0.07 H new ATOM 0 HA VAL A 367 11.491 -5.473 -2.282 1.00 0.08 H new ATOM 0 HB VAL A 367 10.410 -6.837 0.209 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.715 -7.493 0.630 1.00 0.12 H new ATOM 0 HG12 VAL A 367 12.084 -8.209 -0.873 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.197 -6.821 -0.946 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.928 -5.273 1.376 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.353 -4.529 -0.185 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.691 -4.403 0.438 1.00 0.10 H new ATOM 657 N ASP A 368 9.267 -7.867 -2.254 1.00 0.08 N ATOM 658 CA ASP A 368 8.778 -8.983 -3.035 1.00 0.09 C ATOM 659 C ASP A 368 7.284 -8.827 -3.239 1.00 0.08 C ATOM 660 O ASP A 368 6.474 -9.245 -2.416 1.00 0.09 O ATOM 661 CB ASP A 368 9.102 -10.317 -2.380 1.00 0.12 C ATOM 662 CG ASP A 368 8.889 -11.486 -3.319 1.00 0.22 C ATOM 663 OD1 ASP A 368 7.727 -11.779 -3.667 1.00 0.45 O ATOM 664 OD2 ASP A 368 9.888 -12.107 -3.733 1.00 0.78 O ATOM 0 H ASP A 368 8.662 -7.598 -1.478 1.00 0.08 H new ATOM 0 HA ASP A 368 9.281 -8.980 -4.002 1.00 0.09 H new ATOM 0 HB2 ASP A 368 10.138 -10.310 -2.041 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.478 -10.446 -1.496 1.00 0.12 H new ATOM 669 N PRO A 369 6.931 -8.180 -4.342 1.00 0.09 N ATOM 670 CA PRO A 369 5.552 -7.840 -4.692 1.00 0.10 C ATOM 671 C PRO A 369 4.655 -9.057 -4.812 1.00 0.12 C ATOM 672 O PRO A 369 3.466 -8.985 -4.523 1.00 0.14 O ATOM 673 CB PRO A 369 5.694 -7.137 -6.047 1.00 0.12 C ATOM 674 CG PRO A 369 7.031 -7.532 -6.553 1.00 0.12 C ATOM 675 CD PRO A 369 7.881 -7.718 -5.345 1.00 0.10 C ATOM 0 HA PRO A 369 5.080 -7.228 -3.923 1.00 0.10 H new ATOM 0 HB2 PRO A 369 4.906 -7.445 -6.735 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.618 -6.055 -5.939 1.00 0.12 H new ATOM 0 HG2 PRO A 369 6.973 -8.451 -7.136 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.444 -6.765 -7.208 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.672 -8.447 -5.517 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.364 -6.788 -5.045 1.00 0.10 H new ATOM 683 N ASN A 370 5.230 -10.169 -5.226 1.00 0.13 N ATOM 684 CA ASN A 370 4.485 -11.412 -5.337 1.00 0.17 C ATOM 685 C ASN A 370 4.113 -11.894 -3.949 1.00 0.17 C ATOM 686 O ASN A 370 2.974 -12.280 -3.683 1.00 0.21 O ATOM 687 CB ASN A 370 5.337 -12.457 -6.040 1.00 0.21 C ATOM 688 CG ASN A 370 4.501 -13.489 -6.774 1.00 0.36 C ATOM 689 OD1 ASN A 370 4.123 -13.286 -7.930 1.00 0.62 O ATOM 690 ND2 ASN A 370 4.213 -14.603 -6.119 1.00 0.59 N ATOM 0 H ASN A 370 6.212 -10.239 -5.492 1.00 0.13 H new ATOM 0 HA ASN A 370 3.578 -11.247 -5.918 1.00 0.17 H new ATOM 0 HB2 ASN A 370 6.002 -11.963 -6.748 1.00 0.21 H new ATOM 0 HB3 ASN A 370 5.968 -12.960 -5.307 1.00 0.21 H new ATOM 0 HD21 ASN A 370 3.660 -15.331 -6.570 1.00 0.59 H new ATOM 0 HD22 ASN A 370 4.545 -14.733 -5.163 1.00 0.59 H new ATOM 697 N GLY A 371 5.097 -11.836 -3.065 1.00 0.16 N ATOM 698 CA GLY A 371 4.884 -12.173 -1.677 1.00 0.19 C ATOM 699 C GLY A 371 3.919 -11.220 -1.010 1.00 0.13 C ATOM 700 O GLY A 371 3.132 -11.612 -0.151 1.00 0.13 O ATOM 0 H GLY A 371 6.052 -11.557 -3.291 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.499 -13.190 -1.605 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.837 -12.155 -1.148 1.00 0.19 H new ATOM 704 N LEU A 372 3.976 -9.965 -1.430 1.00 0.10 N ATOM 705 CA LEU A 372 3.193 -8.907 -0.814 1.00 0.08 C ATOM 706 C LEU A 372 1.748 -9.019 -1.273 1.00 0.11 C ATOM 707 O LEU A 372 0.808 -8.848 -0.501 1.00 0.13 O ATOM 708 CB LEU A 372 3.776 -7.542 -1.203 1.00 0.08 C ATOM 709 CG LEU A 372 3.529 -6.403 -0.211 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.084 -5.936 -0.240 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.896 -6.852 1.186 1.00 0.09 C ATOM 0 H LEU A 372 4.563 -9.653 -2.203 1.00 0.10 H new ATOM 0 HA LEU A 372 3.228 -9.004 0.271 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.852 -7.653 -1.338 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.361 -7.253 -2.169 1.00 0.08 H new ATOM 0 HG LEU A 372 4.157 -5.562 -0.505 1.00 0.08 H new ATOM 0 HD11 LEU A 372 1.949 -5.127 0.478 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.837 -5.579 -1.240 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.428 -6.766 0.021 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.718 -6.038 1.888 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.285 -7.711 1.464 1.00 0.09 H new ATOM 0 HD23 LEU A 372 4.949 -7.132 1.213 1.00 0.09 H new ATOM 723 N ALA A 373 1.596 -9.321 -2.549 1.00 0.12 N ATOM 724 CA ALA A 373 0.296 -9.486 -3.160 1.00 0.15 C ATOM 725 C ALA A 373 -0.450 -10.641 -2.520 1.00 0.14 C ATOM 726 O ALA A 373 -1.652 -10.552 -2.275 1.00 0.16 O ATOM 727 CB ALA A 373 0.463 -9.719 -4.644 1.00 0.20 C ATOM 0 H ALA A 373 2.376 -9.459 -3.191 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.289 -8.580 -3.005 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.517 -9.844 -5.105 1.00 0.20 H new ATOM 0 HB2 ALA A 373 0.969 -8.864 -5.092 1.00 0.20 H new ATOM 0 HB3 ALA A 373 1.057 -10.618 -4.807 1.00 0.20 H new ATOM 733 N ARG A 374 0.279 -11.717 -2.229 1.00 0.14 N ATOM 734 CA ARG A 374 -0.300 -12.879 -1.578 1.00 0.17 C ATOM 735 C ARG A 374 -0.951 -12.458 -0.264 1.00 0.14 C ATOM 736 O ARG A 374 -1.990 -12.982 0.118 1.00 0.16 O ATOM 737 CB ARG A 374 0.777 -13.947 -1.347 1.00 0.24 C ATOM 738 CG ARG A 374 1.090 -14.206 0.109 1.00 0.28 C ATOM 739 CD ARG A 374 2.084 -15.342 0.274 1.00 0.47 C ATOM 740 NE ARG A 374 1.550 -16.621 -0.198 1.00 1.44 N ATOM 741 CZ ARG A 374 2.303 -17.688 -0.478 1.00 2.04 C ATOM 742 NH1 ARG A 374 3.618 -17.648 -0.282 1.00 2.01 N ATOM 743 NH2 ARG A 374 1.742 -18.802 -0.934 1.00 3.03 N ATOM 0 H ARG A 374 1.274 -11.803 -2.437 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.067 -13.312 -2.220 1.00 0.17 H new ATOM 0 HB2 ARG A 374 0.453 -14.880 -1.809 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.692 -13.641 -1.855 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.493 -13.300 0.562 1.00 0.28 H new ATOM 0 HG3 ARG A 374 0.170 -14.446 0.642 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.996 -15.107 -0.275 1.00 0.47 H new ATOM 0 HD3 ARG A 374 2.359 -15.431 1.325 1.00 0.47 H new ATOM 0 HE ARG A 374 0.541 -16.702 -0.321 1.00 1.44 H new ATOM 0 HH11 ARG A 374 4.054 -16.801 0.083 1.00 2.01 H new ATOM 0 HH12 ARG A 374 4.191 -18.464 -0.497 1.00 2.01 H new ATOM 0 HH21 ARG A 374 0.732 -18.845 -1.072 1.00 3.03 H new ATOM 0 HH22 ARG A 374 2.321 -19.614 -1.147 1.00 3.03 H new ATOM 757 N LEU A 375 -0.334 -11.484 0.394 1.00 0.13 N ATOM 758 CA LEU A 375 -0.869 -10.902 1.620 1.00 0.15 C ATOM 759 C LEU A 375 -2.180 -10.187 1.321 1.00 0.16 C ATOM 760 O LEU A 375 -3.166 -10.359 2.026 1.00 0.18 O ATOM 761 CB LEU A 375 0.134 -9.895 2.203 1.00 0.17 C ATOM 762 CG LEU A 375 1.237 -10.433 3.122 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.720 -11.800 2.694 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.403 -9.467 3.119 1.00 0.15 C ATOM 0 H LEU A 375 0.551 -11.075 0.093 1.00 0.13 H new ATOM 0 HA LEU A 375 -1.043 -11.700 2.342 1.00 0.15 H new ATOM 0 HB2 LEU A 375 0.614 -9.380 1.370 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.429 -9.146 2.759 1.00 0.17 H new ATOM 0 HG LEU A 375 0.818 -10.529 4.124 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.501 -12.140 3.375 1.00 0.29 H new ATOM 0 HD12 LEU A 375 0.888 -12.503 2.717 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.120 -11.744 1.682 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.190 -9.845 3.771 1.00 0.15 H new ATOM 0 HD22 LEU A 375 2.789 -9.366 2.105 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.070 -8.494 3.479 1.00 0.15 H new ATOM 776 N TRP A 376 -2.176 -9.396 0.253 1.00 0.16 N ATOM 777 CA TRP A 376 -3.347 -8.614 -0.147 1.00 0.18 C ATOM 778 C TRP A 376 -4.523 -9.530 -0.472 1.00 0.20 C ATOM 779 O TRP A 376 -5.658 -9.262 -0.083 1.00 0.25 O ATOM 780 CB TRP A 376 -2.991 -7.756 -1.364 1.00 0.19 C ATOM 781 CG TRP A 376 -3.972 -6.659 -1.700 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.412 -6.318 -2.949 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.631 -5.761 -0.793 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.251 -5.233 -2.880 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.413 -4.882 -1.571 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.630 -5.603 0.594 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.179 -3.863 -1.008 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.397 -4.593 1.146 1.00 0.22 C ATOM 789 CH2 TRP A 376 -6.159 -3.739 0.345 1.00 0.24 C ATOM 0 H TRP A 376 -1.368 -9.277 -0.358 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.642 -7.968 0.680 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -2.013 -7.305 -1.194 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.894 -8.410 -2.231 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -4.139 -6.829 -3.860 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.683 -4.766 -3.677 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -4.043 -6.256 1.223 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.766 -3.197 -1.623 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.407 -4.462 2.218 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.746 -2.962 0.812 1.00 0.24 H new ATOM 800 N GLY A 377 -4.245 -10.611 -1.189 1.00 0.21 N ATOM 801 CA GLY A 377 -5.282 -11.568 -1.515 1.00 0.27 C ATOM 802 C GLY A 377 -5.695 -12.388 -0.316 1.00 0.30 C ATOM 803 O GLY A 377 -6.870 -12.689 -0.139 1.00 0.38 O ATOM 0 H GLY A 377 -3.319 -10.841 -1.550 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.150 -11.041 -1.910 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -4.927 -12.232 -2.303 1.00 0.27 H new ATOM 807 N ASN A 378 -4.719 -12.747 0.503 1.00 0.27 N ATOM 808 CA ASN A 378 -4.968 -13.460 1.746 1.00 0.30 C ATOM 809 C ASN A 378 -5.839 -12.628 2.675 1.00 0.30 C ATOM 810 O ASN A 378 -6.768 -13.135 3.309 1.00 0.35 O ATOM 811 CB ASN A 378 -3.648 -13.798 2.415 1.00 0.32 C ATOM 812 CG ASN A 378 -3.248 -15.236 2.170 1.00 0.38 C ATOM 813 OD1 ASN A 378 -4.095 -16.119 2.021 1.00 0.76 O ATOM 814 ND2 ASN A 378 -1.956 -15.477 2.128 1.00 0.42 N ATOM 0 H ASN A 378 -3.734 -12.553 0.325 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.500 -14.385 1.522 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.869 -13.135 2.039 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.728 -13.620 3.487 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.619 -16.426 1.967 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -1.291 -14.715 2.257 1.00 0.42 H new ATOM 821 N HIS A 379 -5.532 -11.343 2.728 1.00 0.28 N ATOM 822 CA HIS A 379 -6.270 -10.391 3.538 1.00 0.30 C ATOM 823 C HIS A 379 -7.678 -10.182 2.984 1.00 0.32 C ATOM 824 O HIS A 379 -8.652 -10.186 3.735 1.00 0.38 O ATOM 825 CB HIS A 379 -5.495 -9.064 3.588 1.00 0.28 C ATOM 826 CG HIS A 379 -6.212 -7.927 4.248 1.00 0.32 C ATOM 827 ND1 HIS A 379 -6.229 -7.781 5.611 1.00 0.43 N ATOM 828 CD2 HIS A 379 -6.884 -6.898 3.683 1.00 0.31 C ATOM 829 CE1 HIS A 379 -6.903 -6.669 5.844 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.324 -6.100 4.704 1.00 0.38 N ATOM 0 H HIS A 379 -4.759 -10.929 2.207 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.373 -10.783 4.550 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.554 -9.232 4.112 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.244 -8.771 2.569 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.043 -6.737 2.627 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -7.092 -6.268 6.829 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -7.866 -5.241 4.616 1.00 0.38 H new ATOM 838 N LYS A 380 -7.789 -10.026 1.667 1.00 0.32 N ATOM 839 CA LYS A 380 -9.074 -9.718 1.055 1.00 0.36 C ATOM 840 C LYS A 380 -9.886 -10.964 0.711 1.00 0.41 C ATOM 841 O LYS A 380 -10.996 -10.865 0.192 1.00 0.45 O ATOM 842 CB LYS A 380 -8.898 -8.861 -0.182 1.00 0.36 C ATOM 843 CG LYS A 380 -8.477 -7.457 0.172 1.00 0.38 C ATOM 844 CD LYS A 380 -8.612 -6.513 -0.999 1.00 0.63 C ATOM 845 CE LYS A 380 -7.819 -6.966 -2.214 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.229 -6.205 -3.427 1.00 0.77 N ATOM 0 H LYS A 380 -7.012 -10.107 1.011 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.637 -9.161 1.804 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.151 -9.312 -0.835 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -9.833 -8.831 -0.741 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -9.084 -7.095 1.001 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -7.442 -7.464 0.514 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -9.664 -6.425 -1.270 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -8.275 -5.520 -0.700 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -6.754 -6.823 -2.032 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -7.974 -8.032 -2.378 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -8.446 -6.870 -4.197 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -9.073 -5.637 -3.212 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -7.454 -5.577 -3.721 1.00 0.77 H new ATOM 943 N THR A 386 -3.502 -10.545 -7.553 1.00 0.23 N ATOM 944 CA THR A 386 -2.156 -10.468 -8.084 1.00 0.24 C ATOM 945 C THR A 386 -1.483 -9.211 -7.554 1.00 0.16 C ATOM 946 O THR A 386 -2.118 -8.428 -6.841 1.00 0.18 O ATOM 947 CB THR A 386 -2.138 -10.430 -9.626 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.690 -9.196 -10.093 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.933 -11.583 -10.211 1.00 0.44 C ATOM 0 HA THR A 386 -1.623 -11.364 -7.764 1.00 0.24 H new ATOM 0 HB THR A 386 -1.101 -10.518 -9.950 1.00 0.33 H new ATOM 0 HG1 THR A 386 -3.098 -9.333 -10.973 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.903 -11.531 -11.299 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.501 -12.528 -9.881 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.967 -11.520 -9.873 1.00 0.44 H new ATOM 957 N TYR A 387 -0.222 -8.998 -7.901 1.00 0.16 N ATOM 958 CA TYR A 387 0.432 -7.742 -7.560 1.00 0.13 C ATOM 959 C TYR A 387 -0.153 -6.633 -8.422 1.00 0.14 C ATOM 960 O TYR A 387 -0.197 -5.475 -8.016 1.00 0.17 O ATOM 961 CB TYR A 387 1.950 -7.806 -7.743 1.00 0.15 C ATOM 962 CG TYR A 387 2.570 -6.460 -7.497 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.463 -5.862 -6.250 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.198 -5.755 -8.514 1.00 0.14 C ATOM 965 CE1 TYR A 387 2.965 -4.613 -6.022 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.699 -4.491 -8.294 1.00 0.14 C ATOM 967 CZ TYR A 387 3.581 -3.922 -7.043 1.00 0.12 C ATOM 968 OH TYR A 387 4.070 -2.656 -6.820 1.00 0.13 O ATOM 0 H TYR A 387 0.360 -9.664 -8.409 1.00 0.16 H new ATOM 0 HA TYR A 387 0.250 -7.541 -6.504 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.374 -8.539 -7.056 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.186 -8.142 -8.753 1.00 0.15 H new ATOM 0 HD1 TYR A 387 1.975 -6.393 -5.446 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.295 -6.204 -9.492 1.00 0.14 H new ATOM 0 HE1 TYR A 387 2.879 -4.167 -5.042 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.181 -3.950 -9.095 1.00 0.14 H new ATOM 0 HH TYR A 387 4.474 -2.312 -7.644 1.00 0.13 H new ATOM 978 N GLU A 388 -0.626 -7.001 -9.603 1.00 0.17 N ATOM 979 CA GLU A 388 -1.286 -6.055 -10.484 1.00 0.24 C ATOM 980 C GLU A 388 -2.526 -5.481 -9.806 1.00 0.25 C ATOM 981 O GLU A 388 -2.794 -4.288 -9.899 1.00 0.31 O ATOM 982 CB GLU A 388 -1.655 -6.708 -11.806 1.00 0.30 C ATOM 983 CG GLU A 388 -2.191 -5.713 -12.813 1.00 0.44 C ATOM 984 CD GLU A 388 -1.191 -4.624 -13.143 1.00 1.53 C ATOM 985 OE1 GLU A 388 -0.165 -4.922 -13.786 1.00 1.96 O ATOM 986 OE2 GLU A 388 -1.429 -3.460 -12.761 1.00 2.21 O ATOM 0 H GLU A 388 -0.564 -7.950 -9.972 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.592 -5.241 -10.694 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -0.777 -7.203 -12.221 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.403 -7.481 -11.630 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -2.465 -6.239 -13.728 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -3.101 -5.259 -12.421 1.00 0.44 H new ATOM 993 N LYS A 389 -3.270 -6.332 -9.110 1.00 0.23 N ATOM 994 CA LYS A 389 -4.410 -5.871 -8.327 1.00 0.28 C ATOM 995 C LYS A 389 -3.965 -4.860 -7.271 1.00 0.28 C ATOM 996 O LYS A 389 -4.714 -3.950 -6.913 1.00 0.40 O ATOM 997 CB LYS A 389 -5.136 -7.049 -7.666 1.00 0.32 C ATOM 998 CG LYS A 389 -6.124 -7.759 -8.583 1.00 0.45 C ATOM 999 CD LYS A 389 -5.442 -8.436 -9.756 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.433 -8.838 -10.841 1.00 0.46 C ATOM 1001 NZ LYS A 389 -7.431 -9.833 -10.368 1.00 1.39 N ATOM 0 H LYS A 389 -3.106 -7.338 -9.071 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.107 -5.380 -9.006 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.396 -7.770 -7.318 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.668 -6.688 -6.786 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.677 -8.503 -8.010 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.851 -7.038 -8.956 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -4.696 -7.763 -10.179 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.911 -9.321 -9.405 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -6.954 -7.950 -11.199 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -5.888 -9.252 -11.690 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -8.080 -10.071 -11.145 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -6.940 -10.693 -10.051 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -7.973 -9.432 -9.576 1.00 1.39 H new ATOM 1015 N MET A 390 -2.744 -5.024 -6.778 1.00 0.19 N ATOM 1016 CA MET A 390 -2.176 -4.097 -5.810 1.00 0.17 C ATOM 1017 C MET A 390 -1.723 -2.803 -6.484 1.00 0.16 C ATOM 1018 O MET A 390 -1.985 -1.710 -5.983 1.00 0.17 O ATOM 1019 CB MET A 390 -0.991 -4.731 -5.083 1.00 0.15 C ATOM 1020 CG MET A 390 -0.406 -3.824 -4.016 1.00 0.14 C ATOM 1021 SD MET A 390 1.041 -4.521 -3.210 1.00 0.18 S ATOM 1022 CE MET A 390 1.495 -3.158 -2.142 1.00 1.57 C ATOM 0 H MET A 390 -2.126 -5.794 -7.035 1.00 0.19 H new ATOM 0 HA MET A 390 -2.958 -3.862 -5.087 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.310 -5.667 -4.624 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.216 -4.980 -5.808 1.00 0.15 H new ATOM 0 HG2 MET A 390 -0.138 -2.869 -4.467 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.169 -3.619 -3.265 1.00 0.14 H new ATOM 0 HE1 MET A 390 2.481 -3.343 -1.715 1.00 1.57 H new ATOM 0 HE2 MET A 390 1.518 -2.234 -2.720 1.00 1.57 H new ATOM 0 HE3 MET A 390 0.763 -3.065 -1.339 1.00 1.57 H new ATOM 1032 N SER A 391 -1.036 -2.927 -7.620 1.00 0.15 N ATOM 1033 CA SER A 391 -0.498 -1.768 -8.320 1.00 0.17 C ATOM 1034 C SER A 391 -1.606 -0.824 -8.775 1.00 0.19 C ATOM 1035 O SER A 391 -1.426 0.387 -8.772 1.00 0.21 O ATOM 1036 CB SER A 391 0.377 -2.205 -9.502 1.00 0.23 C ATOM 1037 OG SER A 391 -0.202 -3.290 -10.205 1.00 1.02 O ATOM 0 H SER A 391 -0.841 -3.820 -8.072 1.00 0.15 H new ATOM 0 HA SER A 391 0.129 -1.218 -7.618 1.00 0.17 H new ATOM 0 HB2 SER A 391 0.519 -1.364 -10.181 1.00 0.23 H new ATOM 0 HB3 SER A 391 1.364 -2.491 -9.139 1.00 0.23 H new ATOM 0 HG SER A 391 -0.534 -2.978 -11.073 1.00 1.02 H new ATOM 1043 N ARG A 392 -2.754 -1.381 -9.141 1.00 0.21 N ATOM 1044 CA ARG A 392 -3.920 -0.574 -9.505 1.00 0.26 C ATOM 1045 C ARG A 392 -4.307 0.337 -8.361 1.00 0.22 C ATOM 1046 O ARG A 392 -4.439 1.551 -8.527 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.094 -1.471 -9.834 1.00 0.38 C ATOM 1048 CG ARG A 392 -4.784 -2.433 -10.941 1.00 1.12 C ATOM 1049 CD ARG A 392 -4.635 -1.711 -12.267 1.00 2.05 C ATOM 1050 NE ARG A 392 -3.899 -2.503 -13.247 1.00 2.61 N ATOM 1051 CZ ARG A 392 -4.189 -2.533 -14.542 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -5.212 -1.830 -15.011 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -3.454 -3.261 -15.373 1.00 4.06 N ATOM 0 H ARG A 392 -2.906 -2.388 -9.195 1.00 0.21 H new ATOM 0 HA ARG A 392 -3.660 0.026 -10.377 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.384 -2.028 -8.943 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -5.949 -0.857 -10.118 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -3.865 -2.972 -10.712 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -5.579 -3.175 -11.015 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -5.623 -1.474 -12.662 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -4.120 -0.764 -12.107 1.00 2.05 H new ATOM 0 HE ARG A 392 -3.115 -3.067 -12.917 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -5.777 -1.266 -14.376 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -5.434 -1.854 -16.006 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -2.664 -3.799 -15.017 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -3.679 -3.282 -16.368 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.481 -0.276 -7.203 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.765 0.461 -5.980 1.00 0.17 C ATOM 1069 C ALA A 393 -3.729 1.564 -5.766 1.00 0.12 C ATOM 1070 O ALA A 393 -4.076 2.684 -5.404 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.802 -0.483 -4.786 1.00 0.20 C ATOM 0 H ALA A 393 -4.431 -1.288 -7.082 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.745 0.928 -6.077 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -5.015 0.084 -3.880 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.580 -1.231 -4.938 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.837 -0.979 -4.684 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.463 1.261 -6.051 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.395 2.242 -5.901 1.00 0.10 C ATOM 1079 C LEU A 394 -1.583 3.375 -6.892 1.00 0.11 C ATOM 1080 O LEU A 394 -1.550 4.545 -6.525 1.00 0.12 O ATOM 1081 CB LEU A 394 -0.033 1.581 -6.125 1.00 0.11 C ATOM 1082 CG LEU A 394 0.349 0.537 -5.085 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.549 -0.271 -5.544 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.645 1.222 -3.772 1.00 0.13 C ATOM 0 H LEU A 394 -2.155 0.348 -6.385 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.433 2.644 -4.888 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.030 1.111 -7.109 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.733 2.356 -6.140 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.486 -0.152 -4.953 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.802 -1.010 -4.784 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.310 -0.779 -6.478 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.398 0.395 -5.700 1.00 0.13 H new ATOM 0 HD21 LEU A 394 0.919 0.476 -3.026 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.470 1.922 -3.905 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.240 1.763 -3.436 1.00 0.13 H new ATOM 1096 N ARG A 395 -1.806 3.007 -8.141 1.00 0.12 N ATOM 1097 CA ARG A 395 -2.009 3.966 -9.217 1.00 0.14 C ATOM 1098 C ARG A 395 -3.156 4.914 -8.894 1.00 0.14 C ATOM 1099 O ARG A 395 -3.139 6.082 -9.277 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.295 3.222 -10.516 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.153 2.322 -10.957 1.00 0.33 C ATOM 1102 CD ARG A 395 -0.101 3.089 -11.745 1.00 0.52 C ATOM 1103 NE ARG A 395 -0.658 3.717 -12.946 1.00 1.30 N ATOM 1104 CZ ARG A 395 0.042 4.478 -13.790 1.00 1.72 C ATOM 1105 NH1 ARG A 395 1.342 4.670 -13.603 1.00 1.66 N ATOM 1106 NH2 ARG A 395 -0.553 5.029 -14.843 1.00 2.64 N ATOM 0 H ARG A 395 -1.852 2.033 -8.440 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.102 4.560 -9.329 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.195 2.620 -10.391 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.502 3.947 -11.304 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -0.691 1.866 -10.082 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.546 1.510 -11.569 1.00 0.33 H new ATOM 0 HD2 ARG A 395 0.341 3.855 -11.108 1.00 0.52 H new ATOM 0 HD3 ARG A 395 0.703 2.410 -12.031 1.00 0.52 H new ATOM 0 HE ARG A 395 -1.645 3.562 -13.150 1.00 1.30 H new ATOM 0 HH11 ARG A 395 1.813 4.235 -12.810 1.00 1.66 H new ATOM 0 HH12 ARG A 395 1.870 5.253 -14.252 1.00 1.66 H new ATOM 0 HH21 ARG A 395 -1.547 4.871 -15.008 1.00 2.64 H new ATOM 0 HH22 ARG A 395 -0.016 5.610 -15.486 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.153 4.411 -8.182 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.281 5.229 -7.778 1.00 0.13 C ATOM 1122 C HIS A 396 -4.886 6.140 -6.619 1.00 0.11 C ATOM 1123 O HIS A 396 -5.299 7.299 -6.556 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.473 4.350 -7.408 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.788 4.977 -7.744 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -8.001 5.558 -8.971 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -8.912 5.095 -6.998 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.240 6.014 -8.943 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -9.831 5.758 -7.769 1.00 0.26 N ATOM 0 H HIS A 396 -4.202 3.440 -7.873 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.577 5.859 -8.617 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.389 3.395 -7.928 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.441 4.135 -6.340 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.056 4.736 -5.990 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.717 6.529 -9.764 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.783 6.008 -7.500 1.00 0.26 H new ATOM 1137 N TYR A 397 -4.043 5.618 -5.736 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.566 6.360 -4.571 1.00 0.10 C ATOM 1139 C TYR A 397 -2.776 7.595 -4.975 1.00 0.09 C ATOM 1140 O TYR A 397 -2.781 8.596 -4.264 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.701 5.461 -3.681 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.487 4.365 -3.020 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.862 4.460 -2.925 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.865 3.240 -2.503 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.607 3.471 -2.339 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -3.608 2.237 -1.908 1.00 0.24 C ATOM 1147 CZ TYR A 397 -4.983 2.360 -1.831 1.00 0.24 C ATOM 1148 OH TYR A 397 -5.730 1.379 -1.230 1.00 0.30 O ATOM 0 H TYR A 397 -3.671 4.671 -5.805 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.443 6.687 -4.013 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -1.906 5.020 -4.282 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -2.221 6.070 -2.915 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.360 5.333 -3.321 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.791 3.146 -2.565 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.681 3.566 -2.277 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -3.117 1.363 -1.506 1.00 0.24 H new ATOM 0 HH TYR A 397 -5.977 0.703 -1.895 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.101 7.525 -6.111 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.266 8.632 -6.559 1.00 0.12 C ATOM 1160 C TYR A 398 -2.118 9.866 -6.828 1.00 0.14 C ATOM 1161 O TYR A 398 -1.811 10.965 -6.358 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.498 8.273 -7.834 1.00 0.14 C ATOM 1163 CG TYR A 398 0.268 6.962 -7.793 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.731 6.408 -6.600 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.523 6.276 -8.971 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.422 5.213 -6.591 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.211 5.086 -8.969 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.656 4.557 -7.780 1.00 0.14 C ATOM 1169 OH TYR A 398 2.336 3.366 -7.782 1.00 0.18 O ATOM 0 H TYR A 398 -2.113 6.720 -6.737 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.551 8.841 -5.763 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.204 8.234 -8.663 1.00 0.14 H new ATOM 0 HB3 TYR A 398 0.205 9.077 -8.051 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.546 6.922 -5.668 1.00 0.11 H new ATOM 0 HD2 TYR A 398 0.174 6.685 -9.908 1.00 0.15 H new ATOM 0 HE1 TYR A 398 1.776 4.796 -5.660 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.401 4.568 -9.898 1.00 0.16 H new ATOM 0 HH TYR A 398 3.025 3.382 -7.086 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.192 9.681 -7.586 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.091 10.781 -7.906 1.00 0.19 C ATOM 1181 C LYS A 399 -4.756 11.314 -6.653 1.00 0.19 C ATOM 1182 O LYS A 399 -4.921 12.518 -6.479 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.171 10.354 -8.882 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.668 10.110 -10.296 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.491 8.631 -10.570 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.808 7.891 -10.405 1.00 0.32 C ATOM 1187 NZ LYS A 399 -5.679 6.439 -10.691 1.00 0.71 N ATOM 0 H LYS A 399 -3.460 8.783 -7.989 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.484 11.561 -8.365 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.640 9.442 -8.512 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -5.944 11.122 -8.910 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.372 10.533 -11.013 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -3.718 10.625 -10.440 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -4.112 8.487 -11.582 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.748 8.217 -9.889 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -6.174 8.027 -9.387 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.552 8.326 -11.072 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -6.380 5.912 -10.132 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -5.844 6.269 -11.704 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -4.723 6.119 -10.437 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.121 10.402 -5.773 1.00 0.17 N ATOM 1202 CA LEU A 400 -5.853 10.750 -4.575 1.00 0.18 C ATOM 1203 C LEU A 400 -4.917 11.213 -3.469 1.00 0.18 C ATOM 1204 O LEU A 400 -5.279 11.215 -2.298 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.692 9.556 -4.149 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.552 8.988 -5.277 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.274 7.739 -4.826 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.536 10.034 -5.771 1.00 0.21 C ATOM 0 H LEU A 400 -4.919 9.407 -5.869 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.516 11.590 -4.783 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -6.033 8.773 -3.774 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.338 9.851 -3.322 1.00 0.18 H new ATOM 0 HG LEU A 400 -6.897 8.716 -6.105 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.880 7.353 -5.646 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.545 6.985 -4.527 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -8.918 7.977 -3.980 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -9.141 9.614 -6.574 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.185 10.340 -4.950 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -7.990 10.900 -6.144 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.711 11.608 -3.866 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.770 12.283 -2.970 1.00 0.20 C ATOM 1222 C ASN A 401 -2.351 11.404 -1.797 1.00 0.17 C ATOM 1223 O ASN A 401 -2.182 11.886 -0.676 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.385 13.575 -2.440 1.00 0.27 C ATOM 1225 CG ASN A 401 -3.355 14.713 -3.433 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -3.129 15.863 -3.066 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -3.620 14.414 -4.682 1.00 1.21 N ATOM 0 H ASN A 401 -3.357 11.471 -4.813 1.00 0.18 H new ATOM 0 HA ASN A 401 -1.877 12.504 -3.555 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.418 13.383 -2.151 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -2.853 13.877 -1.538 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -3.644 15.149 -5.388 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -3.802 13.446 -4.947 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.181 10.123 -2.061 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.883 9.157 -1.024 1.00 0.10 C ATOM 1236 C ILE A 402 -0.457 8.657 -1.115 1.00 0.09 C ATOM 1237 O ILE A 402 0.365 8.937 -0.247 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.858 7.989 -1.166 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.264 8.524 -0.994 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.579 6.881 -0.165 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.304 7.589 -1.500 1.00 0.13 C ATOM 0 H ILE A 402 -2.246 9.724 -2.998 1.00 0.11 H new ATOM 0 HA ILE A 402 -1.993 9.636 -0.051 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.736 7.546 -2.154 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.445 8.724 0.062 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.352 9.476 -1.518 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.298 6.074 -0.306 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.570 6.499 -0.317 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.669 7.274 0.848 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.291 8.027 -1.350 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.145 7.409 -2.563 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.239 6.645 -0.958 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.171 7.916 -2.164 1.00 0.07 N ATOM 1254 CA ILE A 403 1.160 7.405 -2.389 1.00 0.07 C ATOM 1255 C ILE A 403 1.655 7.924 -3.726 1.00 0.08 C ATOM 1256 O ILE A 403 0.868 8.412 -4.528 1.00 0.10 O ATOM 1257 CB ILE A 403 1.191 5.856 -2.388 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.508 5.285 -1.152 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.620 5.341 -2.458 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.548 3.775 -1.117 1.00 0.11 C ATOM 0 H ILE A 403 -0.850 7.654 -2.879 1.00 0.07 H new ATOM 0 HA ILE A 403 1.804 7.745 -1.578 1.00 0.07 H new ATOM 0 HB ILE A 403 0.646 5.525 -3.272 1.00 0.09 H new ATOM 0 HG12 ILE A 403 0.992 5.679 -0.258 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.529 5.619 -1.127 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.614 4.251 -2.456 1.00 0.14 H new ATOM 0 HG22 ILE A 403 3.092 5.700 -3.373 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.180 5.703 -1.595 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.048 3.419 -0.216 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.040 3.377 -1.996 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.585 3.438 -1.114 1.00 0.11 H new ATOM 1272 N ARG A 404 2.948 7.863 -3.946 1.00 0.10 N ATOM 1273 CA ARG A 404 3.514 8.220 -5.231 1.00 0.13 C ATOM 1274 C ARG A 404 4.461 7.130 -5.694 1.00 0.14 C ATOM 1275 O ARG A 404 4.822 6.238 -4.927 1.00 0.16 O ATOM 1276 CB ARG A 404 4.257 9.545 -5.134 1.00 0.17 C ATOM 1277 CG ARG A 404 5.677 9.392 -4.668 1.00 0.25 C ATOM 1278 CD ARG A 404 6.383 10.721 -4.637 1.00 0.36 C ATOM 1279 NE ARG A 404 6.627 11.256 -5.978 1.00 1.14 N ATOM 1280 CZ ARG A 404 7.838 11.383 -6.519 1.00 1.56 C ATOM 1281 NH1 ARG A 404 8.888 10.811 -5.941 1.00 1.63 N ATOM 1282 NH2 ARG A 404 7.995 12.020 -7.674 1.00 2.39 N ATOM 0 H ARG A 404 3.632 7.568 -3.250 1.00 0.10 H new ATOM 0 HA ARG A 404 2.705 8.326 -5.954 1.00 0.13 H new ATOM 0 HB2 ARG A 404 4.252 10.030 -6.110 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.725 10.204 -4.448 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.691 8.946 -3.673 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.209 8.709 -5.331 1.00 0.25 H new ATOM 0 HD2 ARG A 404 5.786 11.433 -4.068 1.00 0.36 H new ATOM 0 HD3 ARG A 404 7.333 10.612 -4.114 1.00 0.36 H new ATOM 0 HE ARG A 404 5.822 11.549 -6.531 1.00 1.14 H new ATOM 0 HH11 ARG A 404 8.768 10.274 -5.082 1.00 1.63 H new ATOM 0 HH12 ARG A 404 9.815 10.909 -6.356 1.00 1.63 H new ATOM 0 HH21 ARG A 404 7.186 12.416 -8.152 1.00 2.39 H new ATOM 0 HH22 ARG A 404 8.925 12.114 -8.083 1.00 2.39 H new ATOM 1296 N LYS A 405 4.867 7.221 -6.937 1.00 0.17 N ATOM 1297 CA LYS A 405 5.777 6.265 -7.519 1.00 0.19 C ATOM 1298 C LYS A 405 7.055 6.985 -7.889 1.00 0.22 C ATOM 1299 O LYS A 405 7.018 8.042 -8.524 1.00 0.27 O ATOM 1300 CB LYS A 405 5.153 5.643 -8.760 1.00 0.22 C ATOM 1301 CG LYS A 405 5.419 4.154 -8.911 1.00 0.34 C ATOM 1302 CD LYS A 405 6.865 3.797 -8.690 1.00 0.29 C ATOM 1303 CE LYS A 405 7.127 2.344 -8.997 1.00 0.23 C ATOM 1304 NZ LYS A 405 6.855 2.014 -10.423 1.00 1.08 N ATOM 0 H LYS A 405 4.575 7.962 -7.575 1.00 0.17 H new ATOM 0 HA LYS A 405 5.990 5.470 -6.804 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.076 5.807 -8.733 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.532 6.160 -9.642 1.00 0.22 H new ATOM 0 HG2 LYS A 405 4.801 3.605 -8.201 1.00 0.34 H new ATOM 0 HG3 LYS A 405 5.119 3.835 -9.909 1.00 0.34 H new ATOM 0 HD2 LYS A 405 7.496 4.423 -9.321 1.00 0.29 H new ATOM 0 HD3 LYS A 405 7.139 4.007 -7.656 1.00 0.29 H new ATOM 0 HE2 LYS A 405 8.164 2.106 -8.762 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.504 1.721 -8.356 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 7.654 1.474 -10.813 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 5.987 1.444 -10.488 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 6.734 2.893 -10.966 1.00 1.08 H new ATOM 1318 N GLU A 406 8.176 6.420 -7.499 1.00 0.23 N ATOM 1319 CA GLU A 406 9.446 7.074 -7.684 1.00 0.28 C ATOM 1320 C GLU A 406 9.927 6.938 -9.118 1.00 0.34 C ATOM 1321 O GLU A 406 9.726 5.910 -9.770 1.00 0.43 O ATOM 1322 CB GLU A 406 10.481 6.493 -6.745 1.00 0.29 C ATOM 1323 CG GLU A 406 10.085 6.531 -5.283 1.00 0.63 C ATOM 1324 CD GLU A 406 10.059 7.939 -4.721 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.148 8.499 -4.471 1.00 2.42 O ATOM 1326 OE2 GLU A 406 8.959 8.498 -4.539 1.00 2.32 O ATOM 0 H GLU A 406 8.231 5.506 -7.050 1.00 0.23 H new ATOM 0 HA GLU A 406 9.310 8.132 -7.461 1.00 0.28 H new ATOM 0 HB2 GLU A 406 10.674 5.459 -7.031 1.00 0.29 H new ATOM 0 HB3 GLU A 406 11.416 7.039 -6.871 1.00 0.29 H new ATOM 0 HG2 GLU A 406 9.100 6.079 -5.166 1.00 0.63 H new ATOM 0 HG3 GLU A 406 10.784 5.926 -4.705 1.00 0.63 H new ATOM 1333 N PRO A 407 10.574 7.991 -9.607 1.00 0.41 N ATOM 1334 CA PRO A 407 11.090 8.054 -10.961 1.00 0.51 C ATOM 1335 C PRO A 407 12.265 7.104 -11.159 1.00 0.52 C ATOM 1336 O PRO A 407 13.332 7.296 -10.573 1.00 0.54 O ATOM 1337 CB PRO A 407 11.524 9.508 -11.142 1.00 0.61 C ATOM 1338 CG PRO A 407 11.521 10.137 -9.790 1.00 0.58 C ATOM 1339 CD PRO A 407 10.895 9.174 -8.819 1.00 0.45 C ATOM 0 HA PRO A 407 10.342 7.750 -11.694 1.00 0.51 H new ATOM 0 HB2 PRO A 407 12.516 9.561 -11.589 1.00 0.61 H new ATOM 0 HB3 PRO A 407 10.844 10.033 -11.813 1.00 0.61 H new ATOM 0 HG2 PRO A 407 12.538 10.378 -9.482 1.00 0.58 H new ATOM 0 HG3 PRO A 407 10.963 11.073 -9.809 1.00 0.58 H new ATOM 0 HD2 PRO A 407 11.581 8.932 -8.007 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.000 9.599 -8.364 1.00 0.45 H new ATOM 1347 N GLY A 408 12.061 6.074 -11.968 1.00 0.54 N ATOM 1348 CA GLY A 408 13.117 5.118 -12.222 1.00 0.58 C ATOM 1349 C GLY A 408 13.066 3.943 -11.271 1.00 0.58 C ATOM 1350 O GLY A 408 13.723 2.924 -11.493 1.00 0.86 O ATOM 0 H GLY A 408 11.184 5.884 -12.452 1.00 0.54 H new ATOM 0 HA2 GLY A 408 13.039 4.757 -13.247 1.00 0.58 H new ATOM 0 HA3 GLY A 408 14.083 5.614 -12.132 1.00 0.58 H new ATOM 1354 N GLN A 409 12.281 4.078 -10.211 1.00 0.47 N ATOM 1355 CA GLN A 409 12.158 3.022 -9.221 1.00 0.51 C ATOM 1356 C GLN A 409 11.136 1.990 -9.640 1.00 0.48 C ATOM 1357 O GLN A 409 10.118 2.298 -10.260 1.00 0.61 O ATOM 1358 CB GLN A 409 11.780 3.576 -7.856 1.00 0.63 C ATOM 1359 CG GLN A 409 12.973 3.975 -7.006 1.00 0.45 C ATOM 1360 CD GLN A 409 13.744 2.769 -6.503 1.00 0.71 C ATOM 1361 OE1 GLN A 409 13.808 1.731 -7.167 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.273 2.869 -5.296 1.00 0.45 N ATOM 0 H GLN A 409 11.721 4.908 -10.016 1.00 0.47 H new ATOM 0 HA GLN A 409 13.136 2.546 -9.150 1.00 0.51 H new ATOM 0 HB2 GLN A 409 11.136 4.445 -7.992 1.00 0.63 H new ATOM 0 HB3 GLN A 409 11.197 2.828 -7.319 1.00 0.63 H new ATOM 0 HG2 GLN A 409 13.637 4.612 -7.590 1.00 0.45 H new ATOM 0 HG3 GLN A 409 12.631 4.566 -6.157 1.00 0.45 H new ATOM 0 HE21 GLN A 409 14.199 3.745 -4.778 1.00 0.45 H new ATOM 0 HE22 GLN A 409 14.755 2.071 -4.883 1.00 0.45 H new ATOM 1371 N ARG A 410 11.428 0.759 -9.270 1.00 0.41 N ATOM 1372 CA ARG A 410 10.585 -0.380 -9.591 1.00 0.39 C ATOM 1373 C ARG A 410 9.413 -0.495 -8.648 1.00 0.31 C ATOM 1374 O ARG A 410 8.257 -0.426 -9.050 1.00 0.42 O ATOM 1375 CB ARG A 410 11.416 -1.664 -9.527 1.00 0.47 C ATOM 1376 CG ARG A 410 12.325 -1.713 -8.306 1.00 0.86 C ATOM 1377 CD ARG A 410 12.708 -3.127 -7.922 1.00 1.11 C ATOM 1378 NE ARG A 410 13.469 -3.150 -6.671 1.00 1.27 N ATOM 1379 CZ ARG A 410 13.577 -4.219 -5.883 1.00 2.04 C ATOM 1380 NH1 ARG A 410 12.926 -5.335 -6.177 1.00 2.65 N ATOM 1381 NH2 ARG A 410 14.344 -4.183 -4.800 1.00 2.43 N ATOM 0 H ARG A 410 12.262 0.517 -8.735 1.00 0.41 H new ATOM 0 HA ARG A 410 10.193 -0.231 -10.597 1.00 0.39 H new ATOM 0 HB2 ARG A 410 10.747 -2.525 -9.512 1.00 0.47 H new ATOM 0 HB3 ARG A 410 12.021 -1.746 -10.430 1.00 0.47 H new ATOM 0 HG2 ARG A 410 13.229 -1.138 -8.507 1.00 0.86 H new ATOM 0 HG3 ARG A 410 11.823 -1.235 -7.465 1.00 0.86 H new ATOM 0 HD2 ARG A 410 11.809 -3.733 -7.814 1.00 1.11 H new ATOM 0 HD3 ARG A 410 13.301 -3.575 -8.719 1.00 1.11 H new ATOM 0 HE ARG A 410 13.946 -2.295 -6.385 1.00 1.27 H new ATOM 0 HH11 ARG A 410 12.339 -5.379 -7.010 1.00 2.65 H new ATOM 0 HH12 ARG A 410 13.012 -6.151 -5.570 1.00 2.65 H new ATOM 0 HH21 ARG A 410 14.856 -3.333 -4.566 1.00 2.43 H new ATOM 0 HH22 ARG A 410 14.421 -5.006 -4.202 1.00 2.43 H new ATOM 1395 N LEU A 411 9.729 -0.683 -7.398 1.00 0.21 N ATOM 1396 CA LEU A 411 8.736 -0.940 -6.391 1.00 0.14 C ATOM 1397 C LEU A 411 8.913 0.020 -5.248 1.00 0.11 C ATOM 1398 O LEU A 411 8.611 -0.287 -4.105 1.00 0.12 O ATOM 1399 CB LEU A 411 8.866 -2.380 -5.925 1.00 0.11 C ATOM 1400 CG LEU A 411 8.565 -3.408 -7.008 1.00 0.11 C ATOM 1401 CD1 LEU A 411 9.060 -4.778 -6.608 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.080 -3.436 -7.277 1.00 0.16 C ATOM 0 H LEU A 411 10.686 -0.662 -7.046 1.00 0.21 H new ATOM 0 HA LEU A 411 7.737 -0.794 -6.801 1.00 0.14 H new ATOM 0 HB2 LEU A 411 9.878 -2.542 -5.555 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.190 -2.542 -5.085 1.00 0.11 H new ATOM 0 HG LEU A 411 9.089 -3.122 -7.920 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.832 -5.492 -7.399 1.00 0.15 H new ATOM 0 HD12 LEU A 411 10.138 -4.743 -6.450 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.568 -5.088 -5.686 1.00 0.15 H new ATOM 0 HD21 LEU A 411 6.864 -4.172 -8.052 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.550 -3.705 -6.364 1.00 0.16 H new ATOM 0 HD23 LEU A 411 6.752 -2.451 -7.610 1.00 0.16 H new ATOM 1414 N LEU A 412 9.431 1.183 -5.564 1.00 0.13 N ATOM 1415 CA LEU A 412 9.590 2.209 -4.553 1.00 0.11 C ATOM 1416 C LEU A 412 8.377 3.117 -4.568 1.00 0.10 C ATOM 1417 O LEU A 412 7.964 3.592 -5.629 1.00 0.11 O ATOM 1418 CB LEU A 412 10.841 3.028 -4.814 1.00 0.13 C ATOM 1419 CG LEU A 412 11.510 3.668 -3.594 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.540 4.503 -2.792 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.119 2.607 -2.714 1.00 0.16 C ATOM 0 H LEU A 412 9.747 1.444 -6.498 1.00 0.13 H new ATOM 0 HA LEU A 412 9.685 1.731 -3.578 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.572 2.386 -5.305 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.588 3.820 -5.519 1.00 0.13 H new ATOM 0 HG LEU A 412 12.294 4.329 -3.964 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.056 4.938 -1.936 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.141 5.300 -3.419 1.00 0.13 H new ATOM 0 HD13 LEU A 412 9.722 3.874 -2.441 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.591 3.077 -1.851 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.340 1.924 -2.375 1.00 0.16 H new ATOM 0 HD23 LEU A 412 12.867 2.051 -3.279 1.00 0.16 H new ATOM 1433 N PHE A 413 7.819 3.361 -3.397 1.00 0.10 N ATOM 1434 CA PHE A 413 6.646 4.191 -3.280 1.00 0.11 C ATOM 1435 C PHE A 413 6.747 5.044 -2.039 1.00 0.12 C ATOM 1436 O PHE A 413 6.990 4.544 -0.940 1.00 0.19 O ATOM 1437 CB PHE A 413 5.379 3.350 -3.230 1.00 0.12 C ATOM 1438 CG PHE A 413 5.258 2.425 -4.395 1.00 0.10 C ATOM 1439 CD1 PHE A 413 4.712 2.857 -5.585 1.00 0.10 C ATOM 1440 CD2 PHE A 413 5.731 1.136 -4.310 1.00 0.11 C ATOM 1441 CE1 PHE A 413 4.641 2.011 -6.669 1.00 0.11 C ATOM 1442 CE2 PHE A 413 5.671 0.287 -5.394 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.126 0.727 -6.577 1.00 0.11 C ATOM 0 H PHE A 413 8.165 2.992 -2.512 1.00 0.10 H new ATOM 0 HA PHE A 413 6.592 4.832 -4.160 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.369 2.770 -2.307 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.511 4.009 -3.202 1.00 0.12 H new ATOM 0 HD1 PHE A 413 4.337 3.867 -5.668 1.00 0.10 H new ATOM 0 HD2 PHE A 413 6.155 0.785 -3.381 1.00 0.11 H new ATOM 0 HE1 PHE A 413 4.203 2.356 -7.594 1.00 0.11 H new ATOM 0 HE2 PHE A 413 6.051 -0.721 -5.314 1.00 0.11 H new ATOM 0 HZ PHE A 413 5.079 0.067 -7.431 1.00 0.11 H new ATOM 1453 N ARG A 414 6.588 6.329 -2.222 1.00 0.10 N ATOM 1454 CA ARG A 414 6.616 7.250 -1.139 1.00 0.12 C ATOM 1455 C ARG A 414 5.216 7.716 -0.842 1.00 0.11 C ATOM 1456 O ARG A 414 4.464 8.088 -1.743 1.00 0.15 O ATOM 1457 CB ARG A 414 7.511 8.427 -1.472 1.00 0.20 C ATOM 1458 CG ARG A 414 7.268 9.599 -0.569 1.00 0.35 C ATOM 1459 CD ARG A 414 8.347 10.639 -0.669 1.00 0.37 C ATOM 1460 NE ARG A 414 8.143 11.698 0.308 1.00 1.21 N ATOM 1461 CZ ARG A 414 8.173 12.998 0.016 1.00 1.46 C ATOM 1462 NH1 ARG A 414 8.442 13.398 -1.223 1.00 1.06 N ATOM 1463 NH2 ARG A 414 7.951 13.898 0.963 1.00 2.58 N ATOM 0 H ARG A 414 6.435 6.758 -3.135 1.00 0.10 H new ATOM 0 HA ARG A 414 7.021 6.756 -0.256 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.554 8.121 -1.394 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.343 8.727 -2.506 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.308 10.052 -0.818 1.00 0.35 H new ATOM 0 HG3 ARG A 414 7.199 9.251 0.462 1.00 0.35 H new ATOM 0 HD2 ARG A 414 9.320 10.175 -0.510 1.00 0.37 H new ATOM 0 HD3 ARG A 414 8.357 11.063 -1.673 1.00 0.37 H new ATOM 0 HE ARG A 414 7.966 11.429 1.276 1.00 1.21 H new ATOM 0 HH11 ARG A 414 8.626 12.709 -1.953 1.00 1.06 H new ATOM 0 HH12 ARG A 414 8.464 14.394 -1.444 1.00 1.06 H new ATOM 0 HH21 ARG A 414 7.757 13.596 1.918 1.00 2.58 H new ATOM 0 HH22 ARG A 414 7.975 14.892 0.737 1.00 2.58 H new ATOM 1477 N PHE A 415 4.868 7.674 0.414 1.00 0.10 N ATOM 1478 CA PHE A 415 3.583 8.160 0.852 1.00 0.09 C ATOM 1479 C PHE A 415 3.553 9.676 0.744 1.00 0.11 C ATOM 1480 O PHE A 415 4.221 10.380 1.503 1.00 0.14 O ATOM 1481 CB PHE A 415 3.297 7.718 2.289 1.00 0.10 C ATOM 1482 CG PHE A 415 2.595 6.403 2.412 1.00 0.10 C ATOM 1483 CD1 PHE A 415 1.211 6.340 2.357 1.00 0.11 C ATOM 1484 CD2 PHE A 415 3.312 5.236 2.598 1.00 0.10 C ATOM 1485 CE1 PHE A 415 0.557 5.134 2.481 1.00 0.13 C ATOM 1486 CE2 PHE A 415 2.670 4.028 2.722 1.00 0.11 C ATOM 1487 CZ PHE A 415 1.290 3.972 2.661 1.00 0.12 C ATOM 0 H PHE A 415 5.459 7.306 1.160 1.00 0.10 H new ATOM 0 HA PHE A 415 2.807 7.739 0.213 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.241 7.663 2.832 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.693 8.483 2.776 1.00 0.10 H new ATOM 0 HD1 PHE A 415 0.640 7.246 2.216 1.00 0.11 H new ATOM 0 HD2 PHE A 415 4.390 5.274 2.646 1.00 0.10 H new ATOM 0 HE1 PHE A 415 -0.521 5.094 2.438 1.00 0.13 H new ATOM 0 HE2 PHE A 415 3.242 3.124 2.867 1.00 0.11 H new ATOM 0 HZ PHE A 415 0.783 3.023 2.754 1.00 0.12 H new ATOM 1497 N MET A 416 2.812 10.152 -0.247 1.00 0.11 N ATOM 1498 CA MET A 416 2.611 11.577 -0.479 1.00 0.15 C ATOM 1499 C MET A 416 2.132 12.267 0.790 1.00 0.17 C ATOM 1500 O MET A 416 2.483 13.417 1.061 1.00 0.23 O ATOM 1501 CB MET A 416 1.569 11.780 -1.577 1.00 0.15 C ATOM 1502 CG MET A 416 1.990 11.287 -2.943 1.00 0.24 C ATOM 1503 SD MET A 416 0.799 11.729 -4.225 1.00 1.41 S ATOM 1504 CE MET A 416 0.823 13.516 -4.109 1.00 1.47 C ATOM 0 H MET A 416 2.329 9.555 -0.919 1.00 0.11 H new ATOM 0 HA MET A 416 3.564 12.011 -0.783 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.651 11.268 -1.288 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.334 12.842 -1.645 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.964 11.707 -3.194 1.00 0.24 H new ATOM 0 HG3 MET A 416 2.107 10.204 -2.916 1.00 0.24 H new ATOM 0 HE1 MET A 416 0.503 13.947 -5.058 1.00 1.47 H new ATOM 0 HE2 MET A 416 0.146 13.838 -3.318 1.00 1.47 H new ATOM 0 HE3 MET A 416 1.834 13.852 -3.881 1.00 1.47 H new ATOM 1514 N LYS A 417 1.314 11.554 1.543 1.00 0.16 N ATOM 1515 CA LYS A 417 0.797 12.029 2.809 1.00 0.21 C ATOM 1516 C LYS A 417 0.798 10.891 3.802 1.00 0.21 C ATOM 1517 O LYS A 417 1.004 9.735 3.434 1.00 0.22 O ATOM 1518 CB LYS A 417 -0.632 12.548 2.652 1.00 0.29 C ATOM 1519 CG LYS A 417 -0.739 13.850 1.895 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.157 14.379 1.939 1.00 0.54 C ATOM 1521 CE LYS A 417 -2.274 15.731 1.248 1.00 0.84 C ATOM 1522 NZ LYS A 417 -1.819 15.678 -0.166 1.00 1.36 N ATOM 0 H LYS A 417 0.988 10.621 1.289 1.00 0.16 H new ATOM 0 HA LYS A 417 1.431 12.844 3.160 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.226 11.792 2.138 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.070 12.679 3.642 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.058 14.584 2.326 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -0.433 13.701 0.860 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -2.827 13.666 1.459 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -2.479 14.471 2.976 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -3.310 16.067 1.282 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -1.682 16.468 1.791 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -1.048 16.361 -0.308 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -1.478 14.720 -0.385 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -2.612 15.915 -0.795 1.00 1.36 H new ATOM 1536 N THR A 418 0.569 11.216 5.053 1.00 0.24 N ATOM 1537 CA THR A 418 0.386 10.198 6.057 1.00 0.24 C ATOM 1538 C THR A 418 -1.099 9.955 6.279 1.00 0.26 C ATOM 1539 O THR A 418 -1.913 10.829 5.982 1.00 0.28 O ATOM 1540 CB THR A 418 1.087 10.573 7.367 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.736 11.907 7.771 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.586 10.458 7.188 1.00 0.22 C ATOM 0 H THR A 418 0.505 12.174 5.397 1.00 0.24 H new ATOM 0 HA THR A 418 0.843 9.275 5.702 1.00 0.24 H new ATOM 0 HB THR A 418 0.761 9.887 8.149 1.00 0.26 H new ATOM 0 HG1 THR A 418 1.151 12.553 7.162 1.00 0.35 H new ATOM 0 HG21 THR A 418 3.085 10.725 8.120 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.843 9.433 6.919 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.911 11.133 6.396 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.471 8.768 6.786 1.00 0.25 N ATOM 1551 CA PRO A 419 -2.874 8.336 6.883 1.00 0.28 C ATOM 1552 C PRO A 419 -3.805 9.399 7.458 1.00 0.31 C ATOM 1553 O PRO A 419 -4.915 9.585 6.965 1.00 0.33 O ATOM 1554 CB PRO A 419 -2.787 7.121 7.801 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.450 6.551 7.493 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.552 7.738 7.307 1.00 0.25 C ATOM 0 HA PRO A 419 -3.304 8.128 5.903 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -2.871 7.404 8.850 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.585 6.406 7.598 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -1.097 5.913 8.303 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.481 5.936 6.594 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.090 8.046 8.245 1.00 0.25 H new ATOM 0 HD3 PRO A 419 0.257 7.527 6.607 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.335 10.112 8.473 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.126 11.167 9.109 1.00 0.42 C ATOM 1566 C ASP A 420 -4.484 12.253 8.098 1.00 0.43 C ATOM 1567 O ASP A 420 -5.617 12.733 8.052 1.00 0.48 O ATOM 1568 CB ASP A 420 -3.346 11.776 10.275 1.00 0.49 C ATOM 1569 CG ASP A 420 -4.130 12.845 11.013 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -4.135 14.008 10.557 1.00 0.72 O ATOM 1571 OD2 ASP A 420 -4.763 12.529 12.040 1.00 0.74 O ATOM 0 H ASP A 420 -2.408 9.981 8.877 1.00 0.35 H new ATOM 0 HA ASP A 420 -5.049 10.727 9.487 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -3.071 10.986 10.974 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -2.418 12.207 9.900 1.00 0.49 H new ATOM 1576 N GLU A 421 -3.507 12.619 7.280 1.00 0.42 N ATOM 1577 CA GLU A 421 -3.682 13.627 6.251 1.00 0.45 C ATOM 1578 C GLU A 421 -4.512 13.082 5.089 1.00 0.42 C ATOM 1579 O GLU A 421 -5.278 13.809 4.461 1.00 0.49 O ATOM 1580 CB GLU A 421 -2.312 14.055 5.737 1.00 0.49 C ATOM 1581 CG GLU A 421 -1.384 14.575 6.817 1.00 0.81 C ATOM 1582 CD GLU A 421 0.001 14.866 6.285 1.00 1.60 C ATOM 1583 OE1 GLU A 421 0.764 13.907 6.045 1.00 2.21 O ATOM 1584 OE2 GLU A 421 0.334 16.059 6.103 1.00 2.17 O ATOM 0 H GLU A 421 -2.568 12.222 7.314 1.00 0.42 H new ATOM 0 HA GLU A 421 -4.209 14.479 6.680 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -1.839 13.206 5.243 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -2.444 14.830 4.982 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -1.804 15.483 7.249 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -1.317 13.842 7.620 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.343 11.797 4.816 1.00 0.34 N ATOM 1592 CA ILE A 422 -4.983 11.147 3.675 1.00 0.33 C ATOM 1593 C ILE A 422 -6.482 10.948 3.898 1.00 0.36 C ATOM 1594 O ILE A 422 -7.277 10.950 2.952 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.325 9.779 3.404 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -2.837 9.951 3.096 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -5.027 9.068 2.270 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.124 8.650 2.803 1.00 0.27 C ATOM 0 H ILE A 422 -3.761 11.174 5.376 1.00 0.34 H new ATOM 0 HA ILE A 422 -4.850 11.803 2.814 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.420 9.167 4.301 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -2.727 10.617 2.240 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.353 10.438 3.943 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.549 8.105 2.093 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -6.074 8.911 2.531 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -4.966 9.675 1.367 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.073 8.850 2.594 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.203 7.990 3.667 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.582 8.171 1.937 1.00 0.27 H new ATOM 1610 N MET A 423 -6.859 10.795 5.155 1.00 0.42 N ATOM 1611 CA MET A 423 -8.241 10.536 5.536 1.00 0.51 C ATOM 1612 C MET A 423 -9.132 11.757 5.364 1.00 0.58 C ATOM 1613 O MET A 423 -10.276 11.779 5.809 1.00 0.71 O ATOM 1614 CB MET A 423 -8.289 10.037 6.965 1.00 0.58 C ATOM 1615 CG MET A 423 -7.768 8.631 7.089 1.00 0.58 C ATOM 1616 SD MET A 423 -8.207 7.854 8.657 1.00 0.90 S ATOM 1617 CE MET A 423 -7.371 8.945 9.807 1.00 2.01 C ATOM 0 H MET A 423 -6.215 10.847 5.945 1.00 0.42 H new ATOM 0 HA MET A 423 -8.631 9.770 4.866 1.00 0.51 H new ATOM 0 HB2 MET A 423 -7.700 10.699 7.600 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.316 10.076 7.328 1.00 0.58 H new ATOM 0 HG2 MET A 423 -8.161 8.030 6.269 1.00 0.58 H new ATOM 0 HG3 MET A 423 -6.683 8.641 6.986 1.00 0.58 H new ATOM 0 HE1 MET A 423 -7.515 8.581 10.824 1.00 2.01 H new ATOM 0 HE2 MET A 423 -6.306 8.969 9.577 1.00 2.01 H new ATOM 0 HE3 MET A 423 -7.783 9.950 9.720 1.00 2.01 H new ATOM 1627 N SER A 424 -8.589 12.768 4.723 1.00 0.59 N ATOM 1628 CA SER A 424 -9.316 14.004 4.460 1.00 0.72 C ATOM 1629 C SER A 424 -10.196 13.880 3.209 1.00 0.67 C ATOM 1630 O SER A 424 -10.332 14.828 2.431 1.00 1.09 O ATOM 1631 CB SER A 424 -8.330 15.161 4.295 1.00 0.92 C ATOM 1632 OG SER A 424 -7.362 14.863 3.303 1.00 1.57 O ATOM 0 H SER A 424 -7.633 12.763 4.367 1.00 0.59 H new ATOM 0 HA SER A 424 -9.969 14.201 5.310 1.00 0.72 H new ATOM 0 HB2 SER A 424 -8.870 16.068 4.022 1.00 0.92 H new ATOM 0 HB3 SER A 424 -7.834 15.360 5.245 1.00 0.92 H new ATOM 0 HG SER A 424 -6.472 14.837 3.712 1.00 1.57 H new ATOM 1638 N GLY A 425 -10.775 12.701 3.003 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.699 12.509 1.902 1.00 0.42 C ATOM 1640 C GLY A 425 -11.077 11.772 0.737 1.00 0.37 C ATOM 1641 O GLY A 425 -11.785 11.251 -0.127 1.00 0.50 O ATOM 0 H GLY A 425 -10.620 11.875 3.580 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.568 11.954 2.255 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -12.058 13.480 1.562 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.754 11.710 0.724 1.00 0.38 N ATOM 1646 CA ARG A 426 -9.021 11.134 -0.391 1.00 0.36 C ATOM 1647 C ARG A 426 -9.228 9.620 -0.489 1.00 0.33 C ATOM 1648 O ARG A 426 -9.634 9.112 -1.533 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.539 11.495 -0.259 1.00 0.39 C ATOM 1650 CG ARG A 426 -7.304 12.980 -0.286 1.00 0.56 C ATOM 1651 CD ARG A 426 -7.407 13.493 -1.702 1.00 0.92 C ATOM 1652 NE ARG A 426 -7.317 14.951 -1.785 1.00 1.37 N ATOM 1653 CZ ARG A 426 -7.274 15.626 -2.935 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -7.267 14.973 -4.091 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -7.247 16.953 -2.931 1.00 2.67 N ATOM 0 H ARG A 426 -9.163 12.055 1.480 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.407 11.554 -1.320 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -7.150 11.086 0.673 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -6.981 11.027 -1.070 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -8.035 13.484 0.346 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -6.319 13.208 0.122 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -6.613 13.050 -2.303 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -8.353 13.167 -2.134 1.00 0.92 H new ATOM 0 HE ARG A 426 -7.285 15.481 -0.914 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -7.295 13.953 -4.101 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -7.234 15.491 -4.969 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -7.259 17.461 -2.046 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -7.214 17.465 -3.813 1.00 2.67 H new ATOM 1669 N THR A 427 -8.981 8.904 0.599 1.00 0.33 N ATOM 1670 CA THR A 427 -9.119 7.448 0.595 1.00 0.37 C ATOM 1671 C THR A 427 -10.403 7.005 1.283 1.00 0.43 C ATOM 1672 O THR A 427 -10.671 5.810 1.419 1.00 0.58 O ATOM 1673 CB THR A 427 -7.895 6.770 1.242 1.00 0.63 C ATOM 1674 OG1 THR A 427 -8.022 5.351 1.210 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.699 7.218 2.672 1.00 0.41 C ATOM 0 H THR A 427 -8.686 9.301 1.491 1.00 0.33 H new ATOM 0 HA THR A 427 -9.173 7.132 -0.447 1.00 0.37 H new ATOM 0 HB THR A 427 -7.024 7.070 0.659 1.00 0.63 H new ATOM 0 HG1 THR A 427 -8.939 5.099 1.448 1.00 1.24 H new ATOM 0 HG21 THR A 427 -6.827 6.718 3.094 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.547 8.297 2.698 1.00 0.41 H new ATOM 0 HG23 THR A 427 -8.582 6.962 3.258 1.00 0.41 H new ATOM 1683 N ASP A 428 -11.204 7.975 1.687 1.00 0.45 N ATOM 1684 CA ASP A 428 -12.520 7.703 2.254 1.00 0.62 C ATOM 1685 C ASP A 428 -13.374 6.966 1.237 1.00 0.61 C ATOM 1686 O ASP A 428 -14.126 6.053 1.575 1.00 0.78 O ATOM 1687 CB ASP A 428 -13.213 9.006 2.643 1.00 0.74 C ATOM 1688 CG ASP A 428 -12.486 9.766 3.730 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -11.252 9.918 3.625 1.00 1.63 O ATOM 1690 OD2 ASP A 428 -13.141 10.208 4.695 1.00 1.75 O ATOM 0 H ASP A 428 -10.967 8.966 1.634 1.00 0.45 H new ATOM 0 HA ASP A 428 -12.394 7.088 3.145 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -13.301 9.641 1.761 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -14.226 8.785 2.979 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.237 7.377 -0.018 1.00 0.54 N ATOM 1696 CA ARG A 429 -13.949 6.753 -1.123 1.00 0.65 C ATOM 1697 C ARG A 429 -13.336 5.402 -1.419 1.00 0.55 C ATOM 1698 O ARG A 429 -14.033 4.418 -1.615 1.00 0.66 O ATOM 1699 CB ARG A 429 -13.877 7.647 -2.364 1.00 0.81 C ATOM 1700 CG ARG A 429 -13.956 9.125 -2.032 1.00 0.98 C ATOM 1701 CD ARG A 429 -13.875 10.001 -3.274 1.00 1.12 C ATOM 1702 NE ARG A 429 -15.130 10.019 -4.023 1.00 1.64 N ATOM 1703 CZ ARG A 429 -15.282 10.606 -5.211 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -14.251 11.186 -5.812 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -16.473 10.615 -5.796 1.00 3.05 N ATOM 0 H ARG A 429 -12.631 8.149 -0.296 1.00 0.54 H new ATOM 0 HA ARG A 429 -14.996 6.620 -0.849 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -12.946 7.448 -2.895 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -14.692 7.388 -3.040 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -14.890 9.328 -1.507 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -13.145 9.386 -1.352 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -13.614 11.018 -2.982 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -13.074 9.639 -3.919 1.00 1.12 H new ATOM 0 HE ARG A 429 -15.939 9.554 -3.612 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -13.334 11.185 -5.366 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -14.376 11.633 -6.720 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -17.270 10.174 -5.337 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -16.592 11.063 -6.704 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.017 5.377 -1.385 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.219 4.205 -1.730 1.00 0.36 C ATOM 1721 C LEU A 430 -11.618 2.956 -0.965 1.00 0.39 C ATOM 1722 O LEU A 430 -11.521 1.841 -1.476 1.00 0.45 O ATOM 1723 CB LEU A 430 -9.770 4.523 -1.464 1.00 0.31 C ATOM 1724 CG LEU A 430 -9.091 5.303 -2.559 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -7.856 5.916 -1.991 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -8.749 4.404 -3.734 1.00 0.56 C ATOM 0 H LEU A 430 -11.455 6.183 -1.112 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.393 3.985 -2.783 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -9.700 5.089 -0.535 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.228 3.590 -1.311 1.00 0.31 H new ATOM 0 HG LEU A 430 -9.760 6.079 -2.930 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -7.344 6.488 -2.765 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -8.124 6.579 -1.168 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.196 5.130 -1.624 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -8.260 4.991 -4.511 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.079 3.611 -3.402 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -9.663 3.964 -4.133 1.00 0.56 H new