USER MOD reduce.3.24.130724 H: found=0, std=0, add=872, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 872 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 432 HIS : no HD1:sc= -0.245 X(o=-0.48,f=-0.41) USER MOD Set 1.2: A 436 GLN : amide:sc= -0.232 K(o=-0.48,f=-2.2) USER MOD Set 2.1: A 370 ASN : amide:sc= 0.0104 K(o=0.042,f=-1.1) USER MOD Set 2.2: A 386 THR OG1 : rot -54:sc= 0.0311 USER MOD Single : A 340 TYR OH : rot 90:sc= -2.08! USER MOD Single : A 342 TYR OH : rot 180:sc= 0 USER MOD Single : A 343 GLN : amide:sc= -0.191 X(o=-0.19,f=-0.49) USER MOD Single : A 346 SER OG : rot -46:sc= 0.291 USER MOD Single : A 348 SER OG : rot 180:sc= 0.0879 USER MOD Single : A 350 TYR OH : rot 180:sc= 0 USER MOD Single : A 352 ASN : amide:sc= -0.795 K(o=-0.79,f=-0.13) 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+ -160:sc= 0.485 (180deg=-0.0762) USER MOD Single : A 378 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 379 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 380 LYS NZ :NH3+ 170:sc= 0.966 (180deg=0.49) USER MOD Single : A 381 ASN : amide:sc= 0.188 K(o=0.19,f=-0.51) USER MOD Single : A 387 TYR OH : rot -85:sc= -1.19 USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 390 MET CE :methyl -109:sc= -2.18 (180deg=-4.4!) USER MOD Single : A 391 SER OG : rot -45:sc= 0.635 USER MOD Single : A 396 HIS : no HD1:sc= -0.229 K(o=-0.23,f=-0.88) USER MOD Single : A 397 TYR OH : rot 50:sc= -2.36! USER MOD Single : A 398 TYR OH : rot 180:sc= 0 USER MOD Single : A 399 LYS NZ :NH3+ -168:sc=-0.00854 (180deg=-0.129) USER MOD Single : A 401 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 405 LYS NZ :NH3+ 162:sc= -0.269 (180deg=-0.294) USER MOD Single : A 409 GLN : amide:sc= -0.537 K(o=-0.54,f=-2.4) USER MOD Single : A 416 MET CE :methyl -118:sc= -0.0745 (180deg=-2.02!) USER MOD Single : A 417 LYS NZ :NH3+ 145:sc= 1.24 (180deg=1.09) USER MOD Single : A 418 THR OG1 : rot -63:sc= 0.852 USER MOD Single : A 423 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 424 SER OG : rot -30:sc= 0.319 USER MOD Single : A 427 THR OG1 : rot 102:sc= 0.995 USER MOD Single : A 435 SER OG : rot 180:sc= 0.144 USER MOD ----------------------------------------------------------------- ATOM 80 N LEU A 336 -1.450 7.522 -5.303 1.00 1.08 N ATOM 81 CA LEU A 336 -1.132 6.935 -4.005 1.00 0.60 C ATOM 82 C LEU A 336 -1.382 5.430 -3.970 1.00 0.50 C ATOM 83 O LEU A 336 -1.907 4.848 -4.920 1.00 0.62 O ATOM 84 CB LEU A 336 -1.915 7.631 -2.883 1.00 0.36 C ATOM 85 CG LEU A 336 -1.872 9.160 -2.927 1.00 0.30 C ATOM 86 CD1 LEU A 336 -2.609 9.764 -1.749 1.00 0.25 C ATOM 87 CD2 LEU A 336 -0.445 9.647 -2.950 1.00 0.39 C ATOM 0 HA LEU A 336 -0.065 7.091 -3.843 1.00 0.60 H new ATOM 0 HB2 LEU A 336 -2.955 7.309 -2.930 1.00 0.36 H new ATOM 0 HB3 LEU A 336 -1.521 7.297 -1.923 1.00 0.36 H new ATOM 0 HG LEU A 336 -2.371 9.481 -3.841 1.00 0.30 H new ATOM 0 HD11 LEU A 336 -2.561 10.851 -1.808 1.00 0.25 H new ATOM 0 HD12 LEU A 336 -3.651 9.445 -1.770 1.00 0.25 H new ATOM 0 HD13 LEU A 336 -2.146 9.430 -0.820 1.00 0.25 H new ATOM 0 HD21 LEU A 336 -0.433 10.736 -2.981 1.00 0.39 H new ATOM 0 HD22 LEU A 336 0.071 9.304 -2.053 1.00 0.39 H new ATOM 0 HD23 LEU A 336 0.060 9.253 -3.832 1.00 0.39 H new ATOM 99 N LEU A 337 -0.987 4.806 -2.869 1.00 0.39 N ATOM 100 CA LEU A 337 -1.143 3.368 -2.686 1.00 0.30 C ATOM 101 C LEU A 337 -2.607 2.942 -2.764 1.00 0.26 C ATOM 102 O LEU A 337 -2.947 2.014 -3.500 1.00 0.25 O ATOM 103 CB LEU A 337 -0.526 2.963 -1.341 1.00 0.32 C ATOM 104 CG LEU A 337 -0.991 1.630 -0.747 1.00 0.31 C ATOM 105 CD1 LEU A 337 -0.620 0.464 -1.642 1.00 0.24 C ATOM 106 CD2 LEU A 337 -0.392 1.448 0.635 1.00 0.39 C ATOM 0 H LEU A 337 -0.550 5.280 -2.079 1.00 0.39 H new ATOM 0 HA LEU A 337 -0.623 2.856 -3.495 1.00 0.30 H new ATOM 0 HB2 LEU A 337 0.557 2.923 -1.461 1.00 0.32 H new ATOM 0 HB3 LEU A 337 -0.738 3.751 -0.618 1.00 0.32 H new ATOM 0 HG LEU A 337 -2.078 1.652 -0.669 1.00 0.31 H new ATOM 0 HD11 LEU A 337 -0.965 -0.466 -1.190 1.00 0.24 H new ATOM 0 HD12 LEU A 337 -1.090 0.590 -2.617 1.00 0.24 H new ATOM 0 HD13 LEU A 337 0.463 0.429 -1.763 1.00 0.24 H new ATOM 0 HD21 LEU A 337 -0.725 0.499 1.054 1.00 0.39 H new ATOM 0 HD22 LEU A 337 0.696 1.451 0.563 1.00 0.39 H new ATOM 0 HD23 LEU A 337 -0.715 2.263 1.282 1.00 0.39 H new ATOM 118 N TRP A 338 -3.466 3.644 -2.034 1.00 0.25 N ATOM 119 CA TRP A 338 -4.859 3.237 -1.886 1.00 0.24 C ATOM 120 C TRP A 338 -5.603 3.171 -3.221 1.00 0.24 C ATOM 121 O TRP A 338 -6.575 2.432 -3.346 1.00 0.24 O ATOM 122 CB TRP A 338 -5.598 4.120 -0.871 1.00 0.24 C ATOM 123 CG TRP A 338 -5.388 5.602 -1.032 1.00 0.21 C ATOM 124 CD1 TRP A 338 -4.718 6.420 -0.173 1.00 0.20 C ATOM 125 CD2 TRP A 338 -5.863 6.448 -2.092 1.00 0.22 C ATOM 126 NE1 TRP A 338 -4.734 7.710 -0.634 1.00 0.17 N ATOM 127 CE2 TRP A 338 -5.429 7.753 -1.812 1.00 0.19 C ATOM 128 CE3 TRP A 338 -6.602 6.230 -3.254 1.00 0.28 C ATOM 129 CZ2 TRP A 338 -5.711 8.831 -2.648 1.00 0.22 C ATOM 130 CZ3 TRP A 338 -6.882 7.298 -4.079 1.00 0.31 C ATOM 131 CH2 TRP A 338 -6.436 8.583 -3.775 1.00 0.28 C ATOM 0 H TRP A 338 -3.222 4.499 -1.534 1.00 0.25 H new ATOM 0 HA TRP A 338 -4.843 2.220 -1.494 1.00 0.24 H new ATOM 0 HB2 TRP A 338 -6.665 3.911 -0.943 1.00 0.24 H new ATOM 0 HB3 TRP A 338 -5.284 3.832 0.132 1.00 0.24 H new ATOM 0 HD1 TRP A 338 -4.242 6.097 0.741 1.00 0.20 H new ATOM 0 HE1 TRP A 338 -4.298 8.509 -0.174 1.00 0.17 H new ATOM 0 HE3 TRP A 338 -6.950 5.239 -3.504 1.00 0.28 H new ATOM 0 HZ2 TRP A 338 -5.368 9.827 -2.412 1.00 0.22 H new ATOM 0 HZ3 TRP A 338 -7.458 7.136 -4.978 1.00 0.31 H new ATOM 0 HH2 TRP A 338 -6.669 9.397 -4.445 1.00 0.28 H new ATOM 142 N ASP A 339 -5.156 3.932 -4.214 1.00 0.25 N ATOM 143 CA ASP A 339 -5.776 3.880 -5.536 1.00 0.27 C ATOM 144 C ASP A 339 -5.422 2.588 -6.237 1.00 0.26 C ATOM 145 O ASP A 339 -6.297 1.868 -6.713 1.00 0.33 O ATOM 146 CB ASP A 339 -5.350 5.067 -6.402 1.00 0.36 C ATOM 147 CG ASP A 339 -5.525 4.797 -7.892 1.00 1.00 C ATOM 148 OD1 ASP A 339 -6.678 4.850 -8.383 1.00 1.80 O ATOM 149 OD2 ASP A 339 -4.516 4.534 -8.577 1.00 1.19 O ATOM 0 H ASP A 339 -4.377 4.585 -4.133 1.00 0.25 H new ATOM 0 HA ASP A 339 -6.855 3.930 -5.392 1.00 0.27 H new ATOM 0 HB2 ASP A 339 -5.935 5.944 -6.124 1.00 0.36 H new ATOM 0 HB3 ASP A 339 -4.305 5.304 -6.199 1.00 0.36 H new ATOM 154 N TYR A 340 -4.132 2.289 -6.274 1.00 0.22 N ATOM 155 CA TYR A 340 -3.650 1.105 -6.957 1.00 0.20 C ATOM 156 C TYR A 340 -4.266 -0.153 -6.361 1.00 0.17 C ATOM 157 O TYR A 340 -4.728 -1.036 -7.084 1.00 0.17 O ATOM 158 CB TYR A 340 -2.126 1.019 -6.882 1.00 0.21 C ATOM 159 CG TYR A 340 -1.595 -0.199 -7.582 1.00 0.20 C ATOM 160 CD1 TYR A 340 -1.469 -0.223 -8.962 1.00 0.26 C ATOM 161 CD2 TYR A 340 -1.250 -1.334 -6.867 1.00 0.17 C ATOM 162 CE1 TYR A 340 -1.015 -1.347 -9.617 1.00 0.28 C ATOM 163 CE2 TYR A 340 -0.789 -2.463 -7.513 1.00 0.18 C ATOM 164 CZ TYR A 340 -0.675 -2.464 -8.890 1.00 0.24 C ATOM 165 OH TYR A 340 -0.235 -3.593 -9.545 1.00 0.28 O ATOM 0 H TYR A 340 -3.402 2.852 -5.838 1.00 0.22 H new ATOM 0 HA TYR A 340 -3.948 1.180 -8.003 1.00 0.20 H new ATOM 0 HB2 TYR A 340 -1.690 1.913 -7.329 1.00 0.21 H new ATOM 0 HB3 TYR A 340 -1.815 1.001 -5.837 1.00 0.21 H new ATOM 0 HD1 TYR A 340 -1.731 0.655 -9.534 1.00 0.26 H new ATOM 0 HD2 TYR A 340 -1.343 -1.335 -5.791 1.00 0.17 H new ATOM 0 HE1 TYR A 340 -0.927 -1.351 -10.693 1.00 0.28 H new ATOM 0 HE2 TYR A 340 -0.519 -3.341 -6.945 1.00 0.18 H new ATOM 0 HH TYR A 340 0.740 -3.557 -9.641 1.00 0.28 H new ATOM 175 N VAL A 341 -4.266 -0.230 -5.038 1.00 0.17 N ATOM 176 CA VAL A 341 -4.819 -1.385 -4.344 1.00 0.15 C ATOM 177 C VAL A 341 -6.326 -1.491 -4.577 1.00 0.15 C ATOM 178 O VAL A 341 -6.859 -2.582 -4.775 1.00 0.15 O ATOM 179 CB VAL A 341 -4.499 -1.334 -2.830 1.00 0.16 C ATOM 180 CG1 VAL A 341 -4.853 0.016 -2.245 1.00 0.18 C ATOM 181 CG2 VAL A 341 -5.222 -2.437 -2.074 1.00 0.15 C ATOM 0 H VAL A 341 -3.890 0.492 -4.424 1.00 0.17 H new ATOM 0 HA VAL A 341 -4.348 -2.277 -4.756 1.00 0.15 H new ATOM 0 HB VAL A 341 -3.426 -1.490 -2.720 1.00 0.16 H new ATOM 0 HG11 VAL A 341 -4.618 0.024 -1.181 1.00 0.18 H new ATOM 0 HG12 VAL A 341 -4.279 0.793 -2.749 1.00 0.18 H new ATOM 0 HG13 VAL A 341 -5.918 0.204 -2.383 1.00 0.18 H new ATOM 0 HG21 VAL A 341 -4.976 -2.373 -1.014 1.00 0.15 H new ATOM 0 HG22 VAL A 341 -6.298 -2.322 -2.204 1.00 0.15 H new ATOM 0 HG23 VAL A 341 -4.911 -3.407 -2.461 1.00 0.15 H new ATOM 191 N TYR A 342 -7.002 -0.352 -4.586 1.00 0.17 N ATOM 192 CA TYR A 342 -8.432 -0.314 -4.865 1.00 0.17 C ATOM 193 C TYR A 342 -8.699 -0.725 -6.312 1.00 0.17 C ATOM 194 O TYR A 342 -9.720 -1.341 -6.620 1.00 0.18 O ATOM 195 CB TYR A 342 -8.981 1.089 -4.593 1.00 0.20 C ATOM 196 CG TYR A 342 -10.469 1.231 -4.813 1.00 0.31 C ATOM 197 CD1 TYR A 342 -11.376 0.717 -3.896 1.00 0.48 C ATOM 198 CD2 TYR A 342 -10.967 1.886 -5.931 1.00 0.44 C ATOM 199 CE1 TYR A 342 -12.736 0.848 -4.090 1.00 0.67 C ATOM 200 CE2 TYR A 342 -12.326 2.023 -6.132 1.00 0.62 C ATOM 201 CZ TYR A 342 -13.206 1.505 -5.210 1.00 0.71 C ATOM 202 OH TYR A 342 -14.561 1.639 -5.407 1.00 0.92 O ATOM 0 H TYR A 342 -6.584 0.560 -4.403 1.00 0.17 H new ATOM 0 HA TYR A 342 -8.941 -1.020 -4.208 1.00 0.17 H new ATOM 0 HB2 TYR A 342 -8.751 1.363 -3.563 1.00 0.20 H new ATOM 0 HB3 TYR A 342 -8.462 1.800 -5.236 1.00 0.20 H new ATOM 0 HD1 TYR A 342 -11.011 0.207 -3.017 1.00 0.48 H new ATOM 0 HD2 TYR A 342 -10.279 2.296 -6.656 1.00 0.44 H new ATOM 0 HE1 TYR A 342 -13.429 0.439 -3.370 1.00 0.67 H new ATOM 0 HE2 TYR A 342 -12.696 2.534 -7.008 1.00 0.62 H new ATOM 0 HH TYR A 342 -14.724 2.127 -6.241 1.00 0.92 H new ATOM 212 N GLN A 343 -7.761 -0.392 -7.191 1.00 0.18 N ATOM 213 CA GLN A 343 -7.855 -0.752 -8.596 1.00 0.19 C ATOM 214 C GLN A 343 -7.701 -2.263 -8.768 1.00 0.18 C ATOM 215 O GLN A 343 -8.300 -2.860 -9.660 1.00 0.23 O ATOM 216 CB GLN A 343 -6.783 -0.013 -9.402 1.00 0.26 C ATOM 217 CG GLN A 343 -7.031 -0.016 -10.901 1.00 0.71 C ATOM 218 CD GLN A 343 -8.314 0.702 -11.279 1.00 1.41 C ATOM 219 OE1 GLN A 343 -9.381 0.093 -11.363 1.00 2.07 O ATOM 220 NE2 GLN A 343 -8.223 2.006 -11.488 1.00 2.22 N ATOM 0 H GLN A 343 -6.920 0.132 -6.950 1.00 0.18 H new ATOM 0 HA GLN A 343 -8.837 -0.459 -8.968 1.00 0.19 H new ATOM 0 HB2 GLN A 343 -6.727 1.019 -9.055 1.00 0.26 H new ATOM 0 HB3 GLN A 343 -5.813 -0.469 -9.203 1.00 0.26 H new ATOM 0 HG2 GLN A 343 -6.190 0.459 -11.406 1.00 0.71 H new ATOM 0 HG3 GLN A 343 -7.076 -1.045 -11.257 1.00 0.71 H new ATOM 0 HE21 GLN A 343 -7.320 2.473 -11.409 1.00 2.22 H new ATOM 0 HE22 GLN A 343 -9.056 2.543 -11.728 1.00 2.22 H new ATOM 229 N LEU A 344 -6.915 -2.882 -7.886 1.00 0.16 N ATOM 230 CA LEU A 344 -6.716 -4.326 -7.915 1.00 0.15 C ATOM 231 C LEU A 344 -8.000 -5.016 -7.494 1.00 0.17 C ATOM 232 O LEU A 344 -8.320 -6.110 -7.953 1.00 0.24 O ATOM 233 CB LEU A 344 -5.584 -4.741 -6.974 1.00 0.15 C ATOM 234 CG LEU A 344 -4.223 -4.103 -7.248 1.00 0.12 C ATOM 235 CD1 LEU A 344 -3.227 -4.546 -6.194 1.00 0.13 C ATOM 236 CD2 LEU A 344 -3.715 -4.460 -8.636 1.00 0.19 C ATOM 0 H LEU A 344 -6.407 -2.403 -7.143 1.00 0.16 H new ATOM 0 HA LEU A 344 -6.446 -4.620 -8.929 1.00 0.15 H new ATOM 0 HB2 LEU A 344 -5.879 -4.499 -5.953 1.00 0.15 H new ATOM 0 HB3 LEU A 344 -5.473 -5.824 -7.025 1.00 0.15 H new ATOM 0 HG LEU A 344 -4.338 -3.020 -7.204 1.00 0.12 H new ATOM 0 HD11 LEU A 344 -2.258 -4.088 -6.394 1.00 0.13 H new ATOM 0 HD12 LEU A 344 -3.578 -4.237 -5.209 1.00 0.13 H new ATOM 0 HD13 LEU A 344 -3.128 -5.631 -6.220 1.00 0.13 H new ATOM 0 HD21 LEU A 344 -2.745 -3.991 -8.800 1.00 0.19 H new ATOM 0 HD22 LEU A 344 -3.613 -5.542 -8.719 1.00 0.19 H new ATOM 0 HD23 LEU A 344 -4.422 -4.103 -9.385 1.00 0.19 H new ATOM 248 N LEU A 345 -8.736 -4.344 -6.618 1.00 0.18 N ATOM 249 CA LEU A 345 -10.008 -4.844 -6.121 1.00 0.20 C ATOM 250 C LEU A 345 -11.075 -4.818 -7.212 1.00 0.25 C ATOM 251 O LEU A 345 -12.143 -5.414 -7.071 1.00 0.36 O ATOM 252 CB LEU A 345 -10.469 -4.003 -4.928 1.00 0.17 C ATOM 253 CG LEU A 345 -9.560 -4.069 -3.703 1.00 0.15 C ATOM 254 CD1 LEU A 345 -9.903 -2.980 -2.698 1.00 0.16 C ATOM 255 CD2 LEU A 345 -9.656 -5.431 -3.045 1.00 0.15 C ATOM 0 H LEU A 345 -8.467 -3.438 -6.233 1.00 0.18 H new ATOM 0 HA LEU A 345 -9.865 -5.878 -5.806 1.00 0.20 H new ATOM 0 HB2 LEU A 345 -10.551 -2.963 -5.245 1.00 0.17 H new ATOM 0 HB3 LEU A 345 -11.468 -4.328 -4.638 1.00 0.17 H new ATOM 0 HG LEU A 345 -8.537 -3.908 -4.042 1.00 0.15 H new ATOM 0 HD11 LEU A 345 -9.237 -3.056 -1.838 1.00 0.16 H new ATOM 0 HD12 LEU A 345 -9.783 -2.003 -3.165 1.00 0.16 H new ATOM 0 HD13 LEU A 345 -10.935 -3.100 -2.369 1.00 0.16 H new ATOM 0 HD21 LEU A 345 -9.002 -5.461 -2.174 1.00 0.15 H new ATOM 0 HD22 LEU A 345 -10.685 -5.613 -2.733 1.00 0.15 H new ATOM 0 HD23 LEU A 345 -9.351 -6.200 -3.754 1.00 0.15 H new ATOM 267 N SER A 346 -10.780 -4.121 -8.298 1.00 0.28 N ATOM 268 CA SER A 346 -11.727 -3.969 -9.386 1.00 0.35 C ATOM 269 C SER A 346 -11.452 -4.993 -10.486 1.00 0.36 C ATOM 270 O SER A 346 -12.136 -5.018 -11.512 1.00 0.54 O ATOM 271 CB SER A 346 -11.650 -2.544 -9.939 1.00 0.46 C ATOM 272 OG SER A 346 -12.697 -2.281 -10.858 1.00 1.06 O ATOM 0 H SER A 346 -9.887 -3.650 -8.448 1.00 0.28 H new ATOM 0 HA SER A 346 -12.734 -4.147 -9.008 1.00 0.35 H new ATOM 0 HB2 SER A 346 -11.700 -1.831 -9.116 1.00 0.46 H new ATOM 0 HB3 SER A 346 -10.688 -2.396 -10.431 1.00 0.46 H new ATOM 0 HG SER A 346 -12.778 -3.030 -11.484 1.00 1.06 H new ATOM 278 N ASP A 347 -10.470 -5.857 -10.263 1.00 0.32 N ATOM 279 CA ASP A 347 -10.057 -6.804 -11.288 1.00 0.34 C ATOM 280 C ASP A 347 -9.970 -8.216 -10.719 1.00 0.34 C ATOM 281 O ASP A 347 -9.360 -8.437 -9.674 1.00 0.43 O ATOM 282 CB ASP A 347 -8.705 -6.392 -11.858 1.00 0.41 C ATOM 283 CG ASP A 347 -8.451 -6.977 -13.230 1.00 0.80 C ATOM 284 OD1 ASP A 347 -8.999 -8.058 -13.527 1.00 0.99 O ATOM 285 OD2 ASP A 347 -7.690 -6.372 -14.014 1.00 1.18 O ATOM 0 H ASP A 347 -9.949 -5.921 -9.389 1.00 0.32 H new ATOM 0 HA ASP A 347 -10.803 -6.798 -12.083 1.00 0.34 H new ATOM 0 HB2 ASP A 347 -8.655 -5.305 -11.915 1.00 0.41 H new ATOM 0 HB3 ASP A 347 -7.915 -6.712 -11.178 1.00 0.41 H new ATOM 290 N SER A 348 -10.574 -9.168 -11.419 1.00 0.40 N ATOM 291 CA SER A 348 -10.605 -10.555 -10.978 1.00 0.43 C ATOM 292 C SER A 348 -9.266 -11.262 -11.185 1.00 0.35 C ATOM 293 O SER A 348 -9.092 -12.401 -10.742 1.00 0.40 O ATOM 294 CB SER A 348 -11.725 -11.301 -11.696 1.00 0.59 C ATOM 295 OG SER A 348 -11.907 -10.811 -13.017 1.00 0.79 O ATOM 0 H SER A 348 -11.054 -9.001 -12.304 1.00 0.40 H new ATOM 0 HA SER A 348 -10.798 -10.556 -9.905 1.00 0.43 H new ATOM 0 HB2 SER A 348 -11.493 -12.365 -11.729 1.00 0.59 H new ATOM 0 HB3 SER A 348 -12.654 -11.195 -11.135 1.00 0.59 H new ATOM 0 HG SER A 348 -12.630 -11.308 -13.454 1.00 0.79 H new ATOM 301 N ARG A 349 -8.327 -10.602 -11.862 1.00 0.34 N ATOM 302 CA ARG A 349 -6.985 -11.138 -12.008 1.00 0.37 C ATOM 303 C ARG A 349 -6.376 -11.386 -10.644 1.00 0.31 C ATOM 304 O ARG A 349 -5.973 -12.496 -10.302 1.00 0.42 O ATOM 305 CB ARG A 349 -6.083 -10.156 -12.729 1.00 0.45 C ATOM 306 CG ARG A 349 -6.568 -9.713 -14.086 1.00 0.71 C ATOM 307 CD ARG A 349 -5.450 -9.024 -14.825 1.00 1.07 C ATOM 308 NE ARG A 349 -5.819 -8.619 -16.179 1.00 1.86 N ATOM 309 CZ ARG A 349 -5.195 -9.036 -17.278 1.00 2.54 C ATOM 310 NH1 ARG A 349 -4.259 -9.975 -17.197 1.00 2.75 N ATOM 311 NH2 ARG A 349 -5.521 -8.530 -18.460 1.00 3.43 N ATOM 0 H ARG A 349 -8.475 -9.700 -12.314 1.00 0.34 H new ATOM 0 HA ARG A 349 -7.064 -12.063 -12.578 1.00 0.37 H new ATOM 0 HB2 ARG A 349 -5.957 -9.274 -12.101 1.00 0.45 H new ATOM 0 HB3 ARG A 349 -5.098 -10.609 -12.843 1.00 0.45 H new ATOM 0 HG2 ARG A 349 -6.918 -10.573 -14.656 1.00 0.71 H new ATOM 0 HG3 ARG A 349 -7.416 -9.037 -13.977 1.00 0.71 H new ATOM 0 HD2 ARG A 349 -5.139 -8.144 -14.262 1.00 1.07 H new ATOM 0 HD3 ARG A 349 -4.590 -9.692 -14.874 1.00 1.07 H new ATOM 0 HE ARG A 349 -6.604 -7.977 -16.289 1.00 1.86 H new ATOM 0 HH11 ARG A 349 -4.018 -10.378 -16.291 1.00 2.75 H new ATOM 0 HH12 ARG A 349 -3.782 -10.293 -18.040 1.00 2.75 H new ATOM 0 HH21 ARG A 349 -6.251 -7.820 -18.527 1.00 3.43 H new ATOM 0 HH22 ARG A 349 -5.042 -8.850 -19.302 1.00 3.43 H new ATOM 325 N TYR A 350 -6.342 -10.321 -9.868 1.00 0.26 N ATOM 326 CA TYR A 350 -5.605 -10.293 -8.619 1.00 0.30 C ATOM 327 C TYR A 350 -6.389 -10.869 -7.446 1.00 0.24 C ATOM 328 O TYR A 350 -6.085 -10.542 -6.312 1.00 0.25 O ATOM 329 CB TYR A 350 -5.218 -8.853 -8.283 1.00 0.40 C ATOM 330 CG TYR A 350 -4.808 -8.048 -9.487 1.00 0.47 C ATOM 331 CD1 TYR A 350 -3.546 -8.180 -10.036 1.00 0.54 C ATOM 332 CD2 TYR A 350 -5.698 -7.164 -10.085 1.00 0.52 C ATOM 333 CE1 TYR A 350 -3.176 -7.454 -11.145 1.00 0.61 C ATOM 334 CE2 TYR A 350 -5.336 -6.436 -11.197 1.00 0.60 C ATOM 335 CZ TYR A 350 -4.073 -6.583 -11.724 1.00 0.63 C ATOM 336 OH TYR A 350 -3.706 -5.858 -12.833 1.00 0.72 O ATOM 0 H TYR A 350 -6.825 -9.449 -10.085 1.00 0.26 H new ATOM 0 HA TYR A 350 -4.724 -10.917 -8.766 1.00 0.30 H new ATOM 0 HB2 TYR A 350 -6.061 -8.362 -7.797 1.00 0.40 H new ATOM 0 HB3 TYR A 350 -4.398 -8.863 -7.565 1.00 0.40 H new ATOM 0 HD1 TYR A 350 -2.840 -8.863 -9.588 1.00 0.54 H new ATOM 0 HD2 TYR A 350 -6.689 -7.046 -9.672 1.00 0.52 H new ATOM 0 HE1 TYR A 350 -2.185 -7.567 -11.560 1.00 0.61 H new ATOM 0 HE2 TYR A 350 -6.039 -5.754 -11.652 1.00 0.60 H new ATOM 0 HH TYR A 350 -4.455 -5.293 -13.117 1.00 0.72 H new ATOM 346 N GLU A 351 -7.370 -11.731 -7.690 1.00 0.22 N ATOM 347 CA GLU A 351 -8.167 -12.277 -6.585 1.00 0.23 C ATOM 348 C GLU A 351 -7.312 -13.152 -5.665 1.00 0.21 C ATOM 349 O GLU A 351 -7.658 -13.377 -4.504 1.00 0.25 O ATOM 350 CB GLU A 351 -9.374 -13.069 -7.092 1.00 0.31 C ATOM 351 CG GLU A 351 -9.028 -14.370 -7.796 1.00 0.36 C ATOM 352 CD GLU A 351 -10.257 -15.217 -8.057 1.00 0.97 C ATOM 353 OE1 GLU A 351 -11.029 -14.893 -8.985 1.00 1.22 O ATOM 354 OE2 GLU A 351 -10.449 -16.220 -7.345 1.00 1.45 O ATOM 0 H GLU A 351 -7.632 -12.064 -8.618 1.00 0.22 H new ATOM 0 HA GLU A 351 -8.538 -11.427 -6.012 1.00 0.23 H new ATOM 0 HB2 GLU A 351 -10.027 -13.291 -6.248 1.00 0.31 H new ATOM 0 HB3 GLU A 351 -9.942 -12.440 -7.778 1.00 0.31 H new ATOM 0 HG2 GLU A 351 -8.532 -14.150 -8.741 1.00 0.36 H new ATOM 0 HG3 GLU A 351 -8.321 -14.934 -7.188 1.00 0.36 H new ATOM 361 N ASN A 352 -6.198 -13.643 -6.193 1.00 0.22 N ATOM 362 CA ASN A 352 -5.257 -14.436 -5.412 1.00 0.24 C ATOM 363 C ASN A 352 -4.240 -13.513 -4.739 1.00 0.19 C ATOM 364 O ASN A 352 -3.402 -13.951 -3.956 1.00 0.21 O ATOM 365 CB ASN A 352 -4.544 -15.446 -6.317 1.00 0.32 C ATOM 366 CG ASN A 352 -3.659 -16.422 -5.561 1.00 0.62 C ATOM 367 OD1 ASN A 352 -2.579 -16.778 -6.026 1.00 1.06 O ATOM 368 ND2 ASN A 352 -4.122 -16.891 -4.415 1.00 1.06 N ATOM 0 H ASN A 352 -5.923 -13.505 -7.165 1.00 0.22 H new ATOM 0 HA ASN A 352 -5.801 -14.984 -4.642 1.00 0.24 H new ATOM 0 HB2 ASN A 352 -5.290 -16.007 -6.880 1.00 0.32 H new ATOM 0 HB3 ASN A 352 -3.937 -14.905 -7.043 1.00 0.32 H new ATOM 0 HD21 ASN A 352 -3.578 -17.572 -3.885 1.00 1.06 H new ATOM 0 HD22 ASN A 352 -5.024 -16.572 -4.060 1.00 1.06 H new ATOM 375 N PHE A 353 -4.331 -12.228 -5.058 1.00 0.16 N ATOM 376 CA PHE A 353 -3.480 -11.211 -4.452 1.00 0.14 C ATOM 377 C PHE A 353 -4.283 -10.400 -3.445 1.00 0.12 C ATOM 378 O PHE A 353 -3.827 -10.127 -2.338 1.00 0.11 O ATOM 379 CB PHE A 353 -2.919 -10.257 -5.513 1.00 0.16 C ATOM 380 CG PHE A 353 -1.991 -10.889 -6.508 1.00 0.19 C ATOM 381 CD1 PHE A 353 -2.486 -11.608 -7.583 1.00 0.30 C ATOM 382 CD2 PHE A 353 -0.621 -10.746 -6.374 1.00 0.21 C ATOM 383 CE1 PHE A 353 -1.630 -12.175 -8.506 1.00 0.34 C ATOM 384 CE2 PHE A 353 0.240 -11.308 -7.294 1.00 0.25 C ATOM 385 CZ PHE A 353 -0.265 -12.024 -8.362 1.00 0.29 C ATOM 0 H PHE A 353 -4.994 -11.862 -5.741 1.00 0.16 H new ATOM 0 HA PHE A 353 -2.652 -11.719 -3.957 1.00 0.14 H new ATOM 0 HB2 PHE A 353 -3.753 -9.806 -6.052 1.00 0.16 H new ATOM 0 HB3 PHE A 353 -2.390 -9.448 -5.009 1.00 0.16 H new ATOM 0 HD1 PHE A 353 -3.553 -11.726 -7.701 1.00 0.30 H new ATOM 0 HD2 PHE A 353 -0.221 -10.188 -5.540 1.00 0.21 H new ATOM 0 HE1 PHE A 353 -2.027 -12.736 -9.339 1.00 0.34 H new ATOM 0 HE2 PHE A 353 1.307 -11.188 -7.179 1.00 0.25 H new ATOM 0 HZ PHE A 353 0.407 -12.465 -9.083 1.00 0.29 H new ATOM 395 N ILE A 354 -5.471 -9.992 -3.859 1.00 0.11 N ATOM 396 CA ILE A 354 -6.364 -9.208 -3.031 1.00 0.11 C ATOM 397 C ILE A 354 -7.800 -9.353 -3.532 1.00 0.12 C ATOM 398 O ILE A 354 -8.027 -9.457 -4.736 1.00 0.16 O ATOM 399 CB ILE A 354 -5.947 -7.727 -3.038 1.00 0.11 C ATOM 400 CG1 ILE A 354 -6.728 -6.952 -1.989 1.00 0.12 C ATOM 401 CG2 ILE A 354 -6.143 -7.112 -4.421 1.00 0.13 C ATOM 402 CD1 ILE A 354 -6.175 -5.577 -1.741 1.00 0.12 C ATOM 0 H ILE A 354 -5.843 -10.198 -4.786 1.00 0.11 H new ATOM 0 HA ILE A 354 -6.305 -9.578 -2.007 1.00 0.11 H new ATOM 0 HB ILE A 354 -4.887 -7.669 -2.792 1.00 0.11 H new ATOM 0 HG12 ILE A 354 -7.767 -6.868 -2.307 1.00 0.12 H new ATOM 0 HG13 ILE A 354 -6.725 -7.513 -1.054 1.00 0.12 H new ATOM 0 HG21 ILE A 354 -5.841 -6.065 -4.400 1.00 0.13 H new ATOM 0 HG22 ILE A 354 -5.535 -7.650 -5.148 1.00 0.13 H new ATOM 0 HG23 ILE A 354 -7.193 -7.181 -4.704 1.00 0.13 H new ATOM 0 HD11 ILE A 354 -6.776 -5.075 -0.983 1.00 0.12 H new ATOM 0 HD12 ILE A 354 -5.145 -5.656 -1.394 1.00 0.12 H new ATOM 0 HD13 ILE A 354 -6.203 -5.001 -2.666 1.00 0.12 H new ATOM 414 N ARG A 355 -8.765 -9.394 -2.627 1.00 0.12 N ATOM 415 CA ARG A 355 -10.158 -9.488 -3.035 1.00 0.14 C ATOM 416 C ARG A 355 -11.104 -8.940 -1.971 1.00 0.14 C ATOM 417 O ARG A 355 -10.780 -8.902 -0.780 1.00 0.15 O ATOM 418 CB ARG A 355 -10.508 -10.934 -3.388 1.00 0.18 C ATOM 419 CG ARG A 355 -10.278 -11.926 -2.265 1.00 0.24 C ATOM 420 CD ARG A 355 -10.340 -13.352 -2.787 1.00 0.40 C ATOM 421 NE ARG A 355 -10.183 -14.340 -1.726 1.00 0.90 N ATOM 422 CZ ARG A 355 -10.561 -15.614 -1.838 1.00 1.53 C ATOM 423 NH1 ARG A 355 -11.085 -16.062 -2.974 1.00 1.59 N ATOM 424 NH2 ARG A 355 -10.409 -16.442 -0.812 1.00 2.39 N ATOM 0 H ARG A 355 -8.613 -9.364 -1.619 1.00 0.12 H new ATOM 0 HA ARG A 355 -10.287 -8.868 -3.922 1.00 0.14 H new ATOM 0 HB2 ARG A 355 -11.555 -10.979 -3.687 1.00 0.18 H new ATOM 0 HB3 ARG A 355 -9.916 -11.238 -4.252 1.00 0.18 H new ATOM 0 HG2 ARG A 355 -9.307 -11.744 -1.805 1.00 0.24 H new ATOM 0 HG3 ARG A 355 -11.030 -11.785 -1.489 1.00 0.24 H new ATOM 0 HD2 ARG A 355 -11.294 -13.511 -3.289 1.00 0.40 H new ATOM 0 HD3 ARG A 355 -9.559 -13.497 -3.533 1.00 0.40 H new ATOM 0 HE ARG A 355 -9.760 -14.039 -0.848 1.00 0.90 H new ATOM 0 HH11 ARG A 355 -11.200 -15.430 -3.767 1.00 1.59 H new ATOM 0 HH12 ARG A 355 -11.372 -17.038 -3.053 1.00 1.59 H new ATOM 0 HH21 ARG A 355 -10.004 -16.104 0.061 1.00 2.39 H new ATOM 0 HH22 ARG A 355 -10.698 -17.417 -0.896 1.00 2.39 H new ATOM 438 N TRP A 356 -12.266 -8.494 -2.430 1.00 0.15 N ATOM 439 CA TRP A 356 -13.304 -7.959 -1.558 1.00 0.16 C ATOM 440 C TRP A 356 -13.917 -9.033 -0.676 1.00 0.18 C ATOM 441 O TRP A 356 -14.407 -10.053 -1.164 1.00 0.25 O ATOM 442 CB TRP A 356 -14.418 -7.326 -2.387 1.00 0.18 C ATOM 443 CG TRP A 356 -14.057 -6.002 -2.970 1.00 0.18 C ATOM 444 CD1 TRP A 356 -13.883 -5.702 -4.288 1.00 0.21 C ATOM 445 CD2 TRP A 356 -13.824 -4.794 -2.249 1.00 0.16 C ATOM 446 NE1 TRP A 356 -13.576 -4.371 -4.426 1.00 0.22 N ATOM 447 CE2 TRP A 356 -13.533 -3.797 -3.186 1.00 0.19 C ATOM 448 CE3 TRP A 356 -13.841 -4.458 -0.899 1.00 0.15 C ATOM 449 CZ2 TRP A 356 -13.262 -2.489 -2.812 1.00 0.21 C ATOM 450 CZ3 TRP A 356 -13.566 -3.163 -0.531 1.00 0.17 C ATOM 451 CH2 TRP A 356 -13.282 -2.189 -1.485 1.00 0.20 C ATOM 0 H TRP A 356 -12.516 -8.493 -3.419 1.00 0.15 H new ATOM 0 HA TRP A 356 -12.827 -7.212 -0.923 1.00 0.16 H new ATOM 0 HB2 TRP A 356 -14.689 -8.006 -3.194 1.00 0.18 H new ATOM 0 HB3 TRP A 356 -15.302 -7.208 -1.760 1.00 0.18 H new ATOM 0 HD1 TRP A 356 -13.973 -6.406 -5.102 1.00 0.21 H new ATOM 0 HE1 TRP A 356 -13.408 -3.889 -5.309 1.00 0.22 H new ATOM 0 HE3 TRP A 356 -14.067 -5.204 -0.151 1.00 0.15 H new ATOM 0 HZ2 TRP A 356 -13.042 -1.733 -3.551 1.00 0.21 H new ATOM 0 HZ3 TRP A 356 -13.570 -2.896 0.515 1.00 0.17 H new ATOM 0 HH2 TRP A 356 -13.074 -1.178 -1.166 1.00 0.20 H new ATOM 462 N GLU A 357 -13.898 -8.786 0.624 1.00 0.18 N ATOM 463 CA GLU A 357 -14.628 -9.608 1.570 1.00 0.22 C ATOM 464 C GLU A 357 -16.033 -9.048 1.728 1.00 0.22 C ATOM 465 O GLU A 357 -17.029 -9.725 1.479 1.00 0.31 O ATOM 466 CB GLU A 357 -13.918 -9.616 2.917 1.00 0.25 C ATOM 467 CG GLU A 357 -12.569 -10.301 2.879 1.00 0.52 C ATOM 468 CD GLU A 357 -12.677 -11.768 2.536 1.00 0.45 C ATOM 469 OE1 GLU A 357 -13.008 -12.572 3.431 1.00 0.73 O ATOM 470 OE2 GLU A 357 -12.427 -12.124 1.367 1.00 0.79 O ATOM 0 H GLU A 357 -13.380 -8.016 1.048 1.00 0.18 H new ATOM 0 HA GLU A 357 -14.678 -10.632 1.200 1.00 0.22 H new ATOM 0 HB2 GLU A 357 -13.787 -8.589 3.257 1.00 0.25 H new ATOM 0 HB3 GLU A 357 -14.551 -10.116 3.650 1.00 0.25 H new ATOM 0 HG2 GLU A 357 -11.933 -9.805 2.145 1.00 0.52 H new ATOM 0 HG3 GLU A 357 -12.082 -10.192 3.848 1.00 0.52 H new ATOM 477 N ASP A 358 -16.091 -7.783 2.113 1.00 0.19 N ATOM 478 CA ASP A 358 -17.347 -7.071 2.280 1.00 0.22 C ATOM 479 C ASP A 358 -17.271 -5.760 1.516 1.00 0.20 C ATOM 480 O ASP A 358 -16.956 -4.718 2.088 1.00 0.22 O ATOM 481 CB ASP A 358 -17.625 -6.800 3.764 1.00 0.28 C ATOM 482 CG ASP A 358 -17.831 -8.068 4.574 1.00 1.02 C ATOM 483 OD1 ASP A 358 -16.858 -8.821 4.780 1.00 1.30 O ATOM 484 OD2 ASP A 358 -18.969 -8.304 5.028 1.00 2.07 O ATOM 0 H ASP A 358 -15.266 -7.220 2.319 1.00 0.19 H new ATOM 0 HA ASP A 358 -18.162 -7.682 1.891 1.00 0.22 H new ATOM 0 HB2 ASP A 358 -16.792 -6.238 4.186 1.00 0.28 H new ATOM 0 HB3 ASP A 358 -18.511 -6.172 3.852 1.00 0.28 H new ATOM 489 N LYS A 359 -17.558 -5.824 0.221 1.00 0.23 N ATOM 490 CA LYS A 359 -17.317 -4.701 -0.680 1.00 0.26 C ATOM 491 C LYS A 359 -18.075 -3.444 -0.272 1.00 0.28 C ATOM 492 O LYS A 359 -17.500 -2.354 -0.274 1.00 0.33 O ATOM 493 CB LYS A 359 -17.653 -5.084 -2.121 1.00 0.35 C ATOM 494 CG LYS A 359 -17.453 -3.949 -3.116 1.00 0.41 C ATOM 495 CD LYS A 359 -17.303 -4.471 -4.531 1.00 0.60 C ATOM 496 CE LYS A 359 -17.325 -3.342 -5.547 1.00 0.96 C ATOM 497 NZ LYS A 359 -17.160 -3.844 -6.934 1.00 1.65 N ATOM 0 H LYS A 359 -17.960 -6.645 -0.231 1.00 0.23 H new ATOM 0 HA LYS A 359 -16.255 -4.467 -0.610 1.00 0.26 H new ATOM 0 HB2 LYS A 359 -17.032 -5.929 -2.418 1.00 0.35 H new ATOM 0 HB3 LYS A 359 -18.690 -5.418 -2.167 1.00 0.35 H new ATOM 0 HG2 LYS A 359 -18.302 -3.267 -3.067 1.00 0.41 H new ATOM 0 HG3 LYS A 359 -16.567 -3.376 -2.843 1.00 0.41 H new ATOM 0 HD2 LYS A 359 -16.367 -5.023 -4.619 1.00 0.60 H new ATOM 0 HD3 LYS A 359 -18.108 -5.173 -4.748 1.00 0.60 H new ATOM 0 HE2 LYS A 359 -18.267 -2.799 -5.467 1.00 0.96 H new ATOM 0 HE3 LYS A 359 -16.529 -2.633 -5.320 1.00 0.96 H new ATOM 0 HZ1 LYS A 359 -17.180 -3.044 -7.598 1.00 1.65 H new ATOM 0 HZ2 LYS A 359 -16.250 -4.340 -7.018 1.00 1.65 H new ATOM 0 HZ3 LYS A 359 -17.934 -4.501 -7.160 1.00 1.65 H new ATOM 511 N GLU A 360 -19.347 -3.577 0.092 1.00 0.32 N ATOM 512 CA GLU A 360 -20.134 -2.410 0.463 1.00 0.36 C ATOM 513 C GLU A 360 -19.567 -1.755 1.718 1.00 0.34 C ATOM 514 O GLU A 360 -19.463 -0.530 1.799 1.00 0.42 O ATOM 515 CB GLU A 360 -21.601 -2.764 0.681 1.00 0.45 C ATOM 516 CG GLU A 360 -22.463 -1.532 0.897 1.00 0.94 C ATOM 517 CD GLU A 360 -23.917 -1.854 1.142 1.00 1.10 C ATOM 518 OE1 GLU A 360 -24.684 -1.943 0.158 1.00 1.33 O ATOM 519 OE2 GLU A 360 -24.304 -1.986 2.319 1.00 1.40 O ATOM 0 H GLU A 360 -19.846 -4.465 0.137 1.00 0.32 H new ATOM 0 HA GLU A 360 -20.076 -1.705 -0.366 1.00 0.36 H new ATOM 0 HB2 GLU A 360 -21.971 -3.318 -0.182 1.00 0.45 H new ATOM 0 HB3 GLU A 360 -21.689 -3.423 1.545 1.00 0.45 H new ATOM 0 HG2 GLU A 360 -22.075 -0.970 1.747 1.00 0.94 H new ATOM 0 HG3 GLU A 360 -22.384 -0.885 0.024 1.00 0.94 H new ATOM 526 N SER A 361 -19.183 -2.581 2.682 1.00 0.28 N ATOM 527 CA SER A 361 -18.577 -2.094 3.910 1.00 0.27 C ATOM 528 C SER A 361 -17.149 -1.616 3.654 1.00 0.23 C ATOM 529 O SER A 361 -16.563 -0.907 4.473 1.00 0.25 O ATOM 530 CB SER A 361 -18.582 -3.205 4.961 1.00 0.29 C ATOM 531 OG SER A 361 -19.901 -3.504 5.385 1.00 1.10 O ATOM 0 H SER A 361 -19.282 -3.595 2.635 1.00 0.28 H new ATOM 0 HA SER A 361 -19.158 -1.248 4.277 1.00 0.27 H new ATOM 0 HB2 SER A 361 -18.118 -4.101 4.549 1.00 0.29 H new ATOM 0 HB3 SER A 361 -17.982 -2.901 5.818 1.00 0.29 H new ATOM 0 HG SER A 361 -19.875 -4.218 6.055 1.00 1.10 H new ATOM 537 N LYS A 362 -16.626 -1.994 2.485 1.00 0.20 N ATOM 538 CA LYS A 362 -15.262 -1.672 2.064 1.00 0.19 C ATOM 539 C LYS A 362 -14.234 -2.485 2.842 1.00 0.15 C ATOM 540 O LYS A 362 -13.077 -2.083 2.980 1.00 0.16 O ATOM 541 CB LYS A 362 -14.983 -0.178 2.193 1.00 0.24 C ATOM 542 CG LYS A 362 -15.893 0.658 1.321 1.00 0.33 C ATOM 543 CD LYS A 362 -15.667 0.352 -0.147 1.00 0.46 C ATOM 544 CE LYS A 362 -16.708 1.010 -1.034 1.00 1.22 C ATOM 545 NZ LYS A 362 -18.086 0.559 -0.709 1.00 1.83 N ATOM 0 H LYS A 362 -17.145 -2.539 1.796 1.00 0.20 H new ATOM 0 HA LYS A 362 -15.173 -1.941 1.012 1.00 0.19 H new ATOM 0 HB2 LYS A 362 -15.105 0.123 3.234 1.00 0.24 H new ATOM 0 HB3 LYS A 362 -13.945 0.019 1.924 1.00 0.24 H new ATOM 0 HG2 LYS A 362 -16.933 0.462 1.581 1.00 0.33 H new ATOM 0 HG3 LYS A 362 -15.711 1.716 1.508 1.00 0.33 H new ATOM 0 HD2 LYS A 362 -14.674 0.694 -0.439 1.00 0.46 H new ATOM 0 HD3 LYS A 362 -15.691 -0.727 -0.300 1.00 0.46 H new ATOM 0 HE2 LYS A 362 -16.646 2.093 -0.923 1.00 1.22 H new ATOM 0 HE3 LYS A 362 -16.490 0.783 -2.078 1.00 1.22 H new ATOM 0 HZ1 LYS A 362 -18.713 0.748 -1.517 1.00 1.83 H new ATOM 0 HZ2 LYS A 362 -18.079 -0.461 -0.507 1.00 1.83 H new ATOM 0 HZ3 LYS A 362 -18.432 1.074 0.125 1.00 1.83 H new ATOM 559 N ILE A 363 -14.665 -3.639 3.332 1.00 0.14 N ATOM 560 CA ILE A 363 -13.779 -4.562 4.029 1.00 0.13 C ATOM 561 C ILE A 363 -13.133 -5.469 2.989 1.00 0.11 C ATOM 562 O ILE A 363 -13.810 -6.264 2.332 1.00 0.14 O ATOM 563 CB ILE A 363 -14.525 -5.427 5.096 1.00 0.15 C ATOM 564 CG1 ILE A 363 -14.963 -4.614 6.328 1.00 0.19 C ATOM 565 CG2 ILE A 363 -13.630 -6.562 5.565 1.00 0.17 C ATOM 566 CD1 ILE A 363 -15.594 -3.284 6.036 1.00 0.19 C ATOM 0 H ILE A 363 -15.630 -3.960 3.259 1.00 0.14 H new ATOM 0 HA ILE A 363 -13.032 -3.980 4.569 1.00 0.13 H new ATOM 0 HB ILE A 363 -15.421 -5.810 4.608 1.00 0.15 H new ATOM 0 HG12 ILE A 363 -15.669 -5.212 6.904 1.00 0.19 H new ATOM 0 HG13 ILE A 363 -14.092 -4.451 6.962 1.00 0.19 H new ATOM 0 HG21 ILE A 363 -14.159 -7.159 6.308 1.00 0.17 H new ATOM 0 HG22 ILE A 363 -13.365 -7.192 4.715 1.00 0.17 H new ATOM 0 HG23 ILE A 363 -12.723 -6.151 6.008 1.00 0.17 H new ATOM 0 HD11 ILE A 363 -15.864 -2.796 6.972 1.00 0.19 H new ATOM 0 HD12 ILE A 363 -14.887 -2.658 5.491 1.00 0.19 H new ATOM 0 HD13 ILE A 363 -16.489 -3.431 5.432 1.00 0.19 H new ATOM 578 N PHE A 364 -11.834 -5.329 2.820 1.00 0.09 N ATOM 579 CA PHE A 364 -11.128 -6.021 1.753 1.00 0.08 C ATOM 580 C PHE A 364 -9.951 -6.797 2.325 1.00 0.08 C ATOM 581 O PHE A 364 -9.301 -6.343 3.269 1.00 0.09 O ATOM 582 CB PHE A 364 -10.649 -5.014 0.701 1.00 0.09 C ATOM 583 CG PHE A 364 -9.451 -4.205 1.116 1.00 0.09 C ATOM 584 CD1 PHE A 364 -9.568 -3.175 2.033 1.00 0.09 C ATOM 585 CD2 PHE A 364 -8.205 -4.484 0.582 1.00 0.10 C ATOM 586 CE1 PHE A 364 -8.458 -2.435 2.404 1.00 0.10 C ATOM 587 CE2 PHE A 364 -7.097 -3.751 0.948 1.00 0.10 C ATOM 588 CZ PHE A 364 -7.219 -2.727 1.859 1.00 0.10 C ATOM 0 H PHE A 364 -11.242 -4.742 3.407 1.00 0.09 H new ATOM 0 HA PHE A 364 -11.808 -6.726 1.274 1.00 0.08 H new ATOM 0 HB2 PHE A 364 -10.409 -5.552 -0.216 1.00 0.09 H new ATOM 0 HB3 PHE A 364 -11.468 -4.334 0.467 1.00 0.09 H new ATOM 0 HD1 PHE A 364 -10.532 -2.947 2.462 1.00 0.09 H new ATOM 0 HD2 PHE A 364 -8.100 -5.288 -0.132 1.00 0.10 H new ATOM 0 HE1 PHE A 364 -8.559 -1.631 3.118 1.00 0.10 H new ATOM 0 HE2 PHE A 364 -6.132 -3.980 0.520 1.00 0.10 H new ATOM 0 HZ PHE A 364 -6.351 -2.153 2.148 1.00 0.10 H new ATOM 598 N ARG A 365 -9.673 -7.967 1.771 1.00 0.08 N ATOM 599 CA ARG A 365 -8.582 -8.778 2.272 1.00 0.09 C ATOM 600 C ARG A 365 -7.429 -8.784 1.309 1.00 0.09 C ATOM 601 O ARG A 365 -7.604 -9.017 0.113 1.00 0.10 O ATOM 602 CB ARG A 365 -9.001 -10.225 2.515 1.00 0.13 C ATOM 603 CG ARG A 365 -7.831 -11.111 2.930 1.00 0.20 C ATOM 604 CD ARG A 365 -8.165 -12.592 2.865 1.00 0.26 C ATOM 605 NE ARG A 365 -9.199 -12.980 3.819 1.00 0.58 N ATOM 606 CZ ARG A 365 -9.527 -14.246 4.078 1.00 0.73 C ATOM 607 NH1 ARG A 365 -8.851 -15.240 3.511 1.00 1.04 N ATOM 608 NH2 ARG A 365 -10.521 -14.522 4.909 1.00 1.14 N ATOM 0 H ARG A 365 -10.182 -8.370 0.984 1.00 0.08 H new ATOM 0 HA ARG A 365 -8.284 -8.329 3.219 1.00 0.09 H new ATOM 0 HB2 ARG A 365 -9.766 -10.253 3.291 1.00 0.13 H new ATOM 0 HB3 ARG A 365 -9.452 -10.626 1.608 1.00 0.13 H new ATOM 0 HG2 ARG A 365 -6.978 -10.906 2.283 1.00 0.20 H new ATOM 0 HG3 ARG A 365 -7.529 -10.855 3.946 1.00 0.20 H new ATOM 0 HD2 ARG A 365 -8.495 -12.842 1.857 1.00 0.26 H new ATOM 0 HD3 ARG A 365 -7.263 -13.172 3.058 1.00 0.26 H new ATOM 0 HE ARG A 365 -9.698 -12.242 4.315 1.00 0.58 H new ATOM 0 HH11 ARG A 365 -8.079 -15.035 2.876 1.00 1.04 H new ATOM 0 HH12 ARG A 365 -9.104 -16.208 3.711 1.00 1.04 H new ATOM 0 HH21 ARG A 365 -11.039 -13.764 5.354 1.00 1.14 H new ATOM 0 HH22 ARG A 365 -10.768 -15.492 5.104 1.00 1.14 H new ATOM 622 N ILE A 366 -6.251 -8.550 1.836 1.00 0.09 N ATOM 623 CA ILE A 366 -5.052 -8.770 1.075 1.00 0.09 C ATOM 624 C ILE A 366 -4.710 -10.252 1.141 1.00 0.09 C ATOM 625 O ILE A 366 -4.344 -10.786 2.193 1.00 0.12 O ATOM 626 CB ILE A 366 -3.899 -7.873 1.559 1.00 0.10 C ATOM 627 CG1 ILE A 366 -4.213 -6.419 1.160 1.00 0.11 C ATOM 628 CG2 ILE A 366 -2.572 -8.346 0.982 1.00 0.09 C ATOM 629 CD1 ILE A 366 -3.196 -5.392 1.608 1.00 0.12 C ATOM 0 H ILE A 366 -6.101 -8.209 2.785 1.00 0.09 H new ATOM 0 HA ILE A 366 -5.216 -8.491 0.034 1.00 0.09 H new ATOM 0 HB ILE A 366 -3.806 -7.931 2.644 1.00 0.10 H new ATOM 0 HG12 ILE A 366 -4.302 -6.369 0.075 1.00 0.11 H new ATOM 0 HG13 ILE A 366 -5.185 -6.148 1.573 1.00 0.11 H new ATOM 0 HG21 ILE A 366 -1.770 -7.699 1.336 1.00 0.09 H new ATOM 0 HG22 ILE A 366 -2.380 -9.370 1.303 1.00 0.09 H new ATOM 0 HG23 ILE A 366 -2.615 -8.308 -0.107 1.00 0.09 H new ATOM 0 HD11 ILE A 366 -3.509 -4.402 1.278 1.00 0.12 H new ATOM 0 HD12 ILE A 366 -3.121 -5.405 2.695 1.00 0.12 H new ATOM 0 HD13 ILE A 366 -2.224 -5.629 1.174 1.00 0.12 H new ATOM 641 N VAL A 367 -4.895 -10.903 0.010 1.00 0.10 N ATOM 642 CA VAL A 367 -4.846 -12.351 -0.096 1.00 0.12 C ATOM 643 C VAL A 367 -3.411 -12.853 -0.228 1.00 0.13 C ATOM 644 O VAL A 367 -3.022 -13.835 0.408 1.00 0.19 O ATOM 645 CB VAL A 367 -5.709 -12.801 -1.289 1.00 0.15 C ATOM 646 CG1 VAL A 367 -5.489 -14.258 -1.620 1.00 0.17 C ATOM 647 CG2 VAL A 367 -7.172 -12.537 -0.995 1.00 0.20 C ATOM 0 H VAL A 367 -5.087 -10.435 -0.876 1.00 0.10 H new ATOM 0 HA VAL A 367 -5.248 -12.787 0.819 1.00 0.12 H new ATOM 0 HB VAL A 367 -5.407 -12.221 -2.161 1.00 0.15 H new ATOM 0 HG11 VAL A 367 -6.116 -14.537 -2.467 1.00 0.17 H new ATOM 0 HG12 VAL A 367 -4.442 -14.419 -1.875 1.00 0.17 H new ATOM 0 HG13 VAL A 367 -5.751 -14.871 -0.757 1.00 0.17 H new ATOM 0 HG21 VAL A 367 -7.777 -12.858 -1.843 1.00 0.20 H new ATOM 0 HG22 VAL A 367 -7.470 -13.092 -0.106 1.00 0.20 H new ATOM 0 HG23 VAL A 367 -7.322 -11.471 -0.824 1.00 0.20 H new ATOM 657 N ASP A 368 -2.623 -12.173 -1.039 1.00 0.12 N ATOM 658 CA ASP A 368 -1.206 -12.479 -1.154 1.00 0.13 C ATOM 659 C ASP A 368 -0.400 -11.211 -0.980 1.00 0.12 C ATOM 660 O ASP A 368 -0.070 -10.528 -1.947 1.00 0.12 O ATOM 661 CB ASP A 368 -0.881 -13.137 -2.496 1.00 0.18 C ATOM 662 CG ASP A 368 0.533 -13.679 -2.539 1.00 0.25 C ATOM 663 OD1 ASP A 368 0.799 -14.689 -1.856 1.00 0.52 O ATOM 664 OD2 ASP A 368 1.384 -13.107 -3.252 1.00 0.50 O ATOM 0 H ASP A 368 -2.939 -11.404 -1.630 1.00 0.12 H new ATOM 0 HA ASP A 368 -0.943 -13.189 -0.370 1.00 0.13 H new ATOM 0 HB2 ASP A 368 -1.585 -13.948 -2.681 1.00 0.18 H new ATOM 0 HB3 ASP A 368 -1.014 -12.410 -3.297 1.00 0.18 H new ATOM 669 N PRO A 369 -0.111 -10.873 0.275 1.00 0.11 N ATOM 670 CA PRO A 369 0.547 -9.628 0.652 1.00 0.11 C ATOM 671 C PRO A 369 1.875 -9.385 -0.049 1.00 0.12 C ATOM 672 O PRO A 369 2.147 -8.270 -0.495 1.00 0.14 O ATOM 673 CB PRO A 369 0.744 -9.790 2.160 1.00 0.13 C ATOM 674 CG PRO A 369 -0.361 -10.673 2.549 1.00 0.13 C ATOM 675 CD PRO A 369 -0.446 -11.669 1.455 1.00 0.13 C ATOM 0 HA PRO A 369 -0.049 -8.762 0.364 1.00 0.11 H new ATOM 0 HB2 PRO A 369 1.713 -10.230 2.395 1.00 0.13 H new ATOM 0 HB3 PRO A 369 0.695 -8.832 2.678 1.00 0.13 H new ATOM 0 HG2 PRO A 369 -0.166 -11.153 3.508 1.00 0.13 H new ATOM 0 HG3 PRO A 369 -1.294 -10.119 2.654 1.00 0.13 H new ATOM 0 HD2 PRO A 369 0.253 -12.492 1.601 1.00 0.13 H new ATOM 0 HD3 PRO A 369 -1.442 -12.106 1.380 1.00 0.13 H new ATOM 683 N ASN A 370 2.694 -10.418 -0.148 1.00 0.15 N ATOM 684 CA ASN A 370 3.994 -10.286 -0.803 1.00 0.18 C ATOM 685 C ASN A 370 3.803 -9.855 -2.251 1.00 0.16 C ATOM 686 O ASN A 370 4.439 -8.915 -2.723 1.00 0.17 O ATOM 687 CB ASN A 370 4.771 -11.601 -0.759 1.00 0.25 C ATOM 688 CG ASN A 370 6.223 -11.423 -1.171 1.00 0.43 C ATOM 689 OD1 ASN A 370 6.818 -10.360 -0.968 1.00 1.13 O ATOM 690 ND2 ASN A 370 6.810 -12.465 -1.738 1.00 0.99 N ATOM 0 H ASN A 370 2.490 -11.350 0.211 1.00 0.15 H new ATOM 0 HA ASN A 370 4.567 -9.530 -0.266 1.00 0.18 H new ATOM 0 HB2 ASN A 370 4.729 -12.012 0.249 1.00 0.25 H new ATOM 0 HB3 ASN A 370 4.294 -12.325 -1.419 1.00 0.25 H new ATOM 0 HD21 ASN A 370 7.787 -12.407 -2.024 1.00 0.99 H new ATOM 0 HD22 ASN A 370 6.285 -13.326 -1.889 1.00 0.99 H new ATOM 697 N GLY A 371 2.893 -10.537 -2.936 1.00 0.16 N ATOM 698 CA GLY A 371 2.586 -10.211 -4.317 1.00 0.17 C ATOM 699 C GLY A 371 1.877 -8.879 -4.452 1.00 0.14 C ATOM 700 O GLY A 371 2.081 -8.158 -5.426 1.00 0.16 O ATOM 0 H GLY A 371 2.357 -11.317 -2.556 1.00 0.16 H new ATOM 0 HA2 GLY A 371 3.509 -10.188 -4.896 1.00 0.17 H new ATOM 0 HA3 GLY A 371 1.962 -10.997 -4.743 1.00 0.17 H new ATOM 704 N LEU A 372 1.037 -8.562 -3.475 1.00 0.13 N ATOM 705 CA LEU A 372 0.345 -7.277 -3.432 1.00 0.12 C ATOM 706 C LEU A 372 1.369 -6.148 -3.398 1.00 0.12 C ATOM 707 O LEU A 372 1.268 -5.170 -4.142 1.00 0.12 O ATOM 708 CB LEU A 372 -0.554 -7.219 -2.191 1.00 0.12 C ATOM 709 CG LEU A 372 -1.847 -6.409 -2.328 1.00 0.11 C ATOM 710 CD1 LEU A 372 -1.566 -4.932 -2.560 1.00 0.11 C ATOM 711 CD2 LEU A 372 -2.691 -6.965 -3.459 1.00 0.14 C ATOM 0 H LEU A 372 0.816 -9.182 -2.695 1.00 0.13 H new ATOM 0 HA LEU A 372 -0.275 -7.164 -4.321 1.00 0.12 H new ATOM 0 HB2 LEU A 372 -0.817 -8.239 -1.911 1.00 0.12 H new ATOM 0 HB3 LEU A 372 0.026 -6.802 -1.368 1.00 0.12 H new ATOM 0 HG LEU A 372 -2.395 -6.497 -1.390 1.00 0.11 H new ATOM 0 HD11 LEU A 372 -2.509 -4.392 -2.652 1.00 0.11 H new ATOM 0 HD12 LEU A 372 -1.000 -4.533 -1.718 1.00 0.11 H new ATOM 0 HD13 LEU A 372 -0.988 -4.811 -3.476 1.00 0.11 H new ATOM 0 HD21 LEU A 372 -3.608 -6.383 -3.549 1.00 0.14 H new ATOM 0 HD22 LEU A 372 -2.132 -6.907 -4.393 1.00 0.14 H new ATOM 0 HD23 LEU A 372 -2.941 -8.005 -3.249 1.00 0.14 H new ATOM 723 N ALA A 373 2.363 -6.309 -2.535 1.00 0.13 N ATOM 724 CA ALA A 373 3.480 -5.381 -2.453 1.00 0.16 C ATOM 725 C ALA A 373 4.238 -5.338 -3.775 1.00 0.18 C ATOM 726 O ALA A 373 4.580 -4.268 -4.264 1.00 0.22 O ATOM 727 CB ALA A 373 4.402 -5.796 -1.329 1.00 0.18 C ATOM 0 H ALA A 373 2.417 -7.084 -1.874 1.00 0.13 H new ATOM 0 HA ALA A 373 3.097 -4.381 -2.249 1.00 0.16 H new ATOM 0 HB1 ALA A 373 5.239 -5.100 -1.269 1.00 0.18 H new ATOM 0 HB2 ALA A 373 3.854 -5.787 -0.387 1.00 0.18 H new ATOM 0 HB3 ALA A 373 4.779 -6.801 -1.520 1.00 0.18 H new ATOM 733 N ARG A 374 4.492 -6.514 -4.352 1.00 0.19 N ATOM 734 CA ARG A 374 5.151 -6.616 -5.655 1.00 0.24 C ATOM 735 C ARG A 374 4.401 -5.815 -6.714 1.00 0.19 C ATOM 736 O ARG A 374 5.009 -5.125 -7.533 1.00 0.21 O ATOM 737 CB ARG A 374 5.244 -8.072 -6.094 1.00 0.33 C ATOM 738 CG ARG A 374 6.177 -8.900 -5.236 1.00 0.67 C ATOM 739 CD ARG A 374 7.616 -8.433 -5.358 1.00 0.92 C ATOM 740 NE ARG A 374 8.514 -9.208 -4.510 1.00 1.47 N ATOM 741 CZ ARG A 374 9.838 -9.208 -4.635 1.00 1.99 C ATOM 742 NH1 ARG A 374 10.422 -8.524 -5.614 1.00 2.45 N ATOM 743 NH2 ARG A 374 10.577 -9.916 -3.798 1.00 2.67 N ATOM 0 H ARG A 374 4.250 -7.413 -3.935 1.00 0.19 H new ATOM 0 HA ARG A 374 6.155 -6.205 -5.550 1.00 0.24 H new ATOM 0 HB2 ARG A 374 4.249 -8.516 -6.068 1.00 0.33 H new ATOM 0 HB3 ARG A 374 5.584 -8.111 -7.129 1.00 0.33 H new ATOM 0 HG2 ARG A 374 5.862 -8.840 -4.194 1.00 0.67 H new ATOM 0 HG3 ARG A 374 6.108 -9.947 -5.530 1.00 0.67 H new ATOM 0 HD2 ARG A 374 7.937 -8.515 -6.396 1.00 0.92 H new ATOM 0 HD3 ARG A 374 7.680 -7.379 -5.086 1.00 0.92 H new ATOM 0 HE ARG A 374 8.102 -9.785 -3.777 1.00 1.47 H new ATOM 0 HH11 ARG A 374 9.854 -7.995 -6.275 1.00 2.45 H new ATOM 0 HH12 ARG A 374 11.438 -8.529 -5.704 1.00 2.45 H new ATOM 0 HH21 ARG A 374 10.131 -10.460 -3.059 1.00 2.67 H new ATOM 0 HH22 ARG A 374 11.593 -9.918 -3.891 1.00 2.67 H new ATOM 757 N LEU A 375 3.081 -5.926 -6.695 1.00 0.17 N ATOM 758 CA LEU A 375 2.229 -5.175 -7.603 1.00 0.18 C ATOM 759 C LEU A 375 2.402 -3.676 -7.381 1.00 0.19 C ATOM 760 O LEU A 375 2.604 -2.914 -8.328 1.00 0.22 O ATOM 761 CB LEU A 375 0.760 -5.569 -7.404 1.00 0.18 C ATOM 762 CG LEU A 375 0.395 -6.997 -7.813 1.00 0.21 C ATOM 763 CD1 LEU A 375 -1.045 -7.302 -7.435 1.00 0.23 C ATOM 764 CD2 LEU A 375 0.592 -7.188 -9.306 1.00 0.26 C ATOM 0 H LEU A 375 2.573 -6.535 -6.054 1.00 0.17 H new ATOM 0 HA LEU A 375 2.523 -5.413 -8.625 1.00 0.18 H new ATOM 0 HB2 LEU A 375 0.507 -5.436 -6.352 1.00 0.18 H new ATOM 0 HB3 LEU A 375 0.137 -4.878 -7.972 1.00 0.18 H new ATOM 0 HG LEU A 375 1.052 -7.686 -7.283 1.00 0.21 H new ATOM 0 HD11 LEU A 375 -1.291 -8.321 -7.732 1.00 0.23 H new ATOM 0 HD12 LEU A 375 -1.168 -7.198 -6.357 1.00 0.23 H new ATOM 0 HD13 LEU A 375 -1.710 -6.605 -7.945 1.00 0.23 H new ATOM 0 HD21 LEU A 375 0.328 -8.209 -9.580 1.00 0.26 H new ATOM 0 HD22 LEU A 375 -0.045 -6.490 -9.849 1.00 0.26 H new ATOM 0 HD23 LEU A 375 1.635 -7.002 -9.562 1.00 0.26 H new ATOM 776 N TRP A 376 2.338 -3.262 -6.122 1.00 0.18 N ATOM 777 CA TRP A 376 2.476 -1.854 -5.778 1.00 0.20 C ATOM 778 C TRP A 376 3.880 -1.349 -6.115 1.00 0.25 C ATOM 779 O TRP A 376 4.044 -0.229 -6.594 1.00 0.30 O ATOM 780 CB TRP A 376 2.155 -1.625 -4.300 1.00 0.20 C ATOM 781 CG TRP A 376 2.170 -0.178 -3.917 1.00 0.20 C ATOM 782 CD1 TRP A 376 1.332 0.799 -4.374 1.00 0.20 C ATOM 783 CD2 TRP A 376 3.060 0.457 -2.990 1.00 0.24 C ATOM 784 NE1 TRP A 376 1.674 2.010 -3.821 1.00 0.23 N ATOM 785 CE2 TRP A 376 2.725 1.823 -2.961 1.00 0.26 C ATOM 786 CE3 TRP A 376 4.111 0.004 -2.190 1.00 0.29 C ATOM 787 CZ2 TRP A 376 3.406 2.737 -2.163 1.00 0.31 C ATOM 788 CZ3 TRP A 376 4.781 0.913 -1.397 1.00 0.34 C ATOM 789 CH2 TRP A 376 4.428 2.266 -1.389 1.00 0.35 C ATOM 0 H TRP A 376 2.192 -3.880 -5.324 1.00 0.18 H new ATOM 0 HA TRP A 376 1.761 -1.286 -6.372 1.00 0.20 H new ATOM 0 HB2 TRP A 376 1.174 -2.044 -4.078 1.00 0.20 H new ATOM 0 HB3 TRP A 376 2.878 -2.165 -3.689 1.00 0.20 H new ATOM 0 HD1 TRP A 376 0.520 0.643 -5.068 1.00 0.20 H new ATOM 0 HE1 TRP A 376 1.220 2.902 -4.018 1.00 0.23 H new ATOM 0 HE3 TRP A 376 4.394 -1.038 -2.192 1.00 0.29 H new ATOM 0 HZ2 TRP A 376 3.136 3.783 -2.156 1.00 0.31 H new ATOM 0 HZ3 TRP A 376 5.593 0.573 -0.771 1.00 0.34 H new ATOM 0 HH2 TRP A 376 4.974 2.952 -0.758 1.00 0.35 H new ATOM 800 N GLY A 377 4.883 -2.189 -5.870 1.00 0.27 N ATOM 801 CA GLY A 377 6.245 -1.875 -6.270 1.00 0.33 C ATOM 802 C GLY A 377 6.332 -1.594 -7.754 1.00 0.38 C ATOM 803 O GLY A 377 6.930 -0.605 -8.168 1.00 0.41 O ATOM 0 H GLY A 377 4.775 -3.087 -5.399 1.00 0.27 H new ATOM 0 HA2 GLY A 377 6.599 -1.008 -5.712 1.00 0.33 H new ATOM 0 HA3 GLY A 377 6.902 -2.707 -6.016 1.00 0.33 H new ATOM 807 N ASN A 378 5.699 -2.456 -8.541 1.00 0.41 N ATOM 808 CA ASN A 378 5.643 -2.304 -9.993 1.00 0.50 C ATOM 809 C ASN A 378 5.078 -0.936 -10.376 1.00 0.51 C ATOM 810 O ASN A 378 5.648 -0.221 -11.202 1.00 0.62 O ATOM 811 CB ASN A 378 4.778 -3.414 -10.596 1.00 0.54 C ATOM 812 CG ASN A 378 4.654 -3.325 -12.108 1.00 0.72 C ATOM 813 OD1 ASN A 378 5.569 -2.875 -12.797 1.00 0.89 O ATOM 814 ND2 ASN A 378 3.510 -3.744 -12.631 1.00 1.06 N ATOM 0 H ASN A 378 5.210 -3.280 -8.192 1.00 0.41 H new ATOM 0 HA ASN A 378 6.656 -2.378 -10.388 1.00 0.50 H new ATOM 0 HB2 ASN A 378 5.203 -4.382 -10.330 1.00 0.54 H new ATOM 0 HB3 ASN A 378 3.783 -3.370 -10.154 1.00 0.54 H new ATOM 0 HD21 ASN A 378 3.364 -3.700 -13.640 1.00 1.06 H new ATOM 0 HD22 ASN A 378 2.776 -4.111 -12.025 1.00 1.06 H new ATOM 821 N HIS A 379 3.967 -0.569 -9.748 1.00 0.44 N ATOM 822 CA HIS A 379 3.314 0.711 -10.013 1.00 0.49 C ATOM 823 C HIS A 379 4.212 1.881 -9.603 1.00 0.53 C ATOM 824 O HIS A 379 4.214 2.933 -10.243 1.00 0.67 O ATOM 825 CB HIS A 379 1.977 0.779 -9.261 1.00 0.51 C ATOM 826 CG HIS A 379 1.224 2.066 -9.446 1.00 0.61 C ATOM 827 ND1 HIS A 379 0.507 2.322 -10.591 1.00 0.70 N ATOM 828 CD2 HIS A 379 1.100 3.122 -8.606 1.00 0.78 C ATOM 829 CE1 HIS A 379 -0.033 3.517 -10.422 1.00 0.84 C ATOM 830 NE2 HIS A 379 0.298 4.040 -9.234 1.00 0.89 N ATOM 0 H HIS A 379 3.496 -1.142 -9.048 1.00 0.44 H new ATOM 0 HA HIS A 379 3.128 0.788 -11.084 1.00 0.49 H new ATOM 0 HB2 HIS A 379 1.347 -0.047 -9.591 1.00 0.51 H new ATOM 0 HB3 HIS A 379 2.165 0.632 -8.197 1.00 0.51 H new ATOM 0 HD2 HIS A 379 1.548 3.222 -7.628 1.00 0.78 H new ATOM 0 HE1 HIS A 379 -0.661 4.009 -11.150 1.00 0.84 H new ATOM 0 HE2 HIS A 379 0.009 4.947 -8.867 1.00 0.89 H new ATOM 838 N LYS A 380 4.989 1.678 -8.549 1.00 0.47 N ATOM 839 CA LYS A 380 5.805 2.745 -7.985 1.00 0.55 C ATOM 840 C LYS A 380 7.233 2.725 -8.522 1.00 0.56 C ATOM 841 O LYS A 380 8.107 3.391 -7.963 1.00 0.70 O ATOM 842 CB LYS A 380 5.826 2.644 -6.460 1.00 0.62 C ATOM 843 CG LYS A 380 4.453 2.793 -5.827 1.00 0.79 C ATOM 844 CD LYS A 380 3.757 4.060 -6.297 1.00 0.75 C ATOM 845 CE LYS A 380 4.566 5.300 -5.966 1.00 0.84 C ATOM 846 NZ LYS A 380 3.946 6.527 -6.523 1.00 1.36 N ATOM 0 H LYS A 380 5.072 0.783 -8.066 1.00 0.47 H new ATOM 0 HA LYS A 380 5.352 3.689 -8.286 1.00 0.55 H new ATOM 0 HB2 LYS A 380 6.248 1.681 -6.173 1.00 0.62 H new ATOM 0 HB3 LYS A 380 6.487 3.413 -6.061 1.00 0.62 H new ATOM 0 HG2 LYS A 380 3.840 1.926 -6.076 1.00 0.79 H new ATOM 0 HG3 LYS A 380 4.552 2.812 -4.742 1.00 0.79 H new ATOM 0 HD2 LYS A 380 3.595 4.008 -7.374 1.00 0.75 H new ATOM 0 HD3 LYS A 380 2.775 4.131 -5.829 1.00 0.75 H new ATOM 0 HE2 LYS A 380 4.656 5.397 -4.884 1.00 0.84 H new ATOM 0 HE3 LYS A 380 5.576 5.191 -6.361 1.00 0.84 H new ATOM 0 HZ1 LYS A 380 4.427 7.365 -6.138 1.00 1.36 H new ATOM 0 HZ2 LYS A 380 4.036 6.522 -7.559 1.00 1.36 H new ATOM 0 HZ3 LYS A 380 2.939 6.556 -6.263 1.00 1.36 H new ATOM 860 N ASN A 381 7.470 1.948 -9.583 1.00 0.52 N ATOM 861 CA ASN A 381 8.785 1.893 -10.244 1.00 0.60 C ATOM 862 C ASN A 381 9.831 1.234 -9.326 1.00 0.59 C ATOM 863 O ASN A 381 11.033 1.243 -9.589 1.00 0.76 O ATOM 864 CB ASN A 381 9.186 3.319 -10.713 1.00 0.76 C ATOM 865 CG ASN A 381 10.519 3.836 -10.183 1.00 1.50 C ATOM 866 OD1 ASN A 381 11.554 3.704 -10.841 1.00 2.30 O ATOM 867 ND2 ASN A 381 10.498 4.442 -9.006 1.00 2.17 N ATOM 0 H ASN A 381 6.766 1.344 -10.007 1.00 0.52 H new ATOM 0 HA ASN A 381 8.732 1.263 -11.132 1.00 0.60 H new ATOM 0 HB2 ASN A 381 9.221 3.327 -11.802 1.00 0.76 H new ATOM 0 HB3 ASN A 381 8.402 4.014 -10.414 1.00 0.76 H new ATOM 0 HD21 ASN A 381 11.359 4.820 -8.612 1.00 2.17 H new ATOM 0 HD22 ASN A 381 9.621 4.530 -8.493 1.00 2.17 H new ATOM 874 N ARG A 382 9.338 0.584 -8.286 1.00 0.49 N ATOM 875 CA ARG A 382 10.188 -0.009 -7.267 1.00 0.55 C ATOM 876 C ARG A 382 10.521 -1.460 -7.602 1.00 0.67 C ATOM 877 O ARG A 382 9.862 -2.077 -8.436 1.00 0.79 O ATOM 878 CB ARG A 382 9.503 0.092 -5.907 1.00 0.51 C ATOM 879 CG ARG A 382 9.325 1.519 -5.455 1.00 0.70 C ATOM 880 CD ARG A 382 10.593 2.334 -5.666 1.00 1.09 C ATOM 881 NE ARG A 382 11.678 1.947 -4.766 1.00 1.88 N ATOM 882 CZ ARG A 382 12.507 2.821 -4.192 1.00 2.39 C ATOM 883 NH1 ARG A 382 12.354 4.123 -4.403 1.00 2.40 N ATOM 884 NH2 ARG A 382 13.492 2.395 -3.411 1.00 3.26 N ATOM 0 H ARG A 382 8.340 0.452 -8.124 1.00 0.49 H new ATOM 0 HA ARG A 382 11.129 0.541 -7.233 1.00 0.55 H new ATOM 0 HB2 ARG A 382 8.529 -0.394 -5.958 1.00 0.51 H new ATOM 0 HB3 ARG A 382 10.091 -0.450 -5.166 1.00 0.51 H new ATOM 0 HG2 ARG A 382 8.502 1.976 -6.005 1.00 0.70 H new ATOM 0 HG3 ARG A 382 9.052 1.536 -4.400 1.00 0.70 H new ATOM 0 HD2 ARG A 382 10.925 2.218 -6.698 1.00 1.09 H new ATOM 0 HD3 ARG A 382 10.367 3.390 -5.521 1.00 1.09 H new ATOM 0 HE ARG A 382 11.808 0.955 -4.566 1.00 1.88 H new ATOM 0 HH11 ARG A 382 11.601 4.457 -5.005 1.00 2.40 H new ATOM 0 HH12 ARG A 382 12.989 4.789 -3.963 1.00 2.40 H new ATOM 0 HH21 ARG A 382 13.618 1.396 -3.248 1.00 3.26 H new ATOM 0 HH22 ARG A 382 14.123 3.067 -2.974 1.00 3.26 H new ATOM 943 N THR A 386 8.398 -5.991 -0.812 1.00 0.33 N ATOM 944 CA THR A 386 7.756 -6.983 0.020 1.00 0.28 C ATOM 945 C THR A 386 6.716 -6.284 0.899 1.00 0.21 C ATOM 946 O THR A 386 6.808 -5.075 1.087 1.00 0.24 O ATOM 947 CB THR A 386 8.821 -7.726 0.858 1.00 0.33 C ATOM 948 OG1 THR A 386 9.457 -8.732 0.056 1.00 0.54 O ATOM 949 CG2 THR A 386 8.235 -8.346 2.103 1.00 0.26 C ATOM 0 HA THR A 386 7.245 -7.729 -0.589 1.00 0.28 H new ATOM 0 HB THR A 386 9.559 -6.991 1.179 1.00 0.33 H new ATOM 0 HG1 THR A 386 8.776 -9.320 -0.332 1.00 0.54 H new ATOM 0 HG21 THR A 386 9.021 -8.857 2.659 1.00 0.26 H new ATOM 0 HG22 THR A 386 7.797 -7.566 2.726 1.00 0.26 H new ATOM 0 HG23 THR A 386 7.463 -9.063 1.824 1.00 0.26 H new ATOM 957 N TYR A 387 5.712 -7.004 1.398 1.00 0.19 N ATOM 958 CA TYR A 387 4.587 -6.360 2.077 1.00 0.17 C ATOM 959 C TYR A 387 5.036 -5.463 3.233 1.00 0.16 C ATOM 960 O TYR A 387 4.505 -4.365 3.396 1.00 0.18 O ATOM 961 CB TYR A 387 3.574 -7.378 2.580 1.00 0.19 C ATOM 962 CG TYR A 387 2.270 -6.721 2.954 1.00 0.20 C ATOM 963 CD1 TYR A 387 2.110 -6.116 4.189 1.00 0.21 C ATOM 964 CD2 TYR A 387 1.211 -6.686 2.064 1.00 0.22 C ATOM 965 CE1 TYR A 387 0.932 -5.490 4.525 1.00 0.24 C ATOM 966 CE2 TYR A 387 0.030 -6.067 2.394 1.00 0.25 C ATOM 967 CZ TYR A 387 -0.102 -5.468 3.626 1.00 0.26 C ATOM 968 OH TYR A 387 -1.273 -4.847 3.962 1.00 0.30 O ATOM 0 H TYR A 387 5.653 -8.021 1.347 1.00 0.19 H new ATOM 0 HA TYR A 387 4.109 -5.729 1.327 1.00 0.17 H new ATOM 0 HB2 TYR A 387 3.397 -8.128 1.809 1.00 0.19 H new ATOM 0 HB3 TYR A 387 3.981 -7.901 3.446 1.00 0.19 H new ATOM 0 HD1 TYR A 387 2.923 -6.136 4.900 1.00 0.21 H new ATOM 0 HD2 TYR A 387 1.315 -7.152 1.095 1.00 0.22 H new ATOM 0 HE1 TYR A 387 0.823 -5.019 5.491 1.00 0.24 H new ATOM 0 HE2 TYR A 387 -0.790 -6.050 1.691 1.00 0.25 H new ATOM 0 HH TYR A 387 -1.841 -5.469 4.464 1.00 0.30 H new ATOM 978 N GLU A 388 5.998 -5.923 4.034 1.00 0.20 N ATOM 979 CA GLU A 388 6.557 -5.099 5.115 1.00 0.26 C ATOM 980 C GLU A 388 6.987 -3.737 4.583 1.00 0.25 C ATOM 981 O GLU A 388 6.818 -2.707 5.236 1.00 0.31 O ATOM 982 CB GLU A 388 7.760 -5.780 5.751 1.00 0.38 C ATOM 983 CG GLU A 388 7.450 -7.108 6.409 1.00 1.00 C ATOM 984 CD GLU A 388 8.658 -7.688 7.109 1.00 1.78 C ATOM 985 OE1 GLU A 388 9.559 -8.203 6.413 1.00 2.37 O ATOM 986 OE2 GLU A 388 8.707 -7.645 8.357 1.00 2.34 O ATOM 0 H GLU A 388 6.406 -6.855 3.959 1.00 0.20 H new ATOM 0 HA GLU A 388 5.777 -4.970 5.866 1.00 0.26 H new ATOM 0 HB2 GLU A 388 8.521 -5.936 4.986 1.00 0.38 H new ATOM 0 HB3 GLU A 388 8.190 -5.110 6.496 1.00 0.38 H new ATOM 0 HG2 GLU A 388 6.642 -6.976 7.129 1.00 1.00 H new ATOM 0 HG3 GLU A 388 7.095 -7.812 5.656 1.00 1.00 H new ATOM 993 N LYS A 389 7.536 -3.762 3.384 1.00 0.24 N ATOM 994 CA LYS A 389 8.003 -2.571 2.700 1.00 0.28 C ATOM 995 C LYS A 389 6.825 -1.731 2.187 1.00 0.26 C ATOM 996 O LYS A 389 6.893 -0.503 2.161 1.00 0.32 O ATOM 997 CB LYS A 389 8.927 -3.003 1.553 1.00 0.34 C ATOM 998 CG LYS A 389 10.187 -3.701 2.053 1.00 0.46 C ATOM 999 CD LYS A 389 10.959 -4.376 0.928 1.00 0.52 C ATOM 1000 CE LYS A 389 12.253 -5.006 1.438 1.00 0.72 C ATOM 1001 NZ LYS A 389 13.000 -5.727 0.367 1.00 1.62 N ATOM 0 H LYS A 389 7.672 -4.621 2.851 1.00 0.24 H new ATOM 0 HA LYS A 389 8.557 -1.939 3.394 1.00 0.28 H new ATOM 0 HB2 LYS A 389 8.385 -3.673 0.886 1.00 0.34 H new ATOM 0 HB3 LYS A 389 9.208 -2.128 0.967 1.00 0.34 H new ATOM 0 HG2 LYS A 389 10.831 -2.973 2.547 1.00 0.46 H new ATOM 0 HG3 LYS A 389 9.915 -4.445 2.801 1.00 0.46 H new ATOM 0 HD2 LYS A 389 10.337 -5.143 0.467 1.00 0.52 H new ATOM 0 HD3 LYS A 389 11.190 -3.645 0.153 1.00 0.52 H new ATOM 0 HE2 LYS A 389 12.890 -4.228 1.860 1.00 0.72 H new ATOM 0 HE3 LYS A 389 12.021 -5.701 2.245 1.00 0.72 H new ATOM 0 HZ1 LYS A 389 13.869 -6.136 0.765 1.00 1.62 H new ATOM 0 HZ2 LYS A 389 12.405 -6.488 -0.019 1.00 1.62 H new ATOM 0 HZ3 LYS A 389 13.247 -5.061 -0.393 1.00 1.62 H new ATOM 1015 N MET A 390 5.742 -2.399 1.802 1.00 0.19 N ATOM 1016 CA MET A 390 4.536 -1.717 1.324 1.00 0.20 C ATOM 1017 C MET A 390 3.730 -1.130 2.493 1.00 0.20 C ATOM 1018 O MET A 390 3.078 -0.092 2.353 1.00 0.22 O ATOM 1019 CB MET A 390 3.665 -2.684 0.515 1.00 0.18 C ATOM 1020 CG MET A 390 2.288 -2.927 1.115 1.00 0.23 C ATOM 1021 SD MET A 390 1.240 -3.950 0.067 1.00 0.68 S ATOM 1022 CE MET A 390 1.045 -2.875 -1.347 1.00 1.18 C ATOM 0 H MET A 390 5.671 -3.417 1.811 1.00 0.19 H new ATOM 0 HA MET A 390 4.847 -0.894 0.680 1.00 0.20 H new ATOM 0 HB2 MET A 390 3.546 -2.291 -0.495 1.00 0.18 H new ATOM 0 HB3 MET A 390 4.185 -3.638 0.427 1.00 0.18 H new ATOM 0 HG2 MET A 390 2.400 -3.407 2.087 1.00 0.23 H new ATOM 0 HG3 MET A 390 1.797 -1.969 1.287 1.00 0.23 H new ATOM 0 HE1 MET A 390 0.024 -2.494 -1.377 1.00 1.18 H new ATOM 0 HE2 MET A 390 1.741 -2.040 -1.268 1.00 1.18 H new ATOM 0 HE3 MET A 390 1.250 -3.434 -2.260 1.00 1.18 H new ATOM 1032 N SER A 391 3.791 -1.800 3.646 1.00 0.20 N ATOM 1033 CA SER A 391 2.993 -1.427 4.817 1.00 0.21 C ATOM 1034 C SER A 391 3.313 -0.011 5.285 1.00 0.18 C ATOM 1035 O SER A 391 2.510 0.626 5.965 1.00 0.18 O ATOM 1036 CB SER A 391 3.255 -2.387 5.967 1.00 0.26 C ATOM 1037 OG SER A 391 3.036 -3.728 5.590 1.00 0.64 O ATOM 0 H SER A 391 4.391 -2.611 3.794 1.00 0.20 H new ATOM 0 HA SER A 391 1.946 -1.475 4.519 1.00 0.21 H new ATOM 0 HB2 SER A 391 4.282 -2.269 6.312 1.00 0.26 H new ATOM 0 HB3 SER A 391 2.606 -2.135 6.806 1.00 0.26 H new ATOM 0 HG SER A 391 2.196 -3.794 5.089 1.00 0.64 H new ATOM 1043 N ARG A 392 4.494 0.467 4.920 1.00 0.19 N ATOM 1044 CA ARG A 392 4.953 1.788 5.331 1.00 0.20 C ATOM 1045 C ARG A 392 4.010 2.872 4.816 1.00 0.19 C ATOM 1046 O ARG A 392 3.725 3.840 5.519 1.00 0.23 O ATOM 1047 CB ARG A 392 6.375 2.046 4.834 1.00 0.24 C ATOM 1048 CG ARG A 392 7.455 1.307 5.603 1.00 0.52 C ATOM 1049 CD ARG A 392 7.671 1.906 6.980 1.00 0.67 C ATOM 1050 NE ARG A 392 8.763 1.248 7.704 1.00 1.31 N ATOM 1051 CZ ARG A 392 9.762 1.900 8.312 1.00 1.66 C ATOM 1052 NH1 ARG A 392 9.831 3.225 8.265 1.00 1.88 N ATOM 1053 NH2 ARG A 392 10.699 1.227 8.969 1.00 2.48 N ATOM 0 H ARG A 392 5.156 -0.044 4.336 1.00 0.19 H new ATOM 0 HA ARG A 392 4.956 1.819 6.421 1.00 0.20 H new ATOM 0 HB2 ARG A 392 6.436 1.762 3.783 1.00 0.24 H new ATOM 0 HB3 ARG A 392 6.576 3.116 4.887 1.00 0.24 H new ATOM 0 HG2 ARG A 392 7.178 0.257 5.702 1.00 0.52 H new ATOM 0 HG3 ARG A 392 8.389 1.339 5.041 1.00 0.52 H new ATOM 0 HD2 ARG A 392 7.891 2.969 6.882 1.00 0.67 H new ATOM 0 HD3 ARG A 392 6.751 1.823 7.559 1.00 0.67 H new ATOM 0 HE ARG A 392 8.762 0.229 7.747 1.00 1.31 H new ATOM 0 HH11 ARG A 392 9.119 3.755 7.763 1.00 1.88 H new ATOM 0 HH12 ARG A 392 10.596 3.713 8.731 1.00 1.88 H new ATOM 0 HH21 ARG A 392 10.660 0.209 9.012 1.00 2.48 H new ATOM 0 HH22 ARG A 392 11.458 1.728 9.431 1.00 2.48 H new ATOM 1067 N ALA A 393 3.509 2.696 3.595 1.00 0.16 N ATOM 1068 CA ALA A 393 2.559 3.650 3.037 1.00 0.16 C ATOM 1069 C ALA A 393 1.201 3.490 3.720 1.00 0.16 C ATOM 1070 O ALA A 393 0.491 4.465 3.957 1.00 0.19 O ATOM 1071 CB ALA A 393 2.436 3.482 1.524 1.00 0.19 C ATOM 0 H ALA A 393 3.742 1.914 2.983 1.00 0.16 H new ATOM 0 HA ALA A 393 2.927 4.659 3.224 1.00 0.16 H new ATOM 0 HB1 ALA A 393 1.721 4.206 1.134 1.00 0.19 H new ATOM 0 HB2 ALA A 393 3.408 3.646 1.059 1.00 0.19 H new ATOM 0 HB3 ALA A 393 2.091 2.473 1.297 1.00 0.19 H new ATOM 1077 N LEU A 394 0.866 2.246 4.062 1.00 0.15 N ATOM 1078 CA LEU A 394 -0.383 1.930 4.758 1.00 0.18 C ATOM 1079 C LEU A 394 -0.428 2.565 6.143 1.00 0.18 C ATOM 1080 O LEU A 394 -1.491 2.955 6.622 1.00 0.20 O ATOM 1081 CB LEU A 394 -0.537 0.415 4.907 1.00 0.22 C ATOM 1082 CG LEU A 394 -0.743 -0.360 3.612 1.00 0.25 C ATOM 1083 CD1 LEU A 394 -0.486 -1.838 3.853 1.00 0.35 C ATOM 1084 CD2 LEU A 394 -2.159 -0.136 3.075 1.00 0.24 C ATOM 0 H LEU A 394 1.449 1.432 3.866 1.00 0.15 H new ATOM 0 HA LEU A 394 -1.199 2.334 4.159 1.00 0.18 H new ATOM 0 HB2 LEU A 394 0.351 0.025 5.404 1.00 0.22 H new ATOM 0 HB3 LEU A 394 -1.383 0.218 5.565 1.00 0.22 H new ATOM 0 HG LEU A 394 -0.037 0.001 2.864 1.00 0.25 H new ATOM 0 HD11 LEU A 394 -0.634 -2.389 2.924 1.00 0.35 H new ATOM 0 HD12 LEU A 394 0.538 -1.978 4.198 1.00 0.35 H new ATOM 0 HD13 LEU A 394 -1.178 -2.209 4.610 1.00 0.35 H new ATOM 0 HD21 LEU A 394 -2.290 -0.697 2.149 1.00 0.24 H new ATOM 0 HD22 LEU A 394 -2.886 -0.477 3.812 1.00 0.24 H new ATOM 0 HD23 LEU A 394 -2.311 0.926 2.881 1.00 0.24 H new ATOM 1096 N ARG A 395 0.734 2.650 6.780 1.00 0.20 N ATOM 1097 CA ARG A 395 0.845 3.156 8.138 1.00 0.26 C ATOM 1098 C ARG A 395 0.236 4.550 8.280 1.00 0.21 C ATOM 1099 O ARG A 395 -0.398 4.854 9.292 1.00 0.22 O ATOM 1100 CB ARG A 395 2.314 3.174 8.566 1.00 0.36 C ATOM 1101 CG ARG A 395 2.503 3.323 10.058 1.00 0.94 C ATOM 1102 CD ARG A 395 1.956 2.105 10.770 1.00 0.94 C ATOM 1103 NE ARG A 395 2.830 0.938 10.634 1.00 1.59 N ATOM 1104 CZ ARG A 395 2.433 -0.318 10.857 1.00 1.91 C ATOM 1105 NH1 ARG A 395 1.202 -0.563 11.286 1.00 1.87 N ATOM 1106 NH2 ARG A 395 3.273 -1.329 10.671 1.00 2.78 N ATOM 0 H ARG A 395 1.624 2.370 6.368 1.00 0.20 H new ATOM 0 HA ARG A 395 0.282 2.488 8.790 1.00 0.26 H new ATOM 0 HB2 ARG A 395 2.792 2.251 8.237 1.00 0.36 H new ATOM 0 HB3 ARG A 395 2.822 3.994 8.059 1.00 0.36 H new ATOM 0 HG2 ARG A 395 3.561 3.445 10.289 1.00 0.94 H new ATOM 0 HG3 ARG A 395 1.994 4.220 10.410 1.00 0.94 H new ATOM 0 HD2 ARG A 395 1.824 2.335 11.827 1.00 0.94 H new ATOM 0 HD3 ARG A 395 0.971 1.866 10.370 1.00 0.94 H new ATOM 0 HE ARG A 395 3.798 1.093 10.353 1.00 1.59 H new ATOM 0 HH11 ARG A 395 0.555 0.209 11.447 1.00 1.87 H new ATOM 0 HH12 ARG A 395 0.903 -1.523 11.455 1.00 1.87 H new ATOM 0 HH21 ARG A 395 4.226 -1.149 10.356 1.00 2.78 H new ATOM 0 HH22 ARG A 395 2.965 -2.286 10.843 1.00 2.78 H new ATOM 1120 N HIS A 396 0.409 5.387 7.265 1.00 0.20 N ATOM 1121 CA HIS A 396 -0.123 6.742 7.305 1.00 0.19 C ATOM 1122 C HIS A 396 -1.633 6.737 7.144 1.00 0.16 C ATOM 1123 O HIS A 396 -2.325 7.613 7.663 1.00 0.22 O ATOM 1124 CB HIS A 396 0.531 7.612 6.231 1.00 0.24 C ATOM 1125 CG HIS A 396 1.985 7.853 6.488 1.00 0.58 C ATOM 1126 ND1 HIS A 396 2.409 8.859 7.323 1.00 1.29 N ATOM 1127 CD2 HIS A 396 3.064 7.179 6.024 1.00 0.53 C ATOM 1128 CE1 HIS A 396 3.730 8.770 7.351 1.00 1.63 C ATOM 1129 NE2 HIS A 396 4.170 7.768 6.579 1.00 1.17 N ATOM 0 H HIS A 396 0.911 5.153 6.408 1.00 0.20 H new ATOM 0 HA HIS A 396 0.112 7.168 8.281 1.00 0.19 H new ATOM 0 HB2 HIS A 396 0.413 7.132 5.259 1.00 0.24 H new ATOM 0 HB3 HIS A 396 0.012 8.569 6.179 1.00 0.24 H new ATOM 0 HD2 HIS A 396 3.055 6.338 5.346 1.00 0.53 H new ATOM 0 HE1 HIS A 396 4.372 9.423 7.924 1.00 1.63 H new ATOM 0 HE2 HIS A 396 5.142 7.495 6.432 1.00 1.17 H new ATOM 1137 N TYR A 397 -2.144 5.712 6.474 1.00 0.15 N ATOM 1138 CA TYR A 397 -3.563 5.635 6.160 1.00 0.15 C ATOM 1139 C TYR A 397 -4.377 5.363 7.417 1.00 0.18 C ATOM 1140 O TYR A 397 -5.575 5.634 7.455 1.00 0.19 O ATOM 1141 CB TYR A 397 -3.836 4.551 5.109 1.00 0.18 C ATOM 1142 CG TYR A 397 -3.182 4.812 3.765 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -2.263 5.841 3.591 1.00 0.20 C ATOM 1144 CD2 TYR A 397 -3.487 4.026 2.664 1.00 0.26 C ATOM 1145 CE1 TYR A 397 -1.674 6.077 2.374 1.00 0.22 C ATOM 1146 CE2 TYR A 397 -2.898 4.253 1.441 1.00 0.32 C ATOM 1147 CZ TYR A 397 -1.991 5.284 1.298 1.00 0.25 C ATOM 1148 OH TYR A 397 -1.418 5.536 0.074 1.00 0.35 O ATOM 0 H TYR A 397 -1.595 4.921 6.137 1.00 0.15 H new ATOM 0 HA TYR A 397 -3.866 6.597 5.748 1.00 0.15 H new ATOM 0 HB2 TYR A 397 -3.485 3.593 5.492 1.00 0.18 H new ATOM 0 HB3 TYR A 397 -4.913 4.462 4.966 1.00 0.18 H new ATOM 0 HD1 TYR A 397 -2.007 6.468 4.432 1.00 0.20 H new ATOM 0 HD2 TYR A 397 -4.200 3.221 2.768 1.00 0.26 H new ATOM 0 HE1 TYR A 397 -0.964 6.883 2.263 1.00 0.22 H new ATOM 0 HE2 TYR A 397 -3.144 3.627 0.596 1.00 0.32 H new ATOM 0 HH TYR A 397 -0.447 5.620 0.178 1.00 0.35 H new ATOM 1158 N TYR A 398 -3.715 4.837 8.444 1.00 0.24 N ATOM 1159 CA TYR A 398 -4.361 4.594 9.727 1.00 0.29 C ATOM 1160 C TYR A 398 -4.715 5.913 10.403 1.00 0.31 C ATOM 1161 O TYR A 398 -5.799 6.068 10.961 1.00 0.39 O ATOM 1162 CB TYR A 398 -3.450 3.771 10.635 1.00 0.33 C ATOM 1163 CG TYR A 398 -3.155 2.404 10.080 1.00 0.35 C ATOM 1164 CD1 TYR A 398 -4.180 1.608 9.603 1.00 0.41 C ATOM 1165 CD2 TYR A 398 -1.858 1.916 10.020 1.00 0.43 C ATOM 1166 CE1 TYR A 398 -3.929 0.361 9.081 1.00 0.48 C ATOM 1167 CE2 TYR A 398 -1.593 0.664 9.498 1.00 0.49 C ATOM 1168 CZ TYR A 398 -2.634 -0.111 9.026 1.00 0.50 C ATOM 1169 OH TYR A 398 -2.383 -1.359 8.504 1.00 0.60 O ATOM 0 H TYR A 398 -2.731 4.571 8.411 1.00 0.24 H new ATOM 0 HA TYR A 398 -5.279 4.033 9.548 1.00 0.29 H new ATOM 0 HB2 TYR A 398 -2.513 4.307 10.785 1.00 0.33 H new ATOM 0 HB3 TYR A 398 -3.918 3.668 11.614 1.00 0.33 H new ATOM 0 HD1 TYR A 398 -5.196 1.972 9.641 1.00 0.41 H new ATOM 0 HD2 TYR A 398 -1.043 2.523 10.386 1.00 0.43 H new ATOM 0 HE1 TYR A 398 -4.743 -0.247 8.715 1.00 0.48 H new ATOM 0 HE2 TYR A 398 -0.579 0.294 9.460 1.00 0.49 H new ATOM 0 HH TYR A 398 -1.420 -1.540 8.537 1.00 0.60 H new ATOM 1179 N LYS A 399 -3.794 6.870 10.322 1.00 0.28 N ATOM 1180 CA LYS A 399 -3.979 8.181 10.922 1.00 0.32 C ATOM 1181 C LYS A 399 -5.016 8.961 10.143 1.00 0.29 C ATOM 1182 O LYS A 399 -5.786 9.751 10.690 1.00 0.31 O ATOM 1183 CB LYS A 399 -2.658 8.944 10.918 1.00 0.37 C ATOM 1184 CG LYS A 399 -1.621 8.369 11.862 1.00 0.53 C ATOM 1185 CD LYS A 399 -1.140 6.989 11.451 1.00 0.68 C ATOM 1186 CE LYS A 399 -0.121 6.440 12.434 1.00 1.31 C ATOM 1187 NZ LYS A 399 1.131 7.244 12.453 1.00 1.98 N ATOM 0 H LYS A 399 -2.903 6.756 9.840 1.00 0.28 H new ATOM 0 HA LYS A 399 -4.319 8.055 11.950 1.00 0.32 H new ATOM 0 HB2 LYS A 399 -2.253 8.947 9.906 1.00 0.37 H new ATOM 0 HB3 LYS A 399 -2.847 9.983 11.189 1.00 0.37 H new ATOM 0 HG2 LYS A 399 -0.767 9.045 11.910 1.00 0.53 H new ATOM 0 HG3 LYS A 399 -2.042 8.316 12.866 1.00 0.53 H new ATOM 0 HD2 LYS A 399 -1.990 6.310 11.389 1.00 0.68 H new ATOM 0 HD3 LYS A 399 -0.698 7.038 10.456 1.00 0.68 H new ATOM 0 HE2 LYS A 399 -0.555 6.423 13.434 1.00 1.31 H new ATOM 0 HE3 LYS A 399 0.115 5.409 12.172 1.00 1.31 H new ATOM 0 HZ1 LYS A 399 1.867 6.728 12.976 1.00 1.98 H new ATOM 0 HZ2 LYS A 399 1.451 7.411 11.478 1.00 1.98 H new ATOM 0 HZ3 LYS A 399 0.951 8.156 12.919 1.00 1.98 H new ATOM 1201 N LEU A 400 -5.020 8.709 8.852 1.00 0.25 N ATOM 1202 CA LEU A 400 -5.962 9.332 7.940 1.00 0.23 C ATOM 1203 C LEU A 400 -7.326 8.681 8.060 1.00 0.22 C ATOM 1204 O LEU A 400 -8.327 9.209 7.575 1.00 0.26 O ATOM 1205 CB LEU A 400 -5.465 9.181 6.510 1.00 0.22 C ATOM 1206 CG LEU A 400 -4.048 9.670 6.269 1.00 0.25 C ATOM 1207 CD1 LEU A 400 -3.470 9.024 5.031 1.00 0.23 C ATOM 1208 CD2 LEU A 400 -4.042 11.169 6.122 1.00 0.36 C ATOM 0 H LEU A 400 -4.370 8.065 8.402 1.00 0.25 H new ATOM 0 HA LEU A 400 -6.046 10.388 8.196 1.00 0.23 H new ATOM 0 HB2 LEU A 400 -5.523 8.129 6.230 1.00 0.22 H new ATOM 0 HB3 LEU A 400 -6.139 9.725 5.848 1.00 0.22 H new ATOM 0 HG LEU A 400 -3.431 9.393 7.124 1.00 0.25 H new ATOM 0 HD11 LEU A 400 -2.454 9.385 4.873 1.00 0.23 H new ATOM 0 HD12 LEU A 400 -3.454 7.942 5.159 1.00 0.23 H new ATOM 0 HD13 LEU A 400 -4.084 9.278 4.167 1.00 0.23 H new ATOM 0 HD21 LEU A 400 -3.022 11.514 5.949 1.00 0.36 H new ATOM 0 HD22 LEU A 400 -4.669 11.454 5.278 1.00 0.36 H new ATOM 0 HD23 LEU A 400 -4.430 11.625 7.033 1.00 0.36 H new ATOM 1220 N ASN A 401 -7.339 7.522 8.715 1.00 0.22 N ATOM 1221 CA ASN A 401 -8.535 6.702 8.853 1.00 0.24 C ATOM 1222 C ASN A 401 -9.086 6.334 7.481 1.00 0.19 C ATOM 1223 O ASN A 401 -10.289 6.223 7.281 1.00 0.23 O ATOM 1224 CB ASN A 401 -9.585 7.402 9.722 1.00 0.33 C ATOM 1225 CG ASN A 401 -9.242 7.319 11.201 1.00 1.01 C ATOM 1226 OD1 ASN A 401 -9.673 6.402 11.899 1.00 1.77 O ATOM 1227 ND2 ASN A 401 -8.449 8.262 11.686 1.00 1.24 N ATOM 0 H ASN A 401 -6.515 7.126 9.166 1.00 0.22 H new ATOM 0 HA ASN A 401 -8.266 5.776 9.362 1.00 0.24 H new ATOM 0 HB2 ASN A 401 -9.663 8.448 9.425 1.00 0.33 H new ATOM 0 HB3 ASN A 401 -10.561 6.948 9.549 1.00 0.33 H new ATOM 0 HD21 ASN A 401 -8.176 8.243 12.669 1.00 1.24 H new ATOM 0 HD22 ASN A 401 -8.111 9.007 11.077 1.00 1.24 H new ATOM 1234 N ILE A 402 -8.171 6.166 6.534 1.00 0.15 N ATOM 1235 CA ILE A 402 -8.500 5.685 5.203 1.00 0.13 C ATOM 1236 C ILE A 402 -8.696 4.185 5.247 1.00 0.13 C ATOM 1237 O ILE A 402 -9.673 3.650 4.726 1.00 0.15 O ATOM 1238 CB ILE A 402 -7.366 6.030 4.210 1.00 0.12 C ATOM 1239 CG1 ILE A 402 -7.315 7.540 3.992 1.00 0.13 C ATOM 1240 CG2 ILE A 402 -7.532 5.292 2.881 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -6.100 7.992 3.223 1.00 0.14 C ATOM 0 H ILE A 402 -7.179 6.361 6.670 1.00 0.15 H new ATOM 0 HA ILE A 402 -9.418 6.168 4.868 1.00 0.13 H new ATOM 0 HB ILE A 402 -6.422 5.699 4.642 1.00 0.12 H new ATOM 0 HG12 ILE A 402 -8.212 7.853 3.457 1.00 0.13 H new ATOM 0 HG13 ILE A 402 -7.330 8.040 4.960 1.00 0.13 H new ATOM 0 HG21 ILE A 402 -6.716 5.561 2.211 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -7.517 4.217 3.058 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -8.482 5.571 2.426 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.127 9.075 3.104 1.00 0.14 H new ATOM 0 HD12 ILE A 402 -5.199 7.709 3.767 1.00 0.14 H new ATOM 0 HD13 ILE A 402 -6.094 7.519 2.241 1.00 0.14 H new ATOM 1253 N ILE A 403 -7.765 3.524 5.905 1.00 0.14 N ATOM 1254 CA ILE A 403 -7.765 2.084 6.006 1.00 0.14 C ATOM 1255 C ILE A 403 -7.592 1.673 7.454 1.00 0.17 C ATOM 1256 O ILE A 403 -6.677 2.135 8.131 1.00 0.26 O ATOM 1257 CB ILE A 403 -6.625 1.481 5.157 1.00 0.16 C ATOM 1258 CG1 ILE A 403 -6.863 1.759 3.674 1.00 0.16 C ATOM 1259 CG2 ILE A 403 -6.489 -0.013 5.408 1.00 0.18 C ATOM 1260 CD1 ILE A 403 -5.686 1.408 2.794 1.00 0.20 C ATOM 0 H ILE A 403 -6.986 3.975 6.385 1.00 0.14 H new ATOM 0 HA ILE A 403 -8.717 1.709 5.631 1.00 0.14 H new ATOM 0 HB ILE A 403 -5.690 1.957 5.454 1.00 0.16 H new ATOM 0 HG12 ILE A 403 -7.734 1.194 3.343 1.00 0.16 H new ATOM 0 HG13 ILE A 403 -7.100 2.815 3.545 1.00 0.16 H new ATOM 0 HG21 ILE A 403 -5.679 -0.412 4.798 1.00 0.18 H new ATOM 0 HG22 ILE A 403 -6.269 -0.186 6.461 1.00 0.18 H new ATOM 0 HG23 ILE A 403 -7.422 -0.512 5.145 1.00 0.18 H new ATOM 0 HD11 ILE A 403 -5.929 1.632 1.755 1.00 0.20 H new ATOM 0 HD12 ILE A 403 -4.817 1.992 3.098 1.00 0.20 H new ATOM 0 HD13 ILE A 403 -5.462 0.346 2.893 1.00 0.20 H new ATOM 1272 N ARG A 404 -8.491 0.840 7.935 1.00 0.14 N ATOM 1273 CA ARG A 404 -8.369 0.282 9.267 1.00 0.18 C ATOM 1274 C ARG A 404 -8.342 -1.230 9.165 1.00 0.20 C ATOM 1275 O ARG A 404 -8.635 -1.788 8.112 1.00 0.28 O ATOM 1276 CB ARG A 404 -9.531 0.721 10.162 1.00 0.27 C ATOM 1277 CG ARG A 404 -10.792 -0.082 9.964 1.00 0.45 C ATOM 1278 CD ARG A 404 -11.483 -0.326 11.289 1.00 0.76 C ATOM 1279 NE ARG A 404 -12.620 -1.234 11.148 1.00 1.16 N ATOM 1280 CZ ARG A 404 -13.617 -1.345 12.022 1.00 1.23 C ATOM 1281 NH1 ARG A 404 -13.720 -0.511 13.047 1.00 1.04 N ATOM 1282 NH2 ARG A 404 -14.526 -2.296 11.853 1.00 2.08 N ATOM 0 H ARG A 404 -9.317 0.533 7.422 1.00 0.14 H new ATOM 0 HA ARG A 404 -7.445 0.647 9.717 1.00 0.18 H new ATOM 0 HB2 ARG A 404 -9.223 0.644 11.205 1.00 0.27 H new ATOM 0 HB3 ARG A 404 -9.747 1.772 9.970 1.00 0.27 H new ATOM 0 HG2 ARG A 404 -11.465 0.448 9.289 1.00 0.45 H new ATOM 0 HG3 ARG A 404 -10.552 -1.035 9.492 1.00 0.45 H new ATOM 0 HD2 ARG A 404 -10.770 -0.744 12.000 1.00 0.76 H new ATOM 0 HD3 ARG A 404 -11.825 0.623 11.701 1.00 0.76 H new ATOM 0 HE ARG A 404 -12.651 -1.826 10.318 1.00 1.16 H new ATOM 0 HH11 ARG A 404 -13.029 0.229 13.174 1.00 1.04 H new ATOM 0 HH12 ARG A 404 -14.490 -0.609 13.709 1.00 1.04 H new ATOM 0 HH21 ARG A 404 -14.456 -2.933 11.059 1.00 2.08 H new ATOM 0 HH22 ARG A 404 -15.295 -2.391 12.517 1.00 2.08 H new ATOM 1296 N LYS A 405 -7.969 -1.883 10.243 1.00 0.24 N ATOM 1297 CA LYS A 405 -7.981 -3.331 10.292 1.00 0.26 C ATOM 1298 C LYS A 405 -9.239 -3.810 10.990 1.00 0.27 C ATOM 1299 O LYS A 405 -9.556 -3.339 12.083 1.00 0.34 O ATOM 1300 CB LYS A 405 -6.756 -3.843 11.045 1.00 0.31 C ATOM 1301 CG LYS A 405 -5.462 -3.711 10.272 1.00 0.58 C ATOM 1302 CD LYS A 405 -4.258 -3.890 11.176 1.00 0.69 C ATOM 1303 CE LYS A 405 -4.293 -5.208 11.923 1.00 1.31 C ATOM 1304 NZ LYS A 405 -4.005 -6.367 11.040 1.00 1.73 N ATOM 0 H LYS A 405 -7.652 -1.433 11.102 1.00 0.24 H new ATOM 0 HA LYS A 405 -7.960 -3.717 9.273 1.00 0.26 H new ATOM 0 HB2 LYS A 405 -6.664 -3.297 11.984 1.00 0.31 H new ATOM 0 HB3 LYS A 405 -6.910 -4.891 11.300 1.00 0.31 H new ATOM 0 HG2 LYS A 405 -5.435 -4.454 9.475 1.00 0.58 H new ATOM 0 HG3 LYS A 405 -5.419 -2.732 9.796 1.00 0.58 H new ATOM 0 HD2 LYS A 405 -3.347 -3.837 10.580 1.00 0.69 H new ATOM 0 HD3 LYS A 405 -4.219 -3.069 11.892 1.00 0.69 H new ATOM 0 HE2 LYS A 405 -3.565 -5.183 12.734 1.00 1.31 H new ATOM 0 HE3 LYS A 405 -5.274 -5.338 12.380 1.00 1.31 H new ATOM 0 HZ1 LYS A 405 -3.740 -7.188 11.620 1.00 1.73 H new ATOM 0 HZ2 LYS A 405 -4.852 -6.597 10.481 1.00 1.73 H new ATOM 0 HZ3 LYS A 405 -3.221 -6.129 10.399 1.00 1.73 H new ATOM 1318 N GLU A 406 -9.957 -4.727 10.360 1.00 0.26 N ATOM 1319 CA GLU A 406 -11.125 -5.320 10.985 1.00 0.27 C ATOM 1320 C GLU A 406 -10.736 -6.047 12.273 1.00 0.29 C ATOM 1321 O GLU A 406 -9.608 -6.525 12.407 1.00 0.33 O ATOM 1322 CB GLU A 406 -11.821 -6.253 10.022 1.00 0.26 C ATOM 1323 CG GLU A 406 -12.600 -5.512 8.961 1.00 0.28 C ATOM 1324 CD GLU A 406 -13.181 -4.197 9.447 1.00 0.56 C ATOM 1325 OE1 GLU A 406 -12.464 -3.171 9.418 1.00 0.81 O ATOM 1326 OE2 GLU A 406 -14.346 -4.176 9.873 1.00 0.84 O ATOM 0 H GLU A 406 -9.752 -5.074 9.423 1.00 0.26 H new ATOM 0 HA GLU A 406 -11.821 -4.524 11.248 1.00 0.27 H new ATOM 0 HB2 GLU A 406 -11.081 -6.895 9.544 1.00 0.26 H new ATOM 0 HB3 GLU A 406 -12.497 -6.904 10.576 1.00 0.26 H new ATOM 0 HG2 GLU A 406 -11.947 -5.320 8.110 1.00 0.28 H new ATOM 0 HG3 GLU A 406 -13.410 -6.149 8.604 1.00 0.28 H new ATOM 1333 N PRO A 407 -11.669 -6.133 13.235 1.00 0.34 N ATOM 1334 CA PRO A 407 -11.406 -6.666 14.581 1.00 0.38 C ATOM 1335 C PRO A 407 -10.859 -8.094 14.578 1.00 0.41 C ATOM 1336 O PRO A 407 -11.557 -9.042 14.206 1.00 0.44 O ATOM 1337 CB PRO A 407 -12.786 -6.619 15.249 1.00 0.43 C ATOM 1338 CG PRO A 407 -13.750 -6.568 14.122 1.00 0.48 C ATOM 1339 CD PRO A 407 -13.073 -5.727 13.090 1.00 0.45 C ATOM 0 HA PRO A 407 -10.637 -6.089 15.094 1.00 0.38 H new ATOM 0 HB2 PRO A 407 -12.953 -7.496 15.874 1.00 0.43 H new ATOM 0 HB3 PRO A 407 -12.884 -5.746 15.894 1.00 0.43 H new ATOM 0 HG2 PRO A 407 -13.968 -7.566 13.741 1.00 0.48 H new ATOM 0 HG3 PRO A 407 -14.699 -6.130 14.431 1.00 0.48 H new ATOM 0 HD2 PRO A 407 -13.454 -5.926 12.088 1.00 0.45 H new ATOM 0 HD3 PRO A 407 -13.211 -4.662 13.277 1.00 0.45 H new ATOM 1347 N GLY A 408 -9.606 -8.234 15.008 1.00 0.51 N ATOM 1348 CA GLY A 408 -8.977 -9.539 15.095 1.00 0.60 C ATOM 1349 C GLY A 408 -8.685 -10.134 13.734 1.00 0.56 C ATOM 1350 O GLY A 408 -8.829 -11.340 13.528 1.00 0.66 O ATOM 0 H GLY A 408 -9.012 -7.458 15.300 1.00 0.51 H new ATOM 0 HA2 GLY A 408 -8.047 -9.454 15.658 1.00 0.60 H new ATOM 0 HA3 GLY A 408 -9.626 -10.215 15.652 1.00 0.60 H new ATOM 1354 N GLN A 409 -8.264 -9.295 12.804 1.00 0.53 N ATOM 1355 CA GLN A 409 -8.024 -9.735 11.441 1.00 0.52 C ATOM 1356 C GLN A 409 -6.544 -9.749 11.100 1.00 0.48 C ATOM 1357 O GLN A 409 -5.739 -9.043 11.708 1.00 0.62 O ATOM 1358 CB GLN A 409 -8.745 -8.829 10.452 1.00 0.67 C ATOM 1359 CG GLN A 409 -10.230 -9.112 10.297 1.00 0.77 C ATOM 1360 CD GLN A 409 -10.519 -10.492 9.770 1.00 0.90 C ATOM 1361 OE1 GLN A 409 -9.669 -11.130 9.145 1.00 1.81 O ATOM 1362 NE2 GLN A 409 -11.752 -10.920 9.941 1.00 1.10 N ATOM 0 H GLN A 409 -8.081 -8.305 12.968 1.00 0.53 H new ATOM 0 HA GLN A 409 -8.408 -10.752 11.367 1.00 0.52 H new ATOM 0 HB2 GLN A 409 -8.617 -7.794 10.769 1.00 0.67 H new ATOM 0 HB3 GLN A 409 -8.267 -8.925 9.477 1.00 0.67 H new ATOM 0 HG2 GLN A 409 -10.719 -8.989 11.263 1.00 0.77 H new ATOM 0 HG3 GLN A 409 -10.665 -8.374 9.623 1.00 0.77 H new ATOM 0 HE21 GLN A 409 -12.420 -10.355 10.466 1.00 1.10 H new ATOM 0 HE22 GLN A 409 -12.040 -11.816 9.548 1.00 1.10 H new ATOM 1371 N ARG A 410 -6.199 -10.552 10.106 1.00 0.44 N ATOM 1372 CA ARG A 410 -4.844 -10.572 9.583 1.00 0.41 C ATOM 1373 C ARG A 410 -4.623 -9.389 8.646 1.00 0.34 C ATOM 1374 O ARG A 410 -4.366 -8.270 9.083 1.00 0.49 O ATOM 1375 CB ARG A 410 -4.531 -11.890 8.855 1.00 0.45 C ATOM 1376 CG ARG A 410 -5.722 -12.817 8.625 1.00 0.57 C ATOM 1377 CD ARG A 410 -6.698 -12.298 7.567 1.00 0.62 C ATOM 1378 NE ARG A 410 -6.068 -12.091 6.254 1.00 0.96 N ATOM 1379 CZ ARG A 410 -5.484 -13.058 5.531 1.00 1.65 C ATOM 1380 NH1 ARG A 410 -5.531 -14.322 5.935 1.00 2.14 N ATOM 1381 NH2 ARG A 410 -4.884 -12.757 4.382 1.00 2.29 N ATOM 0 H ARG A 410 -6.840 -11.199 9.646 1.00 0.44 H new ATOM 0 HA ARG A 410 -4.163 -10.493 10.431 1.00 0.41 H new ATOM 0 HB2 ARG A 410 -4.086 -11.653 7.888 1.00 0.45 H new ATOM 0 HB3 ARG A 410 -3.778 -12.431 9.429 1.00 0.45 H new ATOM 0 HG2 ARG A 410 -5.357 -13.798 8.322 1.00 0.57 H new ATOM 0 HG3 ARG A 410 -6.255 -12.952 9.566 1.00 0.57 H new ATOM 0 HD2 ARG A 410 -7.520 -13.006 7.461 1.00 0.62 H new ATOM 0 HD3 ARG A 410 -7.129 -11.357 7.909 1.00 0.62 H new ATOM 0 HE ARG A 410 -6.076 -11.147 5.867 1.00 0.96 H new ATOM 0 HH11 ARG A 410 -6.014 -14.563 6.801 1.00 2.14 H new ATOM 0 HH12 ARG A 410 -5.084 -15.052 5.380 1.00 2.14 H new ATOM 0 HH21 ARG A 410 -4.869 -11.792 4.052 1.00 2.29 H new ATOM 0 HH22 ARG A 410 -4.439 -13.491 3.831 1.00 2.29 H new ATOM 1395 N LEU A 411 -4.765 -9.636 7.355 1.00 0.21 N ATOM 1396 CA LEU A 411 -4.641 -8.587 6.358 1.00 0.15 C ATOM 1397 C LEU A 411 -6.016 -8.159 5.872 1.00 0.11 C ATOM 1398 O LEU A 411 -6.194 -7.780 4.714 1.00 0.12 O ATOM 1399 CB LEU A 411 -3.767 -9.034 5.188 1.00 0.14 C ATOM 1400 CG LEU A 411 -2.317 -9.330 5.555 1.00 0.17 C ATOM 1401 CD1 LEU A 411 -1.959 -10.773 5.243 1.00 0.20 C ATOM 1402 CD2 LEU A 411 -1.396 -8.380 4.816 1.00 0.16 C ATOM 0 H LEU A 411 -4.967 -10.559 6.971 1.00 0.21 H new ATOM 0 HA LEU A 411 -4.153 -7.731 6.824 1.00 0.15 H new ATOM 0 HB2 LEU A 411 -4.206 -9.928 4.745 1.00 0.14 H new ATOM 0 HB3 LEU A 411 -3.783 -8.258 4.423 1.00 0.14 H new ATOM 0 HG LEU A 411 -2.193 -9.182 6.628 1.00 0.17 H new ATOM 0 HD11 LEU A 411 -0.919 -10.957 5.514 1.00 0.20 H new ATOM 0 HD12 LEU A 411 -2.606 -11.440 5.813 1.00 0.20 H new ATOM 0 HD13 LEU A 411 -2.094 -10.959 4.178 1.00 0.20 H new ATOM 0 HD21 LEU A 411 -0.361 -8.596 5.082 1.00 0.16 H new ATOM 0 HD22 LEU A 411 -1.529 -8.507 3.742 1.00 0.16 H new ATOM 0 HD23 LEU A 411 -1.635 -7.353 5.092 1.00 0.16 H new ATOM 1414 N LEU A 412 -6.999 -8.279 6.752 1.00 0.12 N ATOM 1415 CA LEU A 412 -8.342 -7.824 6.455 1.00 0.10 C ATOM 1416 C LEU A 412 -8.496 -6.390 6.888 1.00 0.09 C ATOM 1417 O LEU A 412 -8.382 -6.062 8.072 1.00 0.10 O ATOM 1418 CB LEU A 412 -9.376 -8.683 7.157 1.00 0.12 C ATOM 1419 CG LEU A 412 -10.552 -9.121 6.303 1.00 0.13 C ATOM 1420 CD1 LEU A 412 -10.873 -8.065 5.280 1.00 0.12 C ATOM 1421 CD2 LEU A 412 -10.240 -10.436 5.637 1.00 0.15 C ATOM 0 H LEU A 412 -6.888 -8.689 7.679 1.00 0.12 H new ATOM 0 HA LEU A 412 -8.503 -7.905 5.380 1.00 0.10 H new ATOM 0 HB2 LEU A 412 -8.880 -9.573 7.545 1.00 0.12 H new ATOM 0 HB3 LEU A 412 -9.759 -8.131 8.016 1.00 0.12 H new ATOM 0 HG LEU A 412 -11.427 -9.255 6.939 1.00 0.13 H new ATOM 0 HD11 LEU A 412 -11.718 -8.391 4.674 1.00 0.12 H new ATOM 0 HD12 LEU A 412 -11.127 -7.134 5.786 1.00 0.12 H new ATOM 0 HD13 LEU A 412 -10.007 -7.905 4.638 1.00 0.12 H new ATOM 0 HD21 LEU A 412 -11.088 -10.745 5.026 1.00 0.15 H new ATOM 0 HD22 LEU A 412 -9.359 -10.324 5.005 1.00 0.15 H new ATOM 0 HD23 LEU A 412 -10.047 -11.192 6.398 1.00 0.15 H new ATOM 1433 N PHE A 413 -8.763 -5.548 5.921 1.00 0.09 N ATOM 1434 CA PHE A 413 -8.738 -4.116 6.137 1.00 0.10 C ATOM 1435 C PHE A 413 -10.054 -3.493 5.715 1.00 0.09 C ATOM 1436 O PHE A 413 -10.963 -4.185 5.255 1.00 0.10 O ATOM 1437 CB PHE A 413 -7.586 -3.460 5.368 1.00 0.12 C ATOM 1438 CG PHE A 413 -6.238 -4.095 5.585 1.00 0.11 C ATOM 1439 CD1 PHE A 413 -5.943 -4.766 6.759 1.00 0.12 C ATOM 1440 CD2 PHE A 413 -5.270 -4.023 4.604 1.00 0.12 C ATOM 1441 CE1 PHE A 413 -4.709 -5.352 6.950 1.00 0.13 C ATOM 1442 CE2 PHE A 413 -4.036 -4.606 4.788 1.00 0.13 C ATOM 1443 CZ PHE A 413 -3.753 -5.270 5.964 1.00 0.14 C ATOM 0 H PHE A 413 -9.002 -5.828 4.970 1.00 0.09 H new ATOM 0 HA PHE A 413 -8.585 -3.944 7.202 1.00 0.10 H new ATOM 0 HB2 PHE A 413 -7.817 -3.487 4.303 1.00 0.12 H new ATOM 0 HB3 PHE A 413 -7.528 -2.410 5.655 1.00 0.12 H new ATOM 0 HD1 PHE A 413 -6.690 -4.832 7.537 1.00 0.12 H new ATOM 0 HD2 PHE A 413 -5.483 -3.503 3.681 1.00 0.12 H new ATOM 0 HE1 PHE A 413 -4.494 -5.874 7.871 1.00 0.13 H new ATOM 0 HE2 PHE A 413 -3.289 -4.543 4.011 1.00 0.13 H new ATOM 0 HZ PHE A 413 -2.784 -5.724 6.110 1.00 0.14 H new ATOM 1453 N ARG A 414 -10.140 -2.186 5.857 1.00 0.11 N ATOM 1454 CA ARG A 414 -11.386 -1.480 5.644 1.00 0.10 C ATOM 1455 C ARG A 414 -11.142 -0.082 5.092 1.00 0.09 C ATOM 1456 O ARG A 414 -10.563 0.768 5.770 1.00 0.12 O ATOM 1457 CB ARG A 414 -12.113 -1.404 6.981 1.00 0.16 C ATOM 1458 CG ARG A 414 -13.464 -0.719 6.963 1.00 0.22 C ATOM 1459 CD ARG A 414 -14.112 -0.854 8.329 1.00 0.35 C ATOM 1460 NE ARG A 414 -15.470 -0.342 8.371 1.00 0.99 N ATOM 1461 CZ ARG A 414 -16.505 -1.019 8.865 1.00 1.11 C ATOM 1462 NH1 ARG A 414 -16.345 -2.256 9.324 1.00 1.13 N ATOM 1463 NH2 ARG A 414 -17.703 -0.459 8.900 1.00 2.09 N ATOM 0 H ARG A 414 -9.356 -1.589 6.121 1.00 0.11 H new ATOM 0 HA ARG A 414 -11.989 -2.013 4.909 1.00 0.10 H new ATOM 0 HB2 ARG A 414 -12.247 -2.418 7.358 1.00 0.16 H new ATOM 0 HB3 ARG A 414 -11.472 -0.882 7.692 1.00 0.16 H new ATOM 0 HG2 ARG A 414 -13.348 0.334 6.705 1.00 0.22 H new ATOM 0 HG3 ARG A 414 -14.101 -1.166 6.200 1.00 0.22 H new ATOM 0 HD2 ARG A 414 -14.118 -1.905 8.619 1.00 0.35 H new ATOM 0 HD3 ARG A 414 -13.508 -0.323 9.065 1.00 0.35 H new ATOM 0 HE ARG A 414 -15.642 0.592 8.000 1.00 0.99 H new ATOM 0 HH11 ARG A 414 -15.424 -2.694 9.300 1.00 1.13 H new ATOM 0 HH12 ARG A 414 -17.143 -2.767 9.701 1.00 1.13 H new ATOM 0 HH21 ARG A 414 -17.833 0.490 8.549 1.00 2.09 H new ATOM 0 HH22 ARG A 414 -18.497 -0.976 9.278 1.00 2.09 H new ATOM 1477 N PHE A 415 -11.576 0.139 3.859 1.00 0.10 N ATOM 1478 CA PHE A 415 -11.527 1.463 3.249 1.00 0.11 C ATOM 1479 C PHE A 415 -12.658 2.327 3.796 1.00 0.12 C ATOM 1480 O PHE A 415 -13.772 2.308 3.273 1.00 0.18 O ATOM 1481 CB PHE A 415 -11.652 1.383 1.720 1.00 0.14 C ATOM 1482 CG PHE A 415 -10.371 1.090 0.985 1.00 0.15 C ATOM 1483 CD1 PHE A 415 -9.397 2.069 0.858 1.00 0.17 C ATOM 1484 CD2 PHE A 415 -10.149 -0.149 0.398 1.00 0.17 C ATOM 1485 CE1 PHE A 415 -8.230 1.820 0.168 1.00 0.20 C ATOM 1486 CE2 PHE A 415 -8.977 -0.405 -0.295 1.00 0.20 C ATOM 1487 CZ PHE A 415 -8.017 0.583 -0.409 1.00 0.21 C ATOM 0 H PHE A 415 -11.968 -0.585 3.257 1.00 0.10 H new ATOM 0 HA PHE A 415 -10.562 1.906 3.495 1.00 0.11 H new ATOM 0 HB2 PHE A 415 -12.379 0.610 1.471 1.00 0.14 H new ATOM 0 HB3 PHE A 415 -12.053 2.328 1.355 1.00 0.14 H new ATOM 0 HD1 PHE A 415 -9.555 3.039 1.306 1.00 0.17 H new ATOM 0 HD2 PHE A 415 -10.899 -0.922 0.483 1.00 0.17 H new ATOM 0 HE1 PHE A 415 -7.481 2.593 0.078 1.00 0.20 H new ATOM 0 HE2 PHE A 415 -8.814 -1.373 -0.745 1.00 0.20 H new ATOM 0 HZ PHE A 415 -7.102 0.388 -0.948 1.00 0.21 H new ATOM 1497 N MET A 416 -12.382 3.070 4.855 1.00 0.14 N ATOM 1498 CA MET A 416 -13.385 3.952 5.443 1.00 0.17 C ATOM 1499 C MET A 416 -13.813 5.009 4.434 1.00 0.20 C ATOM 1500 O MET A 416 -14.989 5.360 4.341 1.00 0.29 O ATOM 1501 CB MET A 416 -12.856 4.631 6.706 1.00 0.23 C ATOM 1502 CG MET A 416 -12.666 3.697 7.889 1.00 0.30 C ATOM 1503 SD MET A 416 -12.161 4.582 9.379 1.00 1.30 S ATOM 1504 CE MET A 416 -12.174 3.267 10.592 1.00 1.23 C ATOM 0 H MET A 416 -11.477 3.083 5.326 1.00 0.14 H new ATOM 0 HA MET A 416 -14.245 3.341 5.717 1.00 0.17 H new ATOM 0 HB2 MET A 416 -11.902 5.105 6.476 1.00 0.23 H new ATOM 0 HB3 MET A 416 -13.546 5.425 6.993 1.00 0.23 H new ATOM 0 HG2 MET A 416 -13.597 3.164 8.083 1.00 0.30 H new ATOM 0 HG3 MET A 416 -11.915 2.947 7.641 1.00 0.30 H new ATOM 0 HE1 MET A 416 -12.907 3.493 11.366 1.00 1.23 H new ATOM 0 HE2 MET A 416 -12.437 2.327 10.107 1.00 1.23 H new ATOM 0 HE3 MET A 416 -11.186 3.179 11.043 1.00 1.23 H new ATOM 1514 N LYS A 417 -12.852 5.505 3.675 1.00 0.18 N ATOM 1515 CA LYS A 417 -13.134 6.463 2.626 1.00 0.21 C ATOM 1516 C LYS A 417 -12.394 6.098 1.351 1.00 0.22 C ATOM 1517 O LYS A 417 -11.369 5.415 1.377 1.00 0.26 O ATOM 1518 CB LYS A 417 -12.777 7.887 3.054 1.00 0.22 C ATOM 1519 CG LYS A 417 -11.381 8.040 3.622 1.00 0.18 C ATOM 1520 CD LYS A 417 -11.012 9.508 3.772 1.00 0.20 C ATOM 1521 CE LYS A 417 -10.006 9.729 4.887 1.00 0.36 C ATOM 1522 NZ LYS A 417 -10.645 9.650 6.229 1.00 0.61 N ATOM 0 H LYS A 417 -11.867 5.258 3.768 1.00 0.18 H new ATOM 0 HA LYS A 417 -14.206 6.429 2.433 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -12.880 8.548 2.194 1.00 0.22 H new ATOM 0 HB3 LYS A 417 -13.498 8.220 3.800 1.00 0.22 H new ATOM 0 HG2 LYS A 417 -11.323 7.546 4.592 1.00 0.18 H new ATOM 0 HG3 LYS A 417 -10.662 7.546 2.969 1.00 0.18 H new ATOM 0 HD2 LYS A 417 -10.599 9.876 2.833 1.00 0.20 H new ATOM 0 HD3 LYS A 417 -11.912 10.089 3.974 1.00 0.20 H new ATOM 0 HE2 LYS A 417 -9.215 8.983 4.816 1.00 0.36 H new ATOM 0 HE3 LYS A 417 -9.536 10.705 4.765 1.00 0.36 H new ATOM 0 HZ1 LYS A 417 -9.981 9.222 6.905 1.00 0.61 H new ATOM 0 HZ2 LYS A 417 -10.898 10.606 6.550 1.00 0.61 H new ATOM 0 HZ3 LYS A 417 -11.504 9.066 6.171 1.00 0.61 H new ATOM 1536 N THR A 418 -12.931 6.565 0.244 1.00 0.24 N ATOM 1537 CA THR A 418 -12.417 6.232 -1.075 1.00 0.26 C ATOM 1538 C THR A 418 -11.566 7.375 -1.638 1.00 0.23 C ATOM 1539 O THR A 418 -11.538 8.457 -1.052 1.00 0.21 O ATOM 1540 CB THR A 418 -13.586 5.930 -2.034 1.00 0.34 C ATOM 1541 OG1 THR A 418 -14.529 7.009 -2.004 1.00 0.37 O ATOM 1542 CG2 THR A 418 -14.278 4.631 -1.651 1.00 0.40 C ATOM 0 H THR A 418 -13.738 7.188 0.229 1.00 0.24 H new ATOM 0 HA THR A 418 -11.786 5.348 -0.982 1.00 0.26 H new ATOM 0 HB THR A 418 -13.186 5.823 -3.042 1.00 0.34 H new ATOM 0 HG1 THR A 418 -14.914 7.082 -1.106 1.00 0.37 H new ATOM 0 HG21 THR A 418 -15.099 4.439 -2.342 1.00 0.40 H new ATOM 0 HG22 THR A 418 -13.563 3.810 -1.700 1.00 0.40 H new ATOM 0 HG23 THR A 418 -14.669 4.712 -0.637 1.00 0.40 H new ATOM 1550 N PRO A 419 -10.855 7.146 -2.770 1.00 0.24 N ATOM 1551 CA PRO A 419 -10.040 8.169 -3.449 1.00 0.24 C ATOM 1552 C PRO A 419 -10.680 9.550 -3.449 1.00 0.28 C ATOM 1553 O PRO A 419 -10.057 10.545 -3.070 1.00 0.28 O ATOM 1554 CB PRO A 419 -9.987 7.635 -4.875 1.00 0.29 C ATOM 1555 CG PRO A 419 -9.979 6.156 -4.724 1.00 0.30 C ATOM 1556 CD PRO A 419 -10.780 5.851 -3.480 1.00 0.28 C ATOM 0 HA PRO A 419 -9.076 8.310 -2.961 1.00 0.24 H new ATOM 0 HB2 PRO A 419 -10.847 7.969 -5.455 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -9.096 7.985 -5.396 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -10.419 5.674 -5.597 1.00 0.30 H new ATOM 0 HG3 PRO A 419 -8.960 5.780 -4.632 1.00 0.30 H new ATOM 0 HD2 PRO A 419 -11.773 5.475 -3.728 1.00 0.28 H new ATOM 0 HD3 PRO A 419 -10.294 5.090 -2.870 1.00 0.28 H new ATOM 1564 N ASP A 420 -11.937 9.579 -3.861 1.00 0.34 N ATOM 1565 CA ASP A 420 -12.712 10.814 -3.952 1.00 0.43 C ATOM 1566 C ASP A 420 -12.739 11.558 -2.618 1.00 0.40 C ATOM 1567 O ASP A 420 -12.582 12.777 -2.566 1.00 0.44 O ATOM 1568 CB ASP A 420 -14.138 10.485 -4.395 1.00 0.55 C ATOM 1569 CG ASP A 420 -15.082 11.663 -4.275 1.00 0.73 C ATOM 1570 OD1 ASP A 420 -15.027 12.564 -5.139 1.00 0.84 O ATOM 1571 OD2 ASP A 420 -15.873 11.702 -3.310 1.00 0.85 O ATOM 0 H ASP A 420 -12.454 8.746 -4.143 1.00 0.34 H new ATOM 0 HA ASP A 420 -12.236 11.465 -4.685 1.00 0.43 H new ATOM 0 HB2 ASP A 420 -14.121 10.144 -5.430 1.00 0.55 H new ATOM 0 HB3 ASP A 420 -14.518 9.659 -3.793 1.00 0.55 H new ATOM 1576 N GLU A 421 -12.925 10.809 -1.543 1.00 0.35 N ATOM 1577 CA GLU A 421 -13.022 11.380 -0.208 1.00 0.35 C ATOM 1578 C GLU A 421 -11.653 11.817 0.312 1.00 0.32 C ATOM 1579 O GLU A 421 -11.535 12.788 1.062 1.00 0.37 O ATOM 1580 CB GLU A 421 -13.639 10.352 0.728 1.00 0.34 C ATOM 1581 CG GLU A 421 -15.063 10.001 0.352 1.00 0.42 C ATOM 1582 CD GLU A 421 -15.566 8.764 1.061 1.00 0.42 C ATOM 1583 OE1 GLU A 421 -16.089 8.891 2.189 1.00 0.51 O ATOM 1584 OE2 GLU A 421 -15.443 7.656 0.489 1.00 0.38 O ATOM 0 H GLU A 421 -13.013 9.793 -1.570 1.00 0.35 H new ATOM 0 HA GLU A 421 -13.654 12.267 -0.251 1.00 0.35 H new ATOM 0 HB2 GLU A 421 -13.031 9.447 0.719 1.00 0.34 H new ATOM 0 HB3 GLU A 421 -13.621 10.738 1.747 1.00 0.34 H new ATOM 0 HG2 GLU A 421 -15.715 10.842 0.590 1.00 0.42 H new ATOM 0 HG3 GLU A 421 -15.122 9.847 -0.725 1.00 0.42 H new ATOM 1591 N ILE A 422 -10.620 11.100 -0.103 1.00 0.26 N ATOM 1592 CA ILE A 422 -9.268 11.341 0.383 1.00 0.24 C ATOM 1593 C ILE A 422 -8.671 12.611 -0.229 1.00 0.29 C ATOM 1594 O ILE A 422 -7.892 13.322 0.418 1.00 0.32 O ATOM 1595 CB ILE A 422 -8.355 10.130 0.083 1.00 0.19 C ATOM 1596 CG1 ILE A 422 -8.992 8.853 0.641 1.00 0.18 C ATOM 1597 CG2 ILE A 422 -6.969 10.340 0.682 1.00 0.24 C ATOM 1598 CD1 ILE A 422 -8.292 7.582 0.220 1.00 0.18 C ATOM 0 H ILE A 422 -10.692 10.341 -0.780 1.00 0.26 H new ATOM 0 HA ILE A 422 -9.329 11.480 1.462 1.00 0.24 H new ATOM 0 HB ILE A 422 -8.245 10.030 -0.997 1.00 0.19 H new ATOM 0 HG12 ILE A 422 -8.999 8.908 1.730 1.00 0.18 H new ATOM 0 HG13 ILE A 422 -10.032 8.807 0.318 1.00 0.18 H new ATOM 0 HG21 ILE A 422 -6.342 9.477 0.460 1.00 0.24 H new ATOM 0 HG22 ILE A 422 -6.519 11.235 0.253 1.00 0.24 H new ATOM 0 HG23 ILE A 422 -7.054 10.458 1.762 1.00 0.24 H new ATOM 0 HD11 ILE A 422 -8.803 6.724 0.656 1.00 0.18 H new ATOM 0 HD12 ILE A 422 -8.308 7.501 -0.867 1.00 0.18 H new ATOM 0 HD13 ILE A 422 -7.259 7.604 0.567 1.00 0.18 H new ATOM 1610 N MET A 423 -9.060 12.915 -1.466 1.00 0.36 N ATOM 1611 CA MET A 423 -8.573 14.107 -2.154 1.00 0.46 C ATOM 1612 C MET A 423 -9.167 15.388 -1.574 1.00 0.55 C ATOM 1613 O MET A 423 -8.987 16.470 -2.132 1.00 0.71 O ATOM 1614 CB MET A 423 -8.873 14.028 -3.651 1.00 0.56 C ATOM 1615 CG MET A 423 -8.046 12.984 -4.370 1.00 0.59 C ATOM 1616 SD MET A 423 -8.144 13.133 -6.166 1.00 0.83 S ATOM 1617 CE MET A 423 -6.882 11.965 -6.666 1.00 1.83 C ATOM 0 H MET A 423 -9.712 12.351 -2.012 1.00 0.36 H new ATOM 0 HA MET A 423 -7.494 14.141 -2.004 1.00 0.46 H new ATOM 0 HB2 MET A 423 -9.931 13.805 -3.792 1.00 0.56 H new ATOM 0 HB3 MET A 423 -8.690 15.002 -4.104 1.00 0.56 H new ATOM 0 HG2 MET A 423 -7.005 13.073 -4.058 1.00 0.59 H new ATOM 0 HG3 MET A 423 -8.384 11.991 -4.073 1.00 0.59 H new ATOM 0 HE1 MET A 423 -6.819 11.941 -7.754 1.00 1.83 H new ATOM 0 HE2 MET A 423 -5.920 12.270 -6.254 1.00 1.83 H new ATOM 0 HE3 MET A 423 -7.137 10.972 -6.295 1.00 1.83 H new ATOM 1627 N SER A 424 -9.855 15.273 -0.447 1.00 0.60 N ATOM 1628 CA SER A 424 -10.414 16.434 0.221 1.00 0.72 C ATOM 1629 C SER A 424 -9.313 17.257 0.897 1.00 0.74 C ATOM 1630 O SER A 424 -9.560 18.370 1.367 1.00 0.94 O ATOM 1631 CB SER A 424 -11.462 16.002 1.251 1.00 1.07 C ATOM 1632 OG SER A 424 -12.061 17.124 1.880 1.00 1.70 O ATOM 0 H SER A 424 -10.038 14.386 0.022 1.00 0.60 H new ATOM 0 HA SER A 424 -10.896 17.060 -0.530 1.00 0.72 H new ATOM 0 HB2 SER A 424 -12.231 15.404 0.762 1.00 1.07 H new ATOM 0 HB3 SER A 424 -10.995 15.367 2.004 1.00 1.07 H new ATOM 0 HG SER A 424 -11.417 17.861 1.916 1.00 1.70 H new ATOM 1638 N GLY A 425 -8.100 16.711 0.952 1.00 0.81 N ATOM 1639 CA GLY A 425 -6.983 17.460 1.505 1.00 1.23 C ATOM 1640 C GLY A 425 -6.081 16.635 2.405 1.00 0.79 C ATOM 1641 O GLY A 425 -5.408 17.179 3.281 1.00 1.10 O ATOM 0 H GLY A 425 -7.872 15.772 0.627 1.00 0.81 H new ATOM 0 HA2 GLY A 425 -6.390 17.868 0.687 1.00 1.23 H new ATOM 0 HA3 GLY A 425 -7.370 18.307 2.071 1.00 1.23 H new ATOM 1645 N ARG A 426 -6.072 15.319 2.216 1.00 0.59 N ATOM 1646 CA ARG A 426 -5.166 14.463 2.970 1.00 0.47 C ATOM 1647 C ARG A 426 -4.118 13.834 2.068 1.00 0.40 C ATOM 1648 O ARG A 426 -3.146 13.251 2.548 1.00 0.47 O ATOM 1649 CB ARG A 426 -5.936 13.370 3.710 1.00 0.94 C ATOM 1650 CG ARG A 426 -6.774 13.893 4.853 1.00 1.03 C ATOM 1651 CD ARG A 426 -5.957 14.775 5.780 1.00 1.41 C ATOM 1652 NE ARG A 426 -6.785 15.478 6.759 1.00 1.79 N ATOM 1653 CZ ARG A 426 -6.495 16.689 7.236 1.00 2.26 C ATOM 1654 NH1 ARG A 426 -5.423 17.332 6.793 1.00 2.43 N ATOM 1655 NH2 ARG A 426 -7.274 17.261 8.145 1.00 2.85 N ATOM 0 H ARG A 426 -6.674 14.828 1.555 1.00 0.59 H new ATOM 0 HA ARG A 426 -4.659 15.094 3.700 1.00 0.47 H new ATOM 0 HB2 ARG A 426 -6.583 12.850 3.003 1.00 0.94 H new ATOM 0 HB3 ARG A 426 -5.229 12.635 4.095 1.00 0.94 H new ATOM 0 HG2 ARG A 426 -7.617 14.460 4.458 1.00 1.03 H new ATOM 0 HG3 ARG A 426 -7.188 13.056 5.416 1.00 1.03 H new ATOM 0 HD2 ARG A 426 -5.222 14.164 6.303 1.00 1.41 H new ATOM 0 HD3 ARG A 426 -5.403 15.503 5.188 1.00 1.41 H new ATOM 0 HE ARG A 426 -7.630 15.017 7.095 1.00 1.79 H new ATOM 0 HH11 ARG A 426 -4.824 16.900 6.090 1.00 2.43 H new ATOM 0 HH12 ARG A 426 -5.198 18.258 7.155 1.00 2.43 H new ATOM 0 HH21 ARG A 426 -8.103 16.774 8.485 1.00 2.85 H new ATOM 0 HH22 ARG A 426 -7.044 18.188 8.504 1.00 2.85 H new ATOM 1669 N THR A 427 -4.305 13.970 0.764 1.00 0.36 N ATOM 1670 CA THR A 427 -3.424 13.331 -0.196 1.00 0.33 C ATOM 1671 C THR A 427 -2.067 14.020 -0.255 1.00 0.37 C ATOM 1672 O THR A 427 -1.066 13.374 -0.517 1.00 0.38 O ATOM 1673 CB THR A 427 -4.042 13.325 -1.604 1.00 0.35 C ATOM 1674 OG1 THR A 427 -4.384 14.659 -1.994 1.00 0.48 O ATOM 1675 CG2 THR A 427 -5.281 12.446 -1.657 1.00 0.33 C ATOM 0 H THR A 427 -5.059 14.517 0.348 1.00 0.36 H new ATOM 0 HA THR A 427 -3.288 12.304 0.142 1.00 0.33 H new ATOM 0 HB THR A 427 -3.302 12.919 -2.294 1.00 0.35 H new ATOM 0 HG1 THR A 427 -3.704 15.004 -2.610 1.00 0.48 H new ATOM 0 HG21 THR A 427 -5.696 12.462 -2.665 1.00 0.33 H new ATOM 0 HG22 THR A 427 -5.013 11.423 -1.391 1.00 0.33 H new ATOM 0 HG23 THR A 427 -6.024 12.821 -0.953 1.00 0.33 H new ATOM 1683 N ASP A 428 -2.041 15.315 0.039 1.00 0.45 N ATOM 1684 CA ASP A 428 -0.836 16.137 -0.122 1.00 0.54 C ATOM 1685 C ASP A 428 0.369 15.525 0.584 1.00 0.55 C ATOM 1686 O ASP A 428 1.469 15.474 0.028 1.00 0.59 O ATOM 1687 CB ASP A 428 -1.084 17.553 0.412 1.00 0.67 C ATOM 1688 CG ASP A 428 -1.325 17.581 1.913 1.00 1.23 C ATOM 1689 OD1 ASP A 428 -2.325 16.994 2.377 1.00 1.53 O ATOM 1690 OD2 ASP A 428 -0.527 18.213 2.634 1.00 1.76 O ATOM 0 H ASP A 428 -2.848 15.828 0.394 1.00 0.45 H new ATOM 0 HA ASP A 428 -0.613 16.181 -1.188 1.00 0.54 H new ATOM 0 HB2 ASP A 428 -0.226 18.182 0.174 1.00 0.67 H new ATOM 0 HB3 ASP A 428 -1.946 17.983 -0.098 1.00 0.67 H new ATOM 1695 N ARG A 429 0.148 15.053 1.796 1.00 0.54 N ATOM 1696 CA ARG A 429 1.199 14.431 2.586 1.00 0.58 C ATOM 1697 C ARG A 429 1.615 13.115 1.956 1.00 0.45 C ATOM 1698 O ARG A 429 2.789 12.778 1.930 1.00 0.46 O ATOM 1699 CB ARG A 429 0.704 14.196 4.011 1.00 0.72 C ATOM 1700 CG ARG A 429 1.793 13.788 4.989 1.00 0.88 C ATOM 1701 CD ARG A 429 1.231 13.641 6.390 1.00 1.22 C ATOM 1702 NE ARG A 429 0.475 14.827 6.792 1.00 1.86 N ATOM 1703 CZ ARG A 429 -0.256 14.903 7.901 1.00 2.48 C ATOM 1704 NH1 ARG A 429 -0.321 13.867 8.730 1.00 2.68 N ATOM 1705 NH2 ARG A 429 -0.927 16.015 8.175 1.00 3.43 N ATOM 0 H ARG A 429 -0.759 15.088 2.261 1.00 0.54 H new ATOM 0 HA ARG A 429 2.063 15.095 2.614 1.00 0.58 H new ATOM 0 HB2 ARG A 429 0.228 15.107 4.373 1.00 0.72 H new ATOM 0 HB3 ARG A 429 -0.063 13.421 3.994 1.00 0.72 H new ATOM 0 HG2 ARG A 429 2.240 12.846 4.671 1.00 0.88 H new ATOM 0 HG3 ARG A 429 2.588 14.534 4.987 1.00 0.88 H new ATOM 0 HD2 ARG A 429 0.585 12.764 6.434 1.00 1.22 H new ATOM 0 HD3 ARG A 429 2.046 13.472 7.094 1.00 1.22 H new ATOM 0 HE ARG A 429 0.510 15.646 6.185 1.00 1.86 H new ATOM 0 HH11 ARG A 429 0.190 13.011 8.517 1.00 2.68 H new ATOM 0 HH12 ARG A 429 -0.882 13.928 9.580 1.00 2.68 H new ATOM 0 HH21 ARG A 429 -0.881 16.809 7.536 1.00 3.43 H new ATOM 0 HH22 ARG A 429 -1.488 16.076 9.025 1.00 3.43 H new ATOM 1719 N LEU A 430 0.635 12.406 1.420 1.00 0.38 N ATOM 1720 CA LEU A 430 0.826 11.077 0.868 1.00 0.32 C ATOM 1721 C LEU A 430 1.505 11.131 -0.494 1.00 0.30 C ATOM 1722 O LEU A 430 2.394 10.341 -0.781 1.00 0.33 O ATOM 1723 CB LEU A 430 -0.523 10.404 0.727 1.00 0.31 C ATOM 1724 CG LEU A 430 -1.374 10.402 1.984 1.00 0.42 C ATOM 1725 CD1 LEU A 430 -2.764 9.897 1.649 1.00 0.70 C ATOM 1726 CD2 LEU A 430 -0.726 9.549 3.065 1.00 0.61 C ATOM 0 H LEU A 430 -0.326 12.742 1.356 1.00 0.38 H new ATOM 0 HA LEU A 430 1.468 10.513 1.544 1.00 0.32 H new ATOM 0 HB2 LEU A 430 -1.078 10.900 -0.069 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -0.366 9.373 0.411 1.00 0.31 H new ATOM 0 HG LEU A 430 -1.453 11.418 2.370 1.00 0.42 H new ATOM 0 HD11 LEU A 430 -3.377 9.895 2.550 1.00 0.70 H new ATOM 0 HD12 LEU A 430 -3.218 10.549 0.903 1.00 0.70 H new ATOM 0 HD13 LEU A 430 -2.697 8.884 1.253 1.00 0.70 H new ATOM 0 HD21 LEU A 430 -1.350 9.559 3.959 1.00 0.61 H new ATOM 0 HD22 LEU A 430 -0.622 8.525 2.707 1.00 0.61 H new ATOM 0 HD23 LEU A 430 0.258 9.951 3.305 1.00 0.61 H new ATOM 1738 N GLU A 431 1.058 12.058 -1.334 1.00 0.31 N ATOM 1739 CA GLU A 431 1.627 12.247 -2.663 1.00 0.35 C ATOM 1740 C GLU A 431 3.107 12.588 -2.544 1.00 0.39 C ATOM 1741 O GLU A 431 3.926 12.238 -3.394 1.00 0.44 O ATOM 1742 CB GLU A 431 0.852 13.347 -3.393 1.00 0.39 C ATOM 1743 CG GLU A 431 -0.650 13.108 -3.398 1.00 0.50 C ATOM 1744 CD GLU A 431 -1.419 14.138 -4.199 1.00 1.35 C ATOM 1745 OE1 GLU A 431 -1.322 14.140 -5.444 1.00 1.54 O ATOM 1746 OE2 GLU A 431 -2.137 14.954 -3.582 1.00 2.30 O ATOM 0 H GLU A 431 0.294 12.697 -1.114 1.00 0.31 H new ATOM 0 HA GLU A 431 1.542 11.328 -3.243 1.00 0.35 H new ATOM 0 HB2 GLU A 431 1.061 14.307 -2.920 1.00 0.39 H new ATOM 0 HB3 GLU A 431 1.208 13.414 -4.421 1.00 0.39 H new ATOM 0 HG2 GLU A 431 -0.852 12.117 -3.805 1.00 0.50 H new ATOM 0 HG3 GLU A 431 -1.015 13.111 -2.371 1.00 0.50 H new ATOM 1753 N HIS A 432 3.425 13.269 -1.459 1.00 0.39 N ATOM 1754 CA HIS A 432 4.795 13.569 -1.088 1.00 0.45 C ATOM 1755 C HIS A 432 5.437 12.373 -0.377 1.00 0.44 C ATOM 1756 O HIS A 432 6.643 12.146 -0.473 1.00 0.52 O ATOM 1757 CB HIS A 432 4.782 14.807 -0.195 1.00 0.50 C ATOM 1758 CG HIS A 432 6.087 15.154 0.452 1.00 0.55 C ATOM 1759 ND1 HIS A 432 7.111 15.803 -0.202 1.00 0.87 N ATOM 1760 CD2 HIS A 432 6.516 14.964 1.720 1.00 0.70 C ATOM 1761 CE1 HIS A 432 8.112 15.994 0.636 1.00 0.91 C ATOM 1762 NE2 HIS A 432 7.776 15.493 1.807 1.00 0.77 N ATOM 0 H HIS A 432 2.733 13.633 -0.804 1.00 0.39 H new ATOM 0 HA HIS A 432 5.394 13.767 -1.977 1.00 0.45 H new ATOM 0 HB2 HIS A 432 4.455 15.659 -0.791 1.00 0.50 H new ATOM 0 HB3 HIS A 432 4.037 14.661 0.587 1.00 0.50 H new ATOM 0 HD2 HIS A 432 5.967 14.484 2.516 1.00 0.70 H new ATOM 0 HE1 HIS A 432 9.048 16.479 0.402 1.00 0.91 H new ATOM 0 HE2 HIS A 432 8.360 15.498 2.643 1.00 0.77 H new ATOM 1771 N LEU A 433 4.605 11.608 0.314 1.00 0.39 N ATOM 1772 CA LEU A 433 5.051 10.491 1.136 1.00 0.40 C ATOM 1773 C LEU A 433 5.450 9.293 0.293 1.00 0.36 C ATOM 1774 O LEU A 433 6.331 8.546 0.686 1.00 0.35 O ATOM 1775 CB LEU A 433 3.933 10.083 2.099 1.00 0.53 C ATOM 1776 CG LEU A 433 4.386 9.519 3.448 1.00 0.43 C ATOM 1777 CD1 LEU A 433 4.950 8.117 3.287 1.00 0.91 C ATOM 1778 CD2 LEU A 433 5.418 10.440 4.074 1.00 0.73 C ATOM 0 H LEU A 433 3.594 11.745 0.321 1.00 0.39 H new ATOM 0 HA LEU A 433 5.929 10.819 1.693 1.00 0.40 H new ATOM 0 HB2 LEU A 433 3.303 10.953 2.284 1.00 0.53 H new ATOM 0 HB3 LEU A 433 3.309 9.337 1.606 1.00 0.53 H new ATOM 0 HG LEU A 433 3.520 9.459 4.107 1.00 0.43 H new ATOM 0 HD11 LEU A 433 5.265 7.738 4.259 1.00 0.91 H new ATOM 0 HD12 LEU A 433 4.184 7.462 2.873 1.00 0.91 H new ATOM 0 HD13 LEU A 433 5.806 8.145 2.613 1.00 0.91 H new ATOM 0 HD21 LEU A 433 5.735 10.032 5.034 1.00 0.73 H new ATOM 0 HD22 LEU A 433 6.280 10.524 3.412 1.00 0.73 H new ATOM 0 HD23 LEU A 433 4.980 11.427 4.226 1.00 0.73 H new ATOM 1790 N GLU A 434 4.799 9.104 -0.851 1.00 0.40 N ATOM 1791 CA GLU A 434 5.057 7.930 -1.686 1.00 0.45 C ATOM 1792 C GLU A 434 6.540 7.689 -1.899 1.00 0.45 C ATOM 1793 O GLU A 434 7.017 6.587 -1.692 1.00 0.56 O ATOM 1794 CB GLU A 434 4.374 8.038 -3.038 1.00 0.66 C ATOM 1795 CG GLU A 434 2.876 7.833 -2.980 1.00 0.80 C ATOM 1796 CD GLU A 434 2.233 7.932 -4.348 1.00 1.20 C ATOM 1797 OE1 GLU A 434 2.098 9.061 -4.865 1.00 1.75 O ATOM 1798 OE2 GLU A 434 1.833 6.892 -4.899 1.00 1.47 O ATOM 0 H GLU A 434 4.094 9.742 -1.221 1.00 0.40 H new ATOM 0 HA GLU A 434 4.641 7.083 -1.141 1.00 0.45 H new ATOM 0 HB2 GLU A 434 4.581 9.020 -3.463 1.00 0.66 H new ATOM 0 HB3 GLU A 434 4.807 7.301 -3.714 1.00 0.66 H new ATOM 0 HG2 GLU A 434 2.661 6.855 -2.549 1.00 0.80 H new ATOM 0 HG3 GLU A 434 2.434 8.577 -2.318 1.00 0.80 H new ATOM 1805 N SER A 435 7.274 8.712 -2.292 1.00 0.46 N ATOM 1806 CA SER A 435 8.697 8.557 -2.497 1.00 0.53 C ATOM 1807 C SER A 435 9.409 8.320 -1.168 1.00 0.50 C ATOM 1808 O SER A 435 10.437 7.646 -1.109 1.00 0.58 O ATOM 1809 CB SER A 435 9.249 9.795 -3.172 1.00 0.62 C ATOM 1810 OG SER A 435 8.220 10.745 -3.430 1.00 1.01 O ATOM 0 H SER A 435 6.912 9.648 -2.473 1.00 0.46 H new ATOM 0 HA SER A 435 8.869 7.690 -3.135 1.00 0.53 H new ATOM 0 HB2 SER A 435 10.014 10.246 -2.540 1.00 0.62 H new ATOM 0 HB3 SER A 435 9.733 9.516 -4.108 1.00 0.62 H new ATOM 0 HG SER A 435 8.605 11.535 -3.864 1.00 1.01 H new ATOM 1816 N GLN A 436 8.826 8.858 -0.104 1.00 0.43 N ATOM 1817 CA GLN A 436 9.436 8.817 1.219 1.00 0.48 C ATOM 1818 C GLN A 436 9.300 7.449 1.866 1.00 0.45 C ATOM 1819 O GLN A 436 10.242 6.967 2.466 1.00 0.51 O ATOM 1820 CB GLN A 436 8.854 9.883 2.138 1.00 0.52 C ATOM 1821 CG GLN A 436 9.211 11.293 1.719 1.00 0.77 C ATOM 1822 CD GLN A 436 9.091 12.277 2.861 1.00 0.77 C ATOM 1823 OE1 GLN A 436 8.028 12.837 3.105 1.00 1.27 O ATOM 1824 NE2 GLN A 436 10.194 12.500 3.558 1.00 1.38 N ATOM 0 H GLN A 436 7.923 9.332 -0.133 1.00 0.43 H new ATOM 0 HA GLN A 436 10.497 9.022 1.074 1.00 0.48 H new ATOM 0 HB2 GLN A 436 7.769 9.781 2.160 1.00 0.52 H new ATOM 0 HB3 GLN A 436 9.211 9.712 3.154 1.00 0.52 H new ATOM 0 HG2 GLN A 436 10.231 11.308 1.334 1.00 0.77 H new ATOM 0 HG3 GLN A 436 8.558 11.604 0.904 1.00 0.77 H new ATOM 0 HE21 GLN A 436 11.056 12.011 3.319 1.00 1.38 H new ATOM 0 HE22 GLN A 436 10.182 13.161 4.335 1.00 1.38 H new ATOM 1833 N VAL A 437 8.131 6.821 1.754 1.00 0.38 N ATOM 1834 CA VAL A 437 7.945 5.459 2.269 1.00 0.38 C ATOM 1835 C VAL A 437 8.926 4.509 1.590 1.00 0.42 C ATOM 1836 O VAL A 437 9.394 3.529 2.172 1.00 0.49 O ATOM 1837 CB VAL A 437 6.483 4.954 2.090 1.00 0.33 C ATOM 1838 CG1 VAL A 437 5.829 5.549 0.862 1.00 0.31 C ATOM 1839 CG2 VAL A 437 6.435 3.438 2.009 1.00 0.38 C ATOM 0 H VAL A 437 7.303 7.226 1.316 1.00 0.38 H new ATOM 0 HA VAL A 437 8.144 5.482 3.340 1.00 0.38 H new ATOM 0 HB VAL A 437 5.927 5.282 2.968 1.00 0.33 H new ATOM 0 HG11 VAL A 437 4.810 5.171 0.773 1.00 0.31 H new ATOM 0 HG12 VAL A 437 5.807 6.635 0.952 1.00 0.31 H new ATOM 0 HG13 VAL A 437 6.398 5.270 -0.025 1.00 0.31 H new ATOM 0 HG21 VAL A 437 5.402 3.113 1.884 1.00 0.38 H new ATOM 0 HG22 VAL A 437 7.027 3.100 1.159 1.00 0.38 H new ATOM 0 HG23 VAL A 437 6.841 3.012 2.926 1.00 0.38 H new ATOM 1849 N LEU A 438 9.270 4.857 0.369 1.00 0.41 N ATOM 1850 CA LEU A 438 10.188 4.077 -0.435 1.00 0.48 C ATOM 1851 C LEU A 438 11.627 4.500 -0.153 1.00 0.55 C ATOM 1852 O LEU A 438 12.579 3.964 -0.723 1.00 0.62 O ATOM 1853 CB LEU A 438 9.833 4.310 -1.896 1.00 0.48 C ATOM 1854 CG LEU A 438 8.338 4.145 -2.199 1.00 0.47 C ATOM 1855 CD1 LEU A 438 8.015 4.483 -3.644 1.00 0.51 C ATOM 1856 CD2 LEU A 438 7.866 2.742 -1.861 1.00 0.54 C ATOM 0 H LEU A 438 8.919 5.694 -0.097 1.00 0.41 H new ATOM 0 HA LEU A 438 10.105 3.017 -0.194 1.00 0.48 H new ATOM 0 HB2 LEU A 438 10.144 5.315 -2.181 1.00 0.48 H new ATOM 0 HB3 LEU A 438 10.399 3.614 -2.514 1.00 0.48 H new ATOM 0 HG LEU A 438 7.801 4.852 -1.566 1.00 0.47 H new ATOM 0 HD11 LEU A 438 6.947 4.354 -3.818 1.00 0.51 H new ATOM 0 HD12 LEU A 438 8.293 5.517 -3.847 1.00 0.51 H new ATOM 0 HD13 LEU A 438 8.573 3.821 -4.306 1.00 0.51 H new ATOM 0 HD21 LEU A 438 6.803 2.652 -2.085 1.00 0.54 H new ATOM 0 HD22 LEU A 438 8.425 2.018 -2.454 1.00 0.54 H new ATOM 0 HD23 LEU A 438 8.031 2.548 -0.801 1.00 0.54 H new