USER MOD reduce.3.24.130724 H: found=0, std=0, add=647, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 635 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 417 HIS : no HD1:sc= -0.65 X(o=-1.7,f=-1.9) USER MOD Set 1.2: A 421 CYS SG : rot -66:sc= 0.425 USER MOD Set 1.3: A 426 CYS SG : rot 142:sc= -1.07 USER MOD Set 1.4: A 429 CYS SG : rot 154:sc= -0.366 USER MOD Set 2.1: A 393 HIS :FLIP no HE2:sc= -0.556 F(o=-1.1,f=0.076) USER MOD Set 2.2: A 397 CYS SG : rot 139:sc= 0.2 USER MOD Set 2.3: A 403 CYS SG : rot 130:sc= -0.145 USER MOD Set 2.4: A 408 CYS SG : rot -143:sc= 0.576 USER MOD Set 3.1: A 394 MET CE :methyl 180:sc= -0.3 (180deg=-0.123) USER MOD Set 3.2: A 411 SER OG : rot -46:sc= 1.03 USER MOD Set 4.1: A 356 GLN : amide:sc= -0.2 X(o=-0.36,f=-0.4) USER MOD Set 4.2: A 387 MET CE :methyl 173:sc= -0.161 (180deg=-0.203) USER MOD Set 5.1: A 362 HIS :FLIP no HD1:sc= 0.155 F(o=-2.3,f=-0.16) USER MOD Set 5.2: A 366 CYS SG : rot -158:sc= -0.745 USER MOD Set 5.3: A 367 GLN : amide:sc= 0.358 K(o=-0.16,f=-8.1) USER MOD Set 5.4: A 384 CYS SG : rot 81:sc= -0.11 USER MOD Set 5.5: A 388 LYS NZ :NH3+ 168:sc= 0.186! (180deg=-0.13) USER MOD Single : A 349 LYS NZ :NH3+ 174:sc=-0.00852 (180deg=-0.0788) USER MOD Single : A 351 LYS NZ :NH3+ 165:sc= 1.1 (180deg=0.793) USER MOD Single : A 354 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 355 GLN : amide:sc= -0.115 K(o=-0.12,f=-3.1!) USER MOD Single : A 364 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 365 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 371 GLN : amide:sc= 0 X(o=0,f=-0.071) USER MOD Single : A 383 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 386 THR OG1 : rot 180:sc= 0 USER MOD Single : A 389 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 392 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 395 THR OG1 : rot -26:sc= 0.666 USER MOD Single : A 396 HIS : no HD1:sc= -0.982 K(o=-0.98,f=-1.9) USER MOD Single : A 398 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 401 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 407 HIS : no HD1:sc= -0.186 X(o=-0.19,f=-0.057) USER MOD Single : A 410 SER OG : rot 83:sc= 0.676 USER MOD Single : A 413 GLN : amide:sc= -0.0626 X(o=-0.063,f=-0.2) USER MOD Single : A 416 SER OG : rot -150:sc= 1.08 USER MOD Single : A 419 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0115) USER MOD Single : A 420 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 HIS : no HE2:sc= 0.573 K(o=0.57,f=-2.2!) USER MOD ----------------------------------------------------------------- ATOM 84 N PRO A 347 2.959 -16.449 15.186 1.00 0.00 N ATOM 85 CA PRO A 347 2.520 -15.094 15.519 1.00 0.00 C ATOM 86 C PRO A 347 3.449 -13.956 15.101 1.00 0.00 C ATOM 87 O PRO A 347 2.962 -12.935 14.629 1.00 0.00 O ATOM 88 CB PRO A 347 2.298 -15.084 17.036 1.00 0.00 C ATOM 89 CG PRO A 347 1.961 -16.536 17.353 1.00 0.00 C ATOM 90 CD PRO A 347 2.832 -17.303 16.361 1.00 0.00 C ATOM 0 HA PRO A 347 1.618 -14.888 14.943 1.00 0.00 H new ATOM 0 HB2 PRO A 347 3.188 -14.752 17.570 1.00 0.00 H new ATOM 0 HB3 PRO A 347 1.488 -14.412 17.319 1.00 0.00 H new ATOM 0 HG2 PRO A 347 2.200 -16.792 18.385 1.00 0.00 H new ATOM 0 HG3 PRO A 347 0.901 -16.747 17.210 1.00 0.00 H new ATOM 0 HD2 PRO A 347 3.810 -17.523 16.790 1.00 0.00 H new ATOM 0 HD3 PRO A 347 2.376 -18.258 16.100 1.00 0.00 H new ATOM 98 N GLU A 348 4.769 -14.106 15.223 1.00 0.00 N ATOM 99 CA GLU A 348 5.738 -13.069 14.830 1.00 0.00 C ATOM 100 C GLU A 348 5.708 -12.848 13.317 1.00 0.00 C ATOM 101 O GLU A 348 5.722 -11.718 12.826 1.00 0.00 O ATOM 102 CB GLU A 348 7.168 -13.443 15.250 1.00 0.00 C ATOM 103 CG GLU A 348 7.333 -13.840 16.726 1.00 0.00 C ATOM 104 CD GLU A 348 6.824 -12.755 17.694 1.00 0.00 C ATOM 105 OE1 GLU A 348 7.189 -11.564 17.542 1.00 0.00 O ATOM 106 OE2 GLU A 348 6.023 -13.071 18.606 1.00 0.00 O ATOM 0 H GLU A 348 5.202 -14.950 15.597 1.00 0.00 H new ATOM 0 HA GLU A 348 5.449 -12.152 15.343 1.00 0.00 H new ATOM 0 HB2 GLU A 348 7.508 -14.271 14.627 1.00 0.00 H new ATOM 0 HB3 GLU A 348 7.824 -12.597 15.042 1.00 0.00 H new ATOM 0 HG2 GLU A 348 6.793 -14.768 16.911 1.00 0.00 H new ATOM 0 HG3 GLU A 348 8.385 -14.038 16.929 1.00 0.00 H new ATOM 113 N LYS A 349 5.579 -13.945 12.568 1.00 0.00 N ATOM 114 CA LYS A 349 5.453 -13.912 11.117 1.00 0.00 C ATOM 115 C LYS A 349 4.126 -13.254 10.760 1.00 0.00 C ATOM 116 O LYS A 349 4.145 -12.382 9.909 1.00 0.00 O ATOM 117 CB LYS A 349 5.651 -15.312 10.522 1.00 0.00 C ATOM 118 CG LYS A 349 7.138 -15.708 10.582 1.00 0.00 C ATOM 119 CD LYS A 349 7.388 -17.101 9.983 1.00 0.00 C ATOM 120 CE LYS A 349 8.859 -17.548 10.051 1.00 0.00 C ATOM 121 NZ LYS A 349 9.385 -17.577 11.441 1.00 0.00 N ATOM 0 H LYS A 349 5.559 -14.887 12.959 1.00 0.00 H new ATOM 0 HA LYS A 349 6.241 -13.307 10.668 1.00 0.00 H new ATOM 0 HB2 LYS A 349 5.051 -16.037 11.072 1.00 0.00 H new ATOM 0 HB3 LYS A 349 5.304 -15.329 9.489 1.00 0.00 H new ATOM 0 HG2 LYS A 349 7.732 -14.970 10.043 1.00 0.00 H new ATOM 0 HG3 LYS A 349 7.475 -15.693 11.618 1.00 0.00 H new ATOM 0 HD2 LYS A 349 6.771 -17.829 10.510 1.00 0.00 H new ATOM 0 HD3 LYS A 349 7.065 -17.103 8.942 1.00 0.00 H new ATOM 0 HE2 LYS A 349 8.954 -18.540 9.610 1.00 0.00 H new ATOM 0 HE3 LYS A 349 9.468 -16.873 9.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 349 10.344 -17.980 11.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 349 9.416 -16.609 11.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 349 8.763 -18.162 12.035 1.00 0.00 H new ATOM 135 N ARG A 350 3.013 -13.562 11.444 1.00 0.00 N ATOM 136 CA ARG A 350 1.711 -12.890 11.227 1.00 0.00 C ATOM 137 C ARG A 350 1.861 -11.370 11.211 1.00 0.00 C ATOM 138 O ARG A 350 1.578 -10.763 10.183 1.00 0.00 O ATOM 139 CB ARG A 350 0.617 -13.316 12.233 1.00 0.00 C ATOM 140 CG ARG A 350 0.267 -14.806 12.370 1.00 0.00 C ATOM 141 CD ARG A 350 0.192 -15.624 11.079 1.00 0.00 C ATOM 142 NE ARG A 350 1.479 -16.286 10.782 1.00 0.00 N ATOM 143 CZ ARG A 350 1.777 -16.998 9.713 1.00 0.00 C ATOM 144 NH1 ARG A 350 0.960 -17.121 8.707 1.00 0.00 N ATOM 145 NH2 ARG A 350 2.914 -17.626 9.648 1.00 0.00 N ATOM 0 H ARG A 350 2.985 -14.283 12.165 1.00 0.00 H new ATOM 0 HA ARG A 350 1.374 -13.222 10.245 1.00 0.00 H new ATOM 0 HB2 ARG A 350 0.918 -12.957 13.217 1.00 0.00 H new ATOM 0 HB3 ARG A 350 -0.298 -12.787 11.967 1.00 0.00 H new ATOM 0 HG2 ARG A 350 1.008 -15.269 13.022 1.00 0.00 H new ATOM 0 HG3 ARG A 350 -0.695 -14.883 12.876 1.00 0.00 H new ATOM 0 HD2 ARG A 350 -0.593 -16.375 11.168 1.00 0.00 H new ATOM 0 HD3 ARG A 350 -0.083 -14.972 10.250 1.00 0.00 H new ATOM 0 HE ARG A 350 2.216 -16.181 11.479 1.00 0.00 H new ATOM 0 HH11 ARG A 350 0.052 -16.657 8.728 1.00 0.00 H new ATOM 0 HH12 ARG A 350 1.228 -17.681 7.898 1.00 0.00 H new ATOM 0 HH21 ARG A 350 3.574 -17.567 10.423 1.00 0.00 H new ATOM 0 HH22 ARG A 350 3.146 -18.177 8.822 1.00 0.00 H new ATOM 159 N LYS A 351 2.359 -10.776 12.300 1.00 0.00 N ATOM 160 CA LYS A 351 2.580 -9.317 12.425 1.00 0.00 C ATOM 161 C LYS A 351 3.546 -8.761 11.379 1.00 0.00 C ATOM 162 O LYS A 351 3.146 -7.861 10.636 1.00 0.00 O ATOM 163 CB LYS A 351 3.005 -8.862 13.841 1.00 0.00 C ATOM 164 CG LYS A 351 3.367 -9.997 14.797 1.00 0.00 C ATOM 165 CD LYS A 351 4.095 -9.514 16.050 1.00 0.00 C ATOM 166 CE LYS A 351 3.928 -10.542 17.175 1.00 0.00 C ATOM 167 NZ LYS A 351 4.838 -10.271 18.315 1.00 0.00 N ATOM 0 H LYS A 351 2.626 -11.296 13.136 1.00 0.00 H new ATOM 0 HA LYS A 351 1.595 -8.891 12.234 1.00 0.00 H new ATOM 0 HB2 LYS A 351 3.862 -8.195 13.751 1.00 0.00 H new ATOM 0 HB3 LYS A 351 2.193 -8.281 14.280 1.00 0.00 H new ATOM 0 HG2 LYS A 351 2.457 -10.521 15.091 1.00 0.00 H new ATOM 0 HG3 LYS A 351 3.995 -10.718 14.274 1.00 0.00 H new ATOM 0 HD2 LYS A 351 5.153 -9.367 15.833 1.00 0.00 H new ATOM 0 HD3 LYS A 351 3.697 -8.549 16.364 1.00 0.00 H new ATOM 0 HE2 LYS A 351 2.896 -10.532 17.525 1.00 0.00 H new ATOM 0 HE3 LYS A 351 4.123 -11.541 16.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 351 4.527 -10.816 19.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 351 5.807 -10.550 18.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 351 4.819 -9.256 18.541 1.00 0.00 H new ATOM 181 N LEU A 352 4.788 -9.261 11.280 1.00 0.00 N ATOM 182 CA LEU A 352 5.697 -8.713 10.272 1.00 0.00 C ATOM 183 C LEU A 352 5.263 -8.926 8.809 1.00 0.00 C ATOM 184 O LEU A 352 5.301 -7.974 8.031 1.00 0.00 O ATOM 185 CB LEU A 352 7.188 -8.984 10.547 1.00 0.00 C ATOM 186 CG LEU A 352 7.672 -9.103 12.005 1.00 0.00 C ATOM 187 CD1 LEU A 352 9.151 -9.490 12.033 1.00 0.00 C ATOM 188 CD2 LEU A 352 7.515 -7.770 12.740 1.00 0.00 C ATOM 0 H LEU A 352 5.170 -10.009 11.858 1.00 0.00 H new ATOM 0 HA LEU A 352 5.595 -7.635 10.401 1.00 0.00 H new ATOM 0 HB2 LEU A 352 7.453 -9.910 10.036 1.00 0.00 H new ATOM 0 HB3 LEU A 352 7.760 -8.185 10.075 1.00 0.00 H new ATOM 0 HG LEU A 352 7.068 -9.866 12.496 1.00 0.00 H new ATOM 0 HD11 LEU A 352 9.486 -9.572 13.067 1.00 0.00 H new ATOM 0 HD12 LEU A 352 9.286 -10.448 11.531 1.00 0.00 H new ATOM 0 HD13 LEU A 352 9.737 -8.726 11.521 1.00 0.00 H new ATOM 0 HD21 LEU A 352 7.863 -7.878 13.767 1.00 0.00 H new ATOM 0 HD22 LEU A 352 8.105 -7.005 12.236 1.00 0.00 H new ATOM 0 HD23 LEU A 352 6.465 -7.477 12.741 1.00 0.00 H new ATOM 200 N ILE A 353 4.790 -10.117 8.426 1.00 0.00 N ATOM 201 CA ILE A 353 4.335 -10.407 7.049 1.00 0.00 C ATOM 202 C ILE A 353 3.122 -9.546 6.663 1.00 0.00 C ATOM 203 O ILE A 353 3.085 -8.957 5.577 1.00 0.00 O ATOM 204 CB ILE A 353 4.098 -11.934 6.880 1.00 0.00 C ATOM 205 CG1 ILE A 353 4.581 -12.450 5.514 1.00 0.00 C ATOM 206 CG2 ILE A 353 2.660 -12.420 7.155 1.00 0.00 C ATOM 207 CD1 ILE A 353 4.744 -13.978 5.494 1.00 0.00 C ATOM 0 H ILE A 353 4.709 -10.913 9.059 1.00 0.00 H new ATOM 0 HA ILE A 353 5.118 -10.128 6.344 1.00 0.00 H new ATOM 0 HB ILE A 353 4.710 -12.370 7.670 1.00 0.00 H new ATOM 0 HG12 ILE A 353 3.870 -12.152 4.743 1.00 0.00 H new ATOM 0 HG13 ILE A 353 5.534 -11.982 5.267 1.00 0.00 H new ATOM 0 HG21 ILE A 353 2.606 -13.499 7.008 1.00 0.00 H new ATOM 0 HG22 ILE A 353 2.385 -12.179 8.182 1.00 0.00 H new ATOM 0 HG23 ILE A 353 1.972 -11.926 6.470 1.00 0.00 H new ATOM 0 HD11 ILE A 353 5.087 -14.294 4.509 1.00 0.00 H new ATOM 0 HD12 ILE A 353 5.475 -14.276 6.245 1.00 0.00 H new ATOM 0 HD13 ILE A 353 3.786 -14.449 5.714 1.00 0.00 H new ATOM 219 N GLN A 354 2.144 -9.418 7.570 1.00 0.00 N ATOM 220 CA GLN A 354 0.964 -8.588 7.309 1.00 0.00 C ATOM 221 C GLN A 354 1.298 -7.094 7.266 1.00 0.00 C ATOM 222 O GLN A 354 0.720 -6.378 6.454 1.00 0.00 O ATOM 223 CB GLN A 354 -0.203 -8.883 8.269 1.00 0.00 C ATOM 224 CG GLN A 354 -0.136 -8.226 9.658 1.00 0.00 C ATOM 225 CD GLN A 354 -1.313 -8.641 10.540 1.00 0.00 C ATOM 226 OE1 GLN A 354 -1.183 -9.402 11.489 1.00 0.00 O ATOM 227 NE2 GLN A 354 -2.509 -8.155 10.271 1.00 0.00 N ATOM 0 H GLN A 354 2.147 -9.875 8.482 1.00 0.00 H new ATOM 0 HA GLN A 354 0.623 -8.869 6.313 1.00 0.00 H new ATOM 0 HB2 GLN A 354 -1.128 -8.567 7.787 1.00 0.00 H new ATOM 0 HB3 GLN A 354 -0.267 -9.963 8.406 1.00 0.00 H new ATOM 0 HG2 GLN A 354 0.799 -8.502 10.146 1.00 0.00 H new ATOM 0 HG3 GLN A 354 -0.130 -7.142 9.547 1.00 0.00 H new ATOM 0 HE21 GLN A 354 -2.636 -7.519 9.484 1.00 0.00 H new ATOM 0 HE22 GLN A 354 -3.307 -8.415 10.850 1.00 0.00 H new ATOM 236 N GLN A 355 2.243 -6.605 8.082 1.00 0.00 N ATOM 237 CA GLN A 355 2.614 -5.187 8.069 1.00 0.00 C ATOM 238 C GLN A 355 3.391 -4.846 6.792 1.00 0.00 C ATOM 239 O GLN A 355 3.200 -3.782 6.208 1.00 0.00 O ATOM 240 CB GLN A 355 3.374 -4.852 9.350 1.00 0.00 C ATOM 241 CG GLN A 355 4.002 -3.446 9.431 1.00 0.00 C ATOM 242 CD GLN A 355 3.004 -2.284 9.509 1.00 0.00 C ATOM 243 OE1 GLN A 355 1.831 -2.376 9.176 1.00 0.00 O ATOM 244 NE2 GLN A 355 3.433 -1.131 9.976 1.00 0.00 N ATOM 0 H GLN A 355 2.761 -7.169 8.756 1.00 0.00 H new ATOM 0 HA GLN A 355 1.721 -4.562 8.051 1.00 0.00 H new ATOM 0 HB2 GLN A 355 2.692 -4.970 10.192 1.00 0.00 H new ATOM 0 HB3 GLN A 355 4.168 -5.588 9.478 1.00 0.00 H new ATOM 0 HG2 GLN A 355 4.650 -3.406 10.307 1.00 0.00 H new ATOM 0 HG3 GLN A 355 4.637 -3.299 8.557 1.00 0.00 H new ATOM 0 HE21 GLN A 355 4.407 -1.027 10.261 1.00 0.00 H new ATOM 0 HE22 GLN A 355 2.792 -0.342 10.053 1.00 0.00 H new ATOM 253 N GLN A 356 4.239 -5.767 6.333 1.00 0.00 N ATOM 254 CA GLN A 356 5.043 -5.622 5.120 1.00 0.00 C ATOM 255 C GLN A 356 4.086 -5.487 3.930 1.00 0.00 C ATOM 256 O GLN A 356 4.159 -4.526 3.168 1.00 0.00 O ATOM 257 CB GLN A 356 5.819 -6.927 4.941 1.00 0.00 C ATOM 258 CG GLN A 356 7.173 -6.891 5.658 1.00 0.00 C ATOM 259 CD GLN A 356 8.135 -5.844 5.095 1.00 0.00 C ATOM 260 OE1 GLN A 356 8.595 -5.925 3.965 1.00 0.00 O ATOM 261 NE2 GLN A 356 8.473 -4.819 5.850 1.00 0.00 N ATOM 0 H GLN A 356 4.389 -6.657 6.807 1.00 0.00 H new ATOM 0 HA GLN A 356 5.707 -4.760 5.184 1.00 0.00 H new ATOM 0 HB2 GLN A 356 5.227 -7.757 5.326 1.00 0.00 H new ATOM 0 HB3 GLN A 356 5.976 -7.113 3.879 1.00 0.00 H new ATOM 0 HG2 GLN A 356 7.009 -6.690 6.717 1.00 0.00 H new ATOM 0 HG3 GLN A 356 7.638 -7.874 5.589 1.00 0.00 H new ATOM 0 HE21 GLN A 356 8.098 -4.736 6.795 1.00 0.00 H new ATOM 0 HE22 GLN A 356 9.109 -4.108 5.490 1.00 0.00 H new ATOM 270 N LEU A 357 3.148 -6.437 3.816 1.00 0.00 N ATOM 271 CA LEU A 357 2.086 -6.471 2.811 1.00 0.00 C ATOM 272 C LEU A 357 1.260 -5.169 2.884 1.00 0.00 C ATOM 273 O LEU A 357 1.105 -4.498 1.869 1.00 0.00 O ATOM 274 CB LEU A 357 1.336 -7.792 3.084 1.00 0.00 C ATOM 275 CG LEU A 357 0.171 -8.151 2.154 1.00 0.00 C ATOM 276 CD1 LEU A 357 -0.259 -9.603 2.371 1.00 0.00 C ATOM 277 CD2 LEU A 357 -1.011 -7.260 2.496 1.00 0.00 C ATOM 0 H LEU A 357 3.110 -7.235 4.450 1.00 0.00 H new ATOM 0 HA LEU A 357 2.422 -6.483 1.774 1.00 0.00 H new ATOM 0 HB2 LEU A 357 2.061 -8.605 3.044 1.00 0.00 H new ATOM 0 HB3 LEU A 357 0.953 -7.757 4.104 1.00 0.00 H new ATOM 0 HG LEU A 357 0.489 -8.015 1.120 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -1.087 -9.841 1.703 1.00 0.00 H new ATOM 0 HD12 LEU A 357 0.580 -10.266 2.160 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -0.577 -9.738 3.405 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -1.850 -7.502 1.843 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -1.301 -7.422 3.534 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -0.732 -6.216 2.356 1.00 0.00 H new ATOM 289 N VAL A 358 0.779 -4.752 4.060 1.00 0.00 N ATOM 290 CA VAL A 358 0.026 -3.490 4.229 1.00 0.00 C ATOM 291 C VAL A 358 0.826 -2.264 3.753 1.00 0.00 C ATOM 292 O VAL A 358 0.257 -1.371 3.126 1.00 0.00 O ATOM 293 CB VAL A 358 -0.439 -3.335 5.696 1.00 0.00 C ATOM 294 CG1 VAL A 358 -0.895 -1.913 6.061 1.00 0.00 C ATOM 295 CG2 VAL A 358 -1.623 -4.273 5.990 1.00 0.00 C ATOM 0 H VAL A 358 0.897 -5.276 4.927 1.00 0.00 H new ATOM 0 HA VAL A 358 -0.857 -3.543 3.592 1.00 0.00 H new ATOM 0 HB VAL A 358 0.439 -3.582 6.293 1.00 0.00 H new ATOM 0 HG11 VAL A 358 -1.205 -1.887 7.106 1.00 0.00 H new ATOM 0 HG12 VAL A 358 -0.070 -1.216 5.910 1.00 0.00 H new ATOM 0 HG13 VAL A 358 -1.733 -1.626 5.426 1.00 0.00 H new ATOM 0 HG21 VAL A 358 -1.936 -4.150 7.027 1.00 0.00 H new ATOM 0 HG22 VAL A 358 -2.454 -4.028 5.328 1.00 0.00 H new ATOM 0 HG23 VAL A 358 -1.319 -5.306 5.823 1.00 0.00 H new ATOM 305 N LEU A 359 2.143 -2.219 3.984 1.00 0.00 N ATOM 306 CA LEU A 359 3.011 -1.112 3.553 1.00 0.00 C ATOM 307 C LEU A 359 3.311 -1.163 2.048 1.00 0.00 C ATOM 308 O LEU A 359 3.460 -0.121 1.416 1.00 0.00 O ATOM 309 CB LEU A 359 4.304 -1.100 4.383 1.00 0.00 C ATOM 310 CG LEU A 359 4.119 -0.641 5.842 1.00 0.00 C ATOM 311 CD1 LEU A 359 5.400 -0.928 6.625 1.00 0.00 C ATOM 312 CD2 LEU A 359 3.828 0.861 5.936 1.00 0.00 C ATOM 0 H LEU A 359 2.643 -2.956 4.480 1.00 0.00 H new ATOM 0 HA LEU A 359 2.475 -0.179 3.729 1.00 0.00 H new ATOM 0 HB2 LEU A 359 4.732 -2.103 4.382 1.00 0.00 H new ATOM 0 HB3 LEU A 359 5.027 -0.445 3.898 1.00 0.00 H new ATOM 0 HG LEU A 359 3.270 -1.187 6.254 1.00 0.00 H new ATOM 0 HD11 LEU A 359 5.275 -0.605 7.659 1.00 0.00 H new ATOM 0 HD12 LEU A 359 5.609 -1.998 6.602 1.00 0.00 H new ATOM 0 HD13 LEU A 359 6.231 -0.386 6.174 1.00 0.00 H new ATOM 0 HD21 LEU A 359 3.704 1.143 6.982 1.00 0.00 H new ATOM 0 HD22 LEU A 359 4.659 1.420 5.505 1.00 0.00 H new ATOM 0 HD23 LEU A 359 2.914 1.089 5.388 1.00 0.00 H new ATOM 324 N LEU A 360 3.337 -2.354 1.450 1.00 0.00 N ATOM 325 CA LEU A 360 3.467 -2.571 0.005 1.00 0.00 C ATOM 326 C LEU A 360 2.231 -2.048 -0.730 1.00 0.00 C ATOM 327 O LEU A 360 2.326 -1.374 -1.756 1.00 0.00 O ATOM 328 CB LEU A 360 3.589 -4.085 -0.233 1.00 0.00 C ATOM 329 CG LEU A 360 4.982 -4.546 -0.691 1.00 0.00 C ATOM 330 CD1 LEU A 360 6.110 -4.089 0.237 1.00 0.00 C ATOM 331 CD2 LEU A 360 5.016 -6.073 -0.761 1.00 0.00 C ATOM 0 H LEU A 360 3.266 -3.226 1.975 1.00 0.00 H new ATOM 0 HA LEU A 360 4.342 -2.041 -0.370 1.00 0.00 H new ATOM 0 HB2 LEU A 360 3.332 -4.607 0.689 1.00 0.00 H new ATOM 0 HB3 LEU A 360 2.856 -4.383 -0.983 1.00 0.00 H new ATOM 0 HG LEU A 360 5.149 -4.091 -1.667 1.00 0.00 H new ATOM 0 HD11 LEU A 360 7.065 -4.449 -0.146 1.00 0.00 H new ATOM 0 HD12 LEU A 360 6.125 -3.000 0.283 1.00 0.00 H new ATOM 0 HD13 LEU A 360 5.945 -4.492 1.236 1.00 0.00 H new ATOM 0 HD21 LEU A 360 6.004 -6.400 -1.086 1.00 0.00 H new ATOM 0 HD22 LEU A 360 4.802 -6.487 0.224 1.00 0.00 H new ATOM 0 HD23 LEU A 360 4.266 -6.421 -1.472 1.00 0.00 H new ATOM 343 N LEU A 361 1.057 -2.345 -0.178 1.00 0.00 N ATOM 344 CA LEU A 361 -0.209 -1.871 -0.715 1.00 0.00 C ATOM 345 C LEU A 361 -0.334 -0.363 -0.492 1.00 0.00 C ATOM 346 O LEU A 361 -0.778 0.332 -1.405 1.00 0.00 O ATOM 347 CB LEU A 361 -1.350 -2.676 -0.098 1.00 0.00 C ATOM 348 CG LEU A 361 -1.245 -4.184 -0.424 1.00 0.00 C ATOM 349 CD1 LEU A 361 -2.395 -4.898 0.273 1.00 0.00 C ATOM 350 CD2 LEU A 361 -1.326 -4.521 -1.912 1.00 0.00 C ATOM 0 H LEU A 361 0.960 -2.923 0.657 1.00 0.00 H new ATOM 0 HA LEU A 361 -0.257 -2.027 -1.793 1.00 0.00 H new ATOM 0 HB2 LEU A 361 -1.346 -2.539 0.983 1.00 0.00 H new ATOM 0 HB3 LEU A 361 -2.302 -2.292 -0.464 1.00 0.00 H new ATOM 0 HG LEU A 361 -0.261 -4.505 -0.081 1.00 0.00 H new ATOM 0 HD11 LEU A 361 -2.344 -5.965 0.059 1.00 0.00 H new ATOM 0 HD12 LEU A 361 -2.323 -4.740 1.349 1.00 0.00 H new ATOM 0 HD13 LEU A 361 -3.343 -4.500 -0.089 1.00 0.00 H new ATOM 0 HD21 LEU A 361 -1.244 -5.600 -2.046 1.00 0.00 H new ATOM 0 HD22 LEU A 361 -2.280 -4.178 -2.311 1.00 0.00 H new ATOM 0 HD23 LEU A 361 -0.512 -4.026 -2.442 1.00 0.00 H new ATOM 362 N HIS A 362 0.144 0.160 0.649 1.00 0.00 N ATOM 363 CA HIS A 362 0.237 1.606 0.862 1.00 0.00 C ATOM 364 C HIS A 362 1.155 2.213 -0.206 1.00 0.00 C ATOM 365 O HIS A 362 0.792 3.217 -0.803 1.00 0.00 O ATOM 366 CB HIS A 362 0.726 1.968 2.276 1.00 0.00 C ATOM 367 CG HIS A 362 0.769 3.466 2.497 1.00 0.00 C ATOM 368 ND1 HIS A 362 1.682 4.348 1.975 1.00 0.00 N flip ATOM 369 CD2 HIS A 362 -0.157 4.220 3.185 1.00 0.00 C flip ATOM 370 CE1 HIS A 362 1.292 5.647 2.319 1.00 0.00 C flip ATOM 371 NE2 HIS A 362 0.181 5.517 3.062 1.00 0.00 N flip ATOM 0 H HIS A 362 0.471 -0.401 1.436 1.00 0.00 H new ATOM 0 HA HIS A 362 -0.765 2.025 0.772 1.00 0.00 H new ATOM 0 HB2 HIS A 362 0.067 1.512 3.015 1.00 0.00 H new ATOM 0 HB3 HIS A 362 1.720 1.550 2.434 1.00 0.00 H new ATOM 0 HD2 HIS A 362 -1.007 3.836 3.729 1.00 0.00 H new ATOM 0 HE1 HIS A 362 1.785 6.568 2.043 1.00 0.00 H new ATOM 0 HE2 HIS A 362 -0.335 6.293 3.476 1.00 0.00 H new ATOM 379 N ALA A 363 2.314 1.609 -0.496 1.00 0.00 N ATOM 380 CA ALA A 363 3.223 2.078 -1.537 1.00 0.00 C ATOM 381 C ALA A 363 2.527 2.152 -2.907 1.00 0.00 C ATOM 382 O ALA A 363 2.640 3.178 -3.573 1.00 0.00 O ATOM 383 CB ALA A 363 4.479 1.201 -1.557 1.00 0.00 C ATOM 0 H ALA A 363 2.645 0.776 -0.009 1.00 0.00 H new ATOM 0 HA ALA A 363 3.531 3.098 -1.307 1.00 0.00 H new ATOM 0 HB1 ALA A 363 5.156 1.553 -2.335 1.00 0.00 H new ATOM 0 HB2 ALA A 363 4.978 1.257 -0.589 1.00 0.00 H new ATOM 0 HB3 ALA A 363 4.198 0.168 -1.761 1.00 0.00 H new ATOM 389 N HIS A 364 1.768 1.125 -3.315 1.00 0.00 N ATOM 390 CA HIS A 364 0.997 1.126 -4.565 1.00 0.00 C ATOM 391 C HIS A 364 -0.005 2.297 -4.611 1.00 0.00 C ATOM 392 O HIS A 364 0.032 3.148 -5.506 1.00 0.00 O ATOM 393 CB HIS A 364 0.273 -0.223 -4.700 1.00 0.00 C ATOM 394 CG HIS A 364 -0.396 -0.404 -6.039 1.00 0.00 C ATOM 395 ND1 HIS A 364 -1.730 -0.201 -6.319 1.00 0.00 N ATOM 396 CD2 HIS A 364 0.206 -0.792 -7.206 1.00 0.00 C ATOM 397 CE1 HIS A 364 -1.929 -0.460 -7.623 1.00 0.00 C ATOM 398 NE2 HIS A 364 -0.774 -0.827 -8.209 1.00 0.00 N ATOM 0 H HIS A 364 1.672 0.262 -2.780 1.00 0.00 H new ATOM 0 HA HIS A 364 1.679 1.262 -5.404 1.00 0.00 H new ATOM 0 HB2 HIS A 364 0.989 -1.030 -4.547 1.00 0.00 H new ATOM 0 HB3 HIS A 364 -0.476 -0.307 -3.912 1.00 0.00 H new ATOM 0 HD2 HIS A 364 1.252 -1.029 -7.332 1.00 0.00 H new ATOM 0 HE1 HIS A 364 -2.880 -0.384 -8.129 1.00 0.00 H new ATOM 0 HE2 HIS A 364 -0.638 -1.080 -9.188 1.00 0.00 H new ATOM 406 N LYS A 365 -0.852 2.363 -3.577 1.00 0.00 N ATOM 407 CA LYS A 365 -1.841 3.418 -3.291 1.00 0.00 C ATOM 408 C LYS A 365 -1.263 4.823 -3.419 1.00 0.00 C ATOM 409 O LYS A 365 -1.761 5.662 -4.167 1.00 0.00 O ATOM 410 CB LYS A 365 -2.367 3.147 -1.861 1.00 0.00 C ATOM 411 CG LYS A 365 -2.817 4.363 -1.031 1.00 0.00 C ATOM 412 CD LYS A 365 -3.339 3.869 0.329 1.00 0.00 C ATOM 413 CE LYS A 365 -4.034 5.012 1.077 1.00 0.00 C ATOM 414 NZ LYS A 365 -4.594 4.556 2.378 1.00 0.00 N ATOM 0 H LYS A 365 -0.868 1.631 -2.867 1.00 0.00 H new ATOM 0 HA LYS A 365 -2.647 3.383 -4.024 1.00 0.00 H new ATOM 0 HB2 LYS A 365 -3.210 2.460 -1.936 1.00 0.00 H new ATOM 0 HB3 LYS A 365 -1.584 2.631 -1.306 1.00 0.00 H new ATOM 0 HG2 LYS A 365 -1.984 5.051 -0.888 1.00 0.00 H new ATOM 0 HG3 LYS A 365 -3.597 4.912 -1.558 1.00 0.00 H new ATOM 0 HD2 LYS A 365 -4.036 3.045 0.181 1.00 0.00 H new ATOM 0 HD3 LYS A 365 -2.512 3.484 0.926 1.00 0.00 H new ATOM 0 HE2 LYS A 365 -3.323 5.820 1.250 1.00 0.00 H new ATOM 0 HE3 LYS A 365 -4.834 5.419 0.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 365 -5.057 5.355 2.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 365 -5.291 3.802 2.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 365 -3.827 4.191 2.978 1.00 0.00 H new ATOM 428 N CYS A 366 -0.219 5.065 -2.642 1.00 0.00 N ATOM 429 CA CYS A 366 0.446 6.334 -2.491 1.00 0.00 C ATOM 430 C CYS A 366 1.241 6.695 -3.751 1.00 0.00 C ATOM 431 O CYS A 366 1.287 7.863 -4.113 1.00 0.00 O ATOM 432 CB CYS A 366 1.220 6.201 -1.177 1.00 0.00 C ATOM 433 SG CYS A 366 2.066 7.698 -0.616 1.00 0.00 S ATOM 0 H CYS A 366 0.205 4.334 -2.071 1.00 0.00 H new ATOM 0 HA CYS A 366 -0.216 7.196 -2.410 1.00 0.00 H new ATOM 0 HB2 CYS A 366 0.527 5.883 -0.398 1.00 0.00 H new ATOM 0 HB3 CYS A 366 1.959 5.408 -1.290 1.00 0.00 H new ATOM 0 HG CYS A 366 3.027 7.374 0.197 1.00 0.00 H new ATOM 438 N GLN A 367 1.817 5.733 -4.483 1.00 0.00 N ATOM 439 CA GLN A 367 2.476 6.016 -5.765 1.00 0.00 C ATOM 440 C GLN A 367 1.442 6.496 -6.789 1.00 0.00 C ATOM 441 O GLN A 367 1.668 7.507 -7.458 1.00 0.00 O ATOM 442 CB GLN A 367 3.261 4.787 -6.262 1.00 0.00 C ATOM 443 CG GLN A 367 4.278 5.139 -7.362 1.00 0.00 C ATOM 444 CD GLN A 367 5.435 6.011 -6.869 1.00 0.00 C ATOM 445 OE1 GLN A 367 5.603 6.280 -5.685 1.00 0.00 O ATOM 446 NE2 GLN A 367 6.272 6.496 -7.760 1.00 0.00 N ATOM 0 H GLN A 367 1.840 4.751 -4.209 1.00 0.00 H new ATOM 0 HA GLN A 367 3.202 6.817 -5.625 1.00 0.00 H new ATOM 0 HB2 GLN A 367 3.784 4.330 -5.422 1.00 0.00 H new ATOM 0 HB3 GLN A 367 2.561 4.044 -6.644 1.00 0.00 H new ATOM 0 HG2 GLN A 367 4.681 4.217 -7.781 1.00 0.00 H new ATOM 0 HG3 GLN A 367 3.762 5.657 -8.170 1.00 0.00 H new ATOM 0 HE21 GLN A 367 6.145 6.281 -8.749 1.00 0.00 H new ATOM 0 HE22 GLN A 367 7.048 7.087 -7.462 1.00 0.00 H new ATOM 455 N ARG A 368 0.275 5.835 -6.859 1.00 0.00 N ATOM 456 CA ARG A 368 -0.842 6.261 -7.714 1.00 0.00 C ATOM 457 C ARG A 368 -1.330 7.655 -7.336 1.00 0.00 C ATOM 458 O ARG A 368 -1.437 8.507 -8.217 1.00 0.00 O ATOM 459 CB ARG A 368 -1.957 5.194 -7.688 1.00 0.00 C ATOM 460 CG ARG A 368 -3.225 5.554 -8.482 1.00 0.00 C ATOM 461 CD ARG A 368 -2.957 5.831 -9.968 1.00 0.00 C ATOM 462 NE ARG A 368 -4.207 6.134 -10.692 1.00 0.00 N ATOM 463 CZ ARG A 368 -4.311 6.569 -11.935 1.00 0.00 C ATOM 464 NH1 ARG A 368 -3.270 6.742 -12.699 1.00 0.00 N ATOM 465 NH2 ARG A 368 -5.479 6.844 -12.442 1.00 0.00 N ATOM 0 H ARG A 368 0.081 4.989 -6.323 1.00 0.00 H new ATOM 0 HA ARG A 368 -0.498 6.342 -8.745 1.00 0.00 H new ATOM 0 HB2 ARG A 368 -1.554 4.260 -8.081 1.00 0.00 H new ATOM 0 HB3 ARG A 368 -2.237 5.009 -6.651 1.00 0.00 H new ATOM 0 HG2 ARG A 368 -3.942 4.738 -8.396 1.00 0.00 H new ATOM 0 HG3 ARG A 368 -3.688 6.433 -8.034 1.00 0.00 H new ATOM 0 HD2 ARG A 368 -2.266 6.669 -10.065 1.00 0.00 H new ATOM 0 HD3 ARG A 368 -2.473 4.965 -10.420 1.00 0.00 H new ATOM 0 HE ARG A 368 -5.078 5.993 -10.181 1.00 0.00 H new ATOM 0 HH11 ARG A 368 -2.336 6.540 -12.342 1.00 0.00 H new ATOM 0 HH12 ARG A 368 -3.389 7.080 -13.654 1.00 0.00 H new ATOM 0 HH21 ARG A 368 -6.321 6.724 -11.878 1.00 0.00 H new ATOM 0 HH22 ARG A 368 -5.552 7.180 -13.402 1.00 0.00 H new ATOM 479 N ARG A 369 -1.581 7.914 -6.050 1.00 0.00 N ATOM 480 CA ARG A 369 -2.048 9.233 -5.588 1.00 0.00 C ATOM 481 C ARG A 369 -1.036 10.340 -5.880 1.00 0.00 C ATOM 482 O ARG A 369 -1.409 11.444 -6.269 1.00 0.00 O ATOM 483 CB ARG A 369 -2.480 9.185 -4.098 1.00 0.00 C ATOM 484 CG ARG A 369 -1.527 9.890 -3.106 1.00 0.00 C ATOM 485 CD ARG A 369 -1.790 9.567 -1.637 1.00 0.00 C ATOM 486 NE ARG A 369 -3.167 9.884 -1.206 1.00 0.00 N ATOM 487 CZ ARG A 369 -3.662 9.716 0.007 1.00 0.00 C ATOM 488 NH1 ARG A 369 -2.951 9.222 0.982 1.00 0.00 N ATOM 489 NH2 ARG A 369 -4.894 10.048 0.271 1.00 0.00 N ATOM 0 H ARG A 369 -1.469 7.227 -5.304 1.00 0.00 H new ATOM 0 HA ARG A 369 -2.937 9.489 -6.165 1.00 0.00 H new ATOM 0 HB2 ARG A 369 -3.468 9.637 -4.009 1.00 0.00 H new ATOM 0 HB3 ARG A 369 -2.579 8.141 -3.800 1.00 0.00 H new ATOM 0 HG2 ARG A 369 -0.501 9.612 -3.348 1.00 0.00 H new ATOM 0 HG3 ARG A 369 -1.608 10.968 -3.248 1.00 0.00 H new ATOM 0 HD2 ARG A 369 -1.598 8.508 -1.465 1.00 0.00 H new ATOM 0 HD3 ARG A 369 -1.086 10.123 -1.018 1.00 0.00 H new ATOM 0 HE ARG A 369 -3.795 10.269 -1.912 1.00 0.00 H new ATOM 0 HH11 ARG A 369 -1.981 8.952 0.820 1.00 0.00 H new ATOM 0 HH12 ARG A 369 -3.365 9.106 1.907 1.00 0.00 H new ATOM 0 HH21 ARG A 369 -5.484 10.441 -0.462 1.00 0.00 H new ATOM 0 HH22 ARG A 369 -5.268 9.915 1.211 1.00 0.00 H new ATOM 503 N GLU A 370 0.248 10.040 -5.690 1.00 0.00 N ATOM 504 CA GLU A 370 1.351 10.977 -5.883 1.00 0.00 C ATOM 505 C GLU A 370 1.441 11.393 -7.353 1.00 0.00 C ATOM 506 O GLU A 370 1.317 12.568 -7.692 1.00 0.00 O ATOM 507 CB GLU A 370 2.649 10.309 -5.410 1.00 0.00 C ATOM 508 CG GLU A 370 3.899 11.197 -5.445 1.00 0.00 C ATOM 509 CD GLU A 370 5.112 10.514 -4.768 1.00 0.00 C ATOM 510 OE1 GLU A 370 4.928 9.671 -3.858 1.00 0.00 O ATOM 511 OE2 GLU A 370 6.282 10.822 -5.091 1.00 0.00 O ATOM 0 H GLU A 370 0.557 9.115 -5.390 1.00 0.00 H new ATOM 0 HA GLU A 370 1.183 11.882 -5.299 1.00 0.00 H new ATOM 0 HB2 GLU A 370 2.504 9.956 -4.389 1.00 0.00 H new ATOM 0 HB3 GLU A 370 2.831 9.430 -6.029 1.00 0.00 H new ATOM 0 HG2 GLU A 370 4.147 11.434 -6.480 1.00 0.00 H new ATOM 0 HG3 GLU A 370 3.688 12.141 -4.943 1.00 0.00 H new ATOM 518 N GLN A 371 1.588 10.405 -8.236 1.00 0.00 N ATOM 519 CA GLN A 371 1.651 10.612 -9.688 1.00 0.00 C ATOM 520 C GLN A 371 0.376 11.267 -10.252 1.00 0.00 C ATOM 521 O GLN A 371 0.453 12.029 -11.219 1.00 0.00 O ATOM 522 CB GLN A 371 1.913 9.266 -10.384 1.00 0.00 C ATOM 523 CG GLN A 371 3.326 8.731 -10.100 1.00 0.00 C ATOM 524 CD GLN A 371 3.569 7.354 -10.720 1.00 0.00 C ATOM 525 OE1 GLN A 371 2.755 6.442 -10.648 1.00 0.00 O ATOM 526 NE2 GLN A 371 4.703 7.136 -11.355 1.00 0.00 N ATOM 0 H GLN A 371 1.668 9.426 -7.962 1.00 0.00 H new ATOM 0 HA GLN A 371 2.470 11.303 -9.887 1.00 0.00 H new ATOM 0 HB2 GLN A 371 1.176 8.536 -10.049 1.00 0.00 H new ATOM 0 HB3 GLN A 371 1.780 9.383 -11.460 1.00 0.00 H new ATOM 0 HG2 GLN A 371 4.062 9.435 -10.488 1.00 0.00 H new ATOM 0 HG3 GLN A 371 3.478 8.672 -9.022 1.00 0.00 H new ATOM 0 HE21 GLN A 371 5.397 7.880 -11.429 1.00 0.00 H new ATOM 0 HE22 GLN A 371 4.886 6.224 -11.773 1.00 0.00 H new ATOM 535 N ALA A 372 -0.792 10.981 -9.664 1.00 0.00 N ATOM 536 CA ALA A 372 -2.073 11.535 -10.115 1.00 0.00 C ATOM 537 C ALA A 372 -2.356 12.976 -9.639 1.00 0.00 C ATOM 538 O ALA A 372 -2.902 13.766 -10.415 1.00 0.00 O ATOM 539 CB ALA A 372 -3.206 10.598 -9.675 1.00 0.00 C ATOM 0 H ALA A 372 -0.875 10.358 -8.861 1.00 0.00 H new ATOM 0 HA ALA A 372 -2.015 11.601 -11.201 1.00 0.00 H new ATOM 0 HB1 ALA A 372 -4.162 11.003 -10.006 1.00 0.00 H new ATOM 0 HB2 ALA A 372 -3.056 9.613 -10.117 1.00 0.00 H new ATOM 0 HB3 ALA A 372 -3.206 10.512 -8.588 1.00 0.00 H new ATOM 652 N LEU A 381 4.697 8.719 6.297 1.00 0.00 N ATOM 653 CA LEU A 381 5.152 7.401 6.765 1.00 0.00 C ATOM 654 C LEU A 381 6.652 7.195 6.439 1.00 0.00 C ATOM 655 O LEU A 381 7.054 7.407 5.290 1.00 0.00 O ATOM 656 CB LEU A 381 4.296 6.286 6.126 1.00 0.00 C ATOM 657 CG LEU A 381 3.041 5.882 6.921 1.00 0.00 C ATOM 658 CD1 LEU A 381 2.000 6.999 6.995 1.00 0.00 C ATOM 659 CD2 LEU A 381 2.394 4.661 6.262 1.00 0.00 C ATOM 0 HA LEU A 381 5.032 7.354 7.847 1.00 0.00 H new ATOM 0 HB2 LEU A 381 3.987 6.612 5.133 1.00 0.00 H new ATOM 0 HB3 LEU A 381 4.921 5.403 5.992 1.00 0.00 H new ATOM 0 HG LEU A 381 3.367 5.661 7.937 1.00 0.00 H new ATOM 0 HD11 LEU A 381 1.138 6.656 7.567 1.00 0.00 H new ATOM 0 HD12 LEU A 381 2.436 7.871 7.483 1.00 0.00 H new ATOM 0 HD13 LEU A 381 1.683 7.268 5.987 1.00 0.00 H new ATOM 0 HD21 LEU A 381 1.505 4.373 6.823 1.00 0.00 H new ATOM 0 HD22 LEU A 381 2.113 4.906 5.238 1.00 0.00 H new ATOM 0 HD23 LEU A 381 3.103 3.833 6.255 1.00 0.00 H new ATOM 671 N PRO A 382 7.498 6.771 7.402 1.00 0.00 N ATOM 672 CA PRO A 382 8.935 6.584 7.171 1.00 0.00 C ATOM 673 C PRO A 382 9.261 5.396 6.248 1.00 0.00 C ATOM 674 O PRO A 382 10.164 5.490 5.415 1.00 0.00 O ATOM 675 CB PRO A 382 9.545 6.411 8.568 1.00 0.00 C ATOM 676 CG PRO A 382 8.401 5.836 9.404 1.00 0.00 C ATOM 677 CD PRO A 382 7.161 6.485 8.792 1.00 0.00 C ATOM 0 HA PRO A 382 9.353 7.440 6.641 1.00 0.00 H new ATOM 0 HB2 PRO A 382 10.402 5.738 8.548 1.00 0.00 H new ATOM 0 HB3 PRO A 382 9.895 7.361 8.971 1.00 0.00 H new ATOM 0 HG2 PRO A 382 8.361 4.749 9.338 1.00 0.00 H new ATOM 0 HG3 PRO A 382 8.508 6.087 10.459 1.00 0.00 H new ATOM 0 HD2 PRO A 382 6.301 5.818 8.855 1.00 0.00 H new ATOM 0 HD3 PRO A 382 6.896 7.398 9.325 1.00 0.00 H new ATOM 685 N HIS A 383 8.532 4.279 6.371 1.00 0.00 N ATOM 686 CA HIS A 383 8.740 3.069 5.560 1.00 0.00 C ATOM 687 C HIS A 383 8.176 3.173 4.133 1.00 0.00 C ATOM 688 O HIS A 383 8.589 2.417 3.253 1.00 0.00 O ATOM 689 CB HIS A 383 8.088 1.868 6.261 1.00 0.00 C ATOM 690 CG HIS A 383 8.512 1.676 7.697 1.00 0.00 C ATOM 691 ND1 HIS A 383 9.798 1.503 8.158 1.00 0.00 N ATOM 692 CD2 HIS A 383 7.684 1.645 8.787 1.00 0.00 C ATOM 693 CE1 HIS A 383 9.749 1.376 9.495 1.00 0.00 C ATOM 694 NE2 HIS A 383 8.478 1.457 9.927 1.00 0.00 N ATOM 0 H HIS A 383 7.771 4.188 7.044 1.00 0.00 H new ATOM 0 HA HIS A 383 9.819 2.944 5.468 1.00 0.00 H new ATOM 0 HB2 HIS A 383 7.005 1.988 6.228 1.00 0.00 H new ATOM 0 HB3 HIS A 383 8.326 0.964 5.701 1.00 0.00 H new ATOM 0 HD2 HIS A 383 6.609 1.747 8.771 1.00 0.00 H new ATOM 0 HE1 HIS A 383 10.609 1.230 10.132 1.00 0.00 H new ATOM 0 HE2 HIS A 383 8.156 1.394 10.893 1.00 0.00 H new ATOM 702 N CYS A 384 7.235 4.096 3.899 1.00 0.00 N ATOM 703 CA CYS A 384 6.547 4.309 2.626 1.00 0.00 C ATOM 704 C CYS A 384 7.496 4.391 1.427 1.00 0.00 C ATOM 705 O CYS A 384 7.368 3.633 0.468 1.00 0.00 O ATOM 706 CB CYS A 384 5.742 5.601 2.774 1.00 0.00 C ATOM 707 SG CYS A 384 4.678 5.861 1.333 1.00 0.00 S ATOM 0 H CYS A 384 6.921 4.741 4.624 1.00 0.00 H new ATOM 0 HA CYS A 384 5.906 3.453 2.417 1.00 0.00 H new ATOM 0 HB2 CYS A 384 5.134 5.555 3.678 1.00 0.00 H new ATOM 0 HB3 CYS A 384 6.420 6.447 2.889 1.00 0.00 H new ATOM 0 HG CYS A 384 3.602 5.142 1.453 1.00 0.00 H new ATOM 712 N ARG A 385 8.474 5.300 1.495 1.00 0.00 N ATOM 713 CA ARG A 385 9.465 5.547 0.435 1.00 0.00 C ATOM 714 C ARG A 385 10.342 4.318 0.153 1.00 0.00 C ATOM 715 O ARG A 385 10.626 4.013 -1.004 1.00 0.00 O ATOM 716 CB ARG A 385 10.291 6.788 0.803 1.00 0.00 C ATOM 717 CG ARG A 385 9.472 8.040 1.175 1.00 0.00 C ATOM 718 CD ARG A 385 8.256 8.388 0.303 1.00 0.00 C ATOM 719 NE ARG A 385 8.596 8.743 -1.092 1.00 0.00 N ATOM 720 CZ ARG A 385 7.751 9.261 -1.970 1.00 0.00 C ATOM 721 NH1 ARG A 385 6.508 9.485 -1.663 1.00 0.00 N ATOM 722 NH2 ARG A 385 8.108 9.554 -3.185 1.00 0.00 N ATOM 0 H ARG A 385 8.604 5.901 2.308 1.00 0.00 H new ATOM 0 HA ARG A 385 8.940 5.740 -0.501 1.00 0.00 H new ATOM 0 HB2 ARG A 385 10.940 6.536 1.642 1.00 0.00 H new ATOM 0 HB3 ARG A 385 10.939 7.035 -0.038 1.00 0.00 H new ATOM 0 HG2 ARG A 385 9.124 7.920 2.201 1.00 0.00 H new ATOM 0 HG3 ARG A 385 10.147 8.896 1.165 1.00 0.00 H new ATOM 0 HD2 ARG A 385 7.573 7.538 0.294 1.00 0.00 H new ATOM 0 HD3 ARG A 385 7.722 9.222 0.759 1.00 0.00 H new ATOM 0 HE ARG A 385 9.554 8.576 -1.401 1.00 0.00 H new ATOM 0 HH11 ARG A 385 6.165 9.261 -0.729 1.00 0.00 H new ATOM 0 HH12 ARG A 385 5.876 9.885 -2.356 1.00 0.00 H new ATOM 0 HH21 ARG A 385 9.067 9.386 -3.489 1.00 0.00 H new ATOM 0 HH22 ARG A 385 7.429 9.952 -3.834 1.00 0.00 H new ATOM 736 N THR A 386 10.707 3.564 1.190 1.00 0.00 N ATOM 737 CA THR A 386 11.464 2.304 1.069 1.00 0.00 C ATOM 738 C THR A 386 10.608 1.251 0.371 1.00 0.00 C ATOM 739 O THR A 386 11.062 0.615 -0.577 1.00 0.00 O ATOM 740 CB THR A 386 11.914 1.783 2.446 1.00 0.00 C ATOM 741 OG1 THR A 386 12.642 2.794 3.114 1.00 0.00 O ATOM 742 CG2 THR A 386 12.827 0.559 2.341 1.00 0.00 C ATOM 0 H THR A 386 10.485 3.809 2.155 1.00 0.00 H new ATOM 0 HA THR A 386 12.357 2.503 0.476 1.00 0.00 H new ATOM 0 HB THR A 386 11.010 1.503 2.987 1.00 0.00 H new ATOM 0 HG1 THR A 386 12.928 2.465 3.992 1.00 0.00 H new ATOM 0 HG21 THR A 386 13.115 0.233 3.340 1.00 0.00 H new ATOM 0 HG22 THR A 386 12.297 -0.248 1.834 1.00 0.00 H new ATOM 0 HG23 THR A 386 13.720 0.819 1.773 1.00 0.00 H new ATOM 750 N MET A 387 9.345 1.093 0.774 1.00 0.00 N ATOM 751 CA MET A 387 8.415 0.150 0.147 1.00 0.00 C ATOM 752 C MET A 387 8.088 0.550 -1.300 1.00 0.00 C ATOM 753 O MET A 387 8.018 -0.306 -2.175 1.00 0.00 O ATOM 754 CB MET A 387 7.137 0.059 0.982 1.00 0.00 C ATOM 755 CG MET A 387 7.288 -0.620 2.359 1.00 0.00 C ATOM 756 SD MET A 387 8.873 -1.387 2.838 1.00 0.00 S ATOM 757 CE MET A 387 8.761 -2.996 2.010 1.00 0.00 C ATOM 0 H MET A 387 8.937 1.618 1.548 1.00 0.00 H new ATOM 0 HA MET A 387 8.894 -0.828 0.110 1.00 0.00 H new ATOM 0 HB2 MET A 387 6.751 1.067 1.134 1.00 0.00 H new ATOM 0 HB3 MET A 387 6.387 -0.486 0.408 1.00 0.00 H new ATOM 0 HG2 MET A 387 7.050 0.128 3.115 1.00 0.00 H new ATOM 0 HG3 MET A 387 6.523 -1.394 2.423 1.00 0.00 H new ATOM 0 HE1 MET A 387 9.710 -3.523 2.110 1.00 0.00 H new ATOM 0 HE2 MET A 387 7.967 -3.586 2.468 1.00 0.00 H new ATOM 0 HE3 MET A 387 8.539 -2.847 0.953 1.00 0.00 H new ATOM 767 N LYS A 388 7.955 1.848 -1.585 1.00 0.00 N ATOM 768 CA LYS A 388 7.809 2.409 -2.940 1.00 0.00 C ATOM 769 C LYS A 388 9.030 2.043 -3.792 1.00 0.00 C ATOM 770 O LYS A 388 8.867 1.637 -4.944 1.00 0.00 O ATOM 771 CB LYS A 388 7.641 3.931 -2.819 1.00 0.00 C ATOM 772 CG LYS A 388 6.189 4.368 -2.557 1.00 0.00 C ATOM 773 CD LYS A 388 6.164 5.797 -2.001 1.00 0.00 C ATOM 774 CE LYS A 388 4.757 6.409 -1.928 1.00 0.00 C ATOM 775 NZ LYS A 388 4.389 7.074 -3.199 1.00 0.00 N ATOM 0 H LYS A 388 7.945 2.564 -0.859 1.00 0.00 H new ATOM 0 HA LYS A 388 6.931 1.994 -3.434 1.00 0.00 H new ATOM 0 HB2 LYS A 388 8.274 4.295 -2.010 1.00 0.00 H new ATOM 0 HB3 LYS A 388 7.994 4.402 -3.736 1.00 0.00 H new ATOM 0 HG2 LYS A 388 5.613 4.318 -3.481 1.00 0.00 H new ATOM 0 HG3 LYS A 388 5.717 3.686 -1.850 1.00 0.00 H new ATOM 0 HD2 LYS A 388 6.602 5.796 -1.003 1.00 0.00 H new ATOM 0 HD3 LYS A 388 6.794 6.431 -2.625 1.00 0.00 H new ATOM 0 HE2 LYS A 388 4.031 5.629 -1.701 1.00 0.00 H new ATOM 0 HE3 LYS A 388 4.715 7.131 -1.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 3.373 7.296 -3.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 4.935 7.953 -3.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 4.600 6.440 -3.996 1.00 0.00 H new ATOM 789 N ASN A 389 10.238 2.108 -3.220 1.00 0.00 N ATOM 790 CA ASN A 389 11.465 1.683 -3.913 1.00 0.00 C ATOM 791 C ASN A 389 11.465 0.160 -4.158 1.00 0.00 C ATOM 792 O ASN A 389 11.812 -0.278 -5.251 1.00 0.00 O ATOM 793 CB ASN A 389 12.717 2.141 -3.138 1.00 0.00 C ATOM 794 CG ASN A 389 12.979 3.640 -3.198 1.00 0.00 C ATOM 795 OD1 ASN A 389 12.422 4.384 -3.995 1.00 0.00 O ATOM 796 ND2 ASN A 389 13.875 4.132 -2.370 1.00 0.00 N ATOM 0 H ASN A 389 10.395 2.453 -2.273 1.00 0.00 H new ATOM 0 HA ASN A 389 11.491 2.165 -4.890 1.00 0.00 H new ATOM 0 HB2 ASN A 389 12.613 1.844 -2.094 1.00 0.00 H new ATOM 0 HB3 ASN A 389 13.587 1.616 -3.533 1.00 0.00 H new ATOM 0 HD21 ASN A 389 14.101 5.126 -2.395 1.00 0.00 H new ATOM 0 HD22 ASN A 389 14.344 3.519 -1.703 1.00 0.00 H new ATOM 803 N VAL A 390 11.022 -0.647 -3.186 1.00 0.00 N ATOM 804 CA VAL A 390 10.864 -2.115 -3.294 1.00 0.00 C ATOM 805 C VAL A 390 9.849 -2.476 -4.386 1.00 0.00 C ATOM 806 O VAL A 390 10.065 -3.418 -5.144 1.00 0.00 O ATOM 807 CB VAL A 390 10.414 -2.684 -1.932 1.00 0.00 C ATOM 808 CG1 VAL A 390 9.880 -4.121 -1.972 1.00 0.00 C ATOM 809 CG2 VAL A 390 11.552 -2.660 -0.911 1.00 0.00 C ATOM 0 H VAL A 390 10.753 -0.291 -2.269 1.00 0.00 H new ATOM 0 HA VAL A 390 11.823 -2.554 -3.570 1.00 0.00 H new ATOM 0 HB VAL A 390 9.594 -2.025 -1.645 1.00 0.00 H new ATOM 0 HG11 VAL A 390 9.590 -4.429 -0.968 1.00 0.00 H new ATOM 0 HG12 VAL A 390 9.013 -4.169 -2.631 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.657 -4.788 -2.346 1.00 0.00 H new ATOM 0 HG21 VAL A 390 11.199 -3.068 0.036 1.00 0.00 H new ATOM 0 HG22 VAL A 390 12.383 -3.262 -1.278 1.00 0.00 H new ATOM 0 HG23 VAL A 390 11.886 -1.633 -0.762 1.00 0.00 H new ATOM 819 N LEU A 391 8.753 -1.721 -4.500 1.00 0.00 N ATOM 820 CA LEU A 391 7.721 -1.929 -5.516 1.00 0.00 C ATOM 821 C LEU A 391 8.282 -1.584 -6.906 1.00 0.00 C ATOM 822 O LEU A 391 8.246 -2.415 -7.812 1.00 0.00 O ATOM 823 CB LEU A 391 6.481 -1.095 -5.131 1.00 0.00 C ATOM 824 CG LEU A 391 5.146 -1.571 -5.733 1.00 0.00 C ATOM 825 CD1 LEU A 391 4.033 -0.648 -5.240 1.00 0.00 C ATOM 826 CD2 LEU A 391 5.107 -1.575 -7.260 1.00 0.00 C ATOM 0 H LEU A 391 8.556 -0.936 -3.879 1.00 0.00 H new ATOM 0 HA LEU A 391 7.414 -2.974 -5.562 1.00 0.00 H new ATOM 0 HB2 LEU A 391 6.389 -1.094 -4.045 1.00 0.00 H new ATOM 0 HB3 LEU A 391 6.650 -0.063 -5.438 1.00 0.00 H new ATOM 0 HG LEU A 391 5.018 -2.604 -5.409 1.00 0.00 H new ATOM 0 HD11 LEU A 391 3.080 -0.972 -5.658 1.00 0.00 H new ATOM 0 HD12 LEU A 391 3.984 -0.686 -4.152 1.00 0.00 H new ATOM 0 HD13 LEU A 391 4.240 0.374 -5.558 1.00 0.00 H new ATOM 0 HD21 LEU A 391 4.131 -1.924 -7.598 1.00 0.00 H new ATOM 0 HD22 LEU A 391 5.280 -0.565 -7.631 1.00 0.00 H new ATOM 0 HD23 LEU A 391 5.882 -2.239 -7.642 1.00 0.00 H new ATOM 838 N ASN A 392 8.884 -0.402 -7.074 1.00 0.00 N ATOM 839 CA ASN A 392 9.536 -0.013 -8.332 1.00 0.00 C ATOM 840 C ASN A 392 10.663 -1.001 -8.707 1.00 0.00 C ATOM 841 O ASN A 392 10.892 -1.294 -9.882 1.00 0.00 O ATOM 842 CB ASN A 392 10.046 1.430 -8.191 1.00 0.00 C ATOM 843 CG ASN A 392 10.681 1.946 -9.473 1.00 0.00 C ATOM 844 OD1 ASN A 392 10.028 2.133 -10.489 1.00 0.00 O ATOM 845 ND2 ASN A 392 11.970 2.210 -9.468 1.00 0.00 N ATOM 0 H ASN A 392 8.934 0.311 -6.346 1.00 0.00 H new ATOM 0 HA ASN A 392 8.818 -0.053 -9.151 1.00 0.00 H new ATOM 0 HB2 ASN A 392 9.217 2.080 -7.912 1.00 0.00 H new ATOM 0 HB3 ASN A 392 10.775 1.478 -7.382 1.00 0.00 H new ATOM 0 HD21 ASN A 392 12.420 2.569 -10.310 1.00 0.00 H new ATOM 0 HD22 ASN A 392 12.519 2.055 -8.622 1.00 0.00 H new ATOM 852 N HIS A 393 11.331 -1.581 -7.704 1.00 0.00 N ATOM 853 CA HIS A 393 12.297 -2.645 -7.934 1.00 0.00 C ATOM 854 C HIS A 393 11.563 -3.873 -8.477 1.00 0.00 C ATOM 855 O HIS A 393 11.955 -4.367 -9.527 1.00 0.00 O ATOM 856 CB HIS A 393 13.113 -2.957 -6.678 1.00 0.00 C ATOM 857 CG HIS A 393 14.065 -4.104 -6.906 1.00 0.00 C ATOM 858 ND1 HIS A 393 13.713 -5.425 -6.917 1.00 0.00 N flip ATOM 859 CD2 HIS A 393 15.376 -4.033 -7.321 1.00 0.00 C flip ATOM 860 CE1 HIS A 393 14.802 -6.169 -7.389 1.00 0.00 C flip ATOM 861 NE2 HIS A 393 15.793 -5.283 -7.596 1.00 0.00 N flip ATOM 0 H HIS A 393 11.215 -1.326 -6.723 1.00 0.00 H new ATOM 0 HA HIS A 393 13.024 -2.317 -8.677 1.00 0.00 H new ATOM 0 HB2 HIS A 393 13.674 -2.072 -6.379 1.00 0.00 H new ATOM 0 HB3 HIS A 393 12.439 -3.200 -5.857 1.00 0.00 H new ATOM 0 HD1 HIS A 393 12.811 -5.804 -6.630 1.00 0.00 H new ATOM 0 HD2 HIS A 393 15.966 -3.133 -7.410 1.00 0.00 H new ATOM 0 HE1 HIS A 393 14.839 -7.236 -7.553 1.00 0.00 H new ATOM 869 N MET A 394 10.480 -4.338 -7.832 1.00 0.00 N ATOM 870 CA MET A 394 9.697 -5.479 -8.329 1.00 0.00 C ATOM 871 C MET A 394 9.166 -5.253 -9.758 1.00 0.00 C ATOM 872 O MET A 394 8.999 -6.226 -10.495 1.00 0.00 O ATOM 873 CB MET A 394 8.592 -5.948 -7.354 1.00 0.00 C ATOM 874 CG MET A 394 7.197 -5.311 -7.481 1.00 0.00 C ATOM 875 SD MET A 394 5.802 -6.396 -7.051 1.00 0.00 S ATOM 876 CE MET A 394 6.164 -6.722 -5.308 1.00 0.00 C ATOM 0 H MET A 394 10.127 -3.939 -6.962 1.00 0.00 H new ATOM 0 HA MET A 394 10.402 -6.308 -8.384 1.00 0.00 H new ATOM 0 HB2 MET A 394 8.479 -7.026 -7.472 1.00 0.00 H new ATOM 0 HB3 MET A 394 8.947 -5.774 -6.338 1.00 0.00 H new ATOM 0 HG2 MET A 394 7.160 -4.429 -6.842 1.00 0.00 H new ATOM 0 HG3 MET A 394 7.065 -4.967 -8.507 1.00 0.00 H new ATOM 0 HE1 MET A 394 5.397 -7.377 -4.893 1.00 0.00 H new ATOM 0 HE2 MET A 394 7.138 -7.204 -5.223 1.00 0.00 H new ATOM 0 HE3 MET A 394 6.175 -5.782 -4.757 1.00 0.00 H new ATOM 886 N THR A 395 8.930 -3.996 -10.175 1.00 0.00 N ATOM 887 CA THR A 395 8.487 -3.711 -11.558 1.00 0.00 C ATOM 888 C THR A 395 9.655 -3.789 -12.549 1.00 0.00 C ATOM 889 O THR A 395 9.497 -4.392 -13.614 1.00 0.00 O ATOM 890 CB THR A 395 7.721 -2.387 -11.745 1.00 0.00 C ATOM 891 OG1 THR A 395 8.527 -1.252 -11.548 1.00 0.00 O ATOM 892 CG2 THR A 395 6.517 -2.250 -10.818 1.00 0.00 C ATOM 0 H THR A 395 9.036 -3.170 -9.586 1.00 0.00 H new ATOM 0 HA THR A 395 7.765 -4.499 -11.772 1.00 0.00 H new ATOM 0 HB THR A 395 7.386 -2.432 -12.781 1.00 0.00 H new ATOM 0 HG1 THR A 395 9.272 -1.479 -10.953 1.00 0.00 H new ATOM 0 HG21 THR A 395 6.023 -1.296 -11.002 1.00 0.00 H new ATOM 0 HG22 THR A 395 5.817 -3.064 -11.008 1.00 0.00 H new ATOM 0 HG23 THR A 395 6.850 -2.293 -9.781 1.00 0.00 H new ATOM 900 N HIS A 396 10.832 -3.236 -12.220 1.00 0.00 N ATOM 901 CA HIS A 396 12.028 -3.323 -13.079 1.00 0.00 C ATOM 902 C HIS A 396 12.798 -4.665 -12.979 1.00 0.00 C ATOM 903 O HIS A 396 13.741 -4.890 -13.745 1.00 0.00 O ATOM 904 CB HIS A 396 12.936 -2.091 -12.896 1.00 0.00 C ATOM 905 CG HIS A 396 13.896 -2.104 -11.728 1.00 0.00 C ATOM 906 ND1 HIS A 396 14.932 -2.992 -11.529 1.00 0.00 N ATOM 907 CD2 HIS A 396 14.019 -1.132 -10.771 1.00 0.00 C ATOM 908 CE1 HIS A 396 15.644 -2.583 -10.467 1.00 0.00 C ATOM 909 NE2 HIS A 396 15.127 -1.446 -9.968 1.00 0.00 N ATOM 0 H HIS A 396 10.984 -2.717 -11.355 1.00 0.00 H new ATOM 0 HA HIS A 396 11.660 -3.313 -14.105 1.00 0.00 H new ATOM 0 HB2 HIS A 396 13.517 -1.962 -13.809 1.00 0.00 H new ATOM 0 HB3 HIS A 396 12.297 -1.213 -12.798 1.00 0.00 H new ATOM 0 HD2 HIS A 396 13.375 -0.273 -10.654 1.00 0.00 H new ATOM 0 HE1 HIS A 396 16.509 -3.094 -10.070 1.00 0.00 H new ATOM 0 HE2 HIS A 396 15.471 -0.917 -9.166 1.00 0.00 H new ATOM 917 N CYS A 397 12.452 -5.520 -12.008 1.00 0.00 N ATOM 918 CA CYS A 397 13.071 -6.804 -11.671 1.00 0.00 C ATOM 919 C CYS A 397 13.250 -7.760 -12.867 1.00 0.00 C ATOM 920 O CYS A 397 12.520 -7.694 -13.863 1.00 0.00 O ATOM 921 CB CYS A 397 12.189 -7.442 -10.585 1.00 0.00 C ATOM 922 SG CYS A 397 13.116 -8.570 -9.511 1.00 0.00 S ATOM 0 H CYS A 397 11.668 -5.313 -11.389 1.00 0.00 H new ATOM 0 HA CYS A 397 14.088 -6.621 -11.325 1.00 0.00 H new ATOM 0 HB2 CYS A 397 11.739 -6.656 -9.979 1.00 0.00 H new ATOM 0 HB3 CYS A 397 11.372 -7.986 -11.059 1.00 0.00 H new ATOM 0 HG CYS A 397 12.731 -8.411 -8.280 1.00 0.00 H new ATOM 927 N GLN A 398 14.206 -8.686 -12.738 1.00 0.00 N ATOM 928 CA GLN A 398 14.537 -9.692 -13.761 1.00 0.00 C ATOM 929 C GLN A 398 14.536 -11.141 -13.240 1.00 0.00 C ATOM 930 O GLN A 398 15.112 -12.046 -13.849 1.00 0.00 O ATOM 931 CB GLN A 398 15.844 -9.307 -14.484 1.00 0.00 C ATOM 932 CG GLN A 398 15.764 -7.933 -15.176 1.00 0.00 C ATOM 933 CD GLN A 398 16.989 -7.597 -16.030 1.00 0.00 C ATOM 934 OE1 GLN A 398 18.025 -8.252 -16.009 1.00 0.00 O ATOM 935 NE2 GLN A 398 16.920 -6.550 -16.826 1.00 0.00 N ATOM 0 H GLN A 398 14.786 -8.761 -11.902 1.00 0.00 H new ATOM 0 HA GLN A 398 13.730 -9.681 -14.493 1.00 0.00 H new ATOM 0 HB2 GLN A 398 16.662 -9.299 -13.764 1.00 0.00 H new ATOM 0 HB3 GLN A 398 16.080 -10.069 -15.227 1.00 0.00 H new ATOM 0 HG2 GLN A 398 14.875 -7.906 -15.806 1.00 0.00 H new ATOM 0 HG3 GLN A 398 15.640 -7.161 -14.416 1.00 0.00 H new ATOM 0 HE21 GLN A 398 16.068 -5.990 -16.860 1.00 0.00 H new ATOM 0 HE22 GLN A 398 17.719 -6.299 -17.409 1.00 0.00 H new ATOM 944 N ALA A 399 13.837 -11.362 -12.126 1.00 0.00 N ATOM 945 CA ALA A 399 13.626 -12.674 -11.518 1.00 0.00 C ATOM 946 C ALA A 399 12.337 -12.745 -10.692 1.00 0.00 C ATOM 947 O ALA A 399 11.657 -13.771 -10.710 1.00 0.00 O ATOM 948 CB ALA A 399 14.804 -13.014 -10.596 1.00 0.00 C ATOM 0 H ALA A 399 13.388 -10.608 -11.606 1.00 0.00 H new ATOM 0 HA ALA A 399 13.545 -13.387 -12.338 1.00 0.00 H new ATOM 0 HB1 ALA A 399 14.642 -13.993 -10.145 1.00 0.00 H new ATOM 0 HB2 ALA A 399 15.727 -13.030 -11.176 1.00 0.00 H new ATOM 0 HB3 ALA A 399 14.881 -12.261 -9.811 1.00 0.00 H new ATOM 954 N PRO A 400 12.028 -11.672 -9.958 1.00 0.00 N ATOM 955 CA PRO A 400 10.898 -11.536 -9.025 1.00 0.00 C ATOM 956 C PRO A 400 10.886 -12.547 -7.860 1.00 0.00 C ATOM 957 O PRO A 400 11.072 -12.173 -6.703 1.00 0.00 O ATOM 961 N LYS A 401 10.697 -13.839 -8.162 1.00 0.00 N ATOM 962 CA LYS A 401 10.701 -14.972 -7.211 1.00 0.00 C ATOM 963 C LYS A 401 12.124 -15.411 -6.857 1.00 0.00 C ATOM 964 O LYS A 401 12.480 -15.550 -5.688 1.00 0.00 O ATOM 965 CB LYS A 401 9.913 -16.161 -7.793 1.00 0.00 C ATOM 966 CG LYS A 401 8.415 -15.862 -7.953 1.00 0.00 C ATOM 967 CD LYS A 401 7.669 -17.109 -8.449 1.00 0.00 C ATOM 968 CE LYS A 401 6.180 -16.798 -8.649 1.00 0.00 C ATOM 969 NZ LYS A 401 5.431 -17.993 -9.115 1.00 0.00 N ATOM 0 H LYS A 401 10.529 -14.143 -9.121 1.00 0.00 H new ATOM 0 HA LYS A 401 10.219 -14.632 -6.294 1.00 0.00 H new ATOM 0 HB2 LYS A 401 10.331 -16.428 -8.764 1.00 0.00 H new ATOM 0 HB3 LYS A 401 10.038 -17.027 -7.143 1.00 0.00 H new ATOM 0 HG2 LYS A 401 7.999 -15.537 -6.999 1.00 0.00 H new ATOM 0 HG3 LYS A 401 8.275 -15.042 -8.658 1.00 0.00 H new ATOM 0 HD2 LYS A 401 8.105 -17.452 -9.388 1.00 0.00 H new ATOM 0 HD3 LYS A 401 7.784 -17.920 -7.729 1.00 0.00 H new ATOM 0 HE2 LYS A 401 5.753 -16.442 -7.711 1.00 0.00 H new ATOM 0 HE3 LYS A 401 6.070 -15.993 -9.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 401 4.428 -17.747 -9.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 401 5.824 -18.317 -10.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 401 5.516 -18.753 -8.410 1.00 0.00 H new ATOM 983 N ALA A 402 12.942 -15.589 -7.897 1.00 0.00 N ATOM 984 CA ALA A 402 14.358 -15.956 -7.839 1.00 0.00 C ATOM 985 C ALA A 402 15.254 -14.790 -7.362 1.00 0.00 C ATOM 986 O ALA A 402 16.439 -14.992 -7.087 1.00 0.00 O ATOM 987 CB ALA A 402 14.790 -16.584 -9.173 1.00 0.00 C ATOM 0 H ALA A 402 12.615 -15.474 -8.856 1.00 0.00 H new ATOM 0 HA ALA A 402 14.494 -16.719 -7.072 1.00 0.00 H new ATOM 0 HB1 ALA A 402 15.845 -16.855 -9.123 1.00 0.00 H new ATOM 0 HB2 ALA A 402 14.195 -17.477 -9.364 1.00 0.00 H new ATOM 0 HB3 ALA A 402 14.637 -15.867 -9.979 1.00 0.00 H new ATOM 993 N CYS A 403 14.692 -13.574 -7.258 1.00 0.00 N ATOM 994 CA CYS A 403 15.296 -12.334 -6.779 1.00 0.00 C ATOM 995 C CYS A 403 15.340 -12.346 -5.250 1.00 0.00 C ATOM 996 O CYS A 403 14.805 -11.485 -4.554 1.00 0.00 O ATOM 997 CB CYS A 403 14.563 -11.097 -7.274 1.00 0.00 C ATOM 998 SG CYS A 403 15.647 -9.643 -7.096 1.00 0.00 S ATOM 0 H CYS A 403 13.720 -13.429 -7.532 1.00 0.00 H new ATOM 0 HA CYS A 403 16.307 -12.283 -7.183 1.00 0.00 H new ATOM 0 HB2 CYS A 403 14.275 -11.224 -8.317 1.00 0.00 H new ATOM 0 HB3 CYS A 403 13.645 -10.952 -6.705 1.00 0.00 H new ATOM 0 HG CYS A 403 15.677 -8.985 -8.217 1.00 0.00 H new ATOM 1003 N GLN A 404 15.967 -13.412 -4.779 1.00 0.00 N ATOM 1004 CA GLN A 404 16.309 -13.835 -3.419 1.00 0.00 C ATOM 1005 C GLN A 404 16.721 -12.695 -2.459 1.00 0.00 C ATOM 1006 O GLN A 404 16.807 -12.932 -1.251 1.00 0.00 O ATOM 1007 CB GLN A 404 17.357 -14.960 -3.530 1.00 0.00 C ATOM 1008 CG GLN A 404 17.528 -15.797 -2.252 1.00 0.00 C ATOM 1009 CD GLN A 404 18.376 -17.044 -2.501 1.00 0.00 C ATOM 1010 OE1 GLN A 404 17.940 -18.020 -3.099 1.00 0.00 O ATOM 1011 NE2 GLN A 404 19.617 -17.072 -2.059 1.00 0.00 N ATOM 0 H GLN A 404 16.301 -14.111 -5.443 1.00 0.00 H new ATOM 0 HA GLN A 404 15.406 -14.210 -2.938 1.00 0.00 H new ATOM 0 HB2 GLN A 404 17.076 -15.622 -4.349 1.00 0.00 H new ATOM 0 HB3 GLN A 404 18.319 -14.519 -3.793 1.00 0.00 H new ATOM 0 HG2 GLN A 404 17.995 -15.188 -1.478 1.00 0.00 H new ATOM 0 HG3 GLN A 404 16.548 -16.092 -1.877 1.00 0.00 H new ATOM 0 HE21 GLN A 404 19.998 -16.269 -1.559 1.00 0.00 H new ATOM 0 HE22 GLN A 404 20.196 -17.897 -2.217 1.00 0.00 H new ATOM 1020 N VAL A 405 16.934 -11.463 -2.955 1.00 0.00 N ATOM 1021 CA VAL A 405 17.159 -10.266 -2.118 1.00 0.00 C ATOM 1022 C VAL A 405 15.991 -10.183 -1.127 1.00 0.00 C ATOM 1023 O VAL A 405 14.842 -10.083 -1.555 1.00 0.00 O ATOM 1024 CB VAL A 405 17.211 -8.974 -2.959 1.00 0.00 C ATOM 1025 CG1 VAL A 405 17.630 -7.785 -2.086 1.00 0.00 C ATOM 1026 CG2 VAL A 405 18.196 -9.067 -4.125 1.00 0.00 C ATOM 0 H VAL A 405 16.955 -11.266 -3.956 1.00 0.00 H new ATOM 0 HA VAL A 405 18.119 -10.355 -1.610 1.00 0.00 H new ATOM 0 HB VAL A 405 16.207 -8.834 -3.359 1.00 0.00 H new ATOM 0 HG11 VAL A 405 17.662 -6.881 -2.694 1.00 0.00 H new ATOM 0 HG12 VAL A 405 16.909 -7.654 -1.279 1.00 0.00 H new ATOM 0 HG13 VAL A 405 18.617 -7.974 -1.664 1.00 0.00 H new ATOM 0 HG21 VAL A 405 18.191 -8.130 -4.682 1.00 0.00 H new ATOM 0 HG22 VAL A 405 19.198 -9.255 -3.740 1.00 0.00 H new ATOM 0 HG23 VAL A 405 17.902 -9.883 -4.785 1.00 0.00 H new ATOM 1036 N ALA A 406 16.267 -10.295 0.176 1.00 0.00 N ATOM 1037 CA ALA A 406 15.271 -10.407 1.250 1.00 0.00 C ATOM 1038 C ALA A 406 13.969 -9.614 1.039 1.00 0.00 C ATOM 1039 O ALA A 406 12.881 -10.198 0.956 1.00 0.00 O ATOM 1040 CB ALA A 406 15.953 -10.045 2.574 1.00 0.00 C ATOM 0 H ALA A 406 17.225 -10.311 0.526 1.00 0.00 H new ATOM 0 HA ALA A 406 14.925 -11.441 1.255 1.00 0.00 H new ATOM 0 HB1 ALA A 406 15.232 -10.121 3.388 1.00 0.00 H new ATOM 0 HB2 ALA A 406 16.780 -10.731 2.757 1.00 0.00 H new ATOM 0 HB3 ALA A 406 16.333 -9.025 2.520 1.00 0.00 H new ATOM 1046 N HIS A 407 14.089 -8.290 0.929 1.00 0.00 N ATOM 1047 CA HIS A 407 12.948 -7.397 0.736 1.00 0.00 C ATOM 1048 C HIS A 407 12.177 -7.659 -0.566 1.00 0.00 C ATOM 1049 O HIS A 407 10.951 -7.685 -0.514 1.00 0.00 O ATOM 1050 CB HIS A 407 13.384 -5.927 0.867 1.00 0.00 C ATOM 1051 CG HIS A 407 14.518 -5.488 -0.033 1.00 0.00 C ATOM 1052 ND1 HIS A 407 15.816 -5.248 0.364 1.00 0.00 N ATOM 1053 CD2 HIS A 407 14.444 -5.179 -1.365 1.00 0.00 C ATOM 1054 CE1 HIS A 407 16.507 -4.808 -0.702 1.00 0.00 C ATOM 1055 NE2 HIS A 407 15.712 -4.754 -1.785 1.00 0.00 N ATOM 0 H HIS A 407 14.986 -7.806 0.972 1.00 0.00 H new ATOM 0 HA HIS A 407 12.238 -7.617 1.533 1.00 0.00 H new ATOM 0 HB2 HIS A 407 12.520 -5.293 0.665 1.00 0.00 H new ATOM 0 HB3 HIS A 407 13.677 -5.747 1.901 1.00 0.00 H new ATOM 0 HD2 HIS A 407 13.562 -5.250 -1.984 1.00 0.00 H new ATOM 0 HE1 HIS A 407 17.552 -4.536 -0.690 1.00 0.00 H new ATOM 0 HE2 HIS A 407 15.979 -4.462 -2.725 1.00 0.00 H new ATOM 1063 N CYS A 408 12.843 -7.887 -1.707 1.00 0.00 N ATOM 1064 CA CYS A 408 12.168 -8.122 -2.988 1.00 0.00 C ATOM 1065 C CYS A 408 11.518 -9.515 -3.067 1.00 0.00 C ATOM 1066 O CYS A 408 10.323 -9.604 -3.366 1.00 0.00 O ATOM 1067 CB CYS A 408 13.187 -7.914 -4.121 1.00 0.00 C ATOM 1068 SG CYS A 408 12.452 -8.266 -5.753 1.00 0.00 S ATOM 0 H CYS A 408 13.861 -7.913 -1.766 1.00 0.00 H new ATOM 0 HA CYS A 408 11.349 -7.409 -3.088 1.00 0.00 H new ATOM 0 HB2 CYS A 408 13.553 -6.887 -4.099 1.00 0.00 H new ATOM 0 HB3 CYS A 408 14.048 -8.563 -3.961 1.00 0.00 H new ATOM 0 HG CYS A 408 13.341 -8.829 -6.517 1.00 0.00 H new ATOM 1073 N ALA A 409 12.258 -10.584 -2.745 1.00 0.00 N ATOM 1074 CA ALA A 409 11.723 -11.948 -2.721 1.00 0.00 C ATOM 1075 C ALA A 409 10.489 -12.017 -1.806 1.00 0.00 C ATOM 1076 O ALA A 409 9.438 -12.529 -2.214 1.00 0.00 O ATOM 1077 CB ALA A 409 12.811 -12.937 -2.284 1.00 0.00 C ATOM 0 H ALA A 409 13.245 -10.525 -2.494 1.00 0.00 H new ATOM 0 HA ALA A 409 11.407 -12.229 -3.726 1.00 0.00 H new ATOM 0 HB1 ALA A 409 12.401 -13.947 -2.270 1.00 0.00 H new ATOM 0 HB2 ALA A 409 13.645 -12.894 -2.985 1.00 0.00 H new ATOM 0 HB3 ALA A 409 13.162 -12.674 -1.286 1.00 0.00 H new ATOM 1083 N SER A 410 10.585 -11.431 -0.599 1.00 0.00 N ATOM 1084 CA SER A 410 9.433 -11.356 0.303 1.00 0.00 C ATOM 1085 C SER A 410 8.321 -10.538 -0.343 1.00 0.00 C ATOM 1086 O SER A 410 7.214 -11.053 -0.440 1.00 0.00 O ATOM 1087 CB SER A 410 9.778 -10.747 1.670 1.00 0.00 C ATOM 1088 OG SER A 410 10.758 -11.521 2.339 1.00 0.00 O ATOM 0 H SER A 410 11.439 -11.009 -0.234 1.00 0.00 H new ATOM 0 HA SER A 410 9.106 -12.381 0.477 1.00 0.00 H new ATOM 0 HB2 SER A 410 10.143 -9.729 1.537 1.00 0.00 H new ATOM 0 HB3 SER A 410 8.878 -10.686 2.282 1.00 0.00 H new ATOM 0 HG SER A 410 11.649 -11.268 2.019 1.00 0.00 H new ATOM 1094 N SER A 411 8.586 -9.318 -0.835 1.00 0.00 N ATOM 1095 CA SER A 411 7.571 -8.459 -1.472 1.00 0.00 C ATOM 1096 C SER A 411 6.739 -9.190 -2.518 1.00 0.00 C ATOM 1097 O SER A 411 5.509 -9.137 -2.486 1.00 0.00 O ATOM 1098 CB SER A 411 8.196 -7.184 -2.078 1.00 0.00 C ATOM 1099 OG SER A 411 8.719 -7.348 -3.380 1.00 0.00 O ATOM 0 H SER A 411 9.514 -8.896 -0.803 1.00 0.00 H new ATOM 0 HA SER A 411 6.893 -8.166 -0.670 1.00 0.00 H new ATOM 0 HB2 SER A 411 7.439 -6.400 -2.101 1.00 0.00 H new ATOM 0 HB3 SER A 411 8.994 -6.838 -1.421 1.00 0.00 H new ATOM 0 HG SER A 411 9.255 -8.167 -3.416 1.00 0.00 H new ATOM 1105 N ARG A 412 7.396 -9.931 -3.410 1.00 0.00 N ATOM 1106 CA ARG A 412 6.731 -10.726 -4.436 1.00 0.00 C ATOM 1107 C ARG A 412 5.914 -11.851 -3.805 1.00 0.00 C ATOM 1108 O ARG A 412 4.771 -12.041 -4.211 1.00 0.00 O ATOM 1109 CB ARG A 412 7.787 -11.206 -5.445 1.00 0.00 C ATOM 1110 CG ARG A 412 8.087 -10.107 -6.488 1.00 0.00 C ATOM 1111 CD ARG A 412 7.429 -10.342 -7.857 1.00 0.00 C ATOM 1112 NE ARG A 412 5.964 -10.166 -7.805 1.00 0.00 N ATOM 1113 CZ ARG A 412 5.053 -11.094 -7.578 1.00 0.00 C ATOM 1114 NH1 ARG A 412 5.335 -12.359 -7.473 1.00 0.00 N ATOM 1115 NH2 ARG A 412 3.803 -10.778 -7.432 1.00 0.00 N ATOM 0 H ARG A 412 8.414 -9.995 -3.439 1.00 0.00 H new ATOM 0 HA ARG A 412 6.006 -10.125 -4.985 1.00 0.00 H new ATOM 0 HB2 ARG A 412 8.703 -11.475 -4.919 1.00 0.00 H new ATOM 0 HB3 ARG A 412 7.433 -12.105 -5.949 1.00 0.00 H new ATOM 0 HG2 ARG A 412 7.750 -9.147 -6.095 1.00 0.00 H new ATOM 0 HG3 ARG A 412 9.166 -10.035 -6.624 1.00 0.00 H new ATOM 0 HD2 ARG A 412 7.851 -9.650 -8.586 1.00 0.00 H new ATOM 0 HD3 ARG A 412 7.661 -11.349 -8.202 1.00 0.00 H new ATOM 0 HE ARG A 412 5.616 -9.220 -7.962 1.00 0.00 H new ATOM 0 HH11 ARG A 412 6.300 -12.676 -7.567 1.00 0.00 H new ATOM 0 HH12 ARG A 412 4.591 -13.034 -7.297 1.00 0.00 H new ATOM 0 HH21 ARG A 412 3.513 -9.802 -7.492 1.00 0.00 H new ATOM 0 HH22 ARG A 412 3.110 -11.506 -7.257 1.00 0.00 H new ATOM 1129 N GLN A 413 6.434 -12.535 -2.780 1.00 0.00 N ATOM 1130 CA GLN A 413 5.701 -13.577 -2.042 1.00 0.00 C ATOM 1131 C GLN A 413 4.354 -13.073 -1.469 1.00 0.00 C ATOM 1132 O GLN A 413 3.302 -13.665 -1.728 1.00 0.00 O ATOM 1133 CB GLN A 413 6.590 -14.131 -0.905 1.00 0.00 C ATOM 1134 CG GLN A 413 6.171 -15.538 -0.447 1.00 0.00 C ATOM 1135 CD GLN A 413 6.404 -16.624 -1.501 1.00 0.00 C ATOM 1136 OE1 GLN A 413 7.400 -16.651 -2.214 1.00 0.00 O ATOM 1137 NE2 GLN A 413 5.495 -17.565 -1.650 1.00 0.00 N ATOM 0 H GLN A 413 7.382 -12.382 -2.435 1.00 0.00 H new ATOM 0 HA GLN A 413 5.463 -14.369 -2.752 1.00 0.00 H new ATOM 0 HB2 GLN A 413 7.626 -14.158 -1.242 1.00 0.00 H new ATOM 0 HB3 GLN A 413 6.549 -13.451 -0.054 1.00 0.00 H new ATOM 0 HG2 GLN A 413 6.724 -15.796 0.456 1.00 0.00 H new ATOM 0 HG3 GLN A 413 5.114 -15.524 -0.180 1.00 0.00 H new ATOM 0 HE21 GLN A 413 4.658 -17.562 -1.067 1.00 0.00 H new ATOM 0 HE22 GLN A 413 5.628 -18.297 -2.348 1.00 0.00 H new ATOM 1146 N ILE A 414 4.367 -11.967 -0.712 1.00 0.00 N ATOM 1147 CA ILE A 414 3.162 -11.376 -0.092 1.00 0.00 C ATOM 1148 C ILE A 414 2.170 -10.775 -1.066 1.00 0.00 C ATOM 1149 O ILE A 414 0.966 -11.001 -0.938 1.00 0.00 O ATOM 1150 CB ILE A 414 3.477 -10.337 1.009 1.00 0.00 C ATOM 1151 CG1 ILE A 414 4.786 -9.575 0.820 1.00 0.00 C ATOM 1152 CG2 ILE A 414 3.405 -11.044 2.371 1.00 0.00 C ATOM 1153 CD1 ILE A 414 5.097 -8.484 1.840 1.00 0.00 C ATOM 0 H ILE A 414 5.221 -11.448 -0.508 1.00 0.00 H new ATOM 0 HA ILE A 414 2.689 -12.246 0.364 1.00 0.00 H new ATOM 0 HB ILE A 414 2.724 -9.552 0.946 1.00 0.00 H new ATOM 0 HG12 ILE A 414 5.604 -10.295 0.832 1.00 0.00 H new ATOM 0 HG13 ILE A 414 4.776 -9.121 -0.171 1.00 0.00 H new ATOM 0 HG21 ILE A 414 3.624 -10.329 3.164 1.00 0.00 H new ATOM 0 HG22 ILE A 414 2.405 -11.452 2.517 1.00 0.00 H new ATOM 0 HG23 ILE A 414 4.135 -11.853 2.400 1.00 0.00 H new ATOM 0 HD11 ILE A 414 6.052 -8.019 1.596 1.00 0.00 H new ATOM 0 HD12 ILE A 414 4.310 -7.730 1.818 1.00 0.00 H new ATOM 0 HD13 ILE A 414 5.151 -8.922 2.836 1.00 0.00 H new ATOM 1165 N ILE A 415 2.651 -10.022 -2.046 1.00 0.00 N ATOM 1166 CA ILE A 415 1.762 -9.424 -3.043 1.00 0.00 C ATOM 1167 C ILE A 415 1.160 -10.528 -3.931 1.00 0.00 C ATOM 1168 O ILE A 415 -0.006 -10.426 -4.308 1.00 0.00 O ATOM 1169 CB ILE A 415 2.520 -8.290 -3.749 1.00 0.00 C ATOM 1170 CG1 ILE A 415 2.277 -6.973 -2.967 1.00 0.00 C ATOM 1171 CG2 ILE A 415 2.194 -8.189 -5.243 1.00 0.00 C ATOM 1172 CD1 ILE A 415 2.819 -5.719 -3.667 1.00 0.00 C ATOM 0 H ILE A 415 3.640 -9.810 -2.175 1.00 0.00 H new ATOM 0 HA ILE A 415 0.886 -8.946 -2.605 1.00 0.00 H new ATOM 0 HB ILE A 415 3.588 -8.509 -3.735 1.00 0.00 H new ATOM 0 HG12 ILE A 415 1.206 -6.851 -2.805 1.00 0.00 H new ATOM 0 HG13 ILE A 415 2.740 -7.056 -1.984 1.00 0.00 H new ATOM 0 HG21 ILE A 415 2.761 -7.369 -5.684 1.00 0.00 H new ATOM 0 HG22 ILE A 415 2.461 -9.123 -5.738 1.00 0.00 H new ATOM 0 HG23 ILE A 415 1.128 -8.003 -5.371 1.00 0.00 H new ATOM 0 HD11 ILE A 415 2.609 -4.841 -3.056 1.00 0.00 H new ATOM 0 HD12 ILE A 415 3.896 -5.816 -3.805 1.00 0.00 H new ATOM 0 HD13 ILE A 415 2.338 -5.608 -4.639 1.00 0.00 H new ATOM 1184 N SER A 416 1.884 -11.625 -4.193 1.00 0.00 N ATOM 1185 CA SER A 416 1.320 -12.779 -4.913 1.00 0.00 C ATOM 1186 C SER A 416 0.278 -13.487 -4.048 1.00 0.00 C ATOM 1187 O SER A 416 -0.766 -13.861 -4.579 1.00 0.00 O ATOM 1188 CB SER A 416 2.375 -13.793 -5.368 1.00 0.00 C ATOM 1189 OG SER A 416 2.829 -13.442 -6.667 1.00 0.00 O ATOM 0 H SER A 416 2.860 -11.739 -3.918 1.00 0.00 H new ATOM 0 HA SER A 416 0.857 -12.374 -5.813 1.00 0.00 H new ATOM 0 HB2 SER A 416 3.211 -13.805 -4.668 1.00 0.00 H new ATOM 0 HB3 SER A 416 1.952 -14.797 -5.377 1.00 0.00 H new ATOM 0 HG SER A 416 3.098 -14.252 -7.150 1.00 0.00 H new ATOM 1195 N HIS A 417 0.493 -13.621 -2.727 1.00 0.00 N ATOM 1196 CA HIS A 417 -0.549 -14.152 -1.837 1.00 0.00 C ATOM 1197 C HIS A 417 -1.807 -13.276 -1.962 1.00 0.00 C ATOM 1198 O HIS A 417 -2.880 -13.790 -2.267 1.00 0.00 O ATOM 1199 CB HIS A 417 -0.085 -14.236 -0.366 1.00 0.00 C ATOM 1200 CG HIS A 417 -1.259 -14.450 0.569 1.00 0.00 C ATOM 1201 ND1 HIS A 417 -1.987 -15.614 0.693 1.00 0.00 N ATOM 1202 CD2 HIS A 417 -2.017 -13.448 1.126 1.00 0.00 C ATOM 1203 CE1 HIS A 417 -3.171 -15.316 1.256 1.00 0.00 C ATOM 1204 NE2 HIS A 417 -3.240 -14.001 1.521 1.00 0.00 N ATOM 0 H HIS A 417 1.365 -13.373 -2.260 1.00 0.00 H new ATOM 0 HA HIS A 417 -0.772 -15.173 -2.146 1.00 0.00 H new ATOM 0 HB2 HIS A 417 0.627 -15.054 -0.253 1.00 0.00 H new ATOM 0 HB3 HIS A 417 0.437 -13.319 -0.094 1.00 0.00 H new ATOM 0 HD2 HIS A 417 -1.721 -12.416 1.239 1.00 0.00 H new ATOM 0 HE1 HIS A 417 -3.953 -16.031 1.465 1.00 0.00 H new ATOM 0 HE2 HIS A 417 -4.030 -13.503 1.930 1.00 0.00 H new ATOM 1212 N TRP A 418 -1.675 -11.956 -1.779 1.00 0.00 N ATOM 1213 CA TRP A 418 -2.788 -11.006 -1.873 1.00 0.00 C ATOM 1214 C TRP A 418 -3.527 -11.085 -3.224 1.00 0.00 C ATOM 1215 O TRP A 418 -4.758 -11.012 -3.257 1.00 0.00 O ATOM 1216 CB TRP A 418 -2.271 -9.595 -1.568 1.00 0.00 C ATOM 1217 CG TRP A 418 -3.335 -8.569 -1.330 1.00 0.00 C ATOM 1218 CD1 TRP A 418 -4.098 -8.473 -0.217 1.00 0.00 C ATOM 1219 CD2 TRP A 418 -3.772 -7.484 -2.208 1.00 0.00 C ATOM 1220 NE1 TRP A 418 -4.964 -7.404 -0.336 1.00 0.00 N ATOM 1221 CE2 TRP A 418 -4.800 -6.751 -1.540 1.00 0.00 C ATOM 1222 CE3 TRP A 418 -3.400 -7.041 -3.497 1.00 0.00 C ATOM 1223 CZ2 TRP A 418 -5.412 -5.624 -2.110 1.00 0.00 C ATOM 1224 CZ3 TRP A 418 -4.009 -5.912 -4.079 1.00 0.00 C ATOM 1225 CH2 TRP A 418 -5.007 -5.200 -3.388 1.00 0.00 C ATOM 0 H TRP A 418 -0.782 -11.514 -1.559 1.00 0.00 H new ATOM 0 HA TRP A 418 -3.537 -11.275 -1.128 1.00 0.00 H new ATOM 0 HB2 TRP A 418 -1.629 -9.642 -0.688 1.00 0.00 H new ATOM 0 HB3 TRP A 418 -1.648 -9.265 -2.400 1.00 0.00 H new ATOM 0 HD1 TRP A 418 -4.039 -9.133 0.636 1.00 0.00 H new ATOM 0 HE1 TRP A 418 -5.640 -7.131 0.377 1.00 0.00 H new ATOM 0 HE3 TRP A 418 -2.638 -7.576 -4.044 1.00 0.00 H new ATOM 0 HZ2 TRP A 418 -6.183 -5.090 -1.575 1.00 0.00 H new ATOM 0 HZ3 TRP A 418 -3.707 -5.590 -5.065 1.00 0.00 H new ATOM 0 HH2 TRP A 418 -5.461 -4.330 -3.838 1.00 0.00 H new ATOM 1236 N LYS A 419 -2.799 -11.294 -4.334 1.00 0.00 N ATOM 1237 CA LYS A 419 -3.387 -11.487 -5.675 1.00 0.00 C ATOM 1238 C LYS A 419 -4.147 -12.819 -5.806 1.00 0.00 C ATOM 1239 O LYS A 419 -5.236 -12.852 -6.381 1.00 0.00 O ATOM 1240 CB LYS A 419 -2.275 -11.430 -6.737 1.00 0.00 C ATOM 1241 CG LYS A 419 -1.792 -9.999 -7.017 1.00 0.00 C ATOM 1242 CD LYS A 419 -0.493 -10.026 -7.838 1.00 0.00 C ATOM 1243 CE LYS A 419 0.037 -8.624 -8.157 1.00 0.00 C ATOM 1244 NZ LYS A 419 -0.872 -7.850 -9.046 1.00 0.00 N ATOM 0 H LYS A 419 -1.780 -11.334 -4.328 1.00 0.00 H new ATOM 0 HA LYS A 419 -4.108 -10.684 -5.828 1.00 0.00 H new ATOM 0 HB2 LYS A 419 -1.431 -12.035 -6.406 1.00 0.00 H new ATOM 0 HB3 LYS A 419 -2.641 -11.873 -7.663 1.00 0.00 H new ATOM 0 HG2 LYS A 419 -2.561 -9.448 -7.558 1.00 0.00 H new ATOM 0 HG3 LYS A 419 -1.625 -9.474 -6.077 1.00 0.00 H new ATOM 0 HD2 LYS A 419 0.267 -10.581 -7.288 1.00 0.00 H new ATOM 0 HD3 LYS A 419 -0.668 -10.564 -8.770 1.00 0.00 H new ATOM 0 HE2 LYS A 419 0.181 -8.075 -7.226 1.00 0.00 H new ATOM 0 HE3 LYS A 419 1.015 -8.710 -8.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 419 -0.432 -6.938 -9.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 419 -1.045 -8.388 -9.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 419 -1.775 -7.683 -8.558 1.00 0.00 H new ATOM 1258 N ASN A 420 -3.570 -13.914 -5.306 1.00 0.00 N ATOM 1259 CA ASN A 420 -4.115 -15.276 -5.398 1.00 0.00 C ATOM 1260 C ASN A 420 -5.222 -15.630 -4.381 1.00 0.00 C ATOM 1261 O ASN A 420 -5.958 -16.593 -4.613 1.00 0.00 O ATOM 1262 CB ASN A 420 -2.945 -16.276 -5.280 1.00 0.00 C ATOM 1263 CG ASN A 420 -1.961 -16.226 -6.443 1.00 0.00 C ATOM 1264 OD1 ASN A 420 -2.256 -15.782 -7.545 1.00 0.00 O ATOM 1265 ND2 ASN A 420 -0.753 -16.706 -6.244 1.00 0.00 N ATOM 0 H ASN A 420 -2.680 -13.879 -4.809 1.00 0.00 H new ATOM 0 HA ASN A 420 -4.614 -15.336 -6.365 1.00 0.00 H new ATOM 0 HB2 ASN A 420 -2.406 -16.079 -4.354 1.00 0.00 H new ATOM 0 HB3 ASN A 420 -3.350 -17.285 -5.205 1.00 0.00 H new ATOM 0 HD21 ASN A 420 -0.073 -16.706 -7.004 1.00 0.00 H new ATOM 0 HD22 ASN A 420 -0.496 -17.078 -5.330 1.00 0.00 H new ATOM 1272 N CYS A 421 -5.323 -14.920 -3.251 1.00 0.00 N ATOM 1273 CA CYS A 421 -6.252 -15.176 -2.150 1.00 0.00 C ATOM 1274 C CYS A 421 -7.751 -14.997 -2.496 1.00 0.00 C ATOM 1275 O CYS A 421 -8.376 -13.977 -2.186 1.00 0.00 O ATOM 1276 CB CYS A 421 -5.800 -14.362 -0.925 1.00 0.00 C ATOM 1277 SG CYS A 421 -6.511 -15.030 0.611 1.00 0.00 S ATOM 0 H CYS A 421 -4.728 -14.111 -3.073 1.00 0.00 H new ATOM 0 HA CYS A 421 -6.201 -16.240 -1.917 1.00 0.00 H new ATOM 0 HB2 CYS A 421 -4.712 -14.373 -0.860 1.00 0.00 H new ATOM 0 HB3 CYS A 421 -6.102 -13.322 -1.046 1.00 0.00 H new ATOM 0 HG CYS A 421 -7.802 -14.880 0.593 1.00 0.00 H new ATOM 1282 N THR A 422 -8.347 -16.011 -3.133 1.00 0.00 N ATOM 1283 CA THR A 422 -9.791 -16.070 -3.443 1.00 0.00 C ATOM 1284 C THR A 422 -10.619 -16.152 -2.155 1.00 0.00 C ATOM 1285 O THR A 422 -11.707 -15.575 -2.068 1.00 0.00 O ATOM 1286 CB THR A 422 -10.128 -17.281 -4.327 1.00 0.00 C ATOM 1287 OG1 THR A 422 -9.572 -18.460 -3.775 1.00 0.00 O ATOM 1288 CG2 THR A 422 -9.578 -17.122 -5.744 1.00 0.00 C ATOM 0 H THR A 422 -7.835 -16.832 -3.456 1.00 0.00 H new ATOM 0 HA THR A 422 -10.039 -15.157 -3.984 1.00 0.00 H new ATOM 0 HB THR A 422 -11.215 -17.347 -4.370 1.00 0.00 H new ATOM 0 HG1 THR A 422 -9.795 -19.225 -4.346 1.00 0.00 H new ATOM 0 HG21 THR A 422 -9.838 -18.000 -6.336 1.00 0.00 H new ATOM 0 HG22 THR A 422 -10.009 -16.233 -6.204 1.00 0.00 H new ATOM 0 HG23 THR A 422 -8.494 -17.020 -5.704 1.00 0.00 H new ATOM 1296 N ARG A 423 -10.064 -16.805 -1.120 1.00 0.00 N ATOM 1297 CA ARG A 423 -10.585 -16.927 0.256 1.00 0.00 C ATOM 1298 C ARG A 423 -10.296 -15.636 1.044 1.00 0.00 C ATOM 1299 O ARG A 423 -9.672 -15.645 2.105 1.00 0.00 O ATOM 1300 CB ARG A 423 -9.989 -18.178 0.932 1.00 0.00 C ATOM 1301 CG ARG A 423 -10.464 -19.484 0.277 1.00 0.00 C ATOM 1302 CD ARG A 423 -9.799 -20.693 0.947 1.00 0.00 C ATOM 1303 NE ARG A 423 -10.204 -21.965 0.314 1.00 0.00 N ATOM 1304 CZ ARG A 423 -9.715 -22.496 -0.795 1.00 0.00 C ATOM 1305 NH1 ARG A 423 -8.784 -21.911 -1.496 1.00 0.00 N ATOM 1306 NH2 ARG A 423 -10.159 -23.640 -1.228 1.00 0.00 N ATOM 0 H ARG A 423 -9.177 -17.297 -1.228 1.00 0.00 H new ATOM 0 HA ARG A 423 -11.667 -17.055 0.235 1.00 0.00 H new ATOM 0 HB2 ARG A 423 -8.901 -18.128 0.887 1.00 0.00 H new ATOM 0 HB3 ARG A 423 -10.265 -18.183 1.987 1.00 0.00 H new ATOM 0 HG2 ARG A 423 -11.548 -19.566 0.359 1.00 0.00 H new ATOM 0 HG3 ARG A 423 -10.225 -19.473 -0.786 1.00 0.00 H new ATOM 0 HD2 ARG A 423 -8.715 -20.589 0.891 1.00 0.00 H new ATOM 0 HD3 ARG A 423 -10.063 -20.713 2.004 1.00 0.00 H new ATOM 0 HE ARG A 423 -10.941 -22.491 0.783 1.00 0.00 H new ATOM 0 HH11 ARG A 423 -8.407 -21.012 -1.194 1.00 0.00 H new ATOM 0 HH12 ARG A 423 -8.432 -22.352 -2.346 1.00 0.00 H new ATOM 0 HH21 ARG A 423 -10.888 -24.133 -0.712 1.00 0.00 H new ATOM 0 HH22 ARG A 423 -9.778 -24.044 -2.084 1.00 0.00 H new ATOM 1320 N HIS A 424 -10.732 -14.518 0.464 1.00 0.00 N ATOM 1321 CA HIS A 424 -10.596 -13.122 0.891 1.00 0.00 C ATOM 1322 C HIS A 424 -10.983 -12.800 2.348 1.00 0.00 C ATOM 1323 O HIS A 424 -10.658 -11.725 2.845 1.00 0.00 O ATOM 1324 CB HIS A 424 -11.393 -12.252 -0.090 1.00 0.00 C ATOM 1325 CG HIS A 424 -12.867 -12.580 -0.128 1.00 0.00 C ATOM 1326 ND1 HIS A 424 -13.470 -13.554 -0.896 1.00 0.00 N ATOM 1327 CD2 HIS A 424 -13.851 -11.999 0.629 1.00 0.00 C ATOM 1328 CE1 HIS A 424 -14.782 -13.563 -0.608 1.00 0.00 C ATOM 1329 NE2 HIS A 424 -15.066 -12.628 0.317 1.00 0.00 N ATOM 0 H HIS A 424 -11.247 -14.573 -0.415 1.00 0.00 H new ATOM 0 HA HIS A 424 -9.528 -12.904 0.873 1.00 0.00 H new ATOM 0 HB2 HIS A 424 -11.269 -11.204 0.183 1.00 0.00 H new ATOM 0 HB3 HIS A 424 -10.977 -12.372 -1.090 1.00 0.00 H new ATOM 0 HD1 HIS A 424 -13.001 -14.162 -1.567 1.00 0.00 H new ATOM 0 HD2 HIS A 424 -13.715 -11.198 1.341 1.00 0.00 H new ATOM 0 HE1 HIS A 424 -15.507 -14.227 -1.056 1.00 0.00 H new ATOM 1337 N ASP A 425 -11.598 -13.734 3.071 1.00 0.00 N ATOM 1338 CA ASP A 425 -11.925 -13.698 4.500 1.00 0.00 C ATOM 1339 C ASP A 425 -10.683 -14.057 5.350 1.00 0.00 C ATOM 1340 O ASP A 425 -10.756 -14.687 6.408 1.00 0.00 O ATOM 1341 CB ASP A 425 -13.155 -14.579 4.776 1.00 0.00 C ATOM 1342 CG ASP A 425 -12.962 -16.062 4.402 1.00 0.00 C ATOM 1343 OD1 ASP A 425 -12.769 -16.363 3.198 1.00 0.00 O ATOM 1344 OD2 ASP A 425 -13.053 -16.935 5.298 1.00 0.00 O ATOM 0 H ASP A 425 -11.906 -14.606 2.641 1.00 0.00 H new ATOM 0 HA ASP A 425 -12.200 -12.687 4.800 1.00 0.00 H new ATOM 0 HB2 ASP A 425 -13.407 -14.512 5.834 1.00 0.00 H new ATOM 0 HB3 ASP A 425 -14.005 -14.183 4.220 1.00 0.00 H new ATOM 1349 N CYS A 426 -9.526 -13.653 4.827 1.00 0.00 N ATOM 1350 CA CYS A 426 -8.178 -13.880 5.337 1.00 0.00 C ATOM 1351 C CYS A 426 -7.848 -12.905 6.492 1.00 0.00 C ATOM 1352 O CYS A 426 -8.336 -11.769 6.466 1.00 0.00 O ATOM 1353 CB CYS A 426 -7.278 -13.666 4.112 1.00 0.00 C ATOM 1354 SG CYS A 426 -5.613 -14.372 4.271 1.00 0.00 S ATOM 0 H CYS A 426 -9.508 -13.113 3.962 1.00 0.00 H new ATOM 0 HA CYS A 426 -8.045 -14.873 5.767 1.00 0.00 H new ATOM 0 HB2 CYS A 426 -7.763 -14.104 3.239 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -7.189 -12.596 3.924 1.00 0.00 H new ATOM 0 HG CYS A 426 -5.243 -14.873 3.130 1.00 0.00 H new ATOM 1359 N PRO A 427 -7.004 -13.284 7.474 1.00 0.00 N ATOM 1360 CA PRO A 427 -6.553 -12.430 8.586 1.00 0.00 C ATOM 1361 C PRO A 427 -5.883 -11.098 8.185 1.00 0.00 C ATOM 1362 O PRO A 427 -5.510 -10.319 9.063 1.00 0.00 O ATOM 1363 CB PRO A 427 -5.553 -13.278 9.387 1.00 0.00 C ATOM 1364 CG PRO A 427 -5.903 -14.716 9.028 1.00 0.00 C ATOM 1365 CD PRO A 427 -6.382 -14.592 7.585 1.00 0.00 C ATOM 0 HA PRO A 427 -7.437 -12.125 9.146 1.00 0.00 H new ATOM 0 HB2 PRO A 427 -4.524 -13.040 9.117 1.00 0.00 H new ATOM 0 HB3 PRO A 427 -5.650 -13.101 10.458 1.00 0.00 H new ATOM 0 HG2 PRO A 427 -5.040 -15.377 9.113 1.00 0.00 H new ATOM 0 HG3 PRO A 427 -6.679 -15.119 9.679 1.00 0.00 H new ATOM 0 HD2 PRO A 427 -5.549 -14.687 6.889 1.00 0.00 H new ATOM 0 HD3 PRO A 427 -7.092 -15.382 7.342 1.00 0.00 H new ATOM 1373 N VAL A 428 -5.691 -10.850 6.882 1.00 0.00 N ATOM 1374 CA VAL A 428 -5.036 -9.669 6.305 1.00 0.00 C ATOM 1375 C VAL A 428 -5.844 -9.067 5.141 1.00 0.00 C ATOM 1376 O VAL A 428 -6.131 -7.863 5.155 1.00 0.00 O ATOM 1377 CB VAL A 428 -3.622 -10.057 5.848 1.00 0.00 C ATOM 1378 CG1 VAL A 428 -2.892 -8.791 5.393 1.00 0.00 C ATOM 1379 CG2 VAL A 428 -2.823 -10.739 6.964 1.00 0.00 C ATOM 0 H VAL A 428 -6.005 -11.503 6.164 1.00 0.00 H new ATOM 0 HA VAL A 428 -4.978 -8.896 7.072 1.00 0.00 H new ATOM 0 HB VAL A 428 -3.709 -10.771 5.029 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -1.885 -9.050 5.065 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -3.437 -8.334 4.567 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -2.834 -8.087 6.223 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -1.830 -10.996 6.596 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -2.731 -10.061 7.812 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -3.339 -11.646 7.279 1.00 0.00 H new ATOM 1389 N CYS A 429 -6.276 -9.889 4.175 1.00 0.00 N ATOM 1390 CA CYS A 429 -7.148 -9.462 3.079 1.00 0.00 C ATOM 1391 C CYS A 429 -8.475 -8.852 3.544 1.00 0.00 C ATOM 1392 O CYS A 429 -8.785 -7.740 3.122 1.00 0.00 O ATOM 1393 CB CYS A 429 -7.325 -10.553 2.008 1.00 0.00 C ATOM 1394 SG CYS A 429 -5.860 -11.625 1.866 1.00 0.00 S ATOM 0 H CYS A 429 -6.026 -10.877 4.135 1.00 0.00 H new ATOM 0 HA CYS A 429 -6.622 -8.640 2.593 1.00 0.00 H new ATOM 0 HB2 CYS A 429 -8.196 -11.162 2.253 1.00 0.00 H new ATOM 0 HB3 CYS A 429 -7.524 -10.084 1.044 1.00 0.00 H new ATOM 0 HG CYS A 429 -6.218 -12.792 1.418 1.00 0.00 H new ATOM 1399 N LEU A 430 -9.243 -9.519 4.416 1.00 0.00 N ATOM 1400 CA LEU A 430 -10.489 -8.974 4.944 1.00 0.00 C ATOM 1401 C LEU A 430 -10.289 -7.604 5.627 1.00 0.00 C ATOM 1402 O LEU A 430 -10.950 -6.646 5.215 1.00 0.00 O ATOM 1403 CB LEU A 430 -11.201 -10.011 5.815 1.00 0.00 C ATOM 1404 CG LEU A 430 -12.658 -10.252 5.403 1.00 0.00 C ATOM 1405 CD1 LEU A 430 -13.354 -11.115 6.462 1.00 0.00 C ATOM 1406 CD2 LEU A 430 -13.528 -9.018 5.199 1.00 0.00 C ATOM 0 H LEU A 430 -9.014 -10.448 4.771 1.00 0.00 H new ATOM 0 HA LEU A 430 -11.156 -8.763 4.108 1.00 0.00 H new ATOM 0 HB2 LEU A 430 -10.656 -10.954 5.764 1.00 0.00 H new ATOM 0 HB3 LEU A 430 -11.174 -9.683 6.854 1.00 0.00 H new ATOM 0 HG LEU A 430 -12.570 -10.730 4.427 1.00 0.00 H new ATOM 0 HD11 LEU A 430 -14.390 -11.286 6.169 1.00 0.00 H new ATOM 0 HD12 LEU A 430 -12.839 -12.072 6.548 1.00 0.00 H new ATOM 0 HD13 LEU A 430 -13.329 -10.602 7.423 1.00 0.00 H new ATOM 0 HD21 LEU A 430 -14.533 -9.325 4.910 1.00 0.00 H new ATOM 0 HD22 LEU A 430 -13.575 -8.448 6.127 1.00 0.00 H new ATOM 0 HD23 LEU A 430 -13.099 -8.396 4.413 1.00 0.00 H new ATOM 1418 N PRO A 431 -9.357 -7.455 6.595 1.00 0.00 N ATOM 1419 CA PRO A 431 -8.989 -6.153 7.155 1.00 0.00 C ATOM 1420 C PRO A 431 -8.749 -5.073 6.095 1.00 0.00 C ATOM 1421 O PRO A 431 -9.384 -4.024 6.149 1.00 0.00 O ATOM 1422 CB PRO A 431 -7.687 -6.397 7.911 1.00 0.00 C ATOM 1423 CG PRO A 431 -7.847 -7.823 8.409 1.00 0.00 C ATOM 1424 CD PRO A 431 -8.550 -8.495 7.231 1.00 0.00 C ATOM 0 HA PRO A 431 -9.804 -5.783 7.777 1.00 0.00 H new ATOM 0 HB2 PRO A 431 -6.817 -6.291 7.263 1.00 0.00 H new ATOM 0 HB3 PRO A 431 -7.559 -5.693 8.734 1.00 0.00 H new ATOM 0 HG2 PRO A 431 -6.886 -8.288 8.630 1.00 0.00 H new ATOM 0 HG3 PRO A 431 -8.442 -7.872 9.321 1.00 0.00 H new ATOM 0 HD2 PRO A 431 -7.826 -8.910 6.530 1.00 0.00 H new ATOM 0 HD3 PRO A 431 -9.175 -9.321 7.570 1.00 0.00 H new ATOM 1432 N LEU A 432 -7.864 -5.323 5.121 1.00 0.00 N ATOM 1433 CA LEU A 432 -7.556 -4.371 4.039 1.00 0.00 C ATOM 1434 C LEU A 432 -8.757 -4.053 3.151 1.00 0.00 C ATOM 1435 O LEU A 432 -8.898 -2.931 2.661 1.00 0.00 O ATOM 1436 CB LEU A 432 -6.436 -4.941 3.164 1.00 0.00 C ATOM 1437 CG LEU A 432 -5.070 -4.497 3.711 1.00 0.00 C ATOM 1438 CD1 LEU A 432 -4.026 -5.558 3.383 1.00 0.00 C ATOM 1439 CD2 LEU A 432 -4.659 -3.153 3.104 1.00 0.00 C ATOM 0 H LEU A 432 -7.338 -6.195 5.059 1.00 0.00 H new ATOM 0 HA LEU A 432 -7.253 -3.441 4.520 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -6.494 -6.029 3.146 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -6.555 -4.598 2.136 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.142 -4.377 4.792 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -3.056 -5.246 3.770 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -4.312 -6.504 3.842 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -3.962 -5.684 2.302 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -3.689 -2.855 3.503 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -4.592 -3.249 2.020 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -5.403 -2.397 3.356 1.00 0.00 H new