USER MOD reduce.3.24.130724 H: found=0, std=0, add=629, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 630 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 Single : A 368 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 369 ASN : amide:sc= -0.0471 K(o=-0.047,f=-2.3) USER MOD Single : A 371 LYS NZ :NH3+ 170:sc= 0.0143 (180deg=-0.167) USER MOD Single : A 373 GLN : amide:sc= -0.0632 X(o=-0.063,f=-0.44) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 380 TYR OH : rot 180:sc= 0 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= -3.56! C(o=-3.6!,f=-2.6!) USER MOD Single : A 387 TYR OH : rot 165:sc= -2.23! USER MOD Single : A 389 THR OG1 : rot 147:sc= -2.73! USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 392 LYS NZ :NH3+ -151:sc= -0.0947 (180deg=-0.6) USER MOD Single : A 394 THR OG1 : rot -150:sc= -1.56! USER MOD Single : A 399 ASN : amide:sc= -2.45 K(o=-2.5,f=-0.73) USER MOD Single : A 400 SER OG : rot -3:sc= -0.756! USER MOD Single : A 404 CYS SG : rot -90:sc= -6.44! USER MOD Single : A 410 THR OG1 : rot 180:sc= 0 USER MOD Single : A 414 THR OG1 : rot -16:sc= 0.889 USER MOD Single : A 419 ASN : amide:sc= -0.131 K(o=-0.13,f=-0.66) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 435 LYS NZ :NH3+ -142:sc= -0.673 (180deg=-1.66!) USER MOD Single : A 436 LYS NZ :NH3+ 154:sc= -1.73 (180deg=-4.17!) USER MOD Single : A 437 MET CE :methyl 150:sc= -0.0951 (180deg=-1.3) USER MOD Single : A 441 TYR OH : rot 108:sc= -2.18! USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.793 X(o=-0.79,f=-0.42) USER MOD ----------------------------------------------------------------- ATOM 40 N ASP A 367 -7.878 -6.855 6.909 1.00 0.00 N ATOM 41 CA ASP A 367 -9.086 -6.114 6.566 1.00 0.00 C ATOM 42 C ASP A 367 -9.757 -6.704 5.332 1.00 0.00 C ATOM 43 O ASP A 367 -9.316 -7.722 4.798 1.00 0.00 O ATOM 44 CB ASP A 367 -8.749 -4.645 6.313 1.00 0.00 C ATOM 45 CG ASP A 367 -8.595 -3.854 7.597 1.00 0.00 C ATOM 46 OD1 ASP A 367 -7.924 -4.353 8.525 1.00 0.00 O ATOM 47 OD2 ASP A 367 -9.144 -2.735 7.675 1.00 0.00 O ATOM 0 HA ASP A 367 -9.777 -6.189 7.406 1.00 0.00 H new ATOM 0 HB2 ASP A 367 -7.825 -4.582 5.738 1.00 0.00 H new ATOM 0 HB3 ASP A 367 -9.534 -4.195 5.705 1.00 0.00 H new ATOM 52 N MET A 368 -10.826 -6.055 4.884 1.00 0.00 N ATOM 53 CA MET A 368 -11.557 -6.511 3.712 1.00 0.00 C ATOM 54 C MET A 368 -11.171 -5.704 2.478 1.00 0.00 C ATOM 55 O MET A 368 -10.927 -6.265 1.411 1.00 0.00 O ATOM 56 CB MET A 368 -13.065 -6.411 3.952 1.00 0.00 C ATOM 57 CG MET A 368 -13.487 -6.866 5.339 1.00 0.00 C ATOM 58 SD MET A 368 -13.839 -8.632 5.412 1.00 0.00 S ATOM 59 CE MET A 368 -15.630 -8.619 5.408 1.00 0.00 C ATOM 0 H MET A 368 -11.204 -5.212 5.316 1.00 0.00 H new ATOM 0 HA MET A 368 -11.293 -7.554 3.536 1.00 0.00 H new ATOM 0 HB2 MET A 368 -13.381 -5.378 3.805 1.00 0.00 H new ATOM 0 HB3 MET A 368 -13.585 -7.013 3.207 1.00 0.00 H new ATOM 0 HG2 MET A 368 -12.698 -6.627 6.052 1.00 0.00 H new ATOM 0 HG3 MET A 368 -14.373 -6.310 5.646 1.00 0.00 H new ATOM 0 HE1 MET A 368 -16.001 -9.643 5.450 1.00 0.00 H new ATOM 0 HE2 MET A 368 -15.992 -8.066 6.275 1.00 0.00 H new ATOM 0 HE3 MET A 368 -15.988 -8.140 4.497 1.00 0.00 H new ATOM 69 N ASN A 369 -11.119 -4.385 2.627 1.00 0.00 N ATOM 70 CA ASN A 369 -10.762 -3.511 1.516 1.00 0.00 C ATOM 71 C ASN A 369 -9.609 -2.579 1.888 1.00 0.00 C ATOM 72 O ASN A 369 -9.818 -1.401 2.182 1.00 0.00 O ATOM 73 CB ASN A 369 -11.981 -2.694 1.100 1.00 0.00 C ATOM 74 CG ASN A 369 -12.705 -3.295 -0.089 1.00 0.00 C ATOM 75 OD1 ASN A 369 -12.196 -3.283 -1.210 1.00 0.00 O ATOM 76 ND2 ASN A 369 -13.900 -3.823 0.149 1.00 0.00 N ATOM 0 H ASN A 369 -11.318 -3.900 3.502 1.00 0.00 H new ATOM 0 HA ASN A 369 -10.433 -4.132 0.683 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -12.670 -2.621 1.942 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -11.668 -1.679 0.855 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -14.434 -4.240 -0.613 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -14.284 -3.811 1.094 1.00 0.00 H new ATOM 83 N ALA A 370 -8.395 -3.113 1.856 1.00 0.00 N ATOM 84 CA ALA A 370 -7.201 -2.334 2.173 1.00 0.00 C ATOM 85 C ALA A 370 -6.729 -1.532 0.972 1.00 0.00 C ATOM 86 O ALA A 370 -6.646 -0.311 1.021 1.00 0.00 O ATOM 87 CB ALA A 370 -6.084 -3.229 2.673 1.00 0.00 C ATOM 0 H ALA A 370 -8.209 -4.086 1.613 1.00 0.00 H new ATOM 0 HA ALA A 370 -7.470 -1.637 2.966 1.00 0.00 H new ATOM 0 HB1 ALA A 370 -5.207 -2.623 2.902 1.00 0.00 H new ATOM 0 HB2 ALA A 370 -6.410 -3.749 3.573 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -5.830 -3.959 1.904 1.00 0.00 H new ATOM 93 N LYS A 371 -6.426 -2.231 -0.112 1.00 0.00 N ATOM 94 CA LYS A 371 -5.971 -1.575 -1.334 1.00 0.00 C ATOM 95 C LYS A 371 -7.027 -0.581 -1.804 1.00 0.00 C ATOM 96 O LYS A 371 -6.733 0.378 -2.507 1.00 0.00 O ATOM 97 CB LYS A 371 -5.672 -2.602 -2.434 1.00 0.00 C ATOM 98 CG LYS A 371 -6.417 -3.917 -2.274 1.00 0.00 C ATOM 99 CD LYS A 371 -5.632 -4.904 -1.422 1.00 0.00 C ATOM 100 CE LYS A 371 -4.823 -5.865 -2.278 1.00 0.00 C ATOM 101 NZ LYS A 371 -3.525 -5.273 -2.702 1.00 0.00 N ATOM 0 H LYS A 371 -6.486 -3.247 -0.173 1.00 0.00 H new ATOM 0 HA LYS A 371 -5.045 -1.041 -1.119 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -5.927 -2.168 -3.401 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.601 -2.803 -2.447 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -7.389 -3.732 -1.816 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -6.605 -4.352 -3.256 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -4.963 -4.359 -0.756 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.319 -5.468 -0.792 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -4.638 -6.782 -1.718 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -5.401 -6.141 -3.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -2.933 -6.009 -3.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -3.698 -4.516 -3.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -3.036 -4.880 -1.873 1.00 0.00 H new ATOM 115 N ARG A 372 -8.252 -0.816 -1.361 1.00 0.00 N ATOM 116 CA ARG A 372 -9.365 0.063 -1.694 1.00 0.00 C ATOM 117 C ARG A 372 -9.376 1.257 -0.760 1.00 0.00 C ATOM 118 O ARG A 372 -9.331 2.406 -1.198 1.00 0.00 O ATOM 119 CB ARG A 372 -10.708 -0.660 -1.605 1.00 0.00 C ATOM 120 CG ARG A 372 -11.899 0.291 -1.613 1.00 0.00 C ATOM 121 CD ARG A 372 -12.625 0.254 -2.948 1.00 0.00 C ATOM 122 NE ARG A 372 -13.794 1.128 -2.966 1.00 0.00 N ATOM 123 CZ ARG A 372 -14.967 0.796 -2.439 1.00 0.00 C ATOM 124 NH1 ARG A 372 -15.107 -0.358 -1.803 1.00 0.00 N ATOM 125 NH2 ARG A 372 -15.999 1.623 -2.539 1.00 0.00 N ATOM 0 H ARG A 372 -8.502 -1.608 -0.769 1.00 0.00 H new ATOM 0 HA ARG A 372 -9.226 0.392 -2.724 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -10.798 -1.352 -2.442 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -10.733 -1.257 -0.693 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -12.589 0.020 -0.814 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -11.558 1.306 -1.410 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -11.939 0.552 -3.741 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -12.935 -0.769 -3.162 1.00 0.00 H new ATOM 0 HE ARG A 372 -13.705 2.043 -3.407 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -14.313 -0.993 -1.718 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -16.009 -0.611 -1.399 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -15.892 2.515 -3.021 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -16.899 1.367 -2.134 1.00 0.00 H new ATOM 139 N GLN A 373 -9.439 0.975 0.532 1.00 0.00 N ATOM 140 CA GLN A 373 -9.463 2.021 1.536 1.00 0.00 C ATOM 141 C GLN A 373 -8.219 2.900 1.421 1.00 0.00 C ATOM 142 O GLN A 373 -8.307 4.124 1.416 1.00 0.00 O ATOM 143 CB GLN A 373 -9.579 1.389 2.919 1.00 0.00 C ATOM 144 CG GLN A 373 -9.775 2.394 4.031 1.00 0.00 C ATOM 145 CD GLN A 373 -11.111 2.244 4.732 1.00 0.00 C ATOM 146 OE1 GLN A 373 -11.557 1.131 5.015 1.00 0.00 O ATOM 147 NE2 GLN A 373 -11.758 3.367 5.015 1.00 0.00 N ATOM 0 H GLN A 373 -9.474 0.028 0.908 1.00 0.00 H new ATOM 0 HA GLN A 373 -10.329 2.664 1.376 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -10.416 0.691 2.921 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -8.679 0.808 3.120 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -8.973 2.282 4.761 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -9.696 3.401 3.622 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -11.351 4.268 4.762 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -12.662 3.330 5.485 1.00 0.00 H new ATOM 156 N LEU A 374 -7.072 2.256 1.286 1.00 0.00 N ATOM 157 CA LEU A 374 -5.808 2.946 1.121 1.00 0.00 C ATOM 158 C LEU A 374 -5.885 3.841 -0.113 1.00 0.00 C ATOM 159 O LEU A 374 -5.785 5.063 -0.016 1.00 0.00 O ATOM 160 CB LEU A 374 -4.685 1.913 0.976 1.00 0.00 C ATOM 161 CG LEU A 374 -3.281 2.469 0.756 1.00 0.00 C ATOM 162 CD1 LEU A 374 -3.063 2.787 -0.709 1.00 0.00 C ATOM 163 CD2 LEU A 374 -3.045 3.696 1.619 1.00 0.00 C ATOM 0 H LEU A 374 -6.993 1.239 1.288 1.00 0.00 H new ATOM 0 HA LEU A 374 -5.599 3.568 1.992 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -4.671 1.294 1.873 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -4.929 1.257 0.140 1.00 0.00 H new ATOM 0 HG LEU A 374 -2.559 1.708 1.052 1.00 0.00 H new ATOM 0 HD11 LEU A 374 -2.057 3.183 -0.850 1.00 0.00 H new ATOM 0 HD12 LEU A 374 -3.182 1.879 -1.300 1.00 0.00 H new ATOM 0 HD13 LEU A 374 -3.793 3.529 -1.033 1.00 0.00 H new ATOM 0 HD21 LEU A 374 -2.038 4.075 1.445 1.00 0.00 H new ATOM 0 HD22 LEU A 374 -3.772 4.467 1.362 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -3.156 3.428 2.670 1.00 0.00 H new ATOM 175 N TYR A 375 -6.077 3.217 -1.275 1.00 0.00 N ATOM 176 CA TYR A 375 -6.181 3.962 -2.533 1.00 0.00 C ATOM 177 C TYR A 375 -7.037 5.198 -2.326 1.00 0.00 C ATOM 178 O TYR A 375 -6.821 6.247 -2.933 1.00 0.00 O ATOM 179 CB TYR A 375 -6.793 3.096 -3.630 1.00 0.00 C ATOM 180 CG TYR A 375 -6.388 3.507 -5.029 1.00 0.00 C ATOM 181 CD1 TYR A 375 -5.099 3.952 -5.295 1.00 0.00 C ATOM 182 CD2 TYR A 375 -7.292 3.447 -6.082 1.00 0.00 C ATOM 183 CE1 TYR A 375 -4.723 4.326 -6.570 1.00 0.00 C ATOM 184 CE2 TYR A 375 -6.923 3.820 -7.361 1.00 0.00 C ATOM 185 CZ TYR A 375 -5.638 4.259 -7.599 1.00 0.00 C ATOM 186 OH TYR A 375 -5.267 4.633 -8.871 1.00 0.00 O ATOM 0 H TYR A 375 -6.163 2.205 -1.373 1.00 0.00 H new ATOM 0 HA TYR A 375 -5.178 4.255 -2.842 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -6.500 2.059 -3.467 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -7.879 3.137 -3.549 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.379 4.006 -4.492 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -8.299 3.103 -5.899 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -3.717 4.669 -6.760 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.637 3.768 -8.169 1.00 0.00 H new ATOM 0 HH TYR A 375 -6.028 4.525 -9.479 1.00 0.00 H new ATOM 196 N SER A 376 -8.004 5.055 -1.442 1.00 0.00 N ATOM 197 CA SER A 376 -8.905 6.145 -1.101 1.00 0.00 C ATOM 198 C SER A 376 -8.182 7.134 -0.193 1.00 0.00 C ATOM 199 O SER A 376 -8.228 8.348 -0.399 1.00 0.00 O ATOM 200 CB SER A 376 -10.152 5.592 -0.402 1.00 0.00 C ATOM 201 OG SER A 376 -10.721 6.556 0.466 1.00 0.00 O ATOM 0 H SER A 376 -8.189 4.186 -0.941 1.00 0.00 H new ATOM 0 HA SER A 376 -9.217 6.659 -2.010 1.00 0.00 H new ATOM 0 HB2 SER A 376 -10.887 5.291 -1.148 1.00 0.00 H new ATOM 0 HB3 SER A 376 -9.889 4.699 0.164 1.00 0.00 H new ATOM 0 HG SER A 376 -11.516 6.179 0.898 1.00 0.00 H new ATOM 207 N LEU A 377 -7.519 6.587 0.816 1.00 0.00 N ATOM 208 CA LEU A 377 -6.776 7.374 1.782 1.00 0.00 C ATOM 209 C LEU A 377 -5.594 8.086 1.123 1.00 0.00 C ATOM 210 O LEU A 377 -5.553 9.315 1.080 1.00 0.00 O ATOM 211 CB LEU A 377 -6.310 6.465 2.922 1.00 0.00 C ATOM 212 CG LEU A 377 -7.324 6.311 4.062 1.00 0.00 C ATOM 213 CD1 LEU A 377 -8.461 5.394 3.641 1.00 0.00 C ATOM 214 CD2 LEU A 377 -6.658 5.782 5.324 1.00 0.00 C ATOM 0 H LEU A 377 -7.483 5.582 0.986 1.00 0.00 H new ATOM 0 HA LEU A 377 -7.428 8.148 2.188 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -6.085 5.479 2.516 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -5.380 6.861 3.330 1.00 0.00 H new ATOM 0 HG LEU A 377 -7.731 7.298 4.284 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -9.172 5.295 4.461 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -8.966 5.816 2.772 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -8.062 4.412 3.387 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -7.402 5.684 6.114 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -6.214 4.808 5.120 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -5.880 6.476 5.643 1.00 0.00 H new ATOM 226 N ILE A 378 -4.630 7.315 0.618 1.00 0.00 N ATOM 227 CA ILE A 378 -3.449 7.889 -0.027 1.00 0.00 C ATOM 228 C ILE A 378 -3.558 7.848 -1.551 1.00 0.00 C ATOM 229 O ILE A 378 -3.231 8.823 -2.226 1.00 0.00 O ATOM 230 CB ILE A 378 -2.200 7.096 0.391 1.00 0.00 C ATOM 231 CG1 ILE A 378 -1.937 7.273 1.883 1.00 0.00 C ATOM 232 CG2 ILE A 378 -0.996 7.519 -0.426 1.00 0.00 C ATOM 233 CD1 ILE A 378 -0.871 6.344 2.424 1.00 0.00 C ATOM 0 H ILE A 378 -4.644 6.295 0.643 1.00 0.00 H new ATOM 0 HA ILE A 378 -3.375 8.929 0.289 1.00 0.00 H new ATOM 0 HB ILE A 378 -2.379 6.039 0.197 1.00 0.00 H new ATOM 0 HG12 ILE A 378 -1.638 8.304 2.071 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -2.865 7.105 2.430 1.00 0.00 H new ATOM 0 HG21 ILE A 378 -0.124 6.945 -0.113 1.00 0.00 H new ATOM 0 HG22 ILE A 378 -1.191 7.336 -1.483 1.00 0.00 H new ATOM 0 HG23 ILE A 378 -0.806 8.581 -0.271 1.00 0.00 H new ATOM 0 HD11 ILE A 378 -0.737 6.526 3.490 1.00 0.00 H new ATOM 0 HD12 ILE A 378 -1.177 5.309 2.268 1.00 0.00 H new ATOM 0 HD13 ILE A 378 0.069 6.527 1.904 1.00 0.00 H new ATOM 245 N GLY A 379 -3.992 6.702 -2.076 1.00 0.00 N ATOM 246 CA GLY A 379 -4.113 6.524 -3.519 1.00 0.00 C ATOM 247 C GLY A 379 -4.289 7.820 -4.280 1.00 0.00 C ATOM 248 O GLY A 379 -5.199 8.601 -4.001 1.00 0.00 O ATOM 0 H GLY A 379 -4.264 5.888 -1.525 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -3.224 6.014 -3.889 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -4.963 5.873 -3.726 1.00 0.00 H new ATOM 252 N TYR A 380 -3.406 8.045 -5.249 1.00 0.00 N ATOM 253 CA TYR A 380 -3.446 9.249 -6.067 1.00 0.00 C ATOM 254 C TYR A 380 -2.727 9.025 -7.393 1.00 0.00 C ATOM 255 O TYR A 380 -1.576 8.589 -7.419 1.00 0.00 O ATOM 256 CB TYR A 380 -2.808 10.417 -5.313 1.00 0.00 C ATOM 257 CG TYR A 380 -3.777 11.156 -4.420 1.00 0.00 C ATOM 258 CD1 TYR A 380 -4.928 11.730 -4.942 1.00 0.00 C ATOM 259 CD2 TYR A 380 -3.542 11.277 -3.056 1.00 0.00 C ATOM 260 CE1 TYR A 380 -5.819 12.406 -4.131 1.00 0.00 C ATOM 261 CE2 TYR A 380 -4.430 11.949 -2.237 1.00 0.00 C ATOM 262 CZ TYR A 380 -5.567 12.512 -2.779 1.00 0.00 C ATOM 263 OH TYR A 380 -6.454 13.181 -1.968 1.00 0.00 O ATOM 0 H TYR A 380 -2.650 7.403 -5.486 1.00 0.00 H new ATOM 0 HA TYR A 380 -4.488 9.488 -6.278 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -1.982 10.042 -4.709 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.384 11.116 -6.033 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -5.130 11.647 -6.000 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -2.652 10.839 -2.629 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -6.709 12.849 -4.554 1.00 0.00 H new ATOM 0 HE2 TYR A 380 -4.235 12.033 -1.178 1.00 0.00 H new ATOM 0 HH TYR A 380 -6.129 13.163 -1.043 1.00 0.00 H new ATOM 273 N ALA A 381 -3.412 9.325 -8.492 1.00 0.00 N ATOM 274 CA ALA A 381 -2.838 9.155 -9.823 1.00 0.00 C ATOM 275 C ALA A 381 -1.413 9.694 -9.872 1.00 0.00 C ATOM 276 O ALA A 381 -0.602 9.264 -10.692 1.00 0.00 O ATOM 277 CB ALA A 381 -3.692 9.843 -10.877 1.00 0.00 C ATOM 0 H ALA A 381 -4.366 9.687 -8.488 1.00 0.00 H new ATOM 0 HA ALA A 381 -2.815 8.087 -10.039 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -3.242 9.701 -11.860 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -4.694 9.413 -10.871 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -3.753 10.909 -10.657 1.00 0.00 H new ATOM 283 N SER A 382 -1.118 10.641 -8.990 1.00 0.00 N ATOM 284 CA SER A 382 0.205 11.249 -8.931 1.00 0.00 C ATOM 285 C SER A 382 1.136 10.459 -8.016 1.00 0.00 C ATOM 286 O SER A 382 2.355 10.483 -8.190 1.00 0.00 O ATOM 287 CB SER A 382 0.097 12.696 -8.449 1.00 0.00 C ATOM 288 OG SER A 382 -0.924 13.390 -9.143 1.00 0.00 O ATOM 0 H SER A 382 -1.779 11.005 -8.304 1.00 0.00 H new ATOM 0 HA SER A 382 0.628 11.236 -9.935 1.00 0.00 H new ATOM 0 HB2 SER A 382 -0.111 12.712 -7.379 1.00 0.00 H new ATOM 0 HB3 SER A 382 1.050 13.204 -8.596 1.00 0.00 H new ATOM 0 HG SER A 382 -0.974 14.312 -8.815 1.00 0.00 H new ATOM 294 N LEU A 383 0.563 9.759 -7.040 1.00 0.00 N ATOM 295 CA LEU A 383 1.357 8.966 -6.107 1.00 0.00 C ATOM 296 C LEU A 383 1.695 7.606 -6.706 1.00 0.00 C ATOM 297 O LEU A 383 2.563 6.893 -6.204 1.00 0.00 O ATOM 298 CB LEU A 383 0.591 8.763 -4.797 1.00 0.00 C ATOM 299 CG LEU A 383 1.208 9.415 -3.557 1.00 0.00 C ATOM 300 CD1 LEU A 383 0.747 8.698 -2.294 1.00 0.00 C ATOM 301 CD2 LEU A 383 2.729 9.408 -3.646 1.00 0.00 C ATOM 0 H LEU A 383 -0.443 9.725 -6.875 1.00 0.00 H new ATOM 0 HA LEU A 383 2.282 9.507 -5.908 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -0.419 9.152 -4.925 1.00 0.00 H new ATOM 0 HB3 LEU A 383 0.499 7.692 -4.614 1.00 0.00 H new ATOM 0 HG LEU A 383 0.872 10.451 -3.512 1.00 0.00 H new ATOM 0 HD11 LEU A 383 1.195 9.174 -1.422 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.339 8.753 -2.220 1.00 0.00 H new ATOM 0 HD13 LEU A 383 1.055 7.653 -2.336 1.00 0.00 H new ATOM 0 HD21 LEU A 383 3.148 9.876 -2.755 1.00 0.00 H new ATOM 0 HD22 LEU A 383 3.085 8.380 -3.717 1.00 0.00 H new ATOM 0 HD23 LEU A 383 3.044 9.963 -4.530 1.00 0.00 H new ATOM 313 N ARG A 384 1.005 7.259 -7.786 1.00 0.00 N ATOM 314 CA ARG A 384 1.224 5.988 -8.463 1.00 0.00 C ATOM 315 C ARG A 384 1.603 4.887 -7.476 1.00 0.00 C ATOM 316 O ARG A 384 2.556 4.143 -7.707 1.00 0.00 O ATOM 317 CB ARG A 384 2.320 6.131 -9.517 1.00 0.00 C ATOM 318 CG ARG A 384 1.913 5.607 -10.883 1.00 0.00 C ATOM 319 CD ARG A 384 1.771 4.094 -10.873 1.00 0.00 C ATOM 320 NE ARG A 384 1.622 3.546 -12.218 1.00 0.00 N ATOM 321 CZ ARG A 384 0.485 3.574 -12.904 1.00 0.00 C ATOM 322 NH1 ARG A 384 -0.594 4.140 -12.379 1.00 0.00 N ATOM 323 NH2 ARG A 384 0.424 3.038 -14.115 1.00 0.00 N ATOM 0 H ARG A 384 0.286 7.843 -8.213 1.00 0.00 H new ATOM 0 HA ARG A 384 0.288 5.707 -8.946 1.00 0.00 H new ATOM 0 HB2 ARG A 384 2.594 7.182 -9.606 1.00 0.00 H new ATOM 0 HB3 ARG A 384 3.209 5.597 -9.181 1.00 0.00 H new ATOM 0 HG2 ARG A 384 0.969 6.061 -11.183 1.00 0.00 H new ATOM 0 HG3 ARG A 384 2.657 5.900 -11.624 1.00 0.00 H new ATOM 0 HD2 ARG A 384 2.646 3.652 -10.397 1.00 0.00 H new ATOM 0 HD3 ARG A 384 0.906 3.816 -10.271 1.00 0.00 H new ATOM 0 HE ARG A 384 2.437 3.117 -12.656 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -0.551 4.554 -11.448 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -1.467 4.161 -12.907 1.00 0.00 H new ATOM 0 HH21 ARG A 384 1.252 2.603 -14.522 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -0.451 3.061 -14.639 1.00 0.00 H new ATOM 337 N LEU A 385 0.854 4.775 -6.381 1.00 0.00 N ATOM 338 CA LEU A 385 1.129 3.750 -5.385 1.00 0.00 C ATOM 339 C LEU A 385 0.920 2.366 -5.990 1.00 0.00 C ATOM 340 O LEU A 385 0.090 2.194 -6.884 1.00 0.00 O ATOM 341 CB LEU A 385 0.250 3.952 -4.146 1.00 0.00 C ATOM 342 CG LEU A 385 -1.234 4.226 -4.409 1.00 0.00 C ATOM 343 CD1 LEU A 385 -1.766 3.353 -5.533 1.00 0.00 C ATOM 344 CD2 LEU A 385 -2.029 3.992 -3.137 1.00 0.00 C ATOM 0 H LEU A 385 0.060 5.377 -6.165 1.00 0.00 H new ATOM 0 HA LEU A 385 2.169 3.833 -5.070 1.00 0.00 H new ATOM 0 HB2 LEU A 385 0.329 3.063 -3.521 1.00 0.00 H new ATOM 0 HB3 LEU A 385 0.655 4.784 -3.570 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.343 5.266 -4.718 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -2.822 3.572 -5.695 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.209 3.557 -6.447 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.650 2.303 -5.264 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.084 4.188 -3.326 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -1.904 2.958 -2.815 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -1.670 4.662 -2.355 1.00 0.00 H new ATOM 356 N HIS A 386 1.677 1.378 -5.517 1.00 0.00 N ATOM 357 CA HIS A 386 1.555 0.020 -6.038 1.00 0.00 C ATOM 358 C HIS A 386 1.966 -1.016 -4.999 1.00 0.00 C ATOM 359 O HIS A 386 2.559 -0.688 -3.971 1.00 0.00 O ATOM 360 CB HIS A 386 2.396 -0.156 -7.306 1.00 0.00 C ATOM 361 CG HIS A 386 3.869 0.054 -7.106 1.00 0.00 C ATOM 362 ND1 HIS A 386 4.733 -0.940 -6.676 1.00 0.00 N ATOM 363 CD2 HIS A 386 4.635 1.153 -7.303 1.00 0.00 C ATOM 364 CE1 HIS A 386 5.961 -0.455 -6.621 1.00 0.00 C ATOM 365 NE2 HIS A 386 5.929 0.810 -6.996 1.00 0.00 N ATOM 0 H HIS A 386 2.374 1.491 -4.781 1.00 0.00 H new ATOM 0 HA HIS A 386 0.505 -0.138 -6.284 1.00 0.00 H new ATOM 0 HB2 HIS A 386 2.234 -1.160 -7.698 1.00 0.00 H new ATOM 0 HB3 HIS A 386 2.041 0.543 -8.063 1.00 0.00 H new ATOM 0 HD2 HIS A 386 4.292 2.120 -7.639 1.00 0.00 H new ATOM 0 HE1 HIS A 386 6.842 -1.002 -6.320 1.00 0.00 H new ATOM 0 HE2 HIS A 386 6.735 1.433 -7.049 1.00 0.00 H new ATOM 374 N TYR A 387 1.640 -2.271 -5.286 1.00 0.00 N ATOM 375 CA TYR A 387 1.963 -3.377 -4.395 1.00 0.00 C ATOM 376 C TYR A 387 3.023 -4.277 -5.018 1.00 0.00 C ATOM 377 O TYR A 387 2.876 -4.735 -6.151 1.00 0.00 O ATOM 378 CB TYR A 387 0.696 -4.176 -4.089 1.00 0.00 C ATOM 379 CG TYR A 387 -0.513 -3.299 -3.861 1.00 0.00 C ATOM 380 CD1 TYR A 387 -0.642 -2.564 -2.693 1.00 0.00 C ATOM 381 CD2 TYR A 387 -1.517 -3.195 -4.817 1.00 0.00 C ATOM 382 CE1 TYR A 387 -1.737 -1.749 -2.477 1.00 0.00 C ATOM 383 CE2 TYR A 387 -2.618 -2.383 -4.609 1.00 0.00 C ATOM 384 CZ TYR A 387 -2.722 -1.662 -3.437 1.00 0.00 C ATOM 385 OH TYR A 387 -3.814 -0.851 -3.228 1.00 0.00 O ATOM 0 H TYR A 387 1.148 -2.548 -6.136 1.00 0.00 H new ATOM 0 HA TYR A 387 2.365 -2.976 -3.465 1.00 0.00 H new ATOM 0 HB2 TYR A 387 0.494 -4.857 -4.916 1.00 0.00 H new ATOM 0 HB3 TYR A 387 0.865 -4.790 -3.204 1.00 0.00 H new ATOM 0 HD1 TYR A 387 0.127 -2.629 -1.938 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -1.436 -3.757 -5.736 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -1.820 -1.183 -1.561 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -3.391 -2.314 -5.360 1.00 0.00 H new ATOM 0 HH TYR A 387 -4.286 -0.713 -4.076 1.00 0.00 H new ATOM 395 N VAL A 388 4.095 -4.517 -4.274 1.00 0.00 N ATOM 396 CA VAL A 388 5.187 -5.353 -4.753 1.00 0.00 C ATOM 397 C VAL A 388 5.247 -6.673 -3.992 1.00 0.00 C ATOM 398 O VAL A 388 5.157 -6.689 -2.770 1.00 0.00 O ATOM 399 CB VAL A 388 6.540 -4.627 -4.608 1.00 0.00 C ATOM 400 CG1 VAL A 388 6.627 -3.908 -3.269 1.00 0.00 C ATOM 401 CG2 VAL A 388 7.690 -5.602 -4.768 1.00 0.00 C ATOM 0 H VAL A 388 4.231 -4.144 -3.335 1.00 0.00 H new ATOM 0 HA VAL A 388 4.996 -5.558 -5.807 1.00 0.00 H new ATOM 0 HB VAL A 388 6.612 -3.881 -5.399 1.00 0.00 H new ATOM 0 HG11 VAL A 388 7.590 -3.403 -3.189 1.00 0.00 H new ATOM 0 HG12 VAL A 388 5.825 -3.173 -3.198 1.00 0.00 H new ATOM 0 HG13 VAL A 388 6.529 -4.632 -2.460 1.00 0.00 H new ATOM 0 HG21 VAL A 388 8.635 -5.070 -4.662 1.00 0.00 H new ATOM 0 HG22 VAL A 388 7.621 -6.375 -4.002 1.00 0.00 H new ATOM 0 HG23 VAL A 388 7.641 -6.063 -5.754 1.00 0.00 H new ATOM 411 N THR A 389 5.416 -7.775 -4.720 1.00 0.00 N ATOM 412 CA THR A 389 5.501 -9.090 -4.094 1.00 0.00 C ATOM 413 C THR A 389 6.951 -9.518 -3.918 1.00 0.00 C ATOM 414 O THR A 389 7.644 -9.820 -4.889 1.00 0.00 O ATOM 415 CB THR A 389 4.766 -10.170 -4.909 1.00 0.00 C ATOM 416 OG1 THR A 389 3.376 -9.859 -5.061 1.00 0.00 O ATOM 417 CG2 THR A 389 4.889 -11.530 -4.229 1.00 0.00 C ATOM 0 H THR A 389 5.496 -7.783 -5.737 1.00 0.00 H new ATOM 0 HA THR A 389 5.019 -8.996 -3.121 1.00 0.00 H new ATOM 0 HB THR A 389 5.233 -10.201 -5.893 1.00 0.00 H new ATOM 0 HG1 THR A 389 3.061 -10.187 -5.929 1.00 0.00 H new ATOM 0 HG21 THR A 389 4.364 -12.281 -4.819 1.00 0.00 H new ATOM 0 HG22 THR A 389 5.941 -11.803 -4.149 1.00 0.00 H new ATOM 0 HG23 THR A 389 4.450 -11.480 -3.232 1.00 0.00 H new ATOM 425 N VAL A 390 7.399 -9.555 -2.670 1.00 0.00 N ATOM 426 CA VAL A 390 8.767 -9.963 -2.365 1.00 0.00 C ATOM 427 C VAL A 390 8.854 -11.479 -2.274 1.00 0.00 C ATOM 428 O VAL A 390 9.770 -12.095 -2.822 1.00 0.00 O ATOM 429 CB VAL A 390 9.285 -9.353 -1.043 1.00 0.00 C ATOM 430 CG1 VAL A 390 10.509 -8.488 -1.294 1.00 0.00 C ATOM 431 CG2 VAL A 390 8.202 -8.548 -0.343 1.00 0.00 C ATOM 0 H VAL A 390 6.839 -9.309 -1.854 1.00 0.00 H new ATOM 0 HA VAL A 390 9.393 -9.593 -3.177 1.00 0.00 H new ATOM 0 HB VAL A 390 9.568 -10.177 -0.388 1.00 0.00 H new ATOM 0 HG11 VAL A 390 10.858 -8.068 -0.350 1.00 0.00 H new ATOM 0 HG12 VAL A 390 11.299 -9.095 -1.735 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.249 -7.679 -1.977 1.00 0.00 H new ATOM 0 HG21 VAL A 390 8.599 -8.133 0.583 1.00 0.00 H new ATOM 0 HG22 VAL A 390 7.874 -7.737 -0.993 1.00 0.00 H new ATOM 0 HG23 VAL A 390 7.356 -9.196 -0.117 1.00 0.00 H new ATOM 441 N LYS A 391 7.886 -12.076 -1.590 1.00 0.00 N ATOM 442 CA LYS A 391 7.845 -13.527 -1.436 1.00 0.00 C ATOM 443 C LYS A 391 6.434 -14.064 -1.654 1.00 0.00 C ATOM 444 O LYS A 391 5.450 -13.335 -1.532 1.00 0.00 O ATOM 445 CB LYS A 391 8.392 -13.950 -0.058 1.00 0.00 C ATOM 446 CG LYS A 391 7.354 -14.500 0.917 1.00 0.00 C ATOM 447 CD LYS A 391 7.994 -15.406 1.960 1.00 0.00 C ATOM 448 CE LYS A 391 8.303 -16.785 1.394 1.00 0.00 C ATOM 449 NZ LYS A 391 9.383 -17.470 2.159 1.00 0.00 N ATOM 0 H LYS A 391 7.120 -11.580 -1.134 1.00 0.00 H new ATOM 0 HA LYS A 391 8.488 -13.963 -2.201 1.00 0.00 H new ATOM 0 HB2 LYS A 391 9.162 -14.707 -0.208 1.00 0.00 H new ATOM 0 HB3 LYS A 391 8.877 -13.089 0.402 1.00 0.00 H new ATOM 0 HG2 LYS A 391 6.846 -13.673 1.414 1.00 0.00 H new ATOM 0 HG3 LYS A 391 6.595 -15.056 0.367 1.00 0.00 H new ATOM 0 HD2 LYS A 391 8.913 -14.948 2.325 1.00 0.00 H new ATOM 0 HD3 LYS A 391 7.326 -15.505 2.815 1.00 0.00 H new ATOM 0 HE2 LYS A 391 7.401 -17.396 1.414 1.00 0.00 H new ATOM 0 HE3 LYS A 391 8.601 -16.690 0.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 9.564 -18.406 1.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 10.252 -16.900 2.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 9.088 -17.583 3.150 1.00 0.00 H new ATOM 463 N LYS A 392 6.356 -15.350 -1.973 1.00 0.00 N ATOM 464 CA LYS A 392 5.084 -16.019 -2.209 1.00 0.00 C ATOM 465 C LYS A 392 5.087 -17.392 -1.550 1.00 0.00 C ATOM 466 O LYS A 392 6.124 -17.858 -1.077 1.00 0.00 O ATOM 467 CB LYS A 392 4.822 -16.163 -3.710 1.00 0.00 C ATOM 468 CG LYS A 392 5.895 -15.530 -4.583 1.00 0.00 C ATOM 469 CD LYS A 392 7.007 -16.517 -4.897 1.00 0.00 C ATOM 470 CE LYS A 392 7.549 -16.315 -6.303 1.00 0.00 C ATOM 471 NZ LYS A 392 6.512 -16.574 -7.339 1.00 0.00 N ATOM 0 H LYS A 392 7.170 -15.956 -2.075 1.00 0.00 H new ATOM 0 HA LYS A 392 4.289 -15.414 -1.773 1.00 0.00 H new ATOM 0 HB2 LYS A 392 4.744 -17.222 -3.956 1.00 0.00 H new ATOM 0 HB3 LYS A 392 3.860 -15.709 -3.947 1.00 0.00 H new ATOM 0 HG2 LYS A 392 5.448 -15.175 -5.512 1.00 0.00 H new ATOM 0 HG3 LYS A 392 6.311 -14.659 -4.077 1.00 0.00 H new ATOM 0 HD2 LYS A 392 7.814 -16.400 -4.174 1.00 0.00 H new ATOM 0 HD3 LYS A 392 6.632 -17.535 -4.793 1.00 0.00 H new ATOM 0 HE2 LYS A 392 7.919 -15.295 -6.407 1.00 0.00 H new ATOM 0 HE3 LYS A 392 8.398 -16.980 -6.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 6.969 -16.909 -8.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 5.850 -17.299 -6.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 5.991 -15.696 -7.536 1.00 0.00 H new ATOM 485 N PRO A 393 3.928 -18.062 -1.506 1.00 0.00 N ATOM 486 CA PRO A 393 3.816 -19.387 -0.895 1.00 0.00 C ATOM 487 C PRO A 393 4.669 -20.419 -1.623 1.00 0.00 C ATOM 488 O PRO A 393 4.636 -20.513 -2.849 1.00 0.00 O ATOM 489 CB PRO A 393 2.327 -19.725 -1.030 1.00 0.00 C ATOM 490 CG PRO A 393 1.823 -18.840 -2.119 1.00 0.00 C ATOM 491 CD PRO A 393 2.647 -17.585 -2.046 1.00 0.00 C ATOM 0 HA PRO A 393 4.168 -19.395 0.137 1.00 0.00 H new ATOM 0 HB2 PRO A 393 2.183 -20.776 -1.278 1.00 0.00 H new ATOM 0 HB3 PRO A 393 1.795 -19.542 -0.096 1.00 0.00 H new ATOM 0 HG2 PRO A 393 1.928 -19.320 -3.092 1.00 0.00 H new ATOM 0 HG3 PRO A 393 0.764 -18.620 -1.985 1.00 0.00 H new ATOM 0 HD2 PRO A 393 2.769 -17.124 -3.026 1.00 0.00 H new ATOM 0 HD3 PRO A 393 2.189 -16.838 -1.398 1.00 0.00 H new ATOM 499 N THR A 394 5.437 -21.190 -0.860 1.00 0.00 N ATOM 500 CA THR A 394 6.300 -22.209 -1.437 1.00 0.00 C ATOM 501 C THR A 394 6.348 -23.450 -0.552 1.00 0.00 C ATOM 502 O THR A 394 6.047 -23.387 0.640 1.00 0.00 O ATOM 503 CB THR A 394 7.731 -21.678 -1.645 1.00 0.00 C ATOM 504 OG1 THR A 394 8.475 -21.686 -0.420 1.00 0.00 O ATOM 505 CG2 THR A 394 7.706 -20.255 -2.185 1.00 0.00 C ATOM 0 H THR A 394 5.478 -21.127 0.157 1.00 0.00 H new ATOM 0 HA THR A 394 5.878 -22.475 -2.406 1.00 0.00 H new ATOM 0 HB THR A 394 8.214 -22.340 -2.364 1.00 0.00 H new ATOM 0 HG1 THR A 394 9.136 -20.962 -0.434 1.00 0.00 H new ATOM 0 HG21 THR A 394 8.727 -19.901 -2.324 1.00 0.00 H new ATOM 0 HG22 THR A 394 7.183 -20.238 -3.141 1.00 0.00 H new ATOM 0 HG23 THR A 394 7.190 -19.606 -1.477 1.00 0.00 H new ATOM 513 N ALA A 395 6.720 -24.577 -1.146 1.00 0.00 N ATOM 514 CA ALA A 395 6.800 -25.835 -0.416 1.00 0.00 C ATOM 515 C ALA A 395 7.489 -25.650 0.929 1.00 0.00 C ATOM 516 O ALA A 395 6.978 -26.077 1.964 1.00 0.00 O ATOM 517 CB ALA A 395 7.521 -26.894 -1.237 1.00 0.00 C ATOM 0 H ALA A 395 6.971 -24.645 -2.132 1.00 0.00 H new ATOM 0 HA ALA A 395 5.780 -26.173 -0.232 1.00 0.00 H new ATOM 0 HB1 ALA A 395 7.568 -27.824 -0.670 1.00 0.00 H new ATOM 0 HB2 ALA A 395 6.980 -27.063 -2.168 1.00 0.00 H new ATOM 0 HB3 ALA A 395 8.532 -26.554 -1.461 1.00 0.00 H new ATOM 523 N VAL A 396 8.650 -25.012 0.907 1.00 0.00 N ATOM 524 CA VAL A 396 9.413 -24.768 2.119 1.00 0.00 C ATOM 525 C VAL A 396 8.682 -23.808 3.050 1.00 0.00 C ATOM 526 O VAL A 396 8.667 -23.994 4.267 1.00 0.00 O ATOM 527 CB VAL A 396 10.804 -24.193 1.790 1.00 0.00 C ATOM 528 CG1 VAL A 396 11.396 -24.895 0.578 1.00 0.00 C ATOM 529 CG2 VAL A 396 10.730 -22.689 1.555 1.00 0.00 C ATOM 0 H VAL A 396 9.085 -24.653 0.057 1.00 0.00 H new ATOM 0 HA VAL A 396 9.530 -25.728 2.621 1.00 0.00 H new ATOM 0 HB VAL A 396 11.456 -24.369 2.646 1.00 0.00 H new ATOM 0 HG11 VAL A 396 12.379 -24.477 0.359 1.00 0.00 H new ATOM 0 HG12 VAL A 396 11.493 -25.961 0.786 1.00 0.00 H new ATOM 0 HG13 VAL A 396 10.741 -24.752 -0.281 1.00 0.00 H new ATOM 0 HG21 VAL A 396 11.725 -22.307 1.325 1.00 0.00 H new ATOM 0 HG22 VAL A 396 10.060 -22.484 0.720 1.00 0.00 H new ATOM 0 HG23 VAL A 396 10.352 -22.199 2.452 1.00 0.00 H new ATOM 539 N ASP A 397 8.083 -22.776 2.466 1.00 0.00 N ATOM 540 CA ASP A 397 7.356 -21.777 3.241 1.00 0.00 C ATOM 541 C ASP A 397 6.195 -21.193 2.442 1.00 0.00 C ATOM 542 O ASP A 397 6.398 -20.440 1.490 1.00 0.00 O ATOM 543 CB ASP A 397 8.298 -20.650 3.672 1.00 0.00 C ATOM 544 CG ASP A 397 9.177 -21.042 4.844 1.00 0.00 C ATOM 545 OD1 ASP A 397 8.685 -21.759 5.741 1.00 0.00 O ATOM 546 OD2 ASP A 397 10.356 -20.632 4.864 1.00 0.00 O ATOM 0 H ASP A 397 8.086 -22.609 1.460 1.00 0.00 H new ATOM 0 HA ASP A 397 6.953 -22.273 4.124 1.00 0.00 H new ATOM 0 HB2 ASP A 397 8.928 -20.365 2.829 1.00 0.00 H new ATOM 0 HB3 ASP A 397 7.710 -19.773 3.941 1.00 0.00 H new ATOM 551 N PRO A 398 4.957 -21.533 2.829 1.00 0.00 N ATOM 552 CA PRO A 398 3.755 -21.041 2.158 1.00 0.00 C ATOM 553 C PRO A 398 3.372 -19.638 2.614 1.00 0.00 C ATOM 554 O PRO A 398 2.233 -19.391 3.012 1.00 0.00 O ATOM 555 CB PRO A 398 2.691 -22.054 2.575 1.00 0.00 C ATOM 556 CG PRO A 398 3.135 -22.560 3.907 1.00 0.00 C ATOM 557 CD PRO A 398 4.637 -22.422 3.958 1.00 0.00 C ATOM 0 HA PRO A 398 3.887 -20.958 1.079 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.707 -21.589 2.638 1.00 0.00 H new ATOM 0 HB3 PRO A 398 2.614 -22.865 1.851 1.00 0.00 H new ATOM 0 HG2 PRO A 398 2.669 -21.990 4.710 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.839 -23.600 4.042 1.00 0.00 H new ATOM 0 HD2 PRO A 398 4.966 -21.996 4.906 1.00 0.00 H new ATOM 0 HD3 PRO A 398 5.129 -23.389 3.855 1.00 0.00 H new ATOM 565 N ASN A 399 4.332 -18.721 2.553 1.00 0.00 N ATOM 566 CA ASN A 399 4.101 -17.339 2.957 1.00 0.00 C ATOM 567 C ASN A 399 4.395 -16.379 1.810 1.00 0.00 C ATOM 568 O ASN A 399 5.157 -16.700 0.901 1.00 0.00 O ATOM 569 CB ASN A 399 4.973 -16.981 4.162 1.00 0.00 C ATOM 570 CG ASN A 399 5.103 -18.126 5.146 1.00 0.00 C ATOM 571 OD1 ASN A 399 6.149 -18.309 5.768 1.00 0.00 O ATOM 572 ND2 ASN A 399 4.038 -18.906 5.292 1.00 0.00 N ATOM 0 H ASN A 399 5.280 -18.911 2.227 1.00 0.00 H new ATOM 0 HA ASN A 399 3.051 -17.243 3.233 1.00 0.00 H new ATOM 0 HB2 ASN A 399 5.965 -16.690 3.815 1.00 0.00 H new ATOM 0 HB3 ASN A 399 4.547 -16.116 4.670 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.067 -19.693 5.940 1.00 0.00 H new ATOM 0 HD22 ASN A 399 3.191 -18.718 4.756 1.00 0.00 H new ATOM 579 N SER A 400 3.801 -15.194 1.870 1.00 0.00 N ATOM 580 CA SER A 400 4.008 -14.176 0.847 1.00 0.00 C ATOM 581 C SER A 400 4.275 -12.825 1.500 1.00 0.00 C ATOM 582 O SER A 400 3.773 -12.544 2.589 1.00 0.00 O ATOM 583 CB SER A 400 2.785 -14.071 -0.067 1.00 0.00 C ATOM 584 OG SER A 400 3.085 -13.344 -1.246 1.00 0.00 O ATOM 0 H SER A 400 3.169 -14.913 2.620 1.00 0.00 H new ATOM 0 HA SER A 400 4.871 -14.465 0.247 1.00 0.00 H new ATOM 0 HB2 SER A 400 2.439 -15.070 -0.331 1.00 0.00 H new ATOM 0 HB3 SER A 400 1.970 -13.582 0.467 1.00 0.00 H new ATOM 0 HG SER A 400 4.011 -13.024 -1.207 1.00 0.00 H new ATOM 590 N ILE A 401 5.057 -11.990 0.831 1.00 0.00 N ATOM 591 CA ILE A 401 5.372 -10.669 1.354 1.00 0.00 C ATOM 592 C ILE A 401 4.994 -9.588 0.349 1.00 0.00 C ATOM 593 O ILE A 401 5.077 -9.795 -0.862 1.00 0.00 O ATOM 594 CB ILE A 401 6.863 -10.533 1.715 1.00 0.00 C ATOM 595 CG1 ILE A 401 7.251 -11.545 2.794 1.00 0.00 C ATOM 596 CG2 ILE A 401 7.160 -9.122 2.187 1.00 0.00 C ATOM 597 CD1 ILE A 401 8.661 -12.070 2.642 1.00 0.00 C ATOM 0 H ILE A 401 5.483 -12.203 -0.071 1.00 0.00 H new ATOM 0 HA ILE A 401 4.787 -10.541 2.265 1.00 0.00 H new ATOM 0 HB ILE A 401 7.455 -10.738 0.823 1.00 0.00 H new ATOM 0 HG12 ILE A 401 7.148 -11.079 3.774 1.00 0.00 H new ATOM 0 HG13 ILE A 401 6.554 -12.382 2.765 1.00 0.00 H new ATOM 0 HG21 ILE A 401 8.217 -9.038 2.439 1.00 0.00 H new ATOM 0 HG22 ILE A 401 6.919 -8.415 1.394 1.00 0.00 H new ATOM 0 HG23 ILE A 401 6.558 -8.899 3.068 1.00 0.00 H new ATOM 0 HD11 ILE A 401 8.872 -12.783 3.439 1.00 0.00 H new ATOM 0 HD12 ILE A 401 8.763 -12.565 1.676 1.00 0.00 H new ATOM 0 HD13 ILE A 401 9.366 -11.241 2.701 1.00 0.00 H new ATOM 609 N VAL A 402 4.578 -8.435 0.858 1.00 0.00 N ATOM 610 CA VAL A 402 4.191 -7.329 -0.008 1.00 0.00 C ATOM 611 C VAL A 402 4.555 -5.975 0.586 1.00 0.00 C ATOM 612 O VAL A 402 4.487 -5.771 1.797 1.00 0.00 O ATOM 613 CB VAL A 402 2.686 -7.358 -0.325 1.00 0.00 C ATOM 614 CG1 VAL A 402 2.263 -6.083 -1.038 1.00 0.00 C ATOM 615 CG2 VAL A 402 2.338 -8.583 -1.156 1.00 0.00 C ATOM 0 H VAL A 402 4.500 -8.242 1.857 1.00 0.00 H new ATOM 0 HA VAL A 402 4.753 -7.461 -0.932 1.00 0.00 H new ATOM 0 HB VAL A 402 2.138 -7.418 0.615 1.00 0.00 H new ATOM 0 HG11 VAL A 402 1.195 -6.124 -1.253 1.00 0.00 H new ATOM 0 HG12 VAL A 402 2.472 -5.223 -0.401 1.00 0.00 H new ATOM 0 HG13 VAL A 402 2.818 -5.987 -1.971 1.00 0.00 H new ATOM 0 HG21 VAL A 402 1.269 -8.586 -1.370 1.00 0.00 H new ATOM 0 HG22 VAL A 402 2.896 -8.558 -2.092 1.00 0.00 H new ATOM 0 HG23 VAL A 402 2.599 -9.485 -0.602 1.00 0.00 H new ATOM 625 N GLU A 403 4.942 -5.054 -0.289 1.00 0.00 N ATOM 626 CA GLU A 403 5.321 -3.704 0.124 1.00 0.00 C ATOM 627 C GLU A 403 4.639 -2.656 -0.749 1.00 0.00 C ATOM 628 O GLU A 403 4.851 -2.617 -1.958 1.00 0.00 O ATOM 629 CB GLU A 403 6.839 -3.537 0.046 1.00 0.00 C ATOM 630 CG GLU A 403 7.590 -4.854 -0.073 1.00 0.00 C ATOM 631 CD GLU A 403 8.989 -4.681 -0.631 1.00 0.00 C ATOM 632 OE1 GLU A 403 9.753 -3.864 -0.074 1.00 0.00 O ATOM 633 OE2 GLU A 403 9.320 -5.363 -1.623 1.00 0.00 O ATOM 0 H GLU A 403 5.002 -5.217 -1.294 1.00 0.00 H new ATOM 0 HA GLU A 403 4.996 -3.559 1.154 1.00 0.00 H new ATOM 0 HB2 GLU A 403 7.084 -2.910 -0.811 1.00 0.00 H new ATOM 0 HB3 GLU A 403 7.185 -3.010 0.935 1.00 0.00 H new ATOM 0 HG2 GLU A 403 7.650 -5.323 0.909 1.00 0.00 H new ATOM 0 HG3 GLU A 403 7.028 -5.531 -0.716 1.00 0.00 H new ATOM 640 N CYS A 404 3.802 -1.815 -0.146 1.00 0.00 N ATOM 641 CA CYS A 404 3.095 -0.794 -0.904 1.00 0.00 C ATOM 642 C CYS A 404 3.978 0.415 -1.186 1.00 0.00 C ATOM 643 O CYS A 404 4.094 1.314 -0.353 1.00 0.00 O ATOM 644 CB CYS A 404 1.880 -0.328 -0.105 1.00 0.00 C ATOM 645 SG CYS A 404 0.679 -1.628 0.262 1.00 0.00 S ATOM 0 H CYS A 404 3.600 -1.822 0.854 1.00 0.00 H new ATOM 0 HA CYS A 404 2.796 -1.234 -1.856 1.00 0.00 H new ATOM 0 HB2 CYS A 404 2.224 0.107 0.834 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.379 0.466 -0.660 1.00 0.00 H new ATOM 0 HG CYS A 404 -0.196 -1.693 -0.697 1.00 0.00 H new ATOM 651 N ARG A 405 4.601 0.442 -2.361 1.00 0.00 N ATOM 652 CA ARG A 405 5.469 1.552 -2.729 1.00 0.00 C ATOM 653 C ARG A 405 4.679 2.644 -3.430 1.00 0.00 C ATOM 654 O ARG A 405 3.454 2.571 -3.536 1.00 0.00 O ATOM 655 CB ARG A 405 6.610 1.068 -3.627 1.00 0.00 C ATOM 656 CG ARG A 405 7.246 -0.228 -3.151 1.00 0.00 C ATOM 657 CD ARG A 405 8.239 -0.773 -4.165 1.00 0.00 C ATOM 658 NE ARG A 405 8.774 0.272 -5.036 1.00 0.00 N ATOM 659 CZ ARG A 405 9.172 0.057 -6.288 1.00 0.00 C ATOM 660 NH1 ARG A 405 9.089 -1.156 -6.819 1.00 0.00 N ATOM 661 NH2 ARG A 405 9.656 1.059 -7.011 1.00 0.00 N ATOM 0 H ARG A 405 4.521 -0.288 -3.069 1.00 0.00 H new ATOM 0 HA ARG A 405 5.895 1.965 -1.815 1.00 0.00 H new ATOM 0 HB2 ARG A 405 6.231 0.927 -4.639 1.00 0.00 H new ATOM 0 HB3 ARG A 405 7.376 1.842 -3.678 1.00 0.00 H new ATOM 0 HG2 ARG A 405 7.753 -0.057 -2.201 1.00 0.00 H new ATOM 0 HG3 ARG A 405 6.468 -0.970 -2.969 1.00 0.00 H new ATOM 0 HD2 ARG A 405 9.060 -1.261 -3.640 1.00 0.00 H new ATOM 0 HD3 ARG A 405 7.752 -1.535 -4.773 1.00 0.00 H new ATOM 0 HE ARG A 405 8.846 1.219 -4.664 1.00 0.00 H new ATOM 0 HH11 ARG A 405 8.719 -1.930 -6.267 1.00 0.00 H new ATOM 0 HH12 ARG A 405 9.395 -1.315 -7.779 1.00 0.00 H new ATOM 0 HH21 ARG A 405 9.723 1.993 -6.607 1.00 0.00 H new ATOM 0 HH22 ARG A 405 9.961 0.895 -7.970 1.00 0.00 H new ATOM 675 N VAL A 406 5.385 3.661 -3.901 1.00 0.00 N ATOM 676 CA VAL A 406 4.746 4.772 -4.584 1.00 0.00 C ATOM 677 C VAL A 406 5.681 5.387 -5.617 1.00 0.00 C ATOM 678 O VAL A 406 6.897 5.238 -5.527 1.00 0.00 O ATOM 679 CB VAL A 406 4.285 5.853 -3.584 1.00 0.00 C ATOM 680 CG1 VAL A 406 2.778 5.787 -3.392 1.00 0.00 C ATOM 681 CG2 VAL A 406 4.999 5.690 -2.247 1.00 0.00 C ATOM 0 H VAL A 406 6.399 3.739 -3.822 1.00 0.00 H new ATOM 0 HA VAL A 406 3.868 4.377 -5.096 1.00 0.00 H new ATOM 0 HB VAL A 406 4.542 6.830 -3.992 1.00 0.00 H new ATOM 0 HG11 VAL A 406 2.467 6.555 -2.684 1.00 0.00 H new ATOM 0 HG12 VAL A 406 2.282 5.953 -4.348 1.00 0.00 H new ATOM 0 HG13 VAL A 406 2.503 4.805 -3.006 1.00 0.00 H new ATOM 0 HG21 VAL A 406 4.659 6.462 -1.557 1.00 0.00 H new ATOM 0 HG22 VAL A 406 4.774 4.708 -1.832 1.00 0.00 H new ATOM 0 HG23 VAL A 406 6.075 5.784 -2.395 1.00 0.00 H new ATOM 691 N GLY A 407 5.105 6.065 -6.603 1.00 0.00 N ATOM 692 CA GLY A 407 5.900 6.683 -7.648 1.00 0.00 C ATOM 693 C GLY A 407 7.223 7.232 -7.144 1.00 0.00 C ATOM 694 O GLY A 407 8.196 7.305 -7.893 1.00 0.00 O ATOM 0 H GLY A 407 4.098 6.198 -6.698 1.00 0.00 H new ATOM 0 HA2 GLY A 407 6.092 5.950 -8.431 1.00 0.00 H new ATOM 0 HA3 GLY A 407 5.327 7.492 -8.102 1.00 0.00 H new ATOM 698 N ASP A 408 7.260 7.624 -5.876 1.00 0.00 N ATOM 699 CA ASP A 408 8.473 8.177 -5.279 1.00 0.00 C ATOM 700 C ASP A 408 9.531 7.102 -5.050 1.00 0.00 C ATOM 701 O ASP A 408 10.608 7.385 -4.523 1.00 0.00 O ATOM 702 CB ASP A 408 8.139 8.856 -3.950 1.00 0.00 C ATOM 703 CG ASP A 408 9.162 9.905 -3.564 1.00 0.00 C ATOM 704 OD1 ASP A 408 9.872 10.400 -4.464 1.00 0.00 O ATOM 705 OD2 ASP A 408 9.253 10.232 -2.363 1.00 0.00 O ATOM 0 H ASP A 408 6.464 7.570 -5.240 1.00 0.00 H new ATOM 0 HA ASP A 408 8.880 8.908 -5.977 1.00 0.00 H new ATOM 0 HB2 ASP A 408 7.155 9.320 -4.019 1.00 0.00 H new ATOM 0 HB3 ASP A 408 8.081 8.102 -3.165 1.00 0.00 H new ATOM 710 N GLY A 409 9.221 5.867 -5.428 1.00 0.00 N ATOM 711 CA GLY A 409 10.159 4.780 -5.231 1.00 0.00 C ATOM 712 C GLY A 409 10.297 4.426 -3.765 1.00 0.00 C ATOM 713 O GLY A 409 11.157 3.631 -3.385 1.00 0.00 O ATOM 0 H GLY A 409 8.339 5.600 -5.866 1.00 0.00 H new ATOM 0 HA2 GLY A 409 9.825 3.905 -5.788 1.00 0.00 H new ATOM 0 HA3 GLY A 409 11.133 5.061 -5.632 1.00 0.00 H new ATOM 717 N THR A 410 9.440 5.026 -2.940 1.00 0.00 N ATOM 718 CA THR A 410 9.454 4.783 -1.505 1.00 0.00 C ATOM 719 C THR A 410 8.345 3.822 -1.105 1.00 0.00 C ATOM 720 O THR A 410 7.267 3.818 -1.699 1.00 0.00 O ATOM 721 CB THR A 410 9.286 6.090 -0.706 1.00 0.00 C ATOM 722 OG1 THR A 410 10.046 7.162 -1.279 1.00 0.00 O ATOM 723 CG2 THR A 410 9.731 5.900 0.736 1.00 0.00 C ATOM 0 H THR A 410 8.725 5.686 -3.246 1.00 0.00 H new ATOM 0 HA THR A 410 10.424 4.344 -1.271 1.00 0.00 H new ATOM 0 HB THR A 410 8.227 6.346 -0.740 1.00 0.00 H new ATOM 0 HG1 THR A 410 9.915 7.976 -0.749 1.00 0.00 H new ATOM 0 HG21 THR A 410 9.604 6.835 1.282 1.00 0.00 H new ATOM 0 HG22 THR A 410 9.128 5.122 1.203 1.00 0.00 H new ATOM 0 HG23 THR A 410 10.781 5.607 0.757 1.00 0.00 H new ATOM 731 N VAL A 411 8.610 3.021 -0.085 1.00 0.00 N ATOM 732 CA VAL A 411 7.626 2.066 0.407 1.00 0.00 C ATOM 733 C VAL A 411 6.796 2.683 1.524 1.00 0.00 C ATOM 734 O VAL A 411 7.304 2.923 2.618 1.00 0.00 O ATOM 735 CB VAL A 411 8.293 0.781 0.928 1.00 0.00 C ATOM 736 CG1 VAL A 411 7.298 -0.370 0.931 1.00 0.00 C ATOM 737 CG2 VAL A 411 9.515 0.437 0.092 1.00 0.00 C ATOM 0 H VAL A 411 9.497 3.012 0.419 1.00 0.00 H new ATOM 0 HA VAL A 411 6.981 1.808 -0.433 1.00 0.00 H new ATOM 0 HB VAL A 411 8.621 0.952 1.953 1.00 0.00 H new ATOM 0 HG11 VAL A 411 7.786 -1.271 1.302 1.00 0.00 H new ATOM 0 HG12 VAL A 411 6.456 -0.121 1.576 1.00 0.00 H new ATOM 0 HG13 VAL A 411 6.939 -0.543 -0.083 1.00 0.00 H new ATOM 0 HG21 VAL A 411 9.973 -0.475 0.476 1.00 0.00 H new ATOM 0 HG22 VAL A 411 9.215 0.284 -0.945 1.00 0.00 H new ATOM 0 HG23 VAL A 411 10.234 1.255 0.145 1.00 0.00 H new ATOM 747 N LEU A 412 5.518 2.938 1.252 1.00 0.00 N ATOM 748 CA LEU A 412 4.648 3.525 2.262 1.00 0.00 C ATOM 749 C LEU A 412 4.079 2.449 3.174 1.00 0.00 C ATOM 750 O LEU A 412 3.891 2.676 4.369 1.00 0.00 O ATOM 751 CB LEU A 412 3.514 4.365 1.646 1.00 0.00 C ATOM 752 CG LEU A 412 2.889 3.856 0.342 1.00 0.00 C ATOM 753 CD1 LEU A 412 1.826 2.809 0.627 1.00 0.00 C ATOM 754 CD2 LEU A 412 2.282 5.025 -0.420 1.00 0.00 C ATOM 0 H LEU A 412 5.070 2.750 0.355 1.00 0.00 H new ATOM 0 HA LEU A 412 5.263 4.202 2.854 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.720 4.455 2.388 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.898 5.369 1.466 1.00 0.00 H new ATOM 0 HG LEU A 412 3.668 3.393 -0.264 1.00 0.00 H new ATOM 0 HD11 LEU A 412 1.396 2.462 -0.313 1.00 0.00 H new ATOM 0 HD12 LEU A 412 2.276 1.967 1.153 1.00 0.00 H new ATOM 0 HD13 LEU A 412 1.042 3.246 1.245 1.00 0.00 H new ATOM 0 HD21 LEU A 412 1.838 4.663 -1.347 1.00 0.00 H new ATOM 0 HD22 LEU A 412 1.513 5.498 0.191 1.00 0.00 H new ATOM 0 HD23 LEU A 412 3.060 5.753 -0.650 1.00 0.00 H new ATOM 766 N GLY A 413 3.805 1.278 2.613 1.00 0.00 N ATOM 767 CA GLY A 413 3.260 0.202 3.413 1.00 0.00 C ATOM 768 C GLY A 413 3.950 -1.126 3.178 1.00 0.00 C ATOM 769 O GLY A 413 4.783 -1.262 2.283 1.00 0.00 O ATOM 0 H GLY A 413 3.949 1.057 1.628 1.00 0.00 H new ATOM 0 HA2 GLY A 413 3.342 0.465 4.468 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.198 0.096 3.192 1.00 0.00 H new ATOM 773 N THR A 414 3.588 -2.106 3.993 1.00 0.00 N ATOM 774 CA THR A 414 4.145 -3.447 3.902 1.00 0.00 C ATOM 775 C THR A 414 3.237 -4.426 4.626 1.00 0.00 C ATOM 776 O THR A 414 2.628 -4.081 5.639 1.00 0.00 O ATOM 777 CB THR A 414 5.559 -3.530 4.510 1.00 0.00 C ATOM 778 OG1 THR A 414 6.449 -2.585 3.900 1.00 0.00 O ATOM 779 CG2 THR A 414 6.140 -4.925 4.333 1.00 0.00 C ATOM 0 H THR A 414 2.899 -1.993 4.737 1.00 0.00 H new ATOM 0 HA THR A 414 4.217 -3.700 2.844 1.00 0.00 H new ATOM 0 HB THR A 414 5.463 -3.299 5.571 1.00 0.00 H new ATOM 0 HG1 THR A 414 6.060 -2.265 3.059 1.00 0.00 H new ATOM 0 HG21 THR A 414 7.138 -4.961 4.769 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.499 -5.652 4.832 1.00 0.00 H new ATOM 0 HG23 THR A 414 6.199 -5.162 3.271 1.00 0.00 H new ATOM 787 N GLY A 415 3.140 -5.642 4.114 1.00 0.00 N ATOM 788 CA GLY A 415 2.292 -6.625 4.747 1.00 0.00 C ATOM 789 C GLY A 415 2.548 -8.027 4.246 1.00 0.00 C ATOM 790 O GLY A 415 2.701 -8.251 3.045 1.00 0.00 O ATOM 0 H GLY A 415 3.629 -5.963 3.279 1.00 0.00 H new ATOM 0 HA2 GLY A 415 2.450 -6.595 5.825 1.00 0.00 H new ATOM 0 HA3 GLY A 415 1.248 -6.366 4.570 1.00 0.00 H new ATOM 794 N VAL A 416 2.585 -8.971 5.174 1.00 0.00 N ATOM 795 CA VAL A 416 2.811 -10.363 4.840 1.00 0.00 C ATOM 796 C VAL A 416 1.501 -11.137 4.940 1.00 0.00 C ATOM 797 O VAL A 416 0.674 -10.861 5.809 1.00 0.00 O ATOM 798 CB VAL A 416 3.877 -10.985 5.773 1.00 0.00 C ATOM 799 CG1 VAL A 416 3.643 -12.475 5.975 1.00 0.00 C ATOM 800 CG2 VAL A 416 5.272 -10.733 5.223 1.00 0.00 C ATOM 0 H VAL A 416 2.460 -8.793 6.171 1.00 0.00 H new ATOM 0 HA VAL A 416 3.182 -10.421 3.817 1.00 0.00 H new ATOM 0 HB VAL A 416 3.790 -10.503 6.747 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.411 -12.878 6.636 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.661 -12.632 6.422 1.00 0.00 H new ATOM 0 HG13 VAL A 416 3.689 -12.984 5.012 1.00 0.00 H new ATOM 0 HG21 VAL A 416 6.012 -11.176 5.890 1.00 0.00 H new ATOM 0 HG22 VAL A 416 5.360 -11.182 4.234 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.446 -9.659 5.151 1.00 0.00 H new ATOM 810 N GLY A 417 1.316 -12.104 4.051 1.00 0.00 N ATOM 811 CA GLY A 417 0.103 -12.895 4.069 1.00 0.00 C ATOM 812 C GLY A 417 0.281 -14.235 3.387 1.00 0.00 C ATOM 813 O GLY A 417 1.240 -14.435 2.641 1.00 0.00 O ATOM 0 H GLY A 417 1.982 -12.354 3.320 1.00 0.00 H new ATOM 0 HA2 GLY A 417 -0.209 -13.054 5.101 1.00 0.00 H new ATOM 0 HA3 GLY A 417 -0.696 -12.342 3.576 1.00 0.00 H new ATOM 817 N ARG A 418 -0.642 -15.155 3.639 1.00 0.00 N ATOM 818 CA ARG A 418 -0.577 -16.482 3.040 1.00 0.00 C ATOM 819 C ARG A 418 -0.179 -16.381 1.576 1.00 0.00 C ATOM 820 O ARG A 418 0.658 -17.140 1.087 1.00 0.00 O ATOM 821 CB ARG A 418 -1.925 -17.184 3.165 1.00 0.00 C ATOM 822 CG ARG A 418 -3.084 -16.346 2.663 1.00 0.00 C ATOM 823 CD ARG A 418 -4.342 -16.593 3.478 1.00 0.00 C ATOM 824 NE ARG A 418 -4.835 -17.959 3.331 1.00 0.00 N ATOM 825 CZ ARG A 418 -5.989 -18.379 3.838 1.00 0.00 C ATOM 826 NH1 ARG A 418 -6.774 -17.531 4.489 1.00 0.00 N ATOM 827 NH2 ARG A 418 -6.362 -19.643 3.690 1.00 0.00 N ATOM 0 H ARG A 418 -1.443 -15.007 4.253 1.00 0.00 H new ATOM 0 HA ARG A 418 0.176 -17.065 3.570 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -1.893 -18.120 2.607 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -2.097 -17.442 4.210 1.00 0.00 H new ATOM 0 HG2 ARG A 418 -2.819 -15.290 2.712 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -3.276 -16.579 1.616 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -4.136 -16.394 4.530 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -5.118 -15.893 3.167 1.00 0.00 H new ATOM 0 HE ARG A 418 -4.264 -18.626 2.812 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -6.492 -16.557 4.600 1.00 0.00 H new ATOM 0 HH12 ARG A 418 -7.660 -17.853 4.879 1.00 0.00 H new ATOM 0 HH21 ARG A 418 -5.762 -20.296 3.186 1.00 0.00 H new ATOM 0 HH22 ARG A 418 -7.249 -19.962 4.081 1.00 0.00 H new ATOM 841 N ASN A 419 -0.782 -15.423 0.889 1.00 0.00 N ATOM 842 CA ASN A 419 -0.496 -15.189 -0.517 1.00 0.00 C ATOM 843 C ASN A 419 -0.137 -13.726 -0.731 1.00 0.00 C ATOM 844 O ASN A 419 -0.009 -12.965 0.227 1.00 0.00 O ATOM 845 CB ASN A 419 -1.699 -15.567 -1.382 1.00 0.00 C ATOM 846 CG ASN A 419 -1.455 -16.824 -2.194 1.00 0.00 C ATOM 847 OD1 ASN A 419 -1.572 -17.939 -1.685 1.00 0.00 O ATOM 848 ND2 ASN A 419 -1.114 -16.651 -3.466 1.00 0.00 N ATOM 0 H ASN A 419 -1.477 -14.791 1.286 1.00 0.00 H new ATOM 0 HA ASN A 419 0.348 -15.813 -0.811 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -2.570 -15.714 -0.744 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -1.932 -14.742 -2.055 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -0.938 -17.460 -4.061 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -1.028 -15.709 -3.847 1.00 0.00 H new ATOM 855 N ILE A 420 0.021 -13.334 -1.986 1.00 0.00 N ATOM 856 CA ILE A 420 0.362 -11.958 -2.305 1.00 0.00 C ATOM 857 C ILE A 420 -0.804 -11.024 -1.993 1.00 0.00 C ATOM 858 O ILE A 420 -0.636 -9.806 -1.923 1.00 0.00 O ATOM 859 CB ILE A 420 0.755 -11.813 -3.787 1.00 0.00 C ATOM 860 CG1 ILE A 420 2.146 -12.397 -4.025 1.00 0.00 C ATOM 861 CG2 ILE A 420 0.710 -10.353 -4.208 1.00 0.00 C ATOM 862 CD1 ILE A 420 2.130 -13.833 -4.500 1.00 0.00 C ATOM 0 H ILE A 420 -0.081 -13.946 -2.796 1.00 0.00 H new ATOM 0 HA ILE A 420 1.216 -11.681 -1.687 1.00 0.00 H new ATOM 0 HB ILE A 420 0.038 -12.367 -4.393 1.00 0.00 H new ATOM 0 HG12 ILE A 420 2.666 -11.785 -4.763 1.00 0.00 H new ATOM 0 HG13 ILE A 420 2.719 -12.336 -3.100 1.00 0.00 H new ATOM 0 HG21 ILE A 420 0.990 -10.268 -5.258 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -0.299 -9.965 -4.070 1.00 0.00 H new ATOM 0 HG23 ILE A 420 1.407 -9.777 -3.599 1.00 0.00 H new ATOM 0 HD11 ILE A 420 3.153 -14.179 -4.647 1.00 0.00 H new ATOM 0 HD12 ILE A 420 1.640 -14.458 -3.753 1.00 0.00 H new ATOM 0 HD13 ILE A 420 1.586 -13.899 -5.442 1.00 0.00 H new ATOM 874 N LYS A 421 -1.984 -11.602 -1.803 1.00 0.00 N ATOM 875 CA LYS A 421 -3.170 -10.821 -1.497 1.00 0.00 C ATOM 876 C LYS A 421 -3.209 -10.431 -0.028 1.00 0.00 C ATOM 877 O LYS A 421 -3.228 -9.249 0.306 1.00 0.00 O ATOM 878 CB LYS A 421 -4.422 -11.611 -1.854 1.00 0.00 C ATOM 879 CG LYS A 421 -5.700 -10.925 -1.428 1.00 0.00 C ATOM 880 CD LYS A 421 -5.604 -9.423 -1.619 1.00 0.00 C ATOM 881 CE LYS A 421 -5.417 -9.069 -3.082 1.00 0.00 C ATOM 882 NZ LYS A 421 -6.706 -8.713 -3.737 1.00 0.00 N ATOM 0 H LYS A 421 -2.142 -12.608 -1.856 1.00 0.00 H new ATOM 0 HA LYS A 421 -3.134 -9.908 -2.092 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.446 -11.774 -2.932 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.370 -12.593 -1.384 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.537 -11.316 -2.007 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -5.905 -11.149 -0.381 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.508 -8.947 -1.239 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -4.769 -9.032 -1.038 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -4.723 -8.232 -3.167 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -4.965 -9.912 -3.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -6.535 -8.478 -4.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -7.360 -9.520 -3.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -7.125 -7.892 -3.255 1.00 0.00 H new ATOM 896 N ILE A 422 -3.215 -11.419 0.850 1.00 0.00 N ATOM 897 CA ILE A 422 -3.248 -11.142 2.277 1.00 0.00 C ATOM 898 C ILE A 422 -2.120 -10.213 2.652 1.00 0.00 C ATOM 899 O ILE A 422 -2.277 -9.333 3.499 1.00 0.00 O ATOM 900 CB ILE A 422 -3.171 -12.429 3.103 1.00 0.00 C ATOM 901 CG1 ILE A 422 -4.361 -13.329 2.774 1.00 0.00 C ATOM 902 CG2 ILE A 422 -3.133 -12.112 4.591 1.00 0.00 C ATOM 903 CD1 ILE A 422 -5.583 -12.578 2.265 1.00 0.00 C ATOM 0 H ILE A 422 -3.198 -12.409 0.605 1.00 0.00 H new ATOM 0 HA ILE A 422 -4.200 -10.660 2.501 1.00 0.00 H new ATOM 0 HB ILE A 422 -2.251 -12.955 2.848 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -4.056 -14.057 2.023 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -4.638 -13.889 3.667 1.00 0.00 H new ATOM 0 HG21 ILE A 422 -3.078 -13.040 5.160 1.00 0.00 H new ATOM 0 HG22 ILE A 422 -2.258 -11.500 4.810 1.00 0.00 H new ATOM 0 HG23 ILE A 422 -4.035 -11.568 4.870 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -6.384 -13.287 2.054 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -5.916 -11.869 3.023 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -5.325 -12.040 1.353 1.00 0.00 H new ATOM 915 N ALA A 423 -0.992 -10.378 1.982 1.00 0.00 N ATOM 916 CA ALA A 423 0.138 -9.513 2.218 1.00 0.00 C ATOM 917 C ALA A 423 -0.219 -8.127 1.701 1.00 0.00 C ATOM 918 O ALA A 423 -0.124 -7.131 2.417 1.00 0.00 O ATOM 919 CB ALA A 423 1.394 -10.045 1.543 1.00 0.00 C ATOM 0 H ALA A 423 -0.840 -11.099 1.277 1.00 0.00 H new ATOM 0 HA ALA A 423 0.355 -9.470 3.285 1.00 0.00 H new ATOM 0 HB1 ALA A 423 2.227 -9.370 1.740 1.00 0.00 H new ATOM 0 HB2 ALA A 423 1.627 -11.034 1.937 1.00 0.00 H new ATOM 0 HB3 ALA A 423 1.229 -10.112 0.468 1.00 0.00 H new ATOM 925 N GLY A 424 -0.662 -8.092 0.445 1.00 0.00 N ATOM 926 CA GLY A 424 -1.071 -6.845 -0.173 1.00 0.00 C ATOM 927 C GLY A 424 -2.141 -6.148 0.641 1.00 0.00 C ATOM 928 O GLY A 424 -2.045 -4.950 0.908 1.00 0.00 O ATOM 0 H GLY A 424 -0.744 -8.912 -0.157 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -0.207 -6.189 -0.278 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -1.446 -7.041 -1.177 1.00 0.00 H new ATOM 932 N ILE A 425 -3.155 -6.904 1.062 1.00 0.00 N ATOM 933 CA ILE A 425 -4.221 -6.344 1.877 1.00 0.00 C ATOM 934 C ILE A 425 -3.613 -5.681 3.106 1.00 0.00 C ATOM 935 O ILE A 425 -3.725 -4.471 3.308 1.00 0.00 O ATOM 936 CB ILE A 425 -5.217 -7.428 2.348 1.00 0.00 C ATOM 937 CG1 ILE A 425 -5.940 -8.062 1.157 1.00 0.00 C ATOM 938 CG2 ILE A 425 -6.223 -6.837 3.326 1.00 0.00 C ATOM 939 CD1 ILE A 425 -6.154 -9.550 1.309 1.00 0.00 C ATOM 0 H ILE A 425 -3.256 -7.897 0.852 1.00 0.00 H new ATOM 0 HA ILE A 425 -4.762 -5.622 1.266 1.00 0.00 H new ATOM 0 HB ILE A 425 -4.652 -8.209 2.857 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -6.906 -7.575 1.026 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -5.364 -7.876 0.251 1.00 0.00 H new ATOM 0 HG21 ILE A 425 -6.917 -7.614 3.648 1.00 0.00 H new ATOM 0 HG22 ILE A 425 -5.696 -6.439 4.193 1.00 0.00 H new ATOM 0 HG23 ILE A 425 -6.777 -6.035 2.838 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -6.671 -9.935 0.430 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -5.190 -10.048 1.409 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -6.756 -9.742 2.197 1.00 0.00 H new ATOM 951 N ARG A 426 -2.966 -6.506 3.921 1.00 0.00 N ATOM 952 CA ARG A 426 -2.319 -6.050 5.146 1.00 0.00 C ATOM 953 C ARG A 426 -1.415 -4.845 4.898 1.00 0.00 C ATOM 954 O ARG A 426 -1.355 -3.928 5.716 1.00 0.00 O ATOM 955 CB ARG A 426 -1.504 -7.187 5.754 1.00 0.00 C ATOM 956 CG ARG A 426 -1.681 -7.324 7.255 1.00 0.00 C ATOM 957 CD ARG A 426 -0.572 -6.612 8.013 1.00 0.00 C ATOM 958 NE ARG A 426 -1.059 -6.005 9.249 1.00 0.00 N ATOM 959 CZ ARG A 426 -0.281 -5.736 10.292 1.00 0.00 C ATOM 960 NH1 ARG A 426 1.013 -6.015 10.244 1.00 0.00 N ATOM 961 NH2 ARG A 426 -0.799 -5.189 11.382 1.00 0.00 N ATOM 0 H ARG A 426 -2.875 -7.508 3.752 1.00 0.00 H new ATOM 0 HA ARG A 426 -3.102 -5.742 5.839 1.00 0.00 H new ATOM 0 HB2 ARG A 426 -1.789 -8.124 5.276 1.00 0.00 H new ATOM 0 HB3 ARG A 426 -0.449 -7.025 5.534 1.00 0.00 H new ATOM 0 HG2 ARG A 426 -2.646 -6.912 7.548 1.00 0.00 H new ATOM 0 HG3 ARG A 426 -1.690 -8.380 7.527 1.00 0.00 H new ATOM 0 HD2 ARG A 426 0.222 -7.322 8.246 1.00 0.00 H new ATOM 0 HD3 ARG A 426 -0.135 -5.841 7.378 1.00 0.00 H new ATOM 0 HE ARG A 426 -2.051 -5.775 9.315 1.00 0.00 H new ATOM 0 HH11 ARG A 426 1.413 -6.437 9.406 1.00 0.00 H new ATOM 0 HH12 ARG A 426 1.609 -5.808 11.045 1.00 0.00 H new ATOM 0 HH21 ARG A 426 -1.795 -4.974 11.421 1.00 0.00 H new ATOM 0 HH22 ARG A 426 -0.201 -4.983 12.182 1.00 0.00 H new ATOM 975 N ALA A 427 -0.707 -4.854 3.774 1.00 0.00 N ATOM 976 CA ALA A 427 0.199 -3.759 3.436 1.00 0.00 C ATOM 977 C ALA A 427 -0.576 -2.490 3.103 1.00 0.00 C ATOM 978 O ALA A 427 -0.449 -1.475 3.781 1.00 0.00 O ATOM 979 CB ALA A 427 1.105 -4.137 2.275 1.00 0.00 C ATOM 0 H ALA A 427 -0.741 -5.603 3.083 1.00 0.00 H new ATOM 0 HA ALA A 427 0.820 -3.566 4.311 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.769 -3.303 2.045 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.699 -5.010 2.546 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.498 -4.369 1.400 1.00 0.00 H new ATOM 985 N ALA A 428 -1.374 -2.562 2.048 1.00 0.00 N ATOM 986 CA ALA A 428 -2.166 -1.418 1.619 1.00 0.00 C ATOM 987 C ALA A 428 -2.765 -0.753 2.838 1.00 0.00 C ATOM 988 O ALA A 428 -2.615 0.448 3.059 1.00 0.00 O ATOM 989 CB ALA A 428 -3.264 -1.839 0.664 1.00 0.00 C ATOM 0 H ALA A 428 -1.490 -3.397 1.475 1.00 0.00 H new ATOM 0 HA ALA A 428 -1.518 -0.718 1.091 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -3.838 -0.963 0.361 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -2.822 -2.305 -0.216 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -3.923 -2.552 1.159 1.00 0.00 H new ATOM 995 N GLU A 429 -3.418 -1.572 3.640 1.00 0.00 N ATOM 996 CA GLU A 429 -4.027 -1.126 4.872 1.00 0.00 C ATOM 997 C GLU A 429 -2.964 -0.512 5.775 1.00 0.00 C ATOM 998 O GLU A 429 -3.056 0.635 6.184 1.00 0.00 O ATOM 999 CB GLU A 429 -4.663 -2.329 5.555 1.00 0.00 C ATOM 1000 CG GLU A 429 -6.099 -2.097 5.992 1.00 0.00 C ATOM 1001 CD GLU A 429 -6.281 -2.226 7.491 1.00 0.00 C ATOM 1002 OE1 GLU A 429 -5.561 -3.037 8.110 1.00 0.00 O ATOM 1003 OE2 GLU A 429 -7.142 -1.512 8.047 1.00 0.00 O ATOM 0 H GLU A 429 -3.540 -2.567 3.452 1.00 0.00 H new ATOM 0 HA GLU A 429 -4.787 -0.372 4.668 1.00 0.00 H new ATOM 0 HB2 GLU A 429 -4.633 -3.180 4.874 1.00 0.00 H new ATOM 0 HB3 GLU A 429 -4.066 -2.598 6.427 1.00 0.00 H new ATOM 0 HG2 GLU A 429 -6.415 -1.103 5.676 1.00 0.00 H new ATOM 0 HG3 GLU A 429 -6.748 -2.813 5.488 1.00 0.00 H new ATOM 1010 N ASN A 430 -1.967 -1.320 6.079 1.00 0.00 N ATOM 1011 CA ASN A 430 -0.876 -0.897 6.951 1.00 0.00 C ATOM 1012 C ASN A 430 -0.423 0.502 6.560 1.00 0.00 C ATOM 1013 O ASN A 430 -0.400 1.412 7.387 1.00 0.00 O ATOM 1014 CB ASN A 430 0.284 -1.875 6.874 1.00 0.00 C ATOM 1015 CG ASN A 430 1.517 -1.376 7.604 1.00 0.00 C ATOM 1016 OD1 ASN A 430 2.382 -0.730 7.014 1.00 0.00 O ATOM 1017 ND2 ASN A 430 1.604 -1.675 8.896 1.00 0.00 N ATOM 0 H ASN A 430 -1.885 -2.277 5.736 1.00 0.00 H new ATOM 0 HA ASN A 430 -1.233 -0.881 7.981 1.00 0.00 H new ATOM 0 HB2 ASN A 430 -0.023 -2.831 7.298 1.00 0.00 H new ATOM 0 HB3 ASN A 430 0.533 -2.056 5.828 1.00 0.00 H new ATOM 0 HD21 ASN A 430 2.411 -1.366 9.438 1.00 0.00 H new ATOM 0 HD22 ASN A 430 0.863 -2.213 9.346 1.00 0.00 H new ATOM 1024 N ALA A 431 -0.098 0.676 5.291 1.00 0.00 N ATOM 1025 CA ALA A 431 0.307 1.978 4.792 1.00 0.00 C ATOM 1026 C ALA A 431 -0.850 2.950 4.945 1.00 0.00 C ATOM 1027 O ALA A 431 -0.663 4.150 5.147 1.00 0.00 O ATOM 1028 CB ALA A 431 0.721 1.897 3.332 1.00 0.00 C ATOM 0 H ALA A 431 -0.106 -0.065 4.590 1.00 0.00 H new ATOM 0 HA ALA A 431 1.165 2.324 5.368 1.00 0.00 H new ATOM 0 HB1 ALA A 431 1.020 2.886 2.983 1.00 0.00 H new ATOM 0 HB2 ALA A 431 1.559 1.207 3.229 1.00 0.00 H new ATOM 0 HB3 ALA A 431 -0.118 1.540 2.735 1.00 0.00 H new ATOM 1034 N LEU A 432 -2.051 2.400 4.822 1.00 0.00 N ATOM 1035 CA LEU A 432 -3.285 3.167 4.913 1.00 0.00 C ATOM 1036 C LEU A 432 -3.605 3.610 6.342 1.00 0.00 C ATOM 1037 O LEU A 432 -3.907 4.779 6.579 1.00 0.00 O ATOM 1038 CB LEU A 432 -4.410 2.310 4.346 1.00 0.00 C ATOM 1039 CG LEU A 432 -5.801 2.543 4.919 1.00 0.00 C ATOM 1040 CD1 LEU A 432 -6.823 1.889 4.015 1.00 0.00 C ATOM 1041 CD2 LEU A 432 -5.916 1.998 6.337 1.00 0.00 C ATOM 0 H LEU A 432 -2.196 1.404 4.655 1.00 0.00 H new ATOM 0 HA LEU A 432 -3.170 4.086 4.339 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -4.453 2.474 3.269 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -4.150 1.263 4.499 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.986 3.616 4.968 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -7.822 2.051 4.419 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -6.759 2.325 3.018 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -6.625 0.819 3.956 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -6.921 2.181 6.717 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -5.719 0.926 6.332 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -5.190 2.497 6.979 1.00 0.00 H new ATOM 1053 N ARG A 433 -3.548 2.679 7.288 1.00 0.00 N ATOM 1054 CA ARG A 433 -3.847 3.001 8.679 1.00 0.00 C ATOM 1055 C ARG A 433 -2.920 4.096 9.176 1.00 0.00 C ATOM 1056 O ARG A 433 -3.321 4.960 9.956 1.00 0.00 O ATOM 1057 CB ARG A 433 -3.744 1.767 9.587 1.00 0.00 C ATOM 1058 CG ARG A 433 -2.876 0.645 9.042 1.00 0.00 C ATOM 1059 CD ARG A 433 -3.726 -0.477 8.471 1.00 0.00 C ATOM 1060 NE ARG A 433 -4.508 -1.150 9.503 1.00 0.00 N ATOM 1061 CZ ARG A 433 -3.971 -1.901 10.459 1.00 0.00 C ATOM 1062 NH1 ARG A 433 -2.656 -2.060 10.519 1.00 0.00 N ATOM 1063 NH2 ARG A 433 -4.747 -2.489 11.358 1.00 0.00 N ATOM 0 H ARG A 433 -3.300 1.704 7.120 1.00 0.00 H new ATOM 0 HA ARG A 433 -4.877 3.355 8.720 1.00 0.00 H new ATOM 0 HB2 ARG A 433 -3.348 2.077 10.554 1.00 0.00 H new ATOM 0 HB3 ARG A 433 -4.747 1.378 9.763 1.00 0.00 H new ATOM 0 HG2 ARG A 433 -2.216 1.035 8.267 1.00 0.00 H new ATOM 0 HG3 ARG A 433 -2.240 0.255 9.836 1.00 0.00 H new ATOM 0 HD2 ARG A 433 -4.397 -0.073 7.713 1.00 0.00 H new ATOM 0 HD3 ARG A 433 -3.082 -1.202 7.973 1.00 0.00 H new ATOM 0 HE ARG A 433 -5.522 -1.038 9.490 1.00 0.00 H new ATOM 0 HH11 ARG A 433 -2.055 -1.606 9.831 1.00 0.00 H new ATOM 0 HH12 ARG A 433 -2.245 -2.637 11.253 1.00 0.00 H new ATOM 0 HH21 ARG A 433 -5.759 -2.366 11.317 1.00 0.00 H new ATOM 0 HH22 ARG A 433 -4.333 -3.065 12.091 1.00 0.00 H new ATOM 1077 N ASP A 434 -1.682 4.068 8.702 1.00 0.00 N ATOM 1078 CA ASP A 434 -0.704 5.068 9.079 1.00 0.00 C ATOM 1079 C ASP A 434 -1.179 6.447 8.643 1.00 0.00 C ATOM 1080 O ASP A 434 -1.125 6.792 7.462 1.00 0.00 O ATOM 1081 CB ASP A 434 0.643 4.737 8.444 1.00 0.00 C ATOM 1082 CG ASP A 434 1.033 3.289 8.664 1.00 0.00 C ATOM 1083 OD1 ASP A 434 0.586 2.701 9.671 1.00 0.00 O ATOM 1084 OD2 ASP A 434 1.782 2.741 7.828 1.00 0.00 O ATOM 0 H ASP A 434 -1.335 3.360 8.055 1.00 0.00 H new ATOM 0 HA ASP A 434 -0.587 5.070 10.163 1.00 0.00 H new ATOM 0 HB2 ASP A 434 0.600 4.943 7.374 1.00 0.00 H new ATOM 0 HB3 ASP A 434 1.411 5.387 8.863 1.00 0.00 H new ATOM 1089 N LYS A 435 -1.667 7.222 9.601 1.00 0.00 N ATOM 1090 CA LYS A 435 -2.178 8.559 9.326 1.00 0.00 C ATOM 1091 C LYS A 435 -1.097 9.468 8.767 1.00 0.00 C ATOM 1092 O LYS A 435 -1.193 9.937 7.637 1.00 0.00 O ATOM 1093 CB LYS A 435 -2.759 9.167 10.599 1.00 0.00 C ATOM 1094 CG LYS A 435 -3.094 10.642 10.471 1.00 0.00 C ATOM 1095 CD LYS A 435 -4.552 10.905 10.807 1.00 0.00 C ATOM 1096 CE LYS A 435 -5.467 9.932 10.085 1.00 0.00 C ATOM 1097 NZ LYS A 435 -6.003 8.888 11.002 1.00 0.00 N ATOM 0 H LYS A 435 -1.720 6.946 10.582 1.00 0.00 H new ATOM 0 HA LYS A 435 -2.961 8.468 8.573 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -3.661 8.621 10.873 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -2.046 9.034 11.413 1.00 0.00 H new ATOM 0 HG2 LYS A 435 -2.454 11.222 11.136 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -2.886 10.978 9.455 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -4.701 10.818 11.883 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -4.813 11.927 10.531 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -6.295 10.479 9.634 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -4.920 9.455 9.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -6.044 7.976 10.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -5.381 8.802 11.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -6.959 9.156 11.313 1.00 0.00 H new ATOM 1111 N LYS A 436 -0.092 9.744 9.580 1.00 0.00 N ATOM 1112 CA LYS A 436 0.981 10.638 9.179 1.00 0.00 C ATOM 1113 C LYS A 436 1.304 10.463 7.706 1.00 0.00 C ATOM 1114 O LYS A 436 1.306 11.433 6.952 1.00 0.00 O ATOM 1115 CB LYS A 436 2.226 10.379 10.021 1.00 0.00 C ATOM 1116 CG LYS A 436 2.395 11.370 11.157 1.00 0.00 C ATOM 1117 CD LYS A 436 1.371 11.134 12.255 1.00 0.00 C ATOM 1118 CE LYS A 436 0.501 12.360 12.477 1.00 0.00 C ATOM 1119 NZ LYS A 436 -0.340 12.671 11.288 1.00 0.00 N ATOM 0 H LYS A 436 0.004 9.362 10.521 1.00 0.00 H new ATOM 0 HA LYS A 436 0.650 11.664 9.341 1.00 0.00 H new ATOM 0 HB2 LYS A 436 2.176 9.370 10.431 1.00 0.00 H new ATOM 0 HB3 LYS A 436 3.106 10.418 9.379 1.00 0.00 H new ATOM 0 HG2 LYS A 436 3.400 11.284 11.570 1.00 0.00 H new ATOM 0 HG3 LYS A 436 2.293 12.386 10.774 1.00 0.00 H new ATOM 0 HD2 LYS A 436 0.743 10.283 11.991 1.00 0.00 H new ATOM 0 HD3 LYS A 436 1.883 10.877 13.182 1.00 0.00 H new ATOM 0 HE2 LYS A 436 -0.141 12.197 13.342 1.00 0.00 H new ATOM 0 HE3 LYS A 436 1.134 13.217 12.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 -1.192 13.186 11.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 0.202 13.259 10.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 -0.619 11.786 10.819 1.00 0.00 H new ATOM 1133 N MET A 437 1.560 9.234 7.292 1.00 0.00 N ATOM 1134 CA MET A 437 1.863 8.971 5.887 1.00 0.00 C ATOM 1135 C MET A 437 0.660 9.339 5.030 1.00 0.00 C ATOM 1136 O MET A 437 0.793 10.005 4.004 1.00 0.00 O ATOM 1137 CB MET A 437 2.268 7.508 5.642 1.00 0.00 C ATOM 1138 CG MET A 437 2.090 6.593 6.843 1.00 0.00 C ATOM 1139 SD MET A 437 3.387 6.810 8.077 1.00 0.00 S ATOM 1140 CE MET A 437 4.102 5.168 8.117 1.00 0.00 C ATOM 0 H MET A 437 1.566 8.411 7.894 1.00 0.00 H new ATOM 0 HA MET A 437 2.718 9.588 5.609 1.00 0.00 H new ATOM 0 HB2 MET A 437 1.680 7.116 4.813 1.00 0.00 H new ATOM 0 HB3 MET A 437 3.313 7.481 5.333 1.00 0.00 H new ATOM 0 HG2 MET A 437 1.121 6.786 7.302 1.00 0.00 H new ATOM 0 HG3 MET A 437 2.083 5.556 6.507 1.00 0.00 H new ATOM 0 HE1 MET A 437 5.160 5.238 8.371 1.00 0.00 H new ATOM 0 HE2 MET A 437 3.588 4.565 8.866 1.00 0.00 H new ATOM 0 HE3 MET A 437 3.994 4.700 7.138 1.00 0.00 H new ATOM 1150 N LEU A 438 -0.524 8.920 5.471 1.00 0.00 N ATOM 1151 CA LEU A 438 -1.753 9.230 4.753 1.00 0.00 C ATOM 1152 C LEU A 438 -1.861 10.741 4.558 1.00 0.00 C ATOM 1153 O LEU A 438 -1.801 11.248 3.437 1.00 0.00 O ATOM 1154 CB LEU A 438 -2.945 8.719 5.554 1.00 0.00 C ATOM 1155 CG LEU A 438 -4.291 9.323 5.177 1.00 0.00 C ATOM 1156 CD1 LEU A 438 -5.355 8.246 5.187 1.00 0.00 C ATOM 1157 CD2 LEU A 438 -4.658 10.448 6.133 1.00 0.00 C ATOM 0 H LEU A 438 -0.656 8.368 6.318 1.00 0.00 H new ATOM 0 HA LEU A 438 -1.743 8.746 3.776 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -3.005 7.637 5.435 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -2.762 8.913 6.611 1.00 0.00 H new ATOM 0 HG LEU A 438 -4.223 9.742 4.173 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -6.317 8.682 4.917 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -5.094 7.470 4.468 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -5.422 7.810 6.184 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -5.623 10.868 5.848 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -4.718 10.057 7.149 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -3.896 11.226 6.088 1.00 0.00 H new ATOM 1169 N ASP A 439 -1.994 11.449 5.673 1.00 0.00 N ATOM 1170 CA ASP A 439 -2.083 12.903 5.688 1.00 0.00 C ATOM 1171 C ASP A 439 -0.862 13.519 5.027 1.00 0.00 C ATOM 1172 O ASP A 439 -0.880 14.671 4.611 1.00 0.00 O ATOM 1173 CB ASP A 439 -2.175 13.386 7.134 1.00 0.00 C ATOM 1174 CG ASP A 439 -3.325 14.347 7.362 1.00 0.00 C ATOM 1175 OD1 ASP A 439 -4.239 14.391 6.512 1.00 0.00 O ATOM 1176 OD2 ASP A 439 -3.313 15.056 8.391 1.00 0.00 O ATOM 0 H ASP A 439 -2.043 11.026 6.600 1.00 0.00 H new ATOM 0 HA ASP A 439 -2.971 13.208 5.135 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.291 12.525 7.793 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -1.240 13.874 7.409 1.00 0.00 H new ATOM 1181 N PHE A 440 0.190 12.731 4.922 1.00 0.00 N ATOM 1182 CA PHE A 440 1.415 13.193 4.300 1.00 0.00 C ATOM 1183 C PHE A 440 1.252 13.190 2.792 1.00 0.00 C ATOM 1184 O PHE A 440 1.444 14.211 2.131 1.00 0.00 O ATOM 1185 CB PHE A 440 2.602 12.318 4.714 1.00 0.00 C ATOM 1186 CG PHE A 440 3.890 12.708 4.046 1.00 0.00 C ATOM 1187 CD1 PHE A 440 4.633 13.779 4.518 1.00 0.00 C ATOM 1188 CD2 PHE A 440 4.357 12.008 2.944 1.00 0.00 C ATOM 1189 CE1 PHE A 440 5.817 14.143 3.904 1.00 0.00 C ATOM 1190 CE2 PHE A 440 5.539 12.369 2.326 1.00 0.00 C ATOM 1191 CZ PHE A 440 6.271 13.437 2.806 1.00 0.00 C ATOM 0 H PHE A 440 0.221 11.769 5.259 1.00 0.00 H new ATOM 0 HA PHE A 440 1.618 14.210 4.636 1.00 0.00 H new ATOM 0 HB2 PHE A 440 2.729 12.378 5.795 1.00 0.00 H new ATOM 0 HB3 PHE A 440 2.378 11.278 4.476 1.00 0.00 H new ATOM 0 HD1 PHE A 440 4.283 14.335 5.375 1.00 0.00 H new ATOM 0 HD2 PHE A 440 3.790 11.171 2.564 1.00 0.00 H new ATOM 0 HE1 PHE A 440 6.387 14.979 4.282 1.00 0.00 H new ATOM 0 HE2 PHE A 440 5.890 11.816 1.468 1.00 0.00 H new ATOM 0 HZ PHE A 440 7.196 13.720 2.325 1.00 0.00 H new ATOM 1201 N TYR A 441 0.875 12.039 2.253 1.00 0.00 N ATOM 1202 CA TYR A 441 0.665 11.909 0.828 1.00 0.00 C ATOM 1203 C TYR A 441 -0.435 12.848 0.372 1.00 0.00 C ATOM 1204 O TYR A 441 -0.248 13.618 -0.570 1.00 0.00 O ATOM 1205 CB TYR A 441 0.333 10.466 0.473 1.00 0.00 C ATOM 1206 CG TYR A 441 1.534 9.558 0.561 1.00 0.00 C ATOM 1207 CD1 TYR A 441 2.788 9.999 0.157 1.00 0.00 C ATOM 1208 CD2 TYR A 441 1.415 8.263 1.036 1.00 0.00 C ATOM 1209 CE1 TYR A 441 3.891 9.173 0.228 1.00 0.00 C ATOM 1210 CE2 TYR A 441 2.513 7.430 1.112 1.00 0.00 C ATOM 1211 CZ TYR A 441 3.750 7.890 0.706 1.00 0.00 C ATOM 1212 OH TYR A 441 4.849 7.064 0.778 1.00 0.00 O ATOM 0 H TYR A 441 0.710 11.185 2.786 1.00 0.00 H new ATOM 0 HA TYR A 441 1.583 12.183 0.309 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -0.445 10.100 1.143 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -0.074 10.428 -0.538 1.00 0.00 H new ATOM 0 HD1 TYR A 441 2.901 11.005 -0.219 1.00 0.00 H new ATOM 0 HD2 TYR A 441 0.448 7.899 1.352 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.859 9.531 -0.090 1.00 0.00 H new ATOM 0 HE2 TYR A 441 2.405 6.423 1.487 1.00 0.00 H new ATOM 0 HH TYR A 441 5.108 6.946 1.716 1.00 0.00 H new ATOM 1222 N ALA A 442 -1.573 12.812 1.057 1.00 0.00 N ATOM 1223 CA ALA A 442 -2.662 13.704 0.707 1.00 0.00 C ATOM 1224 C ALA A 442 -2.132 15.131 0.727 1.00 0.00 C ATOM 1225 O ALA A 442 -2.086 15.807 -0.300 1.00 0.00 O ATOM 1226 CB ALA A 442 -3.835 13.547 1.663 1.00 0.00 C ATOM 0 H ALA A 442 -1.760 12.187 1.841 1.00 0.00 H new ATOM 0 HA ALA A 442 -3.032 13.457 -0.288 1.00 0.00 H new ATOM 0 HB1 ALA A 442 -4.634 14.229 1.373 1.00 0.00 H new ATOM 0 HB2 ALA A 442 -4.201 12.521 1.624 1.00 0.00 H new ATOM 0 HB3 ALA A 442 -3.511 13.778 2.678 1.00 0.00 H new ATOM 1232 N LYS A 443 -1.725 15.574 1.913 1.00 0.00 N ATOM 1233 CA LYS A 443 -1.187 16.914 2.083 1.00 0.00 C ATOM 1234 C LYS A 443 -0.225 17.221 0.954 1.00 0.00 C ATOM 1235 O LYS A 443 -0.134 18.354 0.485 1.00 0.00 O ATOM 1236 CB LYS A 443 -0.444 17.022 3.409 1.00 0.00 C ATOM 1237 CG LYS A 443 -1.346 17.140 4.618 1.00 0.00 C ATOM 1238 CD LYS A 443 -1.645 18.592 4.955 1.00 0.00 C ATOM 1239 CE LYS A 443 -2.080 19.388 3.733 1.00 0.00 C ATOM 1240 NZ LYS A 443 -2.375 20.807 4.082 1.00 0.00 N ATOM 0 H LYS A 443 -1.759 15.021 2.770 1.00 0.00 H new ATOM 0 HA LYS A 443 -2.013 17.625 2.074 1.00 0.00 H new ATOM 0 HB2 LYS A 443 0.192 16.145 3.529 1.00 0.00 H new ATOM 0 HB3 LYS A 443 0.214 17.890 3.374 1.00 0.00 H new ATOM 0 HG2 LYS A 443 -2.280 16.610 4.429 1.00 0.00 H new ATOM 0 HG3 LYS A 443 -0.873 16.657 5.473 1.00 0.00 H new ATOM 0 HD2 LYS A 443 -2.429 18.634 5.711 1.00 0.00 H new ATOM 0 HD3 LYS A 443 -0.758 19.053 5.390 1.00 0.00 H new ATOM 0 HE2 LYS A 443 -1.296 19.354 2.977 1.00 0.00 H new ATOM 0 HE3 LYS A 443 -2.966 18.928 3.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 -2.668 21.321 3.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 -3.140 20.840 4.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 -1.522 21.252 4.478 1.00 0.00 H new ATOM 1254 N GLN A 444 0.468 16.186 0.502 1.00 0.00 N ATOM 1255 CA GLN A 444 1.399 16.323 -0.603 1.00 0.00 C ATOM 1256 C GLN A 444 0.619 16.699 -1.857 1.00 0.00 C ATOM 1257 O GLN A 444 0.890 17.706 -2.504 1.00 0.00 O ATOM 1258 CB GLN A 444 2.160 15.014 -0.821 1.00 0.00 C ATOM 1259 CG GLN A 444 3.536 15.201 -1.434 1.00 0.00 C ATOM 1260 CD GLN A 444 4.523 14.150 -0.973 1.00 0.00 C ATOM 1261 OE1 GLN A 444 5.036 14.212 0.143 1.00 0.00 O ATOM 1262 NE2 GLN A 444 4.792 13.174 -1.832 1.00 0.00 N ATOM 0 H GLN A 444 0.402 15.243 0.885 1.00 0.00 H new ATOM 0 HA GLN A 444 2.126 17.103 -0.377 1.00 0.00 H new ATOM 0 HB2 GLN A 444 2.265 14.502 0.135 1.00 0.00 H new ATOM 0 HB3 GLN A 444 1.570 14.364 -1.467 1.00 0.00 H new ATOM 0 HG2 GLN A 444 3.454 15.166 -2.520 1.00 0.00 H new ATOM 0 HG3 GLN A 444 3.915 16.190 -1.174 1.00 0.00 H new ATOM 0 HE21 GLN A 444 4.343 13.162 -2.748 1.00 0.00 H new ATOM 0 HE22 GLN A 444 5.448 12.436 -1.576 1.00 0.00 H new