USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 559 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 298 THR OG1 : rot 89:sc= 1.82 USER MOD Set 1.2: A 314 SER OG : rot 77:sc= 0.862 USER MOD Set 2.1: A 267 GLN : amide:sc= -1.33! X(o=-1!,f=-1.4) USER MOD Set 2.2: A 296 THR OG1 : rot -133:sc= 0.308 USER MOD Set 3.1: A 269 LYS NZ :NH3+ -178:sc= 1.25 (180deg=-0.0131) USER MOD Set 3.2: A 271 THR OG1 : rot -130:sc= 0.965 USER MOD Set 4.1: A 248 THR OG1 : rot 180:sc= -0.108 USER MOD Set 4.2: A 312 THR OG1 : rot -125:sc= 0.334 USER MOD Single : A 227 THR OG1 : rot 180:sc= 0 USER MOD Single : A 229 THR OG1 : rot 180:sc= 0 USER MOD Single : A 231 LYS NZ :NH3+ -169:sc= -0.056 (180deg=-0.267) USER MOD Single : A 232 THR OG1 : rot -73:sc= 1.52 USER MOD Single : A 233 GLN : amide:sc= -0.687 X(o=-0.69,f=-0.85) USER MOD Single : A 235 THR OG1 : rot 180:sc= 0 USER MOD Single : A 237 THR OG1 : rot 180:sc= 0.00486 USER MOD Single : A 238 TYR OH : rot 180:sc= 0 USER MOD Single : A 239 ASN : amide:sc= -1.58! C(o=-1.6!,f=-6.6!) USER MOD Single : A 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot 180:sc= -0.0128 USER MOD Single : A 245 TYR OH : rot 180:sc= -0.256 USER MOD Single : A 246 GLN : amide:sc= -1.11 K(o=-1.1,f=0) USER MOD Single : A 250 THR OG1 : rot 180:sc= 0 USER MOD Single : A 252 THR OG1 : rot 151:sc= -0.0225 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0.00364 USER MOD Single : A 257 SER OG : rot -42:sc= 0.68 USER MOD Single : A 259 THR OG1 : rot 180:sc= 0 USER MOD Single : A 263 LYS NZ :NH3+ 180:sc= 1.24 (180deg=1.24) USER MOD Single : A 272 ASN : amide:sc= -1.31 K(o=-1.3,f=-1.9) USER MOD Single : A 292 SER OG : rot -26:sc= 0.262 USER MOD Single : A 294 THR OG1 : rot 180:sc= 0 USER MOD Single : A 302 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 303 SER OG : rot -101:sc= 1.24 USER MOD Single : A 305 SER OG : rot 180:sc= 0 USER MOD Single : A 310 THR OG1 : rot -172:sc= -2.92! USER MOD Single : A 340 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 47 N GLY A 226 12.248 -4.417 -9.532 1.00 0.00 N ATOM 48 CA GLY A 226 12.215 -4.075 -8.132 1.00 0.00 C ATOM 49 C GLY A 226 11.065 -4.783 -7.459 1.00 0.00 C ATOM 50 O GLY A 226 9.904 -4.501 -7.756 1.00 0.00 O ATOM 0 HA2 GLY A 226 13.155 -4.357 -7.657 1.00 0.00 H new ATOM 0 HA3 GLY A 226 12.109 -2.997 -8.014 1.00 0.00 H new ATOM 54 N THR A 227 11.378 -5.699 -6.562 1.00 0.00 N ATOM 55 CA THR A 227 10.366 -6.539 -5.945 1.00 0.00 C ATOM 56 C THR A 227 10.516 -6.524 -4.430 1.00 0.00 C ATOM 57 O THR A 227 11.617 -6.691 -3.905 1.00 0.00 O ATOM 58 CB THR A 227 10.480 -7.989 -6.453 1.00 0.00 C ATOM 59 OG1 THR A 227 10.542 -8.002 -7.889 1.00 0.00 O ATOM 60 CG2 THR A 227 9.299 -8.833 -5.990 1.00 0.00 C ATOM 0 H THR A 227 12.329 -5.882 -6.243 1.00 0.00 H new ATOM 0 HA THR A 227 9.388 -6.142 -6.216 1.00 0.00 H new ATOM 0 HB THR A 227 11.393 -8.417 -6.039 1.00 0.00 H new ATOM 0 HG1 THR A 227 10.616 -8.927 -8.205 1.00 0.00 H new ATOM 0 HG21 THR A 227 9.410 -9.850 -6.365 1.00 0.00 H new ATOM 0 HG22 THR A 227 9.268 -8.849 -4.901 1.00 0.00 H new ATOM 0 HG23 THR A 227 8.373 -8.404 -6.373 1.00 0.00 H new ATOM 68 N LEU A 228 9.411 -6.309 -3.736 1.00 0.00 N ATOM 69 CA LEU A 228 9.414 -6.265 -2.288 1.00 0.00 C ATOM 70 C LEU A 228 8.197 -6.998 -1.739 1.00 0.00 C ATOM 71 O LEU A 228 7.407 -7.571 -2.492 1.00 0.00 O ATOM 72 CB LEU A 228 9.422 -4.818 -1.790 1.00 0.00 C ATOM 73 CG LEU A 228 10.639 -3.970 -2.258 1.00 0.00 C ATOM 74 CD1 LEU A 228 10.267 -2.933 -3.319 1.00 0.00 C ATOM 75 CD2 LEU A 228 11.277 -3.279 -1.067 1.00 0.00 C ATOM 0 H LEU A 228 8.495 -6.161 -4.159 1.00 0.00 H new ATOM 0 HA LEU A 228 10.318 -6.758 -1.932 1.00 0.00 H new ATOM 0 HB2 LEU A 228 8.507 -4.329 -2.125 1.00 0.00 H new ATOM 0 HB3 LEU A 228 9.400 -4.824 -0.700 1.00 0.00 H new ATOM 0 HG LEU A 228 11.348 -4.659 -2.717 1.00 0.00 H new ATOM 0 HD11 LEU A 228 11.156 -2.372 -3.607 1.00 0.00 H new ATOM 0 HD12 LEU A 228 9.858 -3.438 -4.194 1.00 0.00 H new ATOM 0 HD13 LEU A 228 9.522 -2.249 -2.914 1.00 0.00 H new ATOM 0 HD21 LEU A 228 12.128 -2.687 -1.403 1.00 0.00 H new ATOM 0 HD22 LEU A 228 10.546 -2.625 -0.591 1.00 0.00 H new ATOM 0 HD23 LEU A 228 11.615 -4.027 -0.350 1.00 0.00 H new ATOM 87 N THR A 229 8.053 -6.983 -0.429 1.00 0.00 N ATOM 88 CA THR A 229 6.980 -7.696 0.237 1.00 0.00 C ATOM 89 C THR A 229 6.486 -6.892 1.441 1.00 0.00 C ATOM 90 O THR A 229 7.208 -6.051 1.969 1.00 0.00 O ATOM 91 CB THR A 229 7.491 -9.077 0.690 1.00 0.00 C ATOM 92 OG1 THR A 229 7.923 -9.829 -0.453 1.00 0.00 O ATOM 93 CG2 THR A 229 6.430 -9.870 1.448 1.00 0.00 C ATOM 0 H THR A 229 8.674 -6.478 0.203 1.00 0.00 H new ATOM 0 HA THR A 229 6.148 -7.830 -0.454 1.00 0.00 H new ATOM 0 HB THR A 229 8.324 -8.908 1.372 1.00 0.00 H new ATOM 0 HG1 THR A 229 8.249 -10.706 -0.163 1.00 0.00 H new ATOM 0 HG21 THR A 229 6.840 -10.835 1.745 1.00 0.00 H new ATOM 0 HG22 THR A 229 6.127 -9.316 2.336 1.00 0.00 H new ATOM 0 HG23 THR A 229 5.564 -10.026 0.805 1.00 0.00 H new ATOM 101 N VAL A 230 5.253 -7.127 1.852 1.00 0.00 N ATOM 102 CA VAL A 230 4.697 -6.467 3.022 1.00 0.00 C ATOM 103 C VAL A 230 4.572 -7.462 4.169 1.00 0.00 C ATOM 104 O VAL A 230 3.915 -8.493 4.031 1.00 0.00 O ATOM 105 CB VAL A 230 3.317 -5.850 2.718 1.00 0.00 C ATOM 106 CG1 VAL A 230 2.745 -5.171 3.953 1.00 0.00 C ATOM 107 CG2 VAL A 230 3.422 -4.850 1.575 1.00 0.00 C ATOM 0 H VAL A 230 4.613 -7.774 1.390 1.00 0.00 H new ATOM 0 HA VAL A 230 5.374 -5.662 3.306 1.00 0.00 H new ATOM 0 HB VAL A 230 2.644 -6.655 2.422 1.00 0.00 H new ATOM 0 HG11 VAL A 230 1.771 -4.743 3.715 1.00 0.00 H new ATOM 0 HG12 VAL A 230 2.634 -5.904 4.752 1.00 0.00 H new ATOM 0 HG13 VAL A 230 3.420 -4.379 4.278 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.439 -4.424 1.373 1.00 0.00 H new ATOM 0 HG22 VAL A 230 4.113 -4.054 1.851 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.789 -5.356 0.682 1.00 0.00 H new ATOM 117 N LYS A 231 5.201 -7.157 5.301 1.00 0.00 N ATOM 118 CA LYS A 231 5.221 -8.092 6.425 1.00 0.00 C ATOM 119 C LYS A 231 4.291 -7.618 7.538 1.00 0.00 C ATOM 120 O LYS A 231 4.065 -8.323 8.521 1.00 0.00 O ATOM 121 CB LYS A 231 6.644 -8.256 6.970 1.00 0.00 C ATOM 122 CG LYS A 231 7.001 -9.695 7.300 1.00 0.00 C ATOM 123 CD LYS A 231 7.108 -10.539 6.039 1.00 0.00 C ATOM 124 CE LYS A 231 7.414 -11.992 6.354 1.00 0.00 C ATOM 125 NZ LYS A 231 8.650 -12.139 7.166 1.00 0.00 N1+ ATOM 0 H LYS A 231 5.698 -6.282 5.465 1.00 0.00 H new ATOM 0 HA LYS A 231 4.871 -9.058 6.062 1.00 0.00 H new ATOM 0 HB2 LYS A 231 7.353 -7.873 6.236 1.00 0.00 H new ATOM 0 HB3 LYS A 231 6.754 -7.647 7.867 1.00 0.00 H new ATOM 0 HG2 LYS A 231 7.947 -9.723 7.841 1.00 0.00 H new ATOM 0 HG3 LYS A 231 6.244 -10.118 7.960 1.00 0.00 H new ATOM 0 HD2 LYS A 231 6.174 -10.478 5.481 1.00 0.00 H new ATOM 0 HD3 LYS A 231 7.890 -10.134 5.397 1.00 0.00 H new ATOM 0 HE2 LYS A 231 6.573 -12.431 6.891 1.00 0.00 H new ATOM 0 HE3 LYS A 231 7.523 -12.549 5.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 8.925 -13.141 7.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 9.417 -11.585 6.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 8.474 -11.794 8.131 1.00 0.00 H new ATOM 139 N THR A 232 3.748 -6.426 7.367 1.00 0.00 N ATOM 140 CA THR A 232 2.854 -5.835 8.348 1.00 0.00 C ATOM 141 C THR A 232 1.590 -5.337 7.658 1.00 0.00 C ATOM 142 O THR A 232 1.346 -5.664 6.503 1.00 0.00 O ATOM 143 CB THR A 232 3.535 -4.677 9.092 1.00 0.00 C ATOM 144 OG1 THR A 232 4.178 -3.817 8.152 1.00 0.00 O ATOM 145 CG2 THR A 232 4.550 -5.196 10.101 1.00 0.00 C ATOM 0 H THR A 232 3.913 -5.842 6.547 1.00 0.00 H new ATOM 0 HA THR A 232 2.594 -6.601 9.079 1.00 0.00 H new ATOM 0 HB THR A 232 2.772 -4.120 9.636 1.00 0.00 H new ATOM 0 HG1 THR A 232 4.983 -4.256 7.804 1.00 0.00 H new ATOM 0 HG21 THR A 232 5.017 -4.355 10.613 1.00 0.00 H new ATOM 0 HG22 THR A 232 4.046 -5.831 10.830 1.00 0.00 H new ATOM 0 HG23 THR A 232 5.315 -5.775 9.583 1.00 0.00 H new ATOM 153 N GLN A 233 0.783 -4.566 8.363 1.00 0.00 N ATOM 154 CA GLN A 233 -0.492 -4.125 7.827 1.00 0.00 C ATOM 155 C GLN A 233 -0.479 -2.616 7.621 1.00 0.00 C ATOM 156 O GLN A 233 -0.383 -1.852 8.584 1.00 0.00 O ATOM 157 CB GLN A 233 -1.638 -4.535 8.757 1.00 0.00 C ATOM 158 CG GLN A 233 -1.550 -5.979 9.240 1.00 0.00 C ATOM 159 CD GLN A 233 -2.875 -6.522 9.731 1.00 0.00 C ATOM 160 OE1 GLN A 233 -3.124 -7.724 9.665 1.00 0.00 O ATOM 161 NE2 GLN A 233 -3.743 -5.644 10.209 1.00 0.00 N ATOM 0 H GLN A 233 0.986 -4.233 9.305 1.00 0.00 H new ATOM 0 HA GLN A 233 -0.651 -4.606 6.862 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.647 -3.872 9.622 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.585 -4.393 8.236 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -1.186 -6.607 8.427 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -0.817 -6.043 10.044 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -3.499 -4.654 10.247 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -4.656 -5.957 10.539 1.00 0.00 H new ATOM 170 N PRO A 234 -0.545 -2.173 6.358 1.00 0.00 N ATOM 171 CA PRO A 234 -0.534 -0.751 6.013 1.00 0.00 C ATOM 172 C PRO A 234 -1.731 -0.002 6.588 1.00 0.00 C ATOM 173 O PRO A 234 -2.858 -0.156 6.120 1.00 0.00 O ATOM 174 CB PRO A 234 -0.582 -0.740 4.479 1.00 0.00 C ATOM 175 CG PRO A 234 -1.063 -2.091 4.080 1.00 0.00 C ATOM 176 CD PRO A 234 -0.623 -3.031 5.164 1.00 0.00 C ATOM 0 HA PRO A 234 0.341 -0.248 6.424 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -1.253 0.038 4.114 1.00 0.00 H new ATOM 0 HB3 PRO A 234 0.402 -0.535 4.058 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -2.148 -2.102 3.973 1.00 0.00 H new ATOM 0 HG3 PRO A 234 -0.644 -2.384 3.117 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -1.335 -3.845 5.301 1.00 0.00 H new ATOM 0 HD3 PRO A 234 0.341 -3.485 4.934 1.00 0.00 H new ATOM 184 N THR A 235 -1.486 0.805 7.609 1.00 0.00 N ATOM 185 CA THR A 235 -2.555 1.574 8.226 1.00 0.00 C ATOM 186 C THR A 235 -2.057 2.904 8.799 1.00 0.00 C ATOM 187 O THR A 235 -1.168 2.946 9.651 1.00 0.00 O ATOM 188 CB THR A 235 -3.282 0.755 9.322 1.00 0.00 C ATOM 189 OG1 THR A 235 -4.306 1.549 9.939 1.00 0.00 O ATOM 190 CG2 THR A 235 -2.312 0.256 10.390 1.00 0.00 C ATOM 0 H THR A 235 -0.565 0.944 8.025 1.00 0.00 H new ATOM 0 HA THR A 235 -3.268 1.802 7.433 1.00 0.00 H new ATOM 0 HB THR A 235 -3.731 -0.112 8.837 1.00 0.00 H new ATOM 0 HG1 THR A 235 -4.759 1.020 10.628 1.00 0.00 H new ATOM 0 HG21 THR A 235 -2.859 -0.314 11.141 1.00 0.00 H new ATOM 0 HG22 THR A 235 -1.559 -0.382 9.928 1.00 0.00 H new ATOM 0 HG23 THR A 235 -1.824 1.107 10.865 1.00 0.00 H new ATOM 198 N VAL A 236 -2.605 3.980 8.253 1.00 0.00 N ATOM 199 CA VAL A 236 -2.418 5.336 8.755 1.00 0.00 C ATOM 200 C VAL A 236 -3.613 6.184 8.299 1.00 0.00 C ATOM 201 O VAL A 236 -4.478 5.646 7.608 1.00 0.00 O ATOM 202 CB VAL A 236 -1.015 5.922 8.369 1.00 0.00 C ATOM 203 CG1 VAL A 236 -1.055 7.354 7.861 1.00 0.00 C ATOM 204 CG2 VAL A 236 -0.109 5.870 9.584 1.00 0.00 C ATOM 0 H VAL A 236 -3.206 3.935 7.430 1.00 0.00 H new ATOM 0 HA VAL A 236 -2.403 5.341 9.845 1.00 0.00 H new ATOM 0 HB VAL A 236 -0.643 5.308 7.549 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -0.045 7.682 7.617 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -1.679 7.406 6.969 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -1.470 8.002 8.633 1.00 0.00 H new ATOM 0 HG21 VAL A 236 0.869 6.275 9.326 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -0.546 6.461 10.389 1.00 0.00 H new ATOM 0 HG23 VAL A 236 0.001 4.836 9.911 1.00 0.00 H new ATOM 214 N THR A 237 -3.689 7.443 8.749 1.00 0.00 N ATOM 215 CA THR A 237 -4.790 8.367 8.457 1.00 0.00 C ATOM 216 C THR A 237 -5.561 8.015 7.184 1.00 0.00 C ATOM 217 O THR A 237 -5.112 8.295 6.068 1.00 0.00 O ATOM 218 CB THR A 237 -4.242 9.801 8.312 1.00 0.00 C ATOM 219 OG1 THR A 237 -3.473 10.157 9.469 1.00 0.00 O ATOM 220 CG2 THR A 237 -5.369 10.808 8.118 1.00 0.00 C ATOM 0 H THR A 237 -2.968 7.856 9.341 1.00 0.00 H new ATOM 0 HA THR A 237 -5.483 8.287 9.294 1.00 0.00 H new ATOM 0 HB THR A 237 -3.604 9.825 7.429 1.00 0.00 H new ATOM 0 HG1 THR A 237 -3.129 11.069 9.365 1.00 0.00 H new ATOM 0 HG21 THR A 237 -4.949 11.809 8.019 1.00 0.00 H new ATOM 0 HG22 THR A 237 -5.929 10.558 7.217 1.00 0.00 H new ATOM 0 HG23 THR A 237 -6.036 10.778 8.979 1.00 0.00 H new ATOM 228 N TYR A 238 -6.708 7.377 7.364 1.00 0.00 N ATOM 229 CA TYR A 238 -7.598 7.094 6.258 1.00 0.00 C ATOM 230 C TYR A 238 -8.873 7.898 6.419 1.00 0.00 C ATOM 231 O TYR A 238 -9.879 7.409 6.938 1.00 0.00 O ATOM 232 CB TYR A 238 -7.924 5.590 6.167 1.00 0.00 C ATOM 233 CG TYR A 238 -7.383 4.939 4.923 1.00 0.00 C ATOM 234 CD1 TYR A 238 -8.239 4.485 3.933 1.00 0.00 C ATOM 235 CD2 TYR A 238 -6.018 4.789 4.733 1.00 0.00 C ATOM 236 CE1 TYR A 238 -7.751 3.900 2.785 1.00 0.00 C ATOM 237 CE2 TYR A 238 -5.520 4.202 3.590 1.00 0.00 C ATOM 238 CZ TYR A 238 -6.390 3.759 2.616 1.00 0.00 C ATOM 239 OH TYR A 238 -5.898 3.178 1.469 1.00 0.00 O ATOM 0 H TYR A 238 -7.041 7.046 8.270 1.00 0.00 H new ATOM 0 HA TYR A 238 -7.098 7.379 5.332 1.00 0.00 H new ATOM 0 HB2 TYR A 238 -7.516 5.083 7.041 1.00 0.00 H new ATOM 0 HB3 TYR A 238 -9.005 5.457 6.198 1.00 0.00 H new ATOM 0 HD1 TYR A 238 -9.306 4.591 4.063 1.00 0.00 H new ATOM 0 HD2 TYR A 238 -5.334 5.138 5.493 1.00 0.00 H new ATOM 0 HE1 TYR A 238 -8.431 3.554 2.021 1.00 0.00 H new ATOM 0 HE2 TYR A 238 -4.454 4.089 3.458 1.00 0.00 H new ATOM 0 HH TYR A 238 -4.919 3.156 1.507 1.00 0.00 H new ATOM 249 N ASN A 239 -8.820 9.137 5.981 1.00 0.00 N ATOM 250 CA ASN A 239 -9.947 10.034 6.100 1.00 0.00 C ATOM 251 C ASN A 239 -10.542 10.266 4.723 1.00 0.00 C ATOM 252 O ASN A 239 -9.833 10.582 3.773 1.00 0.00 O ATOM 253 CB ASN A 239 -9.506 11.349 6.745 1.00 0.00 C ATOM 254 CG ASN A 239 -10.670 12.195 7.222 1.00 0.00 C ATOM 255 OD1 ASN A 239 -11.730 12.241 6.597 1.00 0.00 O ATOM 256 ND2 ASN A 239 -10.480 12.863 8.348 1.00 0.00 N ATOM 0 H ASN A 239 -8.000 9.548 5.535 1.00 0.00 H new ATOM 0 HA ASN A 239 -10.710 9.592 6.741 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -8.852 11.132 7.590 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -8.919 11.921 6.026 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -11.227 13.443 8.729 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -9.586 12.798 8.835 1.00 0.00 H new ATOM 263 N ALA A 240 -11.838 10.104 4.624 1.00 0.00 N ATOM 264 CA ALA A 240 -12.513 10.093 3.340 1.00 0.00 C ATOM 265 C ALA A 240 -13.218 11.411 3.065 1.00 0.00 C ATOM 266 O ALA A 240 -13.174 11.921 1.948 1.00 0.00 O ATOM 267 CB ALA A 240 -13.494 8.941 3.287 1.00 0.00 C ATOM 0 H ALA A 240 -12.457 9.976 5.425 1.00 0.00 H new ATOM 0 HA ALA A 240 -11.761 9.961 2.562 1.00 0.00 H new ATOM 0 HB1 ALA A 240 -13.999 8.937 2.321 1.00 0.00 H new ATOM 0 HB2 ALA A 240 -12.959 8.001 3.421 1.00 0.00 H new ATOM 0 HB3 ALA A 240 -14.232 9.055 4.081 1.00 0.00 H new ATOM 273 N VAL A 241 -13.861 11.965 4.084 1.00 0.00 N ATOM 274 CA VAL A 241 -14.538 13.250 3.945 1.00 0.00 C ATOM 275 C VAL A 241 -13.516 14.351 3.690 1.00 0.00 C ATOM 276 O VAL A 241 -13.771 15.306 2.957 1.00 0.00 O ATOM 277 CB VAL A 241 -15.364 13.594 5.209 1.00 0.00 C ATOM 278 CG1 VAL A 241 -16.090 14.924 5.052 1.00 0.00 C ATOM 279 CG2 VAL A 241 -16.354 12.480 5.526 1.00 0.00 C ATOM 0 H VAL A 241 -13.929 11.548 5.012 1.00 0.00 H new ATOM 0 HA VAL A 241 -15.222 13.177 3.099 1.00 0.00 H new ATOM 0 HB VAL A 241 -14.669 13.688 6.043 1.00 0.00 H new ATOM 0 HG11 VAL A 241 -16.660 15.136 5.956 1.00 0.00 H new ATOM 0 HG12 VAL A 241 -15.362 15.719 4.887 1.00 0.00 H new ATOM 0 HG13 VAL A 241 -16.768 14.870 4.200 1.00 0.00 H new ATOM 0 HG21 VAL A 241 -16.924 12.742 6.417 1.00 0.00 H new ATOM 0 HG22 VAL A 241 -17.035 12.349 4.685 1.00 0.00 H new ATOM 0 HG23 VAL A 241 -15.812 11.551 5.702 1.00 0.00 H new ATOM 289 N LYS A 242 -12.346 14.193 4.289 1.00 0.00 N ATOM 290 CA LYS A 242 -11.262 15.149 4.120 1.00 0.00 C ATOM 291 C LYS A 242 -10.410 14.779 2.920 1.00 0.00 C ATOM 292 O LYS A 242 -9.558 15.548 2.473 1.00 0.00 O ATOM 293 CB LYS A 242 -10.401 15.171 5.373 1.00 0.00 C ATOM 294 CG LYS A 242 -11.183 15.444 6.645 1.00 0.00 C ATOM 295 CD LYS A 242 -11.346 16.929 6.899 1.00 0.00 C ATOM 296 CE LYS A 242 -12.534 17.520 6.155 1.00 0.00 C ATOM 297 NZ LYS A 242 -12.744 18.950 6.498 1.00 0.00 N1+ ATOM 0 H LYS A 242 -12.122 13.407 4.900 1.00 0.00 H new ATOM 0 HA LYS A 242 -11.689 16.138 3.953 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -9.890 14.213 5.469 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -9.630 15.933 5.260 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -12.166 14.978 6.574 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -10.672 14.985 7.491 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -11.469 17.100 7.968 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -10.437 17.448 6.596 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -12.375 17.423 5.081 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -13.433 16.953 6.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -13.562 19.317 5.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -12.921 19.040 7.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -11.896 19.496 6.244 1.00 0.00 H new ATOM 311 N ASP A 243 -10.663 13.577 2.429 1.00 0.00 N ATOM 312 CA ASP A 243 -9.944 13.004 1.290 1.00 0.00 C ATOM 313 C ASP A 243 -8.450 12.943 1.585 1.00 0.00 C ATOM 314 O ASP A 243 -7.651 13.681 1.016 1.00 0.00 O ATOM 315 CB ASP A 243 -10.213 13.800 0.009 1.00 0.00 C ATOM 316 CG ASP A 243 -9.624 13.136 -1.220 1.00 0.00 C ATOM 317 OD1 ASP A 243 -10.215 12.150 -1.709 1.00 0.00 O ATOM 318 OD2 ASP A 243 -8.574 13.601 -1.712 1.00 0.00 O1- ATOM 0 H ASP A 243 -11.380 12.960 2.810 1.00 0.00 H new ATOM 0 HA ASP A 243 -10.309 11.989 1.132 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -11.289 13.915 -0.124 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -9.795 14.801 0.113 1.00 0.00 H new ATOM 323 N SER A 244 -8.086 12.073 2.508 1.00 0.00 N ATOM 324 CA SER A 244 -6.705 11.944 2.938 1.00 0.00 C ATOM 325 C SER A 244 -6.402 10.497 3.303 1.00 0.00 C ATOM 326 O SER A 244 -6.816 10.017 4.358 1.00 0.00 O ATOM 327 CB SER A 244 -6.444 12.850 4.142 1.00 0.00 C ATOM 328 OG SER A 244 -6.845 14.184 3.874 1.00 0.00 O ATOM 0 H SER A 244 -8.733 11.440 2.978 1.00 0.00 H new ATOM 0 HA SER A 244 -6.053 12.246 2.118 1.00 0.00 H new ATOM 0 HB2 SER A 244 -6.985 12.472 5.010 1.00 0.00 H new ATOM 0 HB3 SER A 244 -5.384 12.829 4.393 1.00 0.00 H new ATOM 0 HG SER A 244 -6.669 14.743 4.660 1.00 0.00 H new ATOM 334 N TYR A 245 -5.682 9.808 2.432 1.00 0.00 N ATOM 335 CA TYR A 245 -5.387 8.400 2.639 1.00 0.00 C ATOM 336 C TYR A 245 -3.883 8.156 2.632 1.00 0.00 C ATOM 337 O TYR A 245 -3.241 8.218 1.580 1.00 0.00 O ATOM 338 CB TYR A 245 -6.036 7.543 1.546 1.00 0.00 C ATOM 339 CG TYR A 245 -7.523 7.768 1.358 1.00 0.00 C ATOM 340 CD1 TYR A 245 -8.423 7.466 2.366 1.00 0.00 C ATOM 341 CD2 TYR A 245 -8.028 8.259 0.160 1.00 0.00 C ATOM 342 CE1 TYR A 245 -9.773 7.643 2.202 1.00 0.00 C ATOM 343 CE2 TYR A 245 -9.383 8.446 -0.017 1.00 0.00 C ATOM 344 CZ TYR A 245 -10.254 8.136 1.005 1.00 0.00 C ATOM 345 OH TYR A 245 -11.605 8.313 0.822 1.00 0.00 O ATOM 0 H TYR A 245 -5.291 10.201 1.576 1.00 0.00 H new ATOM 0 HA TYR A 245 -5.794 8.118 3.610 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -5.531 7.742 0.601 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -5.869 6.492 1.782 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -8.053 7.081 3.305 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -7.349 8.498 -0.645 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -10.455 7.399 3.003 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -9.760 8.834 -0.952 1.00 0.00 H new ATOM 0 HH TYR A 245 -11.770 8.669 -0.076 1.00 0.00 H new ATOM 355 N GLN A 246 -3.314 7.908 3.802 1.00 0.00 N ATOM 356 CA GLN A 246 -1.927 7.484 3.888 1.00 0.00 C ATOM 357 C GLN A 246 -1.878 6.170 4.645 1.00 0.00 C ATOM 358 O GLN A 246 -2.833 5.821 5.333 1.00 0.00 O ATOM 359 CB GLN A 246 -1.048 8.518 4.610 1.00 0.00 C ATOM 360 CG GLN A 246 -1.125 9.939 4.069 1.00 0.00 C ATOM 361 CD GLN A 246 -2.100 10.805 4.842 1.00 0.00 C ATOM 362 OE1 GLN A 246 -1.746 11.394 5.865 1.00 0.00 O ATOM 363 NE2 GLN A 246 -3.318 10.920 4.348 1.00 0.00 N ATOM 0 H GLN A 246 -3.789 7.993 4.700 1.00 0.00 H new ATOM 0 HA GLN A 246 -1.537 7.374 2.876 1.00 0.00 H new ATOM 0 HB2 GLN A 246 -1.328 8.534 5.663 1.00 0.00 H new ATOM 0 HB3 GLN A 246 -0.011 8.185 4.560 1.00 0.00 H new ATOM 0 HG2 GLN A 246 -0.134 10.392 4.106 1.00 0.00 H new ATOM 0 HG3 GLN A 246 -1.423 9.909 3.021 1.00 0.00 H new ATOM 0 HE21 GLN A 246 -3.574 10.416 3.499 1.00 0.00 H new ATOM 0 HE22 GLN A 246 -4.004 11.513 4.815 1.00 0.00 H new ATOM 372 N PHE A 247 -0.790 5.433 4.526 1.00 0.00 N ATOM 373 CA PHE A 247 -0.637 4.224 5.311 1.00 0.00 C ATOM 374 C PHE A 247 0.828 3.944 5.635 1.00 0.00 C ATOM 375 O PHE A 247 1.691 4.050 4.771 1.00 0.00 O ATOM 376 CB PHE A 247 -1.291 3.018 4.631 1.00 0.00 C ATOM 377 CG PHE A 247 -0.875 2.765 3.209 1.00 0.00 C ATOM 378 CD1 PHE A 247 0.270 2.042 2.925 1.00 0.00 C ATOM 379 CD2 PHE A 247 -1.656 3.211 2.156 1.00 0.00 C ATOM 380 CE1 PHE A 247 0.629 1.769 1.625 1.00 0.00 C ATOM 381 CE2 PHE A 247 -1.293 2.947 0.851 1.00 0.00 C ATOM 382 CZ PHE A 247 -0.149 2.223 0.588 1.00 0.00 C ATOM 0 H PHE A 247 -0.010 5.646 3.903 1.00 0.00 H new ATOM 0 HA PHE A 247 -1.158 4.391 6.254 1.00 0.00 H new ATOM 0 HB2 PHE A 247 -1.068 2.128 5.219 1.00 0.00 H new ATOM 0 HB3 PHE A 247 -2.372 3.153 4.655 1.00 0.00 H new ATOM 0 HD1 PHE A 247 0.890 1.687 3.735 1.00 0.00 H new ATOM 0 HD2 PHE A 247 -2.557 3.771 2.358 1.00 0.00 H new ATOM 0 HE1 PHE A 247 1.522 1.198 1.420 1.00 0.00 H new ATOM 0 HE2 PHE A 247 -1.904 3.307 0.037 1.00 0.00 H new ATOM 0 HZ PHE A 247 0.135 2.013 -0.433 1.00 0.00 H new ATOM 392 N THR A 248 1.110 3.595 6.885 1.00 0.00 N ATOM 393 CA THR A 248 2.465 3.283 7.304 1.00 0.00 C ATOM 394 C THR A 248 2.644 1.782 7.318 1.00 0.00 C ATOM 395 O THR A 248 1.746 1.053 7.753 1.00 0.00 O ATOM 396 CB THR A 248 2.751 3.833 8.723 1.00 0.00 C ATOM 397 OG1 THR A 248 2.737 5.262 8.711 1.00 0.00 O ATOM 398 CG2 THR A 248 4.088 3.338 9.264 1.00 0.00 C ATOM 0 H THR A 248 0.413 3.522 7.626 1.00 0.00 H new ATOM 0 HA THR A 248 3.158 3.748 6.603 1.00 0.00 H new ATOM 0 HB THR A 248 1.964 3.464 9.380 1.00 0.00 H new ATOM 0 HG1 THR A 248 2.918 5.599 9.614 1.00 0.00 H new ATOM 0 HG21 THR A 248 4.251 3.747 10.261 1.00 0.00 H new ATOM 0 HG22 THR A 248 4.079 2.249 9.315 1.00 0.00 H new ATOM 0 HG23 THR A 248 4.891 3.664 8.603 1.00 0.00 H new ATOM 406 N VAL A 249 3.778 1.312 6.826 1.00 0.00 N ATOM 407 CA VAL A 249 4.012 -0.126 6.785 1.00 0.00 C ATOM 408 C VAL A 249 5.466 -0.475 7.095 1.00 0.00 C ATOM 409 O VAL A 249 6.382 0.294 6.806 1.00 0.00 O ATOM 410 CB VAL A 249 3.664 -0.743 5.409 1.00 0.00 C ATOM 411 CG1 VAL A 249 3.005 -2.100 5.579 1.00 0.00 C ATOM 412 CG2 VAL A 249 2.790 0.179 4.578 1.00 0.00 C ATOM 0 H VAL A 249 4.536 1.887 6.457 1.00 0.00 H new ATOM 0 HA VAL A 249 3.355 -0.543 7.548 1.00 0.00 H new ATOM 0 HB VAL A 249 4.601 -0.877 4.868 1.00 0.00 H new ATOM 0 HG11 VAL A 249 2.769 -2.515 4.599 1.00 0.00 H new ATOM 0 HG12 VAL A 249 3.685 -2.771 6.103 1.00 0.00 H new ATOM 0 HG13 VAL A 249 2.087 -1.989 6.157 1.00 0.00 H new ATOM 0 HG21 VAL A 249 2.570 -0.293 3.621 1.00 0.00 H new ATOM 0 HG22 VAL A 249 1.858 0.374 5.109 1.00 0.00 H new ATOM 0 HG23 VAL A 249 3.313 1.120 4.407 1.00 0.00 H new ATOM 422 N THR A 250 5.658 -1.634 7.702 1.00 0.00 N ATOM 423 CA THR A 250 6.963 -2.251 7.815 1.00 0.00 C ATOM 424 C THR A 250 7.077 -3.323 6.731 1.00 0.00 C ATOM 425 O THR A 250 6.425 -4.372 6.811 1.00 0.00 O ATOM 426 CB THR A 250 7.137 -2.887 9.208 1.00 0.00 C ATOM 427 OG1 THR A 250 6.882 -1.902 10.217 1.00 0.00 O ATOM 428 CG2 THR A 250 8.534 -3.459 9.391 1.00 0.00 C ATOM 0 H THR A 250 4.907 -2.174 8.132 1.00 0.00 H new ATOM 0 HA THR A 250 7.743 -1.500 7.687 1.00 0.00 H new ATOM 0 HB THR A 250 6.425 -3.708 9.298 1.00 0.00 H new ATOM 0 HG1 THR A 250 6.991 -2.306 11.103 1.00 0.00 H new ATOM 0 HG21 THR A 250 8.620 -3.899 10.385 1.00 0.00 H new ATOM 0 HG22 THR A 250 8.715 -4.226 8.638 1.00 0.00 H new ATOM 0 HG23 THR A 250 9.270 -2.663 9.282 1.00 0.00 H new ATOM 436 N LEU A 251 7.876 -3.063 5.710 1.00 0.00 N ATOM 437 CA LEU A 251 7.895 -3.922 4.545 1.00 0.00 C ATOM 438 C LEU A 251 9.125 -4.812 4.591 1.00 0.00 C ATOM 439 O LEU A 251 10.017 -4.618 5.416 1.00 0.00 O ATOM 440 CB LEU A 251 7.878 -3.090 3.241 1.00 0.00 C ATOM 441 CG LEU A 251 6.660 -2.181 3.016 1.00 0.00 C ATOM 442 CD1 LEU A 251 6.790 -0.873 3.786 1.00 0.00 C ATOM 443 CD2 LEU A 251 6.491 -1.895 1.536 1.00 0.00 C ATOM 0 H LEU A 251 8.515 -2.269 5.666 1.00 0.00 H new ATOM 0 HA LEU A 251 7.000 -4.543 4.554 1.00 0.00 H new ATOM 0 HB2 LEU A 251 8.774 -2.469 3.222 1.00 0.00 H new ATOM 0 HB3 LEU A 251 7.949 -3.778 2.398 1.00 0.00 H new ATOM 0 HG LEU A 251 5.779 -2.704 3.388 1.00 0.00 H new ATOM 0 HD11 LEU A 251 5.911 -0.255 3.604 1.00 0.00 H new ATOM 0 HD12 LEU A 251 6.870 -1.085 4.852 1.00 0.00 H new ATOM 0 HD13 LEU A 251 7.682 -0.342 3.454 1.00 0.00 H new ATOM 0 HD21 LEU A 251 5.625 -1.250 1.387 1.00 0.00 H new ATOM 0 HD22 LEU A 251 7.384 -1.397 1.157 1.00 0.00 H new ATOM 0 HD23 LEU A 251 6.342 -2.832 0.999 1.00 0.00 H new ATOM 455 N THR A 252 9.152 -5.807 3.736 1.00 0.00 N ATOM 456 CA THR A 252 10.296 -6.678 3.612 1.00 0.00 C ATOM 457 C THR A 252 10.937 -6.499 2.235 1.00 0.00 C ATOM 458 O THR A 252 10.236 -6.281 1.243 1.00 0.00 O ATOM 459 CB THR A 252 9.874 -8.137 3.814 1.00 0.00 C ATOM 460 OG1 THR A 252 8.439 -8.217 3.861 1.00 0.00 O ATOM 461 CG2 THR A 252 10.463 -8.711 5.100 1.00 0.00 C ATOM 0 H THR A 252 8.382 -6.035 3.107 1.00 0.00 H new ATOM 0 HA THR A 252 11.025 -6.418 4.379 1.00 0.00 H new ATOM 0 HB THR A 252 10.253 -8.723 2.977 1.00 0.00 H new ATOM 0 HG1 THR A 252 8.149 -9.093 3.530 1.00 0.00 H new ATOM 0 HG21 THR A 252 10.145 -9.747 5.215 1.00 0.00 H new ATOM 0 HG22 THR A 252 11.551 -8.668 5.053 1.00 0.00 H new ATOM 0 HG23 THR A 252 10.114 -8.128 5.952 1.00 0.00 H new ATOM 469 N GLY A 253 12.257 -6.585 2.175 1.00 0.00 N ATOM 470 CA GLY A 253 12.968 -6.286 0.952 1.00 0.00 C ATOM 471 C GLY A 253 14.154 -7.199 0.738 1.00 0.00 C ATOM 472 O GLY A 253 14.095 -8.389 1.047 1.00 0.00 O ATOM 0 H GLY A 253 12.851 -6.859 2.958 1.00 0.00 H new ATOM 0 HA2 GLY A 253 12.286 -6.377 0.107 1.00 0.00 H new ATOM 0 HA3 GLY A 253 13.309 -5.251 0.977 1.00 0.00 H new ATOM 476 N ALA A 254 15.231 -6.643 0.208 1.00 0.00 N ATOM 477 CA ALA A 254 16.412 -7.423 -0.122 1.00 0.00 C ATOM 478 C ALA A 254 17.598 -7.045 0.755 1.00 0.00 C ATOM 479 O ALA A 254 17.460 -6.255 1.689 1.00 0.00 O ATOM 480 CB ALA A 254 16.756 -7.271 -1.598 1.00 0.00 C ATOM 0 H ALA A 254 15.311 -5.648 -0.004 1.00 0.00 H new ATOM 0 HA ALA A 254 16.185 -8.471 0.075 1.00 0.00 H new ATOM 0 HB1 ALA A 254 17.643 -7.862 -1.828 1.00 0.00 H new ATOM 0 HB2 ALA A 254 15.920 -7.620 -2.204 1.00 0.00 H new ATOM 0 HB3 ALA A 254 16.951 -6.222 -1.820 1.00 0.00 H new ATOM 486 N THR A 255 18.755 -7.613 0.438 1.00 0.00 N ATOM 487 CA THR A 255 19.943 -7.501 1.271 1.00 0.00 C ATOM 488 C THR A 255 20.543 -6.082 1.241 1.00 0.00 C ATOM 489 O THR A 255 20.091 -5.217 0.485 1.00 0.00 O ATOM 490 CB THR A 255 20.992 -8.541 0.807 1.00 0.00 C ATOM 491 OG1 THR A 255 20.310 -9.737 0.404 1.00 0.00 O ATOM 492 CG2 THR A 255 21.985 -8.902 1.922 1.00 0.00 C ATOM 0 H THR A 255 18.895 -8.166 -0.408 1.00 0.00 H new ATOM 0 HA THR A 255 19.653 -7.700 2.303 1.00 0.00 H new ATOM 0 HB THR A 255 21.553 -8.101 -0.018 1.00 0.00 H new ATOM 0 HG1 THR A 255 20.965 -10.403 0.106 1.00 0.00 H new ATOM 0 HG21 THR A 255 22.701 -9.634 1.549 1.00 0.00 H new ATOM 0 HG22 THR A 255 22.516 -8.005 2.241 1.00 0.00 H new ATOM 0 HG23 THR A 255 21.444 -9.323 2.769 1.00 0.00 H new ATOM 500 N ALA A 256 21.559 -5.865 2.074 1.00 0.00 N ATOM 501 CA ALA A 256 22.213 -4.568 2.227 1.00 0.00 C ATOM 502 C ALA A 256 22.887 -4.083 0.934 1.00 0.00 C ATOM 503 O ALA A 256 22.805 -4.742 -0.106 1.00 0.00 O ATOM 504 CB ALA A 256 23.221 -4.649 3.366 1.00 0.00 C ATOM 0 H ALA A 256 21.955 -6.593 2.668 1.00 0.00 H new ATOM 0 HA ALA A 256 21.444 -3.831 2.461 1.00 0.00 H new ATOM 0 HB1 ALA A 256 23.713 -3.684 3.486 1.00 0.00 H new ATOM 0 HB2 ALA A 256 22.706 -4.911 4.290 1.00 0.00 H new ATOM 0 HB3 ALA A 256 23.967 -5.411 3.138 1.00 0.00 H new ATOM 510 N SER A 257 23.550 -2.920 1.030 1.00 0.00 N ATOM 511 CA SER A 257 24.204 -2.248 -0.099 1.00 0.00 C ATOM 512 C SER A 257 23.193 -1.462 -0.934 1.00 0.00 C ATOM 513 O SER A 257 23.505 -0.989 -2.027 1.00 0.00 O ATOM 514 CB SER A 257 24.992 -3.234 -0.973 1.00 0.00 C ATOM 515 OG SER A 257 25.755 -2.563 -1.966 1.00 0.00 O ATOM 0 H SER A 257 23.647 -2.413 1.910 1.00 0.00 H new ATOM 0 HA SER A 257 24.920 -1.541 0.319 1.00 0.00 H new ATOM 0 HB2 SER A 257 25.655 -3.828 -0.344 1.00 0.00 H new ATOM 0 HB3 SER A 257 24.301 -3.928 -1.452 1.00 0.00 H new ATOM 0 HG SER A 257 25.218 -1.845 -2.362 1.00 0.00 H new ATOM 521 N VAL A 258 21.983 -1.318 -0.412 1.00 0.00 N ATOM 522 CA VAL A 258 21.007 -0.415 -0.995 1.00 0.00 C ATOM 523 C VAL A 258 20.543 0.567 0.074 1.00 0.00 C ATOM 524 O VAL A 258 19.639 0.263 0.868 1.00 0.00 O ATOM 525 CB VAL A 258 19.787 -1.160 -1.585 1.00 0.00 C ATOM 526 CG1 VAL A 258 18.851 -0.186 -2.288 1.00 0.00 C ATOM 527 CG2 VAL A 258 20.232 -2.258 -2.543 1.00 0.00 C ATOM 0 H VAL A 258 21.656 -1.817 0.415 1.00 0.00 H new ATOM 0 HA VAL A 258 21.488 0.110 -1.820 1.00 0.00 H new ATOM 0 HB VAL A 258 19.245 -1.625 -0.762 1.00 0.00 H new ATOM 0 HG11 VAL A 258 17.999 -0.730 -2.696 1.00 0.00 H new ATOM 0 HG12 VAL A 258 18.498 0.559 -1.574 1.00 0.00 H new ATOM 0 HG13 VAL A 258 19.385 0.312 -3.097 1.00 0.00 H new ATOM 0 HG21 VAL A 258 19.356 -2.767 -2.945 1.00 0.00 H new ATOM 0 HG22 VAL A 258 20.803 -1.818 -3.361 1.00 0.00 H new ATOM 0 HG23 VAL A 258 20.856 -2.975 -2.010 1.00 0.00 H new ATOM 537 N THR A 259 21.196 1.727 0.113 1.00 0.00 N ATOM 538 CA THR A 259 20.900 2.750 1.107 1.00 0.00 C ATOM 539 C THR A 259 19.516 3.336 0.873 1.00 0.00 C ATOM 540 O THR A 259 19.359 4.332 0.168 1.00 0.00 O ATOM 541 CB THR A 259 21.943 3.879 1.073 1.00 0.00 C ATOM 542 OG1 THR A 259 23.263 3.321 1.105 1.00 0.00 O ATOM 543 CG2 THR A 259 21.758 4.817 2.256 1.00 0.00 C ATOM 0 H THR A 259 21.939 1.980 -0.539 1.00 0.00 H new ATOM 0 HA THR A 259 20.932 2.274 2.087 1.00 0.00 H new ATOM 0 HB THR A 259 21.808 4.447 0.152 1.00 0.00 H new ATOM 0 HG1 THR A 259 23.924 4.044 1.081 1.00 0.00 H new ATOM 0 HG21 THR A 259 22.506 5.609 2.213 1.00 0.00 H new ATOM 0 HG22 THR A 259 20.761 5.257 2.219 1.00 0.00 H new ATOM 0 HG23 THR A 259 21.874 4.258 3.185 1.00 0.00 H new ATOM 551 N GLY A 260 18.526 2.708 1.483 1.00 0.00 N ATOM 552 CA GLY A 260 17.150 3.079 1.261 1.00 0.00 C ATOM 553 C GLY A 260 16.681 2.721 -0.134 1.00 0.00 C ATOM 554 O GLY A 260 17.104 3.352 -1.100 1.00 0.00 O ATOM 0 H GLY A 260 18.656 1.936 2.137 1.00 0.00 H new ATOM 0 HA2 GLY A 260 16.517 2.580 1.995 1.00 0.00 H new ATOM 0 HA3 GLY A 260 17.034 4.151 1.418 1.00 0.00 H new ATOM 558 N PHE A 261 15.836 1.693 -0.250 1.00 0.00 N ATOM 559 CA PHE A 261 15.231 1.349 -1.535 1.00 0.00 C ATOM 560 C PHE A 261 14.740 2.598 -2.263 1.00 0.00 C ATOM 561 O PHE A 261 15.165 2.882 -3.380 1.00 0.00 O ATOM 562 CB PHE A 261 14.040 0.387 -1.360 1.00 0.00 C ATOM 563 CG PHE A 261 14.423 -1.062 -1.340 1.00 0.00 C ATOM 564 CD1 PHE A 261 14.384 -1.794 -0.167 1.00 0.00 C ATOM 565 CD2 PHE A 261 14.814 -1.694 -2.509 1.00 0.00 C ATOM 566 CE1 PHE A 261 14.729 -3.132 -0.161 1.00 0.00 C ATOM 567 CE2 PHE A 261 15.161 -3.027 -2.509 1.00 0.00 C ATOM 568 CZ PHE A 261 15.120 -3.748 -1.335 1.00 0.00 C ATOM 0 H PHE A 261 15.558 1.090 0.525 1.00 0.00 H new ATOM 0 HA PHE A 261 16.007 0.860 -2.124 1.00 0.00 H new ATOM 0 HB2 PHE A 261 13.525 0.629 -0.430 1.00 0.00 H new ATOM 0 HB3 PHE A 261 13.330 0.553 -2.170 1.00 0.00 H new ATOM 0 HD1 PHE A 261 14.081 -1.315 0.753 1.00 0.00 H new ATOM 0 HD2 PHE A 261 14.847 -1.134 -3.432 1.00 0.00 H new ATOM 0 HE1 PHE A 261 14.693 -3.696 0.760 1.00 0.00 H new ATOM 0 HE2 PHE A 261 15.465 -3.507 -3.428 1.00 0.00 H new ATOM 0 HZ PHE A 261 15.393 -4.793 -1.332 1.00 0.00 H new ATOM 578 N LEU A 262 13.864 3.349 -1.609 1.00 0.00 N ATOM 579 CA LEU A 262 13.275 4.542 -2.195 1.00 0.00 C ATOM 580 C LEU A 262 13.005 5.559 -1.101 1.00 0.00 C ATOM 581 O LEU A 262 12.728 5.182 0.037 1.00 0.00 O ATOM 582 CB LEU A 262 11.959 4.204 -2.901 1.00 0.00 C ATOM 583 CG LEU A 262 12.066 3.250 -4.091 1.00 0.00 C ATOM 584 CD1 LEU A 262 10.682 2.850 -4.567 1.00 0.00 C ATOM 585 CD2 LEU A 262 12.852 3.889 -5.227 1.00 0.00 C ATOM 0 H LEU A 262 13.544 3.148 -0.662 1.00 0.00 H new ATOM 0 HA LEU A 262 13.972 4.952 -2.926 1.00 0.00 H new ATOM 0 HB2 LEU A 262 11.279 3.767 -2.170 1.00 0.00 H new ATOM 0 HB3 LEU A 262 11.504 5.133 -3.245 1.00 0.00 H new ATOM 0 HG LEU A 262 12.600 2.356 -3.768 1.00 0.00 H new ATOM 0 HD11 LEU A 262 10.771 2.171 -5.415 1.00 0.00 H new ATOM 0 HD12 LEU A 262 10.149 2.352 -3.757 1.00 0.00 H new ATOM 0 HD13 LEU A 262 10.131 3.740 -4.871 1.00 0.00 H new ATOM 0 HD21 LEU A 262 12.915 3.192 -6.063 1.00 0.00 H new ATOM 0 HD22 LEU A 262 12.348 4.799 -5.551 1.00 0.00 H new ATOM 0 HD23 LEU A 262 13.857 4.134 -4.882 1.00 0.00 H new ATOM 597 N LYS A 263 13.127 6.835 -1.431 1.00 0.00 N ATOM 598 CA LYS A 263 12.823 7.891 -0.493 1.00 0.00 C ATOM 599 C LYS A 263 11.598 8.687 -0.924 1.00 0.00 C ATOM 600 O LYS A 263 10.854 8.275 -1.817 1.00 0.00 O ATOM 601 CB LYS A 263 14.018 8.826 -0.335 1.00 0.00 C ATOM 602 CG LYS A 263 15.270 8.134 0.164 1.00 0.00 C ATOM 603 CD LYS A 263 15.998 7.396 -0.947 1.00 0.00 C ATOM 604 CE LYS A 263 17.234 6.684 -0.426 1.00 0.00 C ATOM 605 NZ LYS A 263 17.977 5.979 -1.505 1.00 0.00 N1+ ATOM 0 H LYS A 263 13.436 7.160 -2.347 1.00 0.00 H new ATOM 0 HA LYS A 263 12.604 7.423 0.466 1.00 0.00 H new ATOM 0 HB2 LYS A 263 14.231 9.295 -1.296 1.00 0.00 H new ATOM 0 HB3 LYS A 263 13.754 9.625 0.358 1.00 0.00 H new ATOM 0 HG2 LYS A 263 15.939 8.872 0.607 1.00 0.00 H new ATOM 0 HG3 LYS A 263 15.004 7.430 0.953 1.00 0.00 H new ATOM 0 HD2 LYS A 263 15.325 6.671 -1.405 1.00 0.00 H new ATOM 0 HD3 LYS A 263 16.285 8.102 -1.727 1.00 0.00 H new ATOM 0 HE2 LYS A 263 17.893 7.408 0.052 1.00 0.00 H new ATOM 0 HE3 LYS A 263 16.941 5.965 0.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 18.812 5.508 -1.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 17.358 5.269 -1.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 18.281 6.667 -2.224 1.00 0.00 H new ATOM 619 N ALA A 264 11.416 9.834 -0.283 1.00 0.00 N ATOM 620 CA ALA A 264 10.254 10.689 -0.485 1.00 0.00 C ATOM 621 C ALA A 264 10.020 11.024 -1.952 1.00 0.00 C ATOM 622 O ALA A 264 10.829 11.700 -2.592 1.00 0.00 O ATOM 623 CB ALA A 264 10.415 11.972 0.314 1.00 0.00 C ATOM 0 H ALA A 264 12.079 10.201 0.400 1.00 0.00 H new ATOM 0 HA ALA A 264 9.382 10.134 -0.137 1.00 0.00 H new ATOM 0 HB1 ALA A 264 9.544 12.608 0.160 1.00 0.00 H new ATOM 0 HB2 ALA A 264 10.506 11.732 1.373 1.00 0.00 H new ATOM 0 HB3 ALA A 264 11.311 12.497 -0.017 1.00 0.00 H new ATOM 629 N GLY A 265 8.914 10.536 -2.480 1.00 0.00 N ATOM 630 CA GLY A 265 8.489 10.936 -3.804 1.00 0.00 C ATOM 631 C GLY A 265 8.518 9.809 -4.810 1.00 0.00 C ATOM 632 O GLY A 265 7.904 9.912 -5.873 1.00 0.00 O ATOM 0 H GLY A 265 8.299 9.868 -2.016 1.00 0.00 H new ATOM 0 HA2 GLY A 265 7.477 11.336 -3.747 1.00 0.00 H new ATOM 0 HA3 GLY A 265 9.132 11.743 -4.155 1.00 0.00 H new ATOM 636 N ASP A 266 9.210 8.728 -4.484 1.00 0.00 N ATOM 637 CA ASP A 266 9.342 7.621 -5.427 1.00 0.00 C ATOM 638 C ASP A 266 8.124 6.717 -5.372 1.00 0.00 C ATOM 639 O ASP A 266 7.641 6.368 -4.294 1.00 0.00 O ATOM 640 CB ASP A 266 10.620 6.812 -5.190 1.00 0.00 C ATOM 641 CG ASP A 266 11.722 7.181 -6.167 1.00 0.00 C ATOM 642 OD1 ASP A 266 11.616 6.816 -7.359 1.00 0.00 O ATOM 643 OD2 ASP A 266 12.705 7.830 -5.752 1.00 0.00 O1- ATOM 0 H ASP A 266 9.682 8.591 -3.590 1.00 0.00 H new ATOM 0 HA ASP A 266 9.411 8.057 -6.424 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.970 6.978 -4.171 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.397 5.749 -5.281 1.00 0.00 H new ATOM 648 N GLN A 267 7.625 6.348 -6.540 1.00 0.00 N ATOM 649 CA GLN A 267 6.384 5.599 -6.636 1.00 0.00 C ATOM 650 C GLN A 267 6.648 4.099 -6.703 1.00 0.00 C ATOM 651 O GLN A 267 7.640 3.648 -7.279 1.00 0.00 O ATOM 652 CB GLN A 267 5.597 6.050 -7.867 1.00 0.00 C ATOM 653 CG GLN A 267 5.392 7.558 -7.932 1.00 0.00 C ATOM 654 CD GLN A 267 3.954 7.982 -7.697 1.00 0.00 C ATOM 655 OE1 GLN A 267 3.694 9.054 -7.144 1.00 0.00 O ATOM 656 NE2 GLN A 267 3.009 7.166 -8.131 1.00 0.00 N ATOM 0 H GLN A 267 8.062 6.556 -7.438 1.00 0.00 H new ATOM 0 HA GLN A 267 5.797 5.798 -5.739 1.00 0.00 H new ATOM 0 HB2 GLN A 267 6.121 5.723 -8.765 1.00 0.00 H new ATOM 0 HB3 GLN A 267 4.624 5.558 -7.868 1.00 0.00 H new ATOM 0 HG2 GLN A 267 6.030 8.036 -7.189 1.00 0.00 H new ATOM 0 HG3 GLN A 267 5.714 7.919 -8.909 1.00 0.00 H new ATOM 0 HE21 GLN A 267 3.262 6.288 -8.584 1.00 0.00 H new ATOM 0 HE22 GLN A 267 2.027 7.415 -8.013 1.00 0.00 H new ATOM 665 N VAL A 268 5.746 3.337 -6.116 1.00 0.00 N ATOM 666 CA VAL A 268 5.850 1.889 -6.091 1.00 0.00 C ATOM 667 C VAL A 268 4.594 1.251 -6.649 1.00 0.00 C ATOM 668 O VAL A 268 3.559 1.889 -6.786 1.00 0.00 O ATOM 669 CB VAL A 268 6.047 1.325 -4.659 1.00 0.00 C ATOM 670 CG1 VAL A 268 7.519 1.294 -4.284 1.00 0.00 C ATOM 671 CG2 VAL A 268 5.268 2.145 -3.634 1.00 0.00 C ATOM 0 H VAL A 268 4.920 3.703 -5.643 1.00 0.00 H new ATOM 0 HA VAL A 268 6.723 1.649 -6.698 1.00 0.00 H new ATOM 0 HB VAL A 268 5.663 0.305 -4.654 1.00 0.00 H new ATOM 0 HG11 VAL A 268 7.629 0.895 -3.276 1.00 0.00 H new ATOM 0 HG12 VAL A 268 8.060 0.660 -4.987 1.00 0.00 H new ATOM 0 HG13 VAL A 268 7.925 2.305 -4.320 1.00 0.00 H new ATOM 0 HG21 VAL A 268 5.424 1.727 -2.639 1.00 0.00 H new ATOM 0 HG22 VAL A 268 5.617 3.177 -3.653 1.00 0.00 H new ATOM 0 HG23 VAL A 268 4.206 2.116 -3.877 1.00 0.00 H new ATOM 681 N LYS A 269 4.706 -0.016 -6.946 1.00 0.00 N ATOM 682 CA LYS A 269 3.581 -0.826 -7.336 1.00 0.00 C ATOM 683 C LYS A 269 3.110 -1.580 -6.090 1.00 0.00 C ATOM 684 O LYS A 269 3.890 -2.320 -5.488 1.00 0.00 O ATOM 685 CB LYS A 269 4.035 -1.774 -8.461 1.00 0.00 C ATOM 686 CG LYS A 269 3.050 -2.864 -8.869 1.00 0.00 C ATOM 687 CD LYS A 269 3.019 -4.011 -7.870 1.00 0.00 C ATOM 688 CE LYS A 269 2.645 -5.327 -8.534 1.00 0.00 C ATOM 689 NZ LYS A 269 1.286 -5.285 -9.141 1.00 0.00 N1+ ATOM 0 H LYS A 269 5.592 -0.522 -6.924 1.00 0.00 H new ATOM 0 HA LYS A 269 2.749 -0.235 -7.719 1.00 0.00 H new ATOM 0 HB2 LYS A 269 4.264 -1.174 -9.342 1.00 0.00 H new ATOM 0 HB3 LYS A 269 4.964 -2.252 -8.151 1.00 0.00 H new ATOM 0 HG2 LYS A 269 2.052 -2.435 -8.959 1.00 0.00 H new ATOM 0 HG3 LYS A 269 3.322 -3.248 -9.852 1.00 0.00 H new ATOM 0 HD2 LYS A 269 3.996 -4.107 -7.397 1.00 0.00 H new ATOM 0 HD3 LYS A 269 2.303 -3.786 -7.080 1.00 0.00 H new ATOM 0 HE2 LYS A 269 3.378 -5.564 -9.305 1.00 0.00 H new ATOM 0 HE3 LYS A 269 2.687 -6.129 -7.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 1.061 -6.213 -9.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 0.586 -5.051 -8.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 1.261 -4.561 -9.887 1.00 0.00 H new ATOM 703 N PHE A 270 1.866 -1.379 -5.681 1.00 0.00 N ATOM 704 CA PHE A 270 1.386 -1.968 -4.445 1.00 0.00 C ATOM 705 C PHE A 270 0.167 -2.837 -4.719 1.00 0.00 C ATOM 706 O PHE A 270 -0.842 -2.363 -5.245 1.00 0.00 O ATOM 707 CB PHE A 270 1.042 -0.865 -3.442 1.00 0.00 C ATOM 708 CG PHE A 270 1.104 -1.302 -2.004 1.00 0.00 C ATOM 709 CD1 PHE A 270 2.214 -1.003 -1.230 1.00 0.00 C ATOM 710 CD2 PHE A 270 0.059 -2.003 -1.426 1.00 0.00 C ATOM 711 CE1 PHE A 270 2.278 -1.395 0.095 1.00 0.00 C ATOM 712 CE2 PHE A 270 0.119 -2.398 -0.103 1.00 0.00 C ATOM 713 CZ PHE A 270 1.230 -2.093 0.658 1.00 0.00 C ATOM 0 H PHE A 270 1.178 -0.818 -6.183 1.00 0.00 H new ATOM 0 HA PHE A 270 2.170 -2.595 -4.020 1.00 0.00 H new ATOM 0 HB2 PHE A 270 1.728 -0.030 -3.587 1.00 0.00 H new ATOM 0 HB3 PHE A 270 0.039 -0.495 -3.655 1.00 0.00 H new ATOM 0 HD1 PHE A 270 3.038 -0.458 -1.666 1.00 0.00 H new ATOM 0 HD2 PHE A 270 -0.813 -2.244 -2.016 1.00 0.00 H new ATOM 0 HE1 PHE A 270 3.148 -1.155 0.688 1.00 0.00 H new ATOM 0 HE2 PHE A 270 -0.703 -2.945 0.335 1.00 0.00 H new ATOM 0 HZ PHE A 270 1.278 -2.400 1.692 1.00 0.00 H new ATOM 723 N THR A 271 0.273 -4.109 -4.386 1.00 0.00 N ATOM 724 CA THR A 271 -0.819 -5.039 -4.591 1.00 0.00 C ATOM 725 C THR A 271 -1.162 -5.754 -3.290 1.00 0.00 C ATOM 726 O THR A 271 -0.364 -6.536 -2.769 1.00 0.00 O ATOM 727 CB THR A 271 -0.458 -6.067 -5.691 1.00 0.00 C ATOM 728 OG1 THR A 271 -0.376 -5.395 -6.954 1.00 0.00 O ATOM 729 CG2 THR A 271 -1.470 -7.225 -5.779 1.00 0.00 C ATOM 0 H THR A 271 1.108 -4.523 -3.971 1.00 0.00 H new ATOM 0 HA THR A 271 -1.693 -4.475 -4.918 1.00 0.00 H new ATOM 0 HB THR A 271 0.504 -6.507 -5.428 1.00 0.00 H new ATOM 0 HG1 THR A 271 -0.909 -5.880 -7.618 1.00 0.00 H new ATOM 0 HG21 THR A 271 -1.166 -7.914 -6.567 1.00 0.00 H new ATOM 0 HG22 THR A 271 -1.502 -7.754 -4.826 1.00 0.00 H new ATOM 0 HG23 THR A 271 -2.459 -6.827 -6.006 1.00 0.00 H new ATOM 737 N ASN A 272 -2.347 -5.472 -2.770 1.00 0.00 N ATOM 738 CA ASN A 272 -2.776 -6.049 -1.500 1.00 0.00 C ATOM 739 C ASN A 272 -3.372 -7.432 -1.703 1.00 0.00 C ATOM 740 O ASN A 272 -3.877 -7.759 -2.779 1.00 0.00 O ATOM 741 CB ASN A 272 -3.804 -5.150 -0.808 1.00 0.00 C ATOM 742 CG ASN A 272 -3.210 -3.851 -0.302 1.00 0.00 C ATOM 743 OD1 ASN A 272 -3.213 -2.840 -1.001 1.00 0.00 O ATOM 744 ND2 ASN A 272 -2.685 -3.871 0.914 1.00 0.00 N ATOM 0 H ASN A 272 -3.028 -4.850 -3.204 1.00 0.00 H new ATOM 0 HA ASN A 272 -1.893 -6.132 -0.867 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -4.611 -4.926 -1.506 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -4.247 -5.691 0.029 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -2.263 -3.027 1.301 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -2.702 -4.731 1.463 1.00 0.00 H new ATOM 1061 N SER A 292 -4.587 -3.745 -7.371 1.00 0.00 N ATOM 1062 CA SER A 292 -3.276 -3.480 -7.929 1.00 0.00 C ATOM 1063 C SER A 292 -3.133 -1.993 -8.261 1.00 0.00 C ATOM 1064 O SER A 292 -3.475 -1.558 -9.361 1.00 0.00 O ATOM 1065 CB SER A 292 -3.069 -4.334 -9.183 1.00 0.00 C ATOM 1066 OG SER A 292 -4.196 -4.256 -10.044 1.00 0.00 O ATOM 0 HA SER A 292 -2.514 -3.741 -7.195 1.00 0.00 H new ATOM 0 HB2 SER A 292 -2.178 -3.998 -9.713 1.00 0.00 H new ATOM 0 HB3 SER A 292 -2.897 -5.371 -8.896 1.00 0.00 H new ATOM 0 HG SER A 292 -4.996 -4.050 -9.517 1.00 0.00 H new ATOM 1072 N PHE A 293 -2.645 -1.210 -7.307 1.00 0.00 N ATOM 1073 CA PHE A 293 -2.499 0.221 -7.513 1.00 0.00 C ATOM 1074 C PHE A 293 -1.039 0.635 -7.392 1.00 0.00 C ATOM 1075 O PHE A 293 -0.171 -0.181 -7.076 1.00 0.00 O ATOM 1076 CB PHE A 293 -3.364 1.003 -6.513 1.00 0.00 C ATOM 1077 CG PHE A 293 -3.001 0.786 -5.069 1.00 0.00 C ATOM 1078 CD1 PHE A 293 -2.199 1.696 -4.398 1.00 0.00 C ATOM 1079 CD2 PHE A 293 -3.471 -0.318 -4.381 1.00 0.00 C ATOM 1080 CE1 PHE A 293 -1.873 1.505 -3.070 1.00 0.00 C ATOM 1081 CE2 PHE A 293 -3.146 -0.515 -3.053 1.00 0.00 C ATOM 1082 CZ PHE A 293 -2.347 0.398 -2.397 1.00 0.00 C ATOM 0 H PHE A 293 -2.346 -1.541 -6.390 1.00 0.00 H new ATOM 0 HA PHE A 293 -2.840 0.456 -8.521 1.00 0.00 H new ATOM 0 HB2 PHE A 293 -3.285 2.067 -6.738 1.00 0.00 H new ATOM 0 HB3 PHE A 293 -4.407 0.723 -6.658 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -1.825 2.564 -4.920 1.00 0.00 H new ATOM 0 HD2 PHE A 293 -4.100 -1.035 -4.888 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -1.247 2.222 -2.559 1.00 0.00 H new ATOM 0 HE2 PHE A 293 -3.517 -1.383 -2.529 1.00 0.00 H new ATOM 0 HZ PHE A 293 -2.093 0.247 -1.358 1.00 0.00 H new ATOM 1092 N THR A 294 -0.773 1.898 -7.662 1.00 0.00 N ATOM 1093 CA THR A 294 0.567 2.438 -7.567 1.00 0.00 C ATOM 1094 C THR A 294 0.663 3.381 -6.367 1.00 0.00 C ATOM 1095 O THR A 294 -0.032 4.398 -6.308 1.00 0.00 O ATOM 1096 CB THR A 294 0.941 3.182 -8.869 1.00 0.00 C ATOM 1097 OG1 THR A 294 0.961 2.254 -9.965 1.00 0.00 O ATOM 1098 CG2 THR A 294 2.292 3.893 -8.768 1.00 0.00 C ATOM 0 H THR A 294 -1.478 2.576 -7.952 1.00 0.00 H new ATOM 0 HA THR A 294 1.270 1.617 -7.427 1.00 0.00 H new ATOM 0 HB THR A 294 0.184 3.948 -9.037 1.00 0.00 H new ATOM 0 HG1 THR A 294 1.197 2.727 -10.790 1.00 0.00 H new ATOM 0 HG21 THR A 294 2.508 4.400 -9.709 1.00 0.00 H new ATOM 0 HG22 THR A 294 2.259 4.625 -7.961 1.00 0.00 H new ATOM 0 HG23 THR A 294 3.074 3.162 -8.563 1.00 0.00 H new ATOM 1106 N ALA A 295 1.515 3.038 -5.411 1.00 0.00 N ATOM 1107 CA ALA A 295 1.634 3.809 -4.186 1.00 0.00 C ATOM 1108 C ALA A 295 2.901 4.650 -4.219 1.00 0.00 C ATOM 1109 O ALA A 295 3.604 4.666 -5.227 1.00 0.00 O ATOM 1110 CB ALA A 295 1.623 2.877 -2.990 1.00 0.00 C ATOM 0 H ALA A 295 2.134 2.229 -5.462 1.00 0.00 H new ATOM 0 HA ALA A 295 0.784 4.486 -4.099 1.00 0.00 H new ATOM 0 HB1 ALA A 295 1.713 3.460 -2.073 1.00 0.00 H new ATOM 0 HB2 ALA A 295 0.688 2.317 -2.974 1.00 0.00 H new ATOM 0 HB3 ALA A 295 2.461 2.183 -3.062 1.00 0.00 H new ATOM 1116 N THR A 296 3.198 5.349 -3.135 1.00 0.00 N ATOM 1117 CA THR A 296 4.352 6.226 -3.115 1.00 0.00 C ATOM 1118 C THR A 296 5.076 6.198 -1.774 1.00 0.00 C ATOM 1119 O THR A 296 4.464 6.325 -0.711 1.00 0.00 O ATOM 1120 CB THR A 296 3.932 7.678 -3.456 1.00 0.00 C ATOM 1121 OG1 THR A 296 3.329 7.720 -4.756 1.00 0.00 O ATOM 1122 CG2 THR A 296 5.112 8.656 -3.398 1.00 0.00 C ATOM 0 H THR A 296 2.661 5.326 -2.268 1.00 0.00 H new ATOM 0 HA THR A 296 5.045 5.859 -3.871 1.00 0.00 H new ATOM 0 HB THR A 296 3.211 7.992 -2.701 1.00 0.00 H new ATOM 0 HG1 THR A 296 3.708 8.464 -5.269 1.00 0.00 H new ATOM 0 HG21 THR A 296 4.765 9.659 -3.645 1.00 0.00 H new ATOM 0 HG22 THR A 296 5.536 8.655 -2.394 1.00 0.00 H new ATOM 0 HG23 THR A 296 5.874 8.349 -4.114 1.00 0.00 H new ATOM 1130 N VAL A 297 6.391 6.032 -1.853 1.00 0.00 N ATOM 1131 CA VAL A 297 7.259 6.056 -0.689 1.00 0.00 C ATOM 1132 C VAL A 297 7.428 7.500 -0.223 1.00 0.00 C ATOM 1133 O VAL A 297 7.615 8.400 -1.044 1.00 0.00 O ATOM 1134 CB VAL A 297 8.632 5.434 -1.028 1.00 0.00 C ATOM 1135 CG1 VAL A 297 9.553 5.454 0.175 1.00 0.00 C ATOM 1136 CG2 VAL A 297 8.456 4.009 -1.535 1.00 0.00 C ATOM 0 H VAL A 297 6.884 5.876 -2.732 1.00 0.00 H new ATOM 0 HA VAL A 297 6.810 5.467 0.111 1.00 0.00 H new ATOM 0 HB VAL A 297 9.090 6.035 -1.814 1.00 0.00 H new ATOM 0 HG11 VAL A 297 10.512 5.010 -0.093 1.00 0.00 H new ATOM 0 HG12 VAL A 297 9.708 6.484 0.498 1.00 0.00 H new ATOM 0 HG13 VAL A 297 9.103 4.883 0.987 1.00 0.00 H new ATOM 0 HG21 VAL A 297 9.432 3.583 -1.770 1.00 0.00 H new ATOM 0 HG22 VAL A 297 7.973 3.406 -0.766 1.00 0.00 H new ATOM 0 HG23 VAL A 297 7.838 4.016 -2.433 1.00 0.00 H new ATOM 1146 N THR A 298 7.361 7.735 1.082 1.00 0.00 N ATOM 1147 CA THR A 298 7.245 9.106 1.567 1.00 0.00 C ATOM 1148 C THR A 298 8.499 9.588 2.302 1.00 0.00 C ATOM 1149 O THR A 298 8.623 10.774 2.607 1.00 0.00 O ATOM 1150 CB THR A 298 6.021 9.261 2.494 1.00 0.00 C ATOM 1151 OG1 THR A 298 4.928 8.480 1.990 1.00 0.00 O ATOM 1152 CG2 THR A 298 5.588 10.718 2.592 1.00 0.00 C ATOM 0 H THR A 298 7.384 7.017 1.806 1.00 0.00 H new ATOM 0 HA THR A 298 7.120 9.728 0.680 1.00 0.00 H new ATOM 0 HB THR A 298 6.304 8.912 3.487 1.00 0.00 H new ATOM 0 HG1 THR A 298 4.974 7.575 2.362 1.00 0.00 H new ATOM 0 HG21 THR A 298 4.724 10.797 3.251 1.00 0.00 H new ATOM 0 HG22 THR A 298 6.407 11.315 2.994 1.00 0.00 H new ATOM 0 HG23 THR A 298 5.323 11.086 1.601 1.00 0.00 H new ATOM 1160 N ALA A 299 9.438 8.692 2.575 1.00 0.00 N ATOM 1161 CA ALA A 299 10.636 9.074 3.313 1.00 0.00 C ATOM 1162 C ALA A 299 11.726 8.029 3.190 1.00 0.00 C ATOM 1163 O ALA A 299 11.628 7.122 2.366 1.00 0.00 O ATOM 1164 CB ALA A 299 10.302 9.317 4.780 1.00 0.00 C ATOM 0 H ALA A 299 9.396 7.710 2.302 1.00 0.00 H new ATOM 0 HA ALA A 299 11.011 9.999 2.875 1.00 0.00 H new ATOM 0 HB1 ALA A 299 11.207 9.601 5.317 1.00 0.00 H new ATOM 0 HB2 ALA A 299 9.567 10.118 4.858 1.00 0.00 H new ATOM 0 HB3 ALA A 299 9.893 8.406 5.216 1.00 0.00 H new ATOM 1170 N ASP A 300 12.762 8.175 4.006 1.00 0.00 N ATOM 1171 CA ASP A 300 13.873 7.253 4.018 1.00 0.00 C ATOM 1172 C ASP A 300 13.415 5.868 4.408 1.00 0.00 C ATOM 1173 O ASP A 300 12.439 5.689 5.141 1.00 0.00 O ATOM 1174 CB ASP A 300 14.968 7.725 4.977 1.00 0.00 C ATOM 1175 CG ASP A 300 15.786 8.870 4.417 1.00 0.00 C ATOM 1176 OD1 ASP A 300 15.399 10.039 4.621 1.00 0.00 O ATOM 1177 OD2 ASP A 300 16.827 8.607 3.774 1.00 0.00 O1- ATOM 0 H ASP A 300 12.849 8.939 4.676 1.00 0.00 H new ATOM 0 HA ASP A 300 14.284 7.219 3.009 1.00 0.00 H new ATOM 0 HB2 ASP A 300 14.512 8.036 5.917 1.00 0.00 H new ATOM 0 HB3 ASP A 300 15.630 6.889 5.205 1.00 0.00 H new ATOM 1182 N ALA A 301 14.140 4.902 3.911 1.00 0.00 N ATOM 1183 CA ALA A 301 13.837 3.505 4.138 1.00 0.00 C ATOM 1184 C ALA A 301 15.133 2.703 4.166 1.00 0.00 C ATOM 1185 O ALA A 301 16.216 3.278 4.053 1.00 0.00 O ATOM 1186 CB ALA A 301 12.875 3.000 3.071 1.00 0.00 C ATOM 0 H ALA A 301 14.965 5.058 3.332 1.00 0.00 H new ATOM 0 HA ALA A 301 13.345 3.381 5.103 1.00 0.00 H new ATOM 0 HB1 ALA A 301 12.653 1.948 3.250 1.00 0.00 H new ATOM 0 HB2 ALA A 301 11.952 3.578 3.111 1.00 0.00 H new ATOM 0 HB3 ALA A 301 13.331 3.112 2.087 1.00 0.00 H new ATOM 1192 N ASN A 302 15.042 1.392 4.332 1.00 0.00 N ATOM 1193 CA ASN A 302 16.240 0.574 4.511 1.00 0.00 C ATOM 1194 C ASN A 302 16.187 -0.710 3.698 1.00 0.00 C ATOM 1195 O ASN A 302 15.156 -1.362 3.648 1.00 0.00 O ATOM 1196 CB ASN A 302 16.399 0.190 5.985 1.00 0.00 C ATOM 1197 CG ASN A 302 16.693 1.379 6.881 1.00 0.00 C ATOM 1198 OD1 ASN A 302 15.780 2.044 7.369 1.00 0.00 O ATOM 1199 ND2 ASN A 302 17.968 1.648 7.111 1.00 0.00 N ATOM 0 H ASN A 302 14.164 0.873 4.347 1.00 0.00 H new ATOM 0 HA ASN A 302 17.082 1.175 4.168 1.00 0.00 H new ATOM 0 HB2 ASN A 302 15.487 -0.299 6.327 1.00 0.00 H new ATOM 0 HB3 ASN A 302 17.205 -0.537 6.080 1.00 0.00 H new ATOM 0 HD21 ASN A 302 18.224 2.431 7.712 1.00 0.00 H new ATOM 0 HD22 ASN A 302 18.695 1.072 6.687 1.00 0.00 H new ATOM 1206 N SER A 303 17.284 -1.058 3.038 1.00 0.00 N ATOM 1207 CA SER A 303 17.478 -2.415 2.571 1.00 0.00 C ATOM 1208 C SER A 303 18.636 -3.028 3.351 1.00 0.00 C ATOM 1209 O SER A 303 19.801 -2.803 3.016 1.00 0.00 O ATOM 1210 CB SER A 303 17.800 -2.411 1.081 1.00 0.00 C ATOM 1211 OG SER A 303 17.292 -1.240 0.462 1.00 0.00 O ATOM 0 H SER A 303 18.047 -0.419 2.817 1.00 0.00 H new ATOM 0 HA SER A 303 16.570 -2.998 2.727 1.00 0.00 H new ATOM 0 HB2 SER A 303 18.879 -2.466 0.937 1.00 0.00 H new ATOM 0 HB3 SER A 303 17.370 -3.294 0.608 1.00 0.00 H new ATOM 0 HG SER A 303 16.461 -1.454 -0.011 1.00 0.00 H new ATOM 1217 N ASP A 304 18.333 -3.757 4.414 1.00 0.00 N ATOM 1218 CA ASP A 304 19.384 -4.318 5.253 1.00 0.00 C ATOM 1219 C ASP A 304 19.615 -5.784 4.916 1.00 0.00 C ATOM 1220 O ASP A 304 18.890 -6.354 4.108 1.00 0.00 O ATOM 1221 CB ASP A 304 19.052 -4.162 6.742 1.00 0.00 C ATOM 1222 CG ASP A 304 18.123 -5.241 7.256 1.00 0.00 C ATOM 1223 OD1 ASP A 304 16.911 -5.171 6.980 1.00 0.00 O ATOM 1224 OD2 ASP A 304 18.602 -6.164 7.947 1.00 0.00 O1- ATOM 0 H ASP A 304 17.382 -3.973 4.714 1.00 0.00 H new ATOM 0 HA ASP A 304 20.300 -3.763 5.051 1.00 0.00 H new ATOM 0 HB2 ASP A 304 19.977 -4.181 7.319 1.00 0.00 H new ATOM 0 HB3 ASP A 304 18.594 -3.187 6.906 1.00 0.00 H new ATOM 1229 N SER A 305 20.605 -6.396 5.538 1.00 0.00 N ATOM 1230 CA SER A 305 20.951 -7.778 5.242 1.00 0.00 C ATOM 1231 C SER A 305 19.790 -8.732 5.535 1.00 0.00 C ATOM 1232 O SER A 305 19.621 -9.742 4.852 1.00 0.00 O ATOM 1233 CB SER A 305 22.175 -8.185 6.047 1.00 0.00 C ATOM 1234 OG SER A 305 23.288 -7.363 5.728 1.00 0.00 O ATOM 0 H SER A 305 21.186 -5.959 6.253 1.00 0.00 H new ATOM 0 HA SER A 305 21.171 -7.846 4.177 1.00 0.00 H new ATOM 0 HB2 SER A 305 21.956 -8.110 7.112 1.00 0.00 H new ATOM 0 HB3 SER A 305 22.418 -9.228 5.844 1.00 0.00 H new ATOM 0 HG SER A 305 24.063 -7.642 6.259 1.00 0.00 H new ATOM 1240 N GLY A 306 18.979 -8.389 6.527 1.00 0.00 N ATOM 1241 CA GLY A 306 17.855 -9.226 6.896 1.00 0.00 C ATOM 1242 C GLY A 306 16.682 -9.057 5.954 1.00 0.00 C ATOM 1243 O GLY A 306 15.663 -9.737 6.087 1.00 0.00 O ATOM 0 H GLY A 306 19.081 -7.541 7.085 1.00 0.00 H new ATOM 0 HA2 GLY A 306 18.168 -10.270 6.900 1.00 0.00 H new ATOM 0 HA3 GLY A 306 17.541 -8.983 7.911 1.00 0.00 H new ATOM 1247 N GLY A 307 16.834 -8.156 4.989 1.00 0.00 N ATOM 1248 CA GLY A 307 15.787 -7.926 4.019 1.00 0.00 C ATOM 1249 C GLY A 307 14.552 -7.260 4.599 1.00 0.00 C ATOM 1250 O GLY A 307 13.435 -7.663 4.285 1.00 0.00 O ATOM 0 H GLY A 307 17.667 -7.581 4.864 1.00 0.00 H new ATOM 0 HA2 GLY A 307 16.180 -7.305 3.214 1.00 0.00 H new ATOM 0 HA3 GLY A 307 15.500 -8.879 3.575 1.00 0.00 H new ATOM 1254 N ASP A 308 14.729 -6.263 5.461 1.00 0.00 N ATOM 1255 CA ASP A 308 13.588 -5.508 5.981 1.00 0.00 C ATOM 1256 C ASP A 308 13.637 -4.057 5.511 1.00 0.00 C ATOM 1257 O ASP A 308 14.688 -3.420 5.548 1.00 0.00 O ATOM 1258 CB ASP A 308 13.539 -5.544 7.509 1.00 0.00 C ATOM 1259 CG ASP A 308 13.209 -6.911 8.066 1.00 0.00 C ATOM 1260 OD1 ASP A 308 14.113 -7.564 8.620 1.00 0.00 O ATOM 1261 OD2 ASP A 308 12.041 -7.341 7.965 1.00 0.00 O1- ATOM 0 H ASP A 308 15.638 -5.960 5.812 1.00 0.00 H new ATOM 0 HA ASP A 308 12.687 -5.983 5.593 1.00 0.00 H new ATOM 0 HB2 ASP A 308 14.502 -5.221 7.904 1.00 0.00 H new ATOM 0 HB3 ASP A 308 12.795 -4.828 7.859 1.00 0.00 H new ATOM 1266 N VAL A 309 12.493 -3.544 5.077 1.00 0.00 N ATOM 1267 CA VAL A 309 12.389 -2.168 4.587 1.00 0.00 C ATOM 1268 C VAL A 309 11.134 -1.473 5.126 1.00 0.00 C ATOM 1269 O VAL A 309 10.028 -1.739 4.682 1.00 0.00 O ATOM 1270 CB VAL A 309 12.390 -2.128 3.028 1.00 0.00 C ATOM 1271 CG1 VAL A 309 11.434 -3.147 2.432 1.00 0.00 C ATOM 1272 CG2 VAL A 309 12.071 -0.739 2.483 1.00 0.00 C ATOM 0 H VAL A 309 11.615 -4.062 5.053 1.00 0.00 H new ATOM 0 HA VAL A 309 13.263 -1.629 4.953 1.00 0.00 H new ATOM 0 HB VAL A 309 13.405 -2.387 2.725 1.00 0.00 H new ATOM 0 HG11 VAL A 309 11.467 -3.084 1.344 1.00 0.00 H new ATOM 0 HG12 VAL A 309 11.727 -4.149 2.747 1.00 0.00 H new ATOM 0 HG13 VAL A 309 10.421 -2.940 2.777 1.00 0.00 H new ATOM 0 HG21 VAL A 309 12.084 -0.764 1.393 1.00 0.00 H new ATOM 0 HG22 VAL A 309 11.084 -0.431 2.827 1.00 0.00 H new ATOM 0 HG23 VAL A 309 12.817 -0.028 2.839 1.00 0.00 H new ATOM 1282 N THR A 310 11.300 -0.578 6.081 1.00 0.00 N ATOM 1283 CA THR A 310 10.155 0.101 6.673 1.00 0.00 C ATOM 1284 C THR A 310 10.011 1.524 6.133 1.00 0.00 C ATOM 1285 O THR A 310 10.978 2.286 6.111 1.00 0.00 O ATOM 1286 CB THR A 310 10.296 0.154 8.216 1.00 0.00 C ATOM 1287 OG1 THR A 310 10.422 -1.174 8.734 1.00 0.00 O ATOM 1288 CG2 THR A 310 9.115 0.863 8.900 1.00 0.00 C ATOM 0 H THR A 310 12.205 -0.304 6.463 1.00 0.00 H new ATOM 0 HA THR A 310 9.264 -0.467 6.405 1.00 0.00 H new ATOM 0 HB THR A 310 11.191 0.736 8.435 1.00 0.00 H new ATOM 0 HG1 THR A 310 10.384 -1.148 9.713 1.00 0.00 H new ATOM 0 HG21 THR A 310 9.270 0.869 9.979 1.00 0.00 H new ATOM 0 HG22 THR A 310 9.047 1.889 8.537 1.00 0.00 H new ATOM 0 HG23 THR A 310 8.190 0.334 8.669 1.00 0.00 H new ATOM 1296 N VAL A 311 8.805 1.868 5.687 1.00 0.00 N ATOM 1297 CA VAL A 311 8.506 3.240 5.259 1.00 0.00 C ATOM 1298 C VAL A 311 6.995 3.437 5.132 1.00 0.00 C ATOM 1299 O VAL A 311 6.243 2.479 4.945 1.00 0.00 O ATOM 1300 CB VAL A 311 9.194 3.587 3.907 1.00 0.00 C ATOM 1301 CG1 VAL A 311 8.634 2.711 2.775 1.00 0.00 C ATOM 1302 CG2 VAL A 311 9.035 5.077 3.563 1.00 0.00 C ATOM 0 H VAL A 311 8.020 1.222 5.611 1.00 0.00 H new ATOM 0 HA VAL A 311 8.901 3.912 6.021 1.00 0.00 H new ATOM 0 HB VAL A 311 10.259 3.381 4.014 1.00 0.00 H new ATOM 0 HG11 VAL A 311 9.127 2.968 1.838 1.00 0.00 H new ATOM 0 HG12 VAL A 311 8.815 1.661 3.004 1.00 0.00 H new ATOM 0 HG13 VAL A 311 7.562 2.882 2.679 1.00 0.00 H new ATOM 0 HG21 VAL A 311 9.527 5.286 2.613 1.00 0.00 H new ATOM 0 HG22 VAL A 311 7.976 5.321 3.484 1.00 0.00 H new ATOM 0 HG23 VAL A 311 9.490 5.682 4.347 1.00 0.00 H new ATOM 1312 N THR A 312 6.562 4.678 5.254 1.00 0.00 N ATOM 1313 CA THR A 312 5.157 5.019 5.167 1.00 0.00 C ATOM 1314 C THR A 312 4.808 5.488 3.756 1.00 0.00 C ATOM 1315 O THR A 312 5.646 6.067 3.056 1.00 0.00 O ATOM 1316 CB THR A 312 4.834 6.139 6.189 1.00 0.00 C ATOM 1317 OG1 THR A 312 5.003 5.638 7.513 1.00 0.00 O ATOM 1318 CG2 THR A 312 3.421 6.736 6.026 1.00 0.00 C ATOM 0 H THR A 312 7.175 5.477 5.416 1.00 0.00 H new ATOM 0 HA THR A 312 4.563 4.134 5.395 1.00 0.00 H new ATOM 0 HB THR A 312 5.532 6.953 5.995 1.00 0.00 H new ATOM 0 HG1 THR A 312 4.179 5.779 8.024 1.00 0.00 H new ATOM 0 HG21 THR A 312 3.266 7.513 6.774 1.00 0.00 H new ATOM 0 HG22 THR A 312 3.321 7.167 5.030 1.00 0.00 H new ATOM 0 HG23 THR A 312 2.677 5.951 6.159 1.00 0.00 H new ATOM 1326 N LEU A 313 3.576 5.236 3.346 1.00 0.00 N ATOM 1327 CA LEU A 313 3.117 5.593 2.021 1.00 0.00 C ATOM 1328 C LEU A 313 1.987 6.605 2.103 1.00 0.00 C ATOM 1329 O LEU A 313 1.089 6.476 2.930 1.00 0.00 O ATOM 1330 CB LEU A 313 2.677 4.343 1.269 1.00 0.00 C ATOM 1331 CG LEU A 313 3.802 3.327 1.043 1.00 0.00 C ATOM 1332 CD1 LEU A 313 3.987 2.413 2.244 1.00 0.00 C ATOM 1333 CD2 LEU A 313 3.572 2.520 -0.220 1.00 0.00 C ATOM 0 H LEU A 313 2.870 4.779 3.923 1.00 0.00 H new ATOM 0 HA LEU A 313 3.939 6.054 1.474 1.00 0.00 H new ATOM 0 HB2 LEU A 313 1.872 3.862 1.824 1.00 0.00 H new ATOM 0 HB3 LEU A 313 2.267 4.637 0.303 1.00 0.00 H new ATOM 0 HG LEU A 313 4.724 3.895 0.917 1.00 0.00 H new ATOM 0 HD11 LEU A 313 4.794 1.708 2.044 1.00 0.00 H new ATOM 0 HD12 LEU A 313 4.237 3.010 3.121 1.00 0.00 H new ATOM 0 HD13 LEU A 313 3.063 1.865 2.430 1.00 0.00 H new ATOM 0 HD21 LEU A 313 4.388 1.809 -0.351 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.629 1.980 -0.140 1.00 0.00 H new ATOM 0 HD23 LEU A 313 3.534 3.191 -1.078 1.00 0.00 H new ATOM 1345 N SER A 314 2.038 7.617 1.251 1.00 0.00 N ATOM 1346 CA SER A 314 1.086 8.712 1.324 1.00 0.00 C ATOM 1347 C SER A 314 0.522 9.053 -0.051 1.00 0.00 C ATOM 1348 O SER A 314 1.270 9.179 -1.024 1.00 0.00 O ATOM 1349 CB SER A 314 1.771 9.941 1.922 1.00 0.00 C ATOM 1350 OG SER A 314 2.528 9.587 3.066 1.00 0.00 O ATOM 0 H SER A 314 2.727 7.702 0.503 1.00 0.00 H new ATOM 0 HA SER A 314 0.256 8.402 1.959 1.00 0.00 H new ATOM 0 HB2 SER A 314 2.422 10.399 1.177 1.00 0.00 H new ATOM 0 HB3 SER A 314 1.022 10.685 2.192 1.00 0.00 H new ATOM 0 HG SER A 314 3.366 9.163 2.786 1.00 0.00 H new ATOM 1632 N VAL A 333 -6.733 -4.283 6.592 1.00 0.00 N ATOM 1633 CA VAL A 333 -5.916 -5.058 5.669 1.00 0.00 C ATOM 1634 C VAL A 333 -5.139 -6.148 6.411 1.00 0.00 C ATOM 1635 O VAL A 333 -5.157 -6.211 7.641 1.00 0.00 O ATOM 1636 CB VAL A 333 -4.926 -4.147 4.919 1.00 0.00 C ATOM 1637 CG1 VAL A 333 -5.665 -3.187 3.999 1.00 0.00 C ATOM 1638 CG2 VAL A 333 -4.062 -3.380 5.906 1.00 0.00 C ATOM 0 HA VAL A 333 -6.587 -5.527 4.949 1.00 0.00 H new ATOM 0 HB VAL A 333 -4.280 -4.775 4.306 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -4.945 -2.554 3.480 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -6.242 -3.754 3.269 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -6.338 -2.564 4.588 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -3.367 -2.741 5.361 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -4.697 -2.765 6.544 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -3.501 -4.083 6.522 1.00 0.00 H new ATOM 1648 N GLU A 334 -4.476 -7.008 5.658 1.00 0.00 N ATOM 1649 CA GLU A 334 -3.706 -8.101 6.232 1.00 0.00 C ATOM 1650 C GLU A 334 -2.321 -8.172 5.594 1.00 0.00 C ATOM 1651 O GLU A 334 -2.162 -7.901 4.407 1.00 0.00 O ATOM 1652 CB GLU A 334 -4.442 -9.431 6.047 1.00 0.00 C ATOM 1653 CG GLU A 334 -3.699 -10.615 6.648 1.00 0.00 C ATOM 1654 CD GLU A 334 -4.531 -11.875 6.696 1.00 0.00 C ATOM 1655 OE1 GLU A 334 -5.102 -12.170 7.768 1.00 0.00 O ATOM 1656 OE2 GLU A 334 -4.601 -12.588 5.676 1.00 0.00 O1- ATOM 0 H GLU A 334 -4.455 -6.971 4.639 1.00 0.00 H new ATOM 0 HA GLU A 334 -3.589 -7.914 7.299 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -5.429 -9.359 6.504 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -4.596 -9.609 4.983 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -2.797 -10.804 6.065 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -3.378 -10.360 7.658 1.00 0.00 H new ATOM 1663 N ALA A 335 -1.327 -8.538 6.400 1.00 0.00 N ATOM 1664 CA ALA A 335 0.057 -8.620 5.943 1.00 0.00 C ATOM 1665 C ALA A 335 0.247 -9.742 4.925 1.00 0.00 C ATOM 1666 O ALA A 335 -0.483 -10.736 4.940 1.00 0.00 O ATOM 1667 CB ALA A 335 0.984 -8.833 7.129 1.00 0.00 C ATOM 0 H ALA A 335 -1.457 -8.784 7.381 1.00 0.00 H new ATOM 0 HA ALA A 335 0.303 -7.678 5.452 1.00 0.00 H new ATOM 0 HB1 ALA A 335 2.015 -8.893 6.779 1.00 0.00 H new ATOM 0 HB2 ALA A 335 0.884 -7.998 7.823 1.00 0.00 H new ATOM 0 HB3 ALA A 335 0.718 -9.760 7.636 1.00 0.00 H new ATOM 1673 N GLY A 336 1.250 -9.598 4.066 1.00 0.00 N ATOM 1674 CA GLY A 336 1.504 -10.590 3.039 1.00 0.00 C ATOM 1675 C GLY A 336 1.347 -10.022 1.643 1.00 0.00 C ATOM 1676 O GLY A 336 1.425 -10.751 0.652 1.00 0.00 O ATOM 0 H GLY A 336 1.895 -8.807 4.063 1.00 0.00 H new ATOM 0 HA2 GLY A 336 2.514 -10.983 3.158 1.00 0.00 H new ATOM 0 HA3 GLY A 336 0.818 -11.428 3.168 1.00 0.00 H new ATOM 1680 N ASP A 337 1.135 -8.715 1.568 1.00 0.00 N ATOM 1681 CA ASP A 337 0.913 -8.037 0.296 1.00 0.00 C ATOM 1682 C ASP A 337 2.189 -8.013 -0.547 1.00 0.00 C ATOM 1683 O ASP A 337 3.298 -8.171 -0.023 1.00 0.00 O ATOM 1684 CB ASP A 337 0.416 -6.611 0.537 1.00 0.00 C ATOM 1685 CG ASP A 337 -0.812 -6.561 1.430 1.00 0.00 C ATOM 1686 OD1 ASP A 337 -1.741 -7.374 1.222 1.00 0.00 O ATOM 1687 OD2 ASP A 337 -0.853 -5.707 2.335 1.00 0.00 O1- ATOM 0 H ASP A 337 1.112 -8.098 2.380 1.00 0.00 H new ATOM 0 HA ASP A 337 0.153 -8.592 -0.254 1.00 0.00 H new ATOM 0 HB2 ASP A 337 1.214 -6.024 0.991 1.00 0.00 H new ATOM 0 HB3 ASP A 337 0.183 -6.145 -0.421 1.00 0.00 H new ATOM 1692 N ALA A 338 2.025 -7.807 -1.849 1.00 0.00 N ATOM 1693 CA ALA A 338 3.144 -7.839 -2.786 1.00 0.00 C ATOM 1694 C ALA A 338 3.508 -6.433 -3.240 1.00 0.00 C ATOM 1695 O ALA A 338 2.630 -5.610 -3.516 1.00 0.00 O ATOM 1696 CB ALA A 338 2.805 -8.714 -3.987 1.00 0.00 C ATOM 0 H ALA A 338 1.122 -7.615 -2.283 1.00 0.00 H new ATOM 0 HA ALA A 338 4.006 -8.267 -2.275 1.00 0.00 H new ATOM 0 HB1 ALA A 338 3.649 -8.728 -4.677 1.00 0.00 H new ATOM 0 HB2 ALA A 338 2.595 -9.729 -3.650 1.00 0.00 H new ATOM 0 HB3 ALA A 338 1.928 -8.312 -4.494 1.00 0.00 H new ATOM 1702 N VAL A 339 4.804 -6.162 -3.324 1.00 0.00 N ATOM 1703 CA VAL A 339 5.284 -4.831 -3.650 1.00 0.00 C ATOM 1704 C VAL A 339 6.280 -4.871 -4.808 1.00 0.00 C ATOM 1705 O VAL A 339 7.039 -5.826 -4.961 1.00 0.00 O ATOM 1706 CB VAL A 339 5.953 -4.190 -2.405 1.00 0.00 C ATOM 1707 CG1 VAL A 339 6.625 -2.870 -2.751 1.00 0.00 C ATOM 1708 CG2 VAL A 339 4.919 -3.965 -1.318 1.00 0.00 C ATOM 0 H VAL A 339 5.541 -6.850 -3.170 1.00 0.00 H new ATOM 0 HA VAL A 339 4.429 -4.229 -3.956 1.00 0.00 H new ATOM 0 HB VAL A 339 6.719 -4.878 -2.048 1.00 0.00 H new ATOM 0 HG11 VAL A 339 7.083 -2.449 -1.856 1.00 0.00 H new ATOM 0 HG12 VAL A 339 7.393 -3.039 -3.506 1.00 0.00 H new ATOM 0 HG13 VAL A 339 5.881 -2.174 -3.139 1.00 0.00 H new ATOM 0 HG21 VAL A 339 5.398 -3.515 -0.448 1.00 0.00 H new ATOM 0 HG22 VAL A 339 4.140 -3.299 -1.689 1.00 0.00 H new ATOM 0 HG23 VAL A 339 4.475 -4.919 -1.035 1.00 0.00 H new ATOM 1718 N SER A 340 6.245 -3.841 -5.637 1.00 0.00 N ATOM 1719 CA SER A 340 7.235 -3.653 -6.685 1.00 0.00 C ATOM 1720 C SER A 340 7.494 -2.159 -6.855 1.00 0.00 C ATOM 1721 O SER A 340 6.845 -1.347 -6.204 1.00 0.00 O ATOM 1722 CB SER A 340 6.763 -4.295 -7.994 1.00 0.00 C ATOM 1723 OG SER A 340 6.478 -5.672 -7.804 1.00 0.00 O ATOM 0 H SER A 340 5.531 -3.113 -5.603 1.00 0.00 H new ATOM 0 HA SER A 340 8.168 -4.144 -6.406 1.00 0.00 H new ATOM 0 HB2 SER A 340 5.873 -3.781 -8.356 1.00 0.00 H new ATOM 0 HB3 SER A 340 7.531 -4.180 -8.759 1.00 0.00 H new ATOM 0 HG SER A 340 6.177 -6.064 -8.650 1.00 0.00 H new ATOM 1729 N VAL A 341 8.437 -1.789 -7.706 1.00 0.00 N ATOM 1730 CA VAL A 341 8.821 -0.387 -7.837 1.00 0.00 C ATOM 1731 C VAL A 341 8.513 0.160 -9.222 1.00 0.00 C ATOM 1732 O VAL A 341 8.989 -0.362 -10.227 1.00 0.00 O ATOM 1733 CB VAL A 341 10.326 -0.189 -7.546 1.00 0.00 C ATOM 1734 CG1 VAL A 341 10.740 1.260 -7.766 1.00 0.00 C ATOM 1735 CG2 VAL A 341 10.666 -0.633 -6.131 1.00 0.00 C ATOM 0 H VAL A 341 8.948 -2.430 -8.312 1.00 0.00 H new ATOM 0 HA VAL A 341 8.231 0.162 -7.103 1.00 0.00 H new ATOM 0 HB VAL A 341 10.886 -0.811 -8.245 1.00 0.00 H new ATOM 0 HG11 VAL A 341 11.803 1.371 -7.554 1.00 0.00 H new ATOM 0 HG12 VAL A 341 10.545 1.541 -8.801 1.00 0.00 H new ATOM 0 HG13 VAL A 341 10.168 1.907 -7.101 1.00 0.00 H new ATOM 0 HG21 VAL A 341 11.730 -0.484 -5.949 1.00 0.00 H new ATOM 0 HG22 VAL A 341 10.090 -0.045 -5.417 1.00 0.00 H new ATOM 0 HG23 VAL A 341 10.422 -1.689 -6.012 1.00 0.00 H new ATOM 1745 N VAL A 342 7.712 1.217 -9.261 1.00 0.00 N ATOM 1746 CA VAL A 342 7.445 1.925 -10.502 1.00 0.00 C ATOM 1747 C VAL A 342 8.550 2.941 -10.753 1.00 0.00 C ATOM 1748 O VAL A 342 9.030 3.092 -11.874 1.00 0.00 O ATOM 1749 CB VAL A 342 6.075 2.639 -10.474 1.00 0.00 C ATOM 1750 CG1 VAL A 342 5.816 3.371 -11.789 1.00 0.00 C ATOM 1751 CG2 VAL A 342 4.962 1.638 -10.196 1.00 0.00 C ATOM 0 H VAL A 342 7.236 1.602 -8.445 1.00 0.00 H new ATOM 0 HA VAL A 342 7.419 1.192 -11.308 1.00 0.00 H new ATOM 0 HB VAL A 342 6.091 3.376 -9.672 1.00 0.00 H new ATOM 0 HG11 VAL A 342 4.846 3.866 -11.745 1.00 0.00 H new ATOM 0 HG12 VAL A 342 6.596 4.115 -11.951 1.00 0.00 H new ATOM 0 HG13 VAL A 342 5.821 2.655 -12.611 1.00 0.00 H new ATOM 0 HG21 VAL A 342 4.003 2.156 -10.179 1.00 0.00 H new ATOM 0 HG22 VAL A 342 4.951 0.879 -10.978 1.00 0.00 H new ATOM 0 HG23 VAL A 342 5.134 1.161 -9.231 1.00 0.00 H new