USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=28 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 178:sc= 1.27 USER MOD Set 1.2: A 314 SER OG : rot 36:sc= 1.29 USER MOD Set 2.1: A 250 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 310 THR OG1 : rot 180:sc= -2.63! USER MOD Set 3.1: A 248 THR OG1 : rot 180:sc= 0.976 USER MOD Set 3.2: A 312 THR OG1 : rot -117:sc= -0.843! 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+ -167:sc= 1.22 (180deg=1.02) USER MOD Single : A 232 THR OG1 : rot -61:sc= 1.6 USER MOD Single : A 233 GLN : amide:sc= -1.5 K(o=-1.5,f=-3.6!) USER MOD Single : A 235 THR OG1 : rot 180:sc= 0 USER MOD Single : A 237 THR OG1 : rot 180:sc= 0.00448 USER MOD Single : A 238 TYR OH : rot 55:sc= 0.835 USER MOD Single : A 239 ASN : amide:sc= -0.824 K(o=-0.82,f=-5.8!) USER MOD Single : A 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : A 245 TYR OH : rot 180:sc= 0 USER MOD Single : A 246 GLN : amide:sc= -0.487 X(o=-0.49,f=-0.74) USER MOD Single : A 252 THR OG1 : rot 180:sc= -0.545 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0.113 USER MOD Single : A 257 SER OG : rot -42:sc= 0.466 USER MOD Single : A 259 THR OG1 : rot 180:sc= 0 USER MOD Single : A 263 LYS NZ :NH3+ -159:sc= 1.23 (180deg=1.18) USER MOD Single : A 267 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 269 LYS NZ :NH3+ 158:sc= -0.124 (180deg=-0.607) USER MOD Single : A 271 THR OG1 : rot 180:sc= 0 USER MOD Single : A 272 ASN : amide:sc= -0.291 X(o=-0.29,f=-0.032) USER MOD Single : A 292 SER OG : rot 33:sc= -1.41 USER MOD Single : A 294 THR OG1 : rot 180:sc= -0.0515 USER MOD Single : A 296 THR OG1 : rot 180:sc= -0.164 USER MOD Single : A 302 ASN : amide:sc= -2.13! C(o=-2.1!,f=-6.9!) USER MOD Single : A 303 SER OG : rot -93:sc= 1.33 USER MOD Single : A 305 SER OG : rot 180:sc=-0.00708 USER MOD Single : A 340 SER OG : rot 62:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 47 N GLY A 226 12.076 -4.388 -9.188 1.00 0.00 N ATOM 48 CA GLY A 226 11.891 -4.247 -7.760 1.00 0.00 C ATOM 49 C GLY A 226 10.850 -5.201 -7.222 1.00 0.00 C ATOM 50 O GLY A 226 9.727 -5.252 -7.720 1.00 0.00 O ATOM 0 HA2 GLY A 226 12.840 -4.424 -7.253 1.00 0.00 H new ATOM 0 HA3 GLY A 226 11.595 -3.223 -7.533 1.00 0.00 H new ATOM 54 N THR A 227 11.228 -5.964 -6.219 1.00 0.00 N ATOM 55 CA THR A 227 10.347 -6.955 -5.636 1.00 0.00 C ATOM 56 C THR A 227 10.446 -6.909 -4.119 1.00 0.00 C ATOM 57 O THR A 227 11.400 -7.420 -3.530 1.00 0.00 O ATOM 58 CB THR A 227 10.720 -8.367 -6.123 1.00 0.00 C ATOM 59 OG1 THR A 227 10.734 -8.403 -7.559 1.00 0.00 O ATOM 60 CG2 THR A 227 9.744 -9.409 -5.594 1.00 0.00 C ATOM 0 H THR A 227 12.150 -5.916 -5.786 1.00 0.00 H new ATOM 0 HA THR A 227 9.327 -6.729 -5.946 1.00 0.00 H new ATOM 0 HB THR A 227 11.713 -8.603 -5.741 1.00 0.00 H new ATOM 0 HG1 THR A 227 10.974 -9.304 -7.861 1.00 0.00 H new ATOM 0 HG21 THR A 227 10.034 -10.396 -5.955 1.00 0.00 H new ATOM 0 HG22 THR A 227 9.760 -9.402 -4.504 1.00 0.00 H new ATOM 0 HG23 THR A 227 8.738 -9.176 -5.943 1.00 0.00 H new ATOM 68 N LEU A 228 9.472 -6.287 -3.491 1.00 0.00 N ATOM 69 CA LEU A 228 9.461 -6.169 -2.052 1.00 0.00 C ATOM 70 C LEU A 228 8.219 -6.846 -1.494 1.00 0.00 C ATOM 71 O LEU A 228 7.378 -7.332 -2.248 1.00 0.00 O ATOM 72 CB LEU A 228 9.530 -4.700 -1.624 1.00 0.00 C ATOM 73 CG LEU A 228 10.700 -3.900 -2.257 1.00 0.00 C ATOM 74 CD1 LEU A 228 10.272 -3.104 -3.489 1.00 0.00 C ATOM 75 CD2 LEU A 228 11.330 -2.974 -1.228 1.00 0.00 C ATOM 0 H LEU A 228 8.675 -5.854 -3.958 1.00 0.00 H new ATOM 0 HA LEU A 228 10.342 -6.667 -1.648 1.00 0.00 H new ATOM 0 HB2 LEU A 228 8.590 -4.214 -1.886 1.00 0.00 H new ATOM 0 HB3 LEU A 228 9.621 -4.655 -0.539 1.00 0.00 H new ATOM 0 HG LEU A 228 11.437 -4.631 -2.588 1.00 0.00 H new ATOM 0 HD11 LEU A 228 11.130 -2.564 -3.890 1.00 0.00 H new ATOM 0 HD12 LEU A 228 9.886 -3.786 -4.247 1.00 0.00 H new ATOM 0 HD13 LEU A 228 9.494 -2.393 -3.211 1.00 0.00 H new ATOM 0 HD21 LEU A 228 12.148 -2.421 -1.689 1.00 0.00 H new ATOM 0 HD22 LEU A 228 10.580 -2.273 -0.861 1.00 0.00 H new ATOM 0 HD23 LEU A 228 11.714 -3.563 -0.395 1.00 0.00 H new ATOM 87 N THR A 229 8.110 -6.887 -0.185 1.00 0.00 N ATOM 88 CA THR A 229 7.037 -7.609 0.467 1.00 0.00 C ATOM 89 C THR A 229 6.494 -6.798 1.645 1.00 0.00 C ATOM 90 O THR A 229 7.169 -5.915 2.160 1.00 0.00 O ATOM 91 CB THR A 229 7.567 -8.970 0.955 1.00 0.00 C ATOM 92 OG1 THR A 229 8.122 -9.699 -0.151 1.00 0.00 O ATOM 93 CG2 THR A 229 6.487 -9.815 1.622 1.00 0.00 C ATOM 0 H THR A 229 8.756 -6.425 0.455 1.00 0.00 H new ATOM 0 HA THR A 229 6.225 -7.770 -0.242 1.00 0.00 H new ATOM 0 HB THR A 229 8.333 -8.765 1.703 1.00 0.00 H new ATOM 0 HG1 THR A 229 8.460 -10.564 0.163 1.00 0.00 H new ATOM 0 HG21 THR A 229 6.916 -10.763 1.947 1.00 0.00 H new ATOM 0 HG22 THR A 229 6.090 -9.282 2.486 1.00 0.00 H new ATOM 0 HG23 THR A 229 5.683 -10.005 0.911 1.00 0.00 H new ATOM 101 N VAL A 230 5.272 -7.090 2.052 1.00 0.00 N ATOM 102 CA VAL A 230 4.653 -6.416 3.183 1.00 0.00 C ATOM 103 C VAL A 230 4.527 -7.385 4.354 1.00 0.00 C ATOM 104 O VAL A 230 3.690 -8.289 4.331 1.00 0.00 O ATOM 105 CB VAL A 230 3.259 -5.859 2.813 1.00 0.00 C ATOM 106 CG1 VAL A 230 2.603 -5.204 4.019 1.00 0.00 C ATOM 107 CG2 VAL A 230 3.369 -4.855 1.670 1.00 0.00 C ATOM 0 H VAL A 230 4.682 -7.796 1.612 1.00 0.00 H new ATOM 0 HA VAL A 230 5.288 -5.577 3.466 1.00 0.00 H new ATOM 0 HB VAL A 230 2.637 -6.694 2.489 1.00 0.00 H new ATOM 0 HG11 VAL A 230 1.623 -4.819 3.736 1.00 0.00 H new ATOM 0 HG12 VAL A 230 2.488 -5.940 4.815 1.00 0.00 H new ATOM 0 HG13 VAL A 230 3.227 -4.383 4.372 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.378 -4.474 1.424 1.00 0.00 H new ATOM 0 HG22 VAL A 230 4.011 -4.028 1.973 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.797 -5.345 0.795 1.00 0.00 H new ATOM 117 N LYS A 231 5.362 -7.200 5.372 1.00 0.00 N ATOM 118 CA LYS A 231 5.416 -8.144 6.483 1.00 0.00 C ATOM 119 C LYS A 231 4.495 -7.706 7.619 1.00 0.00 C ATOM 120 O LYS A 231 4.217 -8.474 8.542 1.00 0.00 O ATOM 121 CB LYS A 231 6.857 -8.287 6.991 1.00 0.00 C ATOM 122 CG LYS A 231 7.332 -7.122 7.847 1.00 0.00 C ATOM 123 CD LYS A 231 8.803 -7.239 8.216 1.00 0.00 C ATOM 124 CE LYS A 231 9.139 -8.611 8.782 1.00 0.00 C ATOM 125 NZ LYS A 231 10.507 -8.654 9.366 1.00 0.00 N1+ ATOM 0 H LYS A 231 6.005 -6.412 5.451 1.00 0.00 H new ATOM 0 HA LYS A 231 5.072 -9.113 6.122 1.00 0.00 H new ATOM 0 HB2 LYS A 231 6.937 -9.206 7.571 1.00 0.00 H new ATOM 0 HB3 LYS A 231 7.524 -8.391 6.135 1.00 0.00 H new ATOM 0 HG2 LYS A 231 7.168 -6.188 7.309 1.00 0.00 H new ATOM 0 HG3 LYS A 231 6.734 -7.075 8.757 1.00 0.00 H new ATOM 0 HD2 LYS A 231 9.415 -7.051 7.334 1.00 0.00 H new ATOM 0 HD3 LYS A 231 9.056 -6.472 8.949 1.00 0.00 H new ATOM 0 HE2 LYS A 231 8.410 -8.876 9.548 1.00 0.00 H new ATOM 0 HE3 LYS A 231 9.058 -9.358 7.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 10.780 -9.643 9.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 11.181 -8.219 8.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 10.517 -8.131 10.265 1.00 0.00 H new ATOM 139 N THR A 232 4.025 -6.471 7.542 1.00 0.00 N ATOM 140 CA THR A 232 3.147 -5.915 8.558 1.00 0.00 C ATOM 141 C THR A 232 1.852 -5.426 7.927 1.00 0.00 C ATOM 142 O THR A 232 1.555 -5.744 6.780 1.00 0.00 O ATOM 143 CB THR A 232 3.815 -4.760 9.323 1.00 0.00 C ATOM 144 OG1 THR A 232 4.335 -3.806 8.396 1.00 0.00 O ATOM 145 CG2 THR A 232 4.930 -5.271 10.223 1.00 0.00 C ATOM 0 H THR A 232 4.240 -5.830 6.778 1.00 0.00 H new ATOM 0 HA THR A 232 2.931 -6.712 9.270 1.00 0.00 H new ATOM 0 HB THR A 232 3.063 -4.285 9.953 1.00 0.00 H new ATOM 0 HG1 THR A 232 5.013 -4.234 7.833 1.00 0.00 H new ATOM 0 HG21 THR A 232 5.384 -4.433 10.751 1.00 0.00 H new ATOM 0 HG22 THR A 232 4.520 -5.976 10.946 1.00 0.00 H new ATOM 0 HG23 THR A 232 5.686 -5.771 9.618 1.00 0.00 H new ATOM 153 N GLN A 233 1.084 -4.665 8.681 1.00 0.00 N ATOM 154 CA GLN A 233 -0.241 -4.262 8.258 1.00 0.00 C ATOM 155 C GLN A 233 -0.277 -2.758 8.005 1.00 0.00 C ATOM 156 O GLN A 233 0.020 -1.969 8.902 1.00 0.00 O ATOM 157 CB GLN A 233 -1.261 -4.654 9.327 1.00 0.00 C ATOM 158 CG GLN A 233 -1.214 -6.131 9.697 1.00 0.00 C ATOM 159 CD GLN A 233 -1.969 -6.439 10.971 1.00 0.00 C ATOM 160 OE1 GLN A 233 -3.151 -6.777 10.950 1.00 0.00 O ATOM 161 NE2 GLN A 233 -1.288 -6.316 12.092 1.00 0.00 N ATOM 0 H GLN A 233 1.359 -4.311 9.597 1.00 0.00 H new ATOM 0 HA GLN A 233 -0.494 -4.770 7.328 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.085 -4.057 10.222 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.262 -4.408 8.971 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -1.633 -6.719 8.880 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -0.175 -6.439 9.812 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -0.308 -6.033 12.065 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -1.740 -6.504 12.987 1.00 0.00 H new ATOM 170 N PRO A 234 -0.622 -2.347 6.777 1.00 0.00 N ATOM 171 CA PRO A 234 -0.679 -0.934 6.396 1.00 0.00 C ATOM 172 C PRO A 234 -1.848 -0.217 7.054 1.00 0.00 C ATOM 173 O PRO A 234 -3.010 -0.513 6.770 1.00 0.00 O ATOM 174 CB PRO A 234 -0.872 -0.966 4.870 1.00 0.00 C ATOM 175 CG PRO A 234 -0.665 -2.387 4.462 1.00 0.00 C ATOM 176 CD PRO A 234 -1.002 -3.219 5.661 1.00 0.00 C ATOM 0 HA PRO A 234 0.216 -0.396 6.709 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -1.869 -0.622 4.595 1.00 0.00 H new ATOM 0 HB3 PRO A 234 -0.159 -0.309 4.372 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -1.302 -2.646 3.617 1.00 0.00 H new ATOM 0 HG3 PRO A 234 0.365 -2.556 4.148 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -2.061 -3.476 5.691 1.00 0.00 H new ATOM 0 HD3 PRO A 234 -0.446 -4.156 5.672 1.00 0.00 H new ATOM 184 N THR A 235 -1.549 0.716 7.945 1.00 0.00 N ATOM 185 CA THR A 235 -2.602 1.441 8.631 1.00 0.00 C ATOM 186 C THR A 235 -2.213 2.886 8.955 1.00 0.00 C ATOM 187 O THR A 235 -1.314 3.152 9.752 1.00 0.00 O ATOM 188 CB THR A 235 -3.050 0.698 9.913 1.00 0.00 C ATOM 189 OG1 THR A 235 -4.109 1.419 10.559 1.00 0.00 O ATOM 190 CG2 THR A 235 -1.889 0.499 10.889 1.00 0.00 C ATOM 0 H THR A 235 -0.600 0.985 8.206 1.00 0.00 H new ATOM 0 HA THR A 235 -3.444 1.485 7.940 1.00 0.00 H new ATOM 0 HB THR A 235 -3.408 -0.287 9.613 1.00 0.00 H new ATOM 0 HG1 THR A 235 -4.386 0.939 11.368 1.00 0.00 H new ATOM 0 HG21 THR A 235 -2.245 -0.026 11.775 1.00 0.00 H new ATOM 0 HG22 THR A 235 -1.107 -0.089 10.409 1.00 0.00 H new ATOM 0 HG23 THR A 235 -1.487 1.470 11.179 1.00 0.00 H new ATOM 198 N VAL A 236 -2.847 3.799 8.234 1.00 0.00 N ATOM 199 CA VAL A 236 -2.888 5.216 8.569 1.00 0.00 C ATOM 200 C VAL A 236 -4.138 5.815 7.899 1.00 0.00 C ATOM 201 O VAL A 236 -4.838 5.086 7.199 1.00 0.00 O ATOM 202 CB VAL A 236 -1.543 5.963 8.249 1.00 0.00 C ATOM 203 CG1 VAL A 236 -1.731 7.329 7.615 1.00 0.00 C ATOM 204 CG2 VAL A 236 -0.754 6.143 9.531 1.00 0.00 C ATOM 0 H VAL A 236 -3.358 3.571 7.381 1.00 0.00 H new ATOM 0 HA VAL A 236 -2.977 5.350 9.647 1.00 0.00 H new ATOM 0 HB VAL A 236 -1.017 5.340 7.525 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -0.757 7.779 7.425 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -2.271 7.222 6.674 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -2.301 7.968 8.290 1.00 0.00 H new ATOM 0 HG21 VAL A 236 0.180 6.661 9.314 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -1.339 6.731 10.239 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -0.535 5.167 9.964 1.00 0.00 H new ATOM 214 N THR A 237 -4.442 7.077 8.161 1.00 0.00 N ATOM 215 CA THR A 237 -5.664 7.725 7.706 1.00 0.00 C ATOM 216 C THR A 237 -6.053 7.359 6.266 1.00 0.00 C ATOM 217 O THR A 237 -5.301 7.600 5.320 1.00 0.00 O ATOM 218 CB THR A 237 -5.493 9.250 7.805 1.00 0.00 C ATOM 219 OG1 THR A 237 -5.127 9.608 9.144 1.00 0.00 O ATOM 220 CG2 THR A 237 -6.769 9.978 7.408 1.00 0.00 C ATOM 0 H THR A 237 -3.836 7.691 8.705 1.00 0.00 H new ATOM 0 HA THR A 237 -6.467 7.370 8.352 1.00 0.00 H new ATOM 0 HB THR A 237 -4.705 9.549 7.114 1.00 0.00 H new ATOM 0 HG1 THR A 237 -5.017 10.580 9.204 1.00 0.00 H new ATOM 0 HG21 THR A 237 -6.614 11.054 7.489 1.00 0.00 H new ATOM 0 HG22 THR A 237 -7.027 9.725 6.380 1.00 0.00 H new ATOM 0 HG23 THR A 237 -7.581 9.677 8.071 1.00 0.00 H new ATOM 228 N TYR A 238 -7.228 6.756 6.123 1.00 0.00 N ATOM 229 CA TYR A 238 -7.819 6.512 4.815 1.00 0.00 C ATOM 230 C TYR A 238 -9.072 7.369 4.670 1.00 0.00 C ATOM 231 O TYR A 238 -10.191 6.892 4.882 1.00 0.00 O ATOM 232 CB TYR A 238 -8.200 5.021 4.650 1.00 0.00 C ATOM 233 CG TYR A 238 -7.043 4.095 4.374 1.00 0.00 C ATOM 234 CD1 TYR A 238 -6.533 3.966 3.094 1.00 0.00 C ATOM 235 CD2 TYR A 238 -6.481 3.329 5.383 1.00 0.00 C ATOM 236 CE1 TYR A 238 -5.495 3.102 2.823 1.00 0.00 C ATOM 237 CE2 TYR A 238 -5.437 2.466 5.124 1.00 0.00 C ATOM 238 CZ TYR A 238 -4.948 2.354 3.842 1.00 0.00 C ATOM 239 OH TYR A 238 -3.914 1.486 3.574 1.00 0.00 O ATOM 0 H TYR A 238 -7.793 6.425 6.905 1.00 0.00 H new ATOM 0 HA TYR A 238 -7.090 6.770 4.047 1.00 0.00 H new ATOM 0 HB2 TYR A 238 -8.704 4.688 5.557 1.00 0.00 H new ATOM 0 HB3 TYR A 238 -8.919 4.933 3.835 1.00 0.00 H new ATOM 0 HD1 TYR A 238 -6.957 4.554 2.293 1.00 0.00 H new ATOM 0 HD2 TYR A 238 -6.867 3.409 6.388 1.00 0.00 H new ATOM 0 HE1 TYR A 238 -5.112 3.012 1.817 1.00 0.00 H new ATOM 0 HE2 TYR A 238 -5.005 1.881 5.923 1.00 0.00 H new ATOM 0 HH TYR A 238 -3.185 1.972 3.135 1.00 0.00 H new ATOM 249 N ASN A 239 -8.889 8.625 4.299 1.00 0.00 N ATOM 250 CA ASN A 239 -9.992 9.565 4.242 1.00 0.00 C ATOM 251 C ASN A 239 -10.215 10.000 2.803 1.00 0.00 C ATOM 252 O ASN A 239 -9.268 10.275 2.074 1.00 0.00 O ATOM 253 CB ASN A 239 -9.708 10.772 5.142 1.00 0.00 C ATOM 254 CG ASN A 239 -10.960 11.554 5.493 1.00 0.00 C ATOM 255 OD1 ASN A 239 -11.881 11.684 4.685 1.00 0.00 O ATOM 256 ND2 ASN A 239 -11.009 12.074 6.712 1.00 0.00 N ATOM 0 H ASN A 239 -7.985 9.016 4.033 1.00 0.00 H new ATOM 0 HA ASN A 239 -10.899 9.082 4.605 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -9.230 10.430 6.060 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -9.001 11.434 4.642 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -11.829 12.603 7.008 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -10.226 11.945 7.353 1.00 0.00 H new ATOM 263 N ALA A 240 -11.466 10.058 2.398 1.00 0.00 N ATOM 264 CA ALA A 240 -11.796 10.288 1.002 1.00 0.00 C ATOM 265 C ALA A 240 -12.328 11.694 0.778 1.00 0.00 C ATOM 266 O ALA A 240 -11.917 12.373 -0.159 1.00 0.00 O ATOM 267 CB ALA A 240 -12.790 9.248 0.520 1.00 0.00 C ATOM 0 H ALA A 240 -12.273 9.950 3.013 1.00 0.00 H new ATOM 0 HA ALA A 240 -10.880 10.192 0.418 1.00 0.00 H new ATOM 0 HB1 ALA A 240 -13.029 9.431 -0.528 1.00 0.00 H new ATOM 0 HB2 ALA A 240 -12.356 8.254 0.624 1.00 0.00 H new ATOM 0 HB3 ALA A 240 -13.700 9.311 1.116 1.00 0.00 H new ATOM 273 N VAL A 241 -13.231 12.135 1.647 1.00 0.00 N ATOM 274 CA VAL A 241 -13.776 13.487 1.560 1.00 0.00 C ATOM 275 C VAL A 241 -12.667 14.514 1.785 1.00 0.00 C ATOM 276 O VAL A 241 -12.716 15.633 1.270 1.00 0.00 O ATOM 277 CB VAL A 241 -14.910 13.705 2.595 1.00 0.00 C ATOM 278 CG1 VAL A 241 -15.498 15.109 2.489 1.00 0.00 C ATOM 279 CG2 VAL A 241 -16.006 12.660 2.425 1.00 0.00 C ATOM 0 H VAL A 241 -13.601 11.579 2.418 1.00 0.00 H new ATOM 0 HA VAL A 241 -14.196 13.616 0.562 1.00 0.00 H new ATOM 0 HB VAL A 241 -14.473 13.595 3.588 1.00 0.00 H new ATOM 0 HG11 VAL A 241 -16.290 15.229 3.228 1.00 0.00 H new ATOM 0 HG12 VAL A 241 -14.716 15.846 2.673 1.00 0.00 H new ATOM 0 HG13 VAL A 241 -15.909 15.257 1.490 1.00 0.00 H new ATOM 0 HG21 VAL A 241 -16.791 12.833 3.162 1.00 0.00 H new ATOM 0 HG22 VAL A 241 -16.427 12.734 1.422 1.00 0.00 H new ATOM 0 HG23 VAL A 241 -15.585 11.665 2.569 1.00 0.00 H new ATOM 289 N LYS A 242 -11.657 14.111 2.543 1.00 0.00 N ATOM 290 CA LYS A 242 -10.516 14.970 2.828 1.00 0.00 C ATOM 291 C LYS A 242 -9.384 14.708 1.848 1.00 0.00 C ATOM 292 O LYS A 242 -8.374 15.412 1.832 1.00 0.00 O ATOM 293 CB LYS A 242 -10.031 14.718 4.248 1.00 0.00 C ATOM 294 CG LYS A 242 -11.119 14.910 5.286 1.00 0.00 C ATOM 295 CD LYS A 242 -11.478 16.376 5.472 1.00 0.00 C ATOM 296 CE LYS A 242 -10.265 17.214 5.853 1.00 0.00 C ATOM 297 NZ LYS A 242 -10.624 18.637 6.090 1.00 0.00 N1+ ATOM 0 H LYS A 242 -11.605 13.188 2.974 1.00 0.00 H new ATOM 0 HA LYS A 242 -10.830 16.009 2.724 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -9.643 13.702 4.319 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -9.203 15.391 4.468 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -12.008 14.355 4.986 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -10.789 14.494 6.238 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -11.912 16.763 4.550 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -12.240 16.468 6.246 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -9.807 16.801 6.752 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -9.520 17.155 5.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -9.770 19.172 6.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -11.038 19.039 5.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -11.316 18.696 6.864 1.00 0.00 H new ATOM 311 N ASP A 243 -9.586 13.670 1.046 1.00 0.00 N ATOM 312 CA ASP A 243 -8.619 13.224 0.042 1.00 0.00 C ATOM 313 C ASP A 243 -7.275 12.918 0.670 1.00 0.00 C ATOM 314 O ASP A 243 -6.265 13.535 0.338 1.00 0.00 O ATOM 315 CB ASP A 243 -8.444 14.264 -1.071 1.00 0.00 C ATOM 316 CG ASP A 243 -9.667 14.403 -1.947 1.00 0.00 C ATOM 317 OD1 ASP A 243 -10.468 15.330 -1.714 1.00 0.00 O ATOM 318 OD2 ASP A 243 -9.828 13.591 -2.882 1.00 0.00 O1- ATOM 0 H ASP A 243 -10.435 13.105 1.072 1.00 0.00 H new ATOM 0 HA ASP A 243 -9.018 12.309 -0.397 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -8.212 15.231 -0.624 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -7.591 13.986 -1.689 1.00 0.00 H new ATOM 323 N SER A 244 -7.260 11.957 1.570 1.00 0.00 N ATOM 324 CA SER A 244 -6.034 11.591 2.244 1.00 0.00 C ATOM 325 C SER A 244 -6.003 10.096 2.492 1.00 0.00 C ATOM 326 O SER A 244 -6.551 9.595 3.470 1.00 0.00 O ATOM 327 CB SER A 244 -5.904 12.342 3.564 1.00 0.00 C ATOM 328 OG SER A 244 -4.577 12.285 4.066 1.00 0.00 O ATOM 0 H SER A 244 -8.079 11.418 1.850 1.00 0.00 H new ATOM 0 HA SER A 244 -5.194 11.863 1.606 1.00 0.00 H new ATOM 0 HB2 SER A 244 -6.196 13.382 3.422 1.00 0.00 H new ATOM 0 HB3 SER A 244 -6.590 11.915 4.296 1.00 0.00 H new ATOM 0 HG SER A 244 -4.526 12.777 4.912 1.00 0.00 H new ATOM 334 N TYR A 245 -5.362 9.398 1.589 1.00 0.00 N ATOM 335 CA TYR A 245 -5.159 7.969 1.720 1.00 0.00 C ATOM 336 C TYR A 245 -3.702 7.707 2.017 1.00 0.00 C ATOM 337 O TYR A 245 -2.854 7.760 1.125 1.00 0.00 O ATOM 338 CB TYR A 245 -5.551 7.257 0.434 1.00 0.00 C ATOM 339 CG TYR A 245 -6.901 6.570 0.459 1.00 0.00 C ATOM 340 CD1 TYR A 245 -8.035 7.199 0.962 1.00 0.00 C ATOM 341 CD2 TYR A 245 -7.037 5.283 -0.045 1.00 0.00 C ATOM 342 CE1 TYR A 245 -9.263 6.560 0.963 1.00 0.00 C ATOM 343 CE2 TYR A 245 -8.256 4.640 -0.045 1.00 0.00 C ATOM 344 CZ TYR A 245 -9.365 5.280 0.458 1.00 0.00 C ATOM 345 OH TYR A 245 -10.580 4.636 0.453 1.00 0.00 O ATOM 0 H TYR A 245 -4.964 9.800 0.740 1.00 0.00 H new ATOM 0 HA TYR A 245 -5.781 7.591 2.531 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -5.546 7.983 -0.379 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -4.788 6.514 0.203 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -7.956 8.201 1.358 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -6.171 4.776 -0.445 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -10.136 7.060 1.357 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -8.340 3.638 -0.438 1.00 0.00 H new ATOM 0 HH TYR A 245 -10.476 3.743 0.062 1.00 0.00 H new ATOM 355 N GLN A 246 -3.409 7.449 3.267 1.00 0.00 N ATOM 356 CA GLN A 246 -2.046 7.220 3.681 1.00 0.00 C ATOM 357 C GLN A 246 -1.975 5.943 4.501 1.00 0.00 C ATOM 358 O GLN A 246 -2.979 5.509 5.060 1.00 0.00 O ATOM 359 CB GLN A 246 -1.540 8.413 4.497 1.00 0.00 C ATOM 360 CG GLN A 246 -1.767 9.762 3.835 1.00 0.00 C ATOM 361 CD GLN A 246 -1.256 10.914 4.675 1.00 0.00 C ATOM 362 OE1 GLN A 246 -1.224 10.840 5.906 1.00 0.00 O ATOM 363 NE2 GLN A 246 -0.855 11.990 4.019 1.00 0.00 N ATOM 0 H GLN A 246 -4.097 7.392 4.018 1.00 0.00 H new ATOM 0 HA GLN A 246 -1.411 7.111 2.802 1.00 0.00 H new ATOM 0 HB2 GLN A 246 -2.034 8.410 5.469 1.00 0.00 H new ATOM 0 HB3 GLN A 246 -0.473 8.286 4.681 1.00 0.00 H new ATOM 0 HG2 GLN A 246 -1.270 9.775 2.865 1.00 0.00 H new ATOM 0 HG3 GLN A 246 -2.832 9.897 3.649 1.00 0.00 H new ATOM 0 HE21 GLN A 246 -0.898 12.011 3.000 1.00 0.00 H new ATOM 0 HE22 GLN A 246 -0.503 12.798 4.532 1.00 0.00 H new ATOM 372 N PHE A 247 -0.808 5.326 4.556 1.00 0.00 N ATOM 373 CA PHE A 247 -0.625 4.136 5.364 1.00 0.00 C ATOM 374 C PHE A 247 0.842 3.920 5.722 1.00 0.00 C ATOM 375 O PHE A 247 1.720 4.076 4.879 1.00 0.00 O ATOM 376 CB PHE A 247 -1.195 2.896 4.678 1.00 0.00 C ATOM 377 CG PHE A 247 -0.835 2.737 3.225 1.00 0.00 C ATOM 378 CD1 PHE A 247 -1.597 3.339 2.237 1.00 0.00 C ATOM 379 CD2 PHE A 247 0.240 1.954 2.848 1.00 0.00 C ATOM 380 CE1 PHE A 247 -1.291 3.160 0.904 1.00 0.00 C ATOM 381 CE2 PHE A 247 0.552 1.777 1.519 1.00 0.00 C ATOM 382 CZ PHE A 247 -0.215 2.377 0.547 1.00 0.00 C ATOM 0 H PHE A 247 0.025 5.629 4.051 1.00 0.00 H new ATOM 0 HA PHE A 247 -1.179 4.295 6.289 1.00 0.00 H new ATOM 0 HB2 PHE A 247 -0.852 2.013 5.218 1.00 0.00 H new ATOM 0 HB3 PHE A 247 -2.281 2.921 4.765 1.00 0.00 H new ATOM 0 HD1 PHE A 247 -2.440 3.955 2.513 1.00 0.00 H new ATOM 0 HD2 PHE A 247 0.843 1.475 3.606 1.00 0.00 H new ATOM 0 HE1 PHE A 247 -1.893 3.632 0.142 1.00 0.00 H new ATOM 0 HE2 PHE A 247 1.399 1.167 1.239 1.00 0.00 H new ATOM 0 HZ PHE A 247 0.026 2.234 -0.496 1.00 0.00 H new ATOM 392 N THR A 248 1.109 3.561 6.973 1.00 0.00 N ATOM 393 CA THR A 248 2.465 3.289 7.414 1.00 0.00 C ATOM 394 C THR A 248 2.681 1.791 7.462 1.00 0.00 C ATOM 395 O THR A 248 1.827 1.058 7.971 1.00 0.00 O ATOM 396 CB THR A 248 2.712 3.880 8.821 1.00 0.00 C ATOM 397 OG1 THR A 248 2.689 5.312 8.769 1.00 0.00 O ATOM 398 CG2 THR A 248 4.032 3.404 9.415 1.00 0.00 C ATOM 0 H THR A 248 0.400 3.452 7.698 1.00 0.00 H new ATOM 0 HA THR A 248 3.160 3.750 6.712 1.00 0.00 H new ATOM 0 HB THR A 248 1.909 3.526 9.468 1.00 0.00 H new ATOM 0 HG1 THR A 248 2.845 5.674 9.666 1.00 0.00 H new ATOM 0 HG21 THR A 248 4.166 3.843 10.404 1.00 0.00 H new ATOM 0 HG22 THR A 248 4.022 2.317 9.499 1.00 0.00 H new ATOM 0 HG23 THR A 248 4.854 3.711 8.768 1.00 0.00 H new ATOM 406 N VAL A 249 3.795 1.319 6.922 1.00 0.00 N ATOM 407 CA VAL A 249 4.021 -0.121 6.878 1.00 0.00 C ATOM 408 C VAL A 249 5.485 -0.476 7.130 1.00 0.00 C ATOM 409 O VAL A 249 6.394 0.279 6.792 1.00 0.00 O ATOM 410 CB VAL A 249 3.604 -0.738 5.518 1.00 0.00 C ATOM 411 CG1 VAL A 249 3.037 -2.135 5.710 1.00 0.00 C ATOM 412 CG2 VAL A 249 2.619 0.142 4.764 1.00 0.00 C ATOM 0 H VAL A 249 4.537 1.891 6.519 1.00 0.00 H new ATOM 0 HA VAL A 249 3.399 -0.536 7.671 1.00 0.00 H new ATOM 0 HB VAL A 249 4.506 -0.807 4.909 1.00 0.00 H new ATOM 0 HG11 VAL A 249 2.751 -2.548 4.743 1.00 0.00 H new ATOM 0 HG12 VAL A 249 3.792 -2.774 6.169 1.00 0.00 H new ATOM 0 HG13 VAL A 249 2.161 -2.086 6.357 1.00 0.00 H new ATOM 0 HG21 VAL A 249 2.357 -0.333 3.818 1.00 0.00 H new ATOM 0 HG22 VAL A 249 1.719 0.277 5.364 1.00 0.00 H new ATOM 0 HG23 VAL A 249 3.074 1.113 4.569 1.00 0.00 H new ATOM 422 N THR A 250 5.698 -1.625 7.742 1.00 0.00 N ATOM 423 CA THR A 250 7.008 -2.231 7.815 1.00 0.00 C ATOM 424 C THR A 250 7.098 -3.305 6.734 1.00 0.00 C ATOM 425 O THR A 250 6.396 -4.323 6.791 1.00 0.00 O ATOM 426 CB THR A 250 7.244 -2.858 9.201 1.00 0.00 C ATOM 427 OG1 THR A 250 7.020 -1.872 10.220 1.00 0.00 O ATOM 428 CG2 THR A 250 8.653 -3.419 9.326 1.00 0.00 C ATOM 0 H THR A 250 4.964 -2.163 8.203 1.00 0.00 H new ATOM 0 HA THR A 250 7.772 -1.470 7.659 1.00 0.00 H new ATOM 0 HB THR A 250 6.543 -3.683 9.324 1.00 0.00 H new ATOM 0 HG1 THR A 250 7.169 -2.273 11.102 1.00 0.00 H new ATOM 0 HG21 THR A 250 8.785 -3.854 10.317 1.00 0.00 H new ATOM 0 HG22 THR A 250 8.807 -4.188 8.569 1.00 0.00 H new ATOM 0 HG23 THR A 250 9.378 -2.618 9.182 1.00 0.00 H new ATOM 436 N LEU A 251 7.926 -3.072 5.736 1.00 0.00 N ATOM 437 CA LEU A 251 7.969 -3.942 4.580 1.00 0.00 C ATOM 438 C LEU A 251 9.225 -4.789 4.629 1.00 0.00 C ATOM 439 O LEU A 251 10.119 -4.558 5.443 1.00 0.00 O ATOM 440 CB LEU A 251 7.934 -3.122 3.273 1.00 0.00 C ATOM 441 CG LEU A 251 6.674 -2.279 3.023 1.00 0.00 C ATOM 442 CD1 LEU A 251 6.683 -1.002 3.851 1.00 0.00 C ATOM 443 CD2 LEU A 251 6.563 -1.937 1.548 1.00 0.00 C ATOM 0 H LEU A 251 8.578 -2.288 5.703 1.00 0.00 H new ATOM 0 HA LEU A 251 7.092 -4.590 4.598 1.00 0.00 H new ATOM 0 HB2 LEU A 251 8.797 -2.456 3.266 1.00 0.00 H new ATOM 0 HB3 LEU A 251 8.055 -3.810 2.436 1.00 0.00 H new ATOM 0 HG LEU A 251 5.810 -2.871 3.327 1.00 0.00 H new ATOM 0 HD11 LEU A 251 5.777 -0.431 3.649 1.00 0.00 H new ATOM 0 HD12 LEU A 251 6.723 -1.256 4.910 1.00 0.00 H new ATOM 0 HD13 LEU A 251 7.555 -0.404 3.588 1.00 0.00 H new ATOM 0 HD21 LEU A 251 5.667 -1.339 1.379 1.00 0.00 H new ATOM 0 HD22 LEU A 251 7.441 -1.370 1.239 1.00 0.00 H new ATOM 0 HD23 LEU A 251 6.501 -2.856 0.965 1.00 0.00 H new ATOM 455 N THR A 252 9.269 -5.786 3.785 1.00 0.00 N ATOM 456 CA THR A 252 10.440 -6.602 3.634 1.00 0.00 C ATOM 457 C THR A 252 11.027 -6.413 2.236 1.00 0.00 C ATOM 458 O THR A 252 10.295 -6.153 1.280 1.00 0.00 O ATOM 459 CB THR A 252 10.092 -8.071 3.869 1.00 0.00 C ATOM 460 OG1 THR A 252 8.663 -8.223 3.969 1.00 0.00 O ATOM 461 CG2 THR A 252 10.758 -8.595 5.138 1.00 0.00 C ATOM 0 H THR A 252 8.491 -6.054 3.182 1.00 0.00 H new ATOM 0 HA THR A 252 11.182 -6.299 4.372 1.00 0.00 H new ATOM 0 HB THR A 252 10.463 -8.651 3.024 1.00 0.00 H new ATOM 0 HG1 THR A 252 8.444 -9.167 4.118 1.00 0.00 H new ATOM 0 HG21 THR A 252 10.494 -9.643 5.282 1.00 0.00 H new ATOM 0 HG22 THR A 252 11.840 -8.503 5.046 1.00 0.00 H new ATOM 0 HG23 THR A 252 10.416 -8.014 5.995 1.00 0.00 H new ATOM 469 N GLY A 253 12.338 -6.533 2.124 1.00 0.00 N ATOM 470 CA GLY A 253 13.011 -6.277 0.871 1.00 0.00 C ATOM 471 C GLY A 253 14.193 -7.198 0.670 1.00 0.00 C ATOM 472 O GLY A 253 14.141 -8.372 1.041 1.00 0.00 O ATOM 0 H GLY A 253 12.955 -6.807 2.889 1.00 0.00 H new ATOM 0 HA2 GLY A 253 12.308 -6.404 0.048 1.00 0.00 H new ATOM 0 HA3 GLY A 253 13.349 -5.241 0.845 1.00 0.00 H new ATOM 476 N ALA A 254 15.262 -6.669 0.094 1.00 0.00 N ATOM 477 CA ALA A 254 16.433 -7.474 -0.212 1.00 0.00 C ATOM 478 C ALA A 254 17.617 -7.118 0.674 1.00 0.00 C ATOM 479 O ALA A 254 17.492 -6.312 1.594 1.00 0.00 O ATOM 480 CB ALA A 254 16.805 -7.343 -1.682 1.00 0.00 C ATOM 0 H ALA A 254 15.342 -5.687 -0.170 1.00 0.00 H new ATOM 0 HA ALA A 254 16.175 -8.513 -0.007 1.00 0.00 H new ATOM 0 HB1 ALA A 254 17.684 -7.953 -1.891 1.00 0.00 H new ATOM 0 HB2 ALA A 254 15.973 -7.682 -2.299 1.00 0.00 H new ATOM 0 HB3 ALA A 254 17.025 -6.300 -1.910 1.00 0.00 H new ATOM 486 N THR A 255 18.755 -7.729 0.370 1.00 0.00 N ATOM 487 CA THR A 255 19.936 -7.675 1.216 1.00 0.00 C ATOM 488 C THR A 255 20.571 -6.275 1.259 1.00 0.00 C ATOM 489 O THR A 255 20.074 -5.326 0.642 1.00 0.00 O ATOM 490 CB THR A 255 20.966 -8.707 0.703 1.00 0.00 C ATOM 491 OG1 THR A 255 20.264 -9.748 0.005 1.00 0.00 O ATOM 492 CG2 THR A 255 21.773 -9.342 1.848 1.00 0.00 C ATOM 0 H THR A 255 18.883 -8.280 -0.479 1.00 0.00 H new ATOM 0 HA THR A 255 19.629 -7.911 2.235 1.00 0.00 H new ATOM 0 HB THR A 255 21.665 -8.186 0.048 1.00 0.00 H new ATOM 0 HG1 THR A 255 20.906 -10.409 -0.328 1.00 0.00 H new ATOM 0 HG21 THR A 255 22.483 -10.060 1.438 1.00 0.00 H new ATOM 0 HG22 THR A 255 22.314 -8.564 2.387 1.00 0.00 H new ATOM 0 HG23 THR A 255 21.095 -9.853 2.532 1.00 0.00 H new ATOM 500 N ALA A 256 21.677 -6.168 1.990 1.00 0.00 N ATOM 501 CA ALA A 256 22.387 -4.911 2.182 1.00 0.00 C ATOM 502 C ALA A 256 23.025 -4.413 0.883 1.00 0.00 C ATOM 503 O ALA A 256 22.831 -5.010 -0.180 1.00 0.00 O ATOM 504 CB ALA A 256 23.436 -5.080 3.273 1.00 0.00 C ATOM 0 H ALA A 256 22.108 -6.959 2.469 1.00 0.00 H new ATOM 0 HA ALA A 256 21.666 -4.154 2.490 1.00 0.00 H new ATOM 0 HB1 ALA A 256 23.967 -4.139 3.416 1.00 0.00 H new ATOM 0 HB2 ALA A 256 22.949 -5.367 4.205 1.00 0.00 H new ATOM 0 HB3 ALA A 256 24.144 -5.855 2.980 1.00 0.00 H new ATOM 510 N SER A 257 23.763 -3.301 0.988 1.00 0.00 N ATOM 511 CA SER A 257 24.441 -2.670 -0.148 1.00 0.00 C ATOM 512 C SER A 257 23.469 -1.807 -0.958 1.00 0.00 C ATOM 513 O SER A 257 23.814 -1.292 -2.023 1.00 0.00 O ATOM 514 CB SER A 257 25.129 -3.725 -1.037 1.00 0.00 C ATOM 515 OG SER A 257 25.936 -3.131 -2.040 1.00 0.00 O ATOM 0 H SER A 257 23.907 -2.811 1.871 1.00 0.00 H new ATOM 0 HA SER A 257 25.217 -2.013 0.246 1.00 0.00 H new ATOM 0 HB2 SER A 257 25.744 -4.377 -0.416 1.00 0.00 H new ATOM 0 HB3 SER A 257 24.372 -4.353 -1.506 1.00 0.00 H new ATOM 0 HG SER A 257 25.464 -2.365 -2.429 1.00 0.00 H new ATOM 521 N VAL A 258 22.258 -1.630 -0.439 1.00 0.00 N ATOM 522 CA VAL A 258 21.297 -0.720 -1.042 1.00 0.00 C ATOM 523 C VAL A 258 20.843 0.303 -0.003 1.00 0.00 C ATOM 524 O VAL A 258 19.884 0.072 0.749 1.00 0.00 O ATOM 525 CB VAL A 258 20.073 -1.466 -1.621 1.00 0.00 C ATOM 526 CG1 VAL A 258 19.148 -0.506 -2.357 1.00 0.00 C ATOM 527 CG2 VAL A 258 20.512 -2.591 -2.548 1.00 0.00 C ATOM 0 H VAL A 258 21.921 -2.106 0.398 1.00 0.00 H new ATOM 0 HA VAL A 258 21.791 -0.215 -1.872 1.00 0.00 H new ATOM 0 HB VAL A 258 19.523 -1.901 -0.786 1.00 0.00 H new ATOM 0 HG11 VAL A 258 18.295 -1.056 -2.755 1.00 0.00 H new ATOM 0 HG12 VAL A 258 18.796 0.261 -1.667 1.00 0.00 H new ATOM 0 HG13 VAL A 258 19.690 -0.035 -3.177 1.00 0.00 H new ATOM 0 HG21 VAL A 258 19.633 -3.101 -2.943 1.00 0.00 H new ATOM 0 HG22 VAL A 258 21.093 -2.177 -3.373 1.00 0.00 H new ATOM 0 HG23 VAL A 258 21.125 -3.301 -1.993 1.00 0.00 H new ATOM 537 N THR A 259 21.556 1.424 0.051 1.00 0.00 N ATOM 538 CA THR A 259 21.266 2.472 1.014 1.00 0.00 C ATOM 539 C THR A 259 19.949 3.163 0.678 1.00 0.00 C ATOM 540 O THR A 259 19.901 4.045 -0.182 1.00 0.00 O ATOM 541 CB THR A 259 22.392 3.521 1.058 1.00 0.00 C ATOM 542 OG1 THR A 259 23.664 2.868 1.179 1.00 0.00 O ATOM 543 CG2 THR A 259 22.194 4.472 2.232 1.00 0.00 C ATOM 0 H THR A 259 22.342 1.627 -0.566 1.00 0.00 H new ATOM 0 HA THR A 259 21.189 1.999 1.993 1.00 0.00 H new ATOM 0 HB THR A 259 22.364 4.095 0.132 1.00 0.00 H new ATOM 0 HG1 THR A 259 24.376 3.541 1.205 1.00 0.00 H new ATOM 0 HG21 THR A 259 23.000 5.206 2.246 1.00 0.00 H new ATOM 0 HG22 THR A 259 21.238 4.985 2.127 1.00 0.00 H new ATOM 0 HG23 THR A 259 22.202 3.906 3.164 1.00 0.00 H new ATOM 551 N GLY A 260 18.889 2.750 1.357 1.00 0.00 N ATOM 552 CA GLY A 260 17.575 3.296 1.111 1.00 0.00 C ATOM 553 C GLY A 260 17.039 2.935 -0.257 1.00 0.00 C ATOM 554 O GLY A 260 17.363 3.600 -1.243 1.00 0.00 O ATOM 0 H GLY A 260 18.920 2.035 2.084 1.00 0.00 H new ATOM 0 HA2 GLY A 260 16.886 2.933 1.874 1.00 0.00 H new ATOM 0 HA3 GLY A 260 17.613 4.381 1.207 1.00 0.00 H new ATOM 558 N PHE A 261 16.236 1.871 -0.322 1.00 0.00 N ATOM 559 CA PHE A 261 15.529 1.510 -1.552 1.00 0.00 C ATOM 560 C PHE A 261 14.949 2.739 -2.260 1.00 0.00 C ATOM 561 O PHE A 261 15.256 2.987 -3.426 1.00 0.00 O ATOM 562 CB PHE A 261 14.364 0.545 -1.259 1.00 0.00 C ATOM 563 CG PHE A 261 14.736 -0.909 -1.285 1.00 0.00 C ATOM 564 CD1 PHE A 261 15.283 -1.471 -2.427 1.00 0.00 C ATOM 565 CD2 PHE A 261 14.513 -1.718 -0.184 1.00 0.00 C ATOM 566 CE1 PHE A 261 15.605 -2.813 -2.470 1.00 0.00 C ATOM 567 CE2 PHE A 261 14.837 -3.060 -0.219 1.00 0.00 C ATOM 568 CZ PHE A 261 15.381 -3.609 -1.365 1.00 0.00 C ATOM 0 H PHE A 261 16.059 1.244 0.463 1.00 0.00 H new ATOM 0 HA PHE A 261 16.267 1.032 -2.196 1.00 0.00 H new ATOM 0 HB2 PHE A 261 13.950 0.783 -0.279 1.00 0.00 H new ATOM 0 HB3 PHE A 261 13.574 0.718 -1.990 1.00 0.00 H new ATOM 0 HD1 PHE A 261 15.460 -0.852 -3.294 1.00 0.00 H new ATOM 0 HD2 PHE A 261 14.081 -1.295 0.711 1.00 0.00 H new ATOM 0 HE1 PHE A 261 16.031 -3.239 -3.366 1.00 0.00 H new ATOM 0 HE2 PHE A 261 14.665 -3.680 0.648 1.00 0.00 H new ATOM 0 HZ PHE A 261 15.630 -4.659 -1.396 1.00 0.00 H new ATOM 578 N LEU A 262 14.123 3.508 -1.555 1.00 0.00 N ATOM 579 CA LEU A 262 13.456 4.664 -2.150 1.00 0.00 C ATOM 580 C LEU A 262 12.873 5.571 -1.071 1.00 0.00 C ATOM 581 O LEU A 262 12.705 5.147 0.071 1.00 0.00 O ATOM 582 CB LEU A 262 12.372 4.203 -3.137 1.00 0.00 C ATOM 583 CG LEU A 262 11.529 2.999 -2.701 1.00 0.00 C ATOM 584 CD1 LEU A 262 10.541 3.374 -1.610 1.00 0.00 C ATOM 585 CD2 LEU A 262 10.804 2.408 -3.897 1.00 0.00 C ATOM 0 H LEU A 262 13.899 3.352 -0.572 1.00 0.00 H new ATOM 0 HA LEU A 262 14.194 5.245 -2.703 1.00 0.00 H new ATOM 0 HB2 LEU A 262 11.701 5.041 -3.325 1.00 0.00 H new ATOM 0 HB3 LEU A 262 12.852 3.960 -4.085 1.00 0.00 H new ATOM 0 HG LEU A 262 12.203 2.249 -2.288 1.00 0.00 H new ATOM 0 HD11 LEU A 262 9.961 2.496 -1.327 1.00 0.00 H new ATOM 0 HD12 LEU A 262 11.083 3.747 -0.741 1.00 0.00 H new ATOM 0 HD13 LEU A 262 9.869 4.149 -1.979 1.00 0.00 H new ATOM 0 HD21 LEU A 262 10.208 1.554 -3.576 1.00 0.00 H new ATOM 0 HD22 LEU A 262 10.150 3.162 -4.335 1.00 0.00 H new ATOM 0 HD23 LEU A 262 11.532 2.084 -4.640 1.00 0.00 H new ATOM 597 N LYS A 263 12.581 6.816 -1.432 1.00 0.00 N ATOM 598 CA LYS A 263 12.111 7.806 -0.471 1.00 0.00 C ATOM 599 C LYS A 263 11.030 8.698 -1.063 1.00 0.00 C ATOM 600 O LYS A 263 10.463 8.388 -2.109 1.00 0.00 O ATOM 601 CB LYS A 263 13.274 8.668 0.007 1.00 0.00 C ATOM 602 CG LYS A 263 14.308 7.890 0.781 1.00 0.00 C ATOM 603 CD LYS A 263 15.405 8.792 1.307 1.00 0.00 C ATOM 604 CE LYS A 263 16.544 7.984 1.897 1.00 0.00 C ATOM 605 NZ LYS A 263 17.531 8.850 2.586 1.00 0.00 N1+ ATOM 0 H LYS A 263 12.662 7.164 -2.387 1.00 0.00 H new ATOM 0 HA LYS A 263 11.681 7.264 0.372 1.00 0.00 H new ATOM 0 HB2 LYS A 263 13.750 9.136 -0.855 1.00 0.00 H new ATOM 0 HB3 LYS A 263 12.889 9.472 0.634 1.00 0.00 H new ATOM 0 HG2 LYS A 263 13.829 7.375 1.614 1.00 0.00 H new ATOM 0 HG3 LYS A 263 14.743 7.123 0.140 1.00 0.00 H new ATOM 0 HD2 LYS A 263 15.781 9.420 0.499 1.00 0.00 H new ATOM 0 HD3 LYS A 263 14.998 9.459 2.066 1.00 0.00 H new ATOM 0 HE2 LYS A 263 16.146 7.254 2.602 1.00 0.00 H new ATOM 0 HE3 LYS A 263 17.041 7.424 1.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 18.439 8.349 2.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 17.663 9.727 2.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 17.184 9.082 3.538 1.00 0.00 H new ATOM 619 N ALA A 264 10.749 9.804 -0.373 1.00 0.00 N ATOM 620 CA ALA A 264 9.742 10.762 -0.801 1.00 0.00 C ATOM 621 C ALA A 264 9.919 11.152 -2.257 1.00 0.00 C ATOM 622 O ALA A 264 10.950 11.694 -2.656 1.00 0.00 O ATOM 623 CB ALA A 264 9.775 11.997 0.088 1.00 0.00 C ATOM 0 H ALA A 264 11.216 10.056 0.498 1.00 0.00 H new ATOM 0 HA ALA A 264 8.768 10.282 -0.706 1.00 0.00 H new ATOM 0 HB1 ALA A 264 9.016 12.705 -0.244 1.00 0.00 H new ATOM 0 HB2 ALA A 264 9.575 11.708 1.120 1.00 0.00 H new ATOM 0 HB3 ALA A 264 10.758 12.464 0.026 1.00 0.00 H new ATOM 629 N GLY A 265 8.910 10.841 -3.040 1.00 0.00 N ATOM 630 CA GLY A 265 8.933 11.158 -4.449 1.00 0.00 C ATOM 631 C GLY A 265 8.970 9.913 -5.300 1.00 0.00 C ATOM 632 O GLY A 265 8.619 9.945 -6.481 1.00 0.00 O ATOM 0 H GLY A 265 8.063 10.369 -2.724 1.00 0.00 H new ATOM 0 HA2 GLY A 265 8.052 11.747 -4.704 1.00 0.00 H new ATOM 0 HA3 GLY A 265 9.804 11.775 -4.669 1.00 0.00 H new ATOM 636 N ASP A 266 9.385 8.808 -4.695 1.00 0.00 N ATOM 637 CA ASP A 266 9.462 7.536 -5.398 1.00 0.00 C ATOM 638 C ASP A 266 8.144 6.795 -5.285 1.00 0.00 C ATOM 639 O ASP A 266 7.485 6.829 -4.241 1.00 0.00 O ATOM 640 CB ASP A 266 10.590 6.662 -4.846 1.00 0.00 C ATOM 641 CG ASP A 266 11.968 7.204 -5.162 1.00 0.00 C ATOM 642 OD1 ASP A 266 12.363 7.180 -6.347 1.00 0.00 O ATOM 643 OD2 ASP A 266 12.671 7.641 -4.223 1.00 0.00 O1- ATOM 0 H ASP A 266 9.674 8.768 -3.718 1.00 0.00 H new ATOM 0 HA ASP A 266 9.673 7.748 -6.446 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.479 6.575 -3.765 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.498 5.657 -5.258 1.00 0.00 H new ATOM 648 N GLN A 267 7.758 6.127 -6.358 1.00 0.00 N ATOM 649 CA GLN A 267 6.496 5.419 -6.385 1.00 0.00 C ATOM 650 C GLN A 267 6.719 3.915 -6.436 1.00 0.00 C ATOM 651 O GLN A 267 7.737 3.434 -6.940 1.00 0.00 O ATOM 652 CB GLN A 267 5.656 5.860 -7.580 1.00 0.00 C ATOM 653 CG GLN A 267 5.414 7.356 -7.643 1.00 0.00 C ATOM 654 CD GLN A 267 4.393 7.727 -8.697 1.00 0.00 C ATOM 655 OE1 GLN A 267 4.729 7.966 -9.856 1.00 0.00 O ATOM 656 NE2 GLN A 267 3.135 7.768 -8.301 1.00 0.00 N ATOM 0 H GLN A 267 8.301 6.062 -7.219 1.00 0.00 H new ATOM 0 HA GLN A 267 5.958 5.661 -5.468 1.00 0.00 H new ATOM 0 HB2 GLN A 267 6.153 5.543 -8.497 1.00 0.00 H new ATOM 0 HB3 GLN A 267 4.695 5.348 -7.545 1.00 0.00 H new ATOM 0 HG2 GLN A 267 5.073 7.708 -6.670 1.00 0.00 H new ATOM 0 HG3 GLN A 267 6.354 7.866 -7.855 1.00 0.00 H new ATOM 0 HE21 GLN A 267 2.899 7.563 -7.330 1.00 0.00 H new ATOM 0 HE22 GLN A 267 2.399 8.005 -8.966 1.00 0.00 H new ATOM 665 N VAL A 268 5.749 3.183 -5.927 1.00 0.00 N ATOM 666 CA VAL A 268 5.815 1.733 -5.873 1.00 0.00 C ATOM 667 C VAL A 268 4.533 1.126 -6.404 1.00 0.00 C ATOM 668 O VAL A 268 3.534 1.812 -6.557 1.00 0.00 O ATOM 669 CB VAL A 268 6.014 1.213 -4.426 1.00 0.00 C ATOM 670 CG1 VAL A 268 7.490 1.188 -4.064 1.00 0.00 C ATOM 671 CG2 VAL A 268 5.242 2.076 -3.429 1.00 0.00 C ATOM 0 H VAL A 268 4.891 3.575 -5.538 1.00 0.00 H new ATOM 0 HA VAL A 268 6.669 1.440 -6.483 1.00 0.00 H new ATOM 0 HB VAL A 268 5.626 0.196 -4.377 1.00 0.00 H new ATOM 0 HG11 VAL A 268 7.608 0.820 -3.045 1.00 0.00 H new ATOM 0 HG12 VAL A 268 8.022 0.530 -4.751 1.00 0.00 H new ATOM 0 HG13 VAL A 268 7.899 2.196 -4.136 1.00 0.00 H new ATOM 0 HG21 VAL A 268 5.396 1.693 -2.420 1.00 0.00 H new ATOM 0 HG22 VAL A 268 5.599 3.104 -3.485 1.00 0.00 H new ATOM 0 HG23 VAL A 268 4.179 2.047 -3.670 1.00 0.00 H new ATOM 681 N LYS A 269 4.566 -0.160 -6.678 1.00 0.00 N ATOM 682 CA LYS A 269 3.356 -0.901 -6.976 1.00 0.00 C ATOM 683 C LYS A 269 3.198 -1.989 -5.946 1.00 0.00 C ATOM 684 O LYS A 269 4.185 -2.460 -5.397 1.00 0.00 O ATOM 685 CB LYS A 269 3.389 -1.557 -8.359 1.00 0.00 C ATOM 686 CG LYS A 269 3.429 -0.582 -9.514 1.00 0.00 C ATOM 687 CD LYS A 269 4.841 -0.144 -9.826 1.00 0.00 C ATOM 688 CE LYS A 269 5.641 -1.252 -10.496 1.00 0.00 C ATOM 689 NZ LYS A 269 5.008 -1.711 -11.761 1.00 0.00 N1+ ATOM 0 H LYS A 269 5.420 -0.717 -6.701 1.00 0.00 H new ATOM 0 HA LYS A 269 2.526 -0.195 -6.960 1.00 0.00 H new ATOM 0 HB2 LYS A 269 4.262 -2.207 -8.418 1.00 0.00 H new ATOM 0 HB3 LYS A 269 2.510 -2.193 -8.467 1.00 0.00 H new ATOM 0 HG2 LYS A 269 2.988 -1.045 -10.397 1.00 0.00 H new ATOM 0 HG3 LYS A 269 2.822 0.291 -9.275 1.00 0.00 H new ATOM 0 HD2 LYS A 269 4.815 0.730 -10.477 1.00 0.00 H new ATOM 0 HD3 LYS A 269 5.340 0.159 -8.905 1.00 0.00 H new ATOM 0 HE2 LYS A 269 6.650 -0.895 -10.704 1.00 0.00 H new ATOM 0 HE3 LYS A 269 5.736 -2.095 -9.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 5.724 -2.167 -12.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 4.253 -2.393 -11.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 4.604 -0.895 -12.263 1.00 0.00 H new ATOM 703 N PHE A 270 1.982 -2.367 -5.650 1.00 0.00 N ATOM 704 CA PHE A 270 1.775 -3.561 -4.858 1.00 0.00 C ATOM 705 C PHE A 270 0.476 -4.245 -5.226 1.00 0.00 C ATOM 706 O PHE A 270 -0.520 -3.594 -5.558 1.00 0.00 O ATOM 707 CB PHE A 270 1.879 -3.290 -3.346 1.00 0.00 C ATOM 708 CG PHE A 270 0.855 -2.364 -2.756 1.00 0.00 C ATOM 709 CD1 PHE A 270 -0.255 -2.872 -2.097 1.00 0.00 C ATOM 710 CD2 PHE A 270 1.023 -0.992 -2.816 1.00 0.00 C ATOM 711 CE1 PHE A 270 -1.177 -2.027 -1.514 1.00 0.00 C ATOM 712 CE2 PHE A 270 0.100 -0.142 -2.239 1.00 0.00 C ATOM 713 CZ PHE A 270 -1.000 -0.660 -1.585 1.00 0.00 C ATOM 0 H PHE A 270 1.133 -1.880 -5.936 1.00 0.00 H new ATOM 0 HA PHE A 270 2.586 -4.248 -5.098 1.00 0.00 H new ATOM 0 HB2 PHE A 270 1.816 -4.245 -2.824 1.00 0.00 H new ATOM 0 HB3 PHE A 270 2.868 -2.879 -3.141 1.00 0.00 H new ATOM 0 HD1 PHE A 270 -0.399 -3.941 -2.040 1.00 0.00 H new ATOM 0 HD2 PHE A 270 1.886 -0.581 -3.320 1.00 0.00 H new ATOM 0 HE1 PHE A 270 -2.036 -2.435 -1.003 1.00 0.00 H new ATOM 0 HE2 PHE A 270 0.239 0.927 -2.299 1.00 0.00 H new ATOM 0 HZ PHE A 270 -1.721 0.003 -1.130 1.00 0.00 H new ATOM 723 N THR A 271 0.510 -5.563 -5.203 1.00 0.00 N ATOM 724 CA THR A 271 -0.674 -6.353 -5.467 1.00 0.00 C ATOM 725 C THR A 271 -1.354 -6.686 -4.151 1.00 0.00 C ATOM 726 O THR A 271 -0.881 -7.517 -3.365 1.00 0.00 O ATOM 727 CB THR A 271 -0.401 -7.635 -6.312 1.00 0.00 C ATOM 728 OG1 THR A 271 -1.592 -8.427 -6.398 1.00 0.00 O ATOM 729 CG2 THR A 271 0.735 -8.500 -5.757 1.00 0.00 C ATOM 0 H THR A 271 1.348 -6.110 -5.003 1.00 0.00 H new ATOM 0 HA THR A 271 -1.338 -5.749 -6.085 1.00 0.00 H new ATOM 0 HB THR A 271 -0.092 -7.290 -7.299 1.00 0.00 H new ATOM 0 HG1 THR A 271 -1.413 -9.230 -6.931 1.00 0.00 H new ATOM 0 HG21 THR A 271 0.871 -9.375 -6.393 1.00 0.00 H new ATOM 0 HG22 THR A 271 1.657 -7.920 -5.736 1.00 0.00 H new ATOM 0 HG23 THR A 271 0.486 -8.822 -4.746 1.00 0.00 H new ATOM 737 N ASN A 272 -2.450 -5.989 -3.914 1.00 0.00 N ATOM 738 CA ASN A 272 -3.174 -6.069 -2.660 1.00 0.00 C ATOM 739 C ASN A 272 -4.245 -7.138 -2.738 1.00 0.00 C ATOM 740 O ASN A 272 -5.028 -7.189 -3.687 1.00 0.00 O ATOM 741 CB ASN A 272 -3.813 -4.710 -2.355 1.00 0.00 C ATOM 742 CG ASN A 272 -4.677 -4.714 -1.108 1.00 0.00 C ATOM 743 OD1 ASN A 272 -5.679 -4.000 -1.029 1.00 0.00 O ATOM 744 ND2 ASN A 272 -4.291 -5.492 -0.118 1.00 0.00 N ATOM 0 H ASN A 272 -2.865 -5.348 -4.590 1.00 0.00 H new ATOM 0 HA ASN A 272 -2.479 -6.332 -1.862 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -3.026 -3.965 -2.240 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -4.420 -4.403 -3.207 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -4.827 -5.517 0.750 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -3.456 -6.070 -0.219 1.00 0.00 H new ATOM 1061 N SER A 292 -3.457 -4.907 -8.898 1.00 0.00 N ATOM 1062 CA SER A 292 -2.242 -4.193 -8.522 1.00 0.00 C ATOM 1063 C SER A 292 -2.390 -2.703 -8.810 1.00 0.00 C ATOM 1064 O SER A 292 -3.049 -2.313 -9.777 1.00 0.00 O ATOM 1065 CB SER A 292 -1.023 -4.763 -9.262 1.00 0.00 C ATOM 1066 OG SER A 292 -0.836 -6.135 -8.961 1.00 0.00 O ATOM 0 HA SER A 292 -2.085 -4.327 -7.452 1.00 0.00 H new ATOM 0 HB2 SER A 292 -1.156 -4.639 -10.337 1.00 0.00 H new ATOM 0 HB3 SER A 292 -0.131 -4.202 -8.984 1.00 0.00 H new ATOM 0 HG SER A 292 -1.707 -6.558 -8.808 1.00 0.00 H new ATOM 1072 N PHE A 293 -1.797 -1.871 -7.960 1.00 0.00 N ATOM 1073 CA PHE A 293 -1.872 -0.432 -8.129 1.00 0.00 C ATOM 1074 C PHE A 293 -0.625 0.241 -7.574 1.00 0.00 C ATOM 1075 O PHE A 293 0.167 -0.382 -6.863 1.00 0.00 O ATOM 1076 CB PHE A 293 -3.142 0.131 -7.476 1.00 0.00 C ATOM 1077 CG PHE A 293 -3.463 -0.418 -6.113 1.00 0.00 C ATOM 1078 CD1 PHE A 293 -3.024 0.224 -4.970 1.00 0.00 C ATOM 1079 CD2 PHE A 293 -4.232 -1.563 -5.980 1.00 0.00 C ATOM 1080 CE1 PHE A 293 -3.343 -0.265 -3.720 1.00 0.00 C ATOM 1081 CE2 PHE A 293 -4.550 -2.059 -4.732 1.00 0.00 C ATOM 1082 CZ PHE A 293 -4.107 -1.408 -3.601 1.00 0.00 C ATOM 0 H PHE A 293 -1.260 -2.173 -7.147 1.00 0.00 H new ATOM 0 HA PHE A 293 -1.924 -0.217 -9.196 1.00 0.00 H new ATOM 0 HB2 PHE A 293 -3.041 1.214 -7.399 1.00 0.00 H new ATOM 0 HB3 PHE A 293 -3.987 -0.064 -8.136 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -2.425 1.118 -5.057 1.00 0.00 H new ATOM 0 HD2 PHE A 293 -4.587 -2.073 -6.863 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -2.995 0.247 -2.835 1.00 0.00 H new ATOM 0 HE2 PHE A 293 -5.145 -2.956 -4.642 1.00 0.00 H new ATOM 0 HZ PHE A 293 -4.357 -1.792 -2.623 1.00 0.00 H new ATOM 1092 N THR A 294 -0.460 1.509 -7.915 1.00 0.00 N ATOM 1093 CA THR A 294 0.747 2.251 -7.588 1.00 0.00 C ATOM 1094 C THR A 294 0.542 3.142 -6.362 1.00 0.00 C ATOM 1095 O THR A 294 -0.483 3.810 -6.240 1.00 0.00 O ATOM 1096 CB THR A 294 1.167 3.120 -8.796 1.00 0.00 C ATOM 1097 OG1 THR A 294 1.452 2.273 -9.919 1.00 0.00 O ATOM 1098 CG2 THR A 294 2.384 3.997 -8.491 1.00 0.00 C ATOM 0 H THR A 294 -1.157 2.052 -8.425 1.00 0.00 H new ATOM 0 HA THR A 294 1.532 1.532 -7.356 1.00 0.00 H new ATOM 0 HB THR A 294 0.336 3.787 -9.024 1.00 0.00 H new ATOM 0 HG1 THR A 294 1.717 2.824 -10.685 1.00 0.00 H new ATOM 0 HG21 THR A 294 2.637 4.587 -9.372 1.00 0.00 H new ATOM 0 HG22 THR A 294 2.152 4.665 -7.661 1.00 0.00 H new ATOM 0 HG23 THR A 294 3.230 3.365 -8.222 1.00 0.00 H new ATOM 1106 N ALA A 295 1.517 3.140 -5.456 1.00 0.00 N ATOM 1107 CA ALA A 295 1.477 4.009 -4.291 1.00 0.00 C ATOM 1108 C ALA A 295 2.760 4.820 -4.197 1.00 0.00 C ATOM 1109 O ALA A 295 3.661 4.646 -5.015 1.00 0.00 O ATOM 1110 CB ALA A 295 1.265 3.192 -3.038 1.00 0.00 C ATOM 0 H ALA A 295 2.343 2.544 -5.510 1.00 0.00 H new ATOM 0 HA ALA A 295 0.641 4.701 -4.394 1.00 0.00 H new ATOM 0 HB1 ALA A 295 1.237 3.854 -2.172 1.00 0.00 H new ATOM 0 HB2 ALA A 295 0.322 2.651 -3.112 1.00 0.00 H new ATOM 0 HB3 ALA A 295 2.083 2.481 -2.924 1.00 0.00 H new ATOM 1116 N THR A 296 2.853 5.698 -3.209 1.00 0.00 N ATOM 1117 CA THR A 296 4.015 6.563 -3.096 1.00 0.00 C ATOM 1118 C THR A 296 4.551 6.624 -1.671 1.00 0.00 C ATOM 1119 O THR A 296 3.795 6.777 -0.708 1.00 0.00 O ATOM 1120 CB THR A 296 3.687 7.992 -3.595 1.00 0.00 C ATOM 1121 OG1 THR A 296 3.335 7.956 -4.984 1.00 0.00 O ATOM 1122 CG2 THR A 296 4.859 8.961 -3.389 1.00 0.00 C ATOM 0 H THR A 296 2.148 5.829 -2.484 1.00 0.00 H new ATOM 0 HA THR A 296 4.792 6.130 -3.726 1.00 0.00 H new ATOM 0 HB THR A 296 2.846 8.356 -3.005 1.00 0.00 H new ATOM 0 HG1 THR A 296 3.127 8.863 -5.292 1.00 0.00 H new ATOM 0 HG21 THR A 296 4.582 9.950 -3.754 1.00 0.00 H new ATOM 0 HG22 THR A 296 5.100 9.020 -2.328 1.00 0.00 H new ATOM 0 HG23 THR A 296 5.729 8.602 -3.939 1.00 0.00 H new ATOM 1130 N VAL A 297 5.870 6.511 -1.561 1.00 0.00 N ATOM 1131 CA VAL A 297 6.557 6.570 -0.281 1.00 0.00 C ATOM 1132 C VAL A 297 7.024 7.996 0.004 1.00 0.00 C ATOM 1133 O VAL A 297 7.397 8.731 -0.913 1.00 0.00 O ATOM 1134 CB VAL A 297 7.764 5.606 -0.266 1.00 0.00 C ATOM 1135 CG1 VAL A 297 8.569 5.744 1.015 1.00 0.00 C ATOM 1136 CG2 VAL A 297 7.292 4.171 -0.445 1.00 0.00 C ATOM 0 H VAL A 297 6.491 6.376 -2.359 1.00 0.00 H new ATOM 0 HA VAL A 297 5.858 6.264 0.497 1.00 0.00 H new ATOM 0 HB VAL A 297 8.417 5.871 -1.098 1.00 0.00 H new ATOM 0 HG11 VAL A 297 9.410 5.052 0.992 1.00 0.00 H new ATOM 0 HG12 VAL A 297 8.941 6.765 1.103 1.00 0.00 H new ATOM 0 HG13 VAL A 297 7.934 5.515 1.870 1.00 0.00 H new ATOM 0 HG21 VAL A 297 8.152 3.501 -0.433 1.00 0.00 H new ATOM 0 HG22 VAL A 297 6.614 3.907 0.367 1.00 0.00 H new ATOM 0 HG23 VAL A 297 6.771 4.075 -1.398 1.00 0.00 H new ATOM 1146 N THR A 298 6.986 8.393 1.271 1.00 0.00 N ATOM 1147 CA THR A 298 7.340 9.753 1.647 1.00 0.00 C ATOM 1148 C THR A 298 8.326 9.781 2.822 1.00 0.00 C ATOM 1149 O THR A 298 8.390 10.754 3.572 1.00 0.00 O ATOM 1150 CB THR A 298 6.068 10.555 1.994 1.00 0.00 C ATOM 1151 OG1 THR A 298 5.045 10.248 1.039 1.00 0.00 O ATOM 1152 CG2 THR A 298 6.328 12.058 1.973 1.00 0.00 C ATOM 0 H THR A 298 6.715 7.794 2.051 1.00 0.00 H new ATOM 0 HA THR A 298 7.835 10.216 0.793 1.00 0.00 H new ATOM 0 HB THR A 298 5.756 10.276 3.000 1.00 0.00 H new ATOM 0 HG1 THR A 298 4.225 10.731 1.272 1.00 0.00 H new ATOM 0 HG21 THR A 298 5.410 12.590 2.222 1.00 0.00 H new ATOM 0 HG22 THR A 298 7.099 12.304 2.703 1.00 0.00 H new ATOM 0 HG23 THR A 298 6.661 12.356 0.979 1.00 0.00 H new ATOM 1160 N ALA A 299 9.098 8.713 2.992 1.00 0.00 N ATOM 1161 CA ALA A 299 10.048 8.652 4.096 1.00 0.00 C ATOM 1162 C ALA A 299 11.294 7.864 3.736 1.00 0.00 C ATOM 1163 O ALA A 299 11.358 7.237 2.680 1.00 0.00 O ATOM 1164 CB ALA A 299 9.386 8.068 5.337 1.00 0.00 C ATOM 0 H ALA A 299 9.086 7.890 2.390 1.00 0.00 H new ATOM 0 HA ALA A 299 10.363 9.674 4.309 1.00 0.00 H new ATOM 0 HB1 ALA A 299 10.109 8.030 6.151 1.00 0.00 H new ATOM 0 HB2 ALA A 299 8.544 8.695 5.629 1.00 0.00 H new ATOM 0 HB3 ALA A 299 9.031 7.061 5.120 1.00 0.00 H new ATOM 1170 N ASP A 300 12.284 7.921 4.625 1.00 0.00 N ATOM 1171 CA ASP A 300 13.524 7.198 4.454 1.00 0.00 C ATOM 1172 C ASP A 300 13.253 5.712 4.463 1.00 0.00 C ATOM 1173 O ASP A 300 12.251 5.248 5.011 1.00 0.00 O ATOM 1174 CB ASP A 300 14.528 7.547 5.560 1.00 0.00 C ATOM 1175 CG ASP A 300 14.990 8.991 5.513 1.00 0.00 C ATOM 1176 OD1 ASP A 300 14.549 9.791 6.365 1.00 0.00 O ATOM 1177 OD2 ASP A 300 15.799 9.339 4.630 1.00 0.00 O1- ATOM 0 H ASP A 300 12.240 8.473 5.482 1.00 0.00 H new ATOM 0 HA ASP A 300 13.957 7.488 3.497 1.00 0.00 H new ATOM 0 HB2 ASP A 300 14.073 7.349 6.531 1.00 0.00 H new ATOM 0 HB3 ASP A 300 15.395 6.892 5.475 1.00 0.00 H new ATOM 1182 N ALA A 301 14.155 4.977 3.874 1.00 0.00 N ATOM 1183 CA ALA A 301 13.985 3.544 3.721 1.00 0.00 C ATOM 1184 C ALA A 301 15.305 2.816 3.917 1.00 0.00 C ATOM 1185 O ALA A 301 16.366 3.438 3.957 1.00 0.00 O ATOM 1186 CB ALA A 301 13.383 3.233 2.358 1.00 0.00 C ATOM 0 H ALA A 301 15.025 5.343 3.487 1.00 0.00 H new ATOM 0 HA ALA A 301 13.299 3.190 4.490 1.00 0.00 H new ATOM 0 HB1 ALA A 301 13.259 2.155 2.252 1.00 0.00 H new ATOM 0 HB2 ALA A 301 12.412 3.720 2.269 1.00 0.00 H new ATOM 0 HB3 ALA A 301 14.046 3.601 1.575 1.00 0.00 H new ATOM 1192 N ASN A 302 15.232 1.501 4.028 1.00 0.00 N ATOM 1193 CA ASN A 302 16.397 0.690 4.343 1.00 0.00 C ATOM 1194 C ASN A 302 16.350 -0.639 3.600 1.00 0.00 C ATOM 1195 O ASN A 302 15.311 -1.286 3.572 1.00 0.00 O ATOM 1196 CB ASN A 302 16.422 0.416 5.850 1.00 0.00 C ATOM 1197 CG ASN A 302 17.593 -0.447 6.282 1.00 0.00 C ATOM 1198 OD1 ASN A 302 17.485 -1.667 6.343 1.00 0.00 O ATOM 1199 ND2 ASN A 302 18.716 0.178 6.596 1.00 0.00 N ATOM 0 H ASN A 302 14.371 0.968 3.904 1.00 0.00 H new ATOM 0 HA ASN A 302 17.292 1.231 4.037 1.00 0.00 H new ATOM 0 HB2 ASN A 302 16.462 1.365 6.385 1.00 0.00 H new ATOM 0 HB3 ASN A 302 15.492 -0.074 6.139 1.00 0.00 H new ATOM 0 HD21 ASN A 302 19.529 -0.357 6.901 1.00 0.00 H new ATOM 0 HD22 ASN A 302 18.769 1.195 6.533 1.00 0.00 H new ATOM 1206 N SER A 303 17.445 -1.026 2.958 1.00 0.00 N ATOM 1207 CA SER A 303 17.602 -2.402 2.528 1.00 0.00 C ATOM 1208 C SER A 303 18.777 -3.024 3.277 1.00 0.00 C ATOM 1209 O SER A 303 19.932 -2.872 2.868 1.00 0.00 O ATOM 1210 CB SER A 303 17.863 -2.447 1.029 1.00 0.00 C ATOM 1211 OG SER A 303 17.528 -1.206 0.424 1.00 0.00 O ATOM 0 H SER A 303 18.226 -0.412 2.728 1.00 0.00 H new ATOM 0 HA SER A 303 16.692 -2.961 2.744 1.00 0.00 H new ATOM 0 HB2 SER A 303 18.913 -2.676 0.844 1.00 0.00 H new ATOM 0 HB3 SER A 303 17.278 -3.248 0.577 1.00 0.00 H new ATOM 0 HG SER A 303 16.605 -1.240 0.096 1.00 0.00 H new ATOM 1217 N ASP A 304 18.496 -3.699 4.380 1.00 0.00 N ATOM 1218 CA ASP A 304 19.561 -4.273 5.192 1.00 0.00 C ATOM 1219 C ASP A 304 19.799 -5.725 4.819 1.00 0.00 C ATOM 1220 O ASP A 304 19.079 -6.282 3.995 1.00 0.00 O ATOM 1221 CB ASP A 304 19.245 -4.167 6.688 1.00 0.00 C ATOM 1222 CG ASP A 304 18.393 -5.313 7.203 1.00 0.00 C ATOM 1223 OD1 ASP A 304 18.932 -6.179 7.923 1.00 0.00 O ATOM 1224 OD2 ASP A 304 17.183 -5.353 6.901 1.00 0.00 O1- ATOM 0 H ASP A 304 17.553 -3.863 4.732 1.00 0.00 H new ATOM 0 HA ASP A 304 20.466 -3.700 4.991 1.00 0.00 H new ATOM 0 HB2 ASP A 304 20.179 -4.137 7.249 1.00 0.00 H new ATOM 0 HB3 ASP A 304 18.729 -3.226 6.878 1.00 0.00 H new ATOM 1229 N SER A 305 20.792 -6.339 5.432 1.00 0.00 N ATOM 1230 CA SER A 305 21.149 -7.716 5.125 1.00 0.00 C ATOM 1231 C SER A 305 19.972 -8.664 5.350 1.00 0.00 C ATOM 1232 O SER A 305 19.801 -9.649 4.626 1.00 0.00 O ATOM 1233 CB SER A 305 22.313 -8.133 6.003 1.00 0.00 C ATOM 1234 OG SER A 305 23.372 -7.193 5.920 1.00 0.00 O ATOM 0 H SER A 305 21.371 -5.905 6.151 1.00 0.00 H new ATOM 0 HA SER A 305 21.428 -7.773 4.073 1.00 0.00 H new ATOM 0 HB2 SER A 305 21.980 -8.221 7.037 1.00 0.00 H new ATOM 0 HB3 SER A 305 22.670 -9.117 5.698 1.00 0.00 H new ATOM 0 HG SER A 305 24.111 -7.481 6.495 1.00 0.00 H new ATOM 1240 N GLY A 306 19.145 -8.340 6.332 1.00 0.00 N ATOM 1241 CA GLY A 306 18.017 -9.181 6.662 1.00 0.00 C ATOM 1242 C GLY A 306 16.877 -9.010 5.687 1.00 0.00 C ATOM 1243 O GLY A 306 15.907 -9.767 5.718 1.00 0.00 O ATOM 0 H GLY A 306 19.237 -7.504 6.909 1.00 0.00 H new ATOM 0 HA2 GLY A 306 18.333 -10.224 6.670 1.00 0.00 H new ATOM 0 HA3 GLY A 306 17.671 -8.945 7.668 1.00 0.00 H new ATOM 1247 N GLY A 307 17.004 -8.035 4.797 1.00 0.00 N ATOM 1248 CA GLY A 307 15.955 -7.782 3.839 1.00 0.00 C ATOM 1249 C GLY A 307 14.727 -7.126 4.445 1.00 0.00 C ATOM 1250 O GLY A 307 13.610 -7.546 4.159 1.00 0.00 O ATOM 0 H GLY A 307 17.813 -7.418 4.724 1.00 0.00 H new ATOM 0 HA2 GLY A 307 16.344 -7.144 3.046 1.00 0.00 H new ATOM 0 HA3 GLY A 307 15.662 -8.724 3.375 1.00 0.00 H new ATOM 1254 N ASP A 308 14.913 -6.134 5.309 1.00 0.00 N ATOM 1255 CA ASP A 308 13.777 -5.406 5.881 1.00 0.00 C ATOM 1256 C ASP A 308 13.781 -3.941 5.456 1.00 0.00 C ATOM 1257 O ASP A 308 14.827 -3.294 5.440 1.00 0.00 O ATOM 1258 CB ASP A 308 13.775 -5.493 7.408 1.00 0.00 C ATOM 1259 CG ASP A 308 13.294 -6.834 7.920 1.00 0.00 C ATOM 1260 OD1 ASP A 308 12.075 -6.994 8.125 1.00 0.00 O ATOM 1261 OD2 ASP A 308 14.131 -7.729 8.143 1.00 0.00 O1- ATOM 0 H ASP A 308 15.828 -5.815 5.628 1.00 0.00 H new ATOM 0 HA ASP A 308 12.873 -5.879 5.498 1.00 0.00 H new ATOM 0 HB2 ASP A 308 14.783 -5.308 7.779 1.00 0.00 H new ATOM 0 HB3 ASP A 308 13.138 -4.706 7.811 1.00 0.00 H new ATOM 1266 N VAL A 309 12.600 -3.424 5.123 1.00 0.00 N ATOM 1267 CA VAL A 309 12.437 -2.026 4.704 1.00 0.00 C ATOM 1268 C VAL A 309 11.147 -1.411 5.261 1.00 0.00 C ATOM 1269 O VAL A 309 10.055 -1.770 4.851 1.00 0.00 O ATOM 1270 CB VAL A 309 12.438 -1.896 3.149 1.00 0.00 C ATOM 1271 CG1 VAL A 309 11.688 -3.045 2.489 1.00 0.00 C ATOM 1272 CG2 VAL A 309 11.839 -0.569 2.679 1.00 0.00 C ATOM 0 H VAL A 309 11.730 -3.957 5.135 1.00 0.00 H new ATOM 0 HA VAL A 309 13.288 -1.480 5.110 1.00 0.00 H new ATOM 0 HB VAL A 309 13.485 -1.931 2.846 1.00 0.00 H new ATOM 0 HG11 VAL A 309 11.710 -2.920 1.406 1.00 0.00 H new ATOM 0 HG12 VAL A 309 12.162 -3.990 2.755 1.00 0.00 H new ATOM 0 HG13 VAL A 309 10.654 -3.049 2.833 1.00 0.00 H new ATOM 0 HG21 VAL A 309 11.862 -0.525 1.590 1.00 0.00 H new ATOM 0 HG22 VAL A 309 10.808 -0.493 3.024 1.00 0.00 H new ATOM 0 HG23 VAL A 309 12.420 0.258 3.088 1.00 0.00 H new ATOM 1282 N THR A 310 11.266 -0.472 6.184 1.00 0.00 N ATOM 1283 CA THR A 310 10.083 0.179 6.742 1.00 0.00 C ATOM 1284 C THR A 310 9.856 1.549 6.099 1.00 0.00 C ATOM 1285 O THR A 310 10.736 2.413 6.147 1.00 0.00 O ATOM 1286 CB THR A 310 10.218 0.361 8.280 1.00 0.00 C ATOM 1287 OG1 THR A 310 10.394 -0.910 8.916 1.00 0.00 O ATOM 1288 CG2 THR A 310 9.007 1.080 8.901 1.00 0.00 C ATOM 0 H THR A 310 12.155 -0.144 6.562 1.00 0.00 H new ATOM 0 HA THR A 310 9.231 -0.466 6.529 1.00 0.00 H new ATOM 0 HB THR A 310 11.094 0.988 8.445 1.00 0.00 H new ATOM 0 HG1 THR A 310 10.480 -0.782 9.884 1.00 0.00 H new ATOM 0 HG21 THR A 310 9.155 1.180 9.976 1.00 0.00 H new ATOM 0 HG22 THR A 310 8.904 2.069 8.456 1.00 0.00 H new ATOM 0 HG23 THR A 310 8.103 0.501 8.712 1.00 0.00 H new ATOM 1296 N VAL A 311 8.680 1.746 5.504 1.00 0.00 N ATOM 1297 CA VAL A 311 8.328 3.041 4.906 1.00 0.00 C ATOM 1298 C VAL A 311 6.846 3.344 5.070 1.00 0.00 C ATOM 1299 O VAL A 311 6.018 2.446 5.220 1.00 0.00 O ATOM 1300 CB VAL A 311 8.668 3.125 3.392 1.00 0.00 C ATOM 1301 CG1 VAL A 311 10.176 3.237 3.159 1.00 0.00 C ATOM 1302 CG2 VAL A 311 8.114 1.909 2.642 1.00 0.00 C ATOM 0 H VAL A 311 7.956 1.032 5.421 1.00 0.00 H new ATOM 0 HA VAL A 311 8.930 3.774 5.442 1.00 0.00 H new ATOM 0 HB VAL A 311 8.196 4.028 3.004 1.00 0.00 H new ATOM 0 HG11 VAL A 311 10.376 3.294 2.089 1.00 0.00 H new ATOM 0 HG12 VAL A 311 10.554 4.136 3.647 1.00 0.00 H new ATOM 0 HG13 VAL A 311 10.674 2.362 3.575 1.00 0.00 H new ATOM 0 HG21 VAL A 311 8.364 1.989 1.584 1.00 0.00 H new ATOM 0 HG22 VAL A 311 8.553 0.999 3.051 1.00 0.00 H new ATOM 0 HG23 VAL A 311 7.031 1.873 2.757 1.00 0.00 H new ATOM 1312 N THR A 312 6.523 4.620 5.037 1.00 0.00 N ATOM 1313 CA THR A 312 5.149 5.063 5.130 1.00 0.00 C ATOM 1314 C THR A 312 4.720 5.675 3.803 1.00 0.00 C ATOM 1315 O THR A 312 5.494 6.385 3.152 1.00 0.00 O ATOM 1316 CB THR A 312 4.989 6.097 6.274 1.00 0.00 C ATOM 1317 OG1 THR A 312 5.144 5.447 7.537 1.00 0.00 O ATOM 1318 CG2 THR A 312 3.637 6.841 6.227 1.00 0.00 C ATOM 0 H THR A 312 7.202 5.375 4.945 1.00 0.00 H new ATOM 0 HA THR A 312 4.514 4.206 5.352 1.00 0.00 H new ATOM 0 HB THR A 312 5.768 6.848 6.138 1.00 0.00 H new ATOM 0 HG1 THR A 312 4.311 5.521 8.047 1.00 0.00 H new ATOM 0 HG21 THR A 312 3.584 7.551 7.052 1.00 0.00 H new ATOM 0 HG22 THR A 312 3.549 7.376 5.282 1.00 0.00 H new ATOM 0 HG23 THR A 312 2.823 6.122 6.314 1.00 0.00 H new ATOM 1326 N LEU A 313 3.495 5.390 3.409 1.00 0.00 N ATOM 1327 CA LEU A 313 2.991 5.801 2.121 1.00 0.00 C ATOM 1328 C LEU A 313 1.873 6.816 2.277 1.00 0.00 C ATOM 1329 O LEU A 313 1.022 6.680 3.152 1.00 0.00 O ATOM 1330 CB LEU A 313 2.518 4.580 1.337 1.00 0.00 C ATOM 1331 CG LEU A 313 3.611 3.534 1.091 1.00 0.00 C ATOM 1332 CD1 LEU A 313 3.724 2.555 2.251 1.00 0.00 C ATOM 1333 CD2 LEU A 313 3.383 2.799 -0.218 1.00 0.00 C ATOM 0 H LEU A 313 2.825 4.868 3.974 1.00 0.00 H new ATOM 0 HA LEU A 313 3.796 6.282 1.565 1.00 0.00 H new ATOM 0 HB2 LEU A 313 1.696 4.111 1.877 1.00 0.00 H new ATOM 0 HB3 LEU A 313 2.122 4.909 0.376 1.00 0.00 H new ATOM 0 HG LEU A 313 4.558 4.068 1.018 1.00 0.00 H new ATOM 0 HD11 LEU A 313 4.509 1.829 2.039 1.00 0.00 H new ATOM 0 HD12 LEU A 313 3.969 3.099 3.163 1.00 0.00 H new ATOM 0 HD13 LEU A 313 2.775 2.035 2.382 1.00 0.00 H new ATOM 0 HD21 LEU A 313 4.174 2.064 -0.365 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.418 2.293 -0.188 1.00 0.00 H new ATOM 0 HD23 LEU A 313 3.393 3.512 -1.042 1.00 0.00 H new ATOM 1345 N SER A 314 1.886 7.839 1.443 1.00 0.00 N ATOM 1346 CA SER A 314 0.869 8.874 1.503 1.00 0.00 C ATOM 1347 C SER A 314 0.446 9.286 0.101 1.00 0.00 C ATOM 1348 O SER A 314 1.255 9.800 -0.678 1.00 0.00 O ATOM 1349 CB SER A 314 1.386 10.083 2.289 1.00 0.00 C ATOM 1350 OG SER A 314 2.550 10.625 1.692 1.00 0.00 O ATOM 0 H SER A 314 2.589 7.976 0.716 1.00 0.00 H new ATOM 0 HA SER A 314 -0.004 8.475 2.020 1.00 0.00 H new ATOM 0 HB2 SER A 314 0.610 10.847 2.337 1.00 0.00 H new ATOM 0 HB3 SER A 314 1.605 9.786 3.315 1.00 0.00 H new ATOM 0 HG SER A 314 2.481 10.554 0.717 1.00 0.00 H new ATOM 1632 N VAL A 333 -6.071 -3.809 8.058 1.00 0.00 N ATOM 1633 CA VAL A 333 -4.877 -4.384 8.660 1.00 0.00 C ATOM 1634 C VAL A 333 -4.687 -5.842 8.227 1.00 0.00 C ATOM 1635 O VAL A 333 -5.414 -6.745 8.648 1.00 0.00 O ATOM 1636 CB VAL A 333 -4.885 -4.269 10.202 1.00 0.00 C ATOM 1637 CG1 VAL A 333 -4.757 -2.814 10.626 1.00 0.00 C ATOM 1638 CG2 VAL A 333 -6.141 -4.886 10.805 1.00 0.00 C ATOM 0 HA VAL A 333 -4.030 -3.802 8.296 1.00 0.00 H new ATOM 0 HB VAL A 333 -4.027 -4.826 10.579 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -4.764 -2.750 11.714 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -3.821 -2.405 10.245 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -5.594 -2.243 10.223 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -6.111 -4.786 11.890 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -7.021 -4.372 10.418 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -6.191 -5.942 10.539 1.00 0.00 H new ATOM 1648 N GLU A 334 -3.714 -6.054 7.354 1.00 0.00 N ATOM 1649 CA GLU A 334 -3.446 -7.370 6.800 1.00 0.00 C ATOM 1650 C GLU A 334 -2.068 -7.385 6.147 1.00 0.00 C ATOM 1651 O GLU A 334 -1.726 -6.471 5.399 1.00 0.00 O ATOM 1652 CB GLU A 334 -4.512 -7.724 5.767 1.00 0.00 C ATOM 1653 CG GLU A 334 -4.415 -9.143 5.238 1.00 0.00 C ATOM 1654 CD GLU A 334 -4.988 -9.263 3.847 1.00 0.00 C ATOM 1655 OE1 GLU A 334 -6.232 -9.258 3.700 1.00 0.00 O ATOM 1656 OE2 GLU A 334 -4.193 -9.318 2.891 1.00 0.00 O1- ATOM 0 H GLU A 334 -3.091 -5.322 7.012 1.00 0.00 H new ATOM 0 HA GLU A 334 -3.469 -8.107 7.603 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -5.496 -7.580 6.213 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -4.436 -7.030 4.930 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -3.371 -9.457 5.230 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -4.946 -9.818 5.909 1.00 0.00 H new ATOM 1663 N ALA A 335 -1.276 -8.400 6.452 1.00 0.00 N ATOM 1664 CA ALA A 335 0.039 -8.548 5.844 1.00 0.00 C ATOM 1665 C ALA A 335 -0.007 -9.555 4.698 1.00 0.00 C ATOM 1666 O ALA A 335 -0.899 -10.407 4.652 1.00 0.00 O ATOM 1667 CB ALA A 335 1.055 -8.987 6.887 1.00 0.00 C ATOM 0 H ALA A 335 -1.519 -9.134 7.117 1.00 0.00 H new ATOM 0 HA ALA A 335 0.342 -7.581 5.442 1.00 0.00 H new ATOM 0 HB1 ALA A 335 2.034 -9.094 6.419 1.00 0.00 H new ATOM 0 HB2 ALA A 335 1.111 -8.239 7.678 1.00 0.00 H new ATOM 0 HB3 ALA A 335 0.750 -9.943 7.312 1.00 0.00 H new ATOM 1673 N GLY A 336 0.954 -9.472 3.782 1.00 0.00 N ATOM 1674 CA GLY A 336 1.040 -10.461 2.721 1.00 0.00 C ATOM 1675 C GLY A 336 1.119 -9.863 1.329 1.00 0.00 C ATOM 1676 O GLY A 336 1.575 -10.530 0.401 1.00 0.00 O ATOM 0 H GLY A 336 1.669 -8.745 3.755 1.00 0.00 H new ATOM 0 HA2 GLY A 336 1.919 -11.084 2.889 1.00 0.00 H new ATOM 0 HA3 GLY A 336 0.170 -11.115 2.776 1.00 0.00 H new ATOM 1680 N ASP A 337 0.661 -8.624 1.172 1.00 0.00 N ATOM 1681 CA ASP A 337 0.699 -7.946 -0.121 1.00 0.00 C ATOM 1682 C ASP A 337 2.121 -7.894 -0.685 1.00 0.00 C ATOM 1683 O ASP A 337 3.091 -7.704 0.054 1.00 0.00 O ATOM 1684 CB ASP A 337 0.126 -6.531 -0.001 1.00 0.00 C ATOM 1685 CG ASP A 337 -1.318 -6.529 0.467 1.00 0.00 C ATOM 1686 OD1 ASP A 337 -1.624 -5.844 1.465 1.00 0.00 O ATOM 1687 OD2 ASP A 337 -2.154 -7.220 -0.156 1.00 0.00 O1- ATOM 0 H ASP A 337 0.258 -8.068 1.926 1.00 0.00 H new ATOM 0 HA ASP A 337 0.084 -8.520 -0.814 1.00 0.00 H new ATOM 0 HB2 ASP A 337 0.732 -5.955 0.698 1.00 0.00 H new ATOM 0 HB3 ASP A 337 0.192 -6.032 -0.968 1.00 0.00 H new ATOM 1692 N ALA A 338 2.238 -8.077 -1.997 1.00 0.00 N ATOM 1693 CA ALA A 338 3.540 -8.087 -2.662 1.00 0.00 C ATOM 1694 C ALA A 338 3.819 -6.739 -3.312 1.00 0.00 C ATOM 1695 O ALA A 338 2.929 -6.144 -3.913 1.00 0.00 O ATOM 1696 CB ALA A 338 3.602 -9.199 -3.699 1.00 0.00 C ATOM 0 H ALA A 338 1.446 -8.221 -2.623 1.00 0.00 H new ATOM 0 HA ALA A 338 4.307 -8.273 -1.910 1.00 0.00 H new ATOM 0 HB1 ALA A 338 4.578 -9.191 -4.183 1.00 0.00 H new ATOM 0 HB2 ALA A 338 3.447 -10.161 -3.211 1.00 0.00 H new ATOM 0 HB3 ALA A 338 2.825 -9.043 -4.447 1.00 0.00 H new ATOM 1702 N VAL A 339 5.059 -6.283 -3.211 1.00 0.00 N ATOM 1703 CA VAL A 339 5.422 -4.922 -3.587 1.00 0.00 C ATOM 1704 C VAL A 339 6.426 -4.893 -4.748 1.00 0.00 C ATOM 1705 O VAL A 339 7.243 -5.800 -4.900 1.00 0.00 O ATOM 1706 CB VAL A 339 6.021 -4.195 -2.349 1.00 0.00 C ATOM 1707 CG1 VAL A 339 6.639 -2.854 -2.726 1.00 0.00 C ATOM 1708 CG2 VAL A 339 4.945 -3.984 -1.296 1.00 0.00 C ATOM 0 H VAL A 339 5.840 -6.842 -2.868 1.00 0.00 H new ATOM 0 HA VAL A 339 4.521 -4.412 -3.926 1.00 0.00 H new ATOM 0 HB VAL A 339 6.811 -4.829 -1.946 1.00 0.00 H new ATOM 0 HG11 VAL A 339 7.046 -2.378 -1.834 1.00 0.00 H new ATOM 0 HG12 VAL A 339 7.438 -3.012 -3.450 1.00 0.00 H new ATOM 0 HG13 VAL A 339 5.875 -2.212 -3.164 1.00 0.00 H new ATOM 0 HG21 VAL A 339 5.375 -3.474 -0.434 1.00 0.00 H new ATOM 0 HG22 VAL A 339 4.142 -3.377 -1.713 1.00 0.00 H new ATOM 0 HG23 VAL A 339 4.546 -4.949 -0.985 1.00 0.00 H new ATOM 1718 N SER A 340 6.334 -3.856 -5.576 1.00 0.00 N ATOM 1719 CA SER A 340 7.291 -3.611 -6.642 1.00 0.00 C ATOM 1720 C SER A 340 7.533 -2.100 -6.766 1.00 0.00 C ATOM 1721 O SER A 340 6.896 -1.313 -6.074 1.00 0.00 O ATOM 1722 CB SER A 340 6.770 -4.204 -7.956 1.00 0.00 C ATOM 1723 OG SER A 340 7.699 -4.036 -9.014 1.00 0.00 O ATOM 0 H SER A 340 5.589 -3.161 -5.523 1.00 0.00 H new ATOM 0 HA SER A 340 8.240 -4.095 -6.411 1.00 0.00 H new ATOM 0 HB2 SER A 340 6.563 -5.265 -7.819 1.00 0.00 H new ATOM 0 HB3 SER A 340 5.827 -3.727 -8.221 1.00 0.00 H new ATOM 0 HG SER A 340 8.531 -4.505 -8.796 1.00 0.00 H new ATOM 1729 N VAL A 341 8.453 -1.696 -7.636 1.00 0.00 N ATOM 1730 CA VAL A 341 8.848 -0.289 -7.754 1.00 0.00 C ATOM 1731 C VAL A 341 8.543 0.240 -9.157 1.00 0.00 C ATOM 1732 O VAL A 341 8.635 -0.497 -10.136 1.00 0.00 O ATOM 1733 CB VAL A 341 10.356 -0.106 -7.459 1.00 0.00 C ATOM 1734 CG1 VAL A 341 10.743 1.365 -7.462 1.00 0.00 C ATOM 1735 CG2 VAL A 341 10.736 -0.748 -6.134 1.00 0.00 C ATOM 0 H VAL A 341 8.943 -2.323 -8.274 1.00 0.00 H new ATOM 0 HA VAL A 341 8.273 0.275 -7.020 1.00 0.00 H new ATOM 0 HB VAL A 341 10.907 -0.606 -8.255 1.00 0.00 H new ATOM 0 HG11 VAL A 341 11.808 1.461 -7.252 1.00 0.00 H new ATOM 0 HG12 VAL A 341 10.525 1.796 -8.439 1.00 0.00 H new ATOM 0 HG13 VAL A 341 10.173 1.893 -6.697 1.00 0.00 H new ATOM 0 HG21 VAL A 341 11.801 -0.604 -5.952 1.00 0.00 H new ATOM 0 HG22 VAL A 341 10.165 -0.286 -5.329 1.00 0.00 H new ATOM 0 HG23 VAL A 341 10.515 -1.815 -6.170 1.00 0.00 H new ATOM 1745 N VAL A 342 8.177 1.522 -9.240 1.00 0.00 N ATOM 1746 CA VAL A 342 7.843 2.155 -10.516 1.00 0.00 C ATOM 1747 C VAL A 342 9.093 2.456 -11.342 1.00 0.00 C ATOM 1748 O VAL A 342 9.097 2.272 -12.560 1.00 0.00 O ATOM 1749 CB VAL A 342 7.044 3.468 -10.308 1.00 0.00 C ATOM 1750 CG1 VAL A 342 6.972 4.282 -11.596 1.00 0.00 C ATOM 1751 CG2 VAL A 342 5.638 3.165 -9.817 1.00 0.00 C ATOM 0 H VAL A 342 8.105 2.143 -8.434 1.00 0.00 H new ATOM 0 HA VAL A 342 7.223 1.442 -11.060 1.00 0.00 H new ATOM 0 HB VAL A 342 7.569 4.056 -9.555 1.00 0.00 H new ATOM 0 HG11 VAL A 342 6.406 5.196 -11.418 1.00 0.00 H new ATOM 0 HG12 VAL A 342 7.980 4.538 -11.922 1.00 0.00 H new ATOM 0 HG13 VAL A 342 6.478 3.695 -12.370 1.00 0.00 H new ATOM 0 HG21 VAL A 342 5.093 4.098 -9.677 1.00 0.00 H new ATOM 0 HG22 VAL A 342 5.121 2.549 -10.553 1.00 0.00 H new ATOM 0 HG23 VAL A 342 5.691 2.630 -8.869 1.00 0.00 H new