USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=31 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 250 THR OG1 : rot -72:sc= 0.168 USER MOD Set 1.2: A 310 THR OG1 : rot 171:sc= -1.79! USER MOD Set 2.1: A 248 THR OG1 : rot 180:sc= 0.942 USER MOD Set 2.2: A 312 THR OG1 : rot -112:sc= 0.432 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+ 171:sc= 0 (180deg=-0.0637) USER MOD Single : A 232 THR OG1 : rot -51:sc= -1.01! USER MOD Single : A 233 GLN :FLIP amide:sc= -0.12 F(o=-1.1,f=-0.12) USER MOD Single : A 235 THR OG1 : rot 180:sc= 0 USER MOD Single : A 237 THR OG1 : rot 180:sc= 0 USER MOD Single : A 238 TYR OH : rot 180:sc= 0 USER MOD Single : A 239 ASN : amide:sc= -3.4! C(o=-3.4!,f=-3!) USER MOD Single : A 242 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0333) USER MOD Single : A 244 SER OG : rot 180:sc=-0.00706 USER MOD Single : A 245 TYR OH : rot 180:sc= 0 USER MOD Single : A 246 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 252 THR OG1 : rot 180:sc= -1.31 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0.0361 USER MOD Single : A 257 SER OG : rot -39:sc= 0.585 USER MOD Single : A 259 THR OG1 : rot 180:sc= 0 USER MOD Single : A 263 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 267 GLN :FLIP amide:sc= -0.0355 F(o=-1.7!,f=-0.036) USER MOD Single : A 269 LYS NZ :NH3+ -164:sc= -0.0229 (180deg=-0.281) USER MOD Single : A 271 THR OG1 : rot 180:sc= 0 USER MOD Single : A 272 ASN : amide:sc= 0.981 K(o=0.98,f=-0.25) USER MOD Single : A 292 SER OG : rot 32:sc= -1.19 USER MOD Single : A 294 THR OG1 : rot 180:sc= 0 USER MOD Single : A 296 THR OG1 : rot 180:sc= -1.01 USER MOD Single : A 298 THR OG1 : rot -43:sc= 0.539 USER MOD Single : A 302 ASN : amide:sc= -0.115 X(o=-0.11,f=-0.11) USER MOD Single : A 303 SER OG : rot -90:sc= 1.32 USER MOD Single : A 305 SER OG : rot 180:sc= 0 USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 340 SER OG : rot 180:sc= -0.0114 USER MOD ----------------------------------------------------------------- ATOM 47 N GLY A 226 12.940 -3.557 -8.616 1.00 0.00 N ATOM 48 CA GLY A 226 12.865 -3.737 -7.184 1.00 0.00 C ATOM 49 C GLY A 226 11.589 -4.429 -6.759 1.00 0.00 C ATOM 50 O GLY A 226 10.490 -3.900 -6.948 1.00 0.00 O ATOM 0 HA2 GLY A 226 13.722 -4.321 -6.848 1.00 0.00 H new ATOM 0 HA3 GLY A 226 12.930 -2.766 -6.694 1.00 0.00 H new ATOM 54 N THR A 227 11.736 -5.617 -6.203 1.00 0.00 N ATOM 55 CA THR A 227 10.609 -6.382 -5.710 1.00 0.00 C ATOM 56 C THR A 227 10.667 -6.448 -4.194 1.00 0.00 C ATOM 57 O THR A 227 11.744 -6.569 -3.608 1.00 0.00 O ATOM 58 CB THR A 227 10.615 -7.803 -6.301 1.00 0.00 C ATOM 59 OG1 THR A 227 10.724 -7.730 -7.730 1.00 0.00 O ATOM 60 CG2 THR A 227 9.351 -8.566 -5.930 1.00 0.00 C ATOM 0 H THR A 227 12.638 -6.077 -6.081 1.00 0.00 H new ATOM 0 HA THR A 227 9.687 -5.889 -6.018 1.00 0.00 H new ATOM 0 HB THR A 227 11.470 -8.336 -5.886 1.00 0.00 H new ATOM 0 HG1 THR A 227 10.729 -8.636 -8.104 1.00 0.00 H new ATOM 0 HG21 THR A 227 9.389 -9.565 -6.364 1.00 0.00 H new ATOM 0 HG22 THR A 227 9.278 -8.644 -4.845 1.00 0.00 H new ATOM 0 HG23 THR A 227 8.480 -8.036 -6.315 1.00 0.00 H new ATOM 68 N LEU A 228 9.516 -6.352 -3.565 1.00 0.00 N ATOM 69 CA LEU A 228 9.441 -6.268 -2.124 1.00 0.00 C ATOM 70 C LEU A 228 8.287 -7.108 -1.599 1.00 0.00 C ATOM 71 O LEU A 228 7.481 -7.626 -2.371 1.00 0.00 O ATOM 72 CB LEU A 228 9.282 -4.803 -1.726 1.00 0.00 C ATOM 73 CG LEU A 228 10.539 -3.930 -1.961 1.00 0.00 C ATOM 74 CD1 LEU A 228 10.147 -2.497 -2.294 1.00 0.00 C ATOM 75 CD2 LEU A 228 11.457 -3.937 -0.751 1.00 0.00 C ATOM 0 H LEU A 228 8.611 -6.330 -4.035 1.00 0.00 H new ATOM 0 HA LEU A 228 10.356 -6.662 -1.683 1.00 0.00 H new ATOM 0 HB2 LEU A 228 8.450 -4.376 -2.286 1.00 0.00 H new ATOM 0 HB3 LEU A 228 9.014 -4.754 -0.671 1.00 0.00 H new ATOM 0 HG LEU A 228 11.077 -4.361 -2.805 1.00 0.00 H new ATOM 0 HD11 LEU A 228 11.046 -1.902 -2.455 1.00 0.00 H new ATOM 0 HD12 LEU A 228 9.538 -2.487 -3.198 1.00 0.00 H new ATOM 0 HD13 LEU A 228 9.576 -2.075 -1.467 1.00 0.00 H new ATOM 0 HD21 LEU A 228 12.329 -3.314 -0.952 1.00 0.00 H new ATOM 0 HD22 LEU A 228 10.922 -3.545 0.114 1.00 0.00 H new ATOM 0 HD23 LEU A 228 11.780 -4.957 -0.545 1.00 0.00 H new ATOM 87 N THR A 229 8.217 -7.240 -0.292 1.00 0.00 N ATOM 88 CA THR A 229 7.220 -8.078 0.343 1.00 0.00 C ATOM 89 C THR A 229 6.473 -7.288 1.419 1.00 0.00 C ATOM 90 O THR A 229 7.011 -6.343 1.995 1.00 0.00 O ATOM 91 CB THR A 229 7.905 -9.301 0.976 1.00 0.00 C ATOM 92 OG1 THR A 229 8.692 -9.981 -0.012 1.00 0.00 O ATOM 93 CG2 THR A 229 6.901 -10.278 1.584 1.00 0.00 C ATOM 0 H THR A 229 8.847 -6.772 0.360 1.00 0.00 H new ATOM 0 HA THR A 229 6.504 -8.411 -0.408 1.00 0.00 H new ATOM 0 HB THR A 229 8.541 -8.935 1.782 1.00 0.00 H new ATOM 0 HG1 THR A 229 9.128 -10.758 0.395 1.00 0.00 H new ATOM 0 HG21 THR A 229 7.434 -11.124 2.018 1.00 0.00 H new ATOM 0 HG22 THR A 229 6.327 -9.773 2.361 1.00 0.00 H new ATOM 0 HG23 THR A 229 6.225 -10.635 0.807 1.00 0.00 H new ATOM 101 N VAL A 230 5.238 -7.680 1.680 1.00 0.00 N ATOM 102 CA VAL A 230 4.416 -7.026 2.691 1.00 0.00 C ATOM 103 C VAL A 230 4.548 -7.767 4.015 1.00 0.00 C ATOM 104 O VAL A 230 4.035 -8.875 4.167 1.00 0.00 O ATOM 105 CB VAL A 230 2.927 -6.985 2.273 1.00 0.00 C ATOM 106 CG1 VAL A 230 2.081 -6.296 3.338 1.00 0.00 C ATOM 107 CG2 VAL A 230 2.761 -6.272 0.937 1.00 0.00 C ATOM 0 H VAL A 230 4.777 -8.454 1.203 1.00 0.00 H new ATOM 0 HA VAL A 230 4.768 -6.000 2.797 1.00 0.00 H new ATOM 0 HB VAL A 230 2.583 -8.014 2.167 1.00 0.00 H new ATOM 0 HG11 VAL A 230 1.038 -6.280 3.020 1.00 0.00 H new ATOM 0 HG12 VAL A 230 2.166 -6.841 4.278 1.00 0.00 H new ATOM 0 HG13 VAL A 230 2.433 -5.274 3.478 1.00 0.00 H new ATOM 0 HG21 VAL A 230 1.706 -6.255 0.662 1.00 0.00 H new ATOM 0 HG22 VAL A 230 3.131 -5.250 1.022 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.327 -6.800 0.170 1.00 0.00 H new ATOM 117 N LYS A 231 5.236 -7.159 4.970 1.00 0.00 N ATOM 118 CA LYS A 231 5.530 -7.832 6.231 1.00 0.00 C ATOM 119 C LYS A 231 4.498 -7.469 7.295 1.00 0.00 C ATOM 120 O LYS A 231 4.167 -8.275 8.162 1.00 0.00 O ATOM 121 CB LYS A 231 6.942 -7.475 6.707 1.00 0.00 C ATOM 122 CG LYS A 231 7.483 -8.408 7.774 1.00 0.00 C ATOM 123 CD LYS A 231 7.447 -9.853 7.308 1.00 0.00 C ATOM 124 CE LYS A 231 8.317 -10.749 8.171 1.00 0.00 C ATOM 125 NZ LYS A 231 7.979 -10.646 9.615 1.00 0.00 N1+ ATOM 0 H LYS A 231 5.600 -6.209 4.899 1.00 0.00 H new ATOM 0 HA LYS A 231 5.479 -8.908 6.065 1.00 0.00 H new ATOM 0 HB2 LYS A 231 7.617 -7.486 5.851 1.00 0.00 H new ATOM 0 HB3 LYS A 231 6.937 -6.457 7.096 1.00 0.00 H new ATOM 0 HG2 LYS A 231 8.507 -8.128 8.021 1.00 0.00 H new ATOM 0 HG3 LYS A 231 6.895 -8.302 8.686 1.00 0.00 H new ATOM 0 HD2 LYS A 231 6.419 -10.216 7.329 1.00 0.00 H new ATOM 0 HD3 LYS A 231 7.783 -9.909 6.273 1.00 0.00 H new ATOM 0 HE2 LYS A 231 8.203 -11.783 7.847 1.00 0.00 H new ATOM 0 HE3 LYS A 231 9.364 -10.483 8.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 8.489 -11.381 10.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 8.256 -9.709 9.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 6.955 -10.776 9.742 1.00 0.00 H new ATOM 139 N THR A 232 3.993 -6.250 7.214 1.00 0.00 N ATOM 140 CA THR A 232 2.969 -5.772 8.131 1.00 0.00 C ATOM 141 C THR A 232 1.813 -5.180 7.341 1.00 0.00 C ATOM 142 O THR A 232 1.741 -5.349 6.129 1.00 0.00 O ATOM 143 CB THR A 232 3.519 -4.720 9.106 1.00 0.00 C ATOM 144 OG1 THR A 232 4.085 -3.639 8.371 1.00 0.00 O ATOM 145 CG2 THR A 232 4.565 -5.322 10.034 1.00 0.00 C ATOM 0 H THR A 232 4.279 -5.565 6.514 1.00 0.00 H new ATOM 0 HA THR A 232 2.625 -6.623 8.719 1.00 0.00 H new ATOM 0 HB THR A 232 2.695 -4.356 9.720 1.00 0.00 H new ATOM 0 HG1 THR A 232 4.714 -3.989 7.706 1.00 0.00 H new ATOM 0 HG21 THR A 232 4.935 -4.553 10.712 1.00 0.00 H new ATOM 0 HG22 THR A 232 4.117 -6.130 10.612 1.00 0.00 H new ATOM 0 HG23 THR A 232 5.393 -5.714 9.443 1.00 0.00 H new ATOM 153 N GLN A 233 0.923 -4.476 8.015 1.00 0.00 N ATOM 154 CA GLN A 233 -0.309 -4.037 7.390 1.00 0.00 C ATOM 155 C GLN A 233 -0.327 -2.520 7.247 1.00 0.00 C ATOM 156 O GLN A 233 -0.087 -1.796 8.215 1.00 0.00 O ATOM 157 CB GLN A 233 -1.509 -4.492 8.218 1.00 0.00 C ATOM 158 CG GLN A 233 -1.479 -5.958 8.621 1.00 0.00 C ATOM 159 CD GLN A 233 -2.694 -6.360 9.436 1.00 0.00 C ATOM 160 OE1 GLN A 233 -3.260 -5.414 10.171 1.00 0.00 O flip ATOM 161 NE2 GLN A 233 -3.126 -7.510 9.399 1.00 0.00 N flip ATOM 0 H GLN A 233 1.030 -4.197 8.990 1.00 0.00 H new ATOM 0 HA GLN A 233 -0.368 -4.483 6.397 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.564 -3.882 9.119 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.419 -4.303 7.649 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -1.425 -6.577 7.725 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -0.576 -6.154 9.199 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -2.662 -8.211 8.821 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -3.948 -7.764 9.947 1.00 0.00 H new ATOM 170 N PRO A 234 -0.605 -2.023 6.036 1.00 0.00 N ATOM 171 CA PRO A 234 -0.666 -0.588 5.767 1.00 0.00 C ATOM 172 C PRO A 234 -1.982 0.042 6.219 1.00 0.00 C ATOM 173 O PRO A 234 -3.034 -0.174 5.617 1.00 0.00 O ATOM 174 CB PRO A 234 -0.519 -0.516 4.247 1.00 0.00 C ATOM 175 CG PRO A 234 -1.085 -1.800 3.741 1.00 0.00 C ATOM 176 CD PRO A 234 -0.873 -2.824 4.826 1.00 0.00 C ATOM 0 HA PRO A 234 0.100 -0.035 6.311 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -1.057 0.340 3.839 1.00 0.00 H new ATOM 0 HB3 PRO A 234 0.526 -0.404 3.957 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -2.145 -1.692 3.512 1.00 0.00 H new ATOM 0 HG3 PRO A 234 -0.590 -2.105 2.819 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -1.752 -3.456 4.954 1.00 0.00 H new ATOM 0 HD3 PRO A 234 -0.037 -3.484 4.593 1.00 0.00 H new ATOM 184 N THR A 235 -1.918 0.816 7.287 1.00 0.00 N ATOM 185 CA THR A 235 -3.092 1.500 7.800 1.00 0.00 C ATOM 186 C THR A 235 -2.940 3.011 7.615 1.00 0.00 C ATOM 187 O THR A 235 -1.826 3.543 7.666 1.00 0.00 O ATOM 188 CB THR A 235 -3.343 1.134 9.280 1.00 0.00 C ATOM 189 OG1 THR A 235 -4.584 1.694 9.730 1.00 0.00 O ATOM 190 CG2 THR A 235 -2.203 1.619 10.171 1.00 0.00 C ATOM 0 H THR A 235 -1.064 0.987 7.817 1.00 0.00 H new ATOM 0 HA THR A 235 -3.964 1.173 7.234 1.00 0.00 H new ATOM 0 HB THR A 235 -3.394 0.047 9.349 1.00 0.00 H new ATOM 0 HG1 THR A 235 -4.731 1.453 10.668 1.00 0.00 H new ATOM 0 HG21 THR A 235 -2.409 1.346 11.206 1.00 0.00 H new ATOM 0 HG22 THR A 235 -1.270 1.155 9.852 1.00 0.00 H new ATOM 0 HG23 THR A 235 -2.115 2.703 10.092 1.00 0.00 H new ATOM 198 N VAL A 236 -4.057 3.696 7.389 1.00 0.00 N ATOM 199 CA VAL A 236 -4.025 5.077 6.918 1.00 0.00 C ATOM 200 C VAL A 236 -4.498 6.072 7.978 1.00 0.00 C ATOM 201 O VAL A 236 -5.486 5.839 8.675 1.00 0.00 O ATOM 202 CB VAL A 236 -4.909 5.258 5.662 1.00 0.00 C ATOM 203 CG1 VAL A 236 -4.681 6.623 5.031 1.00 0.00 C ATOM 204 CG2 VAL A 236 -4.668 4.147 4.649 1.00 0.00 C ATOM 0 H VAL A 236 -4.995 3.318 7.524 1.00 0.00 H new ATOM 0 HA VAL A 236 -2.981 5.283 6.682 1.00 0.00 H new ATOM 0 HB VAL A 236 -5.950 5.198 5.979 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -5.314 6.727 4.150 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -4.931 7.403 5.751 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -3.635 6.719 4.740 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -5.305 4.304 3.778 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -3.623 4.156 4.340 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -4.904 3.184 5.102 1.00 0.00 H new ATOM 214 N THR A 237 -3.776 7.178 8.088 1.00 0.00 N ATOM 215 CA THR A 237 -4.218 8.326 8.859 1.00 0.00 C ATOM 216 C THR A 237 -4.754 9.396 7.900 1.00 0.00 C ATOM 217 O THR A 237 -4.009 9.899 7.055 1.00 0.00 O ATOM 218 CB THR A 237 -3.052 8.920 9.679 1.00 0.00 C ATOM 219 OG1 THR A 237 -2.389 7.883 10.419 1.00 0.00 O ATOM 220 CG2 THR A 237 -3.551 9.992 10.636 1.00 0.00 C ATOM 0 H THR A 237 -2.866 7.303 7.644 1.00 0.00 H new ATOM 0 HA THR A 237 -5.000 8.005 9.548 1.00 0.00 H new ATOM 0 HB THR A 237 -2.347 9.376 8.983 1.00 0.00 H new ATOM 0 HG1 THR A 237 -1.650 8.270 10.934 1.00 0.00 H new ATOM 0 HG21 THR A 237 -2.711 10.394 11.202 1.00 0.00 H new ATOM 0 HG22 THR A 237 -4.024 10.794 10.069 1.00 0.00 H new ATOM 0 HG23 THR A 237 -4.276 9.557 11.324 1.00 0.00 H new ATOM 228 N TYR A 238 -6.039 9.722 8.004 1.00 0.00 N ATOM 229 CA TYR A 238 -6.650 10.683 7.089 1.00 0.00 C ATOM 230 C TYR A 238 -6.840 12.047 7.742 1.00 0.00 C ATOM 231 O TYR A 238 -7.347 12.151 8.861 1.00 0.00 O ATOM 232 CB TYR A 238 -8.016 10.168 6.573 1.00 0.00 C ATOM 233 CG TYR A 238 -7.900 9.139 5.483 1.00 0.00 C ATOM 234 CD1 TYR A 238 -7.507 9.515 4.212 1.00 0.00 C ATOM 235 CD2 TYR A 238 -8.172 7.801 5.718 1.00 0.00 C ATOM 236 CE1 TYR A 238 -7.384 8.598 3.202 1.00 0.00 C ATOM 237 CE2 TYR A 238 -8.055 6.867 4.709 1.00 0.00 C ATOM 238 CZ TYR A 238 -7.659 7.270 3.450 1.00 0.00 C ATOM 239 OH TYR A 238 -7.534 6.343 2.442 1.00 0.00 O ATOM 0 H TYR A 238 -6.673 9.340 8.705 1.00 0.00 H new ATOM 0 HA TYR A 238 -5.965 10.794 6.249 1.00 0.00 H new ATOM 0 HB2 TYR A 238 -8.572 9.740 7.407 1.00 0.00 H new ATOM 0 HB3 TYR A 238 -8.597 11.013 6.203 1.00 0.00 H new ATOM 0 HD1 TYR A 238 -7.292 10.554 4.011 1.00 0.00 H new ATOM 0 HD2 TYR A 238 -8.480 7.485 6.704 1.00 0.00 H new ATOM 0 HE1 TYR A 238 -7.073 8.913 2.217 1.00 0.00 H new ATOM 0 HE2 TYR A 238 -8.272 5.827 4.903 1.00 0.00 H new ATOM 0 HH TYR A 238 -7.764 5.454 2.785 1.00 0.00 H new ATOM 249 N ASN A 239 -6.416 13.087 7.035 1.00 0.00 N ATOM 250 CA ASN A 239 -6.666 14.460 7.441 1.00 0.00 C ATOM 251 C ASN A 239 -6.950 15.272 6.183 1.00 0.00 C ATOM 252 O ASN A 239 -6.050 15.848 5.576 1.00 0.00 O ATOM 253 CB ASN A 239 -5.460 15.018 8.203 1.00 0.00 C ATOM 254 CG ASN A 239 -5.850 15.800 9.445 1.00 0.00 C ATOM 255 OD1 ASN A 239 -5.142 16.716 9.860 1.00 0.00 O ATOM 256 ND2 ASN A 239 -6.960 15.432 10.069 1.00 0.00 N ATOM 0 H ASN A 239 -5.890 13.000 6.165 1.00 0.00 H new ATOM 0 HA ASN A 239 -7.522 14.513 8.114 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -4.806 14.194 8.490 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -4.886 15.664 7.539 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -7.250 15.913 10.921 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -7.524 14.668 9.698 1.00 0.00 H new ATOM 263 N ALA A 240 -8.213 15.312 5.800 1.00 0.00 N ATOM 264 CA ALA A 240 -8.600 15.720 4.453 1.00 0.00 C ATOM 265 C ALA A 240 -8.812 17.219 4.344 1.00 0.00 C ATOM 266 O ALA A 240 -8.407 17.838 3.362 1.00 0.00 O ATOM 267 CB ALA A 240 -9.847 14.974 4.018 1.00 0.00 C ATOM 0 H ALA A 240 -8.997 15.066 6.404 1.00 0.00 H new ATOM 0 HA ALA A 240 -7.777 15.464 3.786 1.00 0.00 H new ATOM 0 HB1 ALA A 240 -10.126 15.287 3.012 1.00 0.00 H new ATOM 0 HB2 ALA A 240 -9.650 13.902 4.023 1.00 0.00 H new ATOM 0 HB3 ALA A 240 -10.663 15.196 4.706 1.00 0.00 H new ATOM 273 N VAL A 241 -9.439 17.804 5.355 1.00 0.00 N ATOM 274 CA VAL A 241 -9.614 19.250 5.403 1.00 0.00 C ATOM 275 C VAL A 241 -8.244 19.914 5.507 1.00 0.00 C ATOM 276 O VAL A 241 -8.054 21.069 5.125 1.00 0.00 O ATOM 277 CB VAL A 241 -10.494 19.675 6.607 1.00 0.00 C ATOM 278 CG1 VAL A 241 -10.710 21.186 6.640 1.00 0.00 C ATOM 279 CG2 VAL A 241 -11.835 18.953 6.576 1.00 0.00 C ATOM 0 H VAL A 241 -9.834 17.302 6.151 1.00 0.00 H new ATOM 0 HA VAL A 241 -10.120 19.568 4.491 1.00 0.00 H new ATOM 0 HB VAL A 241 -9.962 19.392 7.515 1.00 0.00 H new ATOM 0 HG11 VAL A 241 -11.331 21.446 7.497 1.00 0.00 H new ATOM 0 HG12 VAL A 241 -9.747 21.689 6.724 1.00 0.00 H new ATOM 0 HG13 VAL A 241 -11.206 21.503 5.723 1.00 0.00 H new ATOM 0 HG21 VAL A 241 -12.436 19.266 7.429 1.00 0.00 H new ATOM 0 HG22 VAL A 241 -12.359 19.199 5.653 1.00 0.00 H new ATOM 0 HG23 VAL A 241 -11.670 17.877 6.624 1.00 0.00 H new ATOM 289 N LYS A 242 -7.287 19.148 6.004 1.00 0.00 N ATOM 290 CA LYS A 242 -5.930 19.626 6.180 1.00 0.00 C ATOM 291 C LYS A 242 -5.063 19.261 4.983 1.00 0.00 C ATOM 292 O LYS A 242 -3.950 19.762 4.822 1.00 0.00 O ATOM 293 CB LYS A 242 -5.348 19.031 7.454 1.00 0.00 C ATOM 294 CG LYS A 242 -6.223 19.280 8.670 1.00 0.00 C ATOM 295 CD LYS A 242 -6.322 20.762 9.001 1.00 0.00 C ATOM 296 CE LYS A 242 -4.959 21.385 9.269 1.00 0.00 C ATOM 297 NZ LYS A 242 -4.310 20.811 10.477 1.00 0.00 N1+ ATOM 0 H LYS A 242 -7.430 18.181 6.295 1.00 0.00 H new ATOM 0 HA LYS A 242 -5.948 20.713 6.260 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -5.215 17.957 7.321 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -4.359 19.455 7.630 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -7.221 18.881 8.488 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -5.816 18.743 9.527 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -6.802 21.286 8.174 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -6.959 20.895 9.876 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -4.314 21.231 8.404 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -5.071 22.462 9.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -3.425 21.321 10.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -4.949 20.904 11.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -4.101 19.805 10.314 1.00 0.00 H new ATOM 311 N ASP A 243 -5.613 18.380 4.154 1.00 0.00 N ATOM 312 CA ASP A 243 -4.958 17.886 2.942 1.00 0.00 C ATOM 313 C ASP A 243 -3.658 17.174 3.285 1.00 0.00 C ATOM 314 O ASP A 243 -2.578 17.547 2.826 1.00 0.00 O ATOM 315 CB ASP A 243 -4.700 19.029 1.955 1.00 0.00 C ATOM 316 CG ASP A 243 -4.521 18.543 0.529 1.00 0.00 C ATOM 317 OD1 ASP A 243 -5.517 18.535 -0.223 1.00 0.00 O ATOM 318 OD2 ASP A 243 -3.390 18.168 0.149 1.00 0.00 O1- ATOM 0 H ASP A 243 -6.540 17.982 4.305 1.00 0.00 H new ATOM 0 HA ASP A 243 -5.627 17.170 2.466 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -5.533 19.731 1.993 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -3.808 19.575 2.263 1.00 0.00 H new ATOM 323 N SER A 244 -3.769 16.153 4.111 1.00 0.00 N ATOM 324 CA SER A 244 -2.621 15.364 4.517 1.00 0.00 C ATOM 325 C SER A 244 -3.035 13.912 4.722 1.00 0.00 C ATOM 326 O SER A 244 -3.851 13.608 5.592 1.00 0.00 O ATOM 327 CB SER A 244 -2.023 15.931 5.807 1.00 0.00 C ATOM 328 OG SER A 244 -1.713 17.309 5.662 1.00 0.00 O ATOM 0 H SER A 244 -4.653 15.847 4.519 1.00 0.00 H new ATOM 0 HA SER A 244 -1.865 15.408 3.733 1.00 0.00 H new ATOM 0 HB2 SER A 244 -2.728 15.798 6.628 1.00 0.00 H new ATOM 0 HB3 SER A 244 -1.121 15.377 6.068 1.00 0.00 H new ATOM 0 HG SER A 244 -1.334 17.649 6.499 1.00 0.00 H new ATOM 334 N TYR A 245 -2.496 13.020 3.907 1.00 0.00 N ATOM 335 CA TYR A 245 -2.789 11.621 4.021 1.00 0.00 C ATOM 336 C TYR A 245 -1.479 10.910 4.278 1.00 0.00 C ATOM 337 O TYR A 245 -0.474 11.227 3.642 1.00 0.00 O ATOM 338 CB TYR A 245 -3.463 11.118 2.730 1.00 0.00 C ATOM 339 CG TYR A 245 -4.678 11.921 2.290 1.00 0.00 C ATOM 340 CD1 TYR A 245 -5.690 12.264 3.184 1.00 0.00 C ATOM 341 CD2 TYR A 245 -4.824 12.310 0.965 1.00 0.00 C ATOM 342 CE1 TYR A 245 -6.799 12.970 2.772 1.00 0.00 C ATOM 343 CE2 TYR A 245 -5.931 13.023 0.546 1.00 0.00 C ATOM 344 CZ TYR A 245 -6.918 13.349 1.454 1.00 0.00 C ATOM 345 OH TYR A 245 -8.024 14.056 1.042 1.00 0.00 O ATOM 0 H TYR A 245 -1.848 13.254 3.155 1.00 0.00 H new ATOM 0 HA TYR A 245 -3.482 11.425 4.839 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -2.728 11.128 1.925 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -3.764 10.080 2.874 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -5.603 11.971 4.220 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -4.058 12.051 0.249 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -7.573 13.225 3.481 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -6.023 13.324 -0.487 1.00 0.00 H new ATOM 0 HH TYR A 245 -7.952 14.246 0.083 1.00 0.00 H new ATOM 355 N GLN A 246 -1.459 10.007 5.246 1.00 0.00 N ATOM 356 CA GLN A 246 -0.256 9.236 5.533 1.00 0.00 C ATOM 357 C GLN A 246 -0.620 7.813 5.926 1.00 0.00 C ATOM 358 O GLN A 246 -1.434 7.609 6.823 1.00 0.00 O ATOM 359 CB GLN A 246 0.550 9.873 6.668 1.00 0.00 C ATOM 360 CG GLN A 246 1.028 11.288 6.382 1.00 0.00 C ATOM 361 CD GLN A 246 1.779 11.899 7.548 1.00 0.00 C ATOM 362 OE1 GLN A 246 2.459 11.066 8.322 1.00 0.00 O flip ATOM 363 NE2 GLN A 246 1.750 13.112 7.752 1.00 0.00 N flip ATOM 0 H GLN A 246 -2.256 9.790 5.844 1.00 0.00 H new ATOM 0 HA GLN A 246 0.351 9.226 4.628 1.00 0.00 H new ATOM 0 HB2 GLN A 246 -0.062 9.885 7.570 1.00 0.00 H new ATOM 0 HB3 GLN A 246 1.416 9.246 6.879 1.00 0.00 H new ATOM 0 HG2 GLN A 246 1.674 11.278 5.504 1.00 0.00 H new ATOM 0 HG3 GLN A 246 0.170 11.915 6.139 1.00 0.00 H new ATOM 0 HE21 GLN A 246 1.215 13.721 7.133 1.00 0.00 H new ATOM 0 HE22 GLN A 246 2.261 13.509 8.540 1.00 0.00 H new ATOM 372 N PHE A 247 -0.036 6.826 5.259 1.00 0.00 N ATOM 373 CA PHE A 247 -0.246 5.447 5.676 1.00 0.00 C ATOM 374 C PHE A 247 1.074 4.699 5.810 1.00 0.00 C ATOM 375 O PHE A 247 1.931 4.779 4.938 1.00 0.00 O ATOM 376 CB PHE A 247 -1.260 4.717 4.780 1.00 0.00 C ATOM 377 CG PHE A 247 -0.801 4.203 3.437 1.00 0.00 C ATOM 378 CD1 PHE A 247 -0.815 5.011 2.311 1.00 0.00 C ATOM 379 CD2 PHE A 247 -0.449 2.872 3.291 1.00 0.00 C ATOM 380 CE1 PHE A 247 -0.487 4.500 1.069 1.00 0.00 C ATOM 381 CE2 PHE A 247 -0.103 2.361 2.056 1.00 0.00 C ATOM 382 CZ PHE A 247 -0.128 3.174 0.943 1.00 0.00 C ATOM 0 H PHE A 247 0.571 6.948 4.448 1.00 0.00 H new ATOM 0 HA PHE A 247 -0.693 5.471 6.670 1.00 0.00 H new ATOM 0 HB2 PHE A 247 -1.649 3.869 5.343 1.00 0.00 H new ATOM 0 HB3 PHE A 247 -2.096 5.395 4.607 1.00 0.00 H new ATOM 0 HD1 PHE A 247 -1.085 6.052 2.405 1.00 0.00 H new ATOM 0 HD2 PHE A 247 -0.445 2.224 4.155 1.00 0.00 H new ATOM 0 HE1 PHE A 247 -0.512 5.138 0.198 1.00 0.00 H new ATOM 0 HE2 PHE A 247 0.187 1.325 1.962 1.00 0.00 H new ATOM 0 HZ PHE A 247 0.133 2.774 -0.026 1.00 0.00 H new ATOM 392 N THR A 248 1.236 3.977 6.915 1.00 0.00 N ATOM 393 CA THR A 248 2.532 3.442 7.294 1.00 0.00 C ATOM 394 C THR A 248 2.607 1.953 7.017 1.00 0.00 C ATOM 395 O THR A 248 1.625 1.227 7.204 1.00 0.00 O ATOM 396 CB THR A 248 2.797 3.704 8.793 1.00 0.00 C ATOM 397 OG1 THR A 248 2.774 5.114 9.047 1.00 0.00 O ATOM 398 CG2 THR A 248 4.135 3.128 9.240 1.00 0.00 C ATOM 0 H THR A 248 0.481 3.751 7.563 1.00 0.00 H new ATOM 0 HA THR A 248 3.293 3.945 6.697 1.00 0.00 H new ATOM 0 HB THR A 248 2.011 3.207 9.362 1.00 0.00 H new ATOM 0 HG1 THR A 248 2.941 5.278 9.999 1.00 0.00 H new ATOM 0 HG21 THR A 248 4.284 3.333 10.300 1.00 0.00 H new ATOM 0 HG22 THR A 248 4.141 2.051 9.075 1.00 0.00 H new ATOM 0 HG23 THR A 248 4.939 3.587 8.665 1.00 0.00 H new ATOM 406 N VAL A 249 3.766 1.496 6.569 1.00 0.00 N ATOM 407 CA VAL A 249 3.935 0.079 6.278 1.00 0.00 C ATOM 408 C VAL A 249 5.355 -0.415 6.592 1.00 0.00 C ATOM 409 O VAL A 249 6.347 0.225 6.245 1.00 0.00 O ATOM 410 CB VAL A 249 3.597 -0.228 4.799 1.00 0.00 C ATOM 411 CG1 VAL A 249 4.641 0.335 3.848 1.00 0.00 C ATOM 412 CG2 VAL A 249 3.406 -1.723 4.586 1.00 0.00 C ATOM 0 H VAL A 249 4.590 2.073 6.401 1.00 0.00 H new ATOM 0 HA VAL A 249 3.240 -0.454 6.927 1.00 0.00 H new ATOM 0 HB VAL A 249 2.656 0.271 4.570 1.00 0.00 H new ATOM 0 HG11 VAL A 249 4.364 0.096 2.821 1.00 0.00 H new ATOM 0 HG12 VAL A 249 4.696 1.417 3.967 1.00 0.00 H new ATOM 0 HG13 VAL A 249 5.613 -0.104 4.073 1.00 0.00 H new ATOM 0 HG21 VAL A 249 3.169 -1.914 3.539 1.00 0.00 H new ATOM 0 HG22 VAL A 249 4.323 -2.249 4.853 1.00 0.00 H new ATOM 0 HG23 VAL A 249 2.589 -2.078 5.213 1.00 0.00 H new ATOM 422 N THR A 250 5.444 -1.544 7.277 1.00 0.00 N ATOM 423 CA THR A 250 6.697 -2.254 7.435 1.00 0.00 C ATOM 424 C THR A 250 6.762 -3.364 6.395 1.00 0.00 C ATOM 425 O THR A 250 5.920 -4.271 6.388 1.00 0.00 O ATOM 426 CB THR A 250 6.824 -2.847 8.856 1.00 0.00 C ATOM 427 OG1 THR A 250 6.886 -1.790 9.820 1.00 0.00 O ATOM 428 CG2 THR A 250 8.050 -3.743 8.986 1.00 0.00 C ATOM 0 H THR A 250 4.650 -1.990 7.737 1.00 0.00 H new ATOM 0 HA THR A 250 7.524 -1.558 7.292 1.00 0.00 H new ATOM 0 HB THR A 250 5.943 -3.462 9.042 1.00 0.00 H new ATOM 0 HG1 THR A 250 7.754 -1.339 9.756 1.00 0.00 H new ATOM 0 HG21 THR A 250 8.104 -4.141 9.999 1.00 0.00 H new ATOM 0 HG22 THR A 250 7.975 -4.567 8.276 1.00 0.00 H new ATOM 0 HG23 THR A 250 8.949 -3.163 8.775 1.00 0.00 H new ATOM 436 N LEU A 251 7.724 -3.279 5.498 1.00 0.00 N ATOM 437 CA LEU A 251 7.819 -4.225 4.411 1.00 0.00 C ATOM 438 C LEU A 251 9.081 -5.049 4.554 1.00 0.00 C ATOM 439 O LEU A 251 9.933 -4.780 5.404 1.00 0.00 O ATOM 440 CB LEU A 251 7.846 -3.495 3.060 1.00 0.00 C ATOM 441 CG LEU A 251 6.886 -2.319 2.918 1.00 0.00 C ATOM 442 CD1 LEU A 251 7.658 -1.074 2.524 1.00 0.00 C ATOM 443 CD2 LEU A 251 5.812 -2.614 1.883 1.00 0.00 C ATOM 0 H LEU A 251 8.450 -2.563 5.503 1.00 0.00 H new ATOM 0 HA LEU A 251 6.946 -4.877 4.447 1.00 0.00 H new ATOM 0 HB2 LEU A 251 8.860 -3.135 2.884 1.00 0.00 H new ATOM 0 HB3 LEU A 251 7.624 -4.217 2.274 1.00 0.00 H new ATOM 0 HG LEU A 251 6.396 -2.155 3.878 1.00 0.00 H new ATOM 0 HD11 LEU A 251 6.969 -0.235 2.423 1.00 0.00 H new ATOM 0 HD12 LEU A 251 8.397 -0.846 3.292 1.00 0.00 H new ATOM 0 HD13 LEU A 251 8.163 -1.245 1.573 1.00 0.00 H new ATOM 0 HD21 LEU A 251 5.141 -1.759 1.801 1.00 0.00 H new ATOM 0 HD22 LEU A 251 6.280 -2.802 0.917 1.00 0.00 H new ATOM 0 HD23 LEU A 251 5.244 -3.493 2.188 1.00 0.00 H new ATOM 455 N THR A 252 9.185 -6.061 3.737 1.00 0.00 N ATOM 456 CA THR A 252 10.392 -6.830 3.631 1.00 0.00 C ATOM 457 C THR A 252 10.993 -6.646 2.238 1.00 0.00 C ATOM 458 O THR A 252 10.267 -6.404 1.271 1.00 0.00 O ATOM 459 CB THR A 252 10.102 -8.311 3.883 1.00 0.00 C ATOM 460 OG1 THR A 252 8.679 -8.521 3.954 1.00 0.00 O ATOM 461 CG2 THR A 252 10.764 -8.791 5.173 1.00 0.00 C ATOM 0 H THR A 252 8.432 -6.376 3.125 1.00 0.00 H new ATOM 0 HA THR A 252 11.102 -6.483 4.381 1.00 0.00 H new ATOM 0 HB THR A 252 10.516 -8.887 3.056 1.00 0.00 H new ATOM 0 HG1 THR A 252 8.496 -9.470 4.114 1.00 0.00 H new ATOM 0 HG21 THR A 252 10.540 -9.847 5.326 1.00 0.00 H new ATOM 0 HG22 THR A 252 11.843 -8.655 5.100 1.00 0.00 H new ATOM 0 HG23 THR A 252 10.382 -8.214 6.015 1.00 0.00 H new ATOM 469 N GLY A 253 12.305 -6.742 2.140 1.00 0.00 N ATOM 470 CA GLY A 253 12.980 -6.549 0.879 1.00 0.00 C ATOM 471 C GLY A 253 14.229 -7.392 0.772 1.00 0.00 C ATOM 472 O GLY A 253 14.275 -8.513 1.282 1.00 0.00 O ATOM 0 H GLY A 253 12.923 -6.953 2.923 1.00 0.00 H new ATOM 0 HA2 GLY A 253 12.302 -6.799 0.063 1.00 0.00 H new ATOM 0 HA3 GLY A 253 13.242 -5.497 0.765 1.00 0.00 H new ATOM 476 N ALA A 254 15.252 -6.849 0.131 1.00 0.00 N ATOM 477 CA ALA A 254 16.472 -7.602 -0.111 1.00 0.00 C ATOM 478 C ALA A 254 17.624 -7.157 0.777 1.00 0.00 C ATOM 479 O ALA A 254 17.465 -6.289 1.635 1.00 0.00 O ATOM 480 CB ALA A 254 16.862 -7.517 -1.579 1.00 0.00 C ATOM 0 H ALA A 254 15.262 -5.895 -0.229 1.00 0.00 H new ATOM 0 HA ALA A 254 16.263 -8.640 0.146 1.00 0.00 H new ATOM 0 HB1 ALA A 254 17.777 -8.085 -1.746 1.00 0.00 H new ATOM 0 HB2 ALA A 254 16.061 -7.930 -2.193 1.00 0.00 H new ATOM 0 HB3 ALA A 254 17.027 -6.475 -1.852 1.00 0.00 H new ATOM 486 N THR A 255 18.779 -7.766 0.542 1.00 0.00 N ATOM 487 CA THR A 255 19.947 -7.618 1.394 1.00 0.00 C ATOM 488 C THR A 255 20.549 -6.204 1.328 1.00 0.00 C ATOM 489 O THR A 255 20.055 -5.332 0.604 1.00 0.00 O ATOM 490 CB THR A 255 21.005 -8.669 0.976 1.00 0.00 C ATOM 491 OG1 THR A 255 20.326 -9.859 0.552 1.00 0.00 O ATOM 492 CG2 THR A 255 21.959 -9.035 2.124 1.00 0.00 C ATOM 0 H THR A 255 18.931 -8.383 -0.256 1.00 0.00 H new ATOM 0 HA THR A 255 19.636 -7.777 2.426 1.00 0.00 H new ATOM 0 HB THR A 255 21.601 -8.236 0.173 1.00 0.00 H new ATOM 0 HG1 THR A 255 20.984 -10.533 0.283 1.00 0.00 H new ATOM 0 HG21 THR A 255 22.680 -9.775 1.776 1.00 0.00 H new ATOM 0 HG22 THR A 255 22.488 -8.142 2.456 1.00 0.00 H new ATOM 0 HG23 THR A 255 21.387 -9.448 2.955 1.00 0.00 H new ATOM 500 N ALA A 256 21.611 -5.996 2.103 1.00 0.00 N ATOM 501 CA ALA A 256 22.333 -4.731 2.164 1.00 0.00 C ATOM 502 C ALA A 256 22.949 -4.346 0.813 1.00 0.00 C ATOM 503 O ALA A 256 22.731 -5.023 -0.198 1.00 0.00 O ATOM 504 CB ALA A 256 23.406 -4.810 3.244 1.00 0.00 C ATOM 0 H ALA A 256 21.999 -6.714 2.715 1.00 0.00 H new ATOM 0 HA ALA A 256 21.618 -3.948 2.415 1.00 0.00 H new ATOM 0 HB1 ALA A 256 23.946 -3.864 3.290 1.00 0.00 H new ATOM 0 HB2 ALA A 256 22.938 -5.008 4.208 1.00 0.00 H new ATOM 0 HB3 ALA A 256 24.102 -5.614 3.007 1.00 0.00 H new ATOM 510 N SER A 257 23.696 -3.233 0.817 1.00 0.00 N ATOM 511 CA SER A 257 24.337 -2.678 -0.375 1.00 0.00 C ATOM 512 C SER A 257 23.340 -1.862 -1.201 1.00 0.00 C ATOM 513 O SER A 257 23.656 -1.397 -2.298 1.00 0.00 O ATOM 514 CB SER A 257 24.993 -3.781 -1.225 1.00 0.00 C ATOM 515 OG SER A 257 25.718 -3.245 -2.322 1.00 0.00 O ATOM 0 H SER A 257 23.872 -2.689 1.661 1.00 0.00 H new ATOM 0 HA SER A 257 25.129 -2.006 -0.044 1.00 0.00 H new ATOM 0 HB2 SER A 257 25.664 -4.370 -0.600 1.00 0.00 H new ATOM 0 HB3 SER A 257 24.224 -4.459 -1.595 1.00 0.00 H new ATOM 0 HG SER A 257 25.222 -2.491 -2.705 1.00 0.00 H new ATOM 521 N VAL A 258 22.143 -1.671 -0.659 1.00 0.00 N ATOM 522 CA VAL A 258 21.166 -0.778 -1.256 1.00 0.00 C ATOM 523 C VAL A 258 20.707 0.236 -0.214 1.00 0.00 C ATOM 524 O VAL A 258 19.747 0.004 0.536 1.00 0.00 O ATOM 525 CB VAL A 258 19.943 -1.533 -1.827 1.00 0.00 C ATOM 526 CG1 VAL A 258 19.005 -0.573 -2.548 1.00 0.00 C ATOM 527 CG2 VAL A 258 20.384 -2.648 -2.766 1.00 0.00 C ATOM 0 H VAL A 258 21.828 -2.127 0.197 1.00 0.00 H new ATOM 0 HA VAL A 258 21.649 -0.273 -2.092 1.00 0.00 H new ATOM 0 HB VAL A 258 19.404 -1.981 -0.992 1.00 0.00 H new ATOM 0 HG11 VAL A 258 18.152 -1.125 -2.942 1.00 0.00 H new ATOM 0 HG12 VAL A 258 18.655 0.187 -1.849 1.00 0.00 H new ATOM 0 HG13 VAL A 258 19.537 -0.093 -3.369 1.00 0.00 H new ATOM 0 HG21 VAL A 258 19.506 -3.165 -3.155 1.00 0.00 H new ATOM 0 HG22 VAL A 258 20.952 -2.223 -3.594 1.00 0.00 H new ATOM 0 HG23 VAL A 258 21.010 -3.355 -2.222 1.00 0.00 H new ATOM 537 N THR A 259 21.420 1.354 -0.161 1.00 0.00 N ATOM 538 CA THR A 259 21.139 2.404 0.799 1.00 0.00 C ATOM 539 C THR A 259 19.821 3.090 0.464 1.00 0.00 C ATOM 540 O THR A 259 19.763 3.974 -0.395 1.00 0.00 O ATOM 541 CB THR A 259 22.273 3.446 0.821 1.00 0.00 C ATOM 542 OG1 THR A 259 23.542 2.778 0.883 1.00 0.00 O ATOM 543 CG2 THR A 259 22.126 4.373 2.019 1.00 0.00 C ATOM 0 H THR A 259 22.205 1.554 -0.781 1.00 0.00 H new ATOM 0 HA THR A 259 21.065 1.946 1.785 1.00 0.00 H new ATOM 0 HB THR A 259 22.216 4.041 -0.090 1.00 0.00 H new ATOM 0 HG1 THR A 259 24.262 3.443 0.895 1.00 0.00 H new ATOM 0 HG21 THR A 259 22.937 5.102 2.017 1.00 0.00 H new ATOM 0 HG22 THR A 259 21.170 4.893 1.961 1.00 0.00 H new ATOM 0 HG23 THR A 259 22.166 3.789 2.938 1.00 0.00 H new ATOM 551 N GLY A 260 18.766 2.661 1.140 1.00 0.00 N ATOM 552 CA GLY A 260 17.448 3.180 0.876 1.00 0.00 C ATOM 553 C GLY A 260 16.925 2.768 -0.483 1.00 0.00 C ATOM 554 O GLY A 260 17.317 3.344 -1.499 1.00 0.00 O ATOM 0 H GLY A 260 18.805 1.954 1.874 1.00 0.00 H new ATOM 0 HA2 GLY A 260 16.762 2.830 1.647 1.00 0.00 H new ATOM 0 HA3 GLY A 260 17.470 4.268 0.939 1.00 0.00 H new ATOM 558 N PHE A 261 16.077 1.739 -0.513 1.00 0.00 N ATOM 559 CA PHE A 261 15.345 1.385 -1.729 1.00 0.00 C ATOM 560 C PHE A 261 14.792 2.631 -2.431 1.00 0.00 C ATOM 561 O PHE A 261 14.988 2.812 -3.632 1.00 0.00 O ATOM 562 CB PHE A 261 14.158 0.456 -1.415 1.00 0.00 C ATOM 563 CG PHE A 261 14.488 -1.008 -1.421 1.00 0.00 C ATOM 564 CD1 PHE A 261 14.854 -1.636 -2.600 1.00 0.00 C ATOM 565 CD2 PHE A 261 14.402 -1.761 -0.262 1.00 0.00 C ATOM 566 CE1 PHE A 261 15.130 -2.988 -2.624 1.00 0.00 C ATOM 567 CE2 PHE A 261 14.683 -3.114 -0.280 1.00 0.00 C ATOM 568 CZ PHE A 261 15.045 -3.728 -1.463 1.00 0.00 C ATOM 0 H PHE A 261 15.881 1.138 0.288 1.00 0.00 H new ATOM 0 HA PHE A 261 16.056 0.876 -2.380 1.00 0.00 H new ATOM 0 HB2 PHE A 261 13.757 0.720 -0.437 1.00 0.00 H new ATOM 0 HB3 PHE A 261 13.368 0.639 -2.143 1.00 0.00 H new ATOM 0 HD1 PHE A 261 14.924 -1.061 -3.511 1.00 0.00 H new ATOM 0 HD2 PHE A 261 14.113 -1.287 0.664 1.00 0.00 H new ATOM 0 HE1 PHE A 261 15.412 -3.466 -3.550 1.00 0.00 H new ATOM 0 HE2 PHE A 261 14.620 -3.691 0.631 1.00 0.00 H new ATOM 0 HZ PHE A 261 15.261 -4.786 -1.479 1.00 0.00 H new ATOM 578 N LEU A 262 14.111 3.485 -1.669 1.00 0.00 N ATOM 579 CA LEU A 262 13.454 4.664 -2.224 1.00 0.00 C ATOM 580 C LEU A 262 13.052 5.630 -1.113 1.00 0.00 C ATOM 581 O LEU A 262 13.067 5.264 0.063 1.00 0.00 O ATOM 582 CB LEU A 262 12.234 4.246 -3.058 1.00 0.00 C ATOM 583 CG LEU A 262 11.424 3.055 -2.523 1.00 0.00 C ATOM 584 CD1 LEU A 262 10.746 3.384 -1.204 1.00 0.00 C ATOM 585 CD2 LEU A 262 10.398 2.620 -3.554 1.00 0.00 C ATOM 0 H LEU A 262 14.000 3.380 -0.660 1.00 0.00 H new ATOM 0 HA LEU A 262 14.157 5.181 -2.878 1.00 0.00 H new ATOM 0 HB2 LEU A 262 11.567 5.104 -3.143 1.00 0.00 H new ATOM 0 HB3 LEU A 262 12.574 4.005 -4.065 1.00 0.00 H new ATOM 0 HG LEU A 262 12.117 2.234 -2.338 1.00 0.00 H new ATOM 0 HD11 LEU A 262 10.183 2.517 -0.858 1.00 0.00 H new ATOM 0 HD12 LEU A 262 11.501 3.646 -0.462 1.00 0.00 H new ATOM 0 HD13 LEU A 262 10.067 4.225 -1.344 1.00 0.00 H new ATOM 0 HD21 LEU A 262 9.828 1.775 -3.167 1.00 0.00 H new ATOM 0 HD22 LEU A 262 9.721 3.448 -3.765 1.00 0.00 H new ATOM 0 HD23 LEU A 262 10.907 2.324 -4.471 1.00 0.00 H new ATOM 597 N LYS A 263 12.706 6.859 -1.486 1.00 0.00 N ATOM 598 CA LYS A 263 12.346 7.889 -0.521 1.00 0.00 C ATOM 599 C LYS A 263 11.183 8.742 -1.015 1.00 0.00 C ATOM 600 O LYS A 263 10.486 8.369 -1.957 1.00 0.00 O ATOM 601 CB LYS A 263 13.550 8.778 -0.216 1.00 0.00 C ATOM 602 CG LYS A 263 14.621 8.057 0.569 1.00 0.00 C ATOM 603 CD LYS A 263 15.737 8.992 1.008 1.00 0.00 C ATOM 604 CE LYS A 263 16.505 9.553 -0.177 1.00 0.00 C ATOM 605 NZ LYS A 263 17.663 10.377 0.257 1.00 0.00 N1+ ATOM 0 H LYS A 263 12.668 7.166 -2.458 1.00 0.00 H new ATOM 0 HA LYS A 263 12.030 7.385 0.392 1.00 0.00 H new ATOM 0 HB2 LYS A 263 13.974 9.143 -1.152 1.00 0.00 H new ATOM 0 HB3 LYS A 263 13.219 9.651 0.346 1.00 0.00 H new ATOM 0 HG2 LYS A 263 14.174 7.590 1.447 1.00 0.00 H new ATOM 0 HG3 LYS A 263 15.039 7.256 -0.040 1.00 0.00 H new ATOM 0 HD2 LYS A 263 15.316 9.812 1.589 1.00 0.00 H new ATOM 0 HD3 LYS A 263 16.423 8.456 1.664 1.00 0.00 H new ATOM 0 HE2 LYS A 263 16.857 8.733 -0.804 1.00 0.00 H new ATOM 0 HE3 LYS A 263 15.837 10.159 -0.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 18.162 10.742 -0.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 17.325 11.174 0.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 18.313 9.793 0.820 1.00 0.00 H new ATOM 619 N ALA A 264 10.973 9.877 -0.352 1.00 0.00 N ATOM 620 CA ALA A 264 9.901 10.798 -0.691 1.00 0.00 C ATOM 621 C ALA A 264 9.913 11.162 -2.164 1.00 0.00 C ATOM 622 O ALA A 264 10.880 11.729 -2.679 1.00 0.00 O ATOM 623 CB ALA A 264 9.998 12.052 0.157 1.00 0.00 C ATOM 0 H ALA A 264 11.545 10.181 0.436 1.00 0.00 H new ATOM 0 HA ALA A 264 8.957 10.293 -0.483 1.00 0.00 H new ATOM 0 HB1 ALA A 264 9.189 12.733 -0.107 1.00 0.00 H new ATOM 0 HB2 ALA A 264 9.918 11.786 1.211 1.00 0.00 H new ATOM 0 HB3 ALA A 264 10.956 12.539 -0.023 1.00 0.00 H new ATOM 629 N GLY A 265 8.836 10.816 -2.835 1.00 0.00 N ATOM 630 CA GLY A 265 8.695 11.139 -4.238 1.00 0.00 C ATOM 631 C GLY A 265 8.849 9.920 -5.117 1.00 0.00 C ATOM 632 O GLY A 265 8.577 9.969 -6.319 1.00 0.00 O ATOM 0 H GLY A 265 8.046 10.312 -2.432 1.00 0.00 H new ATOM 0 HA2 GLY A 265 7.717 11.589 -4.410 1.00 0.00 H new ATOM 0 HA3 GLY A 265 9.442 11.883 -4.516 1.00 0.00 H new ATOM 636 N ASP A 266 9.289 8.823 -4.518 1.00 0.00 N ATOM 637 CA ASP A 266 9.465 7.574 -5.246 1.00 0.00 C ATOM 638 C ASP A 266 8.209 6.725 -5.125 1.00 0.00 C ATOM 639 O ASP A 266 7.616 6.624 -4.047 1.00 0.00 O ATOM 640 CB ASP A 266 10.684 6.806 -4.728 1.00 0.00 C ATOM 641 CG ASP A 266 11.993 7.528 -5.002 1.00 0.00 C ATOM 642 OD1 ASP A 266 12.632 8.008 -4.040 1.00 0.00 O ATOM 643 OD2 ASP A 266 12.389 7.625 -6.182 1.00 0.00 O1- ATOM 0 H ASP A 266 9.531 8.772 -3.528 1.00 0.00 H new ATOM 0 HA ASP A 266 9.637 7.806 -6.297 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.579 6.648 -3.655 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.713 5.821 -5.194 1.00 0.00 H new ATOM 648 N GLN A 267 7.793 6.127 -6.231 1.00 0.00 N ATOM 649 CA GLN A 267 6.520 5.423 -6.272 1.00 0.00 C ATOM 650 C GLN A 267 6.697 3.910 -6.333 1.00 0.00 C ATOM 651 O GLN A 267 7.682 3.397 -6.869 1.00 0.00 O ATOM 652 CB GLN A 267 5.693 5.890 -7.469 1.00 0.00 C ATOM 653 CG GLN A 267 5.574 7.401 -7.570 1.00 0.00 C ATOM 654 CD GLN A 267 4.576 7.846 -8.621 1.00 0.00 C ATOM 655 OE1 GLN A 267 3.509 7.081 -8.791 1.00 0.00 O flip ATOM 656 NE2 GLN A 267 4.753 8.885 -9.257 1.00 0.00 N flip ATOM 0 H GLN A 267 8.315 6.115 -7.107 1.00 0.00 H new ATOM 0 HA GLN A 267 5.996 5.660 -5.346 1.00 0.00 H new ATOM 0 HB2 GLN A 267 6.144 5.507 -8.384 1.00 0.00 H new ATOM 0 HB3 GLN A 267 4.694 5.458 -7.401 1.00 0.00 H new ATOM 0 HG2 GLN A 267 5.277 7.802 -6.601 1.00 0.00 H new ATOM 0 HG3 GLN A 267 6.552 7.822 -7.803 1.00 0.00 H new ATOM 0 HE21 GLN A 267 5.590 9.446 -9.095 1.00 0.00 H new ATOM 0 HE22 GLN A 267 4.063 9.185 -9.946 1.00 0.00 H new ATOM 665 N VAL A 268 5.710 3.211 -5.799 1.00 0.00 N ATOM 666 CA VAL A 268 5.691 1.755 -5.788 1.00 0.00 C ATOM 667 C VAL A 268 4.402 1.249 -6.419 1.00 0.00 C ATOM 668 O VAL A 268 3.447 2.003 -6.564 1.00 0.00 O ATOM 669 CB VAL A 268 5.768 1.176 -4.347 1.00 0.00 C ATOM 670 CG1 VAL A 268 7.205 1.122 -3.856 1.00 0.00 C ATOM 671 CG2 VAL A 268 4.917 2.003 -3.383 1.00 0.00 C ATOM 0 H VAL A 268 4.895 3.638 -5.359 1.00 0.00 H new ATOM 0 HA VAL A 268 6.565 1.426 -6.350 1.00 0.00 H new ATOM 0 HB VAL A 268 5.375 0.160 -4.378 1.00 0.00 H new ATOM 0 HG11 VAL A 268 7.229 0.713 -2.846 1.00 0.00 H new ATOM 0 HG12 VAL A 268 7.792 0.487 -4.519 1.00 0.00 H new ATOM 0 HG13 VAL A 268 7.626 2.128 -3.851 1.00 0.00 H new ATOM 0 HG21 VAL A 268 4.986 1.579 -2.381 1.00 0.00 H new ATOM 0 HG22 VAL A 268 5.279 3.031 -3.368 1.00 0.00 H new ATOM 0 HG23 VAL A 268 3.878 1.989 -3.712 1.00 0.00 H new ATOM 681 N LYS A 269 4.378 -0.019 -6.780 1.00 0.00 N ATOM 682 CA LYS A 269 3.137 -0.667 -7.175 1.00 0.00 C ATOM 683 C LYS A 269 3.071 -2.033 -6.493 1.00 0.00 C ATOM 684 O LYS A 269 4.020 -2.812 -6.564 1.00 0.00 O ATOM 685 CB LYS A 269 2.990 -0.787 -8.713 1.00 0.00 C ATOM 686 CG LYS A 269 3.548 -2.066 -9.341 1.00 0.00 C ATOM 687 CD LYS A 269 5.038 -1.981 -9.645 1.00 0.00 C ATOM 688 CE LYS A 269 5.334 -1.001 -10.769 1.00 0.00 C ATOM 689 NZ LYS A 269 4.687 -1.395 -12.048 1.00 0.00 N1+ ATOM 0 H LYS A 269 5.200 -0.622 -6.809 1.00 0.00 H new ATOM 0 HA LYS A 269 2.298 -0.050 -6.853 1.00 0.00 H new ATOM 0 HB2 LYS A 269 1.932 -0.714 -8.964 1.00 0.00 H new ATOM 0 HB3 LYS A 269 3.486 0.067 -9.174 1.00 0.00 H new ATOM 0 HG2 LYS A 269 3.368 -2.903 -8.667 1.00 0.00 H new ATOM 0 HG3 LYS A 269 3.007 -2.277 -10.263 1.00 0.00 H new ATOM 0 HD2 LYS A 269 5.575 -1.676 -8.747 1.00 0.00 H new ATOM 0 HD3 LYS A 269 5.409 -2.969 -9.918 1.00 0.00 H new ATOM 0 HE2 LYS A 269 4.990 -0.008 -10.482 1.00 0.00 H new ATOM 0 HE3 LYS A 269 6.412 -0.935 -10.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 5.122 -0.870 -12.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 4.814 -2.416 -12.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 3.671 -1.175 -12.006 1.00 0.00 H new ATOM 703 N PHE A 270 1.986 -2.315 -5.791 1.00 0.00 N ATOM 704 CA PHE A 270 1.905 -3.538 -5.015 1.00 0.00 C ATOM 705 C PHE A 270 0.493 -4.093 -5.025 1.00 0.00 C ATOM 706 O PHE A 270 -0.458 -3.390 -5.366 1.00 0.00 O ATOM 707 CB PHE A 270 2.375 -3.291 -3.574 1.00 0.00 C ATOM 708 CG PHE A 270 1.552 -2.293 -2.804 1.00 0.00 C ATOM 709 CD1 PHE A 270 1.722 -0.932 -3.000 1.00 0.00 C ATOM 710 CD2 PHE A 270 0.616 -2.718 -1.874 1.00 0.00 C ATOM 711 CE1 PHE A 270 0.975 -0.016 -2.286 1.00 0.00 C ATOM 712 CE2 PHE A 270 -0.134 -1.806 -1.157 1.00 0.00 C ATOM 713 CZ PHE A 270 0.046 -0.453 -1.363 1.00 0.00 C ATOM 0 H PHE A 270 1.159 -1.720 -5.743 1.00 0.00 H new ATOM 0 HA PHE A 270 2.563 -4.276 -5.474 1.00 0.00 H new ATOM 0 HB2 PHE A 270 2.367 -4.239 -3.037 1.00 0.00 H new ATOM 0 HB3 PHE A 270 3.409 -2.947 -3.598 1.00 0.00 H new ATOM 0 HD1 PHE A 270 2.448 -0.583 -3.720 1.00 0.00 H new ATOM 0 HD2 PHE A 270 0.471 -3.775 -1.708 1.00 0.00 H new ATOM 0 HE1 PHE A 270 1.117 1.042 -2.450 1.00 0.00 H new ATOM 0 HE2 PHE A 270 -0.860 -2.151 -0.436 1.00 0.00 H new ATOM 0 HZ PHE A 270 -0.539 0.262 -0.803 1.00 0.00 H new ATOM 723 N THR A 271 0.366 -5.350 -4.646 1.00 0.00 N ATOM 724 CA THR A 271 -0.927 -6.000 -4.596 1.00 0.00 C ATOM 725 C THR A 271 -1.200 -6.505 -3.182 1.00 0.00 C ATOM 726 O THR A 271 -0.654 -7.525 -2.747 1.00 0.00 O ATOM 727 CB THR A 271 -1.065 -7.150 -5.638 1.00 0.00 C ATOM 728 OG1 THR A 271 -2.325 -7.812 -5.466 1.00 0.00 O ATOM 729 CG2 THR A 271 0.070 -8.182 -5.539 1.00 0.00 C ATOM 0 H THR A 271 1.148 -5.943 -4.367 1.00 0.00 H new ATOM 0 HA THR A 271 -1.677 -5.256 -4.864 1.00 0.00 H new ATOM 0 HB THR A 271 -1.005 -6.693 -6.626 1.00 0.00 H new ATOM 0 HG1 THR A 271 -2.408 -8.533 -6.124 1.00 0.00 H new ATOM 0 HG21 THR A 271 -0.079 -8.959 -6.289 1.00 0.00 H new ATOM 0 HG22 THR A 271 1.026 -7.689 -5.712 1.00 0.00 H new ATOM 0 HG23 THR A 271 0.068 -8.631 -4.546 1.00 0.00 H new ATOM 737 N ASN A 272 -2.017 -5.747 -2.458 1.00 0.00 N ATOM 738 CA ASN A 272 -2.374 -6.071 -1.078 1.00 0.00 C ATOM 739 C ASN A 272 -3.782 -6.647 -1.043 1.00 0.00 C ATOM 740 O ASN A 272 -4.651 -6.223 -1.808 1.00 0.00 O ATOM 741 CB ASN A 272 -2.295 -4.809 -0.205 1.00 0.00 C ATOM 742 CG ASN A 272 -2.541 -5.066 1.278 1.00 0.00 C ATOM 743 OD1 ASN A 272 -3.101 -4.224 1.976 1.00 0.00 O ATOM 744 ND2 ASN A 272 -2.108 -6.212 1.776 1.00 0.00 N ATOM 0 H ASN A 272 -2.450 -4.893 -2.809 1.00 0.00 H new ATOM 0 HA ASN A 272 -1.674 -6.809 -0.686 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -1.311 -4.356 -0.327 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -3.026 -4.085 -0.564 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -2.235 -6.418 2.767 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -1.647 -6.890 1.169 1.00 0.00 H new ATOM 1061 N SER A 292 -3.239 -4.664 -8.600 1.00 0.00 N ATOM 1062 CA SER A 292 -2.099 -3.996 -8.002 1.00 0.00 C ATOM 1063 C SER A 292 -2.282 -2.486 -8.120 1.00 0.00 C ATOM 1064 O SER A 292 -2.820 -1.999 -9.116 1.00 0.00 O ATOM 1065 CB SER A 292 -0.794 -4.434 -8.678 1.00 0.00 C ATOM 1066 OG SER A 292 -0.627 -5.841 -8.605 1.00 0.00 O ATOM 0 HA SER A 292 -2.037 -4.272 -6.949 1.00 0.00 H new ATOM 0 HB2 SER A 292 -0.798 -4.119 -9.721 1.00 0.00 H new ATOM 0 HB3 SER A 292 0.051 -3.939 -8.199 1.00 0.00 H new ATOM 0 HG SER A 292 -1.505 -6.276 -8.620 1.00 0.00 H new ATOM 1072 N PHE A 293 -1.852 -1.747 -7.113 1.00 0.00 N ATOM 1073 CA PHE A 293 -2.057 -0.310 -7.085 1.00 0.00 C ATOM 1074 C PHE A 293 -0.748 0.421 -6.825 1.00 0.00 C ATOM 1075 O PHE A 293 0.120 -0.071 -6.103 1.00 0.00 O ATOM 1076 CB PHE A 293 -3.102 0.064 -6.027 1.00 0.00 C ATOM 1077 CG PHE A 293 -3.437 -1.053 -5.076 1.00 0.00 C ATOM 1078 CD1 PHE A 293 -4.576 -1.820 -5.269 1.00 0.00 C ATOM 1079 CD2 PHE A 293 -2.617 -1.340 -3.998 1.00 0.00 C ATOM 1080 CE1 PHE A 293 -4.889 -2.850 -4.406 1.00 0.00 C ATOM 1081 CE2 PHE A 293 -2.927 -2.369 -3.130 1.00 0.00 C ATOM 1082 CZ PHE A 293 -4.064 -3.126 -3.336 1.00 0.00 C ATOM 0 H PHE A 293 -1.358 -2.119 -6.302 1.00 0.00 H new ATOM 0 HA PHE A 293 -2.429 -0.002 -8.062 1.00 0.00 H new ATOM 0 HB2 PHE A 293 -2.736 0.917 -5.455 1.00 0.00 H new ATOM 0 HB3 PHE A 293 -4.014 0.385 -6.530 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -5.226 -1.609 -6.105 1.00 0.00 H new ATOM 0 HD2 PHE A 293 -1.725 -0.753 -3.834 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -5.779 -3.440 -4.568 1.00 0.00 H new ATOM 0 HE2 PHE A 293 -2.281 -2.581 -2.291 1.00 0.00 H new ATOM 0 HZ PHE A 293 -4.306 -3.933 -2.660 1.00 0.00 H new ATOM 1092 N THR A 294 -0.614 1.585 -7.438 1.00 0.00 N ATOM 1093 CA THR A 294 0.581 2.397 -7.305 1.00 0.00 C ATOM 1094 C THR A 294 0.453 3.363 -6.125 1.00 0.00 C ATOM 1095 O THR A 294 -0.564 4.045 -5.982 1.00 0.00 O ATOM 1096 CB THR A 294 0.831 3.193 -8.610 1.00 0.00 C ATOM 1097 OG1 THR A 294 0.975 2.281 -9.710 1.00 0.00 O ATOM 1098 CG2 THR A 294 2.070 4.086 -8.518 1.00 0.00 C ATOM 0 H THR A 294 -1.330 1.992 -8.040 1.00 0.00 H new ATOM 0 HA THR A 294 1.426 1.734 -7.120 1.00 0.00 H new ATOM 0 HB THR A 294 -0.030 3.843 -8.767 1.00 0.00 H new ATOM 0 HG1 THR A 294 1.131 2.786 -10.535 1.00 0.00 H new ATOM 0 HG21 THR A 294 2.202 4.623 -9.457 1.00 0.00 H new ATOM 0 HG22 THR A 294 1.943 4.802 -7.706 1.00 0.00 H new ATOM 0 HG23 THR A 294 2.949 3.470 -8.325 1.00 0.00 H new ATOM 1106 N ALA A 295 1.472 3.405 -5.274 1.00 0.00 N ATOM 1107 CA ALA A 295 1.491 4.337 -4.156 1.00 0.00 C ATOM 1108 C ALA A 295 2.812 5.098 -4.134 1.00 0.00 C ATOM 1109 O ALA A 295 3.648 4.903 -5.018 1.00 0.00 O ATOM 1110 CB ALA A 295 1.269 3.593 -2.854 1.00 0.00 C ATOM 0 H ALA A 295 2.294 2.805 -5.338 1.00 0.00 H new ATOM 0 HA ALA A 295 0.683 5.059 -4.276 1.00 0.00 H new ATOM 0 HB1 ALA A 295 1.285 4.299 -2.024 1.00 0.00 H new ATOM 0 HB2 ALA A 295 0.303 3.089 -2.883 1.00 0.00 H new ATOM 0 HB3 ALA A 295 2.059 2.855 -2.717 1.00 0.00 H new ATOM 1116 N THR A 296 3.008 5.971 -3.152 1.00 0.00 N ATOM 1117 CA THR A 296 4.229 6.763 -3.100 1.00 0.00 C ATOM 1118 C THR A 296 4.742 6.945 -1.678 1.00 0.00 C ATOM 1119 O THR A 296 3.986 7.260 -0.759 1.00 0.00 O ATOM 1120 CB THR A 296 4.007 8.144 -3.767 1.00 0.00 C ATOM 1121 OG1 THR A 296 3.612 7.949 -5.131 1.00 0.00 O ATOM 1122 CG2 THR A 296 5.257 9.035 -3.719 1.00 0.00 C ATOM 0 H THR A 296 2.349 6.146 -2.394 1.00 0.00 H new ATOM 0 HA THR A 296 4.990 6.212 -3.652 1.00 0.00 H new ATOM 0 HB THR A 296 3.226 8.656 -3.205 1.00 0.00 H new ATOM 0 HG1 THR A 296 3.469 8.820 -5.558 1.00 0.00 H new ATOM 0 HG21 THR A 296 5.043 9.989 -4.201 1.00 0.00 H new ATOM 0 HG22 THR A 296 5.541 9.208 -2.681 1.00 0.00 H new ATOM 0 HG23 THR A 296 6.076 8.541 -4.241 1.00 0.00 H new ATOM 1130 N VAL A 297 6.041 6.744 -1.525 1.00 0.00 N ATOM 1131 CA VAL A 297 6.702 6.838 -0.236 1.00 0.00 C ATOM 1132 C VAL A 297 7.108 8.277 0.058 1.00 0.00 C ATOM 1133 O VAL A 297 7.441 9.034 -0.854 1.00 0.00 O ATOM 1134 CB VAL A 297 7.933 5.907 -0.197 1.00 0.00 C ATOM 1135 CG1 VAL A 297 8.704 6.058 1.102 1.00 0.00 C ATOM 1136 CG2 VAL A 297 7.497 4.464 -0.398 1.00 0.00 C ATOM 0 H VAL A 297 6.668 6.510 -2.295 1.00 0.00 H new ATOM 0 HA VAL A 297 6.001 6.519 0.536 1.00 0.00 H new ATOM 0 HB VAL A 297 8.602 6.193 -1.008 1.00 0.00 H new ATOM 0 HG11 VAL A 297 9.564 5.388 1.095 1.00 0.00 H new ATOM 0 HG12 VAL A 297 9.047 7.088 1.204 1.00 0.00 H new ATOM 0 HG13 VAL A 297 8.055 5.807 1.941 1.00 0.00 H new ATOM 0 HG21 VAL A 297 8.370 3.813 -0.369 1.00 0.00 H new ATOM 0 HG22 VAL A 297 6.806 4.179 0.395 1.00 0.00 H new ATOM 0 HG23 VAL A 297 7.002 4.365 -1.364 1.00 0.00 H new ATOM 1146 N THR A 298 7.058 8.654 1.330 1.00 0.00 N ATOM 1147 CA THR A 298 7.333 10.022 1.726 1.00 0.00 C ATOM 1148 C THR A 298 8.434 10.090 2.798 1.00 0.00 C ATOM 1149 O THR A 298 8.588 11.110 3.475 1.00 0.00 O ATOM 1150 CB THR A 298 6.037 10.701 2.240 1.00 0.00 C ATOM 1151 OG1 THR A 298 6.234 12.111 2.409 1.00 0.00 O ATOM 1152 CG2 THR A 298 5.578 10.094 3.559 1.00 0.00 C ATOM 0 H THR A 298 6.829 8.028 2.102 1.00 0.00 H new ATOM 0 HA THR A 298 7.693 10.558 0.848 1.00 0.00 H new ATOM 0 HB THR A 298 5.265 10.532 1.490 1.00 0.00 H new ATOM 0 HG1 THR A 298 7.103 12.271 2.833 1.00 0.00 H new ATOM 0 HG21 THR A 298 4.667 10.592 3.892 1.00 0.00 H new ATOM 0 HG22 THR A 298 5.380 9.031 3.421 1.00 0.00 H new ATOM 0 HG23 THR A 298 6.357 10.224 4.310 1.00 0.00 H new ATOM 1160 N ALA A 299 9.215 9.015 2.936 1.00 0.00 N ATOM 1161 CA ALA A 299 10.263 8.965 3.956 1.00 0.00 C ATOM 1162 C ALA A 299 11.386 8.012 3.582 1.00 0.00 C ATOM 1163 O ALA A 299 11.376 7.423 2.502 1.00 0.00 O ATOM 1164 CB ALA A 299 9.670 8.592 5.308 1.00 0.00 C ATOM 0 H ALA A 299 9.142 8.176 2.360 1.00 0.00 H new ATOM 0 HA ALA A 299 10.699 9.962 4.022 1.00 0.00 H new ATOM 0 HB1 ALA A 299 10.462 8.559 6.056 1.00 0.00 H new ATOM 0 HB2 ALA A 299 8.928 9.336 5.598 1.00 0.00 H new ATOM 0 HB3 ALA A 299 9.195 7.613 5.239 1.00 0.00 H new ATOM 1170 N ASP A 300 12.356 7.881 4.486 1.00 0.00 N ATOM 1171 CA ASP A 300 13.518 7.042 4.269 1.00 0.00 C ATOM 1172 C ASP A 300 13.145 5.579 4.286 1.00 0.00 C ATOM 1173 O ASP A 300 12.088 5.188 4.790 1.00 0.00 O ATOM 1174 CB ASP A 300 14.590 7.301 5.335 1.00 0.00 C ATOM 1175 CG ASP A 300 15.390 8.559 5.079 1.00 0.00 C ATOM 1176 OD1 ASP A 300 14.926 9.650 5.472 1.00 0.00 O ATOM 1177 OD2 ASP A 300 16.493 8.466 4.500 1.00 0.00 O1- ATOM 0 H ASP A 300 12.352 8.357 5.388 1.00 0.00 H new ATOM 0 HA ASP A 300 13.919 7.296 3.288 1.00 0.00 H new ATOM 0 HB2 ASP A 300 14.112 7.374 6.312 1.00 0.00 H new ATOM 0 HB3 ASP A 300 15.268 6.448 5.375 1.00 0.00 H new ATOM 1182 N ALA A 301 14.040 4.783 3.762 1.00 0.00 N ATOM 1183 CA ALA A 301 13.838 3.354 3.653 1.00 0.00 C ATOM 1184 C ALA A 301 15.169 2.628 3.797 1.00 0.00 C ATOM 1185 O ALA A 301 16.226 3.255 3.757 1.00 0.00 O ATOM 1186 CB ALA A 301 13.167 3.018 2.329 1.00 0.00 C ATOM 0 H ALA A 301 14.936 5.105 3.396 1.00 0.00 H new ATOM 0 HA ALA A 301 13.181 3.021 4.456 1.00 0.00 H new ATOM 0 HB1 ALA A 301 13.020 1.940 2.259 1.00 0.00 H new ATOM 0 HB2 ALA A 301 12.201 3.520 2.273 1.00 0.00 H new ATOM 0 HB3 ALA A 301 13.798 3.353 1.506 1.00 0.00 H new ATOM 1192 N ASN A 302 15.122 1.313 3.967 1.00 0.00 N ATOM 1193 CA ASN A 302 16.331 0.541 4.237 1.00 0.00 C ATOM 1194 C ASN A 302 16.297 -0.809 3.538 1.00 0.00 C ATOM 1195 O ASN A 302 15.316 -1.533 3.655 1.00 0.00 O ATOM 1196 CB ASN A 302 16.475 0.278 5.739 1.00 0.00 C ATOM 1197 CG ASN A 302 16.541 1.544 6.574 1.00 0.00 C ATOM 1198 OD1 ASN A 302 15.525 2.014 7.092 1.00 0.00 O ATOM 1199 ND2 ASN A 302 17.729 2.111 6.710 1.00 0.00 N ATOM 0 H ASN A 302 14.266 0.760 3.923 1.00 0.00 H new ATOM 0 HA ASN A 302 17.170 1.129 3.865 1.00 0.00 H new ATOM 0 HB2 ASN A 302 15.633 -0.326 6.076 1.00 0.00 H new ATOM 0 HB3 ASN A 302 17.377 -0.309 5.912 1.00 0.00 H new ATOM 0 HD21 ASN A 302 17.826 2.966 7.258 1.00 0.00 H new ATOM 0 HD22 ASN A 302 18.547 1.693 6.267 1.00 0.00 H new ATOM 1206 N SER A 303 17.344 -1.151 2.802 1.00 0.00 N ATOM 1207 CA SER A 303 17.541 -2.528 2.398 1.00 0.00 C ATOM 1208 C SER A 303 18.733 -3.090 3.166 1.00 0.00 C ATOM 1209 O SER A 303 19.879 -2.895 2.764 1.00 0.00 O ATOM 1210 CB SER A 303 17.811 -2.592 0.899 1.00 0.00 C ATOM 1211 OG SER A 303 17.420 -1.381 0.265 1.00 0.00 O ATOM 0 H SER A 303 18.060 -0.501 2.478 1.00 0.00 H new ATOM 0 HA SER A 303 16.648 -3.114 2.616 1.00 0.00 H new ATOM 0 HB2 SER A 303 18.871 -2.774 0.723 1.00 0.00 H new ATOM 0 HB3 SER A 303 17.267 -3.429 0.462 1.00 0.00 H new ATOM 0 HG SER A 303 16.483 -1.445 -0.013 1.00 0.00 H new ATOM 1217 N ASP A 304 18.476 -3.758 4.282 1.00 0.00 N ATOM 1218 CA ASP A 304 19.563 -4.251 5.118 1.00 0.00 C ATOM 1219 C ASP A 304 19.790 -5.739 4.904 1.00 0.00 C ATOM 1220 O ASP A 304 19.126 -6.353 4.075 1.00 0.00 O ATOM 1221 CB ASP A 304 19.300 -3.962 6.599 1.00 0.00 C ATOM 1222 CG ASP A 304 18.245 -4.866 7.209 1.00 0.00 C ATOM 1223 OD1 ASP A 304 18.619 -5.892 7.816 1.00 0.00 O ATOM 1224 OD2 ASP A 304 17.045 -4.549 7.101 1.00 0.00 O1- ATOM 0 H ASP A 304 17.539 -3.969 4.626 1.00 0.00 H new ATOM 0 HA ASP A 304 20.467 -3.719 4.821 1.00 0.00 H new ATOM 0 HB2 ASP A 304 20.231 -4.075 7.155 1.00 0.00 H new ATOM 0 HB3 ASP A 304 18.987 -2.924 6.709 1.00 0.00 H new ATOM 1229 N SER A 305 20.712 -6.322 5.653 1.00 0.00 N ATOM 1230 CA SER A 305 21.083 -7.719 5.461 1.00 0.00 C ATOM 1231 C SER A 305 19.889 -8.648 5.675 1.00 0.00 C ATOM 1232 O SER A 305 19.762 -9.675 5.008 1.00 0.00 O ATOM 1233 CB SER A 305 22.198 -8.086 6.429 1.00 0.00 C ATOM 1234 OG SER A 305 22.761 -9.353 6.122 1.00 0.00 O ATOM 0 H SER A 305 21.219 -5.850 6.402 1.00 0.00 H new ATOM 0 HA SER A 305 21.426 -7.842 4.434 1.00 0.00 H new ATOM 0 HB2 SER A 305 22.976 -7.323 6.395 1.00 0.00 H new ATOM 0 HB3 SER A 305 21.808 -8.098 7.447 1.00 0.00 H new ATOM 0 HG SER A 305 23.475 -9.557 6.762 1.00 0.00 H new ATOM 1240 N GLY A 306 19.000 -8.268 6.580 1.00 0.00 N ATOM 1241 CA GLY A 306 17.840 -9.084 6.858 1.00 0.00 C ATOM 1242 C GLY A 306 16.735 -8.841 5.860 1.00 0.00 C ATOM 1243 O GLY A 306 15.694 -9.501 5.893 1.00 0.00 O ATOM 0 H GLY A 306 19.062 -7.409 7.126 1.00 0.00 H new ATOM 0 HA2 GLY A 306 18.122 -10.137 6.839 1.00 0.00 H new ATOM 0 HA3 GLY A 306 17.476 -8.869 7.863 1.00 0.00 H new ATOM 1247 N GLY A 307 16.969 -7.905 4.949 1.00 0.00 N ATOM 1248 CA GLY A 307 15.967 -7.578 3.966 1.00 0.00 C ATOM 1249 C GLY A 307 14.700 -7.004 4.572 1.00 0.00 C ATOM 1250 O GLY A 307 13.608 -7.435 4.226 1.00 0.00 O ATOM 0 H GLY A 307 17.834 -7.370 4.877 1.00 0.00 H new ATOM 0 HA2 GLY A 307 16.382 -6.859 3.259 1.00 0.00 H new ATOM 0 HA3 GLY A 307 15.717 -8.475 3.399 1.00 0.00 H new ATOM 1254 N ASP A 308 14.824 -6.085 5.517 1.00 0.00 N ATOM 1255 CA ASP A 308 13.643 -5.461 6.108 1.00 0.00 C ATOM 1256 C ASP A 308 13.591 -3.968 5.782 1.00 0.00 C ATOM 1257 O ASP A 308 14.544 -3.234 6.041 1.00 0.00 O ATOM 1258 CB ASP A 308 13.617 -5.654 7.623 1.00 0.00 C ATOM 1259 CG ASP A 308 13.480 -7.103 8.044 1.00 0.00 C ATOM 1260 OD1 ASP A 308 12.349 -7.635 8.007 1.00 0.00 O ATOM 1261 OD2 ASP A 308 14.497 -7.713 8.441 1.00 0.00 O1- ATOM 0 H ASP A 308 15.715 -5.756 5.889 1.00 0.00 H new ATOM 0 HA ASP A 308 12.769 -5.949 5.676 1.00 0.00 H new ATOM 0 HB2 ASP A 308 14.533 -5.245 8.049 1.00 0.00 H new ATOM 0 HB3 ASP A 308 12.788 -5.082 8.040 1.00 0.00 H new ATOM 1266 N VAL A 309 12.470 -3.522 5.227 1.00 0.00 N ATOM 1267 CA VAL A 309 12.294 -2.117 4.840 1.00 0.00 C ATOM 1268 C VAL A 309 10.935 -1.562 5.274 1.00 0.00 C ATOM 1269 O VAL A 309 9.902 -2.049 4.850 1.00 0.00 O ATOM 1270 CB VAL A 309 12.467 -1.927 3.303 1.00 0.00 C ATOM 1271 CG1 VAL A 309 12.010 -3.153 2.529 1.00 0.00 C ATOM 1272 CG2 VAL A 309 11.721 -0.698 2.786 1.00 0.00 C ATOM 0 H VAL A 309 11.662 -4.113 5.032 1.00 0.00 H new ATOM 0 HA VAL A 309 13.072 -1.557 5.360 1.00 0.00 H new ATOM 0 HB VAL A 309 13.534 -1.780 3.138 1.00 0.00 H new ATOM 0 HG11 VAL A 309 12.147 -2.981 1.461 1.00 0.00 H new ATOM 0 HG12 VAL A 309 12.599 -4.017 2.836 1.00 0.00 H new ATOM 0 HG13 VAL A 309 10.956 -3.341 2.734 1.00 0.00 H new ATOM 0 HG21 VAL A 309 11.871 -0.607 1.710 1.00 0.00 H new ATOM 0 HG22 VAL A 309 10.657 -0.803 2.996 1.00 0.00 H new ATOM 0 HG23 VAL A 309 12.102 0.194 3.282 1.00 0.00 H new ATOM 1282 N THR A 310 10.942 -0.531 6.103 1.00 0.00 N ATOM 1283 CA THR A 310 9.702 0.101 6.549 1.00 0.00 C ATOM 1284 C THR A 310 9.599 1.525 6.000 1.00 0.00 C ATOM 1285 O THR A 310 10.575 2.274 6.040 1.00 0.00 O ATOM 1286 CB THR A 310 9.648 0.149 8.101 1.00 0.00 C ATOM 1287 OG1 THR A 310 9.591 -1.179 8.630 1.00 0.00 O ATOM 1288 CG2 THR A 310 8.458 0.966 8.634 1.00 0.00 C ATOM 0 H THR A 310 11.790 -0.111 6.483 1.00 0.00 H new ATOM 0 HA THR A 310 8.867 -0.491 6.174 1.00 0.00 H new ATOM 0 HB THR A 310 10.558 0.650 8.432 1.00 0.00 H new ATOM 0 HG1 THR A 310 9.703 -1.149 9.603 1.00 0.00 H new ATOM 0 HG21 THR A 310 8.474 0.963 9.724 1.00 0.00 H new ATOM 0 HG22 THR A 310 8.530 1.992 8.273 1.00 0.00 H new ATOM 0 HG23 THR A 310 7.526 0.523 8.283 1.00 0.00 H new ATOM 1296 N VAL A 311 8.427 1.896 5.486 1.00 0.00 N ATOM 1297 CA VAL A 311 8.201 3.263 4.997 1.00 0.00 C ATOM 1298 C VAL A 311 6.770 3.690 5.254 1.00 0.00 C ATOM 1299 O VAL A 311 5.904 2.874 5.551 1.00 0.00 O ATOM 1300 CB VAL A 311 8.472 3.417 3.474 1.00 0.00 C ATOM 1301 CG1 VAL A 311 9.968 3.394 3.160 1.00 0.00 C ATOM 1302 CG2 VAL A 311 7.748 2.321 2.688 1.00 0.00 C ATOM 0 H VAL A 311 7.622 1.277 5.396 1.00 0.00 H new ATOM 0 HA VAL A 311 8.905 3.891 5.543 1.00 0.00 H new ATOM 0 HB VAL A 311 8.084 4.389 3.169 1.00 0.00 H new ATOM 0 HG11 VAL A 311 10.116 3.504 2.086 1.00 0.00 H new ATOM 0 HG12 VAL A 311 10.462 4.215 3.680 1.00 0.00 H new ATOM 0 HG13 VAL A 311 10.394 2.447 3.490 1.00 0.00 H new ATOM 0 HG21 VAL A 311 7.948 2.444 1.624 1.00 0.00 H new ATOM 0 HG22 VAL A 311 8.104 1.344 3.014 1.00 0.00 H new ATOM 0 HG23 VAL A 311 6.675 2.394 2.866 1.00 0.00 H new ATOM 1312 N THR A 312 6.535 4.978 5.157 1.00 0.00 N ATOM 1313 CA THR A 312 5.197 5.505 5.229 1.00 0.00 C ATOM 1314 C THR A 312 4.872 6.244 3.933 1.00 0.00 C ATOM 1315 O THR A 312 5.716 6.949 3.373 1.00 0.00 O ATOM 1316 CB THR A 312 5.054 6.435 6.460 1.00 0.00 C ATOM 1317 OG1 THR A 312 5.093 5.657 7.661 1.00 0.00 O ATOM 1318 CG2 THR A 312 3.771 7.286 6.430 1.00 0.00 C ATOM 0 H THR A 312 7.261 5.683 5.027 1.00 0.00 H new ATOM 0 HA THR A 312 4.486 4.687 5.348 1.00 0.00 H new ATOM 0 HB THR A 312 5.893 7.130 6.431 1.00 0.00 H new ATOM 0 HG1 THR A 312 4.216 5.684 8.097 1.00 0.00 H new ATOM 0 HG21 THR A 312 3.731 7.915 7.319 1.00 0.00 H new ATOM 0 HG22 THR A 312 3.773 7.915 5.540 1.00 0.00 H new ATOM 0 HG23 THR A 312 2.900 6.631 6.409 1.00 0.00 H new ATOM 1326 N LEU A 313 3.659 6.041 3.460 1.00 0.00 N ATOM 1327 CA LEU A 313 3.206 6.576 2.191 1.00 0.00 C ATOM 1328 C LEU A 313 2.185 7.679 2.436 1.00 0.00 C ATOM 1329 O LEU A 313 1.726 7.852 3.562 1.00 0.00 O ATOM 1330 CB LEU A 313 2.601 5.439 1.365 1.00 0.00 C ATOM 1331 CG LEU A 313 3.532 4.235 1.171 1.00 0.00 C ATOM 1332 CD1 LEU A 313 3.299 3.180 2.240 1.00 0.00 C ATOM 1333 CD2 LEU A 313 3.390 3.641 -0.217 1.00 0.00 C ATOM 0 H LEU A 313 2.952 5.494 3.951 1.00 0.00 H new ATOM 0 HA LEU A 313 4.042 7.006 1.640 1.00 0.00 H new ATOM 0 HB2 LEU A 313 1.685 5.101 1.850 1.00 0.00 H new ATOM 0 HB3 LEU A 313 2.319 5.827 0.386 1.00 0.00 H new ATOM 0 HG LEU A 313 4.555 4.596 1.274 1.00 0.00 H new ATOM 0 HD11 LEU A 313 3.974 2.340 2.075 1.00 0.00 H new ATOM 0 HD12 LEU A 313 3.489 3.610 3.223 1.00 0.00 H new ATOM 0 HD13 LEU A 313 2.267 2.832 2.189 1.00 0.00 H new ATOM 0 HD21 LEU A 313 4.064 2.790 -0.319 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.362 3.310 -0.368 1.00 0.00 H new ATOM 0 HD23 LEU A 313 3.641 4.395 -0.963 1.00 0.00 H new ATOM 1345 N SER A 314 1.820 8.424 1.402 1.00 0.00 N ATOM 1346 CA SER A 314 0.969 9.588 1.596 1.00 0.00 C ATOM 1347 C SER A 314 -0.522 9.239 1.566 1.00 0.00 C ATOM 1348 O SER A 314 -1.264 9.726 0.725 1.00 0.00 O ATOM 1349 CB SER A 314 1.280 10.629 0.535 1.00 0.00 C ATOM 1350 OG SER A 314 2.666 10.940 0.515 1.00 0.00 O ATOM 0 H SER A 314 2.095 8.247 0.436 1.00 0.00 H new ATOM 0 HA SER A 314 1.183 9.987 2.588 1.00 0.00 H new ATOM 0 HB2 SER A 314 0.973 10.259 -0.443 1.00 0.00 H new ATOM 0 HB3 SER A 314 0.704 11.534 0.729 1.00 0.00 H new ATOM 0 HG SER A 314 2.841 11.611 -0.177 1.00 0.00 H new ATOM 1632 N VAL A 333 -6.669 -4.503 6.902 1.00 0.00 N ATOM 1633 CA VAL A 333 -5.597 -4.932 6.022 1.00 0.00 C ATOM 1634 C VAL A 333 -4.999 -6.265 6.454 1.00 0.00 C ATOM 1635 O VAL A 333 -5.314 -6.790 7.524 1.00 0.00 O ATOM 1636 CB VAL A 333 -4.492 -3.865 5.923 1.00 0.00 C ATOM 1637 CG1 VAL A 333 -4.818 -2.879 4.813 1.00 0.00 C ATOM 1638 CG2 VAL A 333 -4.339 -3.127 7.244 1.00 0.00 C ATOM 0 HA VAL A 333 -6.041 -5.068 5.036 1.00 0.00 H new ATOM 0 HB VAL A 333 -3.550 -4.364 5.694 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -4.031 -2.128 4.751 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -4.889 -3.410 3.864 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -5.769 -2.391 5.028 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -3.553 -2.377 7.153 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -5.279 -2.638 7.499 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -4.075 -3.836 8.028 1.00 0.00 H new ATOM 1648 N GLU A 334 -4.153 -6.812 5.595 1.00 0.00 N ATOM 1649 CA GLU A 334 -3.523 -8.100 5.832 1.00 0.00 C ATOM 1650 C GLU A 334 -2.106 -8.079 5.272 1.00 0.00 C ATOM 1651 O GLU A 334 -1.831 -7.380 4.296 1.00 0.00 O ATOM 1652 CB GLU A 334 -4.345 -9.213 5.171 1.00 0.00 C ATOM 1653 CG GLU A 334 -3.811 -10.614 5.426 1.00 0.00 C ATOM 1654 CD GLU A 334 -3.750 -10.956 6.898 1.00 0.00 C ATOM 1655 OE1 GLU A 334 -2.663 -10.827 7.500 1.00 0.00 O ATOM 1656 OE2 GLU A 334 -4.792 -11.355 7.463 1.00 0.00 O1- ATOM 0 H GLU A 334 -3.884 -6.375 4.714 1.00 0.00 H new ATOM 0 HA GLU A 334 -3.479 -8.294 6.904 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -5.372 -9.156 5.533 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -4.376 -9.038 4.096 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -4.445 -11.339 4.915 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -2.814 -10.702 4.995 1.00 0.00 H new ATOM 1663 N ALA A 335 -1.208 -8.810 5.912 1.00 0.00 N ATOM 1664 CA ALA A 335 0.178 -8.871 5.477 1.00 0.00 C ATOM 1665 C ALA A 335 0.433 -10.134 4.656 1.00 0.00 C ATOM 1666 O ALA A 335 -0.436 -10.999 4.555 1.00 0.00 O ATOM 1667 CB ALA A 335 1.105 -8.820 6.681 1.00 0.00 C ATOM 0 H ALA A 335 -1.415 -9.372 6.738 1.00 0.00 H new ATOM 0 HA ALA A 335 0.381 -8.009 4.842 1.00 0.00 H new ATOM 0 HB1 ALA A 335 2.141 -8.866 6.345 1.00 0.00 H new ATOM 0 HB2 ALA A 335 0.942 -7.891 7.227 1.00 0.00 H new ATOM 0 HB3 ALA A 335 0.898 -9.666 7.336 1.00 0.00 H new ATOM 1673 N GLY A 336 1.627 -10.241 4.080 1.00 0.00 N ATOM 1674 CA GLY A 336 1.990 -11.436 3.333 1.00 0.00 C ATOM 1675 C GLY A 336 1.829 -11.271 1.834 1.00 0.00 C ATOM 1676 O GLY A 336 1.959 -12.236 1.077 1.00 0.00 O ATOM 0 H GLY A 336 2.350 -9.523 4.116 1.00 0.00 H new ATOM 0 HA2 GLY A 336 3.025 -11.696 3.555 1.00 0.00 H new ATOM 0 HA3 GLY A 336 1.373 -12.269 3.669 1.00 0.00 H new ATOM 1680 N ASP A 337 1.554 -10.052 1.399 1.00 0.00 N ATOM 1681 CA ASP A 337 1.327 -9.776 -0.017 1.00 0.00 C ATOM 1682 C ASP A 337 2.610 -9.352 -0.724 1.00 0.00 C ATOM 1683 O ASP A 337 3.693 -9.379 -0.136 1.00 0.00 O ATOM 1684 CB ASP A 337 0.255 -8.703 -0.188 1.00 0.00 C ATOM 1685 CG ASP A 337 -1.133 -9.240 0.072 1.00 0.00 C ATOM 1686 OD1 ASP A 337 -1.814 -8.727 0.978 1.00 0.00 O ATOM 1687 OD2 ASP A 337 -1.546 -10.181 -0.632 1.00 0.00 O1- ATOM 0 H ASP A 337 1.482 -9.234 2.004 1.00 0.00 H new ATOM 0 HA ASP A 337 0.983 -10.702 -0.478 1.00 0.00 H new ATOM 0 HB2 ASP A 337 0.457 -7.877 0.494 1.00 0.00 H new ATOM 0 HB3 ASP A 337 0.304 -8.300 -1.200 1.00 0.00 H new ATOM 1692 N ALA A 338 2.476 -8.939 -1.984 1.00 0.00 N ATOM 1693 CA ALA A 338 3.635 -8.663 -2.827 1.00 0.00 C ATOM 1694 C ALA A 338 3.758 -7.177 -3.146 1.00 0.00 C ATOM 1695 O ALA A 338 2.755 -6.492 -3.356 1.00 0.00 O ATOM 1696 CB ALA A 338 3.550 -9.470 -4.116 1.00 0.00 C ATOM 0 H ALA A 338 1.577 -8.789 -2.442 1.00 0.00 H new ATOM 0 HA ALA A 338 4.526 -8.959 -2.273 1.00 0.00 H new ATOM 0 HB1 ALA A 338 4.420 -9.256 -4.737 1.00 0.00 H new ATOM 0 HB2 ALA A 338 3.526 -10.534 -3.879 1.00 0.00 H new ATOM 0 HB3 ALA A 338 2.643 -9.199 -4.656 1.00 0.00 H new ATOM 1702 N VAL A 339 4.997 -6.694 -3.188 1.00 0.00 N ATOM 1703 CA VAL A 339 5.288 -5.288 -3.452 1.00 0.00 C ATOM 1704 C VAL A 339 6.286 -5.158 -4.603 1.00 0.00 C ATOM 1705 O VAL A 339 7.111 -6.044 -4.821 1.00 0.00 O ATOM 1706 CB VAL A 339 5.873 -4.603 -2.184 1.00 0.00 C ATOM 1707 CG1 VAL A 339 6.304 -3.170 -2.473 1.00 0.00 C ATOM 1708 CG2 VAL A 339 4.853 -4.609 -1.063 1.00 0.00 C ATOM 0 H VAL A 339 5.828 -7.267 -3.040 1.00 0.00 H new ATOM 0 HA VAL A 339 4.355 -4.796 -3.726 1.00 0.00 H new ATOM 0 HB VAL A 339 6.752 -5.172 -1.880 1.00 0.00 H new ATOM 0 HG11 VAL A 339 6.708 -2.721 -1.565 1.00 0.00 H new ATOM 0 HG12 VAL A 339 7.069 -3.170 -3.249 1.00 0.00 H new ATOM 0 HG13 VAL A 339 5.444 -2.592 -2.811 1.00 0.00 H new ATOM 0 HG21 VAL A 339 5.277 -4.126 -0.183 1.00 0.00 H new ATOM 0 HG22 VAL A 339 3.961 -4.068 -1.379 1.00 0.00 H new ATOM 0 HG23 VAL A 339 4.586 -5.637 -0.820 1.00 0.00 H new ATOM 1718 N SER A 340 6.192 -4.071 -5.356 1.00 0.00 N ATOM 1719 CA SER A 340 7.158 -3.782 -6.402 1.00 0.00 C ATOM 1720 C SER A 340 7.341 -2.275 -6.560 1.00 0.00 C ATOM 1721 O SER A 340 6.494 -1.490 -6.145 1.00 0.00 O ATOM 1722 CB SER A 340 6.716 -4.415 -7.723 1.00 0.00 C ATOM 1723 OG SER A 340 6.575 -5.820 -7.587 1.00 0.00 O ATOM 0 H SER A 340 5.454 -3.374 -5.260 1.00 0.00 H new ATOM 0 HA SER A 340 8.118 -4.213 -6.118 1.00 0.00 H new ATOM 0 HB2 SER A 340 5.769 -3.979 -8.041 1.00 0.00 H new ATOM 0 HB3 SER A 340 7.447 -4.192 -8.501 1.00 0.00 H new ATOM 0 HG SER A 340 6.290 -6.205 -8.442 1.00 0.00 H new ATOM 1729 N VAL A 341 8.462 -1.880 -7.139 1.00 0.00 N ATOM 1730 CA VAL A 341 8.783 -0.470 -7.313 1.00 0.00 C ATOM 1731 C VAL A 341 8.525 -0.029 -8.751 1.00 0.00 C ATOM 1732 O VAL A 341 8.854 -0.745 -9.702 1.00 0.00 O ATOM 1733 CB VAL A 341 10.263 -0.205 -6.958 1.00 0.00 C ATOM 1734 CG1 VAL A 341 10.603 1.273 -7.072 1.00 0.00 C ATOM 1735 CG2 VAL A 341 10.582 -0.719 -5.562 1.00 0.00 C ATOM 0 H VAL A 341 9.171 -2.519 -7.499 1.00 0.00 H new ATOM 0 HA VAL A 341 8.141 0.103 -6.644 1.00 0.00 H new ATOM 0 HB VAL A 341 10.878 -0.747 -7.676 1.00 0.00 H new ATOM 0 HG11 VAL A 341 11.651 1.426 -6.816 1.00 0.00 H new ATOM 0 HG12 VAL A 341 10.426 1.609 -8.094 1.00 0.00 H new ATOM 0 HG13 VAL A 341 9.975 1.845 -6.388 1.00 0.00 H new ATOM 0 HG21 VAL A 341 11.629 -0.522 -5.332 1.00 0.00 H new ATOM 0 HG22 VAL A 341 9.949 -0.211 -4.834 1.00 0.00 H new ATOM 0 HG23 VAL A 341 10.396 -1.792 -5.518 1.00 0.00 H new ATOM 1745 N VAL A 342 7.923 1.150 -8.897 1.00 0.00 N ATOM 1746 CA VAL A 342 7.688 1.744 -10.208 1.00 0.00 C ATOM 1747 C VAL A 342 9.003 2.221 -10.809 1.00 0.00 C ATOM 1748 O VAL A 342 9.270 2.026 -11.993 1.00 0.00 O ATOM 1749 CB VAL A 342 6.704 2.938 -10.125 1.00 0.00 C ATOM 1750 CG1 VAL A 342 6.675 3.713 -11.439 1.00 0.00 C ATOM 1751 CG2 VAL A 342 5.301 2.459 -9.781 1.00 0.00 C ATOM 0 H VAL A 342 7.588 1.715 -8.116 1.00 0.00 H new ATOM 0 HA VAL A 342 7.245 0.975 -10.842 1.00 0.00 H new ATOM 0 HB VAL A 342 7.055 3.601 -9.334 1.00 0.00 H new ATOM 0 HG11 VAL A 342 5.977 4.546 -11.355 1.00 0.00 H new ATOM 0 HG12 VAL A 342 7.672 4.096 -11.658 1.00 0.00 H new ATOM 0 HG13 VAL A 342 6.355 3.052 -12.244 1.00 0.00 H new ATOM 0 HG21 VAL A 342 4.627 3.314 -9.728 1.00 0.00 H new ATOM 0 HG22 VAL A 342 4.953 1.770 -10.550 1.00 0.00 H new ATOM 0 HG23 VAL A 342 5.317 1.949 -8.818 1.00 0.00 H new