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 246 GLN : amide:sc= 0 K(o=2.3,f=1.7) USER MOD Set 1.2: A 298 THR OG1 : rot 140:sc= 1.26 USER MOD Set 1.3: A 314 SER OG : rot 180:sc= 1.01 USER MOD Set 2.1: A 272 ASN : amide:sc= -2.43! C(o=-2.7!,f=-5!) USER MOD Set 2.2: A 292 SER OG : rot -14:sc= -0.277 USER MOD Set 3.1: A 269 LYS NZ :NH3+ 142:sc= 1.27 (180deg=-0.0329) USER MOD Set 3.2: A 294 THR OG1 : rot 170:sc= 1.04 USER MOD Set 4.1: A 267 GLN : amide:sc= 0.835 K(o=1.6,f=0) USER MOD Set 4.2: A 296 THR OG1 : rot 180:sc= 0.729 USER MOD Set 5.1: A 250 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 310 THR OG1 : rot 180:sc= -0.539 USER MOD Set 6.1: A 248 THR OG1 : rot -160:sc= -0.419! USER MOD Set 6.2: A 312 THR OG1 : rot -133:sc= 0.586 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+ 150:sc= 1.22 (180deg=1.09) USER MOD Single : A 232 THR OG1 : rot 120:sc= 0.938 USER MOD Single : A 233 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 235 THR OG1 : rot 37:sc= 0.848 USER MOD Single : A 237 THR OG1 : rot 180:sc= -0.214 USER MOD Single : A 238 TYR OH : rot 180:sc= 0 USER MOD Single : A 239 ASN : amide:sc= -2.39! C(o=-2.4!,f=-2.6!) USER MOD Single : A 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : A 245 TYR OH : rot 180:sc= 0 USER MOD Single : A 252 THR OG1 : rot 180:sc= -0.81 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0 USER MOD Single : A 257 SER OG : rot -32:sc= 0.61 USER MOD Single : A 259 THR OG1 : rot 180:sc= 0 USER MOD Single : A 263 LYS NZ :NH3+ 163:sc= -0.0784 (180deg=-0.418) USER MOD Single : A 271 THR OG1 : rot 33:sc= 0.291 USER MOD Single : A 302 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 303 SER OG : rot -76:sc= 1.36 USER MOD Single : A 305 SER OG : rot 180:sc= 0 USER MOD Single : A 340 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 47 N GLY A 226 12.132 -4.158 -9.503 1.00 0.00 N ATOM 48 CA GLY A 226 12.397 -4.308 -8.077 1.00 0.00 C ATOM 49 C GLY A 226 11.207 -4.833 -7.302 1.00 0.00 C ATOM 50 O GLY A 226 10.165 -4.182 -7.226 1.00 0.00 O ATOM 0 HA2 GLY A 226 13.240 -4.986 -7.940 1.00 0.00 H new ATOM 0 HA3 GLY A 226 12.694 -3.343 -7.666 1.00 0.00 H new ATOM 54 N THR A 227 11.367 -6.021 -6.744 1.00 0.00 N ATOM 55 CA THR A 227 10.293 -6.698 -6.046 1.00 0.00 C ATOM 56 C THR A 227 10.534 -6.683 -4.542 1.00 0.00 C ATOM 57 O THR A 227 11.669 -6.797 -4.080 1.00 0.00 O ATOM 58 CB THR A 227 10.179 -8.153 -6.537 1.00 0.00 C ATOM 59 OG1 THR A 227 10.142 -8.168 -7.972 1.00 0.00 O ATOM 60 CG2 THR A 227 8.931 -8.834 -5.990 1.00 0.00 C ATOM 0 H THR A 227 12.244 -6.541 -6.763 1.00 0.00 H new ATOM 0 HA THR A 227 9.363 -6.171 -6.256 1.00 0.00 H new ATOM 0 HB THR A 227 11.048 -8.702 -6.174 1.00 0.00 H new ATOM 0 HG1 THR A 227 10.071 -9.093 -8.288 1.00 0.00 H new ATOM 0 HG21 THR A 227 8.885 -9.859 -6.358 1.00 0.00 H new ATOM 0 HG22 THR A 227 8.968 -8.841 -4.901 1.00 0.00 H new ATOM 0 HG23 THR A 227 8.046 -8.290 -6.319 1.00 0.00 H new ATOM 68 N LEU A 228 9.459 -6.530 -3.791 1.00 0.00 N ATOM 69 CA LEU A 228 9.519 -6.473 -2.345 1.00 0.00 C ATOM 70 C LEU A 228 8.301 -7.184 -1.762 1.00 0.00 C ATOM 71 O LEU A 228 7.429 -7.637 -2.505 1.00 0.00 O ATOM 72 CB LEU A 228 9.574 -5.007 -1.894 1.00 0.00 C ATOM 73 CG LEU A 228 10.867 -4.237 -2.290 1.00 0.00 C ATOM 74 CD1 LEU A 228 10.614 -2.734 -2.327 1.00 0.00 C ATOM 75 CD2 LEU A 228 12.024 -4.535 -1.349 1.00 0.00 C ATOM 0 H LEU A 228 8.516 -6.442 -4.170 1.00 0.00 H new ATOM 0 HA LEU A 228 10.417 -6.976 -1.985 1.00 0.00 H new ATOM 0 HB2 LEU A 228 8.716 -4.483 -2.314 1.00 0.00 H new ATOM 0 HB3 LEU A 228 9.469 -4.974 -0.810 1.00 0.00 H new ATOM 0 HG LEU A 228 11.144 -4.583 -3.286 1.00 0.00 H new ATOM 0 HD11 LEU A 228 11.532 -2.217 -2.606 1.00 0.00 H new ATOM 0 HD12 LEU A 228 9.837 -2.514 -3.059 1.00 0.00 H new ATOM 0 HD13 LEU A 228 10.292 -2.395 -1.342 1.00 0.00 H new ATOM 0 HD21 LEU A 228 12.904 -3.975 -1.666 1.00 0.00 H new ATOM 0 HD22 LEU A 228 11.753 -4.242 -0.335 1.00 0.00 H new ATOM 0 HD23 LEU A 228 12.246 -5.602 -1.371 1.00 0.00 H new ATOM 87 N THR A 229 8.242 -7.296 -0.449 1.00 0.00 N ATOM 88 CA THR A 229 7.168 -8.019 0.210 1.00 0.00 C ATOM 89 C THR A 229 6.582 -7.189 1.352 1.00 0.00 C ATOM 90 O THR A 229 7.266 -6.352 1.923 1.00 0.00 O ATOM 91 CB THR A 229 7.712 -9.347 0.761 1.00 0.00 C ATOM 92 OG1 THR A 229 8.344 -10.085 -0.295 1.00 0.00 O ATOM 93 CG2 THR A 229 6.621 -10.202 1.400 1.00 0.00 C ATOM 0 H THR A 229 8.930 -6.893 0.187 1.00 0.00 H new ATOM 0 HA THR A 229 6.378 -8.216 -0.515 1.00 0.00 H new ATOM 0 HB THR A 229 8.436 -9.104 1.539 1.00 0.00 H new ATOM 0 HG1 THR A 229 8.691 -10.930 0.059 1.00 0.00 H new ATOM 0 HG21 THR A 229 7.057 -11.129 1.773 1.00 0.00 H new ATOM 0 HG22 THR A 229 6.168 -9.655 2.227 1.00 0.00 H new ATOM 0 HG23 THR A 229 5.858 -10.434 0.657 1.00 0.00 H new ATOM 101 N VAL A 230 5.318 -7.415 1.672 1.00 0.00 N ATOM 102 CA VAL A 230 4.670 -6.730 2.788 1.00 0.00 C ATOM 103 C VAL A 230 4.630 -7.638 4.009 1.00 0.00 C ATOM 104 O VAL A 230 4.172 -8.779 3.928 1.00 0.00 O ATOM 105 CB VAL A 230 3.235 -6.268 2.430 1.00 0.00 C ATOM 106 CG1 VAL A 230 2.413 -5.992 3.686 1.00 0.00 C ATOM 107 CG2 VAL A 230 3.286 -5.008 1.575 1.00 0.00 C ATOM 0 H VAL A 230 4.715 -8.070 1.174 1.00 0.00 H new ATOM 0 HA VAL A 230 5.260 -5.841 3.011 1.00 0.00 H new ATOM 0 HB VAL A 230 2.758 -7.073 1.871 1.00 0.00 H new ATOM 0 HG11 VAL A 230 1.411 -5.670 3.402 1.00 0.00 H new ATOM 0 HG12 VAL A 230 2.346 -6.901 4.284 1.00 0.00 H new ATOM 0 HG13 VAL A 230 2.894 -5.208 4.271 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.272 -4.693 1.330 1.00 0.00 H new ATOM 0 HG22 VAL A 230 3.789 -4.214 2.127 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.834 -5.214 0.656 1.00 0.00 H new ATOM 117 N LYS A 231 5.107 -7.130 5.136 1.00 0.00 N ATOM 118 CA LYS A 231 5.202 -7.930 6.349 1.00 0.00 C ATOM 119 C LYS A 231 4.206 -7.455 7.410 1.00 0.00 C ATOM 120 O LYS A 231 3.725 -8.249 8.220 1.00 0.00 O ATOM 121 CB LYS A 231 6.638 -7.890 6.885 1.00 0.00 C ATOM 122 CG LYS A 231 6.855 -8.685 8.163 1.00 0.00 C ATOM 123 CD LYS A 231 8.337 -8.840 8.480 1.00 0.00 C ATOM 124 CE LYS A 231 9.066 -7.506 8.445 1.00 0.00 C ATOM 125 NZ LYS A 231 10.495 -7.640 8.824 1.00 0.00 N1+ ATOM 0 H LYS A 231 5.434 -6.169 5.236 1.00 0.00 H new ATOM 0 HA LYS A 231 4.945 -8.961 6.105 1.00 0.00 H new ATOM 0 HB2 LYS A 231 7.310 -8.271 6.116 1.00 0.00 H new ATOM 0 HB3 LYS A 231 6.916 -6.852 7.066 1.00 0.00 H new ATOM 0 HG2 LYS A 231 6.355 -8.185 8.993 1.00 0.00 H new ATOM 0 HG3 LYS A 231 6.399 -9.670 8.062 1.00 0.00 H new ATOM 0 HD2 LYS A 231 8.452 -9.291 9.466 1.00 0.00 H new ATOM 0 HD3 LYS A 231 8.793 -9.522 7.762 1.00 0.00 H new ATOM 0 HE2 LYS A 231 8.995 -7.081 7.444 1.00 0.00 H new ATOM 0 HE3 LYS A 231 8.576 -6.808 9.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 11.054 -6.913 8.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 10.594 -7.518 9.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 10.839 -8.583 8.552 1.00 0.00 H new ATOM 139 N THR A 232 3.875 -6.171 7.390 1.00 0.00 N ATOM 140 CA THR A 232 2.942 -5.619 8.361 1.00 0.00 C ATOM 141 C THR A 232 1.722 -5.028 7.662 1.00 0.00 C ATOM 142 O THR A 232 1.528 -5.226 6.466 1.00 0.00 O ATOM 143 CB THR A 232 3.609 -4.542 9.236 1.00 0.00 C ATOM 144 OG1 THR A 232 4.014 -3.426 8.434 1.00 0.00 O ATOM 145 CG2 THR A 232 4.810 -5.112 9.973 1.00 0.00 C ATOM 0 H THR A 232 4.236 -5.496 6.716 1.00 0.00 H new ATOM 0 HA THR A 232 2.624 -6.438 9.006 1.00 0.00 H new ATOM 0 HB THR A 232 2.878 -4.204 9.971 1.00 0.00 H new ATOM 0 HG1 THR A 232 3.558 -2.617 8.746 1.00 0.00 H new ATOM 0 HG21 THR A 232 5.265 -4.333 10.585 1.00 0.00 H new ATOM 0 HG22 THR A 232 4.488 -5.934 10.613 1.00 0.00 H new ATOM 0 HG23 THR A 232 5.540 -5.479 9.251 1.00 0.00 H new ATOM 153 N GLN A 233 0.906 -4.304 8.411 1.00 0.00 N ATOM 154 CA GLN A 233 -0.366 -3.812 7.905 1.00 0.00 C ATOM 155 C GLN A 233 -0.328 -2.284 7.793 1.00 0.00 C ATOM 156 O GLN A 233 -0.020 -1.602 8.771 1.00 0.00 O ATOM 157 CB GLN A 233 -1.495 -4.262 8.836 1.00 0.00 C ATOM 158 CG GLN A 233 -1.555 -5.766 9.071 1.00 0.00 C ATOM 159 CD GLN A 233 -2.641 -6.148 10.056 1.00 0.00 C ATOM 160 OE1 GLN A 233 -2.963 -5.392 10.971 1.00 0.00 O ATOM 161 NE2 GLN A 233 -3.228 -7.319 9.865 1.00 0.00 N ATOM 0 H GLN A 233 1.103 -4.043 9.377 1.00 0.00 H new ATOM 0 HA GLN A 233 -0.548 -4.222 6.912 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.379 -3.761 9.797 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.447 -3.934 8.418 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -1.732 -6.273 8.123 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -0.591 -6.113 9.443 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -2.932 -7.918 9.094 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -3.976 -7.622 10.489 1.00 0.00 H new ATOM 170 N PRO A 234 -0.632 -1.720 6.605 1.00 0.00 N ATOM 171 CA PRO A 234 -0.404 -0.305 6.304 1.00 0.00 C ATOM 172 C PRO A 234 -1.591 0.635 6.575 1.00 0.00 C ATOM 173 O PRO A 234 -2.569 0.645 5.829 1.00 0.00 O ATOM 174 CB PRO A 234 -0.118 -0.329 4.794 1.00 0.00 C ATOM 175 CG PRO A 234 -0.490 -1.701 4.304 1.00 0.00 C ATOM 176 CD PRO A 234 -1.193 -2.398 5.436 1.00 0.00 C ATOM 0 HA PRO A 234 0.385 0.090 6.944 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -0.698 0.436 4.278 1.00 0.00 H new ATOM 0 HB3 PRO A 234 0.933 -0.120 4.596 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -1.138 -1.636 3.430 1.00 0.00 H new ATOM 0 HG3 PRO A 234 0.398 -2.256 4.002 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -2.275 -2.282 5.377 1.00 0.00 H new ATOM 0 HD3 PRO A 234 -0.987 -3.468 5.447 1.00 0.00 H new ATOM 184 N THR A 235 -1.491 1.426 7.641 1.00 0.00 N ATOM 185 CA THR A 235 -2.381 2.571 7.862 1.00 0.00 C ATOM 186 C THR A 235 -1.713 3.579 8.804 1.00 0.00 C ATOM 187 O THR A 235 -1.097 3.175 9.783 1.00 0.00 O ATOM 188 CB THR A 235 -3.772 2.132 8.394 1.00 0.00 C ATOM 189 OG1 THR A 235 -4.610 1.795 7.285 1.00 0.00 O ATOM 190 CG2 THR A 235 -4.440 3.230 9.220 1.00 0.00 C ATOM 0 H THR A 235 -0.795 1.295 8.375 1.00 0.00 H new ATOM 0 HA THR A 235 -2.556 3.054 6.901 1.00 0.00 H new ATOM 0 HB THR A 235 -3.629 1.269 9.044 1.00 0.00 H new ATOM 0 HG1 THR A 235 -4.076 1.349 6.595 1.00 0.00 H new ATOM 0 HG21 THR A 235 -5.411 2.881 9.572 1.00 0.00 H new ATOM 0 HG22 THR A 235 -3.810 3.476 10.075 1.00 0.00 H new ATOM 0 HG23 THR A 235 -4.576 4.118 8.603 1.00 0.00 H new ATOM 198 N VAL A 236 -1.743 4.876 8.458 1.00 0.00 N ATOM 199 CA VAL A 236 -1.197 5.912 9.340 1.00 0.00 C ATOM 200 C VAL A 236 -1.768 7.315 9.063 1.00 0.00 C ATOM 201 O VAL A 236 -1.963 7.701 7.929 1.00 0.00 O ATOM 202 CB VAL A 236 0.357 5.931 9.308 1.00 0.00 C ATOM 203 CG1 VAL A 236 0.926 7.343 9.265 1.00 0.00 C ATOM 204 CG2 VAL A 236 0.900 5.206 10.529 1.00 0.00 C ATOM 0 H VAL A 236 -2.135 5.226 7.584 1.00 0.00 H new ATOM 0 HA VAL A 236 -1.519 5.640 10.345 1.00 0.00 H new ATOM 0 HB VAL A 236 0.667 5.427 8.392 1.00 0.00 H new ATOM 0 HG11 VAL A 236 2.015 7.296 9.244 1.00 0.00 H new ATOM 0 HG12 VAL A 236 0.567 7.853 8.371 1.00 0.00 H new ATOM 0 HG13 VAL A 236 0.604 7.892 10.150 1.00 0.00 H new ATOM 0 HG21 VAL A 236 1.990 5.220 10.506 1.00 0.00 H new ATOM 0 HG22 VAL A 236 0.550 5.704 11.433 1.00 0.00 H new ATOM 0 HG23 VAL A 236 0.550 4.174 10.525 1.00 0.00 H new ATOM 214 N THR A 237 -2.038 8.054 10.125 1.00 0.00 N ATOM 215 CA THR A 237 -2.395 9.472 10.053 1.00 0.00 C ATOM 216 C THR A 237 -3.768 9.701 9.427 1.00 0.00 C ATOM 217 O THR A 237 -3.964 9.532 8.222 1.00 0.00 O ATOM 218 CB THR A 237 -1.329 10.290 9.291 1.00 0.00 C ATOM 219 OG1 THR A 237 -0.073 10.210 9.981 1.00 0.00 O ATOM 220 CG2 THR A 237 -1.744 11.750 9.156 1.00 0.00 C ATOM 0 H THR A 237 -2.017 7.687 11.077 1.00 0.00 H new ATOM 0 HA THR A 237 -2.436 9.821 11.085 1.00 0.00 H new ATOM 0 HB THR A 237 -1.230 9.869 8.291 1.00 0.00 H new ATOM 0 HG1 THR A 237 0.601 10.728 9.494 1.00 0.00 H new ATOM 0 HG21 THR A 237 -0.973 12.299 8.615 1.00 0.00 H new ATOM 0 HG22 THR A 237 -2.685 11.812 8.609 1.00 0.00 H new ATOM 0 HG23 THR A 237 -1.872 12.185 10.147 1.00 0.00 H new ATOM 228 N TYR A 238 -4.717 10.092 10.261 1.00 0.00 N ATOM 229 CA TYR A 238 -6.042 10.432 9.789 1.00 0.00 C ATOM 230 C TYR A 238 -6.340 11.898 10.055 1.00 0.00 C ATOM 231 O TYR A 238 -6.685 12.287 11.174 1.00 0.00 O ATOM 232 CB TYR A 238 -7.108 9.537 10.449 1.00 0.00 C ATOM 233 CG TYR A 238 -7.429 8.298 9.659 1.00 0.00 C ATOM 234 CD1 TYR A 238 -8.731 8.023 9.278 1.00 0.00 C ATOM 235 CD2 TYR A 238 -6.433 7.405 9.294 1.00 0.00 C ATOM 236 CE1 TYR A 238 -9.034 6.892 8.555 1.00 0.00 C ATOM 237 CE2 TYR A 238 -6.727 6.274 8.571 1.00 0.00 C ATOM 238 CZ TYR A 238 -8.030 6.019 8.204 1.00 0.00 C ATOM 239 OH TYR A 238 -8.328 4.886 7.488 1.00 0.00 O ATOM 0 H TYR A 238 -4.591 10.181 11.269 1.00 0.00 H new ATOM 0 HA TYR A 238 -6.074 10.260 8.713 1.00 0.00 H new ATOM 0 HB2 TYR A 238 -6.762 9.246 11.441 1.00 0.00 H new ATOM 0 HB3 TYR A 238 -8.021 10.116 10.587 1.00 0.00 H new ATOM 0 HD1 TYR A 238 -9.521 8.706 9.552 1.00 0.00 H new ATOM 0 HD2 TYR A 238 -5.411 7.601 9.582 1.00 0.00 H new ATOM 0 HE1 TYR A 238 -10.055 6.691 8.265 1.00 0.00 H new ATOM 0 HE2 TYR A 238 -5.940 5.589 8.292 1.00 0.00 H new ATOM 0 HH TYR A 238 -7.506 4.379 7.322 1.00 0.00 H new ATOM 249 N ASN A 239 -6.189 12.705 9.021 1.00 0.00 N ATOM 250 CA ASN A 239 -6.496 14.117 9.096 1.00 0.00 C ATOM 251 C ASN A 239 -7.701 14.372 8.208 1.00 0.00 C ATOM 252 O ASN A 239 -7.568 14.684 7.033 1.00 0.00 O ATOM 253 CB ASN A 239 -5.286 14.942 8.643 1.00 0.00 C ATOM 254 CG ASN A 239 -5.011 16.138 9.537 1.00 0.00 C ATOM 255 OD1 ASN A 239 -4.502 17.159 9.080 1.00 0.00 O ATOM 256 ND2 ASN A 239 -5.317 16.016 10.823 1.00 0.00 N ATOM 0 H ASN A 239 -5.851 12.399 8.109 1.00 0.00 H new ATOM 0 HA ASN A 239 -6.724 14.413 10.120 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -4.404 14.301 8.622 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -5.452 15.289 7.623 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -5.130 16.785 11.467 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -5.739 15.153 11.167 1.00 0.00 H new ATOM 263 N ALA A 240 -8.877 14.229 8.783 1.00 0.00 N ATOM 264 CA ALA A 240 -10.106 14.090 8.009 1.00 0.00 C ATOM 265 C ALA A 240 -10.661 15.436 7.589 1.00 0.00 C ATOM 266 O ALA A 240 -11.059 15.622 6.439 1.00 0.00 O ATOM 267 CB ALA A 240 -11.140 13.319 8.806 1.00 0.00 C ATOM 0 H ALA A 240 -9.014 14.205 9.793 1.00 0.00 H new ATOM 0 HA ALA A 240 -9.866 13.536 7.101 1.00 0.00 H new ATOM 0 HB1 ALA A 240 -12.053 13.221 8.219 1.00 0.00 H new ATOM 0 HB2 ALA A 240 -10.753 12.328 9.042 1.00 0.00 H new ATOM 0 HB3 ALA A 240 -11.359 13.853 9.731 1.00 0.00 H new ATOM 273 N VAL A 241 -10.672 16.376 8.519 1.00 0.00 N ATOM 274 CA VAL A 241 -11.137 17.725 8.235 1.00 0.00 C ATOM 275 C VAL A 241 -10.178 18.388 7.253 1.00 0.00 C ATOM 276 O VAL A 241 -10.537 19.311 6.525 1.00 0.00 O ATOM 277 CB VAL A 241 -11.232 18.571 9.531 1.00 0.00 C ATOM 278 CG1 VAL A 241 -11.887 19.924 9.269 1.00 0.00 C ATOM 279 CG2 VAL A 241 -11.987 17.813 10.617 1.00 0.00 C ATOM 0 H VAL A 241 -10.363 16.230 9.480 1.00 0.00 H new ATOM 0 HA VAL A 241 -12.135 17.665 7.800 1.00 0.00 H new ATOM 0 HB VAL A 241 -10.215 18.755 9.879 1.00 0.00 H new ATOM 0 HG11 VAL A 241 -11.937 20.490 10.199 1.00 0.00 H new ATOM 0 HG12 VAL A 241 -11.298 20.478 8.538 1.00 0.00 H new ATOM 0 HG13 VAL A 241 -12.895 19.772 8.882 1.00 0.00 H new ATOM 0 HG21 VAL A 241 -12.042 18.425 11.517 1.00 0.00 H new ATOM 0 HG22 VAL A 241 -12.995 17.588 10.270 1.00 0.00 H new ATOM 0 HG23 VAL A 241 -11.465 16.883 10.842 1.00 0.00 H new ATOM 289 N LYS A 242 -8.954 17.880 7.234 1.00 0.00 N ATOM 290 CA LYS A 242 -7.907 18.414 6.378 1.00 0.00 C ATOM 291 C LYS A 242 -7.743 17.564 5.127 1.00 0.00 C ATOM 292 O LYS A 242 -6.952 17.880 4.236 1.00 0.00 O ATOM 293 CB LYS A 242 -6.605 18.476 7.163 1.00 0.00 C ATOM 294 CG LYS A 242 -6.788 19.134 8.515 1.00 0.00 C ATOM 295 CD LYS A 242 -7.084 20.614 8.365 1.00 0.00 C ATOM 296 CE LYS A 242 -7.844 21.152 9.563 1.00 0.00 C ATOM 297 NZ LYS A 242 -7.020 21.157 10.801 1.00 0.00 N1+ ATOM 0 H LYS A 242 -8.661 17.090 7.809 1.00 0.00 H new ATOM 0 HA LYS A 242 -8.183 19.419 6.058 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -6.216 17.467 7.301 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -5.861 19.028 6.589 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -7.604 18.649 9.052 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -5.887 18.999 9.114 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -6.150 21.163 8.249 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -7.666 20.780 7.459 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -8.181 22.166 9.350 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -8.736 20.547 9.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -7.583 21.533 11.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -6.719 20.186 11.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -6.182 21.755 10.658 1.00 0.00 H new ATOM 311 N ASP A 243 -8.513 16.479 5.096 1.00 0.00 N ATOM 312 CA ASP A 243 -8.544 15.539 3.972 1.00 0.00 C ATOM 313 C ASP A 243 -7.155 14.961 3.677 1.00 0.00 C ATOM 314 O ASP A 243 -6.537 15.257 2.655 1.00 0.00 O ATOM 315 CB ASP A 243 -9.144 16.222 2.732 1.00 0.00 C ATOM 316 CG ASP A 243 -9.231 15.315 1.519 1.00 0.00 C ATOM 317 OD1 ASP A 243 -8.524 15.580 0.522 1.00 0.00 O ATOM 318 OD2 ASP A 243 -10.016 14.344 1.544 1.00 0.00 O1- ATOM 0 H ASP A 243 -9.141 16.223 5.858 1.00 0.00 H new ATOM 0 HA ASP A 243 -9.181 14.698 4.247 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -10.142 16.585 2.975 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -8.540 17.094 2.480 1.00 0.00 H new ATOM 323 N SER A 244 -6.666 14.139 4.594 1.00 0.00 N ATOM 324 CA SER A 244 -5.383 13.476 4.424 1.00 0.00 C ATOM 325 C SER A 244 -5.353 12.162 5.200 1.00 0.00 C ATOM 326 O SER A 244 -5.529 12.140 6.421 1.00 0.00 O ATOM 327 CB SER A 244 -4.245 14.390 4.888 1.00 0.00 C ATOM 328 OG SER A 244 -2.975 13.823 4.604 1.00 0.00 O ATOM 0 H SER A 244 -7.142 13.915 5.468 1.00 0.00 H new ATOM 0 HA SER A 244 -5.247 13.257 3.365 1.00 0.00 H new ATOM 0 HB2 SER A 244 -4.331 15.359 4.395 1.00 0.00 H new ATOM 0 HB3 SER A 244 -4.334 14.568 5.960 1.00 0.00 H new ATOM 0 HG SER A 244 -2.270 14.430 4.910 1.00 0.00 H new ATOM 334 N TYR A 245 -5.156 11.069 4.479 1.00 0.00 N ATOM 335 CA TYR A 245 -5.044 9.745 5.081 1.00 0.00 C ATOM 336 C TYR A 245 -3.786 9.072 4.538 1.00 0.00 C ATOM 337 O TYR A 245 -3.581 9.035 3.319 1.00 0.00 O ATOM 338 CB TYR A 245 -6.278 8.878 4.770 1.00 0.00 C ATOM 339 CG TYR A 245 -7.614 9.590 4.927 1.00 0.00 C ATOM 340 CD1 TYR A 245 -8.102 9.936 6.183 1.00 0.00 C ATOM 341 CD2 TYR A 245 -8.388 9.912 3.816 1.00 0.00 C ATOM 342 CE1 TYR A 245 -9.315 10.582 6.327 1.00 0.00 C ATOM 343 CE2 TYR A 245 -9.602 10.558 3.954 1.00 0.00 C ATOM 344 CZ TYR A 245 -10.060 10.892 5.209 1.00 0.00 C ATOM 345 OH TYR A 245 -11.273 11.532 5.344 1.00 0.00 O ATOM 0 H TYR A 245 -5.069 11.072 3.463 1.00 0.00 H new ATOM 0 HA TYR A 245 -4.984 9.852 6.164 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -6.197 8.509 3.748 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -6.267 8.007 5.425 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -7.522 9.695 7.062 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -8.034 9.653 2.829 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -9.678 10.843 7.310 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -10.189 10.800 3.081 1.00 0.00 H new ATOM 0 HH TYR A 245 -11.667 11.677 4.458 1.00 0.00 H new ATOM 355 N GLN A 246 -2.931 8.564 5.417 1.00 0.00 N ATOM 356 CA GLN A 246 -1.668 7.978 4.980 1.00 0.00 C ATOM 357 C GLN A 246 -1.585 6.523 5.442 1.00 0.00 C ATOM 358 O GLN A 246 -2.559 5.988 5.976 1.00 0.00 O ATOM 359 CB GLN A 246 -0.503 8.797 5.545 1.00 0.00 C ATOM 360 CG GLN A 246 -0.620 10.288 5.271 1.00 0.00 C ATOM 361 CD GLN A 246 0.560 11.077 5.801 1.00 0.00 C ATOM 362 OE1 GLN A 246 1.189 10.697 6.788 1.00 0.00 O ATOM 363 NE2 GLN A 246 0.869 12.183 5.146 1.00 0.00 N ATOM 0 H GLN A 246 -3.085 8.545 6.425 1.00 0.00 H new ATOM 0 HA GLN A 246 -1.611 7.995 3.892 1.00 0.00 H new ATOM 0 HB2 GLN A 246 -0.445 8.637 6.622 1.00 0.00 H new ATOM 0 HB3 GLN A 246 0.430 8.429 5.118 1.00 0.00 H new ATOM 0 HG2 GLN A 246 -0.706 10.450 4.196 1.00 0.00 H new ATOM 0 HG3 GLN A 246 -1.537 10.665 5.724 1.00 0.00 H new ATOM 0 HE21 GLN A 246 0.322 12.463 4.332 1.00 0.00 H new ATOM 0 HE22 GLN A 246 1.654 12.756 5.455 1.00 0.00 H new ATOM 372 N PHE A 247 -0.454 5.862 5.224 1.00 0.00 N ATOM 373 CA PHE A 247 -0.281 4.521 5.749 1.00 0.00 C ATOM 374 C PHE A 247 1.190 4.131 5.916 1.00 0.00 C ATOM 375 O PHE A 247 1.964 4.208 4.969 1.00 0.00 O ATOM 376 CB PHE A 247 -1.038 3.488 4.907 1.00 0.00 C ATOM 377 CG PHE A 247 -0.827 3.548 3.412 1.00 0.00 C ATOM 378 CD1 PHE A 247 -1.292 4.620 2.667 1.00 0.00 C ATOM 379 CD2 PHE A 247 -0.206 2.503 2.746 1.00 0.00 C ATOM 380 CE1 PHE A 247 -1.142 4.650 1.296 1.00 0.00 C ATOM 381 CE2 PHE A 247 -0.050 2.529 1.375 1.00 0.00 C ATOM 382 CZ PHE A 247 -0.520 3.604 0.649 1.00 0.00 C ATOM 0 H PHE A 247 0.340 6.227 4.698 1.00 0.00 H new ATOM 0 HA PHE A 247 -0.714 4.526 6.749 1.00 0.00 H new ATOM 0 HB2 PHE A 247 -0.754 2.494 5.251 1.00 0.00 H new ATOM 0 HB3 PHE A 247 -2.104 3.602 5.105 1.00 0.00 H new ATOM 0 HD1 PHE A 247 -1.779 5.444 3.167 1.00 0.00 H new ATOM 0 HD2 PHE A 247 0.161 1.657 3.308 1.00 0.00 H new ATOM 0 HE1 PHE A 247 -1.512 5.492 0.730 1.00 0.00 H new ATOM 0 HE2 PHE A 247 0.439 1.709 0.871 1.00 0.00 H new ATOM 0 HZ PHE A 247 -0.401 3.626 -0.424 1.00 0.00 H new ATOM 392 N THR A 248 1.570 3.704 7.127 1.00 0.00 N ATOM 393 CA THR A 248 2.940 3.282 7.391 1.00 0.00 C ATOM 394 C THR A 248 3.038 1.779 7.247 1.00 0.00 C ATOM 395 O THR A 248 2.113 1.057 7.623 1.00 0.00 O ATOM 396 CB THR A 248 3.389 3.685 8.818 1.00 0.00 C ATOM 397 OG1 THR A 248 3.450 5.110 8.931 1.00 0.00 O ATOM 398 CG2 THR A 248 4.744 3.089 9.178 1.00 0.00 C ATOM 0 H THR A 248 0.947 3.644 7.932 1.00 0.00 H new ATOM 0 HA THR A 248 3.593 3.777 6.672 1.00 0.00 H new ATOM 0 HB THR A 248 2.650 3.289 9.515 1.00 0.00 H new ATOM 0 HG1 THR A 248 4.019 5.354 9.691 1.00 0.00 H new ATOM 0 HG21 THR A 248 5.021 3.397 10.186 1.00 0.00 H new ATOM 0 HG22 THR A 248 4.687 2.001 9.133 1.00 0.00 H new ATOM 0 HG23 THR A 248 5.496 3.442 8.472 1.00 0.00 H new ATOM 406 N VAL A 249 4.141 1.299 6.702 1.00 0.00 N ATOM 407 CA VAL A 249 4.284 -0.133 6.504 1.00 0.00 C ATOM 408 C VAL A 249 5.724 -0.612 6.723 1.00 0.00 C ATOM 409 O VAL A 249 6.682 0.041 6.308 1.00 0.00 O ATOM 410 CB VAL A 249 3.811 -0.541 5.090 1.00 0.00 C ATOM 411 CG1 VAL A 249 4.748 -0.030 4.012 1.00 0.00 C ATOM 412 CG2 VAL A 249 3.630 -2.050 4.988 1.00 0.00 C ATOM 0 H VAL A 249 4.934 1.863 6.395 1.00 0.00 H new ATOM 0 HA VAL A 249 3.655 -0.615 7.252 1.00 0.00 H new ATOM 0 HB VAL A 249 2.841 -0.071 4.925 1.00 0.00 H new ATOM 0 HG11 VAL A 249 4.380 -0.338 3.034 1.00 0.00 H new ATOM 0 HG12 VAL A 249 4.794 1.058 4.056 1.00 0.00 H new ATOM 0 HG13 VAL A 249 5.745 -0.442 4.171 1.00 0.00 H new ATOM 0 HG21 VAL A 249 3.297 -2.309 3.983 1.00 0.00 H new ATOM 0 HG22 VAL A 249 4.579 -2.545 5.195 1.00 0.00 H new ATOM 0 HG23 VAL A 249 2.885 -2.377 5.713 1.00 0.00 H new ATOM 422 N THR A 250 5.868 -1.743 7.395 1.00 0.00 N ATOM 423 CA THR A 250 7.135 -2.434 7.472 1.00 0.00 C ATOM 424 C THR A 250 7.132 -3.551 6.444 1.00 0.00 C ATOM 425 O THR A 250 6.351 -4.503 6.547 1.00 0.00 O ATOM 426 CB THR A 250 7.377 -3.027 8.874 1.00 0.00 C ATOM 427 OG1 THR A 250 7.371 -1.985 9.859 1.00 0.00 O ATOM 428 CG2 THR A 250 8.697 -3.781 8.931 1.00 0.00 C ATOM 0 H THR A 250 5.110 -2.203 7.899 1.00 0.00 H new ATOM 0 HA THR A 250 7.936 -1.721 7.273 1.00 0.00 H new ATOM 0 HB THR A 250 6.571 -3.730 9.085 1.00 0.00 H new ATOM 0 HG1 THR A 250 7.524 -2.373 10.746 1.00 0.00 H new ATOM 0 HG21 THR A 250 8.841 -4.188 9.932 1.00 0.00 H new ATOM 0 HG22 THR A 250 8.682 -4.595 8.207 1.00 0.00 H new ATOM 0 HG23 THR A 250 9.515 -3.100 8.695 1.00 0.00 H new ATOM 436 N LEU A 251 7.973 -3.433 5.441 1.00 0.00 N ATOM 437 CA LEU A 251 7.980 -4.392 4.371 1.00 0.00 C ATOM 438 C LEU A 251 9.220 -5.256 4.479 1.00 0.00 C ATOM 439 O LEU A 251 10.125 -4.980 5.265 1.00 0.00 O ATOM 440 CB LEU A 251 7.953 -3.691 3.006 1.00 0.00 C ATOM 441 CG LEU A 251 6.950 -2.557 2.857 1.00 0.00 C ATOM 442 CD1 LEU A 251 7.671 -1.224 2.868 1.00 0.00 C ATOM 443 CD2 LEU A 251 6.153 -2.715 1.577 1.00 0.00 C ATOM 0 H LEU A 251 8.658 -2.683 5.348 1.00 0.00 H new ATOM 0 HA LEU A 251 7.088 -5.013 4.453 1.00 0.00 H new ATOM 0 HB2 LEU A 251 8.949 -3.297 2.802 1.00 0.00 H new ATOM 0 HB3 LEU A 251 7.743 -4.438 2.241 1.00 0.00 H new ATOM 0 HG LEU A 251 6.257 -2.591 3.698 1.00 0.00 H new ATOM 0 HD11 LEU A 251 6.946 -0.417 2.761 1.00 0.00 H new ATOM 0 HD12 LEU A 251 8.207 -1.108 3.810 1.00 0.00 H new ATOM 0 HD13 LEU A 251 8.380 -1.187 2.041 1.00 0.00 H new ATOM 0 HD21 LEU A 251 5.441 -1.895 1.488 1.00 0.00 H new ATOM 0 HD22 LEU A 251 6.830 -2.702 0.723 1.00 0.00 H new ATOM 0 HD23 LEU A 251 5.614 -3.662 1.598 1.00 0.00 H new ATOM 455 N THR A 252 9.242 -6.309 3.716 1.00 0.00 N ATOM 456 CA THR A 252 10.405 -7.137 3.597 1.00 0.00 C ATOM 457 C THR A 252 11.053 -6.900 2.233 1.00 0.00 C ATOM 458 O THR A 252 10.353 -6.759 1.228 1.00 0.00 O ATOM 459 CB THR A 252 10.010 -8.603 3.738 1.00 0.00 C ATOM 460 OG1 THR A 252 8.575 -8.714 3.761 1.00 0.00 O ATOM 461 CG2 THR A 252 10.600 -9.218 5.002 1.00 0.00 C ATOM 0 H THR A 252 8.448 -6.619 3.155 1.00 0.00 H new ATOM 0 HA THR A 252 11.116 -6.886 4.384 1.00 0.00 H new ATOM 0 HB THR A 252 10.409 -9.149 2.883 1.00 0.00 H new ATOM 0 HG1 THR A 252 8.321 -9.656 3.850 1.00 0.00 H new ATOM 0 HG21 THR A 252 10.299 -10.263 5.072 1.00 0.00 H new ATOM 0 HG22 THR A 252 11.688 -9.155 4.964 1.00 0.00 H new ATOM 0 HG23 THR A 252 10.235 -8.676 5.875 1.00 0.00 H new ATOM 469 N GLY A 253 12.373 -6.842 2.190 1.00 0.00 N ATOM 470 CA GLY A 253 13.050 -6.525 0.957 1.00 0.00 C ATOM 471 C GLY A 253 14.321 -7.311 0.756 1.00 0.00 C ATOM 472 O GLY A 253 14.435 -8.451 1.211 1.00 0.00 O ATOM 0 H GLY A 253 12.986 -7.009 2.988 1.00 0.00 H new ATOM 0 HA2 GLY A 253 12.377 -6.716 0.121 1.00 0.00 H new ATOM 0 HA3 GLY A 253 13.283 -5.460 0.942 1.00 0.00 H new ATOM 476 N ALA A 254 15.274 -6.705 0.068 1.00 0.00 N ATOM 477 CA ALA A 254 16.524 -7.377 -0.251 1.00 0.00 C ATOM 478 C ALA A 254 17.637 -7.051 0.736 1.00 0.00 C ATOM 479 O ALA A 254 17.417 -6.376 1.741 1.00 0.00 O ATOM 480 CB ALA A 254 16.954 -7.052 -1.674 1.00 0.00 C ATOM 0 H ALA A 254 15.207 -5.749 -0.281 1.00 0.00 H new ATOM 0 HA ALA A 254 16.339 -8.448 -0.169 1.00 0.00 H new ATOM 0 HB1 ALA A 254 17.891 -7.563 -1.897 1.00 0.00 H new ATOM 0 HB2 ALA A 254 16.185 -7.384 -2.371 1.00 0.00 H new ATOM 0 HB3 ALA A 254 17.095 -5.976 -1.775 1.00 0.00 H new ATOM 486 N THR A 255 18.827 -7.543 0.422 1.00 0.00 N ATOM 487 CA THR A 255 19.964 -7.510 1.328 1.00 0.00 C ATOM 488 C THR A 255 20.610 -6.114 1.393 1.00 0.00 C ATOM 489 O THR A 255 20.205 -5.192 0.681 1.00 0.00 O ATOM 490 CB THR A 255 20.999 -8.569 0.870 1.00 0.00 C ATOM 491 OG1 THR A 255 20.294 -9.744 0.441 1.00 0.00 O ATOM 492 CG2 THR A 255 21.970 -8.970 1.992 1.00 0.00 C ATOM 0 H THR A 255 19.031 -7.980 -0.477 1.00 0.00 H new ATOM 0 HA THR A 255 19.613 -7.741 2.334 1.00 0.00 H new ATOM 0 HB THR A 255 21.584 -8.129 0.063 1.00 0.00 H new ATOM 0 HG1 THR A 255 20.937 -10.422 0.147 1.00 0.00 H new ATOM 0 HG21 THR A 255 22.673 -9.714 1.616 1.00 0.00 H new ATOM 0 HG22 THR A 255 22.518 -8.091 2.330 1.00 0.00 H new ATOM 0 HG23 THR A 255 21.408 -9.390 2.826 1.00 0.00 H new ATOM 500 N ALA A 256 21.604 -5.977 2.268 1.00 0.00 N ATOM 501 CA ALA A 256 22.331 -4.730 2.469 1.00 0.00 C ATOM 502 C ALA A 256 23.127 -4.315 1.227 1.00 0.00 C ATOM 503 O ALA A 256 23.040 -4.963 0.180 1.00 0.00 O ATOM 504 CB ALA A 256 23.244 -4.866 3.679 1.00 0.00 C ATOM 0 H ALA A 256 21.929 -6.739 2.863 1.00 0.00 H new ATOM 0 HA ALA A 256 21.603 -3.939 2.649 1.00 0.00 H new ATOM 0 HB1 ALA A 256 23.788 -3.934 3.831 1.00 0.00 H new ATOM 0 HB2 ALA A 256 22.646 -5.085 4.563 1.00 0.00 H new ATOM 0 HB3 ALA A 256 23.953 -5.677 3.511 1.00 0.00 H new ATOM 510 N SER A 257 23.881 -3.217 1.362 1.00 0.00 N ATOM 511 CA SER A 257 24.655 -2.619 0.270 1.00 0.00 C ATOM 512 C SER A 257 23.751 -1.771 -0.626 1.00 0.00 C ATOM 513 O SER A 257 24.174 -1.282 -1.674 1.00 0.00 O ATOM 514 CB SER A 257 25.406 -3.687 -0.545 1.00 0.00 C ATOM 515 OG SER A 257 26.264 -3.102 -1.516 1.00 0.00 O ATOM 0 H SER A 257 23.971 -2.713 2.244 1.00 0.00 H new ATOM 0 HA SER A 257 25.408 -1.966 0.712 1.00 0.00 H new ATOM 0 HB2 SER A 257 25.992 -4.313 0.128 1.00 0.00 H new ATOM 0 HB3 SER A 257 24.687 -4.339 -1.041 1.00 0.00 H new ATOM 0 HG SER A 257 25.877 -2.258 -1.829 1.00 0.00 H new ATOM 521 N VAL A 258 22.505 -1.601 -0.205 1.00 0.00 N ATOM 522 CA VAL A 258 21.600 -0.665 -0.850 1.00 0.00 C ATOM 523 C VAL A 258 21.088 0.332 0.188 1.00 0.00 C ATOM 524 O VAL A 258 20.076 0.091 0.871 1.00 0.00 O ATOM 525 CB VAL A 258 20.407 -1.372 -1.533 1.00 0.00 C ATOM 526 CG1 VAL A 258 19.583 -0.378 -2.339 1.00 0.00 C ATOM 527 CG2 VAL A 258 20.886 -2.513 -2.421 1.00 0.00 C ATOM 0 H VAL A 258 22.098 -2.103 0.584 1.00 0.00 H new ATOM 0 HA VAL A 258 22.156 -0.149 -1.633 1.00 0.00 H new ATOM 0 HB VAL A 258 19.773 -1.792 -0.752 1.00 0.00 H new ATOM 0 HG11 VAL A 258 18.748 -0.896 -2.812 1.00 0.00 H new ATOM 0 HG12 VAL A 258 19.200 0.399 -1.677 1.00 0.00 H new ATOM 0 HG13 VAL A 258 20.210 0.076 -3.107 1.00 0.00 H new ATOM 0 HG21 VAL A 258 20.028 -2.994 -2.890 1.00 0.00 H new ATOM 0 HG22 VAL A 258 21.548 -2.120 -3.193 1.00 0.00 H new ATOM 0 HG23 VAL A 258 21.426 -3.242 -1.817 1.00 0.00 H new ATOM 537 N THR A 259 21.811 1.437 0.324 1.00 0.00 N ATOM 538 CA THR A 259 21.488 2.446 1.314 1.00 0.00 C ATOM 539 C THR A 259 20.254 3.231 0.897 1.00 0.00 C ATOM 540 O THR A 259 20.343 4.222 0.170 1.00 0.00 O ATOM 541 CB THR A 259 22.656 3.420 1.532 1.00 0.00 C ATOM 542 OG1 THR A 259 23.889 2.691 1.612 1.00 0.00 O ATOM 543 CG2 THR A 259 22.449 4.215 2.813 1.00 0.00 C ATOM 0 H THR A 259 22.629 1.654 -0.245 1.00 0.00 H new ATOM 0 HA THR A 259 21.291 1.924 2.250 1.00 0.00 H new ATOM 0 HB THR A 259 22.697 4.111 0.690 1.00 0.00 H new ATOM 0 HG1 THR A 259 24.631 3.317 1.749 1.00 0.00 H new ATOM 0 HG21 THR A 259 23.284 4.901 2.955 1.00 0.00 H new ATOM 0 HG22 THR A 259 21.521 4.783 2.743 1.00 0.00 H new ATOM 0 HG23 THR A 259 22.393 3.532 3.660 1.00 0.00 H new ATOM 551 N GLY A 260 19.109 2.770 1.355 1.00 0.00 N ATOM 552 CA GLY A 260 17.866 3.417 1.033 1.00 0.00 C ATOM 553 C GLY A 260 17.341 3.039 -0.334 1.00 0.00 C ATOM 554 O GLY A 260 17.743 3.629 -1.337 1.00 0.00 O ATOM 0 H GLY A 260 19.019 1.948 1.952 1.00 0.00 H new ATOM 0 HA2 GLY A 260 17.122 3.158 1.786 1.00 0.00 H new ATOM 0 HA3 GLY A 260 18.003 4.497 1.078 1.00 0.00 H new ATOM 558 N PHE A 261 16.470 2.035 -0.372 1.00 0.00 N ATOM 559 CA PHE A 261 15.721 1.711 -1.588 1.00 0.00 C ATOM 560 C PHE A 261 15.184 2.972 -2.277 1.00 0.00 C ATOM 561 O PHE A 261 15.464 3.210 -3.452 1.00 0.00 O ATOM 562 CB PHE A 261 14.520 0.793 -1.280 1.00 0.00 C ATOM 563 CG PHE A 261 14.791 -0.673 -1.468 1.00 0.00 C ATOM 564 CD1 PHE A 261 14.720 -1.553 -0.402 1.00 0.00 C ATOM 565 CD2 PHE A 261 15.092 -1.172 -2.725 1.00 0.00 C ATOM 566 CE1 PHE A 261 14.946 -2.904 -0.585 1.00 0.00 C ATOM 567 CE2 PHE A 261 15.324 -2.519 -2.916 1.00 0.00 C ATOM 568 CZ PHE A 261 15.249 -3.387 -1.845 1.00 0.00 C ATOM 0 H PHE A 261 16.264 1.430 0.423 1.00 0.00 H new ATOM 0 HA PHE A 261 16.423 1.201 -2.248 1.00 0.00 H new ATOM 0 HB2 PHE A 261 14.205 0.962 -0.250 1.00 0.00 H new ATOM 0 HB3 PHE A 261 13.686 1.080 -1.920 1.00 0.00 H new ATOM 0 HD1 PHE A 261 14.485 -1.180 0.584 1.00 0.00 H new ATOM 0 HD2 PHE A 261 15.146 -0.498 -3.567 1.00 0.00 H new ATOM 0 HE1 PHE A 261 14.886 -3.581 0.254 1.00 0.00 H new ATOM 0 HE2 PHE A 261 15.564 -2.893 -3.900 1.00 0.00 H new ATOM 0 HZ PHE A 261 15.427 -4.442 -1.991 1.00 0.00 H new ATOM 578 N LEU A 262 14.428 3.784 -1.538 1.00 0.00 N ATOM 579 CA LEU A 262 13.748 4.941 -2.111 1.00 0.00 C ATOM 580 C LEU A 262 13.262 5.877 -1.009 1.00 0.00 C ATOM 581 O LEU A 262 13.375 5.553 0.175 1.00 0.00 O ATOM 582 CB LEU A 262 12.581 4.479 -3.000 1.00 0.00 C ATOM 583 CG LEU A 262 11.695 3.358 -2.433 1.00 0.00 C ATOM 584 CD1 LEU A 262 10.821 3.858 -1.294 1.00 0.00 C ATOM 585 CD2 LEU A 262 10.839 2.758 -3.536 1.00 0.00 C ATOM 0 H LEU A 262 14.272 3.659 -0.538 1.00 0.00 H new ATOM 0 HA LEU A 262 14.453 5.494 -2.731 1.00 0.00 H new ATOM 0 HB2 LEU A 262 11.949 5.342 -3.210 1.00 0.00 H new ATOM 0 HB3 LEU A 262 12.989 4.143 -3.953 1.00 0.00 H new ATOM 0 HG LEU A 262 12.350 2.585 -2.030 1.00 0.00 H new ATOM 0 HD11 LEU A 262 10.209 3.038 -0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 262 11.452 4.237 -0.490 1.00 0.00 H new ATOM 0 HD13 LEU A 262 10.175 4.658 -1.655 1.00 0.00 H new ATOM 0 HD21 LEU A 262 10.216 1.965 -3.122 1.00 0.00 H new ATOM 0 HD22 LEU A 262 10.203 3.532 -3.965 1.00 0.00 H new ATOM 0 HD23 LEU A 262 11.483 2.345 -4.313 1.00 0.00 H new ATOM 597 N LYS A 263 12.735 7.036 -1.396 1.00 0.00 N ATOM 598 CA LYS A 263 12.272 8.031 -0.438 1.00 0.00 C ATOM 599 C LYS A 263 11.018 8.746 -0.925 1.00 0.00 C ATOM 600 O LYS A 263 10.359 8.301 -1.865 1.00 0.00 O ATOM 601 CB LYS A 263 13.368 9.056 -0.163 1.00 0.00 C ATOM 602 CG LYS A 263 14.540 8.473 0.584 1.00 0.00 C ATOM 603 CD LYS A 263 15.557 9.541 0.951 1.00 0.00 C ATOM 604 CE LYS A 263 16.779 8.940 1.624 1.00 0.00 C ATOM 605 NZ LYS A 263 17.435 7.916 0.771 1.00 0.00 N1+ ATOM 0 H LYS A 263 12.618 7.308 -2.372 1.00 0.00 H new ATOM 0 HA LYS A 263 12.026 7.502 0.483 1.00 0.00 H new ATOM 0 HB2 LYS A 263 13.716 9.471 -1.109 1.00 0.00 H new ATOM 0 HB3 LYS A 263 12.950 9.882 0.413 1.00 0.00 H new ATOM 0 HG2 LYS A 263 14.186 7.980 1.490 1.00 0.00 H new ATOM 0 HG3 LYS A 263 15.019 7.709 -0.028 1.00 0.00 H new ATOM 0 HD2 LYS A 263 15.862 10.078 0.053 1.00 0.00 H new ATOM 0 HD3 LYS A 263 15.096 10.270 1.617 1.00 0.00 H new ATOM 0 HE2 LYS A 263 17.492 9.731 1.854 1.00 0.00 H new ATOM 0 HE3 LYS A 263 16.486 8.489 2.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 18.399 7.740 1.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 16.888 7.032 0.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 17.478 8.257 -0.210 1.00 0.00 H new ATOM 619 N ALA A 264 10.692 9.850 -0.260 1.00 0.00 N ATOM 620 CA ALA A 264 9.545 10.662 -0.610 1.00 0.00 C ATOM 621 C ALA A 264 9.580 11.057 -2.074 1.00 0.00 C ATOM 622 O ALA A 264 10.553 11.640 -2.558 1.00 0.00 O ATOM 623 CB ALA A 264 9.484 11.899 0.271 1.00 0.00 C ATOM 0 H ALA A 264 11.221 10.203 0.538 1.00 0.00 H new ATOM 0 HA ALA A 264 8.647 10.067 -0.443 1.00 0.00 H new ATOM 0 HB1 ALA A 264 8.617 12.499 -0.004 1.00 0.00 H new ATOM 0 HB2 ALA A 264 9.401 11.598 1.315 1.00 0.00 H new ATOM 0 HB3 ALA A 264 10.391 12.488 0.134 1.00 0.00 H new ATOM 629 N GLY A 265 8.528 10.698 -2.773 1.00 0.00 N ATOM 630 CA GLY A 265 8.409 11.039 -4.173 1.00 0.00 C ATOM 631 C GLY A 265 8.541 9.821 -5.058 1.00 0.00 C ATOM 632 O GLY A 265 8.187 9.856 -6.237 1.00 0.00 O ATOM 0 H GLY A 265 7.742 10.170 -2.395 1.00 0.00 H new ATOM 0 HA2 GLY A 265 7.445 11.515 -4.351 1.00 0.00 H new ATOM 0 HA3 GLY A 265 9.177 11.766 -4.437 1.00 0.00 H new ATOM 636 N ASP A 266 9.057 8.744 -4.488 1.00 0.00 N ATOM 637 CA ASP A 266 9.197 7.495 -5.215 1.00 0.00 C ATOM 638 C ASP A 266 7.898 6.716 -5.161 1.00 0.00 C ATOM 639 O ASP A 266 7.231 6.674 -4.123 1.00 0.00 O ATOM 640 CB ASP A 266 10.338 6.650 -4.649 1.00 0.00 C ATOM 641 CG ASP A 266 11.702 7.208 -4.993 1.00 0.00 C ATOM 642 OD1 ASP A 266 12.381 7.749 -4.095 1.00 0.00 O ATOM 643 OD2 ASP A 266 12.102 7.115 -6.175 1.00 0.00 O1- ATOM 0 H ASP A 266 9.386 8.711 -3.523 1.00 0.00 H new ATOM 0 HA ASP A 266 9.434 7.731 -6.252 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.237 6.589 -3.565 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.258 5.633 -5.034 1.00 0.00 H new ATOM 648 N GLN A 267 7.531 6.108 -6.275 1.00 0.00 N ATOM 649 CA GLN A 267 6.292 5.359 -6.340 1.00 0.00 C ATOM 650 C GLN A 267 6.567 3.867 -6.388 1.00 0.00 C ATOM 651 O GLN A 267 7.604 3.420 -6.887 1.00 0.00 O ATOM 652 CB GLN A 267 5.458 5.760 -7.556 1.00 0.00 C ATOM 653 CG GLN A 267 5.171 7.247 -7.652 1.00 0.00 C ATOM 654 CD GLN A 267 4.000 7.536 -8.561 1.00 0.00 C ATOM 655 OE1 GLN A 267 4.161 7.723 -9.767 1.00 0.00 O ATOM 656 NE2 GLN A 267 2.812 7.571 -7.985 1.00 0.00 N ATOM 0 H GLN A 267 8.070 6.119 -7.141 1.00 0.00 H new ATOM 0 HA GLN A 267 5.727 5.594 -5.438 1.00 0.00 H new ATOM 0 HB2 GLN A 267 5.978 5.443 -8.460 1.00 0.00 H new ATOM 0 HB3 GLN A 267 4.512 5.220 -7.527 1.00 0.00 H new ATOM 0 HG2 GLN A 267 4.965 7.642 -6.657 1.00 0.00 H new ATOM 0 HG3 GLN A 267 6.056 7.764 -8.023 1.00 0.00 H new ATOM 0 HE21 GLN A 267 2.727 7.410 -6.981 1.00 0.00 H new ATOM 0 HE22 GLN A 267 1.980 7.759 -8.544 1.00 0.00 H new ATOM 665 N VAL A 268 5.622 3.105 -5.885 1.00 0.00 N ATOM 666 CA VAL A 268 5.735 1.662 -5.839 1.00 0.00 C ATOM 667 C VAL A 268 4.464 1.016 -6.353 1.00 0.00 C ATOM 668 O VAL A 268 3.505 1.696 -6.681 1.00 0.00 O ATOM 669 CB VAL A 268 5.988 1.147 -4.399 1.00 0.00 C ATOM 670 CG1 VAL A 268 7.472 1.170 -4.070 1.00 0.00 C ATOM 671 CG2 VAL A 268 5.213 1.985 -3.382 1.00 0.00 C ATOM 0 H VAL A 268 4.752 3.467 -5.495 1.00 0.00 H new ATOM 0 HA VAL A 268 6.584 1.394 -6.468 1.00 0.00 H new ATOM 0 HB VAL A 268 5.636 0.117 -4.345 1.00 0.00 H new ATOM 0 HG11 VAL A 268 7.625 0.804 -3.055 1.00 0.00 H new ATOM 0 HG12 VAL A 268 8.010 0.531 -4.771 1.00 0.00 H new ATOM 0 HG13 VAL A 268 7.846 2.191 -4.148 1.00 0.00 H new ATOM 0 HG21 VAL A 268 5.404 1.607 -2.378 1.00 0.00 H new ATOM 0 HG22 VAL A 268 5.535 3.024 -3.446 1.00 0.00 H new ATOM 0 HG23 VAL A 268 4.146 1.922 -3.596 1.00 0.00 H new ATOM 681 N LYS A 269 4.478 -0.295 -6.432 1.00 0.00 N ATOM 682 CA LYS A 269 3.289 -1.068 -6.743 1.00 0.00 C ATOM 683 C LYS A 269 3.047 -2.077 -5.634 1.00 0.00 C ATOM 684 O LYS A 269 4.000 -2.623 -5.082 1.00 0.00 O ATOM 685 CB LYS A 269 3.447 -1.824 -8.065 1.00 0.00 C ATOM 686 CG LYS A 269 3.005 -1.059 -9.300 1.00 0.00 C ATOM 687 CD LYS A 269 3.904 0.131 -9.597 1.00 0.00 C ATOM 688 CE LYS A 269 3.933 0.464 -11.084 1.00 0.00 C ATOM 689 NZ LYS A 269 2.581 0.733 -11.638 1.00 0.00 N1+ ATOM 0 H LYS A 269 5.314 -0.860 -6.283 1.00 0.00 H new ATOM 0 HA LYS A 269 2.449 -0.379 -6.832 1.00 0.00 H new ATOM 0 HB2 LYS A 269 4.494 -2.102 -8.184 1.00 0.00 H new ATOM 0 HB3 LYS A 269 2.876 -2.751 -8.007 1.00 0.00 H new ATOM 0 HG2 LYS A 269 3.001 -1.731 -10.158 1.00 0.00 H new ATOM 0 HG3 LYS A 269 1.981 -0.712 -9.162 1.00 0.00 H new ATOM 0 HD2 LYS A 269 3.555 0.999 -9.037 1.00 0.00 H new ATOM 0 HD3 LYS A 269 4.916 -0.084 -9.253 1.00 0.00 H new ATOM 0 HE2 LYS A 269 4.567 1.336 -11.245 1.00 0.00 H new ATOM 0 HE3 LYS A 269 4.386 -0.364 -11.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 2.638 1.506 -12.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 2.220 -0.124 -12.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 1.938 1.006 -10.867 1.00 0.00 H new ATOM 703 N PHE A 270 1.794 -2.325 -5.299 1.00 0.00 N ATOM 704 CA PHE A 270 1.471 -3.377 -4.358 1.00 0.00 C ATOM 705 C PHE A 270 0.272 -4.160 -4.871 1.00 0.00 C ATOM 706 O PHE A 270 -0.627 -3.591 -5.482 1.00 0.00 O ATOM 707 CB PHE A 270 1.244 -2.816 -2.938 1.00 0.00 C ATOM 708 CG PHE A 270 0.041 -1.926 -2.757 1.00 0.00 C ATOM 709 CD1 PHE A 270 -1.074 -2.387 -2.076 1.00 0.00 C ATOM 710 CD2 PHE A 270 0.035 -0.625 -3.236 1.00 0.00 C ATOM 711 CE1 PHE A 270 -2.171 -1.572 -1.877 1.00 0.00 C ATOM 712 CE2 PHE A 270 -1.064 0.194 -3.043 1.00 0.00 C ATOM 713 CZ PHE A 270 -2.167 -0.280 -2.363 1.00 0.00 C ATOM 0 H PHE A 270 0.989 -1.815 -5.663 1.00 0.00 H new ATOM 0 HA PHE A 270 2.317 -4.060 -4.278 1.00 0.00 H new ATOM 0 HB2 PHE A 270 1.156 -3.655 -2.248 1.00 0.00 H new ATOM 0 HB3 PHE A 270 2.132 -2.255 -2.645 1.00 0.00 H new ATOM 0 HD1 PHE A 270 -1.085 -3.398 -1.696 1.00 0.00 H new ATOM 0 HD2 PHE A 270 0.897 -0.247 -3.765 1.00 0.00 H new ATOM 0 HE1 PHE A 270 -3.031 -1.945 -1.342 1.00 0.00 H new ATOM 0 HE2 PHE A 270 -1.058 1.204 -3.425 1.00 0.00 H new ATOM 0 HZ PHE A 270 -3.025 0.358 -2.211 1.00 0.00 H new ATOM 723 N THR A 271 0.296 -5.467 -4.657 1.00 0.00 N ATOM 724 CA THR A 271 -0.718 -6.378 -5.182 1.00 0.00 C ATOM 725 C THR A 271 -0.878 -7.575 -4.243 1.00 0.00 C ATOM 726 O THR A 271 0.016 -8.421 -4.138 1.00 0.00 O ATOM 727 CB THR A 271 -0.341 -6.895 -6.603 1.00 0.00 C ATOM 728 OG1 THR A 271 1.005 -7.395 -6.579 1.00 0.00 O ATOM 729 CG2 THR A 271 -0.443 -5.812 -7.698 1.00 0.00 C ATOM 0 H THR A 271 1.022 -5.931 -4.112 1.00 0.00 H new ATOM 0 HA THR A 271 -1.655 -5.825 -5.251 1.00 0.00 H new ATOM 0 HB THR A 271 -1.059 -7.676 -6.853 1.00 0.00 H new ATOM 0 HG1 THR A 271 1.193 -7.785 -5.700 1.00 0.00 H new ATOM 0 HG21 THR A 271 -0.167 -6.241 -8.661 1.00 0.00 H new ATOM 0 HG22 THR A 271 -1.466 -5.439 -7.747 1.00 0.00 H new ATOM 0 HG23 THR A 271 0.232 -4.990 -7.460 1.00 0.00 H new ATOM 737 N ASN A 272 -2.008 -7.639 -3.554 1.00 0.00 N ATOM 738 CA ASN A 272 -2.242 -8.690 -2.568 1.00 0.00 C ATOM 739 C ASN A 272 -3.284 -9.687 -3.043 1.00 0.00 C ATOM 740 O ASN A 272 -4.210 -9.349 -3.783 1.00 0.00 O ATOM 741 CB ASN A 272 -2.694 -8.098 -1.230 1.00 0.00 C ATOM 742 CG ASN A 272 -4.045 -7.411 -1.308 1.00 0.00 C ATOM 743 OD1 ASN A 272 -4.367 -6.733 -2.284 1.00 0.00 O ATOM 744 ND2 ASN A 272 -4.856 -7.598 -0.281 1.00 0.00 N ATOM 0 H ASN A 272 -2.778 -6.978 -3.658 1.00 0.00 H new ATOM 0 HA ASN A 272 -1.293 -9.210 -2.436 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -2.740 -8.892 -0.485 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -1.948 -7.381 -0.886 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -5.784 -7.174 -0.280 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -4.554 -8.166 0.510 1.00 0.00 H new ATOM 1061 N SER A 292 -4.626 -4.546 -6.116 1.00 0.00 N ATOM 1062 CA SER A 292 -4.116 -3.210 -5.865 1.00 0.00 C ATOM 1063 C SER A 292 -3.230 -2.732 -7.025 1.00 0.00 C ATOM 1064 O SER A 292 -3.237 -3.336 -8.101 1.00 0.00 O ATOM 1065 CB SER A 292 -3.367 -3.215 -4.534 1.00 0.00 C ATOM 1066 OG SER A 292 -3.070 -4.546 -4.127 1.00 0.00 O ATOM 0 HA SER A 292 -4.943 -2.503 -5.800 1.00 0.00 H new ATOM 0 HB2 SER A 292 -2.443 -2.644 -4.629 1.00 0.00 H new ATOM 0 HB3 SER A 292 -3.969 -2.722 -3.771 1.00 0.00 H new ATOM 0 HG SER A 292 -3.599 -5.176 -4.659 1.00 0.00 H new ATOM 1072 N PHE A 293 -2.467 -1.659 -6.809 1.00 0.00 N ATOM 1073 CA PHE A 293 -1.781 -0.973 -7.890 1.00 0.00 C ATOM 1074 C PHE A 293 -0.651 -0.095 -7.338 1.00 0.00 C ATOM 1075 O PHE A 293 0.003 -0.463 -6.366 1.00 0.00 O ATOM 1076 CB PHE A 293 -2.788 -0.145 -8.715 1.00 0.00 C ATOM 1077 CG PHE A 293 -3.706 0.733 -7.899 1.00 0.00 C ATOM 1078 CD1 PHE A 293 -4.919 0.246 -7.436 1.00 0.00 C ATOM 1079 CD2 PHE A 293 -3.362 2.044 -7.604 1.00 0.00 C ATOM 1080 CE1 PHE A 293 -5.769 1.046 -6.696 1.00 0.00 C ATOM 1081 CE2 PHE A 293 -4.208 2.848 -6.863 1.00 0.00 C ATOM 1082 CZ PHE A 293 -5.412 2.348 -6.409 1.00 0.00 C ATOM 0 H PHE A 293 -2.312 -1.249 -5.888 1.00 0.00 H new ATOM 0 HA PHE A 293 -1.330 -1.713 -8.551 1.00 0.00 H new ATOM 0 HB2 PHE A 293 -2.235 0.483 -9.414 1.00 0.00 H new ATOM 0 HB3 PHE A 293 -3.395 -0.827 -9.311 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -5.203 -0.772 -7.657 1.00 0.00 H new ATOM 0 HD2 PHE A 293 -2.422 2.441 -7.957 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -6.711 0.653 -6.343 1.00 0.00 H new ATOM 0 HE2 PHE A 293 -3.927 3.867 -6.639 1.00 0.00 H new ATOM 0 HZ PHE A 293 -6.074 2.975 -5.830 1.00 0.00 H new ATOM 1092 N THR A 294 -0.431 1.056 -7.955 1.00 0.00 N ATOM 1093 CA THR A 294 0.674 1.935 -7.594 1.00 0.00 C ATOM 1094 C THR A 294 0.411 2.681 -6.280 1.00 0.00 C ATOM 1095 O THR A 294 -0.697 3.163 -6.037 1.00 0.00 O ATOM 1096 CB THR A 294 0.908 2.958 -8.729 1.00 0.00 C ATOM 1097 OG1 THR A 294 1.122 2.255 -9.957 1.00 0.00 O ATOM 1098 CG2 THR A 294 2.094 3.889 -8.456 1.00 0.00 C ATOM 0 H THR A 294 -1.010 1.407 -8.717 1.00 0.00 H new ATOM 0 HA THR A 294 1.559 1.315 -7.452 1.00 0.00 H new ATOM 0 HB THR A 294 0.019 3.586 -8.792 1.00 0.00 H new ATOM 0 HG1 THR A 294 1.110 2.890 -10.704 1.00 0.00 H new ATOM 0 HG21 THR A 294 2.209 4.585 -9.287 1.00 0.00 H new ATOM 0 HG22 THR A 294 1.914 4.447 -7.537 1.00 0.00 H new ATOM 0 HG23 THR A 294 3.004 3.298 -8.349 1.00 0.00 H new ATOM 1106 N ALA A 295 1.434 2.756 -5.431 1.00 0.00 N ATOM 1107 CA ALA A 295 1.375 3.558 -4.217 1.00 0.00 C ATOM 1108 C ALA A 295 2.543 4.534 -4.196 1.00 0.00 C ATOM 1109 O ALA A 295 3.427 4.453 -5.048 1.00 0.00 O ATOM 1110 CB ALA A 295 1.405 2.666 -2.993 1.00 0.00 C ATOM 0 H ALA A 295 2.318 2.266 -5.566 1.00 0.00 H new ATOM 0 HA ALA A 295 0.441 4.120 -4.204 1.00 0.00 H new ATOM 0 HB1 ALA A 295 1.360 3.280 -2.094 1.00 0.00 H new ATOM 0 HB2 ALA A 295 0.550 1.991 -3.014 1.00 0.00 H new ATOM 0 HB3 ALA A 295 2.327 2.084 -2.989 1.00 0.00 H new ATOM 1116 N THR A 296 2.564 5.451 -3.238 1.00 0.00 N ATOM 1117 CA THR A 296 3.619 6.452 -3.203 1.00 0.00 C ATOM 1118 C THR A 296 4.204 6.632 -1.810 1.00 0.00 C ATOM 1119 O THR A 296 3.483 6.834 -0.830 1.00 0.00 O ATOM 1120 CB THR A 296 3.110 7.813 -3.751 1.00 0.00 C ATOM 1121 OG1 THR A 296 2.647 7.650 -5.100 1.00 0.00 O ATOM 1122 CG2 THR A 296 4.192 8.903 -3.711 1.00 0.00 C ATOM 0 H THR A 296 1.876 5.522 -2.488 1.00 0.00 H new ATOM 0 HA THR A 296 4.418 6.085 -3.847 1.00 0.00 H new ATOM 0 HB THR A 296 2.293 8.136 -3.105 1.00 0.00 H new ATOM 0 HG1 THR A 296 2.325 8.510 -5.442 1.00 0.00 H new ATOM 0 HG21 THR A 296 3.785 9.834 -4.105 1.00 0.00 H new ATOM 0 HG22 THR A 296 4.517 9.056 -2.682 1.00 0.00 H new ATOM 0 HG23 THR A 296 5.043 8.594 -4.318 1.00 0.00 H new ATOM 1130 N VAL A 297 5.529 6.573 -1.752 1.00 0.00 N ATOM 1131 CA VAL A 297 6.269 6.669 -0.507 1.00 0.00 C ATOM 1132 C VAL A 297 6.615 8.119 -0.186 1.00 0.00 C ATOM 1133 O VAL A 297 6.942 8.904 -1.077 1.00 0.00 O ATOM 1134 CB VAL A 297 7.558 5.825 -0.581 1.00 0.00 C ATOM 1135 CG1 VAL A 297 8.386 5.971 0.683 1.00 0.00 C ATOM 1136 CG2 VAL A 297 7.219 4.365 -0.835 1.00 0.00 C ATOM 0 H VAL A 297 6.121 6.456 -2.575 1.00 0.00 H new ATOM 0 HA VAL A 297 5.635 6.282 0.291 1.00 0.00 H new ATOM 0 HB VAL A 297 8.157 6.195 -1.413 1.00 0.00 H new ATOM 0 HG11 VAL A 297 9.288 5.364 0.600 1.00 0.00 H new ATOM 0 HG12 VAL A 297 8.664 7.016 0.817 1.00 0.00 H new ATOM 0 HG13 VAL A 297 7.802 5.637 1.541 1.00 0.00 H new ATOM 0 HG21 VAL A 297 8.138 3.781 -0.885 1.00 0.00 H new ATOM 0 HG22 VAL A 297 6.595 3.990 -0.024 1.00 0.00 H new ATOM 0 HG23 VAL A 297 6.681 4.275 -1.779 1.00 0.00 H new ATOM 1146 N THR A 298 6.522 8.471 1.088 1.00 0.00 N ATOM 1147 CA THR A 298 6.808 9.823 1.527 1.00 0.00 C ATOM 1148 C THR A 298 7.874 9.829 2.633 1.00 0.00 C ATOM 1149 O THR A 298 7.963 10.770 3.420 1.00 0.00 O ATOM 1150 CB THR A 298 5.521 10.503 2.036 1.00 0.00 C ATOM 1151 OG1 THR A 298 4.411 10.090 1.228 1.00 0.00 O ATOM 1152 CG2 THR A 298 5.637 12.022 1.980 1.00 0.00 C ATOM 0 H THR A 298 6.249 7.834 1.836 1.00 0.00 H new ATOM 0 HA THR A 298 7.194 10.380 0.673 1.00 0.00 H new ATOM 0 HB THR A 298 5.369 10.205 3.073 1.00 0.00 H new ATOM 0 HG1 THR A 298 3.627 9.946 1.798 1.00 0.00 H new ATOM 0 HG21 THR A 298 4.714 12.471 2.345 1.00 0.00 H new ATOM 0 HG22 THR A 298 6.470 12.347 2.604 1.00 0.00 H new ATOM 0 HG23 THR A 298 5.811 12.336 0.951 1.00 0.00 H new ATOM 1160 N ALA A 299 8.698 8.784 2.684 1.00 0.00 N ATOM 1161 CA ALA A 299 9.715 8.685 3.725 1.00 0.00 C ATOM 1162 C ALA A 299 10.876 7.799 3.322 1.00 0.00 C ATOM 1163 O ALA A 299 10.932 7.296 2.203 1.00 0.00 O ATOM 1164 CB ALA A 299 9.099 8.196 5.028 1.00 0.00 C ATOM 0 H ALA A 299 8.682 8.005 2.026 1.00 0.00 H new ATOM 0 HA ALA A 299 10.116 9.688 3.873 1.00 0.00 H new ATOM 0 HB1 ALA A 299 9.872 8.128 5.793 1.00 0.00 H new ATOM 0 HB2 ALA A 299 8.329 8.896 5.352 1.00 0.00 H new ATOM 0 HB3 ALA A 299 8.654 7.213 4.874 1.00 0.00 H new ATOM 1170 N ASP A 300 11.800 7.631 4.257 1.00 0.00 N ATOM 1171 CA ASP A 300 13.029 6.911 4.025 1.00 0.00 C ATOM 1172 C ASP A 300 12.785 5.418 4.028 1.00 0.00 C ATOM 1173 O ASP A 300 11.743 4.941 4.478 1.00 0.00 O ATOM 1174 CB ASP A 300 14.064 7.279 5.091 1.00 0.00 C ATOM 1175 CG ASP A 300 14.521 8.723 4.990 1.00 0.00 C ATOM 1176 OD1 ASP A 300 15.683 8.954 4.597 1.00 0.00 O ATOM 1177 OD2 ASP A 300 13.720 9.635 5.300 1.00 0.00 O1- ATOM 0 H ASP A 300 11.710 7.997 5.205 1.00 0.00 H new ATOM 0 HA ASP A 300 13.413 7.193 3.045 1.00 0.00 H new ATOM 0 HB2 ASP A 300 13.639 7.105 6.080 1.00 0.00 H new ATOM 0 HB3 ASP A 300 14.928 6.621 4.995 1.00 0.00 H new ATOM 1182 N ALA A 301 13.765 4.694 3.538 1.00 0.00 N ATOM 1183 CA ALA A 301 13.657 3.253 3.373 1.00 0.00 C ATOM 1184 C ALA A 301 15.012 2.585 3.574 1.00 0.00 C ATOM 1185 O ALA A 301 16.053 3.216 3.395 1.00 0.00 O ATOM 1186 CB ALA A 301 13.091 2.933 1.995 1.00 0.00 C ATOM 0 H ALA A 301 14.661 5.082 3.241 1.00 0.00 H new ATOM 0 HA ALA A 301 12.978 2.860 4.129 1.00 0.00 H new ATOM 0 HB1 ALA A 301 13.012 1.852 1.876 1.00 0.00 H new ATOM 0 HB2 ALA A 301 12.103 3.382 1.894 1.00 0.00 H new ATOM 0 HB3 ALA A 301 13.753 3.335 1.228 1.00 0.00 H new ATOM 1192 N ASN A 302 14.996 1.311 3.946 1.00 0.00 N ATOM 1193 CA ASN A 302 16.223 0.580 4.258 1.00 0.00 C ATOM 1194 C ASN A 302 16.290 -0.738 3.496 1.00 0.00 C ATOM 1195 O ASN A 302 15.307 -1.468 3.454 1.00 0.00 O ATOM 1196 CB ASN A 302 16.271 0.254 5.753 1.00 0.00 C ATOM 1197 CG ASN A 302 16.333 1.485 6.637 1.00 0.00 C ATOM 1198 OD1 ASN A 302 16.891 2.518 6.257 1.00 0.00 O ATOM 1199 ND2 ASN A 302 15.764 1.383 7.828 1.00 0.00 N ATOM 0 H ASN A 302 14.144 0.758 4.040 1.00 0.00 H new ATOM 0 HA ASN A 302 17.061 1.214 3.969 1.00 0.00 H new ATOM 0 HB2 ASN A 302 15.390 -0.330 6.018 1.00 0.00 H new ATOM 0 HB3 ASN A 302 17.141 -0.372 5.953 1.00 0.00 H new ATOM 0 HD21 ASN A 302 15.777 2.176 8.469 1.00 0.00 H new ATOM 0 HD22 ASN A 302 15.313 0.511 8.105 1.00 0.00 H new ATOM 1206 N SER A 303 17.425 -1.041 2.878 1.00 0.00 N ATOM 1207 CA SER A 303 17.685 -2.396 2.432 1.00 0.00 C ATOM 1208 C SER A 303 18.814 -2.988 3.273 1.00 0.00 C ATOM 1209 O SER A 303 19.992 -2.750 2.992 1.00 0.00 O ATOM 1210 CB SER A 303 18.083 -2.391 0.961 1.00 0.00 C ATOM 1211 OG SER A 303 17.668 -1.187 0.330 1.00 0.00 O ATOM 0 H SER A 303 18.169 -0.373 2.678 1.00 0.00 H new ATOM 0 HA SER A 303 16.785 -2.999 2.549 1.00 0.00 H new ATOM 0 HB2 SER A 303 19.164 -2.500 0.872 1.00 0.00 H new ATOM 0 HB3 SER A 303 17.634 -3.246 0.455 1.00 0.00 H new ATOM 0 HG SER A 303 16.703 -1.222 0.162 1.00 0.00 H new ATOM 1217 N ASP A 304 18.469 -3.724 4.321 1.00 0.00 N ATOM 1218 CA ASP A 304 19.486 -4.292 5.193 1.00 0.00 C ATOM 1219 C ASP A 304 19.630 -5.788 4.939 1.00 0.00 C ATOM 1220 O ASP A 304 18.810 -6.374 4.237 1.00 0.00 O ATOM 1221 CB ASP A 304 19.175 -4.013 6.673 1.00 0.00 C ATOM 1222 CG ASP A 304 18.387 -5.120 7.352 1.00 0.00 C ATOM 1223 OD1 ASP A 304 19.016 -5.971 8.020 1.00 0.00 O ATOM 1224 OD2 ASP A 304 17.145 -5.134 7.244 1.00 0.00 O1- ATOM 0 H ASP A 304 17.507 -3.939 4.585 1.00 0.00 H new ATOM 0 HA ASP A 304 20.436 -3.810 4.962 1.00 0.00 H new ATOM 0 HB2 ASP A 304 20.112 -3.864 7.210 1.00 0.00 H new ATOM 0 HB3 ASP A 304 18.614 -3.082 6.748 1.00 0.00 H new ATOM 1229 N SER A 305 20.660 -6.405 5.498 1.00 0.00 N ATOM 1230 CA SER A 305 20.931 -7.816 5.242 1.00 0.00 C ATOM 1231 C SER A 305 19.752 -8.705 5.624 1.00 0.00 C ATOM 1232 O SER A 305 19.521 -9.747 5.004 1.00 0.00 O ATOM 1233 CB SER A 305 22.170 -8.258 6.002 1.00 0.00 C ATOM 1234 OG SER A 305 23.313 -7.535 5.579 1.00 0.00 O ATOM 0 H SER A 305 21.322 -5.955 6.130 1.00 0.00 H new ATOM 0 HA SER A 305 21.097 -7.924 4.170 1.00 0.00 H new ATOM 0 HB2 SER A 305 22.017 -8.109 7.071 1.00 0.00 H new ATOM 0 HB3 SER A 305 22.333 -9.325 5.849 1.00 0.00 H new ATOM 0 HG SER A 305 24.097 -7.837 6.084 1.00 0.00 H new ATOM 1240 N GLY A 306 18.993 -8.279 6.622 1.00 0.00 N ATOM 1241 CA GLY A 306 17.869 -9.061 7.082 1.00 0.00 C ATOM 1242 C GLY A 306 16.671 -8.958 6.160 1.00 0.00 C ATOM 1243 O GLY A 306 15.597 -9.457 6.486 1.00 0.00 O ATOM 0 H GLY A 306 19.138 -7.402 7.122 1.00 0.00 H new ATOM 0 HA2 GLY A 306 18.168 -10.106 7.167 1.00 0.00 H new ATOM 0 HA3 GLY A 306 17.584 -8.729 8.080 1.00 0.00 H new ATOM 1247 N GLY A 307 16.855 -8.313 5.006 1.00 0.00 N ATOM 1248 CA GLY A 307 15.781 -8.186 4.047 1.00 0.00 C ATOM 1249 C GLY A 307 14.569 -7.459 4.599 1.00 0.00 C ATOM 1250 O GLY A 307 13.438 -7.876 4.366 1.00 0.00 O ATOM 0 H GLY A 307 17.733 -7.878 4.724 1.00 0.00 H new ATOM 0 HA2 GLY A 307 16.147 -7.653 3.169 1.00 0.00 H new ATOM 0 HA3 GLY A 307 15.480 -9.180 3.714 1.00 0.00 H new ATOM 1254 N ASP A 308 14.791 -6.386 5.346 1.00 0.00 N ATOM 1255 CA ASP A 308 13.689 -5.639 5.950 1.00 0.00 C ATOM 1256 C ASP A 308 13.697 -4.176 5.498 1.00 0.00 C ATOM 1257 O ASP A 308 14.648 -3.438 5.760 1.00 0.00 O ATOM 1258 CB ASP A 308 13.778 -5.738 7.471 1.00 0.00 C ATOM 1259 CG ASP A 308 12.779 -4.859 8.203 1.00 0.00 C ATOM 1260 OD1 ASP A 308 13.140 -3.720 8.578 1.00 0.00 O ATOM 1261 OD2 ASP A 308 11.643 -5.315 8.439 1.00 0.00 O1- ATOM 0 H ASP A 308 15.718 -6.012 5.549 1.00 0.00 H new ATOM 0 HA ASP A 308 12.747 -6.076 5.618 1.00 0.00 H new ATOM 0 HB2 ASP A 308 13.621 -6.775 7.768 1.00 0.00 H new ATOM 0 HB3 ASP A 308 14.786 -5.466 7.785 1.00 0.00 H new ATOM 1266 N VAL A 309 12.630 -3.768 4.821 1.00 0.00 N ATOM 1267 CA VAL A 309 12.505 -2.403 4.303 1.00 0.00 C ATOM 1268 C VAL A 309 11.212 -1.749 4.790 1.00 0.00 C ATOM 1269 O VAL A 309 10.140 -2.285 4.599 1.00 0.00 O ATOM 1270 CB VAL A 309 12.541 -2.378 2.743 1.00 0.00 C ATOM 1271 CG1 VAL A 309 11.585 -3.392 2.137 1.00 0.00 C ATOM 1272 CG2 VAL A 309 12.233 -0.992 2.180 1.00 0.00 C ATOM 0 H VAL A 309 11.830 -4.366 4.615 1.00 0.00 H new ATOM 0 HA VAL A 309 13.358 -1.839 4.682 1.00 0.00 H new ATOM 0 HB VAL A 309 13.561 -2.646 2.466 1.00 0.00 H new ATOM 0 HG11 VAL A 309 11.642 -3.341 1.050 1.00 0.00 H new ATOM 0 HG12 VAL A 309 11.859 -4.394 2.468 1.00 0.00 H new ATOM 0 HG13 VAL A 309 10.567 -3.170 2.458 1.00 0.00 H new ATOM 0 HG21 VAL A 309 12.270 -1.025 1.091 1.00 0.00 H new ATOM 0 HG22 VAL A 309 11.238 -0.682 2.500 1.00 0.00 H new ATOM 0 HG23 VAL A 309 12.971 -0.278 2.546 1.00 0.00 H new ATOM 1282 N THR A 310 11.307 -0.589 5.413 1.00 0.00 N ATOM 1283 CA THR A 310 10.123 0.063 5.961 1.00 0.00 C ATOM 1284 C THR A 310 9.909 1.441 5.334 1.00 0.00 C ATOM 1285 O THR A 310 10.865 2.199 5.178 1.00 0.00 O ATOM 1286 CB THR A 310 10.279 0.219 7.497 1.00 0.00 C ATOM 1287 OG1 THR A 310 10.471 -1.071 8.097 1.00 0.00 O ATOM 1288 CG2 THR A 310 9.080 0.925 8.152 1.00 0.00 C ATOM 0 H THR A 310 12.180 -0.080 5.553 1.00 0.00 H new ATOM 0 HA THR A 310 9.257 -0.559 5.732 1.00 0.00 H new ATOM 0 HB THR A 310 11.151 0.850 7.668 1.00 0.00 H new ATOM 0 HG1 THR A 310 10.571 -0.969 9.067 1.00 0.00 H new ATOM 0 HG21 THR A 310 9.247 1.005 9.226 1.00 0.00 H new ATOM 0 HG22 THR A 310 8.969 1.923 7.727 1.00 0.00 H new ATOM 0 HG23 THR A 310 8.173 0.349 7.968 1.00 0.00 H new ATOM 1296 N VAL A 311 8.662 1.756 4.966 1.00 0.00 N ATOM 1297 CA VAL A 311 8.322 3.092 4.451 1.00 0.00 C ATOM 1298 C VAL A 311 6.914 3.476 4.863 1.00 0.00 C ATOM 1299 O VAL A 311 6.132 2.640 5.307 1.00 0.00 O ATOM 1300 CB VAL A 311 8.402 3.194 2.899 1.00 0.00 C ATOM 1301 CG1 VAL A 311 9.848 3.220 2.410 1.00 0.00 C ATOM 1302 CG2 VAL A 311 7.647 2.039 2.240 1.00 0.00 C ATOM 0 H VAL A 311 7.874 1.110 5.014 1.00 0.00 H new ATOM 0 HA VAL A 311 9.062 3.767 4.881 1.00 0.00 H new ATOM 0 HB VAL A 311 7.932 4.134 2.612 1.00 0.00 H new ATOM 0 HG11 VAL A 311 9.863 3.292 1.322 1.00 0.00 H new ATOM 0 HG12 VAL A 311 10.361 4.081 2.838 1.00 0.00 H new ATOM 0 HG13 VAL A 311 10.354 2.306 2.720 1.00 0.00 H new ATOM 0 HG21 VAL A 311 7.716 2.131 1.156 1.00 0.00 H new ATOM 0 HG22 VAL A 311 8.086 1.092 2.553 1.00 0.00 H new ATOM 0 HG23 VAL A 311 6.600 2.070 2.541 1.00 0.00 H new ATOM 1312 N THR A 312 6.602 4.747 4.729 1.00 0.00 N ATOM 1313 CA THR A 312 5.259 5.220 4.950 1.00 0.00 C ATOM 1314 C THR A 312 4.744 5.908 3.693 1.00 0.00 C ATOM 1315 O THR A 312 5.463 6.676 3.044 1.00 0.00 O ATOM 1316 CB THR A 312 5.215 6.184 6.159 1.00 0.00 C ATOM 1317 OG1 THR A 312 5.483 5.454 7.357 1.00 0.00 O ATOM 1318 CG2 THR A 312 3.872 6.932 6.285 1.00 0.00 C ATOM 0 H THR A 312 7.268 5.473 4.466 1.00 0.00 H new ATOM 0 HA THR A 312 4.615 4.370 5.175 1.00 0.00 H new ATOM 0 HB THR A 312 5.980 6.943 5.997 1.00 0.00 H new ATOM 0 HG1 THR A 312 4.820 5.690 8.039 1.00 0.00 H new ATOM 0 HG21 THR A 312 3.903 7.592 7.152 1.00 0.00 H new ATOM 0 HG22 THR A 312 3.698 7.522 5.385 1.00 0.00 H new ATOM 0 HG23 THR A 312 3.064 6.211 6.408 1.00 0.00 H new ATOM 1326 N LEU A 313 3.508 5.606 3.352 1.00 0.00 N ATOM 1327 CA LEU A 313 2.910 6.061 2.118 1.00 0.00 C ATOM 1328 C LEU A 313 1.791 7.048 2.415 1.00 0.00 C ATOM 1329 O LEU A 313 1.259 7.069 3.524 1.00 0.00 O ATOM 1330 CB LEU A 313 2.378 4.853 1.342 1.00 0.00 C ATOM 1331 CG LEU A 313 3.412 3.745 1.093 1.00 0.00 C ATOM 1332 CD1 LEU A 313 3.451 2.755 2.248 1.00 0.00 C ATOM 1333 CD2 LEU A 313 3.137 3.027 -0.212 1.00 0.00 C ATOM 0 H LEU A 313 2.889 5.035 3.927 1.00 0.00 H new ATOM 0 HA LEU A 313 3.659 6.570 1.511 1.00 0.00 H new ATOM 0 HB2 LEU A 313 1.536 4.429 1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 313 1.994 5.196 0.381 1.00 0.00 H new ATOM 0 HG LEU A 313 4.390 4.221 1.023 1.00 0.00 H new ATOM 0 HD11 LEU A 313 4.193 1.983 2.041 1.00 0.00 H new ATOM 0 HD12 LEU A 313 3.718 3.278 3.166 1.00 0.00 H new ATOM 0 HD13 LEU A 313 2.470 2.294 2.365 1.00 0.00 H new ATOM 0 HD21 LEU A 313 3.884 2.248 -0.363 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.145 2.577 -0.178 1.00 0.00 H new ATOM 0 HD23 LEU A 313 3.184 3.739 -1.036 1.00 0.00 H new ATOM 1345 N SER A 314 1.438 7.865 1.438 1.00 0.00 N ATOM 1346 CA SER A 314 0.432 8.895 1.647 1.00 0.00 C ATOM 1347 C SER A 314 -0.592 8.914 0.520 1.00 0.00 C ATOM 1348 O SER A 314 -0.246 8.745 -0.653 1.00 0.00 O ATOM 1349 CB SER A 314 1.101 10.265 1.743 1.00 0.00 C ATOM 1350 OG SER A 314 2.169 10.253 2.672 1.00 0.00 O ATOM 0 H SER A 314 1.830 7.837 0.497 1.00 0.00 H new ATOM 0 HA SER A 314 -0.086 8.667 2.578 1.00 0.00 H new ATOM 0 HB2 SER A 314 1.473 10.560 0.762 1.00 0.00 H new ATOM 0 HB3 SER A 314 0.365 11.011 2.042 1.00 0.00 H new ATOM 0 HG SER A 314 2.579 11.142 2.711 1.00 0.00 H new ATOM 1632 N VAL A 333 -6.536 -3.338 6.627 1.00 0.00 N ATOM 1633 CA VAL A 333 -5.092 -3.491 6.514 1.00 0.00 C ATOM 1634 C VAL A 333 -4.637 -4.952 6.600 1.00 0.00 C ATOM 1635 O VAL A 333 -4.703 -5.597 7.651 1.00 0.00 O ATOM 1636 CB VAL A 333 -4.386 -2.631 7.578 1.00 0.00 C ATOM 1637 CG1 VAL A 333 -4.683 -1.171 7.327 1.00 0.00 C ATOM 1638 CG2 VAL A 333 -4.819 -3.011 8.989 1.00 0.00 C ATOM 0 HA VAL A 333 -4.808 -3.142 5.521 1.00 0.00 H new ATOM 0 HB VAL A 333 -3.314 -2.812 7.500 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -4.183 -0.563 8.081 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -4.322 -0.891 6.337 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -5.759 -1.004 7.382 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -4.299 -2.382 9.711 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -5.895 -2.867 9.091 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -4.574 -4.056 9.176 1.00 0.00 H new ATOM 1648 N GLU A 334 -4.231 -5.473 5.450 1.00 0.00 N ATOM 1649 CA GLU A 334 -3.792 -6.850 5.320 1.00 0.00 C ATOM 1650 C GLU A 334 -2.284 -6.935 5.089 1.00 0.00 C ATOM 1651 O GLU A 334 -1.686 -6.059 4.463 1.00 0.00 O ATOM 1652 CB GLU A 334 -4.525 -7.530 4.155 1.00 0.00 C ATOM 1653 CG GLU A 334 -4.253 -6.907 2.785 1.00 0.00 C ATOM 1654 CD GLU A 334 -5.047 -5.635 2.510 1.00 0.00 C ATOM 1655 OE1 GLU A 334 -4.673 -4.566 3.036 1.00 0.00 O ATOM 1656 OE2 GLU A 334 -6.034 -5.700 1.743 1.00 0.00 O1- ATOM 0 H GLU A 334 -4.198 -4.946 4.577 1.00 0.00 H new ATOM 0 HA GLU A 334 -4.027 -7.362 6.253 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -4.238 -8.581 4.126 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -5.597 -7.498 4.348 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -3.189 -6.683 2.705 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -4.483 -7.640 2.012 1.00 0.00 H new ATOM 1663 N ALA A 335 -1.671 -7.980 5.627 1.00 0.00 N ATOM 1664 CA ALA A 335 -0.263 -8.252 5.388 1.00 0.00 C ATOM 1665 C ALA A 335 -0.096 -9.335 4.317 1.00 0.00 C ATOM 1666 O ALA A 335 -1.001 -10.145 4.102 1.00 0.00 O ATOM 1667 CB ALA A 335 0.420 -8.675 6.681 1.00 0.00 C ATOM 0 H ALA A 335 -2.131 -8.657 6.236 1.00 0.00 H new ATOM 0 HA ALA A 335 0.208 -7.338 5.027 1.00 0.00 H new ATOM 0 HB1 ALA A 335 1.474 -8.875 6.487 1.00 0.00 H new ATOM 0 HB2 ALA A 335 0.332 -7.876 7.417 1.00 0.00 H new ATOM 0 HB3 ALA A 335 -0.056 -9.577 7.066 1.00 0.00 H new ATOM 1673 N GLY A 336 1.056 -9.357 3.649 1.00 0.00 N ATOM 1674 CA GLY A 336 1.342 -10.424 2.698 1.00 0.00 C ATOM 1675 C GLY A 336 1.268 -9.979 1.250 1.00 0.00 C ATOM 1676 O GLY A 336 1.315 -10.804 0.338 1.00 0.00 O ATOM 0 H GLY A 336 1.794 -8.660 3.747 1.00 0.00 H new ATOM 0 HA2 GLY A 336 2.337 -10.821 2.898 1.00 0.00 H new ATOM 0 HA3 GLY A 336 0.636 -11.240 2.856 1.00 0.00 H new ATOM 1680 N ASP A 337 1.142 -8.680 1.042 1.00 0.00 N ATOM 1681 CA ASP A 337 1.089 -8.106 -0.306 1.00 0.00 C ATOM 1682 C ASP A 337 2.428 -8.299 -1.036 1.00 0.00 C ATOM 1683 O ASP A 337 3.487 -8.380 -0.404 1.00 0.00 O ATOM 1684 CB ASP A 337 0.739 -6.612 -0.209 1.00 0.00 C ATOM 1685 CG ASP A 337 0.536 -5.958 -1.558 1.00 0.00 C ATOM 1686 OD1 ASP A 337 1.529 -5.772 -2.285 1.00 0.00 O ATOM 1687 OD2 ASP A 337 -0.619 -5.623 -1.890 1.00 0.00 O1- ATOM 0 H ASP A 337 1.073 -7.992 1.792 1.00 0.00 H new ATOM 0 HA ASP A 337 0.319 -8.621 -0.881 1.00 0.00 H new ATOM 0 HB2 ASP A 337 -0.168 -6.496 0.384 1.00 0.00 H new ATOM 0 HB3 ASP A 337 1.536 -6.093 0.323 1.00 0.00 H new ATOM 1692 N ALA A 338 2.371 -8.404 -2.362 1.00 0.00 N ATOM 1693 CA ALA A 338 3.565 -8.513 -3.189 1.00 0.00 C ATOM 1694 C ALA A 338 3.914 -7.146 -3.769 1.00 0.00 C ATOM 1695 O ALA A 338 3.188 -6.615 -4.611 1.00 0.00 O ATOM 1696 CB ALA A 338 3.345 -9.522 -4.310 1.00 0.00 C ATOM 0 H ALA A 338 1.498 -8.416 -2.889 1.00 0.00 H new ATOM 0 HA ALA A 338 4.393 -8.861 -2.572 1.00 0.00 H new ATOM 0 HB1 ALA A 338 4.246 -9.592 -4.919 1.00 0.00 H new ATOM 0 HB2 ALA A 338 3.120 -10.499 -3.881 1.00 0.00 H new ATOM 0 HB3 ALA A 338 2.511 -9.198 -4.932 1.00 0.00 H new ATOM 1702 N VAL A 339 5.032 -6.593 -3.331 1.00 0.00 N ATOM 1703 CA VAL A 339 5.385 -5.218 -3.634 1.00 0.00 C ATOM 1704 C VAL A 339 6.338 -5.130 -4.824 1.00 0.00 C ATOM 1705 O VAL A 339 7.125 -6.039 -5.083 1.00 0.00 O ATOM 1706 CB VAL A 339 6.022 -4.555 -2.381 1.00 0.00 C ATOM 1707 CG1 VAL A 339 6.615 -3.189 -2.702 1.00 0.00 C ATOM 1708 CG2 VAL A 339 4.977 -4.414 -1.293 1.00 0.00 C ATOM 0 H VAL A 339 5.718 -7.083 -2.757 1.00 0.00 H new ATOM 0 HA VAL A 339 4.474 -4.685 -3.906 1.00 0.00 H new ATOM 0 HB VAL A 339 6.833 -5.198 -2.040 1.00 0.00 H new ATOM 0 HG11 VAL A 339 7.050 -2.760 -1.799 1.00 0.00 H new ATOM 0 HG12 VAL A 339 7.389 -3.298 -3.462 1.00 0.00 H new ATOM 0 HG13 VAL A 339 5.831 -2.530 -3.075 1.00 0.00 H new ATOM 0 HG21 VAL A 339 5.426 -3.949 -0.415 1.00 0.00 H new ATOM 0 HG22 VAL A 339 4.158 -3.792 -1.654 1.00 0.00 H new ATOM 0 HG23 VAL A 339 4.595 -5.399 -1.026 1.00 0.00 H new ATOM 1718 N SER A 340 6.227 -4.042 -5.565 1.00 0.00 N ATOM 1719 CA SER A 340 7.138 -3.741 -6.650 1.00 0.00 C ATOM 1720 C SER A 340 7.387 -2.239 -6.712 1.00 0.00 C ATOM 1721 O SER A 340 6.754 -1.474 -5.994 1.00 0.00 O ATOM 1722 CB SER A 340 6.574 -4.251 -7.975 1.00 0.00 C ATOM 1723 OG SER A 340 6.410 -5.660 -7.945 1.00 0.00 O ATOM 0 H SER A 340 5.499 -3.341 -5.429 1.00 0.00 H new ATOM 0 HA SER A 340 8.087 -4.246 -6.469 1.00 0.00 H new ATOM 0 HB2 SER A 340 5.615 -3.773 -8.175 1.00 0.00 H new ATOM 0 HB3 SER A 340 7.243 -3.976 -8.790 1.00 0.00 H new ATOM 0 HG SER A 340 6.046 -5.965 -8.802 1.00 0.00 H new ATOM 1729 N VAL A 341 8.328 -1.826 -7.539 1.00 0.00 N ATOM 1730 CA VAL A 341 8.673 -0.417 -7.676 1.00 0.00 C ATOM 1731 C VAL A 341 8.427 0.031 -9.114 1.00 0.00 C ATOM 1732 O VAL A 341 8.678 -0.727 -10.050 1.00 0.00 O ATOM 1733 CB VAL A 341 10.154 -0.172 -7.299 1.00 0.00 C ATOM 1734 CG1 VAL A 341 10.476 1.314 -7.273 1.00 0.00 C ATOM 1735 CG2 VAL A 341 10.489 -0.812 -5.958 1.00 0.00 C ATOM 0 H VAL A 341 8.874 -2.450 -8.133 1.00 0.00 H new ATOM 0 HA VAL A 341 8.046 0.161 -6.997 1.00 0.00 H new ATOM 0 HB VAL A 341 10.770 -0.640 -8.067 1.00 0.00 H new ATOM 0 HG11 VAL A 341 11.523 1.455 -7.005 1.00 0.00 H new ATOM 0 HG12 VAL A 341 10.293 1.743 -8.258 1.00 0.00 H new ATOM 0 HG13 VAL A 341 9.843 1.811 -6.537 1.00 0.00 H new ATOM 0 HG21 VAL A 341 11.535 -0.625 -5.717 1.00 0.00 H new ATOM 0 HG22 VAL A 341 9.855 -0.383 -5.182 1.00 0.00 H new ATOM 0 HG23 VAL A 341 10.316 -1.887 -6.014 1.00 0.00 H new ATOM 1745 N VAL A 342 7.929 1.257 -9.291 1.00 0.00 N ATOM 1746 CA VAL A 342 7.629 1.772 -10.628 1.00 0.00 C ATOM 1747 C VAL A 342 8.918 2.124 -11.369 1.00 0.00 C ATOM 1748 O VAL A 342 8.980 2.070 -12.596 1.00 0.00 O ATOM 1749 CB VAL A 342 6.708 3.022 -10.578 1.00 0.00 C ATOM 1750 CG1 VAL A 342 7.444 4.216 -9.980 1.00 0.00 C ATOM 1751 CG2 VAL A 342 6.176 3.371 -11.967 1.00 0.00 C ATOM 0 H VAL A 342 7.726 1.907 -8.531 1.00 0.00 H new ATOM 0 HA VAL A 342 7.101 0.981 -11.161 1.00 0.00 H new ATOM 0 HB VAL A 342 5.860 2.781 -9.938 1.00 0.00 H new ATOM 0 HG11 VAL A 342 6.778 5.079 -9.956 1.00 0.00 H new ATOM 0 HG12 VAL A 342 7.764 3.976 -8.966 1.00 0.00 H new ATOM 0 HG13 VAL A 342 8.317 4.448 -10.590 1.00 0.00 H new ATOM 0 HG21 VAL A 342 5.535 4.250 -11.901 1.00 0.00 H new ATOM 0 HG22 VAL A 342 7.012 3.581 -12.634 1.00 0.00 H new ATOM 0 HG23 VAL A 342 5.602 2.531 -12.358 1.00 0.00 H new