USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 559 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 246 GLN : amide:sc= 1.09 X(o=2.1,f=2.2) USER MOD Set 1.2: A 314 SER OG : rot 71:sc= 1.03 USER MOD Set 2.1: A 250 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 310 THR OG1 : rot 180:sc= -1.87! USER MOD Set 3.1: A 267 GLN : amide:sc= 0.938 K(o=1.8,f=0) USER MOD Set 3.2: A 296 THR OG1 : rot -175:sc= 0.817 USER MOD Set 4.1: A 269 LYS NZ :NH3+ -157:sc= 1.16 (180deg=-0.286) USER MOD Set 4.2: A 340 SER OG : rot 38:sc= 2.16 USER MOD Set 5.1: A 248 THR OG1 : rot 180:sc= 0.959 USER MOD Set 5.2: A 312 THR OG1 : rot -131:sc= 0.822 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 232 THR OG1 : rot -60:sc= 0.942 USER MOD Single : A 233 GLN : amide:sc= 0 K(o=0,f=-0.64) 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= -2.3! C(o=-2.3!,f=-3.3!) USER MOD Single : A 242 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0343) 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= -0.0171 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0.00198 USER MOD Single : A 257 SER OG : rot -29:sc= 0.824 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 271 THR OG1 : rot 49:sc= 1.16 USER MOD Single : A 272 ASN : amide:sc= -0.487 K(o=-0.49,f=-6!) USER MOD Single : A 292 SER OG : rot 32:sc= -0.96 USER MOD Single : A 294 THR OG1 : rot 180:sc= 0 USER MOD Single : A 298 THR OG1 : rot -42:sc= 0.761 USER MOD Single : A 302 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 303 SER OG : rot -7:sc= 0.534 USER MOD Single : A 305 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 47 N GLY A 226 11.880 -3.765 -9.728 1.00 0.00 N ATOM 48 CA GLY A 226 11.744 -3.569 -8.300 1.00 0.00 C ATOM 49 C GLY A 226 10.780 -4.559 -7.685 1.00 0.00 C ATOM 50 O GLY A 226 9.619 -4.627 -8.085 1.00 0.00 O ATOM 0 HA2 GLY A 226 12.720 -3.669 -7.825 1.00 0.00 H new ATOM 0 HA3 GLY A 226 11.397 -2.554 -8.104 1.00 0.00 H new ATOM 54 N THR A 227 11.259 -5.333 -6.723 1.00 0.00 N ATOM 55 CA THR A 227 10.439 -6.344 -6.071 1.00 0.00 C ATOM 56 C THR A 227 10.642 -6.299 -4.560 1.00 0.00 C ATOM 57 O THR A 227 11.769 -6.182 -4.079 1.00 0.00 O ATOM 58 CB THR A 227 10.786 -7.753 -6.594 1.00 0.00 C ATOM 59 OG1 THR A 227 10.851 -7.734 -8.026 1.00 0.00 O ATOM 60 CG2 THR A 227 9.749 -8.777 -6.153 1.00 0.00 C ATOM 0 H THR A 227 12.216 -5.280 -6.375 1.00 0.00 H new ATOM 0 HA THR A 227 9.396 -6.129 -6.302 1.00 0.00 H new ATOM 0 HB THR A 227 11.752 -8.038 -6.178 1.00 0.00 H new ATOM 0 HG1 THR A 227 11.073 -8.630 -8.355 1.00 0.00 H new ATOM 0 HG21 THR A 227 10.022 -9.760 -6.537 1.00 0.00 H new ATOM 0 HG22 THR A 227 9.711 -8.811 -5.064 1.00 0.00 H new ATOM 0 HG23 THR A 227 8.771 -8.494 -6.541 1.00 0.00 H new ATOM 68 N LEU A 228 9.544 -6.381 -3.826 1.00 0.00 N ATOM 69 CA LEU A 228 9.572 -6.300 -2.378 1.00 0.00 C ATOM 70 C LEU A 228 8.459 -7.159 -1.778 1.00 0.00 C ATOM 71 O LEU A 228 7.640 -7.729 -2.501 1.00 0.00 O ATOM 72 CB LEU A 228 9.426 -4.836 -1.948 1.00 0.00 C ATOM 73 CG LEU A 228 10.726 -3.992 -2.011 1.00 0.00 C ATOM 74 CD1 LEU A 228 10.402 -2.526 -2.272 1.00 0.00 C ATOM 75 CD2 LEU A 228 11.534 -4.113 -0.727 1.00 0.00 C ATOM 0 H LEU A 228 8.611 -6.505 -4.218 1.00 0.00 H new ATOM 0 HA LEU A 228 10.525 -6.681 -2.010 1.00 0.00 H new ATOM 0 HB2 LEU A 228 8.674 -4.363 -2.580 1.00 0.00 H new ATOM 0 HB3 LEU A 228 9.046 -4.811 -0.927 1.00 0.00 H new ATOM 0 HG LEU A 228 11.325 -4.382 -2.833 1.00 0.00 H new ATOM 0 HD11 LEU A 228 11.327 -1.951 -2.313 1.00 0.00 H new ATOM 0 HD12 LEU A 228 9.875 -2.433 -3.222 1.00 0.00 H new ATOM 0 HD13 LEU A 228 9.772 -2.144 -1.469 1.00 0.00 H new ATOM 0 HD21 LEU A 228 12.438 -3.509 -0.807 1.00 0.00 H new ATOM 0 HD22 LEU A 228 10.936 -3.762 0.114 1.00 0.00 H new ATOM 0 HD23 LEU A 228 11.808 -5.156 -0.566 1.00 0.00 H new ATOM 87 N THR A 229 8.445 -7.257 -0.462 1.00 0.00 N ATOM 88 CA THR A 229 7.492 -8.090 0.252 1.00 0.00 C ATOM 89 C THR A 229 6.913 -7.311 1.439 1.00 0.00 C ATOM 90 O THR A 229 7.485 -6.303 1.850 1.00 0.00 O ATOM 91 CB THR A 229 8.215 -9.358 0.746 1.00 0.00 C ATOM 92 OG1 THR A 229 8.831 -10.028 -0.362 1.00 0.00 O ATOM 93 CG2 THR A 229 7.285 -10.329 1.467 1.00 0.00 C ATOM 0 H THR A 229 9.096 -6.760 0.145 1.00 0.00 H new ATOM 0 HA THR A 229 6.673 -8.373 -0.409 1.00 0.00 H new ATOM 0 HB THR A 229 8.967 -9.033 1.465 1.00 0.00 H new ATOM 0 HG1 THR A 229 9.291 -10.833 -0.043 1.00 0.00 H new ATOM 0 HG21 THR A 229 7.851 -11.202 1.791 1.00 0.00 H new ATOM 0 HG22 THR A 229 6.848 -9.837 2.336 1.00 0.00 H new ATOM 0 HG23 THR A 229 6.491 -10.643 0.790 1.00 0.00 H new ATOM 101 N VAL A 230 5.785 -7.760 1.975 1.00 0.00 N ATOM 102 CA VAL A 230 5.155 -7.093 3.113 1.00 0.00 C ATOM 103 C VAL A 230 5.141 -8.015 4.328 1.00 0.00 C ATOM 104 O VAL A 230 4.897 -9.215 4.196 1.00 0.00 O ATOM 105 CB VAL A 230 3.706 -6.667 2.795 1.00 0.00 C ATOM 106 CG1 VAL A 230 3.174 -5.735 3.877 1.00 0.00 C ATOM 107 CG2 VAL A 230 3.627 -5.993 1.436 1.00 0.00 C ATOM 0 H VAL A 230 5.285 -8.584 1.641 1.00 0.00 H new ATOM 0 HA VAL A 230 5.743 -6.200 3.327 1.00 0.00 H new ATOM 0 HB VAL A 230 3.087 -7.564 2.770 1.00 0.00 H new ATOM 0 HG11 VAL A 230 2.151 -5.445 3.637 1.00 0.00 H new ATOM 0 HG12 VAL A 230 3.189 -6.248 4.839 1.00 0.00 H new ATOM 0 HG13 VAL A 230 3.801 -4.845 3.931 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.596 -5.702 1.234 1.00 0.00 H new ATOM 0 HG22 VAL A 230 4.262 -5.107 1.432 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.966 -6.686 0.666 1.00 0.00 H new ATOM 117 N LYS A 231 5.407 -7.461 5.508 1.00 0.00 N ATOM 118 CA LYS A 231 5.448 -8.263 6.725 1.00 0.00 C ATOM 119 C LYS A 231 4.416 -7.775 7.741 1.00 0.00 C ATOM 120 O LYS A 231 4.270 -8.346 8.822 1.00 0.00 O ATOM 121 CB LYS A 231 6.848 -8.214 7.332 1.00 0.00 C ATOM 122 CG LYS A 231 7.250 -9.497 8.041 1.00 0.00 C ATOM 123 CD LYS A 231 8.671 -9.409 8.564 1.00 0.00 C ATOM 124 CE LYS A 231 9.242 -10.781 8.867 1.00 0.00 C ATOM 125 NZ LYS A 231 10.673 -10.709 9.263 1.00 0.00 N1+ ATOM 0 H LYS A 231 5.596 -6.468 5.646 1.00 0.00 H new ATOM 0 HA LYS A 231 5.204 -9.293 6.465 1.00 0.00 H new ATOM 0 HB2 LYS A 231 7.570 -8.004 6.543 1.00 0.00 H new ATOM 0 HB3 LYS A 231 6.899 -7.387 8.040 1.00 0.00 H new ATOM 0 HG2 LYS A 231 6.566 -9.689 8.868 1.00 0.00 H new ATOM 0 HG3 LYS A 231 7.164 -10.339 7.354 1.00 0.00 H new ATOM 0 HD2 LYS A 231 9.299 -8.907 7.828 1.00 0.00 H new ATOM 0 HD3 LYS A 231 8.689 -8.799 9.467 1.00 0.00 H new ATOM 0 HE2 LYS A 231 8.666 -11.245 9.668 1.00 0.00 H new ATOM 0 HE3 LYS A 231 9.140 -11.419 7.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 11.027 -11.667 9.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 11.227 -10.289 8.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 10.768 -10.121 10.115 1.00 0.00 H new ATOM 139 N THR A 232 3.697 -6.719 7.383 1.00 0.00 N ATOM 140 CA THR A 232 2.662 -6.152 8.242 1.00 0.00 C ATOM 141 C THR A 232 1.452 -5.758 7.406 1.00 0.00 C ATOM 142 O THR A 232 1.356 -6.130 6.241 1.00 0.00 O ATOM 143 CB THR A 232 3.173 -4.925 9.015 1.00 0.00 C ATOM 144 OG1 THR A 232 3.837 -4.041 8.118 1.00 0.00 O ATOM 145 CG2 THR A 232 4.111 -5.331 10.143 1.00 0.00 C ATOM 0 H THR A 232 3.813 -6.232 6.494 1.00 0.00 H new ATOM 0 HA THR A 232 2.380 -6.915 8.967 1.00 0.00 H new ATOM 0 HB THR A 232 2.317 -4.419 9.462 1.00 0.00 H new ATOM 0 HG1 THR A 232 4.596 -4.503 7.705 1.00 0.00 H new ATOM 0 HG21 THR A 232 4.454 -4.440 10.669 1.00 0.00 H new ATOM 0 HG22 THR A 232 3.583 -5.983 10.839 1.00 0.00 H new ATOM 0 HG23 THR A 232 4.969 -5.861 9.730 1.00 0.00 H new ATOM 153 N GLN A 233 0.531 -5.015 7.997 1.00 0.00 N ATOM 154 CA GLN A 233 -0.717 -4.686 7.327 1.00 0.00 C ATOM 155 C GLN A 233 -0.786 -3.191 7.048 1.00 0.00 C ATOM 156 O GLN A 233 -1.048 -2.400 7.958 1.00 0.00 O ATOM 157 CB GLN A 233 -1.914 -5.112 8.183 1.00 0.00 C ATOM 158 CG GLN A 233 -1.839 -6.544 8.689 1.00 0.00 C ATOM 159 CD GLN A 233 -3.072 -6.943 9.481 1.00 0.00 C ATOM 160 OE1 GLN A 233 -3.730 -6.106 10.096 1.00 0.00 O ATOM 161 NE2 GLN A 233 -3.387 -8.229 9.485 1.00 0.00 N ATOM 0 H GLN A 233 0.623 -4.629 8.937 1.00 0.00 H new ATOM 0 HA GLN A 233 -0.753 -5.226 6.381 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.993 -4.440 9.038 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.826 -4.992 7.598 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -1.720 -7.220 7.842 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -0.955 -6.659 9.316 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -2.818 -8.895 8.963 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -4.199 -8.554 10.010 1.00 0.00 H new ATOM 170 N PRO A 234 -0.537 -2.782 5.795 1.00 0.00 N ATOM 171 CA PRO A 234 -0.591 -1.373 5.410 1.00 0.00 C ATOM 172 C PRO A 234 -2.006 -0.810 5.484 1.00 0.00 C ATOM 173 O PRO A 234 -2.852 -1.090 4.635 1.00 0.00 O ATOM 174 CB PRO A 234 -0.075 -1.366 3.968 1.00 0.00 C ATOM 175 CG PRO A 234 -0.295 -2.752 3.468 1.00 0.00 C ATOM 176 CD PRO A 234 -0.175 -3.654 4.664 1.00 0.00 C ATOM 0 HA PRO A 234 -0.002 -0.746 6.079 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -0.613 -0.638 3.361 1.00 0.00 H new ATOM 0 HB3 PRO A 234 0.980 -1.096 3.929 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -1.277 -2.847 3.006 1.00 0.00 H new ATOM 0 HG3 PRO A 234 0.442 -3.013 2.708 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -0.844 -4.511 4.588 1.00 0.00 H new ATOM 0 HD3 PRO A 234 0.836 -4.048 4.769 1.00 0.00 H new ATOM 184 N THR A 235 -2.247 -0.009 6.502 1.00 0.00 N ATOM 185 CA THR A 235 -3.564 0.552 6.729 1.00 0.00 C ATOM 186 C THR A 235 -3.539 2.062 6.522 1.00 0.00 C ATOM 187 O THR A 235 -2.547 2.726 6.829 1.00 0.00 O ATOM 188 CB THR A 235 -4.070 0.196 8.141 1.00 0.00 C ATOM 189 OG1 THR A 235 -5.461 0.516 8.268 1.00 0.00 O ATOM 190 CG2 THR A 235 -3.275 0.924 9.224 1.00 0.00 C ATOM 0 H THR A 235 -1.545 0.269 7.188 1.00 0.00 H new ATOM 0 HA THR A 235 -4.256 0.120 6.006 1.00 0.00 H new ATOM 0 HB THR A 235 -3.929 -0.876 8.278 1.00 0.00 H new ATOM 0 HG1 THR A 235 -5.769 0.283 9.169 1.00 0.00 H new ATOM 0 HG21 THR A 235 -3.660 0.648 10.206 1.00 0.00 H new ATOM 0 HG22 THR A 235 -2.224 0.643 9.155 1.00 0.00 H new ATOM 0 HG23 THR A 235 -3.373 2.001 9.085 1.00 0.00 H new ATOM 198 N VAL A 236 -4.629 2.593 5.985 1.00 0.00 N ATOM 199 CA VAL A 236 -4.676 3.986 5.573 1.00 0.00 C ATOM 200 C VAL A 236 -4.931 4.921 6.748 1.00 0.00 C ATOM 201 O VAL A 236 -5.929 4.795 7.459 1.00 0.00 O ATOM 202 CB VAL A 236 -5.746 4.216 4.489 1.00 0.00 C ATOM 203 CG1 VAL A 236 -5.676 5.641 3.961 1.00 0.00 C ATOM 204 CG2 VAL A 236 -5.575 3.213 3.358 1.00 0.00 C ATOM 0 H VAL A 236 -5.494 2.077 5.825 1.00 0.00 H new ATOM 0 HA VAL A 236 -3.695 4.217 5.158 1.00 0.00 H new ATOM 0 HB VAL A 236 -6.730 4.068 4.935 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -6.440 5.784 3.196 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -5.846 6.341 4.779 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -4.692 5.821 3.529 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -6.338 3.387 2.599 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -4.587 3.331 2.913 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -5.678 2.201 3.750 1.00 0.00 H new ATOM 214 N THR A 237 -4.016 5.854 6.930 1.00 0.00 N ATOM 215 CA THR A 237 -4.112 6.863 7.964 1.00 0.00 C ATOM 216 C THR A 237 -4.667 8.161 7.381 1.00 0.00 C ATOM 217 O THR A 237 -4.124 8.702 6.414 1.00 0.00 O ATOM 218 CB THR A 237 -2.728 7.133 8.582 1.00 0.00 C ATOM 219 OG1 THR A 237 -2.209 5.928 9.158 1.00 0.00 O ATOM 220 CG2 THR A 237 -2.803 8.225 9.638 1.00 0.00 C ATOM 0 H THR A 237 -3.176 5.932 6.357 1.00 0.00 H new ATOM 0 HA THR A 237 -4.784 6.496 8.740 1.00 0.00 H new ATOM 0 HB THR A 237 -2.060 7.473 7.790 1.00 0.00 H new ATOM 0 HG1 THR A 237 -1.328 6.105 9.548 1.00 0.00 H new ATOM 0 HG21 THR A 237 -1.811 8.394 10.057 1.00 0.00 H new ATOM 0 HG22 THR A 237 -3.167 9.146 9.183 1.00 0.00 H new ATOM 0 HG23 THR A 237 -3.485 7.918 10.431 1.00 0.00 H new ATOM 228 N TYR A 238 -5.743 8.654 7.965 1.00 0.00 N ATOM 229 CA TYR A 238 -6.377 9.865 7.479 1.00 0.00 C ATOM 230 C TYR A 238 -5.859 11.087 8.222 1.00 0.00 C ATOM 231 O TYR A 238 -5.907 11.154 9.449 1.00 0.00 O ATOM 232 CB TYR A 238 -7.908 9.756 7.616 1.00 0.00 C ATOM 233 CG TYR A 238 -8.589 9.274 6.363 1.00 0.00 C ATOM 234 CD1 TYR A 238 -9.726 9.907 5.897 1.00 0.00 C ATOM 235 CD2 TYR A 238 -8.094 8.195 5.644 1.00 0.00 C ATOM 236 CE1 TYR A 238 -10.356 9.481 4.748 1.00 0.00 C ATOM 237 CE2 TYR A 238 -8.716 7.764 4.495 1.00 0.00 C ATOM 238 CZ TYR A 238 -9.848 8.411 4.049 1.00 0.00 C ATOM 239 OH TYR A 238 -10.478 7.982 2.902 1.00 0.00 O ATOM 0 H TYR A 238 -6.196 8.234 8.777 1.00 0.00 H new ATOM 0 HA TYR A 238 -6.127 9.983 6.425 1.00 0.00 H new ATOM 0 HB2 TYR A 238 -8.144 9.075 8.434 1.00 0.00 H new ATOM 0 HB3 TYR A 238 -8.311 10.732 7.887 1.00 0.00 H new ATOM 0 HD1 TYR A 238 -10.127 10.749 6.442 1.00 0.00 H new ATOM 0 HD2 TYR A 238 -7.207 7.686 5.992 1.00 0.00 H new ATOM 0 HE1 TYR A 238 -11.245 9.985 4.398 1.00 0.00 H new ATOM 0 HE2 TYR A 238 -8.319 6.923 3.946 1.00 0.00 H new ATOM 0 HH TYR A 238 -9.992 7.217 2.528 1.00 0.00 H new ATOM 249 N ASN A 239 -5.350 12.040 7.462 1.00 0.00 N ATOM 250 CA ASN A 239 -4.869 13.295 8.007 1.00 0.00 C ATOM 251 C ASN A 239 -5.564 14.411 7.238 1.00 0.00 C ATOM 252 O ASN A 239 -4.955 15.124 6.448 1.00 0.00 O ATOM 253 CB ASN A 239 -3.344 13.374 7.860 1.00 0.00 C ATOM 254 CG ASN A 239 -2.675 14.139 8.984 1.00 0.00 C ATOM 255 OD1 ASN A 239 -3.194 14.216 10.098 1.00 0.00 O ATOM 256 ND2 ASN A 239 -1.501 14.685 8.705 1.00 0.00 N ATOM 0 H ASN A 239 -5.259 11.965 6.449 1.00 0.00 H new ATOM 0 HA ASN A 239 -5.093 13.383 9.070 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -2.936 12.364 7.824 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -3.101 13.850 6.910 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -0.991 15.193 9.427 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -1.107 14.597 7.768 1.00 0.00 H new ATOM 263 N ALA A 240 -6.854 14.547 7.497 1.00 0.00 N ATOM 264 CA ALA A 240 -7.764 15.266 6.612 1.00 0.00 C ATOM 265 C ALA A 240 -7.776 16.752 6.906 1.00 0.00 C ATOM 266 O ALA A 240 -8.019 17.565 6.017 1.00 0.00 O ATOM 267 CB ALA A 240 -9.164 14.687 6.722 1.00 0.00 C ATOM 0 H ALA A 240 -7.303 14.162 8.328 1.00 0.00 H new ATOM 0 HA ALA A 240 -7.406 15.141 5.590 1.00 0.00 H new ATOM 0 HB1 ALA A 240 -9.836 15.231 6.058 1.00 0.00 H new ATOM 0 HB2 ALA A 240 -9.146 13.635 6.438 1.00 0.00 H new ATOM 0 HB3 ALA A 240 -9.516 14.780 7.749 1.00 0.00 H new ATOM 273 N VAL A 241 -7.503 17.107 8.149 1.00 0.00 N ATOM 274 CA VAL A 241 -7.330 18.505 8.515 1.00 0.00 C ATOM 275 C VAL A 241 -6.074 19.029 7.830 1.00 0.00 C ATOM 276 O VAL A 241 -5.912 20.227 7.595 1.00 0.00 O ATOM 277 CB VAL A 241 -7.208 18.675 10.050 1.00 0.00 C ATOM 278 CG1 VAL A 241 -7.064 20.140 10.439 1.00 0.00 C ATOM 279 CG2 VAL A 241 -8.405 18.050 10.758 1.00 0.00 C ATOM 0 H VAL A 241 -7.396 16.450 8.922 1.00 0.00 H new ATOM 0 HA VAL A 241 -8.204 19.070 8.192 1.00 0.00 H new ATOM 0 HB VAL A 241 -6.304 18.155 10.368 1.00 0.00 H new ATOM 0 HG11 VAL A 241 -6.981 20.222 11.523 1.00 0.00 H new ATOM 0 HG12 VAL A 241 -6.169 20.554 9.974 1.00 0.00 H new ATOM 0 HG13 VAL A 241 -7.939 20.694 10.099 1.00 0.00 H new ATOM 0 HG21 VAL A 241 -8.300 18.180 11.835 1.00 0.00 H new ATOM 0 HG22 VAL A 241 -9.321 18.536 10.422 1.00 0.00 H new ATOM 0 HG23 VAL A 241 -8.451 16.986 10.524 1.00 0.00 H new ATOM 289 N LYS A 242 -5.197 18.094 7.494 1.00 0.00 N ATOM 290 CA LYS A 242 -3.948 18.404 6.823 1.00 0.00 C ATOM 291 C LYS A 242 -4.064 18.104 5.335 1.00 0.00 C ATOM 292 O LYS A 242 -3.129 18.306 4.560 1.00 0.00 O ATOM 293 CB LYS A 242 -2.826 17.576 7.442 1.00 0.00 C ATOM 294 CG LYS A 242 -2.940 17.482 8.951 1.00 0.00 C ATOM 295 CD LYS A 242 -2.615 18.800 9.622 1.00 0.00 C ATOM 296 CE LYS A 242 -3.176 18.852 11.031 1.00 0.00 C ATOM 297 NZ LYS A 242 -2.608 17.789 11.902 1.00 0.00 N1+ ATOM 0 H LYS A 242 -5.333 17.100 7.680 1.00 0.00 H new ATOM 0 HA LYS A 242 -3.724 19.464 6.945 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -2.842 16.573 7.016 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -1.865 18.019 7.180 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -3.951 17.176 9.221 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -2.264 16.710 9.319 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -1.534 18.939 9.653 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -3.025 19.621 9.034 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -2.966 19.828 11.468 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -4.260 18.747 10.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -2.955 17.915 12.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -2.902 16.856 11.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -1.570 17.851 11.894 1.00 0.00 H new ATOM 311 N ASP A 243 -5.250 17.618 4.971 1.00 0.00 N ATOM 312 CA ASP A 243 -5.581 17.195 3.607 1.00 0.00 C ATOM 313 C ASP A 243 -4.531 16.235 3.054 1.00 0.00 C ATOM 314 O ASP A 243 -3.973 16.441 1.980 1.00 0.00 O ATOM 315 CB ASP A 243 -5.759 18.407 2.680 1.00 0.00 C ATOM 316 CG ASP A 243 -6.347 18.028 1.330 1.00 0.00 C ATOM 317 OD1 ASP A 243 -5.603 18.019 0.323 1.00 0.00 O ATOM 318 OD2 ASP A 243 -7.558 17.728 1.268 1.00 0.00 O1- ATOM 0 H ASP A 243 -6.023 17.504 5.626 1.00 0.00 H new ATOM 0 HA ASP A 243 -6.530 16.661 3.649 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -6.408 19.137 3.163 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -4.793 18.890 2.529 1.00 0.00 H new ATOM 323 N SER A 244 -4.253 15.187 3.807 1.00 0.00 N ATOM 324 CA SER A 244 -3.316 14.171 3.374 1.00 0.00 C ATOM 325 C SER A 244 -3.819 12.785 3.759 1.00 0.00 C ATOM 326 O SER A 244 -4.201 12.548 4.903 1.00 0.00 O ATOM 327 CB SER A 244 -1.941 14.425 3.995 1.00 0.00 C ATOM 328 OG SER A 244 -1.482 15.735 3.700 1.00 0.00 O ATOM 0 H SER A 244 -4.665 15.018 4.725 1.00 0.00 H new ATOM 0 HA SER A 244 -3.227 14.219 2.289 1.00 0.00 H new ATOM 0 HB2 SER A 244 -1.996 14.290 5.075 1.00 0.00 H new ATOM 0 HB3 SER A 244 -1.227 13.693 3.618 1.00 0.00 H new ATOM 0 HG SER A 244 -0.602 15.873 4.109 1.00 0.00 H new ATOM 334 N TYR A 245 -3.850 11.880 2.797 1.00 0.00 N ATOM 335 CA TYR A 245 -4.198 10.496 3.074 1.00 0.00 C ATOM 336 C TYR A 245 -2.950 9.644 2.927 1.00 0.00 C ATOM 337 O TYR A 245 -2.412 9.485 1.831 1.00 0.00 O ATOM 338 CB TYR A 245 -5.313 9.997 2.141 1.00 0.00 C ATOM 339 CG TYR A 245 -6.553 10.871 2.130 1.00 0.00 C ATOM 340 CD1 TYR A 245 -7.008 11.447 0.948 1.00 0.00 C ATOM 341 CD2 TYR A 245 -7.266 11.130 3.298 1.00 0.00 C ATOM 342 CE1 TYR A 245 -8.130 12.252 0.932 1.00 0.00 C ATOM 343 CE2 TYR A 245 -8.390 11.933 3.285 1.00 0.00 C ATOM 344 CZ TYR A 245 -8.817 12.491 2.103 1.00 0.00 C ATOM 345 OH TYR A 245 -9.934 13.296 2.094 1.00 0.00 O ATOM 0 H TYR A 245 -3.639 12.077 1.819 1.00 0.00 H new ATOM 0 HA TYR A 245 -4.580 10.421 4.092 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -4.920 9.931 1.127 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -5.596 8.988 2.439 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -6.475 11.261 0.027 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -6.935 10.696 4.230 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -8.468 12.693 0.006 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -8.932 12.122 4.200 1.00 0.00 H new ATOM 0 HH TYR A 245 -10.299 13.359 3.001 1.00 0.00 H new ATOM 355 N GLN A 246 -2.472 9.136 4.044 1.00 0.00 N ATOM 356 CA GLN A 246 -1.220 8.408 4.082 1.00 0.00 C ATOM 357 C GLN A 246 -1.486 6.985 4.541 1.00 0.00 C ATOM 358 O GLN A 246 -2.619 6.647 4.857 1.00 0.00 O ATOM 359 CB GLN A 246 -0.258 9.099 5.053 1.00 0.00 C ATOM 360 CG GLN A 246 -0.138 10.601 4.842 1.00 0.00 C ATOM 361 CD GLN A 246 0.611 11.291 5.967 1.00 0.00 C ATOM 362 OE1 GLN A 246 0.010 11.725 6.949 1.00 0.00 O ATOM 363 NE2 GLN A 246 1.923 11.400 5.835 1.00 0.00 N ATOM 0 H GLN A 246 -2.938 9.215 4.948 1.00 0.00 H new ATOM 0 HA GLN A 246 -0.771 8.390 3.089 1.00 0.00 H new ATOM 0 HB2 GLN A 246 -0.591 8.911 6.074 1.00 0.00 H new ATOM 0 HB3 GLN A 246 0.729 8.648 4.952 1.00 0.00 H new ATOM 0 HG2 GLN A 246 0.374 10.792 3.899 1.00 0.00 H new ATOM 0 HG3 GLN A 246 -1.135 11.033 4.756 1.00 0.00 H new ATOM 0 HE21 GLN A 246 2.385 11.027 5.005 1.00 0.00 H new ATOM 0 HE22 GLN A 246 2.473 11.857 6.563 1.00 0.00 H new ATOM 372 N PHE A 247 -0.462 6.150 4.571 1.00 0.00 N ATOM 373 CA PHE A 247 -0.600 4.830 5.171 1.00 0.00 C ATOM 374 C PHE A 247 0.754 4.239 5.526 1.00 0.00 C ATOM 375 O PHE A 247 1.747 4.502 4.858 1.00 0.00 O ATOM 376 CB PHE A 247 -1.420 3.880 4.293 1.00 0.00 C ATOM 377 CG PHE A 247 -0.740 3.313 3.083 1.00 0.00 C ATOM 378 CD1 PHE A 247 -0.313 1.996 3.074 1.00 0.00 C ATOM 379 CD2 PHE A 247 -0.589 4.066 1.937 1.00 0.00 C ATOM 380 CE1 PHE A 247 0.251 1.444 1.944 1.00 0.00 C ATOM 381 CE2 PHE A 247 -0.018 3.525 0.808 1.00 0.00 C ATOM 382 CZ PHE A 247 0.398 2.209 0.807 1.00 0.00 C ATOM 0 H PHE A 247 0.463 6.356 4.193 1.00 0.00 H new ATOM 0 HA PHE A 247 -1.157 4.957 6.100 1.00 0.00 H new ATOM 0 HB2 PHE A 247 -1.755 3.049 4.914 1.00 0.00 H new ATOM 0 HB3 PHE A 247 -2.313 4.410 3.962 1.00 0.00 H new ATOM 0 HD1 PHE A 247 -0.423 1.394 3.964 1.00 0.00 H new ATOM 0 HD2 PHE A 247 -0.923 5.093 1.926 1.00 0.00 H new ATOM 0 HE1 PHE A 247 0.577 0.414 1.949 1.00 0.00 H new ATOM 0 HE2 PHE A 247 0.105 4.130 -0.078 1.00 0.00 H new ATOM 0 HZ PHE A 247 0.837 1.780 -0.082 1.00 0.00 H new ATOM 392 N THR A 248 0.781 3.435 6.575 1.00 0.00 N ATOM 393 CA THR A 248 2.028 2.995 7.172 1.00 0.00 C ATOM 394 C THR A 248 2.233 1.506 6.956 1.00 0.00 C ATOM 395 O THR A 248 1.267 0.738 6.950 1.00 0.00 O ATOM 396 CB THR A 248 2.012 3.309 8.683 1.00 0.00 C ATOM 397 OG1 THR A 248 1.990 4.729 8.878 1.00 0.00 O ATOM 398 CG2 THR A 248 3.211 2.711 9.409 1.00 0.00 C ATOM 0 H THR A 248 -0.055 3.072 7.033 1.00 0.00 H new ATOM 0 HA THR A 248 2.852 3.526 6.695 1.00 0.00 H new ATOM 0 HB THR A 248 1.114 2.856 9.104 1.00 0.00 H new ATOM 0 HG1 THR A 248 1.979 4.927 9.838 1.00 0.00 H new ATOM 0 HG21 THR A 248 3.155 2.959 10.469 1.00 0.00 H new ATOM 0 HG22 THR A 248 3.206 1.628 9.289 1.00 0.00 H new ATOM 0 HG23 THR A 248 4.131 3.118 8.989 1.00 0.00 H new ATOM 406 N VAL A 249 3.482 1.096 6.769 1.00 0.00 N ATOM 407 CA VAL A 249 3.760 -0.314 6.526 1.00 0.00 C ATOM 408 C VAL A 249 5.178 -0.729 6.950 1.00 0.00 C ATOM 409 O VAL A 249 6.135 0.033 6.816 1.00 0.00 O ATOM 410 CB VAL A 249 3.563 -0.642 5.030 1.00 0.00 C ATOM 411 CG1 VAL A 249 4.667 -0.047 4.177 1.00 0.00 C ATOM 412 CG2 VAL A 249 3.436 -2.146 4.813 1.00 0.00 C ATOM 0 H VAL A 249 4.301 1.704 6.780 1.00 0.00 H new ATOM 0 HA VAL A 249 3.057 -0.878 7.138 1.00 0.00 H new ATOM 0 HB VAL A 249 2.629 -0.180 4.710 1.00 0.00 H new ATOM 0 HG11 VAL A 249 4.494 -0.299 3.131 1.00 0.00 H new ATOM 0 HG12 VAL A 249 4.673 1.037 4.293 1.00 0.00 H new ATOM 0 HG13 VAL A 249 5.629 -0.451 4.493 1.00 0.00 H new ATOM 0 HG21 VAL A 249 3.298 -2.350 3.751 1.00 0.00 H new ATOM 0 HG22 VAL A 249 4.341 -2.642 5.163 1.00 0.00 H new ATOM 0 HG23 VAL A 249 2.578 -2.523 5.369 1.00 0.00 H new ATOM 422 N THR A 250 5.287 -1.936 7.484 1.00 0.00 N ATOM 423 CA THR A 250 6.565 -2.598 7.675 1.00 0.00 C ATOM 424 C THR A 250 6.723 -3.669 6.600 1.00 0.00 C ATOM 425 O THR A 250 6.006 -4.680 6.599 1.00 0.00 O ATOM 426 CB THR A 250 6.661 -3.239 9.079 1.00 0.00 C ATOM 427 OG1 THR A 250 6.765 -2.213 10.073 1.00 0.00 O ATOM 428 CG2 THR A 250 7.852 -4.185 9.189 1.00 0.00 C ATOM 0 H THR A 250 4.487 -2.485 7.798 1.00 0.00 H new ATOM 0 HA THR A 250 7.363 -1.860 7.595 1.00 0.00 H new ATOM 0 HB THR A 250 5.755 -3.823 9.241 1.00 0.00 H new ATOM 0 HG1 THR A 250 6.824 -2.623 10.961 1.00 0.00 H new ATOM 0 HG21 THR A 250 7.884 -4.615 10.190 1.00 0.00 H new ATOM 0 HG22 THR A 250 7.751 -4.984 8.454 1.00 0.00 H new ATOM 0 HG23 THR A 250 8.773 -3.634 9.001 1.00 0.00 H new ATOM 436 N LEU A 251 7.628 -3.435 5.671 1.00 0.00 N ATOM 437 CA LEU A 251 7.808 -4.325 4.545 1.00 0.00 C ATOM 438 C LEU A 251 9.091 -5.117 4.719 1.00 0.00 C ATOM 439 O LEU A 251 9.884 -4.858 5.623 1.00 0.00 O ATOM 440 CB LEU A 251 7.879 -3.529 3.232 1.00 0.00 C ATOM 441 CG LEU A 251 6.877 -2.386 3.089 1.00 0.00 C ATOM 442 CD1 LEU A 251 7.604 -1.097 2.744 1.00 0.00 C ATOM 443 CD2 LEU A 251 5.846 -2.698 2.020 1.00 0.00 C ATOM 0 H LEU A 251 8.254 -2.629 5.676 1.00 0.00 H new ATOM 0 HA LEU A 251 6.956 -5.004 4.502 1.00 0.00 H new ATOM 0 HB2 LEU A 251 8.884 -3.120 3.132 1.00 0.00 H new ATOM 0 HB3 LEU A 251 7.733 -4.221 2.402 1.00 0.00 H new ATOM 0 HG LEU A 251 6.360 -2.266 4.041 1.00 0.00 H new ATOM 0 HD11 LEU A 251 6.881 -0.287 2.644 1.00 0.00 H new ATOM 0 HD12 LEU A 251 8.312 -0.855 3.537 1.00 0.00 H new ATOM 0 HD13 LEU A 251 8.141 -1.222 1.804 1.00 0.00 H new ATOM 0 HD21 LEU A 251 5.144 -1.868 1.938 1.00 0.00 H new ATOM 0 HD22 LEU A 251 6.347 -2.845 1.063 1.00 0.00 H new ATOM 0 HD23 LEU A 251 5.305 -3.605 2.290 1.00 0.00 H new ATOM 455 N THR A 252 9.284 -6.086 3.858 1.00 0.00 N ATOM 456 CA THR A 252 10.502 -6.850 3.836 1.00 0.00 C ATOM 457 C THR A 252 11.114 -6.822 2.434 1.00 0.00 C ATOM 458 O THR A 252 10.399 -6.907 1.434 1.00 0.00 O ATOM 459 CB THR A 252 10.224 -8.293 4.268 1.00 0.00 C ATOM 460 OG1 THR A 252 8.863 -8.644 3.958 1.00 0.00 O ATOM 461 CG2 THR A 252 10.480 -8.468 5.760 1.00 0.00 C ATOM 0 H THR A 252 8.600 -6.365 3.154 1.00 0.00 H new ATOM 0 HA THR A 252 11.212 -6.407 4.535 1.00 0.00 H new ATOM 0 HB THR A 252 10.899 -8.953 3.723 1.00 0.00 H new ATOM 0 HG1 THR A 252 8.692 -9.568 4.235 1.00 0.00 H new ATOM 0 HG21 THR A 252 10.276 -9.500 6.045 1.00 0.00 H new ATOM 0 HG22 THR A 252 11.520 -8.229 5.981 1.00 0.00 H new ATOM 0 HG23 THR A 252 9.827 -7.801 6.322 1.00 0.00 H new ATOM 469 N GLY A 253 12.428 -6.689 2.358 1.00 0.00 N ATOM 470 CA GLY A 253 13.089 -6.580 1.081 1.00 0.00 C ATOM 471 C GLY A 253 14.333 -7.429 1.014 1.00 0.00 C ATOM 472 O GLY A 253 14.372 -8.523 1.579 1.00 0.00 O ATOM 0 H GLY A 253 13.050 -6.655 3.165 1.00 0.00 H new ATOM 0 HA2 GLY A 253 12.402 -6.881 0.290 1.00 0.00 H new ATOM 0 HA3 GLY A 253 13.351 -5.538 0.896 1.00 0.00 H new ATOM 476 N ALA A 254 15.350 -6.928 0.336 1.00 0.00 N ATOM 477 CA ALA A 254 16.578 -7.680 0.159 1.00 0.00 C ATOM 478 C ALA A 254 17.680 -7.212 1.099 1.00 0.00 C ATOM 479 O ALA A 254 17.458 -6.367 1.965 1.00 0.00 O ATOM 480 CB ALA A 254 17.035 -7.612 -1.290 1.00 0.00 C ATOM 0 H ALA A 254 15.350 -6.006 -0.100 1.00 0.00 H new ATOM 0 HA ALA A 254 16.366 -8.718 0.413 1.00 0.00 H new ATOM 0 HB1 ALA A 254 17.957 -8.181 -1.408 1.00 0.00 H new ATOM 0 HB2 ALA A 254 16.264 -8.034 -1.935 1.00 0.00 H new ATOM 0 HB3 ALA A 254 17.212 -6.573 -1.567 1.00 0.00 H new ATOM 486 N THR A 255 18.862 -7.779 0.915 1.00 0.00 N ATOM 487 CA THR A 255 19.989 -7.559 1.802 1.00 0.00 C ATOM 488 C THR A 255 20.594 -6.159 1.605 1.00 0.00 C ATOM 489 O THR A 255 20.093 -5.358 0.808 1.00 0.00 O ATOM 490 CB THR A 255 21.048 -8.664 1.554 1.00 0.00 C ATOM 491 OG1 THR A 255 20.363 -9.900 1.304 1.00 0.00 O ATOM 492 CG2 THR A 255 21.989 -8.869 2.754 1.00 0.00 C ATOM 0 H THR A 255 19.066 -8.409 0.139 1.00 0.00 H new ATOM 0 HA THR A 255 19.645 -7.612 2.835 1.00 0.00 H new ATOM 0 HB THR A 255 21.656 -8.352 0.705 1.00 0.00 H new ATOM 0 HG1 THR A 255 21.018 -10.611 1.143 1.00 0.00 H new ATOM 0 HG21 THR A 255 22.708 -9.654 2.522 1.00 0.00 H new ATOM 0 HG22 THR A 255 22.520 -7.940 2.963 1.00 0.00 H new ATOM 0 HG23 THR A 255 21.406 -9.158 3.628 1.00 0.00 H new ATOM 500 N ALA A 256 21.658 -5.876 2.349 1.00 0.00 N ATOM 501 CA ALA A 256 22.348 -4.591 2.319 1.00 0.00 C ATOM 502 C ALA A 256 22.888 -4.236 0.926 1.00 0.00 C ATOM 503 O ALA A 256 22.680 -4.973 -0.044 1.00 0.00 O ATOM 504 CB ALA A 256 23.472 -4.609 3.345 1.00 0.00 C ATOM 0 H ALA A 256 22.072 -6.543 3.000 1.00 0.00 H new ATOM 0 HA ALA A 256 21.624 -3.815 2.568 1.00 0.00 H new ATOM 0 HB1 ALA A 256 23.994 -3.652 3.330 1.00 0.00 H new ATOM 0 HB2 ALA A 256 23.056 -4.780 4.338 1.00 0.00 H new ATOM 0 HB3 ALA A 256 24.173 -5.408 3.103 1.00 0.00 H new ATOM 510 N SER A 257 23.582 -3.093 0.854 1.00 0.00 N ATOM 511 CA SER A 257 24.128 -2.540 -0.390 1.00 0.00 C ATOM 512 C SER A 257 23.052 -1.794 -1.180 1.00 0.00 C ATOM 513 O SER A 257 23.280 -1.370 -2.314 1.00 0.00 O ATOM 514 CB SER A 257 24.793 -3.624 -1.257 1.00 0.00 C ATOM 515 OG SER A 257 25.387 -3.072 -2.422 1.00 0.00 O ATOM 0 H SER A 257 23.783 -2.518 1.672 1.00 0.00 H new ATOM 0 HA SER A 257 24.903 -1.826 -0.111 1.00 0.00 H new ATOM 0 HB2 SER A 257 25.552 -4.143 -0.672 1.00 0.00 H new ATOM 0 HB3 SER A 257 24.049 -4.367 -1.545 1.00 0.00 H new ATOM 0 HG SER A 257 24.900 -2.264 -2.686 1.00 0.00 H new ATOM 521 N VAL A 258 21.881 -1.621 -0.584 1.00 0.00 N ATOM 522 CA VAL A 258 20.856 -0.775 -1.170 1.00 0.00 C ATOM 523 C VAL A 258 20.377 0.237 -0.134 1.00 0.00 C ATOM 524 O VAL A 258 19.437 -0.016 0.633 1.00 0.00 O ATOM 525 CB VAL A 258 19.659 -1.588 -1.719 1.00 0.00 C ATOM 526 CG1 VAL A 258 18.623 -0.662 -2.341 1.00 0.00 C ATOM 527 CG2 VAL A 258 20.123 -2.619 -2.737 1.00 0.00 C ATOM 0 H VAL A 258 21.619 -2.054 0.302 1.00 0.00 H new ATOM 0 HA VAL A 258 21.301 -0.257 -2.019 1.00 0.00 H new ATOM 0 HB VAL A 258 19.199 -2.115 -0.883 1.00 0.00 H new ATOM 0 HG11 VAL A 258 17.789 -1.252 -2.721 1.00 0.00 H new ATOM 0 HG12 VAL A 258 18.259 0.036 -1.587 1.00 0.00 H new ATOM 0 HG13 VAL A 258 19.078 -0.106 -3.161 1.00 0.00 H new ATOM 0 HG21 VAL A 258 19.263 -3.177 -3.108 1.00 0.00 H new ATOM 0 HG22 VAL A 258 20.614 -2.114 -3.569 1.00 0.00 H new ATOM 0 HG23 VAL A 258 20.825 -3.306 -2.265 1.00 0.00 H new ATOM 537 N THR A 259 21.049 1.378 -0.112 1.00 0.00 N ATOM 538 CA THR A 259 20.737 2.438 0.824 1.00 0.00 C ATOM 539 C THR A 259 19.492 3.192 0.379 1.00 0.00 C ATOM 540 O THR A 259 19.555 4.065 -0.491 1.00 0.00 O ATOM 541 CB THR A 259 21.917 3.417 0.961 1.00 0.00 C ATOM 542 OG1 THR A 259 23.089 2.708 1.394 1.00 0.00 O ATOM 543 CG2 THR A 259 21.592 4.523 1.953 1.00 0.00 C ATOM 0 H THR A 259 21.823 1.591 -0.742 1.00 0.00 H new ATOM 0 HA THR A 259 20.549 1.981 1.796 1.00 0.00 H new ATOM 0 HB THR A 259 22.102 3.870 -0.013 1.00 0.00 H new ATOM 0 HG1 THR A 259 23.838 3.335 1.478 1.00 0.00 H new ATOM 0 HG21 THR A 259 22.441 5.202 2.032 1.00 0.00 H new ATOM 0 HG22 THR A 259 20.717 5.075 1.609 1.00 0.00 H new ATOM 0 HG23 THR A 259 21.384 4.086 2.930 1.00 0.00 H new ATOM 551 N GLY A 260 18.366 2.841 0.974 1.00 0.00 N ATOM 552 CA GLY A 260 17.107 3.450 0.612 1.00 0.00 C ATOM 553 C GLY A 260 16.659 3.068 -0.780 1.00 0.00 C ATOM 554 O GLY A 260 17.019 3.733 -1.753 1.00 0.00 O ATOM 0 H GLY A 260 18.302 2.137 1.709 1.00 0.00 H new ATOM 0 HA2 GLY A 260 16.343 3.153 1.331 1.00 0.00 H new ATOM 0 HA3 GLY A 260 17.200 4.534 0.676 1.00 0.00 H new ATOM 558 N PHE A 261 15.907 1.974 -0.879 1.00 0.00 N ATOM 559 CA PHE A 261 15.243 1.610 -2.127 1.00 0.00 C ATOM 560 C PHE A 261 14.555 2.836 -2.727 1.00 0.00 C ATOM 561 O PHE A 261 14.856 3.262 -3.842 1.00 0.00 O ATOM 562 CB PHE A 261 14.160 0.540 -1.900 1.00 0.00 C ATOM 563 CG PHE A 261 14.617 -0.888 -1.987 1.00 0.00 C ATOM 564 CD1 PHE A 261 14.443 -1.749 -0.918 1.00 0.00 C ATOM 565 CD2 PHE A 261 15.180 -1.377 -3.155 1.00 0.00 C ATOM 566 CE1 PHE A 261 14.821 -3.074 -1.013 1.00 0.00 C ATOM 567 CE2 PHE A 261 15.567 -2.700 -3.252 1.00 0.00 C ATOM 568 CZ PHE A 261 15.386 -3.551 -2.179 1.00 0.00 C ATOM 0 H PHE A 261 15.743 1.325 -0.110 1.00 0.00 H new ATOM 0 HA PHE A 261 16.010 1.219 -2.796 1.00 0.00 H new ATOM 0 HB2 PHE A 261 13.719 0.700 -0.916 1.00 0.00 H new ATOM 0 HB3 PHE A 261 13.368 0.692 -2.633 1.00 0.00 H new ATOM 0 HD1 PHE A 261 14.007 -1.381 -0.001 1.00 0.00 H new ATOM 0 HD2 PHE A 261 15.318 -0.717 -3.999 1.00 0.00 H new ATOM 0 HE1 PHE A 261 14.674 -3.738 -0.174 1.00 0.00 H new ATOM 0 HE2 PHE A 261 16.010 -3.068 -4.165 1.00 0.00 H new ATOM 0 HZ PHE A 261 15.685 -4.586 -2.252 1.00 0.00 H new ATOM 578 N LEU A 262 13.632 3.396 -1.950 1.00 0.00 N ATOM 579 CA LEU A 262 12.860 4.561 -2.360 1.00 0.00 C ATOM 580 C LEU A 262 13.047 5.673 -1.338 1.00 0.00 C ATOM 581 O LEU A 262 13.395 5.407 -0.186 1.00 0.00 O ATOM 582 CB LEU A 262 11.356 4.237 -2.458 1.00 0.00 C ATOM 583 CG LEU A 262 10.933 3.131 -3.438 1.00 0.00 C ATOM 584 CD1 LEU A 262 11.773 3.153 -4.706 1.00 0.00 C ATOM 585 CD2 LEU A 262 10.976 1.769 -2.764 1.00 0.00 C ATOM 0 H LEU A 262 13.399 3.053 -1.018 1.00 0.00 H new ATOM 0 HA LEU A 262 13.216 4.870 -3.343 1.00 0.00 H new ATOM 0 HB2 LEU A 262 11.006 3.958 -1.464 1.00 0.00 H new ATOM 0 HB3 LEU A 262 10.832 5.152 -2.736 1.00 0.00 H new ATOM 0 HG LEU A 262 9.903 3.326 -3.736 1.00 0.00 H new ATOM 0 HD11 LEU A 262 11.444 2.357 -5.374 1.00 0.00 H new ATOM 0 HD12 LEU A 262 11.656 4.116 -5.204 1.00 0.00 H new ATOM 0 HD13 LEU A 262 12.822 3.002 -4.450 1.00 0.00 H new ATOM 0 HD21 LEU A 262 10.673 1.001 -3.476 1.00 0.00 H new ATOM 0 HD22 LEU A 262 11.990 1.565 -2.420 1.00 0.00 H new ATOM 0 HD23 LEU A 262 10.296 1.763 -1.912 1.00 0.00 H new ATOM 597 N LYS A 263 12.841 6.910 -1.762 1.00 0.00 N ATOM 598 CA LYS A 263 12.800 8.040 -0.849 1.00 0.00 C ATOM 599 C LYS A 263 11.591 8.912 -1.152 1.00 0.00 C ATOM 600 O LYS A 263 10.700 8.497 -1.892 1.00 0.00 O ATOM 601 CB LYS A 263 14.091 8.856 -0.928 1.00 0.00 C ATOM 602 CG LYS A 263 15.285 8.109 -0.371 1.00 0.00 C ATOM 603 CD LYS A 263 16.491 9.017 -0.176 1.00 0.00 C ATOM 604 CE LYS A 263 17.027 9.541 -1.497 1.00 0.00 C ATOM 605 NZ LYS A 263 18.189 10.446 -1.299 1.00 0.00 N1+ ATOM 0 H LYS A 263 12.699 7.157 -2.741 1.00 0.00 H new ATOM 0 HA LYS A 263 12.710 7.659 0.168 1.00 0.00 H new ATOM 0 HB2 LYS A 263 14.286 9.122 -1.967 1.00 0.00 H new ATOM 0 HB3 LYS A 263 13.962 9.789 -0.379 1.00 0.00 H new ATOM 0 HG2 LYS A 263 15.015 7.656 0.583 1.00 0.00 H new ATOM 0 HG3 LYS A 263 15.550 7.296 -1.046 1.00 0.00 H new ATOM 0 HD2 LYS A 263 16.214 9.857 0.461 1.00 0.00 H new ATOM 0 HD3 LYS A 263 17.278 8.469 0.343 1.00 0.00 H new ATOM 0 HE2 LYS A 263 17.322 8.703 -2.128 1.00 0.00 H new ATOM 0 HE3 LYS A 263 16.236 10.074 -2.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 18.527 10.784 -2.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 17.901 11.259 -0.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 18.953 9.930 -0.818 1.00 0.00 H new ATOM 619 N ALA A 264 11.555 10.109 -0.576 1.00 0.00 N ATOM 620 CA ALA A 264 10.434 11.019 -0.764 1.00 0.00 C ATOM 621 C ALA A 264 10.164 11.269 -2.240 1.00 0.00 C ATOM 622 O ALA A 264 10.996 11.827 -2.955 1.00 0.00 O ATOM 623 CB ALA A 264 10.687 12.333 -0.046 1.00 0.00 C ATOM 0 H ALA A 264 12.293 10.471 0.027 1.00 0.00 H new ATOM 0 HA ALA A 264 9.550 10.548 -0.335 1.00 0.00 H new ATOM 0 HB1 ALA A 264 9.838 13.000 -0.198 1.00 0.00 H new ATOM 0 HB2 ALA A 264 10.815 12.146 1.020 1.00 0.00 H new ATOM 0 HB3 ALA A 264 11.589 12.797 -0.444 1.00 0.00 H new ATOM 629 N GLY A 265 9.011 10.815 -2.693 1.00 0.00 N ATOM 630 CA GLY A 265 8.593 11.071 -4.056 1.00 0.00 C ATOM 631 C GLY A 265 8.689 9.842 -4.932 1.00 0.00 C ATOM 632 O GLY A 265 8.155 9.819 -6.041 1.00 0.00 O ATOM 0 H GLY A 265 8.350 10.270 -2.139 1.00 0.00 H new ATOM 0 HA2 GLY A 265 7.565 11.433 -4.055 1.00 0.00 H new ATOM 0 HA3 GLY A 265 9.210 11.864 -4.479 1.00 0.00 H new ATOM 636 N ASP A 266 9.366 8.817 -4.437 1.00 0.00 N ATOM 637 CA ASP A 266 9.504 7.571 -5.177 1.00 0.00 C ATOM 638 C ASP A 266 8.234 6.749 -5.066 1.00 0.00 C ATOM 639 O ASP A 266 7.652 6.626 -3.983 1.00 0.00 O ATOM 640 CB ASP A 266 10.697 6.768 -4.675 1.00 0.00 C ATOM 641 CG ASP A 266 12.014 7.285 -5.206 1.00 0.00 C ATOM 642 OD1 ASP A 266 12.757 7.938 -4.442 1.00 0.00 O ATOM 643 OD2 ASP A 266 12.311 7.047 -6.395 1.00 0.00 O1- ATOM 0 H ASP A 266 9.828 8.823 -3.528 1.00 0.00 H new ATOM 0 HA ASP A 266 9.675 7.816 -6.225 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.714 6.794 -3.585 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.576 5.725 -4.967 1.00 0.00 H new ATOM 648 N GLN A 267 7.806 6.181 -6.182 1.00 0.00 N ATOM 649 CA GLN A 267 6.518 5.519 -6.233 1.00 0.00 C ATOM 650 C GLN A 267 6.654 4.012 -6.379 1.00 0.00 C ATOM 651 O GLN A 267 7.511 3.506 -7.107 1.00 0.00 O ATOM 652 CB GLN A 267 5.678 6.070 -7.382 1.00 0.00 C ATOM 653 CG GLN A 267 5.581 7.585 -7.385 1.00 0.00 C ATOM 654 CD GLN A 267 4.394 8.087 -8.171 1.00 0.00 C ATOM 655 OE1 GLN A 267 4.479 8.320 -9.376 1.00 0.00 O ATOM 656 NE2 GLN A 267 3.277 8.264 -7.488 1.00 0.00 N ATOM 0 H GLN A 267 8.329 6.166 -7.057 1.00 0.00 H new ATOM 0 HA GLN A 267 6.019 5.721 -5.285 1.00 0.00 H new ATOM 0 HB2 GLN A 267 6.107 5.739 -8.328 1.00 0.00 H new ATOM 0 HB3 GLN A 267 4.674 5.649 -7.323 1.00 0.00 H new ATOM 0 HG2 GLN A 267 5.510 7.943 -6.358 1.00 0.00 H new ATOM 0 HG3 GLN A 267 6.495 8.003 -7.806 1.00 0.00 H new ATOM 0 HE21 GLN A 267 3.252 8.058 -6.489 1.00 0.00 H new ATOM 0 HE22 GLN A 267 2.440 8.607 -7.959 1.00 0.00 H new ATOM 665 N VAL A 268 5.776 3.312 -5.693 1.00 0.00 N ATOM 666 CA VAL A 268 5.706 1.865 -5.758 1.00 0.00 C ATOM 667 C VAL A 268 4.352 1.450 -6.291 1.00 0.00 C ATOM 668 O VAL A 268 3.457 2.272 -6.408 1.00 0.00 O ATOM 669 CB VAL A 268 5.894 1.195 -4.369 1.00 0.00 C ATOM 670 CG1 VAL A 268 7.366 1.118 -3.994 1.00 0.00 C ATOM 671 CG2 VAL A 268 5.124 1.953 -3.290 1.00 0.00 C ATOM 0 H VAL A 268 5.086 3.732 -5.070 1.00 0.00 H new ATOM 0 HA VAL A 268 6.515 1.539 -6.412 1.00 0.00 H new ATOM 0 HB VAL A 268 5.498 0.182 -4.437 1.00 0.00 H new ATOM 0 HG11 VAL A 268 7.468 0.645 -3.017 1.00 0.00 H new ATOM 0 HG12 VAL A 268 7.901 0.530 -4.740 1.00 0.00 H new ATOM 0 HG13 VAL A 268 7.785 2.124 -3.956 1.00 0.00 H new ATOM 0 HG21 VAL A 268 5.271 1.465 -2.327 1.00 0.00 H new ATOM 0 HG22 VAL A 268 5.488 2.979 -3.236 1.00 0.00 H new ATOM 0 HG23 VAL A 268 4.062 1.957 -3.536 1.00 0.00 H new ATOM 681 N LYS A 269 4.200 0.185 -6.602 1.00 0.00 N ATOM 682 CA LYS A 269 2.896 -0.357 -6.937 1.00 0.00 C ATOM 683 C LYS A 269 2.860 -1.806 -6.483 1.00 0.00 C ATOM 684 O LYS A 269 3.834 -2.528 -6.664 1.00 0.00 O ATOM 685 CB LYS A 269 2.584 -0.214 -8.442 1.00 0.00 C ATOM 686 CG LYS A 269 3.050 -1.354 -9.344 1.00 0.00 C ATOM 687 CD LYS A 269 4.559 -1.389 -9.524 1.00 0.00 C ATOM 688 CE LYS A 269 4.954 -2.347 -10.638 1.00 0.00 C ATOM 689 NZ LYS A 269 4.344 -3.693 -10.460 1.00 0.00 N1+ ATOM 0 H LYS A 269 4.962 -0.493 -6.631 1.00 0.00 H new ATOM 0 HA LYS A 269 2.118 0.207 -6.422 1.00 0.00 H new ATOM 0 HB2 LYS A 269 1.506 -0.105 -8.558 1.00 0.00 H new ATOM 0 HB3 LYS A 269 3.038 0.711 -8.798 1.00 0.00 H new ATOM 0 HG2 LYS A 269 2.718 -2.303 -8.923 1.00 0.00 H new ATOM 0 HG3 LYS A 269 2.575 -1.255 -10.320 1.00 0.00 H new ATOM 0 HD2 LYS A 269 4.925 -0.388 -9.754 1.00 0.00 H new ATOM 0 HD3 LYS A 269 5.033 -1.695 -8.591 1.00 0.00 H new ATOM 0 HE2 LYS A 269 4.645 -1.933 -11.598 1.00 0.00 H new ATOM 0 HE3 LYS A 269 6.039 -2.442 -10.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 4.909 -4.401 -10.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 4.322 -3.933 -9.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 3.374 -3.687 -10.836 1.00 0.00 H new ATOM 703 N PHE A 270 1.789 -2.234 -5.845 1.00 0.00 N ATOM 704 CA PHE A 270 1.793 -3.573 -5.277 1.00 0.00 C ATOM 705 C PHE A 270 0.424 -4.224 -5.306 1.00 0.00 C ATOM 706 O PHE A 270 -0.604 -3.554 -5.434 1.00 0.00 O ATOM 707 CB PHE A 270 2.359 -3.552 -3.849 1.00 0.00 C ATOM 708 CG PHE A 270 1.585 -2.725 -2.860 1.00 0.00 C ATOM 709 CD1 PHE A 270 0.734 -3.331 -1.951 1.00 0.00 C ATOM 710 CD2 PHE A 270 1.726 -1.346 -2.823 1.00 0.00 C ATOM 711 CE1 PHE A 270 0.037 -2.580 -1.026 1.00 0.00 C ATOM 712 CE2 PHE A 270 1.030 -0.590 -1.903 1.00 0.00 C ATOM 713 CZ PHE A 270 0.184 -1.209 -1.002 1.00 0.00 C ATOM 0 H PHE A 270 0.932 -1.699 -5.708 1.00 0.00 H new ATOM 0 HA PHE A 270 2.442 -4.183 -5.905 1.00 0.00 H new ATOM 0 HB2 PHE A 270 2.408 -4.577 -3.481 1.00 0.00 H new ATOM 0 HB3 PHE A 270 3.382 -3.178 -3.887 1.00 0.00 H new ATOM 0 HD1 PHE A 270 0.614 -4.404 -1.966 1.00 0.00 H new ATOM 0 HD2 PHE A 270 2.389 -0.858 -3.523 1.00 0.00 H new ATOM 0 HE1 PHE A 270 -0.623 -3.065 -0.322 1.00 0.00 H new ATOM 0 HE2 PHE A 270 1.146 0.484 -1.887 1.00 0.00 H new ATOM 0 HZ PHE A 270 -0.361 -0.619 -0.280 1.00 0.00 H new ATOM 723 N THR A 271 0.439 -5.544 -5.201 1.00 0.00 N ATOM 724 CA THR A 271 -0.769 -6.338 -5.181 1.00 0.00 C ATOM 725 C THR A 271 -1.100 -6.700 -3.736 1.00 0.00 C ATOM 726 O THR A 271 -0.558 -7.663 -3.187 1.00 0.00 O ATOM 727 CB THR A 271 -0.592 -7.643 -6.012 1.00 0.00 C ATOM 728 OG1 THR A 271 0.470 -8.427 -5.452 1.00 0.00 O ATOM 729 CG2 THR A 271 -0.253 -7.372 -7.486 1.00 0.00 C ATOM 0 H THR A 271 1.296 -6.092 -5.127 1.00 0.00 H new ATOM 0 HA THR A 271 -1.578 -5.757 -5.622 1.00 0.00 H new ATOM 0 HB THR A 271 -1.546 -8.169 -5.973 1.00 0.00 H new ATOM 0 HG1 THR A 271 0.341 -8.508 -4.484 1.00 0.00 H new ATOM 0 HG21 THR A 271 -0.142 -8.319 -8.014 1.00 0.00 H new ATOM 0 HG22 THR A 271 -1.056 -6.794 -7.944 1.00 0.00 H new ATOM 0 HG23 THR A 271 0.679 -6.811 -7.548 1.00 0.00 H new ATOM 737 N ASN A 272 -1.973 -5.919 -3.120 1.00 0.00 N ATOM 738 CA ASN A 272 -2.310 -6.116 -1.710 1.00 0.00 C ATOM 739 C ASN A 272 -3.267 -7.291 -1.539 1.00 0.00 C ATOM 740 O ASN A 272 -3.931 -7.722 -2.486 1.00 0.00 O ATOM 741 CB ASN A 272 -2.908 -4.840 -1.099 1.00 0.00 C ATOM 742 CG ASN A 272 -4.145 -4.336 -1.821 1.00 0.00 C ATOM 743 OD1 ASN A 272 -4.279 -4.478 -3.036 1.00 0.00 O ATOM 744 ND2 ASN A 272 -5.055 -3.731 -1.073 1.00 0.00 N ATOM 0 H ASN A 272 -2.462 -5.144 -3.568 1.00 0.00 H new ATOM 0 HA ASN A 272 -1.387 -6.345 -1.177 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -3.160 -5.032 -0.056 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -2.151 -4.056 -1.105 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -5.904 -3.363 -1.501 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -4.907 -3.633 -0.069 1.00 0.00 H new ATOM 1061 N SER A 292 -3.455 -3.893 -9.314 1.00 0.00 N ATOM 1062 CA SER A 292 -2.510 -3.305 -8.377 1.00 0.00 C ATOM 1063 C SER A 292 -2.776 -1.811 -8.282 1.00 0.00 C ATOM 1064 O SER A 292 -3.476 -1.253 -9.131 1.00 0.00 O ATOM 1065 CB SER A 292 -1.067 -3.533 -8.850 1.00 0.00 C ATOM 1066 OG SER A 292 -0.810 -4.904 -9.084 1.00 0.00 O ATOM 0 HA SER A 292 -2.636 -3.776 -7.402 1.00 0.00 H new ATOM 0 HB2 SER A 292 -0.889 -2.967 -9.764 1.00 0.00 H new ATOM 0 HB3 SER A 292 -0.373 -3.154 -8.100 1.00 0.00 H new ATOM 0 HG SER A 292 -1.631 -5.343 -9.389 1.00 0.00 H new ATOM 1072 N PHE A 293 -2.236 -1.162 -7.263 1.00 0.00 N ATOM 1073 CA PHE A 293 -2.333 0.284 -7.170 1.00 0.00 C ATOM 1074 C PHE A 293 -0.985 0.881 -6.797 1.00 0.00 C ATOM 1075 O PHE A 293 -0.203 0.275 -6.059 1.00 0.00 O ATOM 1076 CB PHE A 293 -3.425 0.718 -6.182 1.00 0.00 C ATOM 1077 CG PHE A 293 -3.162 0.390 -4.739 1.00 0.00 C ATOM 1078 CD1 PHE A 293 -3.427 -0.875 -4.238 1.00 0.00 C ATOM 1079 CD2 PHE A 293 -2.678 1.361 -3.876 1.00 0.00 C ATOM 1080 CE1 PHE A 293 -3.211 -1.163 -2.906 1.00 0.00 C ATOM 1081 CE2 PHE A 293 -2.457 1.076 -2.544 1.00 0.00 C ATOM 1082 CZ PHE A 293 -2.726 -0.188 -2.057 1.00 0.00 C ATOM 0 H PHE A 293 -1.732 -1.608 -6.497 1.00 0.00 H new ATOM 0 HA PHE A 293 -2.620 0.665 -8.150 1.00 0.00 H new ATOM 0 HB2 PHE A 293 -3.564 1.795 -6.272 1.00 0.00 H new ATOM 0 HB3 PHE A 293 -4.364 0.250 -6.477 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -3.806 -1.642 -4.897 1.00 0.00 H new ATOM 0 HD2 PHE A 293 -2.471 2.353 -4.251 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -3.422 -2.152 -2.527 1.00 0.00 H new ATOM 0 HE2 PHE A 293 -2.074 1.840 -1.884 1.00 0.00 H new ATOM 0 HZ PHE A 293 -2.557 -0.413 -1.014 1.00 0.00 H new ATOM 1092 N THR A 294 -0.715 2.057 -7.339 1.00 0.00 N ATOM 1093 CA THR A 294 0.563 2.716 -7.148 1.00 0.00 C ATOM 1094 C THR A 294 0.537 3.624 -5.920 1.00 0.00 C ATOM 1095 O THR A 294 -0.386 4.425 -5.750 1.00 0.00 O ATOM 1096 CB THR A 294 0.927 3.535 -8.408 1.00 0.00 C ATOM 1097 OG1 THR A 294 1.060 2.652 -9.531 1.00 0.00 O ATOM 1098 CG2 THR A 294 2.213 4.338 -8.225 1.00 0.00 C ATOM 0 H THR A 294 -1.372 2.578 -7.920 1.00 0.00 H new ATOM 0 HA THR A 294 1.321 1.950 -6.985 1.00 0.00 H new ATOM 0 HB THR A 294 0.122 4.248 -8.583 1.00 0.00 H new ATOM 0 HG1 THR A 294 1.289 3.171 -10.330 1.00 0.00 H new ATOM 0 HG21 THR A 294 2.426 4.896 -9.137 1.00 0.00 H new ATOM 0 HG22 THR A 294 2.093 5.033 -7.394 1.00 0.00 H new ATOM 0 HG23 THR A 294 3.039 3.659 -8.014 1.00 0.00 H new ATOM 1106 N ALA A 295 1.547 3.496 -5.066 1.00 0.00 N ATOM 1107 CA ALA A 295 1.636 4.307 -3.865 1.00 0.00 C ATOM 1108 C ALA A 295 2.955 5.075 -3.838 1.00 0.00 C ATOM 1109 O ALA A 295 3.810 4.858 -4.693 1.00 0.00 O ATOM 1110 CB ALA A 295 1.503 3.425 -2.644 1.00 0.00 C ATOM 0 H ALA A 295 2.315 2.836 -5.187 1.00 0.00 H new ATOM 0 HA ALA A 295 0.823 5.033 -3.863 1.00 0.00 H new ATOM 0 HB1 ALA A 295 1.570 4.037 -1.744 1.00 0.00 H new ATOM 0 HB2 ALA A 295 0.539 2.916 -2.666 1.00 0.00 H new ATOM 0 HB3 ALA A 295 2.304 2.685 -2.641 1.00 0.00 H new ATOM 1116 N THR A 296 3.132 5.958 -2.860 1.00 0.00 N ATOM 1117 CA THR A 296 4.326 6.795 -2.823 1.00 0.00 C ATOM 1118 C THR A 296 4.951 6.855 -1.437 1.00 0.00 C ATOM 1119 O THR A 296 4.284 7.162 -0.447 1.00 0.00 O ATOM 1120 CB THR A 296 4.008 8.233 -3.313 1.00 0.00 C ATOM 1121 OG1 THR A 296 3.471 8.191 -4.641 1.00 0.00 O ATOM 1122 CG2 THR A 296 5.242 9.150 -3.289 1.00 0.00 C ATOM 0 H THR A 296 2.476 6.111 -2.094 1.00 0.00 H new ATOM 0 HA THR A 296 5.049 6.332 -3.495 1.00 0.00 H new ATOM 0 HB THR A 296 3.274 8.650 -2.623 1.00 0.00 H new ATOM 0 HG1 THR A 296 3.346 9.105 -4.973 1.00 0.00 H new ATOM 0 HG21 THR A 296 4.964 10.143 -3.641 1.00 0.00 H new ATOM 0 HG22 THR A 296 5.624 9.220 -2.270 1.00 0.00 H new ATOM 0 HG23 THR A 296 6.014 8.738 -3.938 1.00 0.00 H new ATOM 1130 N VAL A 297 6.247 6.576 -1.391 1.00 0.00 N ATOM 1131 CA VAL A 297 7.005 6.596 -0.151 1.00 0.00 C ATOM 1132 C VAL A 297 7.506 8.010 0.126 1.00 0.00 C ATOM 1133 O VAL A 297 7.916 8.723 -0.793 1.00 0.00 O ATOM 1134 CB VAL A 297 8.200 5.613 -0.216 1.00 0.00 C ATOM 1135 CG1 VAL A 297 8.924 5.541 1.117 1.00 0.00 C ATOM 1136 CG2 VAL A 297 7.734 4.228 -0.646 1.00 0.00 C ATOM 0 H VAL A 297 6.800 6.330 -2.212 1.00 0.00 H new ATOM 0 HA VAL A 297 6.348 6.280 0.659 1.00 0.00 H new ATOM 0 HB VAL A 297 8.902 5.989 -0.961 1.00 0.00 H new ATOM 0 HG11 VAL A 297 9.758 4.843 1.041 1.00 0.00 H new ATOM 0 HG12 VAL A 297 9.301 6.529 1.380 1.00 0.00 H new ATOM 0 HG13 VAL A 297 8.234 5.199 1.888 1.00 0.00 H new ATOM 0 HG21 VAL A 297 8.589 3.553 -0.685 1.00 0.00 H new ATOM 0 HG22 VAL A 297 7.006 3.850 0.071 1.00 0.00 H new ATOM 0 HG23 VAL A 297 7.274 4.289 -1.632 1.00 0.00 H new ATOM 1146 N THR A 298 7.454 8.431 1.383 1.00 0.00 N ATOM 1147 CA THR A 298 7.828 9.792 1.731 1.00 0.00 C ATOM 1148 C THR A 298 9.123 9.837 2.552 1.00 0.00 C ATOM 1149 O THR A 298 9.487 10.883 3.091 1.00 0.00 O ATOM 1150 CB THR A 298 6.689 10.497 2.506 1.00 0.00 C ATOM 1151 OG1 THR A 298 6.988 11.889 2.673 1.00 0.00 O ATOM 1152 CG2 THR A 298 6.473 9.855 3.869 1.00 0.00 C ATOM 0 H THR A 298 7.159 7.854 2.171 1.00 0.00 H new ATOM 0 HA THR A 298 8.003 10.322 0.795 1.00 0.00 H new ATOM 0 HB THR A 298 5.774 10.390 1.923 1.00 0.00 H new ATOM 0 HG1 THR A 298 7.935 11.995 2.903 1.00 0.00 H new ATOM 0 HG21 THR A 298 5.667 10.371 4.391 1.00 0.00 H new ATOM 0 HG22 THR A 298 6.208 8.806 3.739 1.00 0.00 H new ATOM 0 HG23 THR A 298 7.389 9.928 4.455 1.00 0.00 H new ATOM 1160 N ALA A 299 9.826 8.714 2.625 1.00 0.00 N ATOM 1161 CA ALA A 299 11.040 8.634 3.430 1.00 0.00 C ATOM 1162 C ALA A 299 11.996 7.579 2.894 1.00 0.00 C ATOM 1163 O ALA A 299 11.693 6.889 1.923 1.00 0.00 O ATOM 1164 CB ALA A 299 10.688 8.342 4.883 1.00 0.00 C ATOM 0 H ALA A 299 9.580 7.851 2.140 1.00 0.00 H new ATOM 0 HA ALA A 299 11.545 9.598 3.372 1.00 0.00 H new ATOM 0 HB1 ALA A 299 11.602 8.284 5.474 1.00 0.00 H new ATOM 0 HB2 ALA A 299 10.054 9.139 5.271 1.00 0.00 H new ATOM 0 HB3 ALA A 299 10.156 7.393 4.945 1.00 0.00 H new ATOM 1170 N ASP A 300 13.150 7.476 3.540 1.00 0.00 N ATOM 1171 CA ASP A 300 14.186 6.528 3.156 1.00 0.00 C ATOM 1172 C ASP A 300 13.723 5.107 3.419 1.00 0.00 C ATOM 1173 O ASP A 300 13.506 4.713 4.569 1.00 0.00 O ATOM 1174 CB ASP A 300 15.477 6.800 3.936 1.00 0.00 C ATOM 1175 CG ASP A 300 16.024 8.197 3.713 1.00 0.00 C ATOM 1176 OD1 ASP A 300 15.391 9.170 4.183 1.00 0.00 O ATOM 1177 OD2 ASP A 300 17.098 8.331 3.093 1.00 0.00 O1- ATOM 0 H ASP A 300 13.394 8.050 4.347 1.00 0.00 H new ATOM 0 HA ASP A 300 14.382 6.649 2.091 1.00 0.00 H new ATOM 0 HB2 ASP A 300 15.289 6.656 5.000 1.00 0.00 H new ATOM 0 HB3 ASP A 300 16.232 6.070 3.644 1.00 0.00 H new ATOM 1182 N ALA A 301 13.563 4.348 2.355 1.00 0.00 N ATOM 1183 CA ALA A 301 13.101 2.966 2.477 1.00 0.00 C ATOM 1184 C ALA A 301 14.283 2.001 2.552 1.00 0.00 C ATOM 1185 O ALA A 301 14.871 1.636 1.538 1.00 0.00 O ATOM 1186 CB ALA A 301 12.141 2.576 1.342 1.00 0.00 C ATOM 0 H ALA A 301 13.742 4.654 1.399 1.00 0.00 H new ATOM 0 HA ALA A 301 12.540 2.894 3.409 1.00 0.00 H new ATOM 0 HB1 ALA A 301 11.824 1.542 1.473 1.00 0.00 H new ATOM 0 HB2 ALA A 301 11.268 3.229 1.363 1.00 0.00 H new ATOM 0 HB3 ALA A 301 12.649 2.681 0.383 1.00 0.00 H new ATOM 1192 N ASN A 302 14.601 1.579 3.765 1.00 0.00 N ATOM 1193 CA ASN A 302 15.813 0.807 4.044 1.00 0.00 C ATOM 1194 C ASN A 302 15.794 -0.594 3.445 1.00 0.00 C ATOM 1195 O ASN A 302 14.857 -1.344 3.666 1.00 0.00 O ATOM 1196 CB ASN A 302 15.998 0.665 5.555 1.00 0.00 C ATOM 1197 CG ASN A 302 16.475 1.946 6.210 1.00 0.00 C ATOM 1198 OD1 ASN A 302 15.676 2.792 6.604 1.00 0.00 O ATOM 1199 ND2 ASN A 302 17.784 2.095 6.340 1.00 0.00 N ATOM 0 H ASN A 302 14.028 1.760 4.589 1.00 0.00 H new ATOM 0 HA ASN A 302 16.632 1.359 3.583 1.00 0.00 H new ATOM 0 HB2 ASN A 302 15.053 0.362 6.005 1.00 0.00 H new ATOM 0 HB3 ASN A 302 16.716 -0.130 5.756 1.00 0.00 H new ATOM 0 HD21 ASN A 302 18.161 2.935 6.780 1.00 0.00 H new ATOM 0 HD22 ASN A 302 18.416 1.370 6.000 1.00 0.00 H new ATOM 1206 N SER A 303 16.822 -0.947 2.683 1.00 0.00 N ATOM 1207 CA SER A 303 17.092 -2.344 2.410 1.00 0.00 C ATOM 1208 C SER A 303 18.293 -2.777 3.249 1.00 0.00 C ATOM 1209 O SER A 303 19.442 -2.577 2.849 1.00 0.00 O ATOM 1210 CB SER A 303 17.390 -2.536 0.925 1.00 0.00 C ATOM 1211 OG SER A 303 17.459 -3.905 0.572 1.00 0.00 O ATOM 0 H SER A 303 17.472 -0.291 2.250 1.00 0.00 H new ATOM 0 HA SER A 303 16.223 -2.950 2.667 1.00 0.00 H new ATOM 0 HB2 SER A 303 16.616 -2.047 0.333 1.00 0.00 H new ATOM 0 HB3 SER A 303 18.334 -2.050 0.679 1.00 0.00 H new ATOM 0 HG SER A 303 17.413 -4.454 1.382 1.00 0.00 H new ATOM 1217 N ASP A 304 18.035 -3.350 4.417 1.00 0.00 N ATOM 1218 CA ASP A 304 19.118 -3.712 5.325 1.00 0.00 C ATOM 1219 C ASP A 304 19.517 -5.171 5.134 1.00 0.00 C ATOM 1220 O ASP A 304 18.918 -5.877 4.327 1.00 0.00 O ATOM 1221 CB ASP A 304 18.725 -3.449 6.786 1.00 0.00 C ATOM 1222 CG ASP A 304 18.021 -4.623 7.439 1.00 0.00 C ATOM 1223 OD1 ASP A 304 18.666 -5.334 8.239 1.00 0.00 O ATOM 1224 OD2 ASP A 304 16.828 -4.839 7.166 1.00 0.00 O1- ATOM 0 H ASP A 304 17.099 -3.572 4.756 1.00 0.00 H new ATOM 0 HA ASP A 304 19.977 -3.085 5.087 1.00 0.00 H new ATOM 0 HB2 ASP A 304 19.621 -3.208 7.358 1.00 0.00 H new ATOM 0 HB3 ASP A 304 18.075 -2.575 6.828 1.00 0.00 H new ATOM 1229 N SER A 305 20.516 -5.627 5.873 1.00 0.00 N ATOM 1230 CA SER A 305 21.025 -6.982 5.705 1.00 0.00 C ATOM 1231 C SER A 305 19.940 -8.020 5.994 1.00 0.00 C ATOM 1232 O SER A 305 19.877 -9.067 5.343 1.00 0.00 O ATOM 1233 CB SER A 305 22.206 -7.206 6.639 1.00 0.00 C ATOM 1234 OG SER A 305 22.978 -8.326 6.243 1.00 0.00 O ATOM 0 H SER A 305 20.990 -5.082 6.593 1.00 0.00 H new ATOM 0 HA SER A 305 21.344 -7.099 4.669 1.00 0.00 H new ATOM 0 HB2 SER A 305 22.835 -6.316 6.651 1.00 0.00 H new ATOM 0 HB3 SER A 305 21.843 -7.354 7.656 1.00 0.00 H new ATOM 0 HG SER A 305 23.729 -8.441 6.862 1.00 0.00 H new ATOM 1240 N GLY A 306 19.060 -7.703 6.933 1.00 0.00 N ATOM 1241 CA GLY A 306 18.008 -8.624 7.305 1.00 0.00 C ATOM 1242 C GLY A 306 16.829 -8.550 6.363 1.00 0.00 C ATOM 1243 O GLY A 306 15.792 -9.175 6.604 1.00 0.00 O ATOM 0 H GLY A 306 19.057 -6.821 7.445 1.00 0.00 H new ATOM 0 HA2 GLY A 306 18.402 -9.640 7.313 1.00 0.00 H new ATOM 0 HA3 GLY A 306 17.676 -8.403 8.319 1.00 0.00 H new ATOM 1247 N GLY A 307 16.988 -7.790 5.284 1.00 0.00 N ATOM 1248 CA GLY A 307 15.932 -7.659 4.307 1.00 0.00 C ATOM 1249 C GLY A 307 14.663 -7.051 4.879 1.00 0.00 C ATOM 1250 O GLY A 307 13.569 -7.538 4.607 1.00 0.00 O ATOM 0 H GLY A 307 17.835 -7.262 5.072 1.00 0.00 H new ATOM 0 HA2 GLY A 307 16.284 -7.041 3.481 1.00 0.00 H new ATOM 0 HA3 GLY A 307 15.703 -8.642 3.894 1.00 0.00 H new ATOM 1254 N ASP A 308 14.801 -6.022 5.699 1.00 0.00 N ATOM 1255 CA ASP A 308 13.639 -5.362 6.290 1.00 0.00 C ATOM 1256 C ASP A 308 13.553 -3.902 5.849 1.00 0.00 C ATOM 1257 O ASP A 308 14.547 -3.175 5.863 1.00 0.00 O ATOM 1258 CB ASP A 308 13.703 -5.454 7.813 1.00 0.00 C ATOM 1259 CG ASP A 308 12.677 -4.586 8.516 1.00 0.00 C ATOM 1260 OD1 ASP A 308 12.991 -3.413 8.820 1.00 0.00 O ATOM 1261 OD2 ASP A 308 11.565 -5.079 8.792 1.00 0.00 O1- ATOM 0 H ASP A 308 15.700 -5.624 5.972 1.00 0.00 H new ATOM 0 HA ASP A 308 12.741 -5.872 5.940 1.00 0.00 H new ATOM 0 HB2 ASP A 308 13.556 -6.492 8.113 1.00 0.00 H new ATOM 0 HB3 ASP A 308 14.700 -5.165 8.145 1.00 0.00 H new ATOM 1266 N VAL A 309 12.351 -3.487 5.469 1.00 0.00 N ATOM 1267 CA VAL A 309 12.098 -2.136 4.978 1.00 0.00 C ATOM 1268 C VAL A 309 10.754 -1.607 5.495 1.00 0.00 C ATOM 1269 O VAL A 309 9.701 -2.026 5.050 1.00 0.00 O ATOM 1270 CB VAL A 309 12.145 -2.090 3.416 1.00 0.00 C ATOM 1271 CG1 VAL A 309 11.771 -3.430 2.805 1.00 0.00 C ATOM 1272 CG2 VAL A 309 11.247 -1.005 2.833 1.00 0.00 C ATOM 0 H VAL A 309 11.521 -4.079 5.492 1.00 0.00 H new ATOM 0 HA VAL A 309 12.887 -1.489 5.360 1.00 0.00 H new ATOM 0 HB VAL A 309 13.177 -1.852 3.160 1.00 0.00 H new ATOM 0 HG11 VAL A 309 11.815 -3.359 1.718 1.00 0.00 H new ATOM 0 HG12 VAL A 309 12.469 -4.194 3.147 1.00 0.00 H new ATOM 0 HG13 VAL A 309 10.760 -3.700 3.110 1.00 0.00 H new ATOM 0 HG21 VAL A 309 11.319 -1.019 1.745 1.00 0.00 H new ATOM 0 HG22 VAL A 309 10.215 -1.188 3.131 1.00 0.00 H new ATOM 0 HG23 VAL A 309 11.564 -0.031 3.205 1.00 0.00 H new ATOM 1282 N THR A 310 10.790 -0.694 6.447 1.00 0.00 N ATOM 1283 CA THR A 310 9.563 -0.142 7.012 1.00 0.00 C ATOM 1284 C THR A 310 9.412 1.334 6.646 1.00 0.00 C ATOM 1285 O THR A 310 10.288 2.146 6.955 1.00 0.00 O ATOM 1286 CB THR A 310 9.567 -0.284 8.559 1.00 0.00 C ATOM 1287 OG1 THR A 310 9.512 -1.667 8.923 1.00 0.00 O ATOM 1288 CG2 THR A 310 8.411 0.474 9.229 1.00 0.00 C ATOM 0 H THR A 310 11.649 -0.317 6.847 1.00 0.00 H new ATOM 0 HA THR A 310 8.724 -0.701 6.596 1.00 0.00 H new ATOM 0 HB THR A 310 10.495 0.162 8.916 1.00 0.00 H new ATOM 0 HG1 THR A 310 9.516 -1.749 9.900 1.00 0.00 H new ATOM 0 HG21 THR A 310 8.465 0.339 10.309 1.00 0.00 H new ATOM 0 HG22 THR A 310 8.486 1.535 8.992 1.00 0.00 H new ATOM 0 HG23 THR A 310 7.461 0.087 8.862 1.00 0.00 H new ATOM 1296 N VAL A 311 8.304 1.692 5.999 1.00 0.00 N ATOM 1297 CA VAL A 311 8.076 3.084 5.600 1.00 0.00 C ATOM 1298 C VAL A 311 6.599 3.420 5.631 1.00 0.00 C ATOM 1299 O VAL A 311 5.745 2.537 5.638 1.00 0.00 O ATOM 1300 CB VAL A 311 8.606 3.394 4.173 1.00 0.00 C ATOM 1301 CG1 VAL A 311 10.136 3.350 4.117 1.00 0.00 C ATOM 1302 CG2 VAL A 311 8.012 2.412 3.155 1.00 0.00 C ATOM 0 H VAL A 311 7.557 1.047 5.741 1.00 0.00 H new ATOM 0 HA VAL A 311 8.626 3.691 6.319 1.00 0.00 H new ATOM 0 HB VAL A 311 8.291 4.406 3.918 1.00 0.00 H new ATOM 0 HG11 VAL A 311 10.470 3.572 3.103 1.00 0.00 H new ATOM 0 HG12 VAL A 311 10.547 4.090 4.804 1.00 0.00 H new ATOM 0 HG13 VAL A 311 10.482 2.357 4.404 1.00 0.00 H new ATOM 0 HG21 VAL A 311 8.394 2.643 2.161 1.00 0.00 H new ATOM 0 HG22 VAL A 311 8.294 1.394 3.424 1.00 0.00 H new ATOM 0 HG23 VAL A 311 6.926 2.500 3.156 1.00 0.00 H new ATOM 1312 N THR A 312 6.309 4.700 5.664 1.00 0.00 N ATOM 1313 CA THR A 312 4.951 5.164 5.546 1.00 0.00 C ATOM 1314 C THR A 312 4.790 5.939 4.243 1.00 0.00 C ATOM 1315 O THR A 312 5.664 6.714 3.842 1.00 0.00 O ATOM 1316 CB THR A 312 4.561 6.035 6.768 1.00 0.00 C ATOM 1317 OG1 THR A 312 4.400 5.199 7.915 1.00 0.00 O ATOM 1318 CG2 THR A 312 3.278 6.861 6.540 1.00 0.00 C ATOM 0 H THR A 312 7.002 5.441 5.772 1.00 0.00 H new ATOM 0 HA THR A 312 4.279 4.306 5.528 1.00 0.00 H new ATOM 0 HB THR A 312 5.370 6.749 6.923 1.00 0.00 H new ATOM 0 HG1 THR A 312 3.551 5.410 8.357 1.00 0.00 H new ATOM 0 HG21 THR A 312 3.060 7.448 7.432 1.00 0.00 H new ATOM 0 HG22 THR A 312 3.422 7.530 5.691 1.00 0.00 H new ATOM 0 HG23 THR A 312 2.444 6.189 6.335 1.00 0.00 H new ATOM 1326 N LEU A 313 3.682 5.696 3.585 1.00 0.00 N ATOM 1327 CA LEU A 313 3.406 6.268 2.292 1.00 0.00 C ATOM 1328 C LEU A 313 2.419 7.405 2.440 1.00 0.00 C ATOM 1329 O LEU A 313 1.596 7.391 3.346 1.00 0.00 O ATOM 1330 CB LEU A 313 2.863 5.179 1.371 1.00 0.00 C ATOM 1331 CG LEU A 313 3.812 3.991 1.210 1.00 0.00 C ATOM 1332 CD1 LEU A 313 3.527 2.906 2.238 1.00 0.00 C ATOM 1333 CD2 LEU A 313 3.770 3.431 -0.198 1.00 0.00 C ATOM 0 H LEU A 313 2.941 5.090 3.936 1.00 0.00 H new ATOM 0 HA LEU A 313 4.320 6.670 1.854 1.00 0.00 H new ATOM 0 HB2 LEU A 313 1.911 4.823 1.764 1.00 0.00 H new ATOM 0 HB3 LEU A 313 2.662 5.610 0.390 1.00 0.00 H new ATOM 0 HG LEU A 313 4.822 4.360 1.389 1.00 0.00 H new ATOM 0 HD11 LEU A 313 4.220 2.077 2.094 1.00 0.00 H new ATOM 0 HD12 LEU A 313 3.652 3.313 3.241 1.00 0.00 H new ATOM 0 HD13 LEU A 313 2.504 2.549 2.116 1.00 0.00 H new ATOM 0 HD21 LEU A 313 4.457 2.588 -0.275 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.758 3.096 -0.426 1.00 0.00 H new ATOM 0 HD23 LEU A 313 4.065 4.205 -0.906 1.00 0.00 H new ATOM 1345 N SER A 314 2.507 8.399 1.577 1.00 0.00 N ATOM 1346 CA SER A 314 1.692 9.589 1.734 1.00 0.00 C ATOM 1347 C SER A 314 1.136 10.073 0.405 1.00 0.00 C ATOM 1348 O SER A 314 1.823 10.052 -0.616 1.00 0.00 O ATOM 1349 CB SER A 314 2.519 10.691 2.389 1.00 0.00 C ATOM 1350 OG SER A 314 3.086 10.239 3.606 1.00 0.00 O ATOM 0 H SER A 314 3.128 8.408 0.768 1.00 0.00 H new ATOM 0 HA SER A 314 0.844 9.335 2.370 1.00 0.00 H new ATOM 0 HB2 SER A 314 3.310 11.010 1.710 1.00 0.00 H new ATOM 0 HB3 SER A 314 1.890 11.561 2.577 1.00 0.00 H new ATOM 0 HG SER A 314 3.795 9.590 3.415 1.00 0.00 H new ATOM 1632 N VAL A 333 -6.465 -5.126 5.091 1.00 0.00 N ATOM 1633 CA VAL A 333 -5.358 -5.812 4.437 1.00 0.00 C ATOM 1634 C VAL A 333 -4.645 -6.774 5.384 1.00 0.00 C ATOM 1635 O VAL A 333 -4.674 -6.606 6.606 1.00 0.00 O ATOM 1636 CB VAL A 333 -4.333 -4.799 3.886 1.00 0.00 C ATOM 1637 CG1 VAL A 333 -5.002 -3.807 2.948 1.00 0.00 C ATOM 1638 CG2 VAL A 333 -3.646 -4.070 5.025 1.00 0.00 C ATOM 0 HA VAL A 333 -5.787 -6.386 3.615 1.00 0.00 H new ATOM 0 HB VAL A 333 -3.581 -5.349 3.319 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -4.259 -3.103 2.573 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -5.450 -4.343 2.111 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -5.777 -3.263 3.487 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -2.926 -3.359 4.620 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -4.390 -3.536 5.616 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -3.128 -4.790 5.658 1.00 0.00 H new ATOM 1648 N GLU A 334 -4.008 -7.779 4.812 1.00 0.00 N ATOM 1649 CA GLU A 334 -3.294 -8.782 5.582 1.00 0.00 C ATOM 1650 C GLU A 334 -1.838 -8.850 5.120 1.00 0.00 C ATOM 1651 O GLU A 334 -1.544 -8.634 3.949 1.00 0.00 O ATOM 1652 CB GLU A 334 -3.976 -10.143 5.417 1.00 0.00 C ATOM 1653 CG GLU A 334 -3.354 -11.231 6.278 1.00 0.00 C ATOM 1654 CD GLU A 334 -4.103 -12.544 6.215 1.00 0.00 C ATOM 1655 OE1 GLU A 334 -3.850 -13.333 5.281 1.00 0.00 O ATOM 1656 OE2 GLU A 334 -4.923 -12.805 7.120 1.00 0.00 O1- ATOM 0 H GLU A 334 -3.971 -7.923 3.803 1.00 0.00 H new ATOM 0 HA GLU A 334 -3.311 -8.510 6.637 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -5.032 -10.047 5.671 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -3.926 -10.443 4.370 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -2.324 -11.392 5.960 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -3.318 -10.890 7.313 1.00 0.00 H new ATOM 1663 N ALA A 335 -0.932 -9.142 6.040 1.00 0.00 N ATOM 1664 CA ALA A 335 0.487 -9.194 5.717 1.00 0.00 C ATOM 1665 C ALA A 335 0.803 -10.387 4.816 1.00 0.00 C ATOM 1666 O ALA A 335 0.267 -11.477 5.025 1.00 0.00 O ATOM 1667 CB ALA A 335 1.312 -9.278 6.990 1.00 0.00 C ATOM 0 H ALA A 335 -1.152 -9.346 7.015 1.00 0.00 H new ATOM 0 HA ALA A 335 0.743 -8.280 5.180 1.00 0.00 H new ATOM 0 HB1 ALA A 335 2.371 -9.316 6.735 1.00 0.00 H new ATOM 0 HB2 ALA A 335 1.119 -8.401 7.607 1.00 0.00 H new ATOM 0 HB3 ALA A 335 1.039 -10.177 7.542 1.00 0.00 H new ATOM 1673 N GLY A 336 1.668 -10.193 3.824 1.00 0.00 N ATOM 1674 CA GLY A 336 2.077 -11.301 2.980 1.00 0.00 C ATOM 1675 C GLY A 336 1.930 -11.003 1.503 1.00 0.00 C ATOM 1676 O GLY A 336 2.282 -11.835 0.660 1.00 0.00 O ATOM 0 H GLY A 336 2.090 -9.294 3.591 1.00 0.00 H new ATOM 0 HA2 GLY A 336 3.117 -11.549 3.194 1.00 0.00 H new ATOM 0 HA3 GLY A 336 1.482 -12.180 3.229 1.00 0.00 H new ATOM 1680 N ASP A 337 1.421 -9.822 1.185 1.00 0.00 N ATOM 1681 CA ASP A 337 1.217 -9.422 -0.199 1.00 0.00 C ATOM 1682 C ASP A 337 2.536 -9.041 -0.866 1.00 0.00 C ATOM 1683 O ASP A 337 3.577 -8.910 -0.205 1.00 0.00 O ATOM 1684 CB ASP A 337 0.207 -8.272 -0.286 1.00 0.00 C ATOM 1685 CG ASP A 337 0.518 -7.120 0.647 1.00 0.00 C ATOM 1686 OD1 ASP A 337 0.590 -7.353 1.875 1.00 0.00 O ATOM 1687 OD2 ASP A 337 0.659 -5.984 0.156 1.00 0.00 O1- ATOM 0 H ASP A 337 1.140 -9.121 1.871 1.00 0.00 H new ATOM 0 HA ASP A 337 0.809 -10.277 -0.739 1.00 0.00 H new ATOM 0 HB2 ASP A 337 0.179 -7.901 -1.311 1.00 0.00 H new ATOM 0 HB3 ASP A 337 -0.788 -8.655 -0.058 1.00 0.00 H new ATOM 1692 N ALA A 338 2.492 -8.888 -2.186 1.00 0.00 N ATOM 1693 CA ALA A 338 3.699 -8.700 -2.980 1.00 0.00 C ATOM 1694 C ALA A 338 3.861 -7.250 -3.415 1.00 0.00 C ATOM 1695 O ALA A 338 2.933 -6.644 -3.954 1.00 0.00 O ATOM 1696 CB ALA A 338 3.674 -9.615 -4.198 1.00 0.00 C ATOM 0 H ALA A 338 1.629 -8.891 -2.729 1.00 0.00 H new ATOM 0 HA ALA A 338 4.554 -8.958 -2.355 1.00 0.00 H new ATOM 0 HB1 ALA A 338 4.581 -9.466 -4.784 1.00 0.00 H new ATOM 0 HB2 ALA A 338 3.620 -10.654 -3.872 1.00 0.00 H new ATOM 0 HB3 ALA A 338 2.804 -9.381 -4.811 1.00 0.00 H new ATOM 1702 N VAL A 339 5.056 -6.711 -3.202 1.00 0.00 N ATOM 1703 CA VAL A 339 5.338 -5.316 -3.498 1.00 0.00 C ATOM 1704 C VAL A 339 6.245 -5.185 -4.718 1.00 0.00 C ATOM 1705 O VAL A 339 7.093 -6.041 -4.972 1.00 0.00 O ATOM 1706 CB VAL A 339 6.005 -4.621 -2.277 1.00 0.00 C ATOM 1707 CG1 VAL A 339 6.464 -3.208 -2.621 1.00 0.00 C ATOM 1708 CG2 VAL A 339 5.032 -4.564 -1.119 1.00 0.00 C ATOM 0 H VAL A 339 5.850 -7.226 -2.822 1.00 0.00 H new ATOM 0 HA VAL A 339 4.388 -4.827 -3.715 1.00 0.00 H new ATOM 0 HB VAL A 339 6.880 -5.208 -1.998 1.00 0.00 H new ATOM 0 HG11 VAL A 339 6.925 -2.752 -1.745 1.00 0.00 H new ATOM 0 HG12 VAL A 339 7.189 -3.249 -3.433 1.00 0.00 H new ATOM 0 HG13 VAL A 339 5.606 -2.612 -2.931 1.00 0.00 H new ATOM 0 HG21 VAL A 339 5.507 -4.076 -0.268 1.00 0.00 H new ATOM 0 HG22 VAL A 339 4.148 -3.999 -1.414 1.00 0.00 H new ATOM 0 HG23 VAL A 339 4.739 -5.576 -0.840 1.00 0.00 H new ATOM 1718 N SER A 340 6.045 -4.118 -5.477 1.00 0.00 N ATOM 1719 CA SER A 340 6.917 -3.794 -6.589 1.00 0.00 C ATOM 1720 C SER A 340 7.081 -2.283 -6.709 1.00 0.00 C ATOM 1721 O SER A 340 6.329 -1.516 -6.109 1.00 0.00 O ATOM 1722 CB SER A 340 6.372 -4.392 -7.895 1.00 0.00 C ATOM 1723 OG SER A 340 4.957 -4.470 -7.882 1.00 0.00 O ATOM 0 H SER A 340 5.279 -3.459 -5.339 1.00 0.00 H new ATOM 0 HA SER A 340 7.898 -4.231 -6.402 1.00 0.00 H new ATOM 0 HB2 SER A 340 6.696 -3.782 -8.738 1.00 0.00 H new ATOM 0 HB3 SER A 340 6.791 -5.388 -8.043 1.00 0.00 H new ATOM 0 HG SER A 340 4.590 -3.675 -7.442 1.00 0.00 H new ATOM 1729 N VAL A 341 8.074 -1.864 -7.472 1.00 0.00 N ATOM 1730 CA VAL A 341 8.388 -0.451 -7.617 1.00 0.00 C ATOM 1731 C VAL A 341 8.018 0.030 -9.013 1.00 0.00 C ATOM 1732 O VAL A 341 8.169 -0.708 -9.985 1.00 0.00 O ATOM 1733 CB VAL A 341 9.896 -0.199 -7.372 1.00 0.00 C ATOM 1734 CG1 VAL A 341 10.235 1.284 -7.452 1.00 0.00 C ATOM 1735 CG2 VAL A 341 10.330 -0.771 -6.030 1.00 0.00 C ATOM 0 H VAL A 341 8.682 -2.486 -8.005 1.00 0.00 H new ATOM 0 HA VAL A 341 7.810 0.102 -6.877 1.00 0.00 H new ATOM 0 HB VAL A 341 10.445 -0.711 -8.162 1.00 0.00 H new ATOM 0 HG11 VAL A 341 11.301 1.424 -7.275 1.00 0.00 H new ATOM 0 HG12 VAL A 341 9.979 1.663 -8.441 1.00 0.00 H new ATOM 0 HG13 VAL A 341 9.668 1.828 -6.697 1.00 0.00 H new ATOM 0 HG21 VAL A 341 11.393 -0.582 -5.880 1.00 0.00 H new ATOM 0 HG22 VAL A 341 9.761 -0.296 -5.231 1.00 0.00 H new ATOM 0 HG23 VAL A 341 10.147 -1.846 -6.016 1.00 0.00 H new ATOM 1745 N VAL A 342 7.510 1.257 -9.101 1.00 0.00 N ATOM 1746 CA VAL A 342 7.211 1.867 -10.388 1.00 0.00 C ATOM 1747 C VAL A 342 8.507 2.260 -11.080 1.00 0.00 C ATOM 1748 O VAL A 342 8.691 1.988 -12.265 1.00 0.00 O ATOM 1749 CB VAL A 342 6.301 3.108 -10.239 1.00 0.00 C ATOM 1750 CG1 VAL A 342 6.191 3.868 -11.558 1.00 0.00 C ATOM 1751 CG2 VAL A 342 4.918 2.690 -9.763 1.00 0.00 C ATOM 0 H VAL A 342 7.298 1.846 -8.295 1.00 0.00 H new ATOM 0 HA VAL A 342 6.675 1.133 -10.989 1.00 0.00 H new ATOM 0 HB VAL A 342 6.750 3.770 -9.499 1.00 0.00 H new ATOM 0 HG11 VAL A 342 5.545 4.736 -11.425 1.00 0.00 H new ATOM 0 HG12 VAL A 342 7.182 4.197 -11.872 1.00 0.00 H new ATOM 0 HG13 VAL A 342 5.767 3.214 -12.320 1.00 0.00 H new ATOM 0 HG21 VAL A 342 4.286 3.572 -9.662 1.00 0.00 H new ATOM 0 HG22 VAL A 342 4.475 2.007 -10.488 1.00 0.00 H new ATOM 0 HG23 VAL A 342 5.001 2.190 -8.798 1.00 0.00 H new