USER MOD reduce.3.24.130724 H: found=0, std=0, add=720, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 722 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 252 GLN : amide:sc= -0.966! X(o=-4.9!,f=-5) USER MOD Set 1.2: A 303 SER OG : rot 72:sc= -3.89! USER MOD Single : A 227 SER OG : rot 26:sc= 0.122 USER MOD Single : A 229 THR OG1 : rot 180:sc= -0.828 USER MOD Single : A 231 SER OG : rot 180:sc= 0 USER MOD Single : A 233 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 236 HIS : no HE2:sc= -6.51! C(o=-6.5!,f=-7.6!) USER MOD Single : A 237 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 254 THR OG1 : rot 180:sc= 0 USER MOD Single : A 256 THR OG1 : rot 180:sc= 0 USER MOD Single : A 258 SER OG : rot 180:sc= 0 USER MOD Single : A 260 SER OG : rot 180:sc= 0 USER MOD Single : A 263 GLN :FLIP amide:sc= -0.434 F(o=-2.8!,f=-0.43) USER MOD Single : A 269 THR OG1 : rot 180:sc= -0.636 USER MOD Single : A 274 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 275 SER OG : rot -60:sc= 1.13 USER MOD Single : A 277 HIS : no HD1:sc= -3.26! K(o=-3.3!,f=-4.4) USER MOD Single : A 278 GLN : amide:sc= -0.15 X(o=-0.15,f=-0.15) USER MOD Single : A 280 THR OG1 : rot 28:sc= 0.599 USER MOD Single : A 281 LYS NZ :NH3+ -166:sc= -0.0171 (180deg=-0.268) USER MOD Single : A 283 THR OG1 : rot 37:sc= 0.335 USER MOD Single : A 284 THR OG1 : rot 113:sc= 0.396 USER MOD Single : A 286 GLN : amide:sc= -0.0614 X(o=-0.061,f=-0.061) USER MOD Single : A 288 GLN : amide:sc= 0.0507 K(o=0.051,f=-0.64) USER MOD Single : A 296 SER OG : rot 180:sc= 0 USER MOD Single : A 298 THR OG1 : rot 13:sc= 0.742 USER MOD Single : A 299 THR OG1 : rot 64:sc= 0.572 USER MOD Single : A 301 THR OG1 : rot 180:sc= -1 USER MOD Single : A 305 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 311 ASN : amide:sc= -2.93 K(o=-2.9,f=-5!) USER MOD Single : A 312 THR OG1 : rot 180:sc= 0 USER MOD Single : A 316 SER OG : rot 180:sc= 0 USER MOD Single : A 319 TYR OH : rot 180:sc= 0 USER MOD Single : A 321 ASN :FLIP amide:sc= -0.233 F(o=-4.3!,f=-0.23) USER MOD Single : A 325 LYS NZ :NH3+ -163:sc= -0.0691 (180deg=-0.403) USER MOD Single : A 329 SER OG : rot 60:sc= 0.124 USER MOD Single : A 333 THR OG1 : rot 180:sc= 0 USER MOD Single : A 336 ASN :FLIP amide:sc= -0.104 F(o=-1.8,f=-0.1) USER MOD Single : A 337 LYS NZ :NH3+ -172:sc= -0.0726 (180deg=-0.196) USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 227 15.925 -5.837 6.372 1.00 0.00 N ATOM 49 CA SER A 227 17.135 -5.055 6.184 1.00 0.00 C ATOM 50 C SER A 227 16.775 -3.612 5.849 1.00 0.00 C ATOM 51 O SER A 227 17.383 -2.670 6.358 1.00 0.00 O ATOM 52 CB SER A 227 17.978 -5.665 5.064 1.00 0.00 C ATOM 53 OG SER A 227 18.256 -7.033 5.329 1.00 0.00 O ATOM 0 HA SER A 227 17.715 -5.065 7.107 1.00 0.00 H new ATOM 0 HB2 SER A 227 17.450 -5.574 4.115 1.00 0.00 H new ATOM 0 HB3 SER A 227 18.912 -5.112 4.964 1.00 0.00 H new ATOM 0 HG SER A 227 17.551 -7.406 5.899 1.00 0.00 H new ATOM 59 N LEU A 228 15.710 -3.449 5.074 1.00 0.00 N ATOM 60 CA LEU A 228 15.181 -2.134 4.765 1.00 0.00 C ATOM 61 C LEU A 228 13.847 -1.971 5.460 1.00 0.00 C ATOM 62 O LEU A 228 12.902 -2.693 5.155 1.00 0.00 O ATOM 63 CB LEU A 228 14.994 -1.977 3.257 1.00 0.00 C ATOM 64 CG LEU A 228 16.257 -2.164 2.417 1.00 0.00 C ATOM 65 CD1 LEU A 228 15.943 -1.993 0.941 1.00 0.00 C ATOM 66 CD2 LEU A 228 17.338 -1.185 2.845 1.00 0.00 C ATOM 0 H LEU A 228 15.195 -4.219 4.647 1.00 0.00 H new ATOM 0 HA LEU A 228 15.881 -1.372 5.109 1.00 0.00 H new ATOM 0 HB2 LEU A 228 14.247 -2.697 2.924 1.00 0.00 H new ATOM 0 HB3 LEU A 228 14.590 -0.984 3.059 1.00 0.00 H new ATOM 0 HG LEU A 228 16.628 -3.176 2.579 1.00 0.00 H new ATOM 0 HD11 LEU A 228 16.853 -2.129 0.357 1.00 0.00 H new ATOM 0 HD12 LEU A 228 15.203 -2.734 0.638 1.00 0.00 H new ATOM 0 HD13 LEU A 228 15.547 -0.993 0.767 1.00 0.00 H new ATOM 0 HD21 LEU A 228 18.228 -1.336 2.234 1.00 0.00 H new ATOM 0 HD22 LEU A 228 16.977 -0.165 2.715 1.00 0.00 H new ATOM 0 HD23 LEU A 228 17.585 -1.351 3.893 1.00 0.00 H new ATOM 78 N THR A 229 13.765 -1.067 6.419 1.00 0.00 N ATOM 79 CA THR A 229 12.520 -0.899 7.154 1.00 0.00 C ATOM 80 C THR A 229 12.000 0.516 7.006 1.00 0.00 C ATOM 81 O THR A 229 12.627 1.332 6.340 1.00 0.00 O ATOM 82 CB THR A 229 12.713 -1.266 8.627 1.00 0.00 C ATOM 83 OG1 THR A 229 13.783 -0.532 9.195 1.00 0.00 O ATOM 84 CG2 THR A 229 12.997 -2.735 8.848 1.00 0.00 C ATOM 0 H THR A 229 14.525 -0.450 6.704 1.00 0.00 H new ATOM 0 HA THR A 229 11.775 -1.575 6.734 1.00 0.00 H new ATOM 0 HB THR A 229 11.767 -1.019 9.108 1.00 0.00 H new ATOM 0 HG1 THR A 229 13.887 -0.781 10.137 1.00 0.00 H new ATOM 0 HG21 THR A 229 13.123 -2.925 9.914 1.00 0.00 H new ATOM 0 HG22 THR A 229 12.164 -3.328 8.470 1.00 0.00 H new ATOM 0 HG23 THR A 229 13.909 -3.013 8.320 1.00 0.00 H new ATOM 92 N VAL A 230 10.839 0.798 7.590 1.00 0.00 N ATOM 93 CA VAL A 230 10.226 2.120 7.483 1.00 0.00 C ATOM 94 C VAL A 230 9.378 2.429 8.716 1.00 0.00 C ATOM 95 O VAL A 230 8.544 1.613 9.134 1.00 0.00 O ATOM 96 CB VAL A 230 9.342 2.246 6.218 1.00 0.00 C ATOM 97 CG1 VAL A 230 8.671 3.609 6.150 1.00 0.00 C ATOM 98 CG2 VAL A 230 10.142 2.016 4.960 1.00 0.00 C ATOM 0 H VAL A 230 10.303 0.129 8.143 1.00 0.00 H new ATOM 0 HA VAL A 230 11.043 2.838 7.410 1.00 0.00 H new ATOM 0 HB VAL A 230 8.574 1.476 6.290 1.00 0.00 H new ATOM 0 HG11 VAL A 230 8.057 3.668 5.251 1.00 0.00 H new ATOM 0 HG12 VAL A 230 8.042 3.749 7.029 1.00 0.00 H new ATOM 0 HG13 VAL A 230 9.432 4.388 6.121 1.00 0.00 H new ATOM 0 HG21 VAL A 230 9.490 2.112 4.092 1.00 0.00 H new ATOM 0 HG22 VAL A 230 10.941 2.754 4.897 1.00 0.00 H new ATOM 0 HG23 VAL A 230 10.573 1.015 4.981 1.00 0.00 H new ATOM 108 N SER A 231 9.536 3.643 9.235 1.00 0.00 N ATOM 109 CA SER A 231 8.733 4.116 10.351 1.00 0.00 C ATOM 110 C SER A 231 7.581 4.973 9.839 1.00 0.00 C ATOM 111 O SER A 231 7.664 5.565 8.762 1.00 0.00 O ATOM 112 CB SER A 231 9.600 4.921 11.325 1.00 0.00 C ATOM 113 OG SER A 231 8.846 5.382 12.439 1.00 0.00 O ATOM 0 H SER A 231 10.219 4.320 8.895 1.00 0.00 H new ATOM 0 HA SER A 231 8.324 3.255 10.879 1.00 0.00 H new ATOM 0 HB2 SER A 231 10.426 4.302 11.675 1.00 0.00 H new ATOM 0 HB3 SER A 231 10.039 5.772 10.804 1.00 0.00 H new ATOM 0 HG SER A 231 9.429 5.890 13.041 1.00 0.00 H new ATOM 119 N GLY A 232 6.498 5.014 10.597 1.00 0.00 N ATOM 120 CA GLY A 232 5.340 5.773 10.180 1.00 0.00 C ATOM 121 C GLY A 232 4.206 4.868 9.765 1.00 0.00 C ATOM 122 O GLY A 232 4.403 3.955 8.964 1.00 0.00 O ATOM 0 H GLY A 232 6.400 4.536 11.493 1.00 0.00 H new ATOM 0 HA2 GLY A 232 5.013 6.417 10.996 1.00 0.00 H new ATOM 0 HA3 GLY A 232 5.610 6.424 9.349 1.00 0.00 H new ATOM 126 N GLN A 233 3.035 5.083 10.345 1.00 0.00 N ATOM 127 CA GLN A 233 1.880 4.241 10.065 1.00 0.00 C ATOM 128 C GLN A 233 1.014 4.865 8.979 1.00 0.00 C ATOM 129 O GLN A 233 0.290 5.827 9.236 1.00 0.00 O ATOM 130 CB GLN A 233 1.042 4.051 11.332 1.00 0.00 C ATOM 131 CG GLN A 233 1.821 3.490 12.510 1.00 0.00 C ATOM 132 CD GLN A 233 0.945 3.266 13.726 1.00 0.00 C ATOM 133 OE1 GLN A 233 -0.018 2.504 13.672 1.00 0.00 O ATOM 134 NE2 GLN A 233 1.270 3.930 14.823 1.00 0.00 N ATOM 0 H GLN A 233 2.859 5.833 11.013 1.00 0.00 H new ATOM 0 HA GLN A 233 2.242 3.272 9.721 1.00 0.00 H new ATOM 0 HB2 GLN A 233 0.612 5.011 11.618 1.00 0.00 H new ATOM 0 HB3 GLN A 233 0.210 3.383 11.108 1.00 0.00 H new ATOM 0 HG2 GLN A 233 2.284 2.547 12.220 1.00 0.00 H new ATOM 0 HG3 GLN A 233 2.628 4.175 12.768 1.00 0.00 H new ATOM 0 HE21 GLN A 233 2.078 4.552 14.822 1.00 0.00 H new ATOM 0 HE22 GLN A 233 0.712 3.820 15.670 1.00 0.00 H new ATOM 143 N PRO A 234 1.101 4.365 7.740 1.00 0.00 N ATOM 144 CA PRO A 234 0.348 4.913 6.629 1.00 0.00 C ATOM 145 C PRO A 234 -0.939 4.141 6.363 1.00 0.00 C ATOM 146 O PRO A 234 -0.907 2.949 6.055 1.00 0.00 O ATOM 147 CB PRO A 234 1.325 4.738 5.467 1.00 0.00 C ATOM 148 CG PRO A 234 2.167 3.543 5.824 1.00 0.00 C ATOM 149 CD PRO A 234 1.967 3.265 7.300 1.00 0.00 C ATOM 0 HA PRO A 234 0.025 5.940 6.802 1.00 0.00 H new ATOM 0 HB2 PRO A 234 0.794 4.577 4.529 1.00 0.00 H new ATOM 0 HB3 PRO A 234 1.942 5.627 5.336 1.00 0.00 H new ATOM 0 HG2 PRO A 234 1.875 2.678 5.229 1.00 0.00 H new ATOM 0 HG3 PRO A 234 3.218 3.738 5.610 1.00 0.00 H new ATOM 0 HD2 PRO A 234 1.499 2.295 7.466 1.00 0.00 H new ATOM 0 HD3 PRO A 234 2.914 3.259 7.840 1.00 0.00 H new ATOM 157 N GLU A 235 -2.055 4.848 6.344 1.00 0.00 N ATOM 158 CA GLU A 235 -3.317 4.245 5.961 1.00 0.00 C ATOM 159 C GLU A 235 -3.686 4.720 4.571 1.00 0.00 C ATOM 160 O GLU A 235 -3.348 5.841 4.193 1.00 0.00 O ATOM 161 CB GLU A 235 -4.409 4.578 6.984 1.00 0.00 C ATOM 162 CG GLU A 235 -4.656 6.065 7.175 1.00 0.00 C ATOM 163 CD GLU A 235 -5.659 6.341 8.270 1.00 0.00 C ATOM 164 OE1 GLU A 235 -5.989 7.519 8.487 1.00 0.00 O ATOM 165 OE2 GLU A 235 -6.094 5.382 8.934 1.00 0.00 O1- ATOM 0 H GLU A 235 -2.112 5.837 6.589 1.00 0.00 H new ATOM 0 HA GLU A 235 -3.219 3.160 5.945 1.00 0.00 H new ATOM 0 HB2 GLU A 235 -5.340 4.104 6.671 1.00 0.00 H new ATOM 0 HB3 GLU A 235 -4.136 4.141 7.944 1.00 0.00 H new ATOM 0 HG2 GLU A 235 -3.715 6.560 7.414 1.00 0.00 H new ATOM 0 HG3 GLU A 235 -5.014 6.495 6.240 1.00 0.00 H new ATOM 172 N HIS A 236 -4.357 3.881 3.796 1.00 0.00 N ATOM 173 CA HIS A 236 -4.728 4.251 2.444 1.00 0.00 C ATOM 174 C HIS A 236 -6.162 3.865 2.213 1.00 0.00 C ATOM 175 O HIS A 236 -6.560 2.746 2.521 1.00 0.00 O ATOM 176 CB HIS A 236 -3.853 3.562 1.378 1.00 0.00 C ATOM 177 CG HIS A 236 -2.395 3.945 1.363 1.00 0.00 C ATOM 178 ND1 HIS A 236 -1.509 3.463 0.421 1.00 0.00 N ATOM 179 CD2 HIS A 236 -1.667 4.755 2.168 1.00 0.00 C ATOM 180 CE1 HIS A 236 -0.309 3.958 0.652 1.00 0.00 C ATOM 181 NE2 HIS A 236 -0.376 4.745 1.706 1.00 0.00 N ATOM 0 H HIS A 236 -4.653 2.947 4.080 1.00 0.00 H new ATOM 0 HA HIS A 236 -4.581 5.327 2.346 1.00 0.00 H new ATOM 0 HB2 HIS A 236 -3.922 2.484 1.523 1.00 0.00 H new ATOM 0 HB3 HIS A 236 -4.274 3.779 0.396 1.00 0.00 H new ATOM 0 HD1 HIS A 236 -1.746 2.823 -0.337 1.00 0.00 H new ATOM 0 HD2 HIS A 236 -2.036 5.308 3.019 1.00 0.00 H new ATOM 0 HE1 HIS A 236 0.580 3.753 0.074 1.00 0.00 H new ATOM 190 N LYS A 237 -6.948 4.787 1.701 1.00 0.00 N ATOM 191 CA LYS A 237 -8.345 4.505 1.472 1.00 0.00 C ATOM 192 C LYS A 237 -8.574 4.305 -0.018 1.00 0.00 C ATOM 193 O LYS A 237 -7.632 4.440 -0.803 1.00 0.00 O ATOM 194 CB LYS A 237 -9.251 5.623 2.004 1.00 0.00 C ATOM 195 CG LYS A 237 -8.843 6.253 3.348 1.00 0.00 C ATOM 196 CD LYS A 237 -8.271 5.281 4.391 1.00 0.00 C ATOM 197 CE LYS A 237 -9.039 3.976 4.497 1.00 0.00 C ATOM 198 NZ LYS A 237 -8.730 3.246 5.753 1.00 0.00 N1+ ATOM 0 H LYS A 237 -6.648 5.726 1.439 1.00 0.00 H new ATOM 0 HA LYS A 237 -8.605 3.597 2.016 1.00 0.00 H new ATOM 0 HB2 LYS A 237 -9.294 6.414 1.255 1.00 0.00 H new ATOM 0 HB3 LYS A 237 -10.261 5.225 2.106 1.00 0.00 H new ATOM 0 HG2 LYS A 237 -8.101 7.028 3.155 1.00 0.00 H new ATOM 0 HG3 LYS A 237 -9.715 6.746 3.777 1.00 0.00 H new ATOM 0 HD2 LYS A 237 -7.233 5.062 4.139 1.00 0.00 H new ATOM 0 HD3 LYS A 237 -8.266 5.769 5.365 1.00 0.00 H new ATOM 0 HE2 LYS A 237 -10.109 4.181 4.451 1.00 0.00 H new ATOM 0 HE3 LYS A 237 -8.798 3.344 3.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 -9.276 2.361 5.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 -7.714 3.027 5.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 -8.983 3.838 6.570 1.00 0.00 H new ATOM 416 N GLN A 252 -3.436 7.893 1.183 1.00 0.00 N ATOM 417 CA GLN A 252 -2.037 7.808 0.747 1.00 0.00 C ATOM 418 C GLN A 252 -1.187 8.893 1.404 1.00 0.00 C ATOM 419 O GLN A 252 -1.691 9.699 2.188 1.00 0.00 O ATOM 420 CB GLN A 252 -1.949 7.907 -0.769 1.00 0.00 C ATOM 421 CG GLN A 252 -2.723 6.813 -1.475 1.00 0.00 C ATOM 422 CD GLN A 252 -2.724 6.985 -2.977 1.00 0.00 C ATOM 423 OE1 GLN A 252 -3.309 6.184 -3.705 1.00 0.00 O ATOM 424 NE2 GLN A 252 -2.056 8.027 -3.451 1.00 0.00 N ATOM 0 HA GLN A 252 -1.644 6.840 1.059 1.00 0.00 H new ATOM 0 HB2 GLN A 252 -2.329 8.878 -1.088 1.00 0.00 H new ATOM 0 HB3 GLN A 252 -0.903 7.859 -1.072 1.00 0.00 H new ATOM 0 HG2 GLN A 252 -2.290 5.845 -1.223 1.00 0.00 H new ATOM 0 HG3 GLN A 252 -3.751 6.807 -1.112 1.00 0.00 H new ATOM 0 HE21 GLN A 252 -1.586 8.666 -2.810 1.00 0.00 H new ATOM 0 HE22 GLN A 252 -2.012 8.190 -4.457 1.00 0.00 H new ATOM 433 N GLY A 253 0.101 8.915 1.102 1.00 0.00 N ATOM 434 CA GLY A 253 0.953 9.922 1.705 1.00 0.00 C ATOM 435 C GLY A 253 2.411 9.536 1.728 1.00 0.00 C ATOM 436 O GLY A 253 2.821 8.591 1.056 1.00 0.00 O ATOM 0 H GLY A 253 0.566 8.269 0.464 1.00 0.00 H new ATOM 0 HA2 GLY A 253 0.841 10.858 1.157 1.00 0.00 H new ATOM 0 HA3 GLY A 253 0.618 10.108 2.725 1.00 0.00 H new ATOM 440 N THR A 254 3.200 10.302 2.468 1.00 0.00 N ATOM 441 CA THR A 254 4.635 10.080 2.545 1.00 0.00 C ATOM 442 C THR A 254 5.013 9.320 3.813 1.00 0.00 C ATOM 443 O THR A 254 4.361 9.457 4.853 1.00 0.00 O ATOM 444 CB THR A 254 5.375 11.420 2.501 1.00 0.00 C ATOM 445 OG1 THR A 254 4.983 12.253 3.580 1.00 0.00 O ATOM 446 CG2 THR A 254 5.140 12.197 1.225 1.00 0.00 C ATOM 0 H THR A 254 2.867 11.088 3.027 1.00 0.00 H new ATOM 0 HA THR A 254 4.928 9.474 1.688 1.00 0.00 H new ATOM 0 HB THR A 254 6.431 11.159 2.564 1.00 0.00 H new ATOM 0 HG1 THR A 254 5.470 13.102 3.532 1.00 0.00 H new ATOM 0 HG21 THR A 254 5.694 13.135 1.263 1.00 0.00 H new ATOM 0 HG22 THR A 254 5.480 11.609 0.373 1.00 0.00 H new ATOM 0 HG23 THR A 254 4.076 12.408 1.118 1.00 0.00 H new ATOM 454 N ILE A 255 6.086 8.545 3.727 1.00 0.00 N ATOM 455 CA ILE A 255 6.586 7.791 4.866 1.00 0.00 C ATOM 456 C ILE A 255 8.058 8.107 5.127 1.00 0.00 C ATOM 457 O ILE A 255 8.805 8.431 4.200 1.00 0.00 O ATOM 458 CB ILE A 255 6.421 6.275 4.640 1.00 0.00 C ATOM 459 CG1 ILE A 255 7.082 5.859 3.322 1.00 0.00 C ATOM 460 CG2 ILE A 255 4.950 5.888 4.646 1.00 0.00 C ATOM 461 CD1 ILE A 255 6.935 4.390 3.006 1.00 0.00 C ATOM 0 H ILE A 255 6.630 8.423 2.873 1.00 0.00 H new ATOM 0 HA ILE A 255 5.999 8.087 5.735 1.00 0.00 H new ATOM 0 HB ILE A 255 6.914 5.748 5.457 1.00 0.00 H new ATOM 0 HG12 ILE A 255 6.649 6.442 2.509 1.00 0.00 H new ATOM 0 HG13 ILE A 255 8.142 6.108 3.363 1.00 0.00 H new ATOM 0 HG21 ILE A 255 4.856 4.814 4.485 1.00 0.00 H new ATOM 0 HG22 ILE A 255 4.509 6.151 5.607 1.00 0.00 H new ATOM 0 HG23 ILE A 255 4.430 6.421 3.850 1.00 0.00 H new ATOM 0 HD11 ILE A 255 7.428 4.171 2.059 1.00 0.00 H new ATOM 0 HD12 ILE A 255 7.394 3.800 3.799 1.00 0.00 H new ATOM 0 HD13 ILE A 255 5.877 4.138 2.932 1.00 0.00 H new ATOM 473 N THR A 256 8.478 7.960 6.376 1.00 0.00 N ATOM 474 CA THR A 256 9.872 8.169 6.747 1.00 0.00 C ATOM 475 C THR A 256 10.587 6.826 6.766 1.00 0.00 C ATOM 476 O THR A 256 10.256 5.958 7.575 1.00 0.00 O ATOM 477 CB THR A 256 9.957 8.829 8.122 1.00 0.00 C ATOM 478 OG1 THR A 256 9.187 10.020 8.154 1.00 0.00 O ATOM 479 CG2 THR A 256 11.372 9.190 8.521 1.00 0.00 C ATOM 0 H THR A 256 7.871 7.696 7.152 1.00 0.00 H new ATOM 0 HA THR A 256 10.348 8.826 6.019 1.00 0.00 H new ATOM 0 HB THR A 256 9.572 8.090 8.825 1.00 0.00 H new ATOM 0 HG1 THR A 256 9.252 10.428 9.043 1.00 0.00 H new ATOM 0 HG21 THR A 256 11.365 9.655 9.507 1.00 0.00 H new ATOM 0 HG22 THR A 256 11.983 8.288 8.550 1.00 0.00 H new ATOM 0 HG23 THR A 256 11.788 9.887 7.794 1.00 0.00 H new ATOM 487 N VAL A 257 11.410 6.573 5.763 1.00 0.00 N ATOM 488 CA VAL A 257 11.941 5.240 5.589 1.00 0.00 C ATOM 489 C VAL A 257 13.255 5.026 6.337 1.00 0.00 C ATOM 490 O VAL A 257 14.168 5.854 6.294 1.00 0.00 O ATOM 491 CB VAL A 257 12.128 4.891 4.090 1.00 0.00 C ATOM 492 CG1 VAL A 257 10.811 5.027 3.344 1.00 0.00 C ATOM 493 CG2 VAL A 257 13.191 5.758 3.438 1.00 0.00 C ATOM 0 H VAL A 257 11.717 7.258 5.073 1.00 0.00 H new ATOM 0 HA VAL A 257 11.200 4.567 6.020 1.00 0.00 H new ATOM 0 HB VAL A 257 12.464 3.856 4.035 1.00 0.00 H new ATOM 0 HG11 VAL A 257 10.961 4.778 2.293 1.00 0.00 H new ATOM 0 HG12 VAL A 257 10.076 4.348 3.776 1.00 0.00 H new ATOM 0 HG13 VAL A 257 10.450 6.052 3.426 1.00 0.00 H new ATOM 0 HG21 VAL A 257 13.292 5.482 2.388 1.00 0.00 H new ATOM 0 HG22 VAL A 257 12.901 6.806 3.512 1.00 0.00 H new ATOM 0 HG23 VAL A 257 14.144 5.609 3.946 1.00 0.00 H new ATOM 503 N SER A 258 13.391 3.821 6.859 1.00 0.00 N ATOM 504 CA SER A 258 14.635 3.335 7.433 1.00 0.00 C ATOM 505 C SER A 258 15.422 2.585 6.360 1.00 0.00 C ATOM 506 O SER A 258 16.364 1.851 6.650 1.00 0.00 O ATOM 507 CB SER A 258 14.359 2.442 8.641 1.00 0.00 C ATOM 508 OG SER A 258 13.623 3.146 9.634 1.00 0.00 O ATOM 0 H SER A 258 12.631 3.142 6.897 1.00 0.00 H new ATOM 0 HA SER A 258 15.229 4.180 7.782 1.00 0.00 H new ATOM 0 HB2 SER A 258 13.802 1.560 8.326 1.00 0.00 H new ATOM 0 HB3 SER A 258 15.301 2.091 9.062 1.00 0.00 H new ATOM 0 HG SER A 258 13.456 2.555 10.398 1.00 0.00 H new ATOM 514 N ALA A 259 14.934 2.677 5.128 1.00 0.00 N ATOM 515 CA ALA A 259 15.503 1.939 4.013 1.00 0.00 C ATOM 516 C ALA A 259 16.429 2.838 3.205 1.00 0.00 C ATOM 517 O ALA A 259 16.507 4.041 3.457 1.00 0.00 O ATOM 518 CB ALA A 259 14.394 1.389 3.127 1.00 0.00 C ATOM 0 H ALA A 259 14.137 3.263 4.878 1.00 0.00 H new ATOM 0 HA ALA A 259 16.083 1.104 4.405 1.00 0.00 H new ATOM 0 HB1 ALA A 259 14.833 0.838 2.295 1.00 0.00 H new ATOM 0 HB2 ALA A 259 13.760 0.721 3.710 1.00 0.00 H new ATOM 0 HB3 ALA A 259 13.795 2.213 2.741 1.00 0.00 H new ATOM 524 N SER A 260 17.102 2.265 2.218 1.00 0.00 N ATOM 525 CA SER A 260 17.991 3.032 1.357 1.00 0.00 C ATOM 526 C SER A 260 17.904 2.549 -0.086 1.00 0.00 C ATOM 527 O SER A 260 17.642 1.372 -0.345 1.00 0.00 O ATOM 528 CB SER A 260 19.431 2.934 1.862 1.00 0.00 C ATOM 529 OG SER A 260 19.856 1.582 1.944 1.00 0.00 O ATOM 0 H SER A 260 17.050 1.271 1.993 1.00 0.00 H new ATOM 0 HA SER A 260 17.676 4.075 1.386 1.00 0.00 H new ATOM 0 HB2 SER A 260 20.092 3.486 1.193 1.00 0.00 H new ATOM 0 HB3 SER A 260 19.508 3.402 2.843 1.00 0.00 H new ATOM 0 HG SER A 260 20.780 1.549 2.268 1.00 0.00 H new ATOM 535 N GLY A 261 18.128 3.463 -1.020 1.00 0.00 N ATOM 536 CA GLY A 261 18.085 3.114 -2.426 1.00 0.00 C ATOM 537 C GLY A 261 16.694 3.216 -3.019 1.00 0.00 C ATOM 538 O GLY A 261 16.353 2.463 -3.933 1.00 0.00 O ATOM 0 H GLY A 261 18.339 4.442 -0.828 1.00 0.00 H new ATOM 0 HA2 GLY A 261 18.758 3.770 -2.978 1.00 0.00 H new ATOM 0 HA3 GLY A 261 18.455 2.097 -2.554 1.00 0.00 H new ATOM 542 N LEU A 262 15.891 4.151 -2.518 1.00 0.00 N ATOM 543 CA LEU A 262 14.544 4.343 -3.038 1.00 0.00 C ATOM 544 C LEU A 262 14.526 5.486 -4.044 1.00 0.00 C ATOM 545 O LEU A 262 15.077 6.561 -3.791 1.00 0.00 O ATOM 546 CB LEU A 262 13.527 4.633 -1.923 1.00 0.00 C ATOM 547 CG LEU A 262 13.465 3.607 -0.787 1.00 0.00 C ATOM 548 CD1 LEU A 262 14.631 3.770 0.171 1.00 0.00 C ATOM 549 CD2 LEU A 262 12.144 3.704 -0.043 1.00 0.00 C ATOM 0 H LEU A 262 16.148 4.782 -1.759 1.00 0.00 H new ATOM 0 HA LEU A 262 14.254 3.412 -3.525 1.00 0.00 H new ATOM 0 HB2 LEU A 262 13.757 5.608 -1.493 1.00 0.00 H new ATOM 0 HB3 LEU A 262 12.537 4.708 -2.372 1.00 0.00 H new ATOM 0 HG LEU A 262 13.537 2.616 -1.234 1.00 0.00 H new ATOM 0 HD11 LEU A 262 14.556 3.027 0.965 1.00 0.00 H new ATOM 0 HD12 LEU A 262 15.568 3.631 -0.369 1.00 0.00 H new ATOM 0 HD13 LEU A 262 14.607 4.769 0.606 1.00 0.00 H new ATOM 0 HD21 LEU A 262 12.123 2.966 0.759 1.00 0.00 H new ATOM 0 HD22 LEU A 262 12.037 4.703 0.380 1.00 0.00 H new ATOM 0 HD23 LEU A 262 11.323 3.513 -0.734 1.00 0.00 H new ATOM 561 N GLN A 263 13.845 5.260 -5.156 1.00 0.00 N ATOM 562 CA GLN A 263 13.684 6.271 -6.190 1.00 0.00 C ATOM 563 C GLN A 263 12.228 6.302 -6.621 1.00 0.00 C ATOM 564 O GLN A 263 11.454 5.418 -6.259 1.00 0.00 O ATOM 565 CB GLN A 263 14.565 5.994 -7.428 1.00 0.00 C ATOM 566 CG GLN A 263 16.070 5.927 -7.169 1.00 0.00 C ATOM 567 CD GLN A 263 16.548 4.599 -6.598 1.00 0.00 C ATOM 568 OE1 GLN A 263 15.661 3.619 -6.524 1.00 0.00 O flip ATOM 569 NE2 GLN A 263 17.724 4.443 -6.263 1.00 0.00 N flip ATOM 0 H GLN A 263 13.389 4.373 -5.368 1.00 0.00 H new ATOM 0 HA GLN A 263 13.995 7.228 -5.770 1.00 0.00 H new ATOM 0 HB2 GLN A 263 14.249 5.050 -7.872 1.00 0.00 H new ATOM 0 HB3 GLN A 263 14.376 6.773 -8.167 1.00 0.00 H new ATOM 0 HG2 GLN A 263 16.597 6.118 -8.104 1.00 0.00 H new ATOM 0 HG3 GLN A 263 16.344 6.726 -6.480 1.00 0.00 H new ATOM 0 HE21 GLN A 263 18.381 5.220 -6.333 1.00 0.00 H new ATOM 0 HE22 GLN A 263 18.040 3.537 -5.916 1.00 0.00 H new ATOM 578 N VAL A 264 11.864 7.275 -7.436 1.00 0.00 N ATOM 579 CA VAL A 264 10.509 7.337 -7.954 1.00 0.00 C ATOM 580 C VAL A 264 10.345 6.346 -9.104 1.00 0.00 C ATOM 581 O VAL A 264 11.223 6.227 -9.959 1.00 0.00 O ATOM 582 CB VAL A 264 10.138 8.750 -8.438 1.00 0.00 C ATOM 583 CG1 VAL A 264 8.674 8.805 -8.847 1.00 0.00 C ATOM 584 CG2 VAL A 264 10.436 9.779 -7.362 1.00 0.00 C ATOM 0 H VAL A 264 12.479 8.025 -7.751 1.00 0.00 H new ATOM 0 HA VAL A 264 9.837 7.077 -7.137 1.00 0.00 H new ATOM 0 HB VAL A 264 10.746 8.986 -9.311 1.00 0.00 H new ATOM 0 HG11 VAL A 264 8.429 9.811 -9.187 1.00 0.00 H new ATOM 0 HG12 VAL A 264 8.495 8.096 -9.655 1.00 0.00 H new ATOM 0 HG13 VAL A 264 8.048 8.548 -7.993 1.00 0.00 H new ATOM 0 HG21 VAL A 264 10.167 10.772 -7.723 1.00 0.00 H new ATOM 0 HG22 VAL A 264 9.857 9.549 -6.468 1.00 0.00 H new ATOM 0 HG23 VAL A 264 11.499 9.756 -7.121 1.00 0.00 H new ATOM 594 N GLY A 265 9.229 5.630 -9.110 1.00 0.00 N ATOM 595 CA GLY A 265 8.989 4.650 -10.149 1.00 0.00 C ATOM 596 C GLY A 265 9.396 3.258 -9.724 1.00 0.00 C ATOM 597 O GLY A 265 9.500 2.353 -10.554 1.00 0.00 O ATOM 0 H GLY A 265 8.487 5.710 -8.415 1.00 0.00 H new ATOM 0 HA2 GLY A 265 7.931 4.653 -10.412 1.00 0.00 H new ATOM 0 HA3 GLY A 265 9.541 4.931 -11.046 1.00 0.00 H new ATOM 601 N ASP A 266 9.598 3.076 -8.423 1.00 0.00 N ATOM 602 CA ASP A 266 9.962 1.774 -7.884 1.00 0.00 C ATOM 603 C ASP A 266 8.723 0.967 -7.543 1.00 0.00 C ATOM 604 O ASP A 266 7.611 1.498 -7.486 1.00 0.00 O ATOM 605 CB ASP A 266 10.859 1.902 -6.646 1.00 0.00 C ATOM 606 CG ASP A 266 12.232 2.454 -6.963 1.00 0.00 C ATOM 607 OD1 ASP A 266 13.037 2.604 -6.023 1.00 0.00 O ATOM 608 OD2 ASP A 266 12.516 2.718 -8.145 1.00 0.00 O1- ATOM 0 H ASP A 266 9.515 3.814 -7.724 1.00 0.00 H new ATOM 0 HA ASP A 266 10.526 1.252 -8.657 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.372 2.551 -5.917 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.966 0.923 -6.179 1.00 0.00 H new ATOM 613 N ALA A 267 8.928 -0.319 -7.321 1.00 0.00 N ATOM 614 CA ALA A 267 7.853 -1.231 -6.984 1.00 0.00 C ATOM 615 C ALA A 267 8.333 -2.209 -5.928 1.00 0.00 C ATOM 616 O ALA A 267 9.383 -2.822 -6.091 1.00 0.00 O ATOM 617 CB ALA A 267 7.396 -1.969 -8.229 1.00 0.00 C ATOM 0 H ALA A 267 9.847 -0.760 -7.370 1.00 0.00 H new ATOM 0 HA ALA A 267 7.007 -0.671 -6.585 1.00 0.00 H new ATOM 0 HB1 ALA A 267 6.588 -2.653 -7.970 1.00 0.00 H new ATOM 0 HB2 ALA A 267 7.041 -1.251 -8.968 1.00 0.00 H new ATOM 0 HB3 ALA A 267 8.231 -2.534 -8.644 1.00 0.00 H new ATOM 623 N PHE A 268 7.658 -2.267 -4.792 1.00 0.00 N ATOM 624 CA PHE A 268 8.164 -3.067 -3.695 1.00 0.00 C ATOM 625 C PHE A 268 7.044 -3.755 -2.939 1.00 0.00 C ATOM 626 O PHE A 268 5.868 -3.488 -3.175 1.00 0.00 O ATOM 627 CB PHE A 268 8.992 -2.185 -2.761 1.00 0.00 C ATOM 628 CG PHE A 268 8.254 -1.016 -2.173 1.00 0.00 C ATOM 629 CD1 PHE A 268 7.199 -1.205 -1.295 1.00 0.00 C ATOM 630 CD2 PHE A 268 8.629 0.277 -2.491 1.00 0.00 C ATOM 631 CE1 PHE A 268 6.541 -0.132 -0.744 1.00 0.00 C ATOM 632 CE2 PHE A 268 7.968 1.356 -1.945 1.00 0.00 C ATOM 633 CZ PHE A 268 6.924 1.147 -1.070 1.00 0.00 C ATOM 0 H PHE A 268 6.780 -1.782 -4.609 1.00 0.00 H new ATOM 0 HA PHE A 268 8.799 -3.852 -4.105 1.00 0.00 H new ATOM 0 HB2 PHE A 268 9.374 -2.801 -1.947 1.00 0.00 H new ATOM 0 HB3 PHE A 268 9.856 -1.811 -3.310 1.00 0.00 H new ATOM 0 HD1 PHE A 268 6.890 -2.208 -1.041 1.00 0.00 H new ATOM 0 HD2 PHE A 268 9.449 0.443 -3.175 1.00 0.00 H new ATOM 0 HE1 PHE A 268 5.724 -0.293 -0.056 1.00 0.00 H new ATOM 0 HE2 PHE A 268 8.267 2.361 -2.202 1.00 0.00 H new ATOM 0 HZ PHE A 268 6.405 1.991 -0.639 1.00 0.00 H new ATOM 643 N THR A 269 7.419 -4.603 -1.996 1.00 0.00 N ATOM 644 CA THR A 269 6.449 -5.286 -1.164 1.00 0.00 C ATOM 645 C THR A 269 6.708 -4.978 0.307 1.00 0.00 C ATOM 646 O THR A 269 7.853 -4.767 0.711 1.00 0.00 O ATOM 647 CB THR A 269 6.516 -6.793 -1.418 1.00 0.00 C ATOM 648 OG1 THR A 269 7.798 -7.303 -1.098 1.00 0.00 O ATOM 649 CG2 THR A 269 6.224 -7.172 -2.856 1.00 0.00 C ATOM 0 H THR A 269 8.391 -4.834 -1.789 1.00 0.00 H new ATOM 0 HA THR A 269 5.449 -4.933 -1.418 1.00 0.00 H new ATOM 0 HB THR A 269 5.747 -7.224 -0.777 1.00 0.00 H new ATOM 0 HG1 THR A 269 7.817 -8.268 -1.266 1.00 0.00 H new ATOM 0 HG21 THR A 269 6.288 -8.254 -2.967 1.00 0.00 H new ATOM 0 HG22 THR A 269 5.221 -6.838 -3.124 1.00 0.00 H new ATOM 0 HG23 THR A 269 6.952 -6.696 -3.513 1.00 0.00 H new ATOM 657 N ILE A 270 5.649 -4.951 1.100 1.00 0.00 N ATOM 658 CA ILE A 270 5.765 -4.668 2.525 1.00 0.00 C ATOM 659 C ILE A 270 5.392 -5.889 3.363 1.00 0.00 C ATOM 660 O ILE A 270 4.417 -6.581 3.067 1.00 0.00 O ATOM 661 CB ILE A 270 4.892 -3.455 2.926 1.00 0.00 C ATOM 662 CG1 ILE A 270 5.500 -2.161 2.378 1.00 0.00 C ATOM 663 CG2 ILE A 270 4.702 -3.368 4.432 1.00 0.00 C ATOM 664 CD1 ILE A 270 4.766 -0.911 2.815 1.00 0.00 C ATOM 0 H ILE A 270 4.695 -5.122 0.781 1.00 0.00 H new ATOM 0 HA ILE A 270 6.808 -4.422 2.724 1.00 0.00 H new ATOM 0 HB ILE A 270 3.905 -3.595 2.485 1.00 0.00 H new ATOM 0 HG12 ILE A 270 6.539 -2.093 2.701 1.00 0.00 H new ATOM 0 HG13 ILE A 270 5.507 -2.206 1.289 1.00 0.00 H new ATOM 0 HG21 ILE A 270 4.083 -2.503 4.671 1.00 0.00 H new ATOM 0 HG22 ILE A 270 4.213 -4.274 4.790 1.00 0.00 H new ATOM 0 HG23 ILE A 270 5.673 -3.265 4.916 1.00 0.00 H new ATOM 0 HD11 ILE A 270 5.254 -0.035 2.388 1.00 0.00 H new ATOM 0 HD12 ILE A 270 3.733 -0.956 2.469 1.00 0.00 H new ATOM 0 HD13 ILE A 270 4.782 -0.841 3.903 1.00 0.00 H new ATOM 676 N ALA A 271 6.182 -6.140 4.408 1.00 0.00 N ATOM 677 CA ALA A 271 5.954 -7.269 5.305 1.00 0.00 C ATOM 678 C ALA A 271 4.602 -7.161 6.000 1.00 0.00 C ATOM 679 O ALA A 271 4.252 -6.109 6.541 1.00 0.00 O ATOM 680 CB ALA A 271 7.070 -7.353 6.336 1.00 0.00 C ATOM 0 H ALA A 271 6.991 -5.570 4.654 1.00 0.00 H new ATOM 0 HA ALA A 271 5.951 -8.180 4.706 1.00 0.00 H new ATOM 0 HB1 ALA A 271 6.889 -8.199 7.000 1.00 0.00 H new ATOM 0 HB2 ALA A 271 8.025 -7.488 5.828 1.00 0.00 H new ATOM 0 HB3 ALA A 271 7.096 -6.433 6.920 1.00 0.00 H new ATOM 686 N GLY A 272 3.838 -8.242 5.962 1.00 0.00 N ATOM 687 CA GLY A 272 2.519 -8.252 6.568 1.00 0.00 C ATOM 688 C GLY A 272 1.437 -7.863 5.584 1.00 0.00 C ATOM 689 O GLY A 272 0.278 -8.247 5.737 1.00 0.00 O ATOM 0 H GLY A 272 4.109 -9.120 5.519 1.00 0.00 H new ATOM 0 HA2 GLY A 272 2.309 -9.246 6.962 1.00 0.00 H new ATOM 0 HA3 GLY A 272 2.504 -7.564 7.413 1.00 0.00 H new ATOM 693 N VAL A 273 1.827 -7.143 4.544 1.00 0.00 N ATOM 694 CA VAL A 273 0.903 -6.751 3.491 1.00 0.00 C ATOM 695 C VAL A 273 0.982 -7.733 2.325 1.00 0.00 C ATOM 696 O VAL A 273 1.933 -7.712 1.542 1.00 0.00 O ATOM 697 CB VAL A 273 1.218 -5.334 2.978 1.00 0.00 C ATOM 698 CG1 VAL A 273 0.229 -4.906 1.907 1.00 0.00 C ATOM 699 CG2 VAL A 273 1.227 -4.333 4.123 1.00 0.00 C ATOM 0 H VAL A 273 2.783 -6.816 4.406 1.00 0.00 H new ATOM 0 HA VAL A 273 -0.102 -6.760 3.912 1.00 0.00 H new ATOM 0 HB VAL A 273 2.212 -5.357 2.532 1.00 0.00 H new ATOM 0 HG11 VAL A 273 0.476 -3.901 1.564 1.00 0.00 H new ATOM 0 HG12 VAL A 273 0.279 -5.599 1.067 1.00 0.00 H new ATOM 0 HG13 VAL A 273 -0.779 -4.910 2.321 1.00 0.00 H new ATOM 0 HG21 VAL A 273 1.452 -3.339 3.736 1.00 0.00 H new ATOM 0 HG22 VAL A 273 0.249 -4.322 4.604 1.00 0.00 H new ATOM 0 HG23 VAL A 273 1.986 -4.619 4.851 1.00 0.00 H new ATOM 709 N ASN A 274 -0.003 -8.611 2.233 1.00 0.00 N ATOM 710 CA ASN A 274 -0.022 -9.623 1.186 1.00 0.00 C ATOM 711 C ASN A 274 -1.261 -9.464 0.326 1.00 0.00 C ATOM 712 O ASN A 274 -2.282 -8.963 0.793 1.00 0.00 O ATOM 713 CB ASN A 274 0.023 -11.015 1.809 1.00 0.00 C ATOM 714 CG ASN A 274 1.270 -11.204 2.641 1.00 0.00 C ATOM 715 OD1 ASN A 274 2.383 -11.213 2.117 1.00 0.00 O ATOM 716 ND2 ASN A 274 1.096 -11.316 3.947 1.00 0.00 N ATOM 0 H ASN A 274 -0.800 -8.645 2.869 1.00 0.00 H new ATOM 0 HA ASN A 274 0.855 -9.495 0.552 1.00 0.00 H new ATOM 0 HB2 ASN A 274 -0.859 -11.166 2.432 1.00 0.00 H new ATOM 0 HB3 ASN A 274 -0.010 -11.769 1.023 1.00 0.00 H new ATOM 0 HD21 ASN A 274 1.903 -11.415 4.562 1.00 0.00 H new ATOM 0 HD22 ASN A 274 0.154 -11.304 4.339 1.00 0.00 H new ATOM 723 N SER A 275 -1.151 -9.828 -0.944 1.00 0.00 N ATOM 724 CA SER A 275 -2.253 -9.655 -1.874 1.00 0.00 C ATOM 725 C SER A 275 -3.265 -10.780 -1.752 1.00 0.00 C ATOM 726 O SER A 275 -2.972 -11.854 -1.215 1.00 0.00 O ATOM 727 CB SER A 275 -1.755 -9.568 -3.316 1.00 0.00 C ATOM 728 OG SER A 275 -1.031 -10.733 -3.692 1.00 0.00 O ATOM 0 H SER A 275 -0.313 -10.243 -1.351 1.00 0.00 H new ATOM 0 HA SER A 275 -2.742 -8.716 -1.613 1.00 0.00 H new ATOM 0 HB2 SER A 275 -2.604 -9.434 -3.987 1.00 0.00 H new ATOM 0 HB3 SER A 275 -1.118 -8.691 -3.429 1.00 0.00 H new ATOM 0 HG SER A 275 -0.251 -10.836 -3.108 1.00 0.00 H new ATOM 734 N VAL A 276 -4.447 -10.524 -2.275 1.00 0.00 N ATOM 735 CA VAL A 276 -5.525 -11.489 -2.253 1.00 0.00 C ATOM 736 C VAL A 276 -5.839 -11.984 -3.654 1.00 0.00 C ATOM 737 O VAL A 276 -5.213 -11.551 -4.628 1.00 0.00 O ATOM 738 CB VAL A 276 -6.802 -10.887 -1.639 1.00 0.00 C ATOM 739 CG1 VAL A 276 -6.572 -10.508 -0.188 1.00 0.00 C ATOM 740 CG2 VAL A 276 -7.268 -9.676 -2.437 1.00 0.00 C ATOM 0 H VAL A 276 -4.686 -9.641 -2.727 1.00 0.00 H new ATOM 0 HA VAL A 276 -5.192 -12.325 -1.638 1.00 0.00 H new ATOM 0 HB VAL A 276 -7.585 -11.645 -1.678 1.00 0.00 H new ATOM 0 HG11 VAL A 276 -7.487 -10.085 0.227 1.00 0.00 H new ATOM 0 HG12 VAL A 276 -6.293 -11.395 0.380 1.00 0.00 H new ATOM 0 HG13 VAL A 276 -5.771 -9.771 -0.127 1.00 0.00 H new ATOM 0 HG21 VAL A 276 -8.172 -9.268 -1.984 1.00 0.00 H new ATOM 0 HG22 VAL A 276 -6.486 -8.916 -2.435 1.00 0.00 H new ATOM 0 HG23 VAL A 276 -7.480 -9.976 -3.463 1.00 0.00 H new ATOM 750 N HIS A 277 -6.832 -12.867 -3.732 1.00 0.00 N ATOM 751 CA HIS A 277 -7.313 -13.420 -4.995 1.00 0.00 C ATOM 752 C HIS A 277 -7.439 -12.346 -6.070 1.00 0.00 C ATOM 753 O HIS A 277 -8.213 -11.400 -5.938 1.00 0.00 O ATOM 754 CB HIS A 277 -8.667 -14.108 -4.790 1.00 0.00 C ATOM 755 CG HIS A 277 -9.716 -13.240 -4.151 1.00 0.00 C ATOM 756 ND1 HIS A 277 -9.640 -12.799 -2.846 1.00 0.00 N ATOM 757 CD2 HIS A 277 -10.850 -12.704 -4.659 1.00 0.00 C ATOM 758 CE1 HIS A 277 -10.680 -12.030 -2.581 1.00 0.00 C ATOM 759 NE2 HIS A 277 -11.429 -11.956 -3.665 1.00 0.00 N ATOM 0 H HIS A 277 -7.329 -13.221 -2.915 1.00 0.00 H new ATOM 0 HA HIS A 277 -6.579 -14.151 -5.334 1.00 0.00 H new ATOM 0 HB2 HIS A 277 -9.036 -14.451 -5.757 1.00 0.00 H new ATOM 0 HB3 HIS A 277 -8.521 -14.994 -4.172 1.00 0.00 H new ATOM 0 HD2 HIS A 277 -11.229 -12.840 -5.661 1.00 0.00 H new ATOM 0 HE1 HIS A 277 -10.883 -11.544 -1.638 1.00 0.00 H new ATOM 0 HE2 HIS A 277 -12.298 -11.428 -3.750 1.00 0.00 H new ATOM 768 N GLN A 278 -6.641 -12.477 -7.113 1.00 0.00 N ATOM 769 CA GLN A 278 -6.634 -11.501 -8.182 1.00 0.00 C ATOM 770 C GLN A 278 -7.752 -11.788 -9.184 1.00 0.00 C ATOM 771 O GLN A 278 -8.354 -10.863 -9.735 1.00 0.00 O ATOM 772 CB GLN A 278 -5.267 -11.496 -8.873 1.00 0.00 C ATOM 773 CG GLN A 278 -5.105 -10.408 -9.919 1.00 0.00 C ATOM 774 CD GLN A 278 -5.264 -9.018 -9.338 1.00 0.00 C ATOM 775 OE1 GLN A 278 -4.538 -8.627 -8.423 1.00 0.00 O ATOM 776 NE2 GLN A 278 -6.214 -8.265 -9.866 1.00 0.00 N ATOM 0 H GLN A 278 -5.989 -13.251 -7.241 1.00 0.00 H new ATOM 0 HA GLN A 278 -6.814 -10.513 -7.758 1.00 0.00 H new ATOM 0 HB2 GLN A 278 -4.490 -11.377 -8.117 1.00 0.00 H new ATOM 0 HB3 GLN A 278 -5.107 -12.465 -9.345 1.00 0.00 H new ATOM 0 HG2 GLN A 278 -4.121 -10.495 -10.380 1.00 0.00 H new ATOM 0 HG3 GLN A 278 -5.842 -10.555 -10.709 1.00 0.00 H new ATOM 0 HE21 GLN A 278 -6.792 -8.630 -10.623 1.00 0.00 H new ATOM 0 HE22 GLN A 278 -6.369 -7.319 -9.516 1.00 0.00 H new ATOM 785 N ILE A 279 -7.990 -13.070 -9.464 1.00 0.00 N ATOM 786 CA ILE A 279 -8.992 -13.447 -10.457 1.00 0.00 C ATOM 787 C ILE A 279 -10.247 -14.038 -9.797 1.00 0.00 C ATOM 788 O ILE A 279 -11.284 -13.380 -9.747 1.00 0.00 O ATOM 789 CB ILE A 279 -8.448 -14.443 -11.527 1.00 0.00 C ATOM 790 CG1 ILE A 279 -7.241 -13.879 -12.295 1.00 0.00 C ATOM 791 CG2 ILE A 279 -9.539 -14.796 -12.527 1.00 0.00 C ATOM 792 CD1 ILE A 279 -5.957 -13.795 -11.500 1.00 0.00 C ATOM 0 H ILE A 279 -7.509 -13.854 -9.023 1.00 0.00 H new ATOM 0 HA ILE A 279 -9.256 -12.522 -10.969 1.00 0.00 H new ATOM 0 HB ILE A 279 -8.125 -15.332 -10.986 1.00 0.00 H new ATOM 0 HG12 ILE A 279 -7.066 -14.500 -13.173 1.00 0.00 H new ATOM 0 HG13 ILE A 279 -7.493 -12.882 -12.655 1.00 0.00 H new ATOM 0 HG21 ILE A 279 -9.143 -15.492 -13.267 1.00 0.00 H new ATOM 0 HG22 ILE A 279 -10.376 -15.259 -12.004 1.00 0.00 H new ATOM 0 HG23 ILE A 279 -9.881 -13.890 -13.027 1.00 0.00 H new ATOM 0 HD11 ILE A 279 -5.166 -13.385 -12.128 1.00 0.00 H new ATOM 0 HD12 ILE A 279 -6.106 -13.148 -10.636 1.00 0.00 H new ATOM 0 HD13 ILE A 279 -5.672 -14.791 -11.162 1.00 0.00 H new ATOM 804 N THR A 280 -10.199 -15.321 -9.431 1.00 0.00 N ATOM 805 CA THR A 280 -11.395 -16.017 -8.948 1.00 0.00 C ATOM 806 C THR A 280 -11.175 -16.708 -7.600 1.00 0.00 C ATOM 807 O THR A 280 -11.162 -17.941 -7.526 1.00 0.00 O ATOM 808 CB THR A 280 -11.837 -17.051 -9.985 1.00 0.00 C ATOM 809 OG1 THR A 280 -10.755 -17.899 -10.336 1.00 0.00 O ATOM 810 CG2 THR A 280 -12.386 -16.445 -11.259 1.00 0.00 C ATOM 0 H THR A 280 -9.356 -15.894 -9.459 1.00 0.00 H new ATOM 0 HA THR A 280 -12.169 -15.264 -8.802 1.00 0.00 H new ATOM 0 HB THR A 280 -12.641 -17.609 -9.505 1.00 0.00 H new ATOM 0 HG1 THR A 280 -10.129 -17.959 -9.584 1.00 0.00 H new ATOM 0 HG21 THR A 280 -12.678 -17.241 -11.944 1.00 0.00 H new ATOM 0 HG22 THR A 280 -13.256 -15.831 -11.025 1.00 0.00 H new ATOM 0 HG23 THR A 280 -11.620 -15.826 -11.727 1.00 0.00 H new ATOM 818 N LYS A 281 -11.046 -15.916 -6.534 1.00 0.00 N ATOM 819 CA LYS A 281 -10.865 -16.448 -5.176 1.00 0.00 C ATOM 820 C LYS A 281 -9.683 -17.421 -5.126 1.00 0.00 C ATOM 821 O LYS A 281 -9.723 -18.440 -4.432 1.00 0.00 O ATOM 822 CB LYS A 281 -12.147 -17.132 -4.678 1.00 0.00 C ATOM 823 CG LYS A 281 -13.368 -16.218 -4.663 1.00 0.00 C ATOM 824 CD LYS A 281 -13.182 -15.021 -3.737 1.00 0.00 C ATOM 825 CE LYS A 281 -13.070 -15.438 -2.277 1.00 0.00 C ATOM 826 NZ LYS A 281 -14.301 -16.125 -1.804 1.00 0.00 N1+ ATOM 0 H LYS A 281 -11.063 -14.897 -6.583 1.00 0.00 H new ATOM 0 HA LYS A 281 -10.648 -15.610 -4.514 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -12.358 -17.993 -5.312 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -11.977 -17.512 -3.671 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -13.567 -15.865 -5.675 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -14.242 -16.787 -4.346 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -12.285 -14.475 -4.027 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -14.023 -14.338 -3.855 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -12.213 -16.100 -2.153 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -12.885 -14.558 -1.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -14.290 -16.182 -0.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -15.138 -15.590 -2.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -14.338 -17.085 -2.203 1.00 0.00 H new ATOM 840 N ASP A 282 -8.656 -17.109 -5.915 1.00 0.00 N ATOM 841 CA ASP A 282 -7.464 -17.948 -6.038 1.00 0.00 C ATOM 842 C ASP A 282 -6.633 -17.933 -4.760 1.00 0.00 C ATOM 843 O ASP A 282 -6.896 -17.158 -3.840 1.00 0.00 O ATOM 844 CB ASP A 282 -6.602 -17.470 -7.208 1.00 0.00 C ATOM 845 CG ASP A 282 -7.308 -17.565 -8.542 1.00 0.00 C ATOM 846 OD1 ASP A 282 -6.730 -17.117 -9.550 1.00 0.00 O ATOM 847 OD2 ASP A 282 -8.427 -18.103 -8.592 1.00 0.00 O1- ATOM 0 H ASP A 282 -8.627 -16.266 -6.488 1.00 0.00 H new ATOM 0 HA ASP A 282 -7.799 -18.970 -6.218 1.00 0.00 H new ATOM 0 HB2 ASP A 282 -6.305 -16.436 -7.034 1.00 0.00 H new ATOM 0 HB3 ASP A 282 -5.688 -18.063 -7.244 1.00 0.00 H new ATOM 852 N THR A 283 -5.598 -18.760 -4.732 1.00 0.00 N ATOM 853 CA THR A 283 -4.693 -18.826 -3.595 1.00 0.00 C ATOM 854 C THR A 283 -3.380 -18.127 -3.926 1.00 0.00 C ATOM 855 O THR A 283 -2.640 -18.552 -4.816 1.00 0.00 O ATOM 856 CB THR A 283 -4.452 -20.289 -3.198 1.00 0.00 C ATOM 857 OG1 THR A 283 -3.919 -21.029 -4.285 1.00 0.00 O ATOM 858 CG2 THR A 283 -5.708 -21.000 -2.743 1.00 0.00 C ATOM 0 H THR A 283 -5.363 -19.400 -5.491 1.00 0.00 H new ATOM 0 HA THR A 283 -5.147 -18.312 -2.748 1.00 0.00 H new ATOM 0 HB THR A 283 -3.749 -20.245 -2.366 1.00 0.00 H new ATOM 0 HG1 THR A 283 -3.302 -20.463 -4.795 1.00 0.00 H new ATOM 0 HG21 THR A 283 -5.467 -22.029 -2.477 1.00 0.00 H new ATOM 0 HG22 THR A 283 -6.121 -20.488 -1.874 1.00 0.00 H new ATOM 0 HG23 THR A 283 -6.441 -20.995 -3.550 1.00 0.00 H new ATOM 866 N THR A 284 -3.153 -16.988 -3.297 1.00 0.00 N ATOM 867 CA THR A 284 -2.002 -16.171 -3.625 1.00 0.00 C ATOM 868 C THR A 284 -1.043 -16.064 -2.436 1.00 0.00 C ATOM 869 O THR A 284 -0.033 -16.768 -2.386 1.00 0.00 O ATOM 870 CB THR A 284 -2.484 -14.800 -4.113 1.00 0.00 C ATOM 871 OG1 THR A 284 -3.296 -14.166 -3.134 1.00 0.00 O ATOM 872 CG2 THR A 284 -3.305 -14.892 -5.384 1.00 0.00 C ATOM 0 H THR A 284 -3.748 -16.610 -2.560 1.00 0.00 H new ATOM 0 HA THR A 284 -1.435 -16.641 -4.429 1.00 0.00 H new ATOM 0 HB THR A 284 -1.579 -14.223 -4.304 1.00 0.00 H new ATOM 0 HG1 THR A 284 -2.834 -13.374 -2.789 1.00 0.00 H new ATOM 0 HG21 THR A 284 -3.621 -13.894 -5.686 1.00 0.00 H new ATOM 0 HG22 THR A 284 -2.702 -15.337 -6.175 1.00 0.00 H new ATOM 0 HG23 THR A 284 -4.183 -15.512 -5.206 1.00 0.00 H new ATOM 880 N GLY A 285 -1.392 -15.242 -1.452 1.00 0.00 N ATOM 881 CA GLY A 285 -0.582 -15.128 -0.245 1.00 0.00 C ATOM 882 C GLY A 285 0.747 -14.436 -0.478 1.00 0.00 C ATOM 883 O GLY A 285 1.602 -14.408 0.407 1.00 0.00 O ATOM 0 H GLY A 285 -2.222 -14.650 -1.466 1.00 0.00 H new ATOM 0 HA2 GLY A 285 -1.143 -14.577 0.510 1.00 0.00 H new ATOM 0 HA3 GLY A 285 -0.399 -16.124 0.157 1.00 0.00 H new ATOM 887 N GLN A 286 0.932 -13.894 -1.672 1.00 0.00 N ATOM 888 CA GLN A 286 2.173 -13.220 -2.021 1.00 0.00 C ATOM 889 C GLN A 286 2.059 -11.727 -1.746 1.00 0.00 C ATOM 890 O GLN A 286 0.997 -11.141 -1.938 1.00 0.00 O ATOM 891 CB GLN A 286 2.499 -13.460 -3.496 1.00 0.00 C ATOM 892 CG GLN A 286 2.645 -14.931 -3.856 1.00 0.00 C ATOM 893 CD GLN A 286 3.778 -15.603 -3.108 1.00 0.00 C ATOM 894 OE1 GLN A 286 4.938 -15.212 -3.239 1.00 0.00 O ATOM 895 NE2 GLN A 286 3.450 -16.613 -2.315 1.00 0.00 N ATOM 0 H GLN A 286 0.236 -13.908 -2.418 1.00 0.00 H new ATOM 0 HA GLN A 286 2.978 -13.626 -1.409 1.00 0.00 H new ATOM 0 HB2 GLN A 286 1.712 -13.021 -4.109 1.00 0.00 H new ATOM 0 HB3 GLN A 286 3.424 -12.940 -3.744 1.00 0.00 H new ATOM 0 HG2 GLN A 286 1.712 -15.449 -3.637 1.00 0.00 H new ATOM 0 HG3 GLN A 286 2.817 -15.024 -4.928 1.00 0.00 H new ATOM 0 HE21 GLN A 286 2.476 -16.904 -2.236 1.00 0.00 H new ATOM 0 HE22 GLN A 286 4.172 -17.099 -1.783 1.00 0.00 H new ATOM 904 N PRO A 287 3.142 -11.097 -1.264 1.00 0.00 N ATOM 905 CA PRO A 287 3.146 -9.665 -0.930 1.00 0.00 C ATOM 906 C PRO A 287 2.748 -8.784 -2.115 1.00 0.00 C ATOM 907 O PRO A 287 3.117 -9.060 -3.258 1.00 0.00 O ATOM 908 CB PRO A 287 4.595 -9.396 -0.526 1.00 0.00 C ATOM 909 CG PRO A 287 5.139 -10.722 -0.116 1.00 0.00 C ATOM 910 CD PRO A 287 4.439 -11.736 -0.974 1.00 0.00 C ATOM 0 HA PRO A 287 2.421 -9.431 -0.150 1.00 0.00 H new ATOM 0 HB2 PRO A 287 5.164 -8.977 -1.356 1.00 0.00 H new ATOM 0 HB3 PRO A 287 4.649 -8.678 0.292 1.00 0.00 H new ATOM 0 HG2 PRO A 287 6.218 -10.764 -0.263 1.00 0.00 H new ATOM 0 HG3 PRO A 287 4.954 -10.910 0.942 1.00 0.00 H new ATOM 0 HD2 PRO A 287 4.997 -11.945 -1.886 1.00 0.00 H new ATOM 0 HD3 PRO A 287 4.312 -12.685 -0.453 1.00 0.00 H new ATOM 918 N GLN A 288 1.975 -7.739 -1.838 1.00 0.00 N ATOM 919 CA GLN A 288 1.500 -6.831 -2.880 1.00 0.00 C ATOM 920 C GLN A 288 2.597 -5.855 -3.297 1.00 0.00 C ATOM 921 O GLN A 288 3.360 -5.370 -2.462 1.00 0.00 O ATOM 922 CB GLN A 288 0.263 -6.069 -2.385 1.00 0.00 C ATOM 923 CG GLN A 288 -0.313 -5.069 -3.383 1.00 0.00 C ATOM 924 CD GLN A 288 -0.749 -5.710 -4.685 1.00 0.00 C ATOM 925 OE1 GLN A 288 -1.589 -6.611 -4.697 1.00 0.00 O ATOM 926 NE2 GLN A 288 -0.187 -5.245 -5.791 1.00 0.00 N ATOM 0 H GLN A 288 1.662 -7.498 -0.897 1.00 0.00 H new ATOM 0 HA GLN A 288 1.227 -7.421 -3.755 1.00 0.00 H new ATOM 0 HB2 GLN A 288 -0.512 -6.791 -2.127 1.00 0.00 H new ATOM 0 HB3 GLN A 288 0.523 -5.538 -1.469 1.00 0.00 H new ATOM 0 HG2 GLN A 288 -1.166 -4.564 -2.930 1.00 0.00 H new ATOM 0 HG3 GLN A 288 0.435 -4.304 -3.594 1.00 0.00 H new ATOM 0 HE21 GLN A 288 0.505 -4.497 -5.736 1.00 0.00 H new ATOM 0 HE22 GLN A 288 -0.446 -5.635 -6.697 1.00 0.00 H new ATOM 935 N VAL A 289 2.667 -5.580 -4.594 1.00 0.00 N ATOM 936 CA VAL A 289 3.665 -4.667 -5.137 1.00 0.00 C ATOM 937 C VAL A 289 3.111 -3.242 -5.212 1.00 0.00 C ATOM 938 O VAL A 289 1.976 -3.032 -5.647 1.00 0.00 O ATOM 939 CB VAL A 289 4.112 -5.119 -6.542 1.00 0.00 C ATOM 940 CG1 VAL A 289 5.225 -4.234 -7.066 1.00 0.00 C ATOM 941 CG2 VAL A 289 4.550 -6.575 -6.528 1.00 0.00 C ATOM 0 H VAL A 289 2.040 -5.979 -5.293 1.00 0.00 H new ATOM 0 HA VAL A 289 4.526 -4.680 -4.469 1.00 0.00 H new ATOM 0 HB VAL A 289 3.257 -5.025 -7.212 1.00 0.00 H new ATOM 0 HG11 VAL A 289 5.523 -4.573 -8.058 1.00 0.00 H new ATOM 0 HG12 VAL A 289 4.874 -3.204 -7.125 1.00 0.00 H new ATOM 0 HG13 VAL A 289 6.080 -4.288 -6.392 1.00 0.00 H new ATOM 0 HG21 VAL A 289 4.861 -6.871 -7.530 1.00 0.00 H new ATOM 0 HG22 VAL A 289 5.385 -6.697 -5.838 1.00 0.00 H new ATOM 0 HG23 VAL A 289 3.719 -7.202 -6.206 1.00 0.00 H new ATOM 951 N PHE A 290 3.884 -2.282 -4.711 1.00 0.00 N ATOM 952 CA PHE A 290 3.445 -0.884 -4.636 1.00 0.00 C ATOM 953 C PHE A 290 4.159 -0.030 -5.673 1.00 0.00 C ATOM 954 O PHE A 290 5.140 -0.464 -6.270 1.00 0.00 O ATOM 955 CB PHE A 290 3.715 -0.301 -3.244 1.00 0.00 C ATOM 956 CG PHE A 290 3.022 -1.015 -2.119 1.00 0.00 C ATOM 957 CD1 PHE A 290 3.249 -0.635 -0.809 1.00 0.00 C ATOM 958 CD2 PHE A 290 2.153 -2.066 -2.362 1.00 0.00 C ATOM 959 CE1 PHE A 290 2.631 -1.292 0.231 1.00 0.00 C ATOM 960 CE2 PHE A 290 1.531 -2.723 -1.327 1.00 0.00 C ATOM 961 CZ PHE A 290 1.773 -2.337 -0.030 1.00 0.00 C ATOM 0 H PHE A 290 4.823 -2.444 -4.348 1.00 0.00 H new ATOM 0 HA PHE A 290 2.373 -0.871 -4.835 1.00 0.00 H new ATOM 0 HB2 PHE A 290 4.789 -0.318 -3.060 1.00 0.00 H new ATOM 0 HB3 PHE A 290 3.407 0.745 -3.237 1.00 0.00 H new ATOM 0 HD1 PHE A 290 3.918 0.186 -0.599 1.00 0.00 H new ATOM 0 HD2 PHE A 290 1.961 -2.374 -3.379 1.00 0.00 H new ATOM 0 HE1 PHE A 290 2.819 -0.988 1.250 1.00 0.00 H new ATOM 0 HE2 PHE A 290 0.855 -3.540 -1.532 1.00 0.00 H new ATOM 0 HZ PHE A 290 1.289 -2.854 0.786 1.00 0.00 H new ATOM 971 N ARG A 291 3.702 1.207 -5.835 1.00 0.00 N ATOM 972 CA ARG A 291 4.341 2.148 -6.742 1.00 0.00 C ATOM 973 C ARG A 291 4.860 3.360 -5.978 1.00 0.00 C ATOM 974 O ARG A 291 4.229 3.830 -5.028 1.00 0.00 O ATOM 975 CB ARG A 291 3.362 2.609 -7.826 1.00 0.00 C ATOM 976 CG ARG A 291 2.826 1.485 -8.697 1.00 0.00 C ATOM 977 CD ARG A 291 3.952 0.730 -9.387 1.00 0.00 C ATOM 978 NE ARG A 291 4.781 1.601 -10.219 1.00 0.00 N ATOM 979 CZ ARG A 291 5.823 1.164 -10.927 1.00 0.00 C ATOM 980 NH1 ARG A 291 6.142 -0.127 -10.904 1.00 0.00 N1+ ATOM 981 NH2 ARG A 291 6.536 2.009 -11.659 1.00 0.00 N ATOM 0 H ARG A 291 2.888 1.581 -5.347 1.00 0.00 H new ATOM 0 HA ARG A 291 5.179 1.637 -7.216 1.00 0.00 H new ATOM 0 HB2 ARG A 291 2.523 3.117 -7.350 1.00 0.00 H new ATOM 0 HB3 ARG A 291 3.859 3.341 -8.462 1.00 0.00 H new ATOM 0 HG2 ARG A 291 2.245 0.795 -8.085 1.00 0.00 H new ATOM 0 HG3 ARG A 291 2.149 1.895 -9.446 1.00 0.00 H new ATOM 0 HD2 ARG A 291 4.577 0.249 -8.635 1.00 0.00 H new ATOM 0 HD3 ARG A 291 3.529 -0.062 -10.005 1.00 0.00 H new ATOM 0 HE ARG A 291 4.550 2.594 -10.260 1.00 0.00 H new ATOM 0 HH11 ARG A 291 5.590 -0.779 -10.346 1.00 0.00 H new ATOM 0 HH12 ARG A 291 6.938 -0.465 -11.444 1.00 0.00 H new ATOM 0 HH21 ARG A 291 6.288 2.998 -11.682 1.00 0.00 H new ATOM 0 HH22 ARG A 291 7.332 1.670 -12.199 1.00 0.00 H new ATOM 995 N VAL A 292 5.986 3.889 -6.424 1.00 0.00 N ATOM 996 CA VAL A 292 6.565 5.079 -5.816 1.00 0.00 C ATOM 997 C VAL A 292 6.256 6.312 -6.653 1.00 0.00 C ATOM 998 O VAL A 292 6.401 6.296 -7.876 1.00 0.00 O ATOM 999 CB VAL A 292 8.088 4.939 -5.634 1.00 0.00 C ATOM 1000 CG1 VAL A 292 8.673 6.185 -4.993 1.00 0.00 C ATOM 1001 CG2 VAL A 292 8.411 3.711 -4.800 1.00 0.00 C ATOM 0 H VAL A 292 6.521 3.513 -7.207 1.00 0.00 H new ATOM 0 HA VAL A 292 6.114 5.193 -4.830 1.00 0.00 H new ATOM 0 HB VAL A 292 8.539 4.820 -6.619 1.00 0.00 H new ATOM 0 HG11 VAL A 292 9.750 6.062 -4.875 1.00 0.00 H new ATOM 0 HG12 VAL A 292 8.474 7.048 -5.628 1.00 0.00 H new ATOM 0 HG13 VAL A 292 8.216 6.340 -4.016 1.00 0.00 H new ATOM 0 HG21 VAL A 292 9.491 3.626 -4.681 1.00 0.00 H new ATOM 0 HG22 VAL A 292 7.944 3.804 -3.820 1.00 0.00 H new ATOM 0 HG23 VAL A 292 8.030 2.821 -5.301 1.00 0.00 H new ATOM 1011 N LEU A 293 5.761 7.353 -5.993 1.00 0.00 N ATOM 1012 CA LEU A 293 5.351 8.570 -6.683 1.00 0.00 C ATOM 1013 C LEU A 293 6.351 9.691 -6.452 1.00 0.00 C ATOM 1014 O LEU A 293 6.489 10.585 -7.289 1.00 0.00 O ATOM 1015 CB LEU A 293 3.959 9.036 -6.225 1.00 0.00 C ATOM 1016 CG LEU A 293 2.793 8.066 -6.468 1.00 0.00 C ATOM 1017 CD1 LEU A 293 2.732 7.644 -7.927 1.00 0.00 C ATOM 1018 CD2 LEU A 293 2.888 6.853 -5.560 1.00 0.00 C ATOM 0 H LEU A 293 5.634 7.378 -4.981 1.00 0.00 H new ATOM 0 HA LEU A 293 5.312 8.333 -7.746 1.00 0.00 H new ATOM 0 HB2 LEU A 293 4.006 9.251 -5.157 1.00 0.00 H new ATOM 0 HB3 LEU A 293 3.731 9.975 -6.729 1.00 0.00 H new ATOM 0 HG LEU A 293 1.869 8.592 -6.227 1.00 0.00 H new ATOM 0 HD11 LEU A 293 1.898 6.957 -8.073 1.00 0.00 H new ATOM 0 HD12 LEU A 293 2.591 8.524 -8.555 1.00 0.00 H new ATOM 0 HD13 LEU A 293 3.663 7.148 -8.201 1.00 0.00 H new ATOM 0 HD21 LEU A 293 2.049 6.185 -5.756 1.00 0.00 H new ATOM 0 HD22 LEU A 293 3.823 6.327 -5.752 1.00 0.00 H new ATOM 0 HD23 LEU A 293 2.860 7.175 -4.519 1.00 0.00 H new ATOM 1030 N ALA A 294 7.020 9.670 -5.301 1.00 0.00 N ATOM 1031 CA ALA A 294 7.973 10.723 -4.966 1.00 0.00 C ATOM 1032 C ALA A 294 8.919 10.285 -3.858 1.00 0.00 C ATOM 1033 O ALA A 294 8.494 9.672 -2.882 1.00 0.00 O ATOM 1034 CB ALA A 294 7.237 11.987 -4.550 1.00 0.00 C ATOM 0 H ALA A 294 6.921 8.943 -4.592 1.00 0.00 H new ATOM 0 HA ALA A 294 8.567 10.929 -5.856 1.00 0.00 H new ATOM 0 HB1 ALA A 294 7.960 12.764 -4.303 1.00 0.00 H new ATOM 0 HB2 ALA A 294 6.605 12.327 -5.371 1.00 0.00 H new ATOM 0 HB3 ALA A 294 6.618 11.777 -3.678 1.00 0.00 H new ATOM 1040 N VAL A 295 10.186 10.664 -3.982 1.00 0.00 N ATOM 1041 CA VAL A 295 11.185 10.377 -2.954 1.00 0.00 C ATOM 1042 C VAL A 295 12.041 11.614 -2.704 1.00 0.00 C ATOM 1043 O VAL A 295 12.682 12.133 -3.619 1.00 0.00 O ATOM 1044 CB VAL A 295 12.105 9.194 -3.346 1.00 0.00 C ATOM 1045 CG1 VAL A 295 13.121 8.905 -2.251 1.00 0.00 C ATOM 1046 CG2 VAL A 295 11.289 7.949 -3.645 1.00 0.00 C ATOM 0 H VAL A 295 10.549 11.173 -4.788 1.00 0.00 H new ATOM 0 HA VAL A 295 10.646 10.098 -2.049 1.00 0.00 H new ATOM 0 HB VAL A 295 12.644 9.481 -4.249 1.00 0.00 H new ATOM 0 HG11 VAL A 295 13.754 8.070 -2.553 1.00 0.00 H new ATOM 0 HG12 VAL A 295 13.739 9.788 -2.086 1.00 0.00 H new ATOM 0 HG13 VAL A 295 12.599 8.650 -1.329 1.00 0.00 H new ATOM 0 HG21 VAL A 295 11.958 7.133 -3.918 1.00 0.00 H new ATOM 0 HG22 VAL A 295 10.716 7.669 -2.761 1.00 0.00 H new ATOM 0 HG23 VAL A 295 10.607 8.151 -4.471 1.00 0.00 H new ATOM 1056 N SER A 296 12.038 12.085 -1.469 1.00 0.00 N ATOM 1057 CA SER A 296 12.806 13.270 -1.096 1.00 0.00 C ATOM 1058 C SER A 296 13.231 13.209 0.364 1.00 0.00 C ATOM 1059 O SER A 296 12.411 13.411 1.260 1.00 0.00 O ATOM 1060 CB SER A 296 11.982 14.539 -1.330 1.00 0.00 C ATOM 1061 OG SER A 296 11.630 14.685 -2.696 1.00 0.00 O ATOM 0 H SER A 296 11.512 11.666 -0.702 1.00 0.00 H new ATOM 0 HA SER A 296 13.698 13.296 -1.722 1.00 0.00 H new ATOM 0 HB2 SER A 296 11.078 14.505 -0.722 1.00 0.00 H new ATOM 0 HB3 SER A 296 12.552 15.409 -1.005 1.00 0.00 H new ATOM 0 HG SER A 296 11.103 15.503 -2.812 1.00 0.00 H new ATOM 1067 N GLY A 297 14.509 12.937 0.598 1.00 0.00 N ATOM 1068 CA GLY A 297 15.014 12.862 1.957 1.00 0.00 C ATOM 1069 C GLY A 297 14.393 11.722 2.734 1.00 0.00 C ATOM 1070 O GLY A 297 13.727 11.950 3.745 1.00 0.00 O ATOM 0 H GLY A 297 15.205 12.767 -0.128 1.00 0.00 H new ATOM 0 HA2 GLY A 297 16.097 12.737 1.934 1.00 0.00 H new ATOM 0 HA3 GLY A 297 14.812 13.802 2.470 1.00 0.00 H new ATOM 1074 N THR A 298 14.548 10.506 2.204 1.00 0.00 N ATOM 1075 CA THR A 298 13.947 9.291 2.773 1.00 0.00 C ATOM 1076 C THR A 298 12.452 9.461 3.070 1.00 0.00 C ATOM 1077 O THR A 298 11.885 8.751 3.899 1.00 0.00 O ATOM 1078 CB THR A 298 14.712 8.830 4.027 1.00 0.00 C ATOM 1079 OG1 THR A 298 14.767 9.842 5.021 1.00 0.00 O ATOM 1080 CG2 THR A 298 16.134 8.407 3.732 1.00 0.00 C ATOM 0 H THR A 298 15.097 10.333 1.362 1.00 0.00 H new ATOM 0 HA THR A 298 14.031 8.512 2.015 1.00 0.00 H new ATOM 0 HB THR A 298 14.147 7.971 4.390 1.00 0.00 H new ATOM 0 HG1 THR A 298 14.139 10.559 4.793 1.00 0.00 H new ATOM 0 HG21 THR A 298 16.619 8.093 4.656 1.00 0.00 H new ATOM 0 HG22 THR A 298 16.128 7.577 3.026 1.00 0.00 H new ATOM 0 HG23 THR A 298 16.681 9.246 3.301 1.00 0.00 H new ATOM 1088 N THR A 299 11.815 10.364 2.341 1.00 0.00 N ATOM 1089 CA THR A 299 10.386 10.590 2.470 1.00 0.00 C ATOM 1090 C THR A 299 9.703 10.212 1.163 1.00 0.00 C ATOM 1091 O THR A 299 10.013 10.773 0.111 1.00 0.00 O ATOM 1092 CB THR A 299 10.131 12.055 2.824 1.00 0.00 C ATOM 1093 OG1 THR A 299 10.826 12.399 4.011 1.00 0.00 O ATOM 1094 CG2 THR A 299 8.673 12.390 3.040 1.00 0.00 C ATOM 0 H THR A 299 12.271 10.957 1.648 1.00 0.00 H new ATOM 0 HA THR A 299 9.975 9.972 3.268 1.00 0.00 H new ATOM 0 HB THR A 299 10.485 12.623 1.964 1.00 0.00 H new ATOM 0 HG1 THR A 299 11.791 12.328 3.857 1.00 0.00 H new ATOM 0 HG21 THR A 299 8.575 13.447 3.287 1.00 0.00 H new ATOM 0 HG22 THR A 299 8.112 12.177 2.130 1.00 0.00 H new ATOM 0 HG23 THR A 299 8.279 11.788 3.859 1.00 0.00 H new ATOM 1102 N VAL A 300 8.922 9.143 1.200 1.00 0.00 N ATOM 1103 CA VAL A 300 8.376 8.570 -0.022 1.00 0.00 C ATOM 1104 C VAL A 300 6.856 8.695 -0.077 1.00 0.00 C ATOM 1105 O VAL A 300 6.152 8.179 0.791 1.00 0.00 O ATOM 1106 CB VAL A 300 8.772 7.081 -0.147 1.00 0.00 C ATOM 1107 CG1 VAL A 300 8.275 6.484 -1.453 1.00 0.00 C ATOM 1108 CG2 VAL A 300 10.279 6.916 -0.028 1.00 0.00 C ATOM 0 H VAL A 300 8.653 8.657 2.056 1.00 0.00 H new ATOM 0 HA VAL A 300 8.797 9.133 -0.855 1.00 0.00 H new ATOM 0 HB VAL A 300 8.296 6.541 0.671 1.00 0.00 H new ATOM 0 HG11 VAL A 300 8.570 5.436 -1.510 1.00 0.00 H new ATOM 0 HG12 VAL A 300 7.188 6.558 -1.497 1.00 0.00 H new ATOM 0 HG13 VAL A 300 8.710 7.029 -2.291 1.00 0.00 H new ATOM 0 HG21 VAL A 300 10.538 5.861 -0.119 1.00 0.00 H new ATOM 0 HG22 VAL A 300 10.770 7.480 -0.821 1.00 0.00 H new ATOM 0 HG23 VAL A 300 10.610 7.289 0.941 1.00 0.00 H new ATOM 1118 N THR A 301 6.358 9.262 -1.171 1.00 0.00 N ATOM 1119 CA THR A 301 4.926 9.311 -1.429 1.00 0.00 C ATOM 1120 C THR A 301 4.485 7.975 -2.019 1.00 0.00 C ATOM 1121 O THR A 301 5.028 7.535 -3.038 1.00 0.00 O ATOM 1122 CB THR A 301 4.597 10.452 -2.397 1.00 0.00 C ATOM 1123 OG1 THR A 301 5.066 11.691 -1.892 1.00 0.00 O ATOM 1124 CG2 THR A 301 3.115 10.602 -2.669 1.00 0.00 C ATOM 0 H THR A 301 6.930 9.696 -1.896 1.00 0.00 H new ATOM 0 HA THR A 301 4.394 9.494 -0.496 1.00 0.00 H new ATOM 0 HB THR A 301 5.097 10.189 -3.329 1.00 0.00 H new ATOM 0 HG1 THR A 301 4.848 12.406 -2.525 1.00 0.00 H new ATOM 0 HG21 THR A 301 2.954 11.428 -3.362 1.00 0.00 H new ATOM 0 HG22 THR A 301 2.730 9.681 -3.107 1.00 0.00 H new ATOM 0 HG23 THR A 301 2.592 10.805 -1.734 1.00 0.00 H new ATOM 1132 N ILE A 302 3.641 7.255 -1.294 1.00 0.00 N ATOM 1133 CA ILE A 302 3.312 5.890 -1.675 1.00 0.00 C ATOM 1134 C ILE A 302 1.862 5.717 -2.116 1.00 0.00 C ATOM 1135 O ILE A 302 0.957 6.434 -1.663 1.00 0.00 O ATOM 1136 CB ILE A 302 3.635 4.908 -0.536 1.00 0.00 C ATOM 1137 CG1 ILE A 302 2.879 5.285 0.741 1.00 0.00 C ATOM 1138 CG2 ILE A 302 5.131 4.898 -0.279 1.00 0.00 C ATOM 1139 CD1 ILE A 302 3.150 4.348 1.897 1.00 0.00 C ATOM 0 H ILE A 302 3.177 7.588 -0.449 1.00 0.00 H new ATOM 0 HA ILE A 302 3.936 5.664 -2.540 1.00 0.00 H new ATOM 0 HB ILE A 302 3.315 3.910 -0.835 1.00 0.00 H new ATOM 0 HG12 ILE A 302 3.155 6.299 1.032 1.00 0.00 H new ATOM 0 HG13 ILE A 302 1.809 5.293 0.532 1.00 0.00 H new ATOM 0 HG21 ILE A 302 5.357 4.201 0.528 1.00 0.00 H new ATOM 0 HG22 ILE A 302 5.653 4.587 -1.184 1.00 0.00 H new ATOM 0 HG23 ILE A 302 5.458 5.899 0.003 1.00 0.00 H new ATOM 0 HD11 ILE A 302 2.583 4.673 2.769 1.00 0.00 H new ATOM 0 HD12 ILE A 302 2.848 3.337 1.624 1.00 0.00 H new ATOM 0 HD13 ILE A 302 4.214 4.358 2.132 1.00 0.00 H new ATOM 1151 N SER A 303 1.688 4.768 -3.033 1.00 0.00 N ATOM 1152 CA SER A 303 0.406 4.431 -3.643 1.00 0.00 C ATOM 1153 C SER A 303 0.576 3.053 -4.302 1.00 0.00 C ATOM 1154 O SER A 303 1.709 2.615 -4.488 1.00 0.00 O ATOM 1155 CB SER A 303 0.045 5.516 -4.678 1.00 0.00 C ATOM 1156 OG SER A 303 -1.217 5.302 -5.286 1.00 0.00 O ATOM 0 H SER A 303 2.458 4.197 -3.381 1.00 0.00 H new ATOM 0 HA SER A 303 -0.402 4.391 -2.913 1.00 0.00 H new ATOM 0 HB2 SER A 303 0.047 6.491 -4.190 1.00 0.00 H new ATOM 0 HB3 SER A 303 0.814 5.544 -5.450 1.00 0.00 H new ATOM 0 HG SER A 303 -1.928 5.492 -4.639 1.00 0.00 H new ATOM 1162 N PRO A 304 -0.500 2.323 -4.662 1.00 0.00 N ATOM 1163 CA PRO A 304 -1.890 2.734 -4.491 1.00 0.00 C ATOM 1164 C PRO A 304 -2.421 2.443 -3.094 1.00 0.00 C ATOM 1165 O PRO A 304 -1.674 2.459 -2.116 1.00 0.00 O ATOM 1166 CB PRO A 304 -2.649 1.895 -5.535 1.00 0.00 C ATOM 1167 CG PRO A 304 -1.637 0.990 -6.174 1.00 0.00 C ATOM 1168 CD PRO A 304 -0.420 1.006 -5.293 1.00 0.00 C ATOM 0 HA PRO A 304 -2.007 3.810 -4.620 1.00 0.00 H new ATOM 0 HB2 PRO A 304 -3.444 1.316 -5.064 1.00 0.00 H new ATOM 0 HB3 PRO A 304 -3.120 2.537 -6.280 1.00 0.00 H new ATOM 0 HG2 PRO A 304 -2.030 -0.022 -6.271 1.00 0.00 H new ATOM 0 HG3 PRO A 304 -1.391 1.334 -7.179 1.00 0.00 H new ATOM 0 HD2 PRO A 304 -0.442 0.202 -4.557 1.00 0.00 H new ATOM 0 HD3 PRO A 304 0.498 0.887 -5.868 1.00 0.00 H new ATOM 1176 N LYS A 305 -3.724 2.223 -3.002 1.00 0.00 N ATOM 1177 CA LYS A 305 -4.363 1.980 -1.722 1.00 0.00 C ATOM 1178 C LYS A 305 -3.992 0.605 -1.177 1.00 0.00 C ATOM 1179 O LYS A 305 -3.890 -0.373 -1.920 1.00 0.00 O ATOM 1180 CB LYS A 305 -5.887 2.090 -1.825 1.00 0.00 C ATOM 1181 CG LYS A 305 -6.561 0.986 -2.640 1.00 0.00 C ATOM 1182 CD LYS A 305 -6.234 1.042 -4.126 1.00 0.00 C ATOM 1183 CE LYS A 305 -6.991 -0.032 -4.898 1.00 0.00 C ATOM 1184 NZ LYS A 305 -6.663 -0.015 -6.349 1.00 0.00 N1+ ATOM 0 H LYS A 305 -4.358 2.208 -3.801 1.00 0.00 H new ATOM 0 HA LYS A 305 -4.002 2.747 -1.037 1.00 0.00 H new ATOM 0 HB2 LYS A 305 -6.305 2.085 -0.819 1.00 0.00 H new ATOM 0 HB3 LYS A 305 -6.137 3.053 -2.269 1.00 0.00 H new ATOM 0 HG2 LYS A 305 -6.256 0.017 -2.245 1.00 0.00 H new ATOM 0 HG3 LYS A 305 -7.641 1.058 -2.511 1.00 0.00 H new ATOM 0 HD2 LYS A 305 -6.490 2.025 -4.520 1.00 0.00 H new ATOM 0 HD3 LYS A 305 -5.162 0.910 -4.270 1.00 0.00 H new ATOM 0 HE2 LYS A 305 -6.752 -1.012 -4.484 1.00 0.00 H new ATOM 0 HE3 LYS A 305 -8.063 0.116 -4.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -7.200 -0.761 -6.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 -6.915 0.910 -6.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 -5.645 -0.182 -6.477 1.00 0.00 H new ATOM 1198 N ILE A 306 -3.864 0.529 0.133 1.00 0.00 N ATOM 1199 CA ILE A 306 -3.586 -0.727 0.803 1.00 0.00 C ATOM 1200 C ILE A 306 -4.831 -1.179 1.552 1.00 0.00 C ATOM 1201 O ILE A 306 -4.978 -0.932 2.749 1.00 0.00 O ATOM 1202 CB ILE A 306 -2.414 -0.568 1.784 1.00 0.00 C ATOM 1203 CG1 ILE A 306 -1.224 0.051 1.060 1.00 0.00 C ATOM 1204 CG2 ILE A 306 -2.025 -1.915 2.376 1.00 0.00 C ATOM 1205 CD1 ILE A 306 -0.079 0.382 1.976 1.00 0.00 C ATOM 0 H ILE A 306 -3.949 1.329 0.760 1.00 0.00 H new ATOM 0 HA ILE A 306 -3.311 -1.475 0.059 1.00 0.00 H new ATOM 0 HB ILE A 306 -2.722 0.087 2.599 1.00 0.00 H new ATOM 0 HG12 ILE A 306 -0.877 -0.638 0.290 1.00 0.00 H new ATOM 0 HG13 ILE A 306 -1.549 0.959 0.552 1.00 0.00 H new ATOM 0 HG21 ILE A 306 -1.194 -1.782 3.068 1.00 0.00 H new ATOM 0 HG22 ILE A 306 -2.877 -2.338 2.909 1.00 0.00 H new ATOM 0 HG23 ILE A 306 -1.726 -2.592 1.575 1.00 0.00 H new ATOM 0 HD11 ILE A 306 0.735 0.819 1.398 1.00 0.00 H new ATOM 0 HD12 ILE A 306 -0.411 1.095 2.731 1.00 0.00 H new ATOM 0 HD13 ILE A 306 0.271 -0.527 2.465 1.00 0.00 H new ATOM 1217 N LEU A 307 -5.786 -1.704 0.804 1.00 0.00 N ATOM 1218 CA LEU A 307 -7.086 -2.032 1.362 1.00 0.00 C ATOM 1219 C LEU A 307 -7.210 -3.501 1.701 1.00 0.00 C ATOM 1220 O LEU A 307 -7.151 -4.356 0.816 1.00 0.00 O ATOM 1221 CB LEU A 307 -8.198 -1.648 0.393 1.00 0.00 C ATOM 1222 CG LEU A 307 -8.336 -0.156 0.136 1.00 0.00 C ATOM 1223 CD1 LEU A 307 -9.441 0.106 -0.872 1.00 0.00 C ATOM 1224 CD2 LEU A 307 -8.619 0.583 1.431 1.00 0.00 C ATOM 0 H LEU A 307 -5.686 -1.912 -0.190 1.00 0.00 H new ATOM 0 HA LEU A 307 -7.183 -1.460 2.285 1.00 0.00 H new ATOM 0 HB2 LEU A 307 -8.021 -2.151 -0.558 1.00 0.00 H new ATOM 0 HB3 LEU A 307 -9.144 -2.024 0.781 1.00 0.00 H new ATOM 0 HG LEU A 307 -7.395 0.212 -0.274 1.00 0.00 H new ATOM 0 HD11 LEU A 307 -9.528 1.179 -1.046 1.00 0.00 H new ATOM 0 HD12 LEU A 307 -9.204 -0.396 -1.810 1.00 0.00 H new ATOM 0 HD13 LEU A 307 -10.385 -0.277 -0.484 1.00 0.00 H new ATOM 0 HD21 LEU A 307 -8.715 1.650 1.228 1.00 0.00 H new ATOM 0 HD22 LEU A 307 -9.547 0.212 1.866 1.00 0.00 H new ATOM 0 HD23 LEU A 307 -7.799 0.419 2.130 1.00 0.00 H new ATOM 1236 N PRO A 308 -7.461 -3.799 2.979 1.00 0.00 N ATOM 1237 CA PRO A 308 -7.704 -5.160 3.453 1.00 0.00 C ATOM 1238 C PRO A 308 -9.029 -5.714 2.943 1.00 0.00 C ATOM 1239 O PRO A 308 -10.037 -5.011 2.923 1.00 0.00 O ATOM 1240 CB PRO A 308 -7.780 -5.008 4.980 1.00 0.00 C ATOM 1241 CG PRO A 308 -7.254 -3.643 5.270 1.00 0.00 C ATOM 1242 CD PRO A 308 -7.600 -2.821 4.064 1.00 0.00 C ATOM 0 HA PRO A 308 -6.930 -5.846 3.109 1.00 0.00 H new ATOM 0 HB2 PRO A 308 -8.805 -5.118 5.335 1.00 0.00 H new ATOM 0 HB3 PRO A 308 -7.186 -5.772 5.481 1.00 0.00 H new ATOM 0 HG2 PRO A 308 -7.708 -3.230 6.171 1.00 0.00 H new ATOM 0 HG3 PRO A 308 -6.177 -3.664 5.436 1.00 0.00 H new ATOM 0 HD2 PRO A 308 -8.611 -2.417 4.122 1.00 0.00 H new ATOM 0 HD3 PRO A 308 -6.925 -1.975 3.940 1.00 0.00 H new ATOM 1250 N VAL A 309 -9.068 -7.010 2.711 1.00 0.00 N ATOM 1251 CA VAL A 309 -10.323 -7.673 2.427 1.00 0.00 C ATOM 1252 C VAL A 309 -10.874 -8.222 3.739 1.00 0.00 C ATOM 1253 O VAL A 309 -12.041 -8.603 3.840 1.00 0.00 O ATOM 1254 CB VAL A 309 -10.150 -8.817 1.397 1.00 0.00 C ATOM 1255 CG1 VAL A 309 -11.492 -9.411 1.002 1.00 0.00 C ATOM 1256 CG2 VAL A 309 -9.409 -8.324 0.167 1.00 0.00 C ATOM 0 H VAL A 309 -8.251 -7.621 2.713 1.00 0.00 H new ATOM 0 HA VAL A 309 -11.015 -6.955 1.988 1.00 0.00 H new ATOM 0 HB VAL A 309 -9.559 -9.601 1.870 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -11.337 -10.211 0.278 1.00 0.00 H new ATOM 0 HG12 VAL A 309 -11.987 -9.813 1.886 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -12.116 -8.636 0.558 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -9.298 -9.143 -0.544 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -9.972 -7.515 -0.297 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -8.424 -7.960 0.458 1.00 0.00 H new ATOM 1266 N GLU A 310 -9.995 -8.291 4.740 1.00 0.00 N ATOM 1267 CA GLU A 310 -10.352 -8.835 6.038 1.00 0.00 C ATOM 1268 C GLU A 310 -10.747 -7.746 7.039 1.00 0.00 C ATOM 1269 O GLU A 310 -10.548 -7.914 8.243 1.00 0.00 O ATOM 1270 CB GLU A 310 -9.193 -9.660 6.607 1.00 0.00 C ATOM 1271 CG GLU A 310 -8.772 -10.836 5.732 1.00 0.00 C ATOM 1272 CD GLU A 310 -9.857 -11.880 5.552 1.00 0.00 C ATOM 1273 OE1 GLU A 310 -9.607 -12.868 4.838 1.00 0.00 O ATOM 1274 OE2 GLU A 310 -10.955 -11.719 6.122 1.00 0.00 O1- ATOM 0 H GLU A 310 -9.028 -7.974 4.669 1.00 0.00 H new ATOM 0 HA GLU A 310 -11.221 -9.474 5.885 1.00 0.00 H new ATOM 0 HB2 GLU A 310 -8.334 -9.005 6.754 1.00 0.00 H new ATOM 0 HB3 GLU A 310 -9.478 -10.037 7.589 1.00 0.00 H new ATOM 0 HG2 GLU A 310 -8.475 -10.461 4.753 1.00 0.00 H new ATOM 0 HG3 GLU A 310 -7.894 -11.309 6.172 1.00 0.00 H new ATOM 1281 N ASN A 311 -11.380 -6.674 6.567 1.00 0.00 N ATOM 1282 CA ASN A 311 -11.875 -5.638 7.475 1.00 0.00 C ATOM 1283 C ASN A 311 -13.400 -5.622 7.499 1.00 0.00 C ATOM 1284 O ASN A 311 -14.048 -6.476 6.890 1.00 0.00 O ATOM 1285 CB ASN A 311 -11.334 -4.243 7.118 1.00 0.00 C ATOM 1286 CG ASN A 311 -11.693 -3.788 5.717 1.00 0.00 C ATOM 1287 OD1 ASN A 311 -12.855 -3.775 5.327 1.00 0.00 O ATOM 1288 ND2 ASN A 311 -10.694 -3.364 4.966 1.00 0.00 N ATOM 0 H ASN A 311 -11.561 -6.500 5.578 1.00 0.00 H new ATOM 0 HA ASN A 311 -11.506 -5.887 8.470 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -11.721 -3.519 7.835 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -10.249 -4.247 7.222 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -10.876 -3.010 4.027 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -9.740 -3.390 5.325 1.00 0.00 H new ATOM 1295 N THR A 312 -13.969 -4.682 8.246 1.00 0.00 N ATOM 1296 CA THR A 312 -15.416 -4.595 8.399 1.00 0.00 C ATOM 1297 C THR A 312 -16.025 -3.677 7.333 1.00 0.00 C ATOM 1298 O THR A 312 -17.229 -3.726 7.069 1.00 0.00 O ATOM 1299 CB THR A 312 -15.746 -4.074 9.804 1.00 0.00 C ATOM 1300 OG1 THR A 312 -15.068 -4.837 10.790 1.00 0.00 O ATOM 1301 CG2 THR A 312 -17.220 -4.124 10.144 1.00 0.00 C ATOM 0 H THR A 312 -13.448 -3.968 8.756 1.00 0.00 H new ATOM 0 HA THR A 312 -15.846 -5.588 8.269 1.00 0.00 H new ATOM 0 HB THR A 312 -15.424 -3.033 9.800 1.00 0.00 H new ATOM 0 HG1 THR A 312 -15.288 -4.491 11.680 1.00 0.00 H new ATOM 0 HG21 THR A 312 -17.374 -3.740 11.152 1.00 0.00 H new ATOM 0 HG22 THR A 312 -17.778 -3.514 9.434 1.00 0.00 H new ATOM 0 HG23 THR A 312 -17.571 -5.155 10.091 1.00 0.00 H new ATOM 1309 N ASP A 313 -15.189 -2.818 6.752 1.00 0.00 N ATOM 1310 CA ASP A 313 -15.633 -1.851 5.747 1.00 0.00 C ATOM 1311 C ASP A 313 -16.163 -2.535 4.491 1.00 0.00 C ATOM 1312 O ASP A 313 -15.392 -2.984 3.642 1.00 0.00 O ATOM 1313 CB ASP A 313 -14.486 -0.913 5.365 1.00 0.00 C ATOM 1314 CG ASP A 313 -14.036 -0.030 6.505 1.00 0.00 C ATOM 1315 OD1 ASP A 313 -13.631 -0.563 7.554 1.00 0.00 O ATOM 1316 OD2 ASP A 313 -14.080 1.205 6.346 1.00 0.00 O1- ATOM 0 H ASP A 313 -14.192 -2.772 6.962 1.00 0.00 H new ATOM 0 HA ASP A 313 -16.447 -1.279 6.193 1.00 0.00 H new ATOM 0 HB2 ASP A 313 -13.640 -1.506 5.017 1.00 0.00 H new ATOM 0 HB3 ASP A 313 -14.800 -0.286 4.530 1.00 0.00 H new ATOM 1321 N VAL A 314 -17.484 -2.552 4.349 1.00 0.00 N ATOM 1322 CA VAL A 314 -18.135 -3.121 3.173 1.00 0.00 C ATOM 1323 C VAL A 314 -17.780 -2.331 1.909 1.00 0.00 C ATOM 1324 O VAL A 314 -17.862 -2.850 0.797 1.00 0.00 O ATOM 1325 CB VAL A 314 -19.671 -3.145 3.355 1.00 0.00 C ATOM 1326 CG1 VAL A 314 -20.369 -3.792 2.167 1.00 0.00 C ATOM 1327 CG2 VAL A 314 -20.041 -3.868 4.639 1.00 0.00 C ATOM 0 H VAL A 314 -18.131 -2.174 5.041 1.00 0.00 H new ATOM 0 HA VAL A 314 -17.773 -4.143 3.060 1.00 0.00 H new ATOM 0 HB VAL A 314 -20.011 -2.111 3.417 1.00 0.00 H new ATOM 0 HG11 VAL A 314 -21.446 -3.790 2.333 1.00 0.00 H new ATOM 0 HG12 VAL A 314 -20.140 -3.231 1.261 1.00 0.00 H new ATOM 0 HG13 VAL A 314 -20.021 -4.819 2.056 1.00 0.00 H new ATOM 0 HG21 VAL A 314 -21.125 -3.876 4.752 1.00 0.00 H new ATOM 0 HG22 VAL A 314 -19.673 -4.893 4.599 1.00 0.00 H new ATOM 0 HG23 VAL A 314 -19.591 -3.354 5.489 1.00 0.00 H new ATOM 1337 N ALA A 315 -17.387 -1.073 2.085 1.00 0.00 N ATOM 1338 CA ALA A 315 -17.029 -0.223 0.956 1.00 0.00 C ATOM 1339 C ALA A 315 -15.571 -0.410 0.540 1.00 0.00 C ATOM 1340 O ALA A 315 -15.189 -0.042 -0.572 1.00 0.00 O ATOM 1341 CB ALA A 315 -17.295 1.239 1.285 1.00 0.00 C ATOM 0 H ALA A 315 -17.309 -0.621 2.996 1.00 0.00 H new ATOM 0 HA ALA A 315 -17.654 -0.522 0.115 1.00 0.00 H new ATOM 0 HB1 ALA A 315 -17.022 1.859 0.431 1.00 0.00 H new ATOM 0 HB2 ALA A 315 -18.353 1.375 1.509 1.00 0.00 H new ATOM 0 HB3 ALA A 315 -16.700 1.531 2.151 1.00 0.00 H new ATOM 1347 N SER A 316 -14.747 -0.928 1.444 1.00 0.00 N ATOM 1348 CA SER A 316 -13.322 -1.090 1.166 1.00 0.00 C ATOM 1349 C SER A 316 -12.993 -2.486 0.637 1.00 0.00 C ATOM 1350 O SER A 316 -12.098 -2.634 -0.190 1.00 0.00 O ATOM 1351 CB SER A 316 -12.494 -0.800 2.418 1.00 0.00 C ATOM 1352 OG SER A 316 -12.674 0.542 2.851 1.00 0.00 O ATOM 0 H SER A 316 -15.037 -1.242 2.370 1.00 0.00 H new ATOM 0 HA SER A 316 -13.065 -0.371 0.388 1.00 0.00 H new ATOM 0 HB2 SER A 316 -12.783 -1.485 3.215 1.00 0.00 H new ATOM 0 HB3 SER A 316 -11.439 -0.980 2.210 1.00 0.00 H new ATOM 0 HG SER A 316 -12.135 0.702 3.654 1.00 0.00 H new ATOM 1358 N ARG A 317 -13.687 -3.506 1.149 1.00 0.00 N ATOM 1359 CA ARG A 317 -13.430 -4.900 0.759 1.00 0.00 C ATOM 1360 C ARG A 317 -13.498 -5.128 -0.767 1.00 0.00 C ATOM 1361 O ARG A 317 -12.622 -5.794 -1.320 1.00 0.00 O ATOM 1362 CB ARG A 317 -14.394 -5.848 1.481 1.00 0.00 C ATOM 1363 CG ARG A 317 -14.285 -5.781 2.999 1.00 0.00 C ATOM 1364 CD ARG A 317 -15.263 -6.729 3.677 1.00 0.00 C ATOM 1365 NE ARG A 317 -14.994 -8.128 3.354 1.00 0.00 N ATOM 1366 CZ ARG A 317 -15.764 -9.138 3.762 1.00 0.00 C ATOM 1367 NH1 ARG A 317 -16.868 -8.886 4.455 1.00 0.00 N1+ ATOM 1368 NH2 ARG A 317 -15.433 -10.389 3.472 1.00 0.00 N ATOM 0 H ARG A 317 -14.433 -3.395 1.836 1.00 0.00 H new ATOM 0 HA ARG A 317 -12.407 -5.120 1.063 1.00 0.00 H new ATOM 0 HB2 ARG A 317 -15.416 -5.609 1.187 1.00 0.00 H new ATOM 0 HB3 ARG A 317 -14.199 -6.870 1.155 1.00 0.00 H new ATOM 0 HG2 ARG A 317 -13.268 -6.030 3.302 1.00 0.00 H new ATOM 0 HG3 ARG A 317 -14.476 -4.761 3.333 1.00 0.00 H new ATOM 0 HD2 ARG A 317 -15.210 -6.591 4.757 1.00 0.00 H new ATOM 0 HD3 ARG A 317 -16.279 -6.477 3.373 1.00 0.00 H new ATOM 0 HE ARG A 317 -14.174 -8.344 2.787 1.00 0.00 H new ATOM 0 HH11 ARG A 317 -17.124 -7.923 4.673 1.00 0.00 H new ATOM 0 HH12 ARG A 317 -17.460 -9.655 4.769 1.00 0.00 H new ATOM 0 HH21 ARG A 317 -14.587 -10.581 2.935 1.00 0.00 H new ATOM 0 HH22 ARG A 317 -16.024 -11.159 3.786 1.00 0.00 H new ATOM 1382 N PRO A 318 -14.537 -4.620 -1.481 1.00 0.00 N ATOM 1383 CA PRO A 318 -14.663 -4.827 -2.934 1.00 0.00 C ATOM 1384 C PRO A 318 -13.475 -4.275 -3.715 1.00 0.00 C ATOM 1385 O PRO A 318 -13.052 -4.852 -4.716 1.00 0.00 O ATOM 1386 CB PRO A 318 -15.930 -4.051 -3.318 1.00 0.00 C ATOM 1387 CG PRO A 318 -16.228 -3.163 -2.158 1.00 0.00 C ATOM 1388 CD PRO A 318 -15.672 -3.854 -0.948 1.00 0.00 C ATOM 0 HA PRO A 318 -14.704 -5.890 -3.170 1.00 0.00 H new ATOM 0 HB2 PRO A 318 -15.772 -3.469 -4.226 1.00 0.00 H new ATOM 0 HB3 PRO A 318 -16.760 -4.730 -3.515 1.00 0.00 H new ATOM 0 HG2 PRO A 318 -15.771 -2.183 -2.291 1.00 0.00 H new ATOM 0 HG3 PRO A 318 -17.301 -3.003 -2.056 1.00 0.00 H new ATOM 0 HD2 PRO A 318 -15.353 -3.140 -0.189 1.00 0.00 H new ATOM 0 HD3 PRO A 318 -16.412 -4.505 -0.482 1.00 0.00 H new ATOM 1396 N TYR A 319 -12.973 -3.126 -3.279 1.00 0.00 N ATOM 1397 CA TYR A 319 -11.871 -2.461 -3.963 1.00 0.00 C ATOM 1398 C TYR A 319 -10.545 -2.782 -3.284 1.00 0.00 C ATOM 1399 O TYR A 319 -9.540 -2.097 -3.494 1.00 0.00 O ATOM 1400 CB TYR A 319 -12.101 -0.948 -3.974 1.00 0.00 C ATOM 1401 CG TYR A 319 -13.415 -0.544 -4.599 1.00 0.00 C ATOM 1402 CD1 TYR A 319 -13.727 -0.900 -5.905 1.00 0.00 C ATOM 1403 CD2 TYR A 319 -14.349 0.186 -3.878 1.00 0.00 C ATOM 1404 CE1 TYR A 319 -14.933 -0.540 -6.473 1.00 0.00 C ATOM 1405 CE2 TYR A 319 -15.556 0.552 -4.441 1.00 0.00 C ATOM 1406 CZ TYR A 319 -15.843 0.185 -5.737 1.00 0.00 C ATOM 1407 OH TYR A 319 -17.049 0.540 -6.294 1.00 0.00 O ATOM 0 H TYR A 319 -13.313 -2.634 -2.452 1.00 0.00 H new ATOM 0 HA TYR A 319 -11.830 -2.825 -4.990 1.00 0.00 H new ATOM 0 HB2 TYR A 319 -12.065 -0.575 -2.950 1.00 0.00 H new ATOM 0 HB3 TYR A 319 -11.287 -0.468 -4.517 1.00 0.00 H new ATOM 0 HD1 TYR A 319 -13.015 -1.468 -6.486 1.00 0.00 H new ATOM 0 HD2 TYR A 319 -14.129 0.473 -2.860 1.00 0.00 H new ATOM 0 HE1 TYR A 319 -15.161 -0.826 -7.489 1.00 0.00 H new ATOM 0 HE2 TYR A 319 -16.271 1.123 -3.868 1.00 0.00 H new ATOM 0 HH TYR A 319 -17.574 1.047 -5.641 1.00 0.00 H new ATOM 1417 N ALA A 320 -10.562 -3.807 -2.445 1.00 0.00 N ATOM 1418 CA ALA A 320 -9.384 -4.210 -1.697 1.00 0.00 C ATOM 1419 C ALA A 320 -8.472 -5.081 -2.545 1.00 0.00 C ATOM 1420 O ALA A 320 -8.926 -5.759 -3.466 1.00 0.00 O ATOM 1421 CB ALA A 320 -9.796 -4.944 -0.435 1.00 0.00 C ATOM 0 H ALA A 320 -11.388 -4.378 -2.265 1.00 0.00 H new ATOM 0 HA ALA A 320 -8.829 -3.314 -1.420 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -8.906 -5.242 0.119 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -10.407 -4.287 0.185 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -10.372 -5.830 -0.701 1.00 0.00 H new ATOM 1427 N ASN A 321 -7.185 -5.066 -2.226 1.00 0.00 N ATOM 1428 CA ASN A 321 -6.212 -5.867 -2.966 1.00 0.00 C ATOM 1429 C ASN A 321 -5.224 -6.568 -2.037 1.00 0.00 C ATOM 1430 O ASN A 321 -4.386 -7.349 -2.487 1.00 0.00 O ATOM 1431 CB ASN A 321 -5.466 -5.019 -4.016 1.00 0.00 C ATOM 1432 CG ASN A 321 -4.710 -3.813 -3.462 1.00 0.00 C ATOM 1433 OD1 ASN A 321 -4.716 -3.623 -2.148 1.00 0.00 O flip ATOM 1434 ND2 ASN A 321 -4.111 -3.056 -4.224 1.00 0.00 N flip ATOM 0 H ASN A 321 -6.790 -4.513 -1.466 1.00 0.00 H new ATOM 0 HA ASN A 321 -6.774 -6.639 -3.491 1.00 0.00 H new ATOM 0 HB2 ASN A 321 -4.759 -5.661 -4.541 1.00 0.00 H new ATOM 0 HB3 ASN A 321 -6.187 -4.668 -4.754 1.00 0.00 H new ATOM 0 HD21 ASN A 321 -4.125 -3.228 -5.229 1.00 0.00 H new ATOM 0 HD22 ASN A 321 -3.600 -2.256 -3.851 1.00 0.00 H new ATOM 1441 N VAL A 322 -5.381 -6.355 -0.736 1.00 0.00 N ATOM 1442 CA VAL A 322 -4.562 -7.042 0.255 1.00 0.00 C ATOM 1443 C VAL A 322 -5.447 -7.566 1.376 1.00 0.00 C ATOM 1444 O VAL A 322 -6.598 -7.162 1.486 1.00 0.00 O ATOM 1445 CB VAL A 322 -3.466 -6.121 0.847 1.00 0.00 C ATOM 1446 CG1 VAL A 322 -2.535 -5.621 -0.244 1.00 0.00 C ATOM 1447 CG2 VAL A 322 -4.075 -4.948 1.598 1.00 0.00 C ATOM 0 H VAL A 322 -6.068 -5.712 -0.343 1.00 0.00 H new ATOM 0 HA VAL A 322 -4.062 -7.869 -0.249 1.00 0.00 H new ATOM 0 HB VAL A 322 -2.887 -6.713 1.556 1.00 0.00 H new ATOM 0 HG11 VAL A 322 -1.774 -4.976 0.195 1.00 0.00 H new ATOM 0 HG12 VAL A 322 -2.055 -6.470 -0.730 1.00 0.00 H new ATOM 0 HG13 VAL A 322 -3.107 -5.057 -0.981 1.00 0.00 H new ATOM 0 HG21 VAL A 322 -3.279 -4.321 2.001 1.00 0.00 H new ATOM 0 HG22 VAL A 322 -4.690 -4.360 0.917 1.00 0.00 H new ATOM 0 HG23 VAL A 322 -4.693 -5.320 2.415 1.00 0.00 H new ATOM 1457 N ASP A 323 -4.927 -8.472 2.193 1.00 0.00 N ATOM 1458 CA ASP A 323 -5.717 -9.035 3.287 1.00 0.00 C ATOM 1459 C ASP A 323 -5.862 -8.029 4.414 1.00 0.00 C ATOM 1460 O ASP A 323 -6.854 -8.035 5.140 1.00 0.00 O ATOM 1461 CB ASP A 323 -5.080 -10.307 3.855 1.00 0.00 C ATOM 1462 CG ASP A 323 -4.909 -11.396 2.827 1.00 0.00 C ATOM 1463 OD1 ASP A 323 -4.131 -11.200 1.879 1.00 0.00 O ATOM 1464 OD2 ASP A 323 -5.560 -12.448 2.966 1.00 0.00 O1- ATOM 0 H ASP A 323 -3.975 -8.831 2.124 1.00 0.00 H new ATOM 0 HA ASP A 323 -6.694 -9.282 2.872 1.00 0.00 H new ATOM 0 HB2 ASP A 323 -4.106 -10.060 4.278 1.00 0.00 H new ATOM 0 HB3 ASP A 323 -5.697 -10.681 4.672 1.00 0.00 H new ATOM 1469 N ALA A 324 -4.821 -7.226 4.598 1.00 0.00 N ATOM 1470 CA ALA A 324 -4.753 -6.273 5.698 1.00 0.00 C ATOM 1471 C ALA A 324 -3.537 -5.375 5.574 1.00 0.00 C ATOM 1472 O ALA A 324 -2.617 -5.655 4.804 1.00 0.00 O ATOM 1473 CB ALA A 324 -4.692 -7.003 7.026 1.00 0.00 C ATOM 0 H ALA A 324 -4.002 -7.217 3.990 1.00 0.00 H new ATOM 0 HA ALA A 324 -5.652 -5.659 5.654 1.00 0.00 H new ATOM 0 HB1 ALA A 324 -4.642 -6.278 7.838 1.00 0.00 H new ATOM 0 HB2 ALA A 324 -5.584 -7.618 7.144 1.00 0.00 H new ATOM 0 HB3 ALA A 324 -3.807 -7.638 7.052 1.00 0.00 H new ATOM 1479 N LYS A 325 -3.478 -4.378 6.446 1.00 0.00 N ATOM 1480 CA LYS A 325 -2.306 -3.530 6.559 1.00 0.00 C ATOM 1481 C LYS A 325 -1.887 -3.376 8.022 1.00 0.00 C ATOM 1482 O LYS A 325 -2.523 -2.657 8.795 1.00 0.00 O ATOM 1483 CB LYS A 325 -2.559 -2.157 5.923 1.00 0.00 C ATOM 1484 CG LYS A 325 -3.864 -1.502 6.354 1.00 0.00 C ATOM 1485 CD LYS A 325 -3.951 -0.058 5.885 1.00 0.00 C ATOM 1486 CE LYS A 325 -2.901 0.799 6.570 1.00 0.00 C ATOM 1487 NZ LYS A 325 -3.079 0.816 8.048 1.00 0.00 N1+ ATOM 0 H LYS A 325 -4.234 -4.138 7.087 1.00 0.00 H new ATOM 0 HA LYS A 325 -1.491 -4.010 6.018 1.00 0.00 H new ATOM 0 HB2 LYS A 325 -1.732 -1.494 6.175 1.00 0.00 H new ATOM 0 HB3 LYS A 325 -2.561 -2.266 4.838 1.00 0.00 H new ATOM 0 HG2 LYS A 325 -4.705 -2.067 5.951 1.00 0.00 H new ATOM 0 HG3 LYS A 325 -3.947 -1.537 7.440 1.00 0.00 H new ATOM 0 HD2 LYS A 325 -3.814 -0.014 4.805 1.00 0.00 H new ATOM 0 HD3 LYS A 325 -4.944 0.338 6.097 1.00 0.00 H new ATOM 0 HE2 LYS A 325 -1.908 0.420 6.328 1.00 0.00 H new ATOM 0 HE3 LYS A 325 -2.956 1.817 6.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 325 -2.549 1.614 8.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 325 -4.089 0.920 8.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 325 -2.724 -0.075 8.451 1.00 0.00 H new ATOM 1501 N PRO A 326 -0.783 -4.035 8.406 1.00 0.00 N ATOM 1502 CA PRO A 326 -0.229 -3.966 9.764 1.00 0.00 C ATOM 1503 C PRO A 326 0.319 -2.579 10.090 1.00 0.00 C ATOM 1504 O PRO A 326 0.394 -1.716 9.213 1.00 0.00 O ATOM 1505 CB PRO A 326 0.903 -5.003 9.758 1.00 0.00 C ATOM 1506 CG PRO A 326 0.693 -5.812 8.521 1.00 0.00 C ATOM 1507 CD PRO A 326 0.035 -4.891 7.538 1.00 0.00 C ATOM 0 HA PRO A 326 -0.989 -4.163 10.520 1.00 0.00 H new ATOM 0 HB2 PRO A 326 1.879 -4.519 9.750 1.00 0.00 H new ATOM 0 HB3 PRO A 326 0.866 -5.630 10.649 1.00 0.00 H new ATOM 0 HG2 PRO A 326 1.640 -6.186 8.133 1.00 0.00 H new ATOM 0 HG3 PRO A 326 0.066 -6.680 8.723 1.00 0.00 H new ATOM 0 HD2 PRO A 326 0.765 -4.314 6.970 1.00 0.00 H new ATOM 0 HD3 PRO A 326 -0.573 -5.435 6.815 1.00 0.00 H new ATOM 1515 N ALA A 327 0.664 -2.362 11.358 1.00 0.00 N ATOM 1516 CA ALA A 327 1.177 -1.070 11.814 1.00 0.00 C ATOM 1517 C ALA A 327 2.444 -0.663 11.059 1.00 0.00 C ATOM 1518 O ALA A 327 3.040 -1.475 10.349 1.00 0.00 O ATOM 1519 CB ALA A 327 1.442 -1.102 13.311 1.00 0.00 C ATOM 0 H ALA A 327 0.597 -3.068 12.091 1.00 0.00 H new ATOM 0 HA ALA A 327 0.413 -0.322 11.604 1.00 0.00 H new ATOM 0 HB1 ALA A 327 1.823 -0.133 13.634 1.00 0.00 H new ATOM 0 HB2 ALA A 327 0.515 -1.322 13.840 1.00 0.00 H new ATOM 0 HB3 ALA A 327 2.178 -1.874 13.534 1.00 0.00 H new ATOM 1525 N GLU A 328 2.780 0.629 11.168 1.00 0.00 N ATOM 1526 CA GLU A 328 3.898 1.263 10.444 1.00 0.00 C ATOM 1527 C GLU A 328 4.031 0.761 9.003 1.00 0.00 C ATOM 1528 O GLU A 328 3.043 0.397 8.362 1.00 0.00 O ATOM 1529 CB GLU A 328 5.256 1.173 11.188 1.00 0.00 C ATOM 1530 CG GLU A 328 5.777 -0.224 11.530 1.00 0.00 C ATOM 1531 CD GLU A 328 5.134 -0.825 12.760 1.00 0.00 C ATOM 1532 OE1 GLU A 328 5.180 -0.178 13.823 1.00 0.00 O ATOM 1533 OE2 GLU A 328 4.627 -1.957 12.676 1.00 0.00 O1- ATOM 0 H GLU A 328 2.275 1.278 11.772 1.00 0.00 H new ATOM 0 HA GLU A 328 3.633 2.320 10.406 1.00 0.00 H new ATOM 0 HB2 GLU A 328 6.008 1.674 10.579 1.00 0.00 H new ATOM 0 HB3 GLU A 328 5.170 1.738 12.116 1.00 0.00 H new ATOM 0 HG2 GLU A 328 5.605 -0.885 10.680 1.00 0.00 H new ATOM 0 HG3 GLU A 328 6.855 -0.174 11.682 1.00 0.00 H new ATOM 1540 N SER A 329 5.241 0.820 8.469 1.00 0.00 N ATOM 1541 CA SER A 329 5.470 0.434 7.087 1.00 0.00 C ATOM 1542 C SER A 329 6.317 -0.831 7.010 1.00 0.00 C ATOM 1543 O SER A 329 6.288 -1.531 6.006 1.00 0.00 O ATOM 1544 CB SER A 329 6.118 1.575 6.322 1.00 0.00 C ATOM 1545 OG SER A 329 5.300 2.735 6.338 1.00 0.00 O ATOM 0 H SER A 329 6.075 1.130 8.969 1.00 0.00 H new ATOM 0 HA SER A 329 4.508 0.216 6.624 1.00 0.00 H new ATOM 0 HB2 SER A 329 7.089 1.805 6.761 1.00 0.00 H new ATOM 0 HB3 SER A 329 6.299 1.269 5.292 1.00 0.00 H new ATOM 0 HG SER A 329 5.160 3.024 7.264 1.00 0.00 H new ATOM 1551 N ALA A 330 6.939 -1.189 8.135 1.00 0.00 N ATOM 1552 CA ALA A 330 7.638 -2.474 8.275 1.00 0.00 C ATOM 1553 C ALA A 330 8.793 -2.649 7.292 1.00 0.00 C ATOM 1554 O ALA A 330 9.305 -1.683 6.722 1.00 0.00 O ATOM 1555 CB ALA A 330 6.648 -3.623 8.118 1.00 0.00 C ATOM 0 H ALA A 330 6.974 -0.604 8.970 1.00 0.00 H new ATOM 0 HA ALA A 330 8.075 -2.481 9.274 1.00 0.00 H new ATOM 0 HB1 ALA A 330 7.173 -4.572 8.223 1.00 0.00 H new ATOM 0 HB2 ALA A 330 5.878 -3.547 8.886 1.00 0.00 H new ATOM 0 HB3 ALA A 330 6.184 -3.572 7.133 1.00 0.00 H new ATOM 1561 N ALA A 331 9.196 -3.906 7.116 1.00 0.00 N ATOM 1562 CA ALA A 331 10.286 -4.258 6.215 1.00 0.00 C ATOM 1563 C ALA A 331 9.810 -4.248 4.773 1.00 0.00 C ATOM 1564 O ALA A 331 8.684 -4.660 4.475 1.00 0.00 O ATOM 1565 CB ALA A 331 10.852 -5.623 6.574 1.00 0.00 C ATOM 0 H ALA A 331 8.777 -4.704 7.593 1.00 0.00 H new ATOM 0 HA ALA A 331 11.075 -3.514 6.324 1.00 0.00 H new ATOM 0 HB1 ALA A 331 11.665 -5.871 5.892 1.00 0.00 H new ATOM 0 HB2 ALA A 331 11.230 -5.603 7.596 1.00 0.00 H new ATOM 0 HB3 ALA A 331 10.067 -6.375 6.492 1.00 0.00 H new ATOM 1571 N ILE A 332 10.637 -3.716 3.891 1.00 0.00 N ATOM 1572 CA ILE A 332 10.266 -3.572 2.495 1.00 0.00 C ATOM 1573 C ILE A 332 11.257 -4.281 1.578 1.00 0.00 C ATOM 1574 O ILE A 332 12.463 -4.283 1.824 1.00 0.00 O ATOM 1575 CB ILE A 332 10.171 -2.086 2.107 1.00 0.00 C ATOM 1576 CG1 ILE A 332 9.163 -1.372 2.997 1.00 0.00 C ATOM 1577 CG2 ILE A 332 9.768 -1.932 0.656 1.00 0.00 C ATOM 1578 CD1 ILE A 332 8.996 0.079 2.638 1.00 0.00 C ATOM 0 H ILE A 332 11.572 -3.376 4.117 1.00 0.00 H new ATOM 0 HA ILE A 332 9.288 -4.037 2.370 1.00 0.00 H new ATOM 0 HB ILE A 332 11.155 -1.638 2.245 1.00 0.00 H new ATOM 0 HG12 ILE A 332 8.198 -1.874 2.921 1.00 0.00 H new ATOM 0 HG13 ILE A 332 9.483 -1.450 4.036 1.00 0.00 H new ATOM 0 HG21 ILE A 332 9.708 -0.873 0.406 1.00 0.00 H new ATOM 0 HG22 ILE A 332 10.510 -2.414 0.019 1.00 0.00 H new ATOM 0 HG23 ILE A 332 8.796 -2.398 0.497 1.00 0.00 H new ATOM 0 HD11 ILE A 332 8.266 0.537 3.305 1.00 0.00 H new ATOM 0 HD12 ILE A 332 9.953 0.592 2.740 1.00 0.00 H new ATOM 0 HD13 ILE A 332 8.648 0.161 1.608 1.00 0.00 H new ATOM 1590 N THR A 333 10.738 -4.835 0.492 1.00 0.00 N ATOM 1591 CA THR A 333 11.569 -5.497 -0.501 1.00 0.00 C ATOM 1592 C THR A 333 11.680 -4.624 -1.748 1.00 0.00 C ATOM 1593 O THR A 333 10.755 -4.566 -2.554 1.00 0.00 O ATOM 1594 CB THR A 333 10.974 -6.865 -0.849 1.00 0.00 C ATOM 1595 OG1 THR A 333 10.856 -7.669 0.317 1.00 0.00 O ATOM 1596 CG2 THR A 333 11.792 -7.644 -1.857 1.00 0.00 C ATOM 0 H THR A 333 9.741 -4.839 0.276 1.00 0.00 H new ATOM 0 HA THR A 333 12.569 -5.648 -0.094 1.00 0.00 H new ATOM 0 HB THR A 333 10.000 -6.649 -1.289 1.00 0.00 H new ATOM 0 HG1 THR A 333 10.473 -8.539 0.077 1.00 0.00 H new ATOM 0 HG21 THR A 333 11.310 -8.601 -2.055 1.00 0.00 H new ATOM 0 HG22 THR A 333 11.864 -7.076 -2.784 1.00 0.00 H new ATOM 0 HG23 THR A 333 12.792 -7.817 -1.459 1.00 0.00 H new ATOM 1604 N ILE A 334 12.768 -3.870 -1.845 1.00 0.00 N ATOM 1605 CA ILE A 334 12.943 -2.909 -2.930 1.00 0.00 C ATOM 1606 C ILE A 334 13.564 -3.551 -4.168 1.00 0.00 C ATOM 1607 O ILE A 334 14.737 -3.934 -4.161 1.00 0.00 O ATOM 1608 CB ILE A 334 13.820 -1.717 -2.474 1.00 0.00 C ATOM 1609 CG1 ILE A 334 13.130 -0.952 -1.346 1.00 0.00 C ATOM 1610 CG2 ILE A 334 14.108 -0.776 -3.638 1.00 0.00 C ATOM 1611 CD1 ILE A 334 11.888 -0.216 -1.795 1.00 0.00 C ATOM 0 H ILE A 334 13.545 -3.905 -1.185 1.00 0.00 H new ATOM 0 HA ILE A 334 11.949 -2.549 -3.194 1.00 0.00 H new ATOM 0 HB ILE A 334 14.767 -2.115 -2.109 1.00 0.00 H new ATOM 0 HG12 ILE A 334 12.863 -1.650 -0.553 1.00 0.00 H new ATOM 0 HG13 ILE A 334 13.833 -0.237 -0.918 1.00 0.00 H new ATOM 0 HG21 ILE A 334 14.725 0.053 -3.292 1.00 0.00 H new ATOM 0 HG22 ILE A 334 14.636 -1.319 -4.422 1.00 0.00 H new ATOM 0 HG23 ILE A 334 13.169 -0.388 -4.033 1.00 0.00 H new ATOM 0 HD11 ILE A 334 11.447 0.306 -0.946 1.00 0.00 H new ATOM 0 HD12 ILE A 334 12.152 0.506 -2.567 1.00 0.00 H new ATOM 0 HD13 ILE A 334 11.168 -0.929 -2.196 1.00 0.00 H new ATOM 1623 N LEU A 335 12.809 -3.539 -5.261 1.00 0.00 N ATOM 1624 CA LEU A 335 13.315 -3.982 -6.553 1.00 0.00 C ATOM 1625 C LEU A 335 12.764 -3.082 -7.653 1.00 0.00 C ATOM 1626 O LEU A 335 11.586 -2.731 -7.651 1.00 0.00 O ATOM 1627 CB LEU A 335 12.960 -5.454 -6.848 1.00 0.00 C ATOM 1628 CG LEU A 335 11.464 -5.807 -6.948 1.00 0.00 C ATOM 1629 CD1 LEU A 335 11.296 -7.226 -7.459 1.00 0.00 C ATOM 1630 CD2 LEU A 335 10.766 -5.676 -5.603 1.00 0.00 C ATOM 0 H LEU A 335 11.839 -3.225 -5.276 1.00 0.00 H new ATOM 0 HA LEU A 335 14.402 -3.913 -6.523 1.00 0.00 H new ATOM 0 HB2 LEU A 335 13.438 -5.736 -7.786 1.00 0.00 H new ATOM 0 HB3 LEU A 335 13.402 -6.072 -6.067 1.00 0.00 H new ATOM 0 HG LEU A 335 11.008 -5.103 -7.644 1.00 0.00 H new ATOM 0 HD11 LEU A 335 10.235 -7.465 -7.526 1.00 0.00 H new ATOM 0 HD12 LEU A 335 11.751 -7.314 -8.446 1.00 0.00 H new ATOM 0 HD13 LEU A 335 11.782 -7.920 -6.773 1.00 0.00 H new ATOM 0 HD21 LEU A 335 9.712 -5.933 -5.713 1.00 0.00 H new ATOM 0 HD22 LEU A 335 11.231 -6.351 -4.885 1.00 0.00 H new ATOM 0 HD23 LEU A 335 10.854 -4.650 -5.246 1.00 0.00 H new ATOM 1642 N ASN A 336 13.620 -2.667 -8.566 1.00 0.00 N ATOM 1643 CA ASN A 336 13.200 -1.766 -9.628 1.00 0.00 C ATOM 1644 C ASN A 336 13.103 -2.527 -10.942 1.00 0.00 C ATOM 1645 O ASN A 336 14.036 -2.515 -11.747 1.00 0.00 O ATOM 1646 CB ASN A 336 14.186 -0.598 -9.755 1.00 0.00 C ATOM 1647 CG ASN A 336 13.726 0.491 -10.715 1.00 0.00 C ATOM 1648 OD1 ASN A 336 12.512 0.372 -11.238 1.00 0.00 O flip ATOM 1649 ND2 ASN A 336 14.454 1.452 -10.963 1.00 0.00 N flip ATOM 0 H ASN A 336 14.604 -2.935 -8.597 1.00 0.00 H new ATOM 0 HA ASN A 336 12.218 -1.361 -9.383 1.00 0.00 H new ATOM 0 HB2 ASN A 336 14.344 -0.159 -8.770 1.00 0.00 H new ATOM 0 HB3 ASN A 336 15.149 -0.982 -10.090 1.00 0.00 H new ATOM 0 HD21 ASN A 336 15.382 1.511 -10.543 1.00 0.00 H new ATOM 0 HD22 ASN A 336 14.130 2.190 -11.588 1.00 0.00 H new ATOM 1656 N LYS A 337 11.974 -3.192 -11.153 1.00 0.00 N ATOM 1657 CA LYS A 337 11.766 -3.960 -12.375 1.00 0.00 C ATOM 1658 C LYS A 337 11.234 -3.055 -13.480 1.00 0.00 C ATOM 1659 O LYS A 337 11.190 -3.497 -14.641 1.00 0.00 O ATOM 1660 CB LYS A 337 10.785 -5.111 -12.142 1.00 0.00 C ATOM 1661 CG LYS A 337 9.367 -4.654 -11.838 1.00 0.00 C ATOM 1662 CD LYS A 337 8.429 -5.834 -11.654 1.00 0.00 C ATOM 1663 CE LYS A 337 6.987 -5.377 -11.500 1.00 0.00 C ATOM 1664 NZ LYS A 337 6.812 -4.441 -10.361 1.00 0.00 N1+ ATOM 0 H LYS A 337 11.192 -3.216 -10.498 1.00 0.00 H new ATOM 0 HA LYS A 337 12.727 -4.378 -12.676 1.00 0.00 H new ATOM 0 HB2 LYS A 337 10.770 -5.748 -13.026 1.00 0.00 H new ATOM 0 HB3 LYS A 337 11.146 -5.722 -11.314 1.00 0.00 H new ATOM 0 HG2 LYS A 337 9.366 -4.043 -10.935 1.00 0.00 H new ATOM 0 HG3 LYS A 337 9.005 -4.023 -12.650 1.00 0.00 H new ATOM 0 HD2 LYS A 337 8.511 -6.503 -12.511 1.00 0.00 H new ATOM 0 HD3 LYS A 337 8.727 -6.404 -10.774 1.00 0.00 H new ATOM 0 HE2 LYS A 337 6.662 -4.891 -12.420 1.00 0.00 H new ATOM 0 HE3 LYS A 337 6.346 -6.247 -11.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 337 5.798 -4.263 -10.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 337 7.221 -4.860 -9.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 337 7.293 -3.544 -10.572 1.00 0.00 H new