USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 545 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 280 ASN : amide:sc= -0.112 X(o=-0.11,f=0.0052) USER MOD Set 1.2: A 281 ASN : amide:sc= 0 X(o=-0.11,f=0.0052) USER MOD Single : A 249 MET CE :methyl -175:sc= 0 (180deg=-0.0103) USER MOD Single : A 251 GLN : amide:sc= -0.2 K(o=-0.2,f=-2.1!) USER MOD Single : A 252 CYS SG : rot -140:sc= -4.93 USER MOD Single : A 254 SER OG : rot 88:sc= -0.267! USER MOD Single : A 260 GLN : amide:sc= -0.0097 X(o=-0.0097,f=-0.0097) USER MOD Single : A 263 THR OG1 : rot 80:sc= 0.0906 USER MOD Single : A 267 GLN : amide:sc= -2.77! C(o=-2.8!,f=-8.7!) USER MOD Single : A 275 SER OG : rot -10:sc= -3.77! USER MOD Single : A 276 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0105) USER MOD Single : A 278 THR OG1 : rot 43:sc= 0.0538 USER MOD Single : A 279 THR OG1 : rot 180:sc= 0.0582 USER MOD Single : A 284 ASN : amide:sc= -2.55 K(o=-2.5,f=-11!) USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 299 SER OG : rot 79:sc= 0.071 USER MOD Single : A 300 THR OG1 : rot -53:sc= -1.15! USER MOD Single : A 302 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 305 LYS NZ :NH3+ 167:sc=-0.00436 (180deg=-0.244) USER MOD Single : A 306 MET CE :methyl 159:sc= -5.29! (180deg=-8.64!) USER MOD Single : A 309 HIS : no HE2:sc= -27.9! C(o=-28!,f=-29!) USER MOD Single : A 310 THR OG1 : rot 57:sc= 0.705 USER MOD Single : A 311 ASN : amide:sc= -1.57 X(o=-1.6,f=-1.8) USER MOD Single : A 312 CYS SG : rot 180:sc= -1.44 USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -5.149 -15.399 3.289 1.00 0.00 N ATOM 76 CA ARG A 247 -4.740 -14.664 2.097 1.00 0.00 C ATOM 77 C ARG A 247 -5.225 -13.236 2.150 1.00 0.00 C ATOM 78 O ARG A 247 -5.989 -12.854 3.037 1.00 0.00 O ATOM 79 CB ARG A 247 -5.253 -15.356 0.833 1.00 0.00 C ATOM 80 CG ARG A 247 -4.345 -15.175 -0.373 1.00 0.00 C ATOM 81 CD ARG A 247 -4.208 -16.464 -1.170 1.00 0.00 C ATOM 82 NE ARG A 247 -4.643 -16.300 -2.555 1.00 0.00 N ATOM 83 CZ ARG A 247 -5.919 -16.317 -2.939 1.00 0.00 C ATOM 84 NH1 ARG A 247 -6.885 -16.486 -2.045 1.00 0.00 N ATOM 85 NH2 ARG A 247 -6.227 -16.163 -4.218 1.00 0.00 N ATOM 0 HA ARG A 247 -3.650 -14.652 2.067 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -5.368 -16.421 1.034 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -6.243 -14.968 0.593 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -4.745 -14.390 -1.015 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -3.360 -14.845 -0.042 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -3.169 -16.792 -1.153 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -4.798 -17.248 -0.695 1.00 0.00 H new ATOM 0 HE ARG A 247 -3.928 -16.165 -3.270 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -6.652 -16.604 -1.059 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -7.860 -16.498 -2.344 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -5.488 -16.032 -4.908 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -7.203 -16.176 -4.513 1.00 0.00 H new ATOM 99 N TRP A 248 -4.733 -12.434 1.221 1.00 0.00 N ATOM 100 CA TRP A 248 -5.079 -11.028 1.202 1.00 0.00 C ATOM 101 C TRP A 248 -5.066 -10.394 -0.179 1.00 0.00 C ATOM 102 O TRP A 248 -4.712 -11.003 -1.186 1.00 0.00 O ATOM 103 CB TRP A 248 -4.082 -10.274 2.061 1.00 0.00 C ATOM 104 CG TRP A 248 -4.387 -10.278 3.514 1.00 0.00 C ATOM 105 CD1 TRP A 248 -3.776 -11.020 4.471 1.00 0.00 C ATOM 106 CD2 TRP A 248 -5.370 -9.487 4.168 1.00 0.00 C ATOM 107 NE1 TRP A 248 -4.288 -10.696 5.709 1.00 0.00 N ATOM 108 CE2 TRP A 248 -5.280 -9.757 5.541 1.00 0.00 C ATOM 109 CE3 TRP A 248 -6.309 -8.566 3.720 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -6.102 -9.119 6.470 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -7.129 -7.947 4.636 1.00 0.00 C ATOM 112 CH2 TRP A 248 -7.017 -8.221 6.000 1.00 0.00 C ATOM 0 H TRP A 248 -4.100 -12.731 0.479 1.00 0.00 H new ATOM 0 HA TRP A 248 -6.102 -10.964 1.574 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -3.093 -10.706 1.910 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -4.034 -9.241 1.716 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -3.005 -11.754 4.290 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -3.983 -11.087 6.600 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -6.394 -8.339 2.668 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -6.018 -9.328 7.526 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -7.870 -7.239 4.294 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -7.667 -7.713 6.697 1.00 0.00 H new ATOM 123 N MET A 249 -5.428 -9.122 -0.146 1.00 0.00 N ATOM 124 CA MET A 249 -5.470 -8.229 -1.294 1.00 0.00 C ATOM 125 C MET A 249 -5.560 -6.819 -0.733 1.00 0.00 C ATOM 126 O MET A 249 -6.629 -6.209 -0.693 1.00 0.00 O ATOM 127 CB MET A 249 -6.669 -8.499 -2.180 1.00 0.00 C ATOM 128 CG MET A 249 -6.872 -9.967 -2.522 1.00 0.00 C ATOM 129 SD MET A 249 -8.163 -10.220 -3.755 1.00 0.00 S ATOM 130 CE MET A 249 -7.222 -10.055 -5.270 1.00 0.00 C ATOM 0 H MET A 249 -5.713 -8.663 0.719 1.00 0.00 H new ATOM 0 HA MET A 249 -4.584 -8.375 -1.912 1.00 0.00 H new ATOM 0 HB2 MET A 249 -7.565 -8.126 -1.684 1.00 0.00 H new ATOM 0 HB3 MET A 249 -6.558 -7.934 -3.105 1.00 0.00 H new ATOM 0 HG2 MET A 249 -5.935 -10.383 -2.892 1.00 0.00 H new ATOM 0 HG3 MET A 249 -7.128 -10.515 -1.615 1.00 0.00 H new ATOM 0 HE1 MET A 249 -7.898 -10.098 -6.124 1.00 0.00 H new ATOM 0 HE2 MET A 249 -6.697 -9.100 -5.270 1.00 0.00 H new ATOM 0 HE3 MET A 249 -6.498 -10.867 -5.339 1.00 0.00 H new ATOM 140 N VAL A 250 -4.439 -6.356 -0.225 1.00 0.00 N ATOM 141 CA VAL A 250 -4.354 -5.062 0.443 1.00 0.00 C ATOM 142 C VAL A 250 -4.666 -3.888 -0.463 1.00 0.00 C ATOM 143 O VAL A 250 -4.426 -3.927 -1.670 1.00 0.00 O ATOM 144 CB VAL A 250 -2.965 -4.854 1.075 1.00 0.00 C ATOM 145 CG1 VAL A 250 -1.869 -5.135 0.065 1.00 0.00 C ATOM 146 CG2 VAL A 250 -2.841 -3.446 1.641 1.00 0.00 C ATOM 0 H VAL A 250 -3.554 -6.863 -0.260 1.00 0.00 H new ATOM 0 HA VAL A 250 -5.120 -5.089 1.218 1.00 0.00 H new ATOM 0 HB VAL A 250 -2.851 -5.560 1.898 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -0.896 -4.982 0.532 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -1.948 -6.166 -0.280 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -1.974 -4.459 -0.784 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -1.853 -3.317 2.083 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -2.978 -2.719 0.841 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -3.603 -3.292 2.405 1.00 0.00 H new ATOM 156 N GLN A 251 -5.182 -2.822 0.151 1.00 0.00 N ATOM 157 CA GLN A 251 -5.503 -1.612 -0.565 1.00 0.00 C ATOM 158 C GLN A 251 -5.270 -0.448 0.357 1.00 0.00 C ATOM 159 O GLN A 251 -6.147 0.380 0.609 1.00 0.00 O ATOM 160 CB GLN A 251 -6.939 -1.650 -1.059 1.00 0.00 C ATOM 161 CG GLN A 251 -7.367 -0.397 -1.805 1.00 0.00 C ATOM 162 CD GLN A 251 -8.447 -0.670 -2.834 1.00 0.00 C ATOM 163 OE1 GLN A 251 -8.595 -1.795 -3.311 1.00 0.00 O ATOM 164 NE2 GLN A 251 -9.208 0.362 -3.181 1.00 0.00 N ATOM 0 H GLN A 251 -5.383 -2.784 1.150 1.00 0.00 H new ATOM 0 HA GLN A 251 -4.867 -1.512 -1.444 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -7.065 -2.512 -1.714 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -7.602 -1.798 -0.207 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -7.730 0.341 -1.090 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -6.500 0.040 -2.301 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -9.049 1.277 -2.759 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -9.951 0.239 -3.869 1.00 0.00 H new ATOM 173 N CYS A 252 -4.059 -0.425 0.866 1.00 0.00 N ATOM 174 CA CYS A 252 -3.624 0.593 1.790 1.00 0.00 C ATOM 175 C CYS A 252 -3.143 1.816 1.042 1.00 0.00 C ATOM 176 O CYS A 252 -1.992 2.230 1.186 1.00 0.00 O ATOM 177 CB CYS A 252 -2.507 0.047 2.675 1.00 0.00 C ATOM 178 SG CYS A 252 -3.060 -1.104 3.955 1.00 0.00 S ATOM 0 H CYS A 252 -3.344 -1.119 0.647 1.00 0.00 H new ATOM 0 HA CYS A 252 -4.468 0.881 2.417 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -1.774 -0.456 2.044 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -1.997 0.884 3.152 1.00 0.00 H new ATOM 0 HG CYS A 252 -2.406 -0.877 5.055 1.00 0.00 H new ATOM 184 N GLY A 253 -4.018 2.386 0.227 1.00 0.00 N ATOM 185 CA GLY A 253 -3.623 3.537 -0.539 1.00 0.00 C ATOM 186 C GLY A 253 -4.693 4.589 -0.706 1.00 0.00 C ATOM 187 O GLY A 253 -5.544 4.783 0.161 1.00 0.00 O ATOM 0 H GLY A 253 -4.979 2.074 0.087 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -2.757 3.994 -0.060 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -3.303 3.205 -1.527 1.00 0.00 H new ATOM 191 N SER A 254 -4.608 5.291 -1.832 1.00 0.00 N ATOM 192 CA SER A 254 -5.520 6.374 -2.162 1.00 0.00 C ATOM 193 C SER A 254 -5.093 7.610 -1.392 1.00 0.00 C ATOM 194 O SER A 254 -5.744 8.025 -0.433 1.00 0.00 O ATOM 195 CB SER A 254 -6.972 6.000 -1.848 1.00 0.00 C ATOM 196 OG SER A 254 -7.131 4.595 -1.740 1.00 0.00 O ATOM 0 H SER A 254 -3.898 5.121 -2.544 1.00 0.00 H new ATOM 0 HA SER A 254 -5.475 6.573 -3.233 1.00 0.00 H new ATOM 0 HB2 SER A 254 -7.279 6.475 -0.916 1.00 0.00 H new ATOM 0 HB3 SER A 254 -7.626 6.383 -2.632 1.00 0.00 H new ATOM 0 HG SER A 254 -6.952 4.315 -0.818 1.00 0.00 H new ATOM 202 N PHE A 255 -3.949 8.157 -1.795 1.00 0.00 N ATOM 203 CA PHE A 255 -3.370 9.313 -1.121 1.00 0.00 C ATOM 204 C PHE A 255 -3.186 10.500 -2.055 1.00 0.00 C ATOM 205 O PHE A 255 -2.507 10.403 -3.079 1.00 0.00 O ATOM 206 CB PHE A 255 -2.016 8.944 -0.458 1.00 0.00 C ATOM 207 CG PHE A 255 -1.352 7.689 -0.998 1.00 0.00 C ATOM 208 CD1 PHE A 255 -2.070 6.510 -1.119 1.00 0.00 C ATOM 209 CD2 PHE A 255 -0.017 7.684 -1.399 1.00 0.00 C ATOM 210 CE1 PHE A 255 -1.486 5.369 -1.626 1.00 0.00 C ATOM 211 CE2 PHE A 255 0.561 6.533 -1.898 1.00 0.00 C ATOM 212 CZ PHE A 255 -0.173 5.380 -2.012 1.00 0.00 C ATOM 0 H PHE A 255 -3.404 7.816 -2.587 1.00 0.00 H new ATOM 0 HA PHE A 255 -4.079 9.611 -0.349 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -1.329 9.781 -0.582 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -2.176 8.819 0.613 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -3.105 6.485 -0.811 1.00 0.00 H new ATOM 0 HD2 PHE A 255 0.570 8.587 -1.319 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -2.067 4.463 -1.719 1.00 0.00 H new ATOM 0 HE2 PHE A 255 1.598 6.541 -2.200 1.00 0.00 H new ATOM 0 HZ PHE A 255 0.284 4.484 -2.405 1.00 0.00 H new ATOM 222 N ARG A 256 -3.775 11.637 -1.672 1.00 0.00 N ATOM 223 CA ARG A 256 -3.660 12.866 -2.456 1.00 0.00 C ATOM 224 C ARG A 256 -2.195 13.168 -2.750 1.00 0.00 C ATOM 225 O ARG A 256 -1.874 13.888 -3.696 1.00 0.00 O ATOM 226 CB ARG A 256 -4.295 14.041 -1.706 1.00 0.00 C ATOM 227 CG ARG A 256 -5.127 14.952 -2.596 1.00 0.00 C ATOM 228 CD ARG A 256 -5.366 16.305 -1.945 1.00 0.00 C ATOM 229 NE ARG A 256 -4.607 17.370 -2.597 1.00 0.00 N ATOM 230 CZ ARG A 256 -4.809 17.765 -3.852 1.00 0.00 C ATOM 231 NH1 ARG A 256 -5.745 17.185 -4.594 1.00 0.00 N ATOM 232 NH2 ARG A 256 -4.076 18.742 -4.366 1.00 0.00 N ATOM 0 H ARG A 256 -4.335 11.730 -0.825 1.00 0.00 H new ATOM 0 HA ARG A 256 -4.189 12.725 -3.398 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -4.926 13.653 -0.906 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -3.507 14.628 -1.234 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -4.619 15.092 -3.550 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -6.084 14.477 -2.810 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -6.429 16.542 -1.983 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -5.088 16.255 -0.892 1.00 0.00 H new ATOM 0 HE ARG A 256 -3.879 17.839 -2.058 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -6.313 16.433 -4.203 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -5.896 17.491 -5.555 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -3.357 19.192 -3.800 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -4.231 19.044 -5.328 1.00 0.00 H new ATOM 246 N GLY A 257 -1.314 12.593 -1.935 1.00 0.00 N ATOM 247 CA GLY A 257 0.107 12.773 -2.107 1.00 0.00 C ATOM 248 C GLY A 257 0.605 12.084 -3.360 1.00 0.00 C ATOM 249 O GLY A 257 1.447 11.201 -3.288 1.00 0.00 O ATOM 0 H GLY A 257 -1.571 11.997 -1.148 1.00 0.00 H new ATOM 0 HA2 GLY A 257 0.336 13.837 -2.160 1.00 0.00 H new ATOM 0 HA3 GLY A 257 0.633 12.376 -1.239 1.00 0.00 H new ATOM 253 N ALA A 258 0.064 12.485 -4.507 1.00 0.00 N ATOM 254 CA ALA A 258 0.430 11.904 -5.798 1.00 0.00 C ATOM 255 C ALA A 258 1.929 11.671 -5.899 1.00 0.00 C ATOM 256 O ALA A 258 2.377 10.583 -6.260 1.00 0.00 O ATOM 257 CB ALA A 258 -0.040 12.804 -6.931 1.00 0.00 C ATOM 0 H ALA A 258 -0.640 13.221 -4.569 1.00 0.00 H new ATOM 0 HA ALA A 258 -0.064 10.936 -5.881 1.00 0.00 H new ATOM 0 HB1 ALA A 258 0.238 12.361 -7.887 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -1.123 12.913 -6.883 1.00 0.00 H new ATOM 0 HB3 ALA A 258 0.428 13.784 -6.835 1.00 0.00 H new ATOM 263 N GLU A 259 2.698 12.695 -5.562 1.00 0.00 N ATOM 264 CA GLU A 259 4.152 12.587 -5.599 1.00 0.00 C ATOM 265 C GLU A 259 4.608 11.578 -4.558 1.00 0.00 C ATOM 266 O GLU A 259 5.298 10.609 -4.876 1.00 0.00 O ATOM 267 CB GLU A 259 4.807 13.946 -5.342 1.00 0.00 C ATOM 268 CG GLU A 259 4.790 14.867 -6.551 1.00 0.00 C ATOM 269 CD GLU A 259 6.114 14.883 -7.289 1.00 0.00 C ATOM 270 OE1 GLU A 259 6.575 13.799 -7.705 1.00 0.00 O ATOM 271 OE2 GLU A 259 6.692 15.979 -7.451 1.00 0.00 O ATOM 0 H GLU A 259 2.345 13.604 -5.262 1.00 0.00 H new ATOM 0 HA GLU A 259 4.455 12.250 -6.590 1.00 0.00 H new ATOM 0 HB2 GLU A 259 4.294 14.437 -4.515 1.00 0.00 H new ATOM 0 HB3 GLU A 259 5.839 13.789 -5.029 1.00 0.00 H new ATOM 0 HG2 GLU A 259 4.001 14.550 -7.234 1.00 0.00 H new ATOM 0 HG3 GLU A 259 4.545 15.879 -6.229 1.00 0.00 H new ATOM 278 N GLN A 260 4.182 11.791 -3.319 1.00 0.00 N ATOM 279 CA GLN A 260 4.512 10.875 -2.238 1.00 0.00 C ATOM 280 C GLN A 260 3.923 9.504 -2.539 1.00 0.00 C ATOM 281 O GLN A 260 4.375 8.490 -2.012 1.00 0.00 O ATOM 282 CB GLN A 260 3.958 11.392 -0.909 1.00 0.00 C ATOM 283 CG GLN A 260 4.876 12.379 -0.208 1.00 0.00 C ATOM 284 CD GLN A 260 6.055 11.704 0.464 1.00 0.00 C ATOM 285 OE1 GLN A 260 7.161 11.677 -0.075 1.00 0.00 O ATOM 286 NE2 GLN A 260 5.824 11.153 1.651 1.00 0.00 N ATOM 0 H GLN A 260 3.609 12.588 -3.040 1.00 0.00 H new ATOM 0 HA GLN A 260 5.597 10.801 -2.158 1.00 0.00 H new ATOM 0 HB2 GLN A 260 2.995 11.869 -1.088 1.00 0.00 H new ATOM 0 HB3 GLN A 260 3.776 10.545 -0.247 1.00 0.00 H new ATOM 0 HG2 GLN A 260 5.243 13.106 -0.933 1.00 0.00 H new ATOM 0 HG3 GLN A 260 4.306 12.933 0.538 1.00 0.00 H new ATOM 0 HE21 GLN A 260 4.891 11.199 2.062 1.00 0.00 H new ATOM 0 HE22 GLN A 260 6.579 10.685 2.152 1.00 0.00 H new ATOM 295 N ALA A 261 2.906 9.496 -3.400 1.00 0.00 N ATOM 296 CA ALA A 261 2.232 8.276 -3.798 1.00 0.00 C ATOM 297 C ALA A 261 3.120 7.456 -4.720 1.00 0.00 C ATOM 298 O ALA A 261 3.373 6.277 -4.473 1.00 0.00 O ATOM 299 CB ALA A 261 0.908 8.602 -4.460 1.00 0.00 C ATOM 0 H ALA A 261 2.532 10.338 -3.837 1.00 0.00 H new ATOM 0 HA ALA A 261 2.029 7.678 -2.910 1.00 0.00 H new ATOM 0 HB1 ALA A 261 0.411 7.678 -4.755 1.00 0.00 H new ATOM 0 HB2 ALA A 261 0.275 9.147 -3.759 1.00 0.00 H new ATOM 0 HB3 ALA A 261 1.084 9.216 -5.343 1.00 0.00 H new ATOM 305 N GLU A 262 3.614 8.100 -5.770 1.00 0.00 N ATOM 306 CA GLU A 262 4.504 7.441 -6.712 1.00 0.00 C ATOM 307 C GLU A 262 5.773 7.025 -5.983 1.00 0.00 C ATOM 308 O GLU A 262 6.249 5.900 -6.131 1.00 0.00 O ATOM 309 CB GLU A 262 4.825 8.386 -7.878 1.00 0.00 C ATOM 310 CG GLU A 262 6.023 7.958 -8.712 1.00 0.00 C ATOM 311 CD GLU A 262 5.790 6.645 -9.435 1.00 0.00 C ATOM 312 OE1 GLU A 262 4.680 6.454 -9.977 1.00 0.00 O ATOM 313 OE2 GLU A 262 6.715 5.808 -9.458 1.00 0.00 O ATOM 0 H GLU A 262 3.413 9.076 -5.989 1.00 0.00 H new ATOM 0 HA GLU A 262 4.023 6.553 -7.122 1.00 0.00 H new ATOM 0 HB2 GLU A 262 3.951 8.456 -8.526 1.00 0.00 H new ATOM 0 HB3 GLU A 262 5.009 9.385 -7.482 1.00 0.00 H new ATOM 0 HG2 GLU A 262 6.250 8.735 -9.442 1.00 0.00 H new ATOM 0 HG3 GLU A 262 6.896 7.863 -8.066 1.00 0.00 H new ATOM 320 N THR A 263 6.290 7.931 -5.159 1.00 0.00 N ATOM 321 CA THR A 263 7.472 7.639 -4.367 1.00 0.00 C ATOM 322 C THR A 263 7.117 6.580 -3.333 1.00 0.00 C ATOM 323 O THR A 263 7.961 5.781 -2.924 1.00 0.00 O ATOM 324 CB THR A 263 7.990 8.903 -3.678 1.00 0.00 C ATOM 325 OG1 THR A 263 8.332 9.892 -4.633 1.00 0.00 O ATOM 326 CG2 THR A 263 9.209 8.658 -2.815 1.00 0.00 C ATOM 0 H THR A 263 5.909 8.868 -5.025 1.00 0.00 H new ATOM 0 HA THR A 263 8.263 7.269 -5.019 1.00 0.00 H new ATOM 0 HB THR A 263 7.173 9.237 -3.039 1.00 0.00 H new ATOM 0 HG1 THR A 263 7.519 10.345 -4.940 1.00 0.00 H new ATOM 0 HG21 THR A 263 9.524 9.595 -2.356 1.00 0.00 H new ATOM 0 HG22 THR A 263 8.964 7.937 -2.035 1.00 0.00 H new ATOM 0 HG23 THR A 263 10.018 8.265 -3.431 1.00 0.00 H new ATOM 334 N VAL A 264 5.844 6.568 -2.934 1.00 0.00 N ATOM 335 CA VAL A 264 5.350 5.598 -1.971 1.00 0.00 C ATOM 336 C VAL A 264 5.548 4.187 -2.516 1.00 0.00 C ATOM 337 O VAL A 264 6.082 3.313 -1.834 1.00 0.00 O ATOM 338 CB VAL A 264 3.847 5.837 -1.645 1.00 0.00 C ATOM 339 CG1 VAL A 264 3.013 4.584 -1.897 1.00 0.00 C ATOM 340 CG2 VAL A 264 3.682 6.308 -0.208 1.00 0.00 C ATOM 0 H VAL A 264 5.138 7.224 -3.268 1.00 0.00 H new ATOM 0 HA VAL A 264 5.916 5.717 -1.047 1.00 0.00 H new ATOM 0 HB VAL A 264 3.483 6.617 -2.314 1.00 0.00 H new ATOM 0 HG11 VAL A 264 1.969 4.788 -1.659 1.00 0.00 H new ATOM 0 HG12 VAL A 264 3.097 4.296 -2.945 1.00 0.00 H new ATOM 0 HG13 VAL A 264 3.377 3.772 -1.268 1.00 0.00 H new ATOM 0 HG21 VAL A 264 2.625 6.470 0.003 1.00 0.00 H new ATOM 0 HG22 VAL A 264 4.075 5.551 0.470 1.00 0.00 H new ATOM 0 HG23 VAL A 264 4.228 7.241 -0.066 1.00 0.00 H new ATOM 350 N ARG A 265 5.109 3.981 -3.757 1.00 0.00 N ATOM 351 CA ARG A 265 5.228 2.684 -4.416 1.00 0.00 C ATOM 352 C ARG A 265 6.616 2.090 -4.206 1.00 0.00 C ATOM 353 O ARG A 265 6.760 0.901 -3.927 1.00 0.00 O ATOM 354 CB ARG A 265 4.954 2.822 -5.918 1.00 0.00 C ATOM 355 CG ARG A 265 4.463 1.530 -6.555 1.00 0.00 C ATOM 356 CD ARG A 265 4.006 1.733 -7.993 1.00 0.00 C ATOM 357 NE ARG A 265 3.307 3.003 -8.181 1.00 0.00 N ATOM 358 CZ ARG A 265 3.309 3.694 -9.320 1.00 0.00 C ATOM 359 NH1 ARG A 265 3.963 3.239 -10.383 1.00 0.00 N ATOM 360 NH2 ARG A 265 2.652 4.842 -9.397 1.00 0.00 N ATOM 0 H ARG A 265 4.666 4.701 -4.328 1.00 0.00 H new ATOM 0 HA ARG A 265 4.490 2.016 -3.973 1.00 0.00 H new ATOM 0 HB2 ARG A 265 4.211 3.603 -6.076 1.00 0.00 H new ATOM 0 HB3 ARG A 265 5.866 3.144 -6.420 1.00 0.00 H new ATOM 0 HG2 ARG A 265 5.262 0.789 -6.531 1.00 0.00 H new ATOM 0 HG3 ARG A 265 3.638 1.128 -5.967 1.00 0.00 H new ATOM 0 HD2 ARG A 265 4.871 1.696 -8.655 1.00 0.00 H new ATOM 0 HD3 ARG A 265 3.348 0.913 -8.282 1.00 0.00 H new ATOM 0 HE ARG A 265 2.786 3.384 -7.391 1.00 0.00 H new ATOM 0 HH11 ARG A 265 4.468 2.355 -10.331 1.00 0.00 H new ATOM 0 HH12 ARG A 265 3.960 3.774 -11.251 1.00 0.00 H new ATOM 0 HH21 ARG A 265 2.146 5.195 -8.585 1.00 0.00 H new ATOM 0 HH22 ARG A 265 2.652 5.372 -10.268 1.00 0.00 H new ATOM 374 N ALA A 266 7.631 2.932 -4.344 1.00 0.00 N ATOM 375 CA ALA A 266 9.008 2.499 -4.170 1.00 0.00 C ATOM 376 C ALA A 266 9.284 2.128 -2.720 1.00 0.00 C ATOM 377 O ALA A 266 9.864 1.081 -2.440 1.00 0.00 O ATOM 378 CB ALA A 266 9.964 3.587 -4.636 1.00 0.00 C ATOM 0 H ALA A 266 7.525 3.920 -4.576 1.00 0.00 H new ATOM 0 HA ALA A 266 9.167 1.609 -4.779 1.00 0.00 H new ATOM 0 HB1 ALA A 266 10.992 3.251 -4.501 1.00 0.00 H new ATOM 0 HB2 ALA A 266 9.788 3.799 -5.691 1.00 0.00 H new ATOM 0 HB3 ALA A 266 9.798 4.492 -4.051 1.00 0.00 H new ATOM 384 N GLN A 267 8.865 2.990 -1.799 1.00 0.00 N ATOM 385 CA GLN A 267 9.073 2.743 -0.377 1.00 0.00 C ATOM 386 C GLN A 267 8.467 1.407 0.042 1.00 0.00 C ATOM 387 O GLN A 267 9.098 0.633 0.757 1.00 0.00 O ATOM 388 CB GLN A 267 8.477 3.878 0.457 1.00 0.00 C ATOM 389 CG GLN A 267 9.522 4.799 1.065 1.00 0.00 C ATOM 390 CD GLN A 267 9.683 6.092 0.291 1.00 0.00 C ATOM 391 OE1 GLN A 267 9.292 6.184 -0.873 1.00 0.00 O ATOM 392 NE2 GLN A 267 10.261 7.100 0.934 1.00 0.00 N ATOM 0 H GLN A 267 8.381 3.863 -2.011 1.00 0.00 H new ATOM 0 HA GLN A 267 10.147 2.702 -0.198 1.00 0.00 H new ATOM 0 HB2 GLN A 267 7.807 4.466 -0.171 1.00 0.00 H new ATOM 0 HB3 GLN A 267 7.872 3.451 1.257 1.00 0.00 H new ATOM 0 HG2 GLN A 267 9.244 5.028 2.094 1.00 0.00 H new ATOM 0 HG3 GLN A 267 10.480 4.281 1.102 1.00 0.00 H new ATOM 0 HE21 GLN A 267 10.570 6.979 1.899 1.00 0.00 H new ATOM 0 HE22 GLN A 267 10.396 7.995 0.463 1.00 0.00 H new ATOM 401 N LEU A 268 7.245 1.131 -0.413 1.00 0.00 N ATOM 402 CA LEU A 268 6.579 -0.126 -0.078 1.00 0.00 C ATOM 403 C LEU A 268 7.440 -1.307 -0.508 1.00 0.00 C ATOM 404 O LEU A 268 7.622 -2.254 0.251 1.00 0.00 O ATOM 405 CB LEU A 268 5.176 -0.200 -0.736 1.00 0.00 C ATOM 406 CG LEU A 268 4.005 0.540 -0.030 1.00 0.00 C ATOM 407 CD1 LEU A 268 2.916 -0.437 0.428 1.00 0.00 C ATOM 408 CD2 LEU A 268 4.483 1.387 1.142 1.00 0.00 C ATOM 0 H LEU A 268 6.701 1.755 -1.009 1.00 0.00 H new ATOM 0 HA LEU A 268 6.444 -0.169 1.003 1.00 0.00 H new ATOM 0 HB2 LEU A 268 5.260 0.195 -1.749 1.00 0.00 H new ATOM 0 HB3 LEU A 268 4.903 -1.251 -0.825 1.00 0.00 H new ATOM 0 HG LEU A 268 3.574 1.213 -0.772 1.00 0.00 H new ATOM 0 HD11 LEU A 268 2.114 0.116 0.917 1.00 0.00 H new ATOM 0 HD12 LEU A 268 2.517 -0.968 -0.436 1.00 0.00 H new ATOM 0 HD13 LEU A 268 3.342 -1.154 1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 268 3.630 1.884 1.603 1.00 0.00 H new ATOM 0 HD22 LEU A 268 4.972 0.748 1.877 1.00 0.00 H new ATOM 0 HD23 LEU A 268 5.190 2.136 0.785 1.00 0.00 H new ATOM 420 N ALA A 269 7.987 -1.239 -1.712 1.00 0.00 N ATOM 421 CA ALA A 269 8.840 -2.311 -2.211 1.00 0.00 C ATOM 422 C ALA A 269 10.238 -2.231 -1.609 1.00 0.00 C ATOM 423 O ALA A 269 10.922 -3.245 -1.472 1.00 0.00 O ATOM 424 CB ALA A 269 8.913 -2.270 -3.729 1.00 0.00 C ATOM 0 H ALA A 269 7.858 -0.461 -2.358 1.00 0.00 H new ATOM 0 HA ALA A 269 8.397 -3.260 -1.907 1.00 0.00 H new ATOM 0 HB1 ALA A 269 9.554 -3.077 -4.084 1.00 0.00 H new ATOM 0 HB2 ALA A 269 7.913 -2.391 -4.145 1.00 0.00 H new ATOM 0 HB3 ALA A 269 9.325 -1.313 -4.048 1.00 0.00 H new ATOM 430 N PHE A 270 10.657 -1.025 -1.247 1.00 0.00 N ATOM 431 CA PHE A 270 11.972 -0.825 -0.657 1.00 0.00 C ATOM 432 C PHE A 270 11.971 -1.233 0.812 1.00 0.00 C ATOM 433 O PHE A 270 12.983 -1.695 1.338 1.00 0.00 O ATOM 434 CB PHE A 270 12.406 0.636 -0.794 1.00 0.00 C ATOM 435 CG PHE A 270 13.878 0.804 -1.040 1.00 0.00 C ATOM 436 CD1 PHE A 270 14.805 0.266 -0.164 1.00 0.00 C ATOM 437 CD2 PHE A 270 14.333 1.499 -2.149 1.00 0.00 C ATOM 438 CE1 PHE A 270 16.161 0.417 -0.388 1.00 0.00 C ATOM 439 CE2 PHE A 270 15.687 1.654 -2.379 1.00 0.00 C ATOM 440 CZ PHE A 270 16.602 1.113 -1.497 1.00 0.00 C ATOM 0 H PHE A 270 10.106 -0.173 -1.352 1.00 0.00 H new ATOM 0 HA PHE A 270 12.682 -1.454 -1.193 1.00 0.00 H new ATOM 0 HB2 PHE A 270 11.854 1.095 -1.614 1.00 0.00 H new ATOM 0 HB3 PHE A 270 12.134 1.174 0.114 1.00 0.00 H new ATOM 0 HD1 PHE A 270 14.465 -0.278 0.705 1.00 0.00 H new ATOM 0 HD2 PHE A 270 13.622 1.924 -2.841 1.00 0.00 H new ATOM 0 HE1 PHE A 270 16.874 -0.008 0.303 1.00 0.00 H new ATOM 0 HE2 PHE A 270 16.029 2.197 -3.247 1.00 0.00 H new ATOM 0 HZ PHE A 270 17.661 1.234 -1.674 1.00 0.00 H new ATOM 450 N GLU A 271 10.829 -1.063 1.470 1.00 0.00 N ATOM 451 CA GLU A 271 10.710 -1.419 2.877 1.00 0.00 C ATOM 452 C GLU A 271 10.535 -2.924 3.054 1.00 0.00 C ATOM 453 O GLU A 271 10.616 -3.439 4.169 1.00 0.00 O ATOM 454 CB GLU A 271 9.535 -0.678 3.507 1.00 0.00 C ATOM 455 CG GLU A 271 9.953 0.518 4.340 1.00 0.00 C ATOM 456 CD GLU A 271 10.085 1.785 3.517 1.00 0.00 C ATOM 457 OE1 GLU A 271 10.994 1.845 2.662 1.00 0.00 O ATOM 458 OE2 GLU A 271 9.281 2.716 3.727 1.00 0.00 O ATOM 0 H GLU A 271 9.979 -0.683 1.054 1.00 0.00 H new ATOM 0 HA GLU A 271 11.632 -1.125 3.379 1.00 0.00 H new ATOM 0 HB2 GLU A 271 8.861 -0.344 2.718 1.00 0.00 H new ATOM 0 HB3 GLU A 271 8.973 -1.370 4.135 1.00 0.00 H new ATOM 0 HG2 GLU A 271 9.221 0.678 5.132 1.00 0.00 H new ATOM 0 HG3 GLU A 271 10.905 0.303 4.825 1.00 0.00 H new ATOM 465 N GLY A 272 10.295 -3.627 1.951 1.00 0.00 N ATOM 466 CA GLY A 272 10.115 -5.063 2.020 1.00 0.00 C ATOM 467 C GLY A 272 8.682 -5.486 1.766 1.00 0.00 C ATOM 468 O GLY A 272 8.309 -6.624 2.052 1.00 0.00 O ATOM 0 H GLY A 272 10.222 -3.228 1.015 1.00 0.00 H new ATOM 0 HA2 GLY A 272 10.766 -5.542 1.289 1.00 0.00 H new ATOM 0 HA3 GLY A 272 10.425 -5.417 3.003 1.00 0.00 H new ATOM 472 N PHE A 273 7.876 -4.581 1.214 1.00 0.00 N ATOM 473 CA PHE A 273 6.486 -4.892 0.914 1.00 0.00 C ATOM 474 C PHE A 273 6.039 -4.205 -0.367 1.00 0.00 C ATOM 475 O PHE A 273 5.282 -3.239 -0.347 1.00 0.00 O ATOM 476 CB PHE A 273 5.567 -4.558 2.100 1.00 0.00 C ATOM 477 CG PHE A 273 5.403 -3.095 2.469 1.00 0.00 C ATOM 478 CD1 PHE A 273 6.492 -2.254 2.725 1.00 0.00 C ATOM 479 CD2 PHE A 273 4.128 -2.579 2.627 1.00 0.00 C ATOM 480 CE1 PHE A 273 6.291 -0.933 3.119 1.00 0.00 C ATOM 481 CE2 PHE A 273 3.934 -1.275 3.026 1.00 0.00 C ATOM 482 CZ PHE A 273 5.012 -0.455 3.272 1.00 0.00 C ATOM 0 H PHE A 273 8.162 -3.633 0.968 1.00 0.00 H new ATOM 0 HA PHE A 273 6.409 -5.967 0.749 1.00 0.00 H new ATOM 0 HB2 PHE A 273 4.578 -4.963 1.884 1.00 0.00 H new ATOM 0 HB3 PHE A 273 5.943 -5.086 2.976 1.00 0.00 H new ATOM 0 HD1 PHE A 273 7.498 -2.633 2.616 1.00 0.00 H new ATOM 0 HD2 PHE A 273 3.272 -3.209 2.434 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.137 -0.287 3.303 1.00 0.00 H new ATOM 0 HE2 PHE A 273 2.931 -0.894 3.147 1.00 0.00 H new ATOM 0 HZ PHE A 273 4.852 0.566 3.586 1.00 0.00 H new ATOM 492 N ASP A 274 6.548 -4.723 -1.483 1.00 0.00 N ATOM 493 CA ASP A 274 6.256 -4.186 -2.809 1.00 0.00 C ATOM 494 C ASP A 274 4.763 -4.145 -3.107 1.00 0.00 C ATOM 495 O ASP A 274 4.164 -5.147 -3.492 1.00 0.00 O ATOM 496 CB ASP A 274 6.971 -5.014 -3.877 1.00 0.00 C ATOM 497 CG ASP A 274 8.438 -5.229 -3.559 1.00 0.00 C ATOM 498 OD1 ASP A 274 8.739 -5.727 -2.453 1.00 0.00 O ATOM 499 OD2 ASP A 274 9.286 -4.899 -4.414 1.00 0.00 O ATOM 0 H ASP A 274 7.175 -5.528 -1.493 1.00 0.00 H new ATOM 0 HA ASP A 274 6.620 -3.159 -2.825 1.00 0.00 H new ATOM 0 HB2 ASP A 274 6.478 -5.981 -3.973 1.00 0.00 H new ATOM 0 HB3 ASP A 274 6.881 -4.513 -4.841 1.00 0.00 H new ATOM 504 N SER A 275 4.186 -2.961 -2.962 1.00 0.00 N ATOM 505 CA SER A 275 2.774 -2.740 -3.243 1.00 0.00 C ATOM 506 C SER A 275 2.626 -2.170 -4.656 1.00 0.00 C ATOM 507 O SER A 275 3.535 -1.515 -5.164 1.00 0.00 O ATOM 508 CB SER A 275 2.200 -1.738 -2.244 1.00 0.00 C ATOM 509 OG SER A 275 2.817 -0.471 -2.385 1.00 0.00 O ATOM 0 H SER A 275 4.682 -2.127 -2.647 1.00 0.00 H new ATOM 0 HA SER A 275 2.238 -3.686 -3.161 1.00 0.00 H new ATOM 0 HB2 SER A 275 1.125 -1.642 -2.397 1.00 0.00 H new ATOM 0 HB3 SER A 275 2.346 -2.107 -1.229 1.00 0.00 H new ATOM 0 HG SER A 275 3.591 -0.548 -2.982 1.00 0.00 H new ATOM 515 N LYS A 276 1.481 -2.401 -5.276 1.00 0.00 N ATOM 516 CA LYS A 276 1.220 -1.887 -6.621 1.00 0.00 C ATOM 517 C LYS A 276 0.184 -0.765 -6.567 1.00 0.00 C ATOM 518 O LYS A 276 -0.852 -0.903 -5.920 1.00 0.00 O ATOM 519 CB LYS A 276 0.729 -3.009 -7.537 1.00 0.00 C ATOM 520 CG LYS A 276 1.649 -4.220 -7.559 1.00 0.00 C ATOM 521 CD LYS A 276 0.881 -5.511 -7.328 1.00 0.00 C ATOM 522 CE LYS A 276 1.787 -6.727 -7.453 1.00 0.00 C ATOM 523 NZ LYS A 276 2.759 -6.816 -6.328 1.00 0.00 N ATOM 0 H LYS A 276 0.714 -2.940 -4.874 1.00 0.00 H new ATOM 0 HA LYS A 276 2.151 -1.489 -7.024 1.00 0.00 H new ATOM 0 HB2 LYS A 276 -0.264 -3.323 -7.214 1.00 0.00 H new ATOM 0 HB3 LYS A 276 0.627 -2.621 -8.551 1.00 0.00 H new ATOM 0 HG2 LYS A 276 2.164 -4.269 -8.519 1.00 0.00 H new ATOM 0 HG3 LYS A 276 2.415 -4.110 -6.792 1.00 0.00 H new ATOM 0 HD2 LYS A 276 0.428 -5.494 -6.337 1.00 0.00 H new ATOM 0 HD3 LYS A 276 0.067 -5.586 -8.050 1.00 0.00 H new ATOM 0 HE2 LYS A 276 1.179 -7.631 -7.479 1.00 0.00 H new ATOM 0 HE3 LYS A 276 2.329 -6.680 -8.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 3.311 -7.693 -6.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 3.401 -5.998 -6.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 2.245 -6.819 -5.424 1.00 0.00 H new ATOM 537 N ILE A 277 0.471 0.352 -7.235 1.00 0.00 N ATOM 538 CA ILE A 277 -0.447 1.491 -7.231 1.00 0.00 C ATOM 539 C ILE A 277 -1.076 1.737 -8.597 1.00 0.00 C ATOM 540 O ILE A 277 -0.552 1.319 -9.630 1.00 0.00 O ATOM 541 CB ILE A 277 0.254 2.790 -6.782 1.00 0.00 C ATOM 542 CG1 ILE A 277 1.201 2.519 -5.614 1.00 0.00 C ATOM 543 CG2 ILE A 277 -0.777 3.838 -6.392 1.00 0.00 C ATOM 544 CD1 ILE A 277 1.939 3.752 -5.135 1.00 0.00 C ATOM 0 H ILE A 277 1.322 0.492 -7.780 1.00 0.00 H new ATOM 0 HA ILE A 277 -1.230 1.228 -6.520 1.00 0.00 H new ATOM 0 HB ILE A 277 0.841 3.169 -7.619 1.00 0.00 H new ATOM 0 HG12 ILE A 277 0.631 2.101 -4.784 1.00 0.00 H new ATOM 0 HG13 ILE A 277 1.928 1.764 -5.914 1.00 0.00 H new ATOM 0 HG21 ILE A 277 -0.268 4.749 -6.077 1.00 0.00 H new ATOM 0 HG22 ILE A 277 -1.416 4.056 -7.248 1.00 0.00 H new ATOM 0 HG23 ILE A 277 -1.387 3.461 -5.571 1.00 0.00 H new ATOM 0 HD11 ILE A 277 2.593 3.485 -4.305 1.00 0.00 H new ATOM 0 HD12 ILE A 277 2.536 4.158 -5.951 1.00 0.00 H new ATOM 0 HD13 ILE A 277 1.220 4.501 -4.804 1.00 0.00 H new ATOM 556 N THR A 278 -2.205 2.438 -8.579 1.00 0.00 N ATOM 557 CA THR A 278 -2.937 2.782 -9.791 1.00 0.00 C ATOM 558 C THR A 278 -3.917 3.913 -9.499 1.00 0.00 C ATOM 559 O THR A 278 -4.821 3.763 -8.678 1.00 0.00 O ATOM 560 CB THR A 278 -3.685 1.567 -10.336 1.00 0.00 C ATOM 561 OG1 THR A 278 -4.320 0.856 -9.288 1.00 0.00 O ATOM 562 CG2 THR A 278 -2.791 0.596 -11.077 1.00 0.00 C ATOM 0 H THR A 278 -2.638 2.784 -7.722 1.00 0.00 H new ATOM 0 HA THR A 278 -2.223 3.110 -10.546 1.00 0.00 H new ATOM 0 HB THR A 278 -4.416 1.969 -11.038 1.00 0.00 H new ATOM 0 HG1 THR A 278 -4.749 1.490 -8.676 1.00 0.00 H new ATOM 0 HG21 THR A 278 -3.386 -0.243 -11.438 1.00 0.00 H new ATOM 0 HG22 THR A 278 -2.327 1.102 -11.923 1.00 0.00 H new ATOM 0 HG23 THR A 278 -2.016 0.229 -10.404 1.00 0.00 H new ATOM 570 N THR A 279 -3.726 5.049 -10.160 1.00 0.00 N ATOM 571 CA THR A 279 -4.586 6.215 -9.956 1.00 0.00 C ATOM 572 C THR A 279 -6.064 5.830 -9.925 1.00 0.00 C ATOM 573 O THR A 279 -6.528 5.037 -10.745 1.00 0.00 O ATOM 574 CB THR A 279 -4.334 7.256 -11.050 1.00 0.00 C ATOM 575 OG1 THR A 279 -3.707 6.665 -12.173 1.00 0.00 O ATOM 576 CG2 THR A 279 -3.463 8.403 -10.585 1.00 0.00 C ATOM 0 H THR A 279 -2.982 5.190 -10.844 1.00 0.00 H new ATOM 0 HA THR A 279 -4.336 6.644 -8.986 1.00 0.00 H new ATOM 0 HB THR A 279 -5.317 7.647 -11.313 1.00 0.00 H new ATOM 0 HG1 THR A 279 -3.557 7.347 -12.860 1.00 0.00 H new ATOM 0 HG21 THR A 279 -3.321 9.107 -11.405 1.00 0.00 H new ATOM 0 HG22 THR A 279 -3.945 8.911 -9.750 1.00 0.00 H new ATOM 0 HG23 THR A 279 -2.495 8.018 -10.265 1.00 0.00 H new ATOM 584 N ASN A 280 -6.797 6.399 -8.970 1.00 0.00 N ATOM 585 CA ASN A 280 -8.221 6.122 -8.823 1.00 0.00 C ATOM 586 C ASN A 280 -8.799 6.921 -7.664 1.00 0.00 C ATOM 587 O ASN A 280 -8.101 7.216 -6.695 1.00 0.00 O ATOM 588 CB ASN A 280 -8.456 4.628 -8.595 1.00 0.00 C ATOM 589 CG ASN A 280 -9.784 4.160 -9.157 1.00 0.00 C ATOM 590 OD1 ASN A 280 -10.643 3.670 -8.425 1.00 0.00 O ATOM 591 ND2 ASN A 280 -9.958 4.309 -10.466 1.00 0.00 N ATOM 0 H ASN A 280 -6.425 7.057 -8.285 1.00 0.00 H new ATOM 0 HA ASN A 280 -8.724 6.419 -9.743 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -7.648 4.061 -9.058 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -8.422 4.416 -7.526 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -10.831 4.012 -10.901 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -9.218 4.721 -11.035 1.00 0.00 H new ATOM 598 N ASN A 281 -10.075 7.282 -7.772 1.00 0.00 N ATOM 599 CA ASN A 281 -10.738 8.061 -6.731 1.00 0.00 C ATOM 600 C ASN A 281 -10.118 9.453 -6.609 1.00 0.00 C ATOM 601 O ASN A 281 -10.425 10.197 -5.678 1.00 0.00 O ATOM 602 CB ASN A 281 -10.649 7.342 -5.386 1.00 0.00 C ATOM 603 CG ASN A 281 -11.310 5.977 -5.412 1.00 0.00 C ATOM 604 OD1 ASN A 281 -12.534 5.868 -5.373 1.00 0.00 O ATOM 605 ND2 ASN A 281 -10.499 4.928 -5.481 1.00 0.00 N ATOM 0 H ASN A 281 -10.669 7.048 -8.568 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.786 8.168 -7.013 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -9.601 7.230 -5.106 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -11.120 7.956 -4.618 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -10.886 3.985 -5.504 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -9.489 5.066 -5.511 1.00 0.00 H new ATOM 612 N GLY A 282 -9.247 9.799 -7.552 1.00 0.00 N ATOM 613 CA GLY A 282 -8.601 11.096 -7.527 1.00 0.00 C ATOM 614 C GLY A 282 -7.141 11.015 -7.127 1.00 0.00 C ATOM 615 O GLY A 282 -6.330 11.835 -7.558 1.00 0.00 O ATOM 0 H GLY A 282 -8.978 9.202 -8.334 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -8.678 11.555 -8.513 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -9.129 11.747 -6.830 1.00 0.00 H new ATOM 619 N TRP A 283 -6.802 10.037 -6.287 1.00 0.00 N ATOM 620 CA TRP A 283 -5.438 9.878 -5.825 1.00 0.00 C ATOM 621 C TRP A 283 -4.937 8.446 -5.979 1.00 0.00 C ATOM 622 O TRP A 283 -5.715 7.511 -6.167 1.00 0.00 O ATOM 623 CB TRP A 283 -5.334 10.313 -4.371 1.00 0.00 C ATOM 624 CG TRP A 283 -6.464 9.855 -3.497 1.00 0.00 C ATOM 625 CD1 TRP A 283 -7.101 8.652 -3.534 1.00 0.00 C ATOM 626 CD2 TRP A 283 -7.077 10.601 -2.440 1.00 0.00 C ATOM 627 NE1 TRP A 283 -8.088 8.610 -2.576 1.00 0.00 N ATOM 628 CE2 TRP A 283 -8.089 9.793 -1.890 1.00 0.00 C ATOM 629 CE3 TRP A 283 -6.870 11.874 -1.910 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -8.891 10.220 -0.834 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -7.664 12.297 -0.861 1.00 0.00 C ATOM 632 CH2 TRP A 283 -8.663 11.471 -0.331 1.00 0.00 C ATOM 0 H TRP A 283 -7.457 9.348 -5.918 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.805 10.510 -6.448 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -4.398 9.935 -3.959 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -5.282 11.401 -4.334 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -6.866 7.848 -4.216 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -8.716 7.825 -2.405 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -6.102 12.518 -2.312 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -9.665 9.586 -0.427 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -7.512 13.281 -0.443 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -9.265 11.829 0.491 1.00 0.00 H new ATOM 643 N ASN A 284 -3.621 8.302 -5.899 1.00 0.00 N ATOM 644 CA ASN A 284 -2.962 7.005 -6.027 1.00 0.00 C ATOM 645 C ASN A 284 -3.514 5.994 -5.022 1.00 0.00 C ATOM 646 O ASN A 284 -3.303 6.130 -3.818 1.00 0.00 O ATOM 647 CB ASN A 284 -1.451 7.178 -5.823 1.00 0.00 C ATOM 648 CG ASN A 284 -0.694 7.208 -7.137 1.00 0.00 C ATOM 649 OD1 ASN A 284 -0.433 6.169 -7.742 1.00 0.00 O ATOM 650 ND2 ASN A 284 -0.336 8.405 -7.586 1.00 0.00 N ATOM 0 H ASN A 284 -2.979 9.079 -5.744 1.00 0.00 H new ATOM 0 HA ASN A 284 -3.158 6.618 -7.027 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -1.264 8.102 -5.277 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -1.074 6.362 -5.207 1.00 0.00 H new ATOM 0 HD21 ASN A 284 0.176 8.488 -8.464 1.00 0.00 H new ATOM 0 HD22 ASN A 284 -0.573 9.242 -7.053 1.00 0.00 H new ATOM 657 N ARG A 285 -4.215 4.975 -5.524 1.00 0.00 N ATOM 658 CA ARG A 285 -4.788 3.941 -4.661 1.00 0.00 C ATOM 659 C ARG A 285 -3.919 2.681 -4.664 1.00 0.00 C ATOM 660 O ARG A 285 -4.146 1.763 -5.451 1.00 0.00 O ATOM 661 CB ARG A 285 -6.215 3.599 -5.101 1.00 0.00 C ATOM 662 CG ARG A 285 -6.324 3.129 -6.543 1.00 0.00 C ATOM 663 CD ARG A 285 -7.427 2.095 -6.711 1.00 0.00 C ATOM 664 NE ARG A 285 -6.910 0.811 -7.178 1.00 0.00 N ATOM 665 CZ ARG A 285 -7.682 -0.205 -7.558 1.00 0.00 C ATOM 666 NH1 ARG A 285 -9.004 -0.089 -7.527 1.00 0.00 N ATOM 667 NH2 ARG A 285 -7.131 -1.338 -7.971 1.00 0.00 N ATOM 0 H ARG A 285 -4.399 4.844 -6.519 1.00 0.00 H new ATOM 0 HA ARG A 285 -4.820 4.334 -3.645 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -6.609 2.822 -4.446 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -6.845 4.478 -4.968 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -6.523 3.983 -7.191 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -5.373 2.702 -6.861 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -7.940 1.954 -5.759 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -8.167 2.467 -7.420 1.00 0.00 H new ATOM 0 HE ARG A 285 -5.898 0.685 -7.215 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -9.432 0.781 -7.211 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -9.591 -0.870 -7.819 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -6.116 -1.431 -7.998 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -7.722 -2.116 -8.262 1.00 0.00 H new ATOM 681 N VAL A 286 -2.912 2.649 -3.794 1.00 0.00 N ATOM 682 CA VAL A 286 -2.008 1.503 -3.727 1.00 0.00 C ATOM 683 C VAL A 286 -2.702 0.225 -3.289 1.00 0.00 C ATOM 684 O VAL A 286 -3.722 0.238 -2.600 1.00 0.00 O ATOM 685 CB VAL A 286 -0.800 1.747 -2.800 1.00 0.00 C ATOM 686 CG1 VAL A 286 -1.239 1.930 -1.355 1.00 0.00 C ATOM 687 CG2 VAL A 286 0.203 0.608 -2.905 1.00 0.00 C ATOM 0 H VAL A 286 -2.702 3.396 -3.131 1.00 0.00 H new ATOM 0 HA VAL A 286 -1.653 1.380 -4.750 1.00 0.00 H new ATOM 0 HB VAL A 286 -0.317 2.668 -3.127 1.00 0.00 H new ATOM 0 HG11 VAL A 286 -0.364 2.100 -0.728 1.00 0.00 H new ATOM 0 HG12 VAL A 286 -1.909 2.787 -1.284 1.00 0.00 H new ATOM 0 HG13 VAL A 286 -1.759 1.034 -1.017 1.00 0.00 H new ATOM 0 HG21 VAL A 286 1.046 0.803 -2.242 1.00 0.00 H new ATOM 0 HG22 VAL A 286 -0.277 -0.327 -2.616 1.00 0.00 H new ATOM 0 HG23 VAL A 286 0.560 0.531 -3.932 1.00 0.00 H new ATOM 697 N VAL A 287 -2.088 -0.870 -3.697 1.00 0.00 N ATOM 698 CA VAL A 287 -2.543 -2.226 -3.394 1.00 0.00 C ATOM 699 C VAL A 287 -1.398 -3.189 -3.669 1.00 0.00 C ATOM 700 O VAL A 287 -0.688 -3.021 -4.653 1.00 0.00 O ATOM 701 CB VAL A 287 -3.735 -2.661 -4.272 1.00 0.00 C ATOM 702 CG1 VAL A 287 -5.024 -1.964 -3.868 1.00 0.00 C ATOM 703 CG2 VAL A 287 -3.430 -2.416 -5.742 1.00 0.00 C ATOM 0 H VAL A 287 -1.239 -0.847 -4.262 1.00 0.00 H new ATOM 0 HA VAL A 287 -2.860 -2.240 -2.351 1.00 0.00 H new ATOM 0 HB VAL A 287 -3.883 -3.730 -4.116 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -5.837 -2.300 -4.512 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -5.259 -2.206 -2.831 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -4.902 -0.886 -3.970 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -4.281 -2.728 -6.347 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -3.241 -1.355 -5.902 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -2.549 -2.989 -6.031 1.00 0.00 H new ATOM 713 N ILE A 288 -1.222 -4.210 -2.839 1.00 0.00 N ATOM 714 CA ILE A 288 -0.145 -5.173 -3.080 1.00 0.00 C ATOM 715 C ILE A 288 -0.717 -6.484 -3.568 1.00 0.00 C ATOM 716 O ILE A 288 -0.669 -7.495 -2.867 1.00 0.00 O ATOM 717 CB ILE A 288 0.731 -5.456 -1.837 1.00 0.00 C ATOM 718 CG1 ILE A 288 1.052 -4.188 -1.045 1.00 0.00 C ATOM 719 CG2 ILE A 288 2.013 -6.157 -2.256 1.00 0.00 C ATOM 720 CD1 ILE A 288 0.957 -4.372 0.454 1.00 0.00 C ATOM 0 H ILE A 288 -1.792 -4.394 -2.013 1.00 0.00 H new ATOM 0 HA ILE A 288 0.495 -4.714 -3.834 1.00 0.00 H new ATOM 0 HB ILE A 288 0.157 -6.105 -1.176 1.00 0.00 H new ATOM 0 HG12 ILE A 288 2.058 -3.856 -1.299 1.00 0.00 H new ATOM 0 HG13 ILE A 288 0.368 -3.396 -1.350 1.00 0.00 H new ATOM 0 HG21 ILE A 288 2.625 -6.353 -1.376 1.00 0.00 H new ATOM 0 HG22 ILE A 288 1.769 -7.100 -2.746 1.00 0.00 H new ATOM 0 HG23 ILE A 288 2.566 -5.521 -2.948 1.00 0.00 H new ATOM 0 HD11 ILE A 288 1.197 -3.433 0.952 1.00 0.00 H new ATOM 0 HD12 ILE A 288 -0.056 -4.675 0.720 1.00 0.00 H new ATOM 0 HD13 ILE A 288 1.661 -5.141 0.771 1.00 0.00 H new ATOM 732 N GLY A 289 -1.267 -6.450 -4.777 1.00 0.00 N ATOM 733 CA GLY A 289 -1.868 -7.639 -5.365 1.00 0.00 C ATOM 734 C GLY A 289 -2.496 -8.528 -4.311 1.00 0.00 C ATOM 735 O GLY A 289 -2.990 -8.028 -3.302 1.00 0.00 O ATOM 0 H GLY A 289 -1.309 -5.617 -5.365 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -2.626 -7.343 -6.090 1.00 0.00 H new ATOM 0 HA3 GLY A 289 -1.108 -8.200 -5.909 1.00 0.00 H new ATOM 739 N PRO A 290 -2.476 -9.852 -4.494 1.00 0.00 N ATOM 740 CA PRO A 290 -3.028 -10.774 -3.521 1.00 0.00 C ATOM 741 C PRO A 290 -1.974 -11.179 -2.495 1.00 0.00 C ATOM 742 O PRO A 290 -1.079 -11.972 -2.790 1.00 0.00 O ATOM 743 CB PRO A 290 -3.431 -11.960 -4.389 1.00 0.00 C ATOM 744 CG PRO A 290 -2.426 -11.976 -5.498 1.00 0.00 C ATOM 745 CD PRO A 290 -1.900 -10.563 -5.647 1.00 0.00 C ATOM 0 HA PRO A 290 -3.852 -10.358 -2.941 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -3.411 -12.891 -3.822 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -4.444 -11.843 -4.774 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -1.614 -12.667 -5.271 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -2.884 -12.316 -6.427 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -0.810 -10.538 -5.629 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -2.214 -10.116 -6.590 1.00 0.00 H new ATOM 753 N VAL A 291 -2.073 -10.616 -1.298 1.00 0.00 N ATOM 754 CA VAL A 291 -1.110 -10.904 -0.233 1.00 0.00 C ATOM 755 C VAL A 291 -1.488 -12.170 0.531 1.00 0.00 C ATOM 756 O VAL A 291 -2.437 -12.864 0.169 1.00 0.00 O ATOM 757 CB VAL A 291 -0.954 -9.727 0.767 1.00 0.00 C ATOM 758 CG1 VAL A 291 0.430 -9.107 0.649 1.00 0.00 C ATOM 759 CG2 VAL A 291 -2.027 -8.662 0.563 1.00 0.00 C ATOM 0 H VAL A 291 -2.807 -9.958 -1.036 1.00 0.00 H new ATOM 0 HA VAL A 291 -0.152 -11.053 -0.730 1.00 0.00 H new ATOM 0 HB VAL A 291 -1.078 -10.135 1.770 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.521 -8.284 1.357 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.186 -9.861 0.869 1.00 0.00 H new ATOM 0 HG13 VAL A 291 0.576 -8.732 -0.364 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -1.882 -7.856 1.283 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -1.955 -8.262 -0.448 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -3.012 -9.105 0.709 1.00 0.00 H new ATOM 769 N LYS A 292 -0.729 -12.471 1.583 1.00 0.00 N ATOM 770 CA LYS A 292 -0.980 -13.662 2.391 1.00 0.00 C ATOM 771 C LYS A 292 -1.307 -13.299 3.833 1.00 0.00 C ATOM 772 O LYS A 292 -0.657 -12.443 4.434 1.00 0.00 O ATOM 773 CB LYS A 292 0.232 -14.594 2.356 1.00 0.00 C ATOM 774 CG LYS A 292 0.690 -14.950 0.951 1.00 0.00 C ATOM 775 CD LYS A 292 1.728 -16.061 0.971 1.00 0.00 C ATOM 776 CE LYS A 292 2.025 -16.576 -0.427 1.00 0.00 C ATOM 777 NZ LYS A 292 3.487 -16.634 -0.697 1.00 0.00 N ATOM 0 H LYS A 292 0.062 -11.908 1.895 1.00 0.00 H new ATOM 0 HA LYS A 292 -1.843 -14.173 1.964 1.00 0.00 H new ATOM 0 HB2 LYS A 292 1.057 -14.122 2.889 1.00 0.00 H new ATOM 0 HB3 LYS A 292 -0.011 -15.511 2.893 1.00 0.00 H new ATOM 0 HG2 LYS A 292 -0.168 -15.262 0.355 1.00 0.00 H new ATOM 0 HG3 LYS A 292 1.109 -14.067 0.469 1.00 0.00 H new ATOM 0 HD2 LYS A 292 2.647 -15.692 1.426 1.00 0.00 H new ATOM 0 HD3 LYS A 292 1.371 -16.882 1.593 1.00 0.00 H new ATOM 0 HE2 LYS A 292 1.594 -17.570 -0.547 1.00 0.00 H new ATOM 0 HE3 LYS A 292 1.545 -15.929 -1.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 3.648 -16.990 -1.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 3.895 -15.681 -0.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 3.942 -17.271 -0.012 1.00 0.00 H new ATOM 791 N GLY A 293 -2.322 -13.960 4.384 1.00 0.00 N ATOM 792 CA GLY A 293 -2.726 -13.702 5.753 1.00 0.00 C ATOM 793 C GLY A 293 -1.864 -14.440 6.755 1.00 0.00 C ATOM 794 O GLY A 293 -1.970 -15.657 6.898 1.00 0.00 O ATOM 0 H GLY A 293 -2.873 -14.672 3.904 1.00 0.00 H new ATOM 0 HA2 GLY A 293 -2.672 -12.631 5.950 1.00 0.00 H new ATOM 0 HA3 GLY A 293 -3.767 -13.998 5.884 1.00 0.00 H new ATOM 798 N LYS A 294 -1.008 -13.699 7.448 1.00 0.00 N ATOM 799 CA LYS A 294 -0.121 -14.289 8.442 1.00 0.00 C ATOM 800 C LYS A 294 0.544 -13.207 9.286 1.00 0.00 C ATOM 801 O LYS A 294 0.549 -13.284 10.515 1.00 0.00 O ATOM 802 CB LYS A 294 0.946 -15.149 7.760 1.00 0.00 C ATOM 803 CG LYS A 294 0.524 -16.596 7.558 1.00 0.00 C ATOM 804 CD LYS A 294 1.539 -17.567 8.142 1.00 0.00 C ATOM 805 CE LYS A 294 0.856 -18.720 8.861 1.00 0.00 C ATOM 806 NZ LYS A 294 0.617 -19.879 7.956 1.00 0.00 N ATOM 0 H LYS A 294 -0.910 -12.690 7.340 1.00 0.00 H new ATOM 0 HA LYS A 294 -0.720 -14.920 9.098 1.00 0.00 H new ATOM 0 HB2 LYS A 294 1.189 -14.712 6.792 1.00 0.00 H new ATOM 0 HB3 LYS A 294 1.857 -15.125 8.358 1.00 0.00 H new ATOM 0 HG2 LYS A 294 -0.447 -16.760 8.026 1.00 0.00 H new ATOM 0 HG3 LYS A 294 0.403 -16.794 6.493 1.00 0.00 H new ATOM 0 HD2 LYS A 294 2.171 -17.957 7.345 1.00 0.00 H new ATOM 0 HD3 LYS A 294 2.192 -17.039 8.837 1.00 0.00 H new ATOM 0 HE2 LYS A 294 1.472 -19.038 9.702 1.00 0.00 H new ATOM 0 HE3 LYS A 294 -0.094 -18.379 9.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 0.150 -20.643 8.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 0.008 -19.583 7.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 1.526 -20.222 7.583 1.00 0.00 H new ATOM 820 N GLU A 295 1.108 -12.202 8.623 1.00 0.00 N ATOM 821 CA GLU A 295 1.777 -11.110 9.321 1.00 0.00 C ATOM 822 C GLU A 295 2.359 -10.081 8.348 1.00 0.00 C ATOM 823 O GLU A 295 2.559 -8.923 8.713 1.00 0.00 O ATOM 824 CB GLU A 295 2.888 -11.665 10.212 1.00 0.00 C ATOM 825 CG GLU A 295 2.547 -11.646 11.694 1.00 0.00 C ATOM 826 CD GLU A 295 3.000 -10.373 12.380 1.00 0.00 C ATOM 827 OE1 GLU A 295 3.271 -9.380 11.673 1.00 0.00 O ATOM 828 OE2 GLU A 295 3.083 -10.368 13.627 1.00 0.00 O ATOM 0 H GLU A 295 1.115 -12.121 7.606 1.00 0.00 H new ATOM 0 HA GLU A 295 1.030 -10.604 9.933 1.00 0.00 H new ATOM 0 HB2 GLU A 295 3.106 -12.690 9.911 1.00 0.00 H new ATOM 0 HB3 GLU A 295 3.796 -11.085 10.049 1.00 0.00 H new ATOM 0 HG2 GLU A 295 1.470 -11.757 11.817 1.00 0.00 H new ATOM 0 HG3 GLU A 295 3.013 -12.502 12.181 1.00 0.00 H new ATOM 835 N ASN A 296 2.638 -10.504 7.118 1.00 0.00 N ATOM 836 CA ASN A 296 3.205 -9.607 6.116 1.00 0.00 C ATOM 837 C ASN A 296 2.280 -8.428 5.850 1.00 0.00 C ATOM 838 O ASN A 296 2.649 -7.277 6.078 1.00 0.00 O ATOM 839 CB ASN A 296 3.478 -10.365 4.815 1.00 0.00 C ATOM 840 CG ASN A 296 4.497 -9.663 3.940 1.00 0.00 C ATOM 841 OD1 ASN A 296 5.678 -9.586 4.281 1.00 0.00 O ATOM 842 ND2 ASN A 296 4.046 -9.146 2.803 1.00 0.00 N ATOM 0 H ASN A 296 2.482 -11.458 6.792 1.00 0.00 H new ATOM 0 HA ASN A 296 4.147 -9.221 6.506 1.00 0.00 H new ATOM 0 HB2 ASN A 296 3.834 -11.368 5.050 1.00 0.00 H new ATOM 0 HB3 ASN A 296 2.546 -10.480 4.262 1.00 0.00 H new ATOM 0 HD21 ASN A 296 4.686 -8.662 2.173 1.00 0.00 H new ATOM 0 HD22 ASN A 296 3.059 -9.233 2.559 1.00 0.00 H new ATOM 849 N ALA A 297 1.074 -8.718 5.373 1.00 0.00 N ATOM 850 CA ALA A 297 0.098 -7.669 5.088 1.00 0.00 C ATOM 851 C ALA A 297 -0.084 -6.769 6.309 1.00 0.00 C ATOM 852 O ALA A 297 -0.197 -5.550 6.186 1.00 0.00 O ATOM 853 CB ALA A 297 -1.232 -8.283 4.673 1.00 0.00 C ATOM 0 H ALA A 297 0.749 -9.665 5.176 1.00 0.00 H new ATOM 0 HA ALA A 297 0.469 -7.061 4.263 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -1.950 -7.490 4.464 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.090 -8.889 3.778 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -1.610 -8.911 5.480 1.00 0.00 H new ATOM 859 N ASP A 298 -0.097 -7.384 7.491 1.00 0.00 N ATOM 860 CA ASP A 298 -0.247 -6.646 8.741 1.00 0.00 C ATOM 861 C ASP A 298 0.977 -5.772 8.983 1.00 0.00 C ATOM 862 O ASP A 298 0.858 -4.559 9.154 1.00 0.00 O ATOM 863 CB ASP A 298 -0.445 -7.609 9.912 1.00 0.00 C ATOM 864 CG ASP A 298 -1.320 -7.022 11.002 1.00 0.00 C ATOM 865 OD1 ASP A 298 -1.013 -5.907 11.474 1.00 0.00 O ATOM 866 OD2 ASP A 298 -2.311 -7.678 11.384 1.00 0.00 O ATOM 0 H ASP A 298 -0.005 -8.393 7.607 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.128 -6.009 8.664 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -0.894 -8.533 9.547 1.00 0.00 H new ATOM 0 HB3 ASP A 298 0.526 -7.871 10.331 1.00 0.00 H new ATOM 871 N SER A 299 2.158 -6.387 8.971 1.00 0.00 N ATOM 872 CA SER A 299 3.394 -5.640 9.161 1.00 0.00 C ATOM 873 C SER A 299 3.499 -4.572 8.086 1.00 0.00 C ATOM 874 O SER A 299 4.025 -3.484 8.320 1.00 0.00 O ATOM 875 CB SER A 299 4.605 -6.574 9.103 1.00 0.00 C ATOM 876 OG SER A 299 5.005 -6.972 10.403 1.00 0.00 O ATOM 0 H SER A 299 2.282 -7.390 8.833 1.00 0.00 H new ATOM 0 HA SER A 299 3.381 -5.169 10.144 1.00 0.00 H new ATOM 0 HB2 SER A 299 4.361 -7.455 8.509 1.00 0.00 H new ATOM 0 HB3 SER A 299 5.432 -6.071 8.603 1.00 0.00 H new ATOM 0 HG SER A 299 4.410 -7.680 10.726 1.00 0.00 H new ATOM 882 N THR A 300 2.954 -4.885 6.912 1.00 0.00 N ATOM 883 CA THR A 300 2.942 -3.952 5.800 1.00 0.00 C ATOM 884 C THR A 300 2.250 -2.668 6.239 1.00 0.00 C ATOM 885 O THR A 300 2.677 -1.570 5.898 1.00 0.00 O ATOM 886 CB THR A 300 2.224 -4.582 4.599 1.00 0.00 C ATOM 887 OG1 THR A 300 3.162 -5.111 3.678 1.00 0.00 O ATOM 888 CG2 THR A 300 1.331 -3.622 3.839 1.00 0.00 C ATOM 0 H THR A 300 2.514 -5.783 6.711 1.00 0.00 H new ATOM 0 HA THR A 300 3.962 -3.717 5.497 1.00 0.00 H new ATOM 0 HB THR A 300 1.595 -5.362 5.028 1.00 0.00 H new ATOM 0 HG1 THR A 300 3.814 -4.419 3.442 1.00 0.00 H new ATOM 0 HG21 THR A 300 0.861 -4.145 3.006 1.00 0.00 H new ATOM 0 HG22 THR A 300 0.561 -3.236 4.506 1.00 0.00 H new ATOM 0 HG23 THR A 300 1.928 -2.794 3.457 1.00 0.00 H new ATOM 896 N LEU A 301 1.188 -2.831 7.025 1.00 0.00 N ATOM 897 CA LEU A 301 0.436 -1.699 7.552 1.00 0.00 C ATOM 898 C LEU A 301 1.388 -0.721 8.216 1.00 0.00 C ATOM 899 O LEU A 301 1.523 0.427 7.794 1.00 0.00 O ATOM 900 CB LEU A 301 -0.591 -2.188 8.571 1.00 0.00 C ATOM 901 CG LEU A 301 -1.581 -1.132 9.059 1.00 0.00 C ATOM 902 CD1 LEU A 301 -2.507 -0.702 7.929 1.00 0.00 C ATOM 903 CD2 LEU A 301 -2.376 -1.666 10.242 1.00 0.00 C ATOM 0 H LEU A 301 0.829 -3.742 7.311 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.083 -1.200 6.733 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -1.152 -3.012 8.130 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -0.060 -2.590 9.434 1.00 0.00 H new ATOM 0 HG LEU A 301 -1.024 -0.254 9.387 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -3.205 0.050 8.297 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -1.917 -0.282 7.115 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -3.063 -1.566 7.566 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -3.078 -0.905 10.582 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -2.925 -2.557 9.939 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -1.694 -1.919 11.054 1.00 0.00 H new ATOM 915 N ASN A 302 2.071 -1.209 9.243 1.00 0.00 N ATOM 916 CA ASN A 302 3.049 -0.407 9.959 1.00 0.00 C ATOM 917 C ASN A 302 4.157 0.011 9.003 1.00 0.00 C ATOM 918 O ASN A 302 4.809 1.038 9.191 1.00 0.00 O ATOM 919 CB ASN A 302 3.633 -1.208 11.123 1.00 0.00 C ATOM 920 CG ASN A 302 2.883 -0.971 12.421 1.00 0.00 C ATOM 921 OD1 ASN A 302 1.675 -0.736 12.420 1.00 0.00 O ATOM 922 ND2 ASN A 302 3.599 -1.032 13.538 1.00 0.00 N ATOM 0 H ASN A 302 1.964 -2.159 9.598 1.00 0.00 H new ATOM 0 HA ASN A 302 2.563 0.483 10.358 1.00 0.00 H new ATOM 0 HB2 ASN A 302 3.606 -2.270 10.880 1.00 0.00 H new ATOM 0 HB3 ASN A 302 4.681 -0.938 11.257 1.00 0.00 H new ATOM 0 HD21 ASN A 302 3.149 -0.881 14.441 1.00 0.00 H new ATOM 0 HD22 ASN A 302 4.599 -1.230 13.493 1.00 0.00 H new ATOM 929 N ARG A 303 4.352 -0.799 7.966 1.00 0.00 N ATOM 930 CA ARG A 303 5.363 -0.529 6.960 1.00 0.00 C ATOM 931 C ARG A 303 4.903 0.588 6.025 1.00 0.00 C ATOM 932 O ARG A 303 5.719 1.345 5.505 1.00 0.00 O ATOM 933 CB ARG A 303 5.676 -1.806 6.177 1.00 0.00 C ATOM 934 CG ARG A 303 7.167 -2.076 6.028 1.00 0.00 C ATOM 935 CD ARG A 303 7.598 -3.304 6.819 1.00 0.00 C ATOM 936 NE ARG A 303 8.388 -2.948 7.995 1.00 0.00 N ATOM 937 CZ ARG A 303 9.701 -2.725 7.969 1.00 0.00 C ATOM 938 NH1 ARG A 303 10.376 -2.814 6.829 1.00 0.00 N ATOM 939 NH2 ARG A 303 10.340 -2.409 9.087 1.00 0.00 N ATOM 0 H ARG A 303 3.817 -1.652 7.804 1.00 0.00 H new ATOM 0 HA ARG A 303 6.275 -0.196 7.455 1.00 0.00 H new ATOM 0 HB2 ARG A 303 5.209 -2.654 6.678 1.00 0.00 H new ATOM 0 HB3 ARG A 303 5.227 -1.735 5.186 1.00 0.00 H new ATOM 0 HG2 ARG A 303 7.408 -2.219 4.975 1.00 0.00 H new ATOM 0 HG3 ARG A 303 7.730 -1.207 6.369 1.00 0.00 H new ATOM 0 HD2 ARG A 303 6.715 -3.863 7.131 1.00 0.00 H new ATOM 0 HD3 ARG A 303 8.182 -3.963 6.176 1.00 0.00 H new ATOM 0 HE ARG A 303 7.905 -2.865 8.890 1.00 0.00 H new ATOM 0 HH11 ARG A 303 9.889 -3.054 5.966 1.00 0.00 H new ATOM 0 HH12 ARG A 303 11.381 -2.642 6.817 1.00 0.00 H new ATOM 0 HH21 ARG A 303 9.826 -2.337 9.965 1.00 0.00 H new ATOM 0 HH22 ARG A 303 11.345 -2.238 9.069 1.00 0.00 H new ATOM 953 N LEU A 304 3.587 0.708 5.827 1.00 0.00 N ATOM 954 CA LEU A 304 3.044 1.762 4.974 1.00 0.00 C ATOM 955 C LEU A 304 3.366 3.108 5.591 1.00 0.00 C ATOM 956 O LEU A 304 3.722 4.056 4.889 1.00 0.00 O ATOM 957 CB LEU A 304 1.540 1.571 4.759 1.00 0.00 C ATOM 958 CG LEU A 304 1.202 0.816 3.469 1.00 0.00 C ATOM 959 CD1 LEU A 304 0.615 -0.552 3.777 1.00 0.00 C ATOM 960 CD2 LEU A 304 0.261 1.617 2.581 1.00 0.00 C ATOM 0 H LEU A 304 2.886 0.094 6.242 1.00 0.00 H new ATOM 0 HA LEU A 304 3.505 1.713 3.988 1.00 0.00 H new ATOM 0 HB2 LEU A 304 1.125 1.029 5.608 1.00 0.00 H new ATOM 0 HB3 LEU A 304 1.056 2.548 4.737 1.00 0.00 H new ATOM 0 HG LEU A 304 2.134 0.674 2.921 1.00 0.00 H new ATOM 0 HD11 LEU A 304 0.384 -1.067 2.845 1.00 0.00 H new ATOM 0 HD12 LEU A 304 1.337 -1.138 4.346 1.00 0.00 H new ATOM 0 HD13 LEU A 304 -0.297 -0.433 4.362 1.00 0.00 H new ATOM 0 HD21 LEU A 304 0.044 1.050 1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 304 -0.667 1.813 3.118 1.00 0.00 H new ATOM 0 HD23 LEU A 304 0.731 2.563 2.312 1.00 0.00 H new ATOM 972 N LYS A 305 3.313 3.173 6.914 1.00 0.00 N ATOM 973 CA LYS A 305 3.672 4.394 7.612 1.00 0.00 C ATOM 974 C LYS A 305 5.130 4.726 7.291 1.00 0.00 C ATOM 975 O LYS A 305 5.554 5.880 7.360 1.00 0.00 O ATOM 976 CB LYS A 305 3.473 4.230 9.121 1.00 0.00 C ATOM 977 CG LYS A 305 2.302 5.031 9.668 1.00 0.00 C ATOM 978 CD LYS A 305 2.590 5.563 11.061 1.00 0.00 C ATOM 979 CE LYS A 305 1.591 6.635 11.467 1.00 0.00 C ATOM 980 NZ LYS A 305 0.191 6.237 11.155 1.00 0.00 N ATOM 0 H LYS A 305 3.028 2.402 7.518 1.00 0.00 H new ATOM 0 HA LYS A 305 3.029 5.210 7.283 1.00 0.00 H new ATOM 0 HB2 LYS A 305 3.318 3.175 9.347 1.00 0.00 H new ATOM 0 HB3 LYS A 305 4.384 4.536 9.635 1.00 0.00 H new ATOM 0 HG2 LYS A 305 2.085 5.863 8.998 1.00 0.00 H new ATOM 0 HG3 LYS A 305 1.412 4.403 9.695 1.00 0.00 H new ATOM 0 HD2 LYS A 305 2.557 4.743 11.779 1.00 0.00 H new ATOM 0 HD3 LYS A 305 3.599 5.974 11.093 1.00 0.00 H new ATOM 0 HE2 LYS A 305 1.683 6.831 12.535 1.00 0.00 H new ATOM 0 HE3 LYS A 305 1.827 7.565 10.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -0.469 6.881 11.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 0.036 6.288 10.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 0.026 5.264 11.482 1.00 0.00 H new ATOM 994 N MET A 306 5.882 3.686 6.911 1.00 0.00 N ATOM 995 CA MET A 306 7.284 3.827 6.543 1.00 0.00 C ATOM 996 C MET A 306 7.406 4.589 5.230 1.00 0.00 C ATOM 997 O MET A 306 8.391 5.285 4.987 1.00 0.00 O ATOM 998 CB MET A 306 7.941 2.445 6.408 1.00 0.00 C ATOM 999 CG MET A 306 9.391 2.424 6.868 1.00 0.00 C ATOM 1000 SD MET A 306 9.708 1.162 8.117 1.00 0.00 S ATOM 1001 CE MET A 306 10.940 0.162 7.287 1.00 0.00 C ATOM 0 H MET A 306 5.532 2.730 6.852 1.00 0.00 H new ATOM 0 HA MET A 306 7.796 4.385 7.327 1.00 0.00 H new ATOM 0 HB2 MET A 306 7.371 1.720 6.990 1.00 0.00 H new ATOM 0 HB3 MET A 306 7.892 2.127 5.367 1.00 0.00 H new ATOM 0 HG2 MET A 306 10.038 2.249 6.008 1.00 0.00 H new ATOM 0 HG3 MET A 306 9.654 3.402 7.271 1.00 0.00 H new ATOM 0 HE1 MET A 306 11.501 -0.412 8.025 1.00 0.00 H new ATOM 0 HE2 MET A 306 10.448 -0.521 6.594 1.00 0.00 H new ATOM 0 HE3 MET A 306 11.622 0.809 6.736 1.00 0.00 H new ATOM 1011 N ALA A 307 6.387 4.450 4.389 1.00 0.00 N ATOM 1012 CA ALA A 307 6.356 5.119 3.099 1.00 0.00 C ATOM 1013 C ALA A 307 5.633 6.457 3.205 1.00 0.00 C ATOM 1014 O ALA A 307 6.140 7.486 2.760 1.00 0.00 O ATOM 1015 CB ALA A 307 5.682 4.228 2.070 1.00 0.00 C ATOM 0 H ALA A 307 5.567 3.875 4.582 1.00 0.00 H new ATOM 0 HA ALA A 307 7.380 5.312 2.780 1.00 0.00 H new ATOM 0 HB1 ALA A 307 5.662 4.736 1.106 1.00 0.00 H new ATOM 0 HB2 ALA A 307 6.237 3.295 1.977 1.00 0.00 H new ATOM 0 HB3 ALA A 307 4.662 4.013 2.387 1.00 0.00 H new ATOM 1021 N GLY A 308 4.445 6.434 3.807 1.00 0.00 N ATOM 1022 CA GLY A 308 3.671 7.650 3.971 1.00 0.00 C ATOM 1023 C GLY A 308 2.431 7.683 3.100 1.00 0.00 C ATOM 1024 O GLY A 308 2.436 8.285 2.025 1.00 0.00 O ATOM 0 H GLY A 308 4.006 5.594 4.183 1.00 0.00 H new ATOM 0 HA2 GLY A 308 3.377 7.749 5.016 1.00 0.00 H new ATOM 0 HA3 GLY A 308 4.299 8.509 3.733 1.00 0.00 H new ATOM 1028 N HIS A 309 1.360 7.043 3.563 1.00 0.00 N ATOM 1029 CA HIS A 309 0.106 7.014 2.811 1.00 0.00 C ATOM 1030 C HIS A 309 -1.051 7.528 3.655 1.00 0.00 C ATOM 1031 O HIS A 309 -1.341 6.980 4.719 1.00 0.00 O ATOM 1032 CB HIS A 309 -0.222 5.596 2.331 1.00 0.00 C ATOM 1033 CG HIS A 309 0.977 4.731 2.109 1.00 0.00 C ATOM 1034 ND1 HIS A 309 1.428 4.394 0.856 1.00 0.00 N ATOM 1035 CD2 HIS A 309 1.813 4.123 2.983 1.00 0.00 C ATOM 1036 CE1 HIS A 309 2.490 3.620 0.966 1.00 0.00 C ATOM 1037 NE2 HIS A 309 2.746 3.442 2.249 1.00 0.00 N ATOM 0 H HIS A 309 1.334 6.540 4.450 1.00 0.00 H new ATOM 0 HA HIS A 309 0.240 7.664 1.946 1.00 0.00 H new ATOM 0 HB2 HIS A 309 -0.871 5.117 3.065 1.00 0.00 H new ATOM 0 HB3 HIS A 309 -0.786 5.661 1.401 1.00 0.00 H new ATOM 0 HD1 HIS A 309 1.007 4.696 -0.023 1.00 0.00 H new ATOM 0 HD2 HIS A 309 1.755 4.167 4.061 1.00 0.00 H new ATOM 0 HE1 HIS A 309 3.055 3.202 0.146 1.00 0.00 H new ATOM 1046 N THR A 310 -1.723 8.571 3.176 1.00 0.00 N ATOM 1047 CA THR A 310 -2.858 9.132 3.904 1.00 0.00 C ATOM 1048 C THR A 310 -4.123 8.287 3.694 1.00 0.00 C ATOM 1049 O THR A 310 -5.170 8.817 3.321 1.00 0.00 O ATOM 1050 CB THR A 310 -3.111 10.573 3.458 1.00 0.00 C ATOM 1051 OG1 THR A 310 -3.637 10.606 2.142 1.00 0.00 O ATOM 1052 CG2 THR A 310 -1.864 11.432 3.474 1.00 0.00 C ATOM 0 H THR A 310 -1.505 9.041 2.297 1.00 0.00 H new ATOM 0 HA THR A 310 -2.615 9.123 4.967 1.00 0.00 H new ATOM 0 HB THR A 310 -3.822 10.978 4.178 1.00 0.00 H new ATOM 0 HG1 THR A 310 -4.459 10.074 2.105 1.00 0.00 H new ATOM 0 HG21 THR A 310 -2.113 12.441 3.147 1.00 0.00 H new ATOM 0 HG22 THR A 310 -1.460 11.468 4.486 1.00 0.00 H new ATOM 0 HG23 THR A 310 -1.120 11.006 2.801 1.00 0.00 H new ATOM 1060 N ASN A 311 -4.016 6.974 3.945 1.00 0.00 N ATOM 1061 CA ASN A 311 -5.140 6.040 3.793 1.00 0.00 C ATOM 1062 C ASN A 311 -4.627 4.617 3.573 1.00 0.00 C ATOM 1063 O ASN A 311 -4.034 4.319 2.535 1.00 0.00 O ATOM 1064 CB ASN A 311 -6.045 6.442 2.622 1.00 0.00 C ATOM 1065 CG ASN A 311 -7.308 7.144 3.080 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -7.584 8.274 2.679 1.00 0.00 O ATOM 1067 ND2 ASN A 311 -8.081 6.477 3.929 1.00 0.00 N ATOM 0 H ASN A 311 -3.152 6.532 4.258 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.724 6.078 4.713 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -5.493 7.097 1.948 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -6.314 5.552 2.052 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -8.942 6.900 4.275 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -7.813 5.542 4.235 1.00 0.00 H new ATOM 1074 N CYS A 312 -4.847 3.743 4.552 1.00 0.00 N ATOM 1075 CA CYS A 312 -4.390 2.355 4.451 1.00 0.00 C ATOM 1076 C CYS A 312 -5.418 1.374 5.031 1.00 0.00 C ATOM 1077 O CYS A 312 -5.932 1.591 6.128 1.00 0.00 O ATOM 1078 CB CYS A 312 -3.045 2.194 5.174 1.00 0.00 C ATOM 1079 SG CYS A 312 -1.938 3.617 5.018 1.00 0.00 S ATOM 0 H CYS A 312 -5.335 3.967 5.419 1.00 0.00 H new ATOM 0 HA CYS A 312 -4.268 2.120 3.394 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -3.234 2.011 6.232 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -2.539 1.311 4.783 1.00 0.00 H new ATOM 0 HG CYS A 312 -0.835 3.381 5.664 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.710 0.282 4.300 1.00 0.00 N ATOM 1086 CA ILE A 313 -6.661 -0.717 4.765 1.00 0.00 C ATOM 1087 C ILE A 313 -6.442 -2.027 4.020 1.00 0.00 C ATOM 1088 O ILE A 313 -6.603 -2.088 2.802 1.00 0.00 O ATOM 1089 CB ILE A 313 -8.117 -0.259 4.562 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -8.328 0.241 3.131 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -8.479 0.824 5.568 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -9.138 -0.707 2.273 1.00 0.00 C ATOM 0 H ILE A 313 -5.297 0.079 3.390 1.00 0.00 H new ATOM 0 HA ILE A 313 -6.493 -0.857 5.833 1.00 0.00 H new ATOM 0 HB ILE A 313 -8.774 -1.113 4.726 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -8.830 1.208 3.163 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -7.356 0.401 2.664 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -9.511 1.136 5.411 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -8.368 0.433 6.579 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -7.817 1.680 5.436 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -9.248 -0.289 1.273 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -8.627 -1.668 2.210 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -10.123 -0.848 2.717 1.00 0.00 H new ATOM 1104 N ARG A 314 -6.069 -3.071 4.749 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.827 -4.365 4.131 1.00 0.00 C ATOM 1106 C ARG A 314 -7.143 -5.009 3.724 1.00 0.00 C ATOM 1107 O ARG A 314 -8.005 -5.272 4.561 1.00 0.00 O ATOM 1108 CB ARG A 314 -5.029 -5.289 5.067 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.607 -5.552 4.574 1.00 0.00 C ATOM 1110 CD ARG A 314 -2.611 -4.520 5.102 1.00 0.00 C ATOM 1111 NE ARG A 314 -2.517 -4.571 6.561 1.00 0.00 N ATOM 1112 CZ ARG A 314 -3.251 -3.825 7.385 1.00 0.00 C ATOM 1113 NH1 ARG A 314 -4.045 -2.877 6.910 1.00 0.00 N ATOM 1114 NH2 ARG A 314 -3.169 -4.012 8.694 1.00 0.00 N ATOM 0 H ARG A 314 -5.929 -3.047 5.759 1.00 0.00 H new ATOM 0 HA ARG A 314 -5.227 -4.208 3.235 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -4.987 -4.842 6.060 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -5.555 -6.239 5.167 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -3.295 -6.548 4.887 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.595 -5.541 3.484 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -1.629 -4.702 4.665 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -2.918 -3.522 4.790 1.00 0.00 H new ATOM 0 HE ARG A 314 -1.846 -5.219 6.974 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -4.098 -2.713 5.905 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -4.603 -2.311 7.550 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -2.545 -4.726 9.069 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -3.730 -3.442 9.327 1.00 0.00 H new ATOM 1128 N LEU A 315 -7.289 -5.250 2.426 1.00 0.00 N ATOM 1129 CA LEU A 315 -8.493 -5.863 1.886 1.00 0.00 C ATOM 1130 C LEU A 315 -8.286 -7.362 1.723 1.00 0.00 C ATOM 1131 O LEU A 315 -7.458 -7.802 0.927 1.00 0.00 O ATOM 1132 CB LEU A 315 -8.860 -5.248 0.539 1.00 0.00 C ATOM 1133 CG LEU A 315 -10.185 -4.481 0.513 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -9.936 -2.981 0.490 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -11.022 -4.905 -0.686 1.00 0.00 C ATOM 0 H LEU A 315 -6.582 -5.028 1.725 1.00 0.00 H new ATOM 0 HA LEU A 315 -9.309 -5.682 2.585 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -8.061 -4.571 0.236 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -8.904 -6.043 -0.206 1.00 0.00 H new ATOM 0 HG LEU A 315 -10.739 -4.720 1.421 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -10.890 -2.454 0.472 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -9.378 -2.691 1.381 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -9.361 -2.721 -0.399 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -11.960 -4.350 -0.689 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -10.474 -4.696 -1.605 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -11.232 -5.973 -0.624 1.00 0.00 H new ATOM 1147 N ALA A 316 -9.026 -8.142 2.488 1.00 0.00 N ATOM 1148 CA ALA A 316 -8.899 -9.592 2.434 1.00 0.00 C ATOM 1149 C ALA A 316 -9.825 -10.205 1.392 1.00 0.00 C ATOM 1150 O ALA A 316 -10.975 -9.794 1.241 1.00 0.00 O ATOM 1151 CB ALA A 316 -9.158 -10.191 3.804 1.00 0.00 C ATOM 0 H ALA A 316 -9.720 -7.801 3.153 1.00 0.00 H new ATOM 0 HA ALA A 316 -7.878 -9.826 2.133 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -9.060 -11.275 3.751 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -8.434 -9.796 4.517 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -10.166 -9.933 4.129 1.00 0.00 H new ATOM 1157 N ALA A 317 -9.305 -11.196 0.676 1.00 0.00 N ATOM 1158 CA ALA A 317 -10.067 -11.883 -0.358 1.00 0.00 C ATOM 1159 C ALA A 317 -11.084 -12.839 0.255 1.00 0.00 C ATOM 1160 O ALA A 317 -10.884 -13.350 1.358 1.00 0.00 O ATOM 1161 CB ALA A 317 -9.121 -12.631 -1.286 1.00 0.00 C ATOM 0 H ALA A 317 -8.353 -11.542 0.795 1.00 0.00 H new ATOM 0 HA ALA A 317 -10.616 -11.139 -0.935 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -9.697 -13.143 -2.057 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -8.436 -11.924 -1.754 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -8.552 -13.363 -0.713 1.00 0.00 H new