USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=12 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 279 THR OG1 : rot -66:sc= -0.0504 USER MOD Set 1.2: A 284 ASN : amide:sc= -4.77! C(o=-4.8!,f=-8.3!) USER MOD Set 2.1: A 251 GLN : amide:sc= -2.25 K(o=-4.1,f=-5.1!) USER MOD Set 2.2: A 254 SER OG : rot 137:sc= -1.3 USER MOD Set 2.3: A 311 ASN : amide:sc= -0.56 K(o=-4.1,f=-3.5) USER MOD Single : A 249 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 252 CYS SG : rot 170:sc= -5.18 USER MOD Single : A 260 GLN : amide:sc= -1.25 K(o=-1.2,f=0.14!) USER MOD Single : A 263 THR OG1 : rot 73:sc= 0.0379 USER MOD Single : A 267 GLN : amide:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 275 SER OG : rot 150:sc= -7.67! USER MOD Single : A 276 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 278 THR OG1 : rot 105:sc= 0.264 USER MOD Single : A 280 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 281 ASN : amide:sc= -0.57 K(o=-0.57,f=0.53) 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=-0.023) USER MOD Single : A 299 SER OG : rot 180:sc= 0 USER MOD Single : A 300 THR OG1 : rot 67:sc= 0.503 USER MOD Single : A 302 ASN : amide:sc= -0.765 X(o=-0.77,f=-0.79) USER MOD Single : A 305 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 306 MET CE :methyl 161:sc= -0.071 (180deg=-0.483) USER MOD Single : A 309 HIS : no HE2:sc= -19.3! C(o=-19!,f=-22!) USER MOD Single : A 310 THR OG1 : rot 180:sc= 0 USER MOD Single : A 312 CYS SG : rot 9:sc= -1.83 USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -5.830 -15.206 3.076 1.00 0.00 N ATOM 76 CA ARG A 247 -5.182 -14.444 2.013 1.00 0.00 C ATOM 77 C ARG A 247 -5.639 -13.008 2.014 1.00 0.00 C ATOM 78 O ARG A 247 -6.512 -12.612 2.786 1.00 0.00 O ATOM 79 CB ARG A 247 -5.448 -15.083 0.649 1.00 0.00 C ATOM 80 CG ARG A 247 -6.927 -15.249 0.335 1.00 0.00 C ATOM 81 CD ARG A 247 -7.281 -16.702 0.058 1.00 0.00 C ATOM 82 NE ARG A 247 -8.571 -17.069 0.637 1.00 0.00 N ATOM 83 CZ ARG A 247 -9.287 -18.121 0.247 1.00 0.00 C ATOM 84 NH1 ARG A 247 -8.844 -18.914 -0.720 1.00 0.00 N ATOM 85 NH2 ARG A 247 -10.451 -18.382 0.827 1.00 0.00 N ATOM 0 HA ARG A 247 -4.109 -14.459 2.203 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -4.987 -14.471 -0.126 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -4.965 -16.060 0.614 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -7.521 -14.883 1.172 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -7.186 -14.639 -0.531 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -7.305 -16.871 -1.019 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -6.504 -17.349 0.465 1.00 0.00 H new ATOM 0 HE ARG A 247 -8.945 -16.484 1.384 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -7.949 -18.719 -1.170 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -9.398 -19.718 -1.014 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -10.797 -17.777 1.571 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -11.000 -19.188 0.529 1.00 0.00 H new ATOM 99 N TRP A 248 -4.996 -12.221 1.173 1.00 0.00 N ATOM 100 CA TRP A 248 -5.288 -10.806 1.109 1.00 0.00 C ATOM 101 C TRP A 248 -5.108 -10.201 -0.270 1.00 0.00 C ATOM 102 O TRP A 248 -4.707 -10.854 -1.230 1.00 0.00 O ATOM 103 CB TRP A 248 -4.355 -10.085 2.061 1.00 0.00 C ATOM 104 CG TRP A 248 -4.820 -10.046 3.469 1.00 0.00 C ATOM 105 CD1 TRP A 248 -4.332 -10.774 4.509 1.00 0.00 C ATOM 106 CD2 TRP A 248 -5.862 -9.227 3.992 1.00 0.00 C ATOM 107 NE1 TRP A 248 -4.974 -10.411 5.672 1.00 0.00 N ATOM 108 CE2 TRP A 248 -5.927 -9.463 5.373 1.00 0.00 C ATOM 109 CE3 TRP A 248 -6.738 -8.304 3.422 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -6.835 -8.796 6.192 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -7.642 -7.655 4.233 1.00 0.00 C ATOM 112 CH2 TRP A 248 -7.681 -7.898 5.607 1.00 0.00 C ATOM 0 H TRP A 248 -4.272 -12.537 0.528 1.00 0.00 H new ATOM 0 HA TRP A 248 -6.339 -10.690 1.375 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -3.379 -10.568 2.028 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -4.217 -9.063 1.709 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -3.558 -11.523 4.434 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -4.776 -10.783 6.601 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -6.708 -8.101 2.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -6.869 -8.983 7.255 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -8.332 -6.947 3.799 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -8.394 -7.366 6.219 1.00 0.00 H new ATOM 123 N MET A 249 -5.388 -8.910 -0.295 1.00 0.00 N ATOM 124 CA MET A 249 -5.262 -8.057 -1.468 1.00 0.00 C ATOM 125 C MET A 249 -5.219 -6.620 -0.969 1.00 0.00 C ATOM 126 O MET A 249 -6.156 -5.842 -1.145 1.00 0.00 O ATOM 127 CB MET A 249 -6.432 -8.229 -2.410 1.00 0.00 C ATOM 128 CG MET A 249 -6.312 -9.430 -3.334 1.00 0.00 C ATOM 129 SD MET A 249 -7.639 -9.507 -4.551 1.00 0.00 S ATOM 130 CE MET A 249 -6.698 -9.546 -6.074 1.00 0.00 C ATOM 0 H MET A 249 -5.721 -8.408 0.528 1.00 0.00 H new ATOM 0 HA MET A 249 -4.361 -8.322 -2.021 1.00 0.00 H new ATOM 0 HB2 MET A 249 -7.346 -8.325 -1.824 1.00 0.00 H new ATOM 0 HB3 MET A 249 -6.534 -7.328 -3.014 1.00 0.00 H new ATOM 0 HG2 MET A 249 -5.353 -9.391 -3.850 1.00 0.00 H new ATOM 0 HG3 MET A 249 -6.317 -10.343 -2.739 1.00 0.00 H new ATOM 0 HE1 MET A 249 -7.381 -9.594 -6.922 1.00 0.00 H new ATOM 0 HE2 MET A 249 -6.089 -8.645 -6.149 1.00 0.00 H new ATOM 0 HE3 MET A 249 -6.050 -10.423 -6.079 1.00 0.00 H new ATOM 140 N VAL A 250 -4.141 -6.324 -0.283 1.00 0.00 N ATOM 141 CA VAL A 250 -3.925 -5.027 0.357 1.00 0.00 C ATOM 142 C VAL A 250 -4.305 -3.844 -0.513 1.00 0.00 C ATOM 143 O VAL A 250 -4.210 -3.894 -1.739 1.00 0.00 O ATOM 144 CB VAL A 250 -2.466 -4.848 0.802 1.00 0.00 C ATOM 145 CG1 VAL A 250 -2.269 -3.460 1.400 1.00 0.00 C ATOM 146 CG2 VAL A 250 -2.071 -5.932 1.794 1.00 0.00 C ATOM 0 H VAL A 250 -3.372 -6.980 -0.146 1.00 0.00 H new ATOM 0 HA VAL A 250 -4.587 -5.038 1.223 1.00 0.00 H new ATOM 0 HB VAL A 250 -1.818 -4.942 -0.069 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -1.231 -3.342 1.713 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -2.511 -2.704 0.653 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -2.924 -3.339 2.263 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -1.034 -5.788 2.097 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -2.716 -5.876 2.671 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -2.179 -6.910 1.326 1.00 0.00 H new ATOM 156 N GLN A 251 -4.712 -2.762 0.152 1.00 0.00 N ATOM 157 CA GLN A 251 -5.079 -1.542 -0.525 1.00 0.00 C ATOM 158 C GLN A 251 -4.659 -0.360 0.321 1.00 0.00 C ATOM 159 O GLN A 251 -5.475 0.458 0.744 1.00 0.00 O ATOM 160 CB GLN A 251 -6.573 -1.523 -0.784 1.00 0.00 C ATOM 161 CG GLN A 251 -7.024 -0.410 -1.716 1.00 0.00 C ATOM 162 CD GLN A 251 -8.017 0.533 -1.064 1.00 0.00 C ATOM 163 OE1 GLN A 251 -9.228 0.327 -1.140 1.00 0.00 O ATOM 164 NE2 GLN A 251 -7.506 1.575 -0.418 1.00 0.00 N ATOM 0 H GLN A 251 -4.792 -2.718 1.168 1.00 0.00 H new ATOM 0 HA GLN A 251 -4.570 -1.484 -1.487 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -6.870 -2.482 -1.209 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -7.095 -1.421 0.167 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -6.154 0.157 -2.046 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -7.476 -0.848 -2.606 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -6.495 1.706 -0.381 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -8.124 2.244 0.041 1.00 0.00 H new ATOM 173 N CYS A 252 -3.366 -0.303 0.560 1.00 0.00 N ATOM 174 CA CYS A 252 -2.766 0.751 1.360 1.00 0.00 C ATOM 175 C CYS A 252 -1.998 1.705 0.472 1.00 0.00 C ATOM 176 O CYS A 252 -0.801 1.523 0.252 1.00 0.00 O ATOM 177 CB CYS A 252 -1.821 0.149 2.398 1.00 0.00 C ATOM 178 SG CYS A 252 -2.587 -1.081 3.472 1.00 0.00 S ATOM 0 H CYS A 252 -2.697 -0.987 0.205 1.00 0.00 H new ATOM 0 HA CYS A 252 -3.561 1.296 1.870 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -0.978 -0.311 1.882 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -1.418 0.952 3.015 1.00 0.00 H new ATOM 0 HG CYS A 252 -1.668 -1.683 4.167 1.00 0.00 H new ATOM 184 N GLY A 253 -2.679 2.712 -0.052 1.00 0.00 N ATOM 185 CA GLY A 253 -2.008 3.647 -0.924 1.00 0.00 C ATOM 186 C GLY A 253 -2.814 4.878 -1.254 1.00 0.00 C ATOM 187 O GLY A 253 -2.251 5.935 -1.514 1.00 0.00 O ATOM 0 H GLY A 253 -3.669 2.896 0.108 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -1.073 3.954 -0.456 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -1.748 3.138 -1.852 1.00 0.00 H new ATOM 191 N SER A 254 -4.128 4.731 -1.290 1.00 0.00 N ATOM 192 CA SER A 254 -5.016 5.832 -1.637 1.00 0.00 C ATOM 193 C SER A 254 -4.724 7.103 -0.838 1.00 0.00 C ATOM 194 O SER A 254 -5.454 7.438 0.095 1.00 0.00 O ATOM 195 CB SER A 254 -6.474 5.403 -1.434 1.00 0.00 C ATOM 196 OG SER A 254 -6.555 4.083 -0.921 1.00 0.00 O ATOM 0 H SER A 254 -4.607 3.855 -1.082 1.00 0.00 H new ATOM 0 HA SER A 254 -4.840 6.072 -2.685 1.00 0.00 H new ATOM 0 HB2 SER A 254 -6.966 6.093 -0.749 1.00 0.00 H new ATOM 0 HB3 SER A 254 -7.008 5.460 -2.383 1.00 0.00 H new ATOM 0 HG SER A 254 -7.232 4.048 -0.214 1.00 0.00 H new ATOM 202 N PHE A 255 -3.674 7.832 -1.224 1.00 0.00 N ATOM 203 CA PHE A 255 -3.340 9.082 -0.545 1.00 0.00 C ATOM 204 C PHE A 255 -3.396 10.265 -1.502 1.00 0.00 C ATOM 205 O PHE A 255 -2.838 10.218 -2.597 1.00 0.00 O ATOM 206 CB PHE A 255 -1.942 9.066 0.107 1.00 0.00 C ATOM 207 CG PHE A 255 -1.275 7.723 0.237 1.00 0.00 C ATOM 208 CD1 PHE A 255 -1.669 6.838 1.226 1.00 0.00 C ATOM 209 CD2 PHE A 255 -0.227 7.356 -0.606 1.00 0.00 C ATOM 210 CE1 PHE A 255 -1.043 5.618 1.372 1.00 0.00 C ATOM 211 CE2 PHE A 255 0.398 6.143 -0.455 1.00 0.00 C ATOM 212 CZ PHE A 255 -0.005 5.273 0.532 1.00 0.00 C ATOM 0 H PHE A 255 -3.050 7.582 -1.991 1.00 0.00 H new ATOM 0 HA PHE A 255 -4.090 9.186 0.239 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -1.288 9.717 -0.473 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -2.025 9.503 1.102 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -2.476 7.106 1.891 1.00 0.00 H new ATOM 0 HD2 PHE A 255 0.096 8.032 -1.384 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -1.365 4.934 2.143 1.00 0.00 H new ATOM 0 HE2 PHE A 255 1.209 5.870 -1.114 1.00 0.00 H new ATOM 0 HZ PHE A 255 0.491 4.321 0.649 1.00 0.00 H new ATOM 222 N ARG A 256 -4.033 11.348 -1.060 1.00 0.00 N ATOM 223 CA ARG A 256 -4.119 12.563 -1.864 1.00 0.00 C ATOM 224 C ARG A 256 -2.724 12.990 -2.314 1.00 0.00 C ATOM 225 O ARG A 256 -2.566 13.697 -3.309 1.00 0.00 O ATOM 226 CB ARG A 256 -4.776 13.686 -1.059 1.00 0.00 C ATOM 227 CG ARG A 256 -5.634 14.620 -1.897 1.00 0.00 C ATOM 228 CD ARG A 256 -6.124 15.808 -1.082 1.00 0.00 C ATOM 229 NE ARG A 256 -7.537 16.093 -1.320 1.00 0.00 N ATOM 230 CZ ARG A 256 -7.986 16.849 -2.320 1.00 0.00 C ATOM 231 NH1 ARG A 256 -7.139 17.391 -3.186 1.00 0.00 N ATOM 232 NH2 ARG A 256 -9.288 17.062 -2.455 1.00 0.00 N ATOM 0 H ARG A 256 -4.495 11.408 -0.153 1.00 0.00 H new ATOM 0 HA ARG A 256 -4.730 12.359 -2.744 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -5.393 13.246 -0.276 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -3.999 14.268 -0.564 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -5.058 14.976 -2.751 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -6.489 14.072 -2.294 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -5.969 15.608 -0.022 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -5.530 16.688 -1.331 1.00 0.00 H new ATOM 0 HE ARG A 256 -8.221 15.688 -0.681 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -6.137 17.230 -3.088 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -7.490 17.969 -3.949 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -9.944 16.647 -1.793 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -9.633 17.641 -3.220 1.00 0.00 H new ATOM 246 N GLY A 257 -1.716 12.537 -1.572 1.00 0.00 N ATOM 247 CA GLY A 257 -0.343 12.849 -1.890 1.00 0.00 C ATOM 248 C GLY A 257 0.167 12.038 -3.064 1.00 0.00 C ATOM 249 O GLY A 257 1.148 11.311 -2.937 1.00 0.00 O ATOM 0 H GLY A 257 -1.835 11.951 -0.745 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -0.256 13.911 -2.118 1.00 0.00 H new ATOM 0 HA3 GLY A 257 0.283 12.658 -1.018 1.00 0.00 H new ATOM 253 N ALA A 258 -0.510 12.159 -4.205 1.00 0.00 N ATOM 254 CA ALA A 258 -0.138 11.432 -5.419 1.00 0.00 C ATOM 255 C ALA A 258 1.375 11.373 -5.589 1.00 0.00 C ATOM 256 O ALA A 258 1.925 10.351 -6.001 1.00 0.00 O ATOM 257 CB ALA A 258 -0.780 12.079 -6.637 1.00 0.00 C ATOM 0 H ALA A 258 -1.327 12.760 -4.315 1.00 0.00 H new ATOM 0 HA ALA A 258 -0.504 10.410 -5.324 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -0.495 11.529 -7.534 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -1.865 12.061 -6.529 1.00 0.00 H new ATOM 0 HB3 ALA A 258 -0.441 13.111 -6.722 1.00 0.00 H new ATOM 263 N GLU A 259 2.045 12.469 -5.249 1.00 0.00 N ATOM 264 CA GLU A 259 3.498 12.525 -5.348 1.00 0.00 C ATOM 265 C GLU A 259 4.107 11.486 -4.421 1.00 0.00 C ATOM 266 O GLU A 259 4.953 10.689 -4.828 1.00 0.00 O ATOM 267 CB GLU A 259 4.014 13.922 -4.997 1.00 0.00 C ATOM 268 CG GLU A 259 3.581 14.405 -3.622 1.00 0.00 C ATOM 269 CD GLU A 259 3.549 15.917 -3.520 1.00 0.00 C ATOM 270 OE1 GLU A 259 3.348 16.579 -4.560 1.00 0.00 O ATOM 271 OE2 GLU A 259 3.726 16.440 -2.400 1.00 0.00 O ATOM 0 H GLU A 259 1.609 13.324 -4.905 1.00 0.00 H new ATOM 0 HA GLU A 259 3.791 12.309 -6.375 1.00 0.00 H new ATOM 0 HB2 GLU A 259 5.103 13.920 -5.046 1.00 0.00 H new ATOM 0 HB3 GLU A 259 3.662 14.629 -5.748 1.00 0.00 H new ATOM 0 HG2 GLU A 259 2.591 14.008 -3.396 1.00 0.00 H new ATOM 0 HG3 GLU A 259 4.263 14.008 -2.870 1.00 0.00 H new ATOM 278 N GLN A 260 3.636 11.476 -3.181 1.00 0.00 N ATOM 279 CA GLN A 260 4.095 10.508 -2.202 1.00 0.00 C ATOM 280 C GLN A 260 3.553 9.132 -2.566 1.00 0.00 C ATOM 281 O GLN A 260 4.172 8.110 -2.278 1.00 0.00 O ATOM 282 CB GLN A 260 3.621 10.900 -0.799 1.00 0.00 C ATOM 283 CG GLN A 260 4.752 11.052 0.204 1.00 0.00 C ATOM 284 CD GLN A 260 4.358 11.890 1.404 1.00 0.00 C ATOM 285 OE1 GLN A 260 4.495 11.458 2.549 1.00 0.00 O ATOM 286 NE2 GLN A 260 3.863 13.095 1.148 1.00 0.00 N ATOM 0 H GLN A 260 2.935 12.130 -2.832 1.00 0.00 H new ATOM 0 HA GLN A 260 5.185 10.486 -2.205 1.00 0.00 H new ATOM 0 HB2 GLN A 260 3.071 11.839 -0.859 1.00 0.00 H new ATOM 0 HB3 GLN A 260 2.923 10.145 -0.436 1.00 0.00 H new ATOM 0 HG2 GLN A 260 5.068 10.065 0.542 1.00 0.00 H new ATOM 0 HG3 GLN A 260 5.610 11.510 -0.288 1.00 0.00 H new ATOM 0 HE21 GLN A 260 3.767 13.413 0.183 1.00 0.00 H new ATOM 0 HE22 GLN A 260 3.579 13.703 1.916 1.00 0.00 H new ATOM 295 N ALA A 261 2.386 9.129 -3.209 1.00 0.00 N ATOM 296 CA ALA A 261 1.734 7.901 -3.632 1.00 0.00 C ATOM 297 C ALA A 261 2.422 7.292 -4.852 1.00 0.00 C ATOM 298 O ALA A 261 2.176 6.140 -5.200 1.00 0.00 O ATOM 299 CB ALA A 261 0.276 8.162 -3.907 1.00 0.00 C ATOM 0 H ALA A 261 1.872 9.977 -3.448 1.00 0.00 H new ATOM 0 HA ALA A 261 1.815 7.175 -2.823 1.00 0.00 H new ATOM 0 HB1 ALA A 261 -0.206 7.237 -4.224 1.00 0.00 H new ATOM 0 HB2 ALA A 261 -0.205 8.530 -3.001 1.00 0.00 H new ATOM 0 HB3 ALA A 261 0.182 8.908 -4.696 1.00 0.00 H new ATOM 305 N GLU A 262 3.311 8.051 -5.481 1.00 0.00 N ATOM 306 CA GLU A 262 4.064 7.540 -6.620 1.00 0.00 C ATOM 307 C GLU A 262 5.356 6.959 -6.081 1.00 0.00 C ATOM 308 O GLU A 262 5.823 5.910 -6.526 1.00 0.00 O ATOM 309 CB GLU A 262 4.342 8.645 -7.642 1.00 0.00 C ATOM 310 CG GLU A 262 4.075 8.225 -9.079 1.00 0.00 C ATOM 311 CD GLU A 262 2.596 8.070 -9.375 1.00 0.00 C ATOM 312 OE1 GLU A 262 2.030 7.010 -9.034 1.00 0.00 O ATOM 313 OE2 GLU A 262 2.004 9.009 -9.946 1.00 0.00 O ATOM 0 H GLU A 262 3.527 9.014 -5.225 1.00 0.00 H new ATOM 0 HA GLU A 262 3.489 6.775 -7.141 1.00 0.00 H new ATOM 0 HB2 GLU A 262 3.725 9.512 -7.405 1.00 0.00 H new ATOM 0 HB3 GLU A 262 5.382 8.959 -7.551 1.00 0.00 H new ATOM 0 HG2 GLU A 262 4.502 8.966 -9.755 1.00 0.00 H new ATOM 0 HG3 GLU A 262 4.583 7.281 -9.278 1.00 0.00 H new ATOM 320 N THR A 263 5.884 7.624 -5.060 1.00 0.00 N ATOM 321 CA THR A 263 7.074 7.159 -4.382 1.00 0.00 C ATOM 322 C THR A 263 6.673 6.008 -3.468 1.00 0.00 C ATOM 323 O THR A 263 7.473 5.128 -3.168 1.00 0.00 O ATOM 324 CB THR A 263 7.708 8.285 -3.567 1.00 0.00 C ATOM 325 OG1 THR A 263 7.936 9.426 -4.376 1.00 0.00 O ATOM 326 CG2 THR A 263 9.026 7.898 -2.934 1.00 0.00 C ATOM 0 H THR A 263 5.499 8.492 -4.686 1.00 0.00 H new ATOM 0 HA THR A 263 7.811 6.826 -5.112 1.00 0.00 H new ATOM 0 HB THR A 263 6.993 8.502 -2.773 1.00 0.00 H new ATOM 0 HG1 THR A 263 7.081 9.861 -4.577 1.00 0.00 H new ATOM 0 HG21 THR A 263 9.421 8.743 -2.370 1.00 0.00 H new ATOM 0 HG22 THR A 263 8.873 7.054 -2.262 1.00 0.00 H new ATOM 0 HG23 THR A 263 9.735 7.618 -3.713 1.00 0.00 H new ATOM 334 N VAL A 264 5.401 6.021 -3.052 1.00 0.00 N ATOM 335 CA VAL A 264 4.851 4.978 -2.198 1.00 0.00 C ATOM 336 C VAL A 264 4.976 3.629 -2.887 1.00 0.00 C ATOM 337 O VAL A 264 5.334 2.625 -2.277 1.00 0.00 O ATOM 338 CB VAL A 264 3.354 5.235 -1.863 1.00 0.00 C ATOM 339 CG1 VAL A 264 2.435 4.758 -2.972 1.00 0.00 C ATOM 340 CG2 VAL A 264 2.982 4.559 -0.555 1.00 0.00 C ATOM 0 H VAL A 264 4.734 6.752 -3.299 1.00 0.00 H new ATOM 0 HA VAL A 264 5.418 4.985 -1.267 1.00 0.00 H new ATOM 0 HB VAL A 264 3.224 6.313 -1.764 1.00 0.00 H new ATOM 0 HG11 VAL A 264 1.399 4.957 -2.697 1.00 0.00 H new ATOM 0 HG12 VAL A 264 2.673 5.287 -3.895 1.00 0.00 H new ATOM 0 HG13 VAL A 264 2.571 3.687 -3.122 1.00 0.00 H new ATOM 0 HG21 VAL A 264 1.932 4.748 -0.334 1.00 0.00 H new ATOM 0 HG22 VAL A 264 3.148 3.485 -0.641 1.00 0.00 H new ATOM 0 HG23 VAL A 264 3.600 4.958 0.249 1.00 0.00 H new ATOM 350 N ARG A 265 4.669 3.633 -4.174 1.00 0.00 N ATOM 351 CA ARG A 265 4.725 2.435 -4.991 1.00 0.00 C ATOM 352 C ARG A 265 6.124 1.825 -4.963 1.00 0.00 C ATOM 353 O ARG A 265 6.279 0.606 -4.882 1.00 0.00 O ATOM 354 CB ARG A 265 4.283 2.779 -6.424 1.00 0.00 C ATOM 355 CG ARG A 265 4.862 1.867 -7.496 1.00 0.00 C ATOM 356 CD ARG A 265 4.450 0.420 -7.273 1.00 0.00 C ATOM 357 NE ARG A 265 5.452 -0.520 -7.769 1.00 0.00 N ATOM 358 CZ ARG A 265 5.566 -0.879 -9.046 1.00 0.00 C ATOM 359 NH1 ARG A 265 4.745 -0.376 -9.961 1.00 0.00 N ATOM 360 NH2 ARG A 265 6.504 -1.741 -9.411 1.00 0.00 N ATOM 0 H ARG A 265 4.374 4.468 -4.680 1.00 0.00 H new ATOM 0 HA ARG A 265 4.044 1.686 -4.587 1.00 0.00 H new ATOM 0 HB2 ARG A 265 3.195 2.736 -6.476 1.00 0.00 H new ATOM 0 HB3 ARG A 265 4.572 3.807 -6.644 1.00 0.00 H new ATOM 0 HG2 ARG A 265 4.523 2.196 -8.478 1.00 0.00 H new ATOM 0 HG3 ARG A 265 5.949 1.942 -7.492 1.00 0.00 H new ATOM 0 HD2 ARG A 265 4.289 0.249 -6.209 1.00 0.00 H new ATOM 0 HD3 ARG A 265 3.500 0.233 -7.773 1.00 0.00 H new ATOM 0 HE ARG A 265 6.103 -0.926 -7.097 1.00 0.00 H new ATOM 0 HH11 ARG A 265 4.022 0.289 -9.687 1.00 0.00 H new ATOM 0 HH12 ARG A 265 4.838 -0.655 -10.938 1.00 0.00 H new ATOM 0 HH21 ARG A 265 7.139 -2.130 -8.714 1.00 0.00 H new ATOM 0 HH22 ARG A 265 6.591 -2.016 -10.389 1.00 0.00 H new ATOM 374 N ALA A 266 7.139 2.678 -5.008 1.00 0.00 N ATOM 375 CA ALA A 266 8.520 2.218 -4.965 1.00 0.00 C ATOM 376 C ALA A 266 8.994 2.109 -3.521 1.00 0.00 C ATOM 377 O ALA A 266 9.869 1.306 -3.200 1.00 0.00 O ATOM 378 CB ALA A 266 9.418 3.158 -5.754 1.00 0.00 C ATOM 0 H ALA A 266 7.032 3.690 -5.074 1.00 0.00 H new ATOM 0 HA ALA A 266 8.574 1.230 -5.422 1.00 0.00 H new ATOM 0 HB1 ALA A 266 10.447 2.800 -5.712 1.00 0.00 H new ATOM 0 HB2 ALA A 266 9.088 3.191 -6.792 1.00 0.00 H new ATOM 0 HB3 ALA A 266 9.364 4.158 -5.325 1.00 0.00 H new ATOM 384 N GLN A 267 8.398 2.921 -2.651 1.00 0.00 N ATOM 385 CA GLN A 267 8.742 2.919 -1.237 1.00 0.00 C ATOM 386 C GLN A 267 8.164 1.688 -0.554 1.00 0.00 C ATOM 387 O GLN A 267 8.758 1.148 0.377 1.00 0.00 O ATOM 388 CB GLN A 267 8.225 4.189 -0.558 1.00 0.00 C ATOM 389 CG GLN A 267 9.011 5.438 -0.924 1.00 0.00 C ATOM 390 CD GLN A 267 9.842 5.965 0.229 1.00 0.00 C ATOM 391 OE1 GLN A 267 9.328 6.635 1.124 1.00 0.00 O ATOM 392 NE2 GLN A 267 11.136 5.666 0.210 1.00 0.00 N ATOM 0 H GLN A 267 7.672 3.590 -2.905 1.00 0.00 H new ATOM 0 HA GLN A 267 9.828 2.893 -1.147 1.00 0.00 H new ATOM 0 HB2 GLN A 267 7.179 4.336 -0.828 1.00 0.00 H new ATOM 0 HB3 GLN A 267 8.259 4.052 0.523 1.00 0.00 H new ATOM 0 HG2 GLN A 267 9.666 5.216 -1.767 1.00 0.00 H new ATOM 0 HG3 GLN A 267 8.320 6.214 -1.253 1.00 0.00 H new ATOM 0 HE21 GLN A 267 11.519 5.107 -0.553 1.00 0.00 H new ATOM 0 HE22 GLN A 267 11.746 5.995 0.958 1.00 0.00 H new ATOM 401 N LEU A 268 7.009 1.235 -1.032 1.00 0.00 N ATOM 402 CA LEU A 268 6.376 0.051 -0.469 1.00 0.00 C ATOM 403 C LEU A 268 7.264 -1.154 -0.724 1.00 0.00 C ATOM 404 O LEU A 268 7.475 -1.982 0.159 1.00 0.00 O ATOM 405 CB LEU A 268 4.973 -0.165 -1.069 1.00 0.00 C ATOM 406 CG LEU A 268 3.822 0.517 -0.308 1.00 0.00 C ATOM 407 CD1 LEU A 268 2.987 1.359 -1.257 1.00 0.00 C ATOM 408 CD2 LEU A 268 2.937 -0.503 0.414 1.00 0.00 C ATOM 0 H LEU A 268 6.497 1.667 -1.801 1.00 0.00 H new ATOM 0 HA LEU A 268 6.252 0.188 0.605 1.00 0.00 H new ATOM 0 HB2 LEU A 268 4.975 0.200 -2.096 1.00 0.00 H new ATOM 0 HB3 LEU A 268 4.775 -1.236 -1.112 1.00 0.00 H new ATOM 0 HG LEU A 268 4.266 1.165 0.448 1.00 0.00 H new ATOM 0 HD11 LEU A 268 2.177 1.835 -0.704 1.00 0.00 H new ATOM 0 HD12 LEU A 268 3.615 2.125 -1.712 1.00 0.00 H new ATOM 0 HD13 LEU A 268 2.569 0.722 -2.037 1.00 0.00 H new ATOM 0 HD21 LEU A 268 2.136 0.017 0.939 1.00 0.00 H new ATOM 0 HD22 LEU A 268 2.506 -1.191 -0.314 1.00 0.00 H new ATOM 0 HD23 LEU A 268 3.538 -1.063 1.131 1.00 0.00 H new ATOM 420 N ALA A 269 7.806 -1.223 -1.932 1.00 0.00 N ATOM 421 CA ALA A 269 8.699 -2.307 -2.311 1.00 0.00 C ATOM 422 C ALA A 269 10.110 -2.049 -1.802 1.00 0.00 C ATOM 423 O ALA A 269 10.856 -2.982 -1.507 1.00 0.00 O ATOM 424 CB ALA A 269 8.705 -2.474 -3.824 1.00 0.00 C ATOM 0 H ALA A 269 7.641 -0.537 -2.669 1.00 0.00 H new ATOM 0 HA ALA A 269 8.336 -3.228 -1.855 1.00 0.00 H new ATOM 0 HB1 ALA A 269 9.376 -3.288 -4.098 1.00 0.00 H new ATOM 0 HB2 ALA A 269 7.697 -2.704 -4.169 1.00 0.00 H new ATOM 0 HB3 ALA A 269 9.046 -1.550 -4.291 1.00 0.00 H new ATOM 430 N PHE A 270 10.469 -0.775 -1.698 1.00 0.00 N ATOM 431 CA PHE A 270 11.789 -0.395 -1.221 1.00 0.00 C ATOM 432 C PHE A 270 11.859 -0.468 0.299 1.00 0.00 C ATOM 433 O PHE A 270 12.931 -0.673 0.868 1.00 0.00 O ATOM 434 CB PHE A 270 12.142 1.017 -1.695 1.00 0.00 C ATOM 435 CG PHE A 270 13.557 1.418 -1.388 1.00 0.00 C ATOM 436 CD1 PHE A 270 13.956 1.655 -0.082 1.00 0.00 C ATOM 437 CD2 PHE A 270 14.486 1.558 -2.406 1.00 0.00 C ATOM 438 CE1 PHE A 270 15.258 2.025 0.202 1.00 0.00 C ATOM 439 CE2 PHE A 270 15.788 1.927 -2.129 1.00 0.00 C ATOM 440 CZ PHE A 270 16.174 2.161 -0.823 1.00 0.00 C ATOM 0 H PHE A 270 9.864 0.010 -1.938 1.00 0.00 H new ATOM 0 HA PHE A 270 12.513 -1.098 -1.634 1.00 0.00 H new ATOM 0 HB2 PHE A 270 11.980 1.081 -2.771 1.00 0.00 H new ATOM 0 HB3 PHE A 270 11.462 1.729 -1.227 1.00 0.00 H new ATOM 0 HD1 PHE A 270 13.243 1.550 0.722 1.00 0.00 H new ATOM 0 HD2 PHE A 270 14.189 1.377 -3.428 1.00 0.00 H new ATOM 0 HE1 PHE A 270 15.558 2.207 1.223 1.00 0.00 H new ATOM 0 HE2 PHE A 270 16.503 2.032 -2.932 1.00 0.00 H new ATOM 0 HZ PHE A 270 17.191 2.450 -0.604 1.00 0.00 H new ATOM 450 N GLU A 271 10.715 -0.299 0.959 1.00 0.00 N ATOM 451 CA GLU A 271 10.674 -0.350 2.414 1.00 0.00 C ATOM 452 C GLU A 271 10.661 -1.792 2.914 1.00 0.00 C ATOM 453 O GLU A 271 10.962 -2.054 4.079 1.00 0.00 O ATOM 454 CB GLU A 271 9.453 0.403 2.940 1.00 0.00 C ATOM 455 CG GLU A 271 9.594 1.914 2.873 1.00 0.00 C ATOM 456 CD GLU A 271 10.507 2.462 3.952 1.00 0.00 C ATOM 457 OE1 GLU A 271 10.513 1.900 5.067 1.00 0.00 O ATOM 458 OE2 GLU A 271 11.216 3.454 3.681 1.00 0.00 O ATOM 0 H GLU A 271 9.814 -0.127 0.513 1.00 0.00 H new ATOM 0 HA GLU A 271 11.575 0.132 2.792 1.00 0.00 H new ATOM 0 HB2 GLU A 271 8.576 0.103 2.366 1.00 0.00 H new ATOM 0 HB3 GLU A 271 9.273 0.109 3.974 1.00 0.00 H new ATOM 0 HG2 GLU A 271 9.983 2.196 1.895 1.00 0.00 H new ATOM 0 HG3 GLU A 271 8.609 2.372 2.968 1.00 0.00 H new ATOM 465 N GLY A 272 10.318 -2.728 2.031 1.00 0.00 N ATOM 466 CA GLY A 272 10.286 -4.128 2.417 1.00 0.00 C ATOM 467 C GLY A 272 8.932 -4.779 2.199 1.00 0.00 C ATOM 468 O GLY A 272 8.679 -5.873 2.703 1.00 0.00 O ATOM 0 H GLY A 272 10.063 -2.543 1.061 1.00 0.00 H new ATOM 0 HA2 GLY A 272 11.039 -4.672 1.847 1.00 0.00 H new ATOM 0 HA3 GLY A 272 10.558 -4.214 3.469 1.00 0.00 H new ATOM 472 N PHE A 273 8.061 -4.115 1.445 1.00 0.00 N ATOM 473 CA PHE A 273 6.735 -4.654 1.166 1.00 0.00 C ATOM 474 C PHE A 273 6.311 -4.326 -0.265 1.00 0.00 C ATOM 475 O PHE A 273 5.586 -3.361 -0.507 1.00 0.00 O ATOM 476 CB PHE A 273 5.710 -4.123 2.175 1.00 0.00 C ATOM 477 CG PHE A 273 5.935 -2.701 2.629 1.00 0.00 C ATOM 478 CD1 PHE A 273 6.925 -2.384 3.554 1.00 0.00 C ATOM 479 CD2 PHE A 273 5.133 -1.683 2.146 1.00 0.00 C ATOM 480 CE1 PHE A 273 7.103 -1.073 3.982 1.00 0.00 C ATOM 481 CE2 PHE A 273 5.305 -0.377 2.577 1.00 0.00 C ATOM 482 CZ PHE A 273 6.287 -0.078 3.492 1.00 0.00 C ATOM 0 H PHE A 273 8.248 -3.208 1.018 1.00 0.00 H new ATOM 0 HA PHE A 273 6.778 -5.738 1.267 1.00 0.00 H new ATOM 0 HB2 PHE A 273 4.717 -4.193 1.732 1.00 0.00 H new ATOM 0 HB3 PHE A 273 5.715 -4.772 3.050 1.00 0.00 H new ATOM 0 HD1 PHE A 273 7.562 -3.164 3.944 1.00 0.00 H new ATOM 0 HD2 PHE A 273 4.363 -1.909 1.424 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.878 -0.836 4.696 1.00 0.00 H new ATOM 0 HE2 PHE A 273 4.668 0.406 2.194 1.00 0.00 H new ATOM 0 HZ PHE A 273 6.419 0.940 3.827 1.00 0.00 H new ATOM 492 N ASP A 274 6.796 -5.134 -1.208 1.00 0.00 N ATOM 493 CA ASP A 274 6.510 -4.949 -2.632 1.00 0.00 C ATOM 494 C ASP A 274 5.020 -4.786 -2.924 1.00 0.00 C ATOM 495 O ASP A 274 4.342 -5.747 -3.282 1.00 0.00 O ATOM 496 CB ASP A 274 7.064 -6.130 -3.432 1.00 0.00 C ATOM 497 CG ASP A 274 8.574 -6.226 -3.351 1.00 0.00 C ATOM 498 OD1 ASP A 274 9.256 -5.531 -4.133 1.00 0.00 O ATOM 499 OD2 ASP A 274 9.076 -6.995 -2.504 1.00 0.00 O ATOM 0 H ASP A 274 7.397 -5.934 -1.008 1.00 0.00 H new ATOM 0 HA ASP A 274 6.999 -4.023 -2.934 1.00 0.00 H new ATOM 0 HB2 ASP A 274 6.624 -7.055 -3.061 1.00 0.00 H new ATOM 0 HB3 ASP A 274 6.765 -6.031 -4.475 1.00 0.00 H new ATOM 504 N SER A 275 4.527 -3.556 -2.797 1.00 0.00 N ATOM 505 CA SER A 275 3.126 -3.250 -3.069 1.00 0.00 C ATOM 506 C SER A 275 2.958 -2.766 -4.513 1.00 0.00 C ATOM 507 O SER A 275 3.879 -2.192 -5.093 1.00 0.00 O ATOM 508 CB SER A 275 2.651 -2.153 -2.123 1.00 0.00 C ATOM 509 OG SER A 275 1.250 -1.965 -2.203 1.00 0.00 O ATOM 0 H SER A 275 5.082 -2.751 -2.506 1.00 0.00 H new ATOM 0 HA SER A 275 2.536 -4.154 -2.921 1.00 0.00 H new ATOM 0 HB2 SER A 275 2.926 -2.410 -1.100 1.00 0.00 H new ATOM 0 HB3 SER A 275 3.158 -1.219 -2.365 1.00 0.00 H new ATOM 0 HG SER A 275 0.911 -1.660 -1.336 1.00 0.00 H new ATOM 515 N LYS A 276 1.775 -2.976 -5.074 1.00 0.00 N ATOM 516 CA LYS A 276 1.476 -2.537 -6.436 1.00 0.00 C ATOM 517 C LYS A 276 0.790 -1.171 -6.410 1.00 0.00 C ATOM 518 O LYS A 276 0.179 -0.795 -5.411 1.00 0.00 O ATOM 519 CB LYS A 276 0.592 -3.565 -7.150 1.00 0.00 C ATOM 520 CG LYS A 276 1.309 -4.316 -8.261 1.00 0.00 C ATOM 521 CD LYS A 276 0.774 -3.933 -9.632 1.00 0.00 C ATOM 522 CE LYS A 276 1.693 -2.943 -10.333 1.00 0.00 C ATOM 523 NZ LYS A 276 1.115 -2.460 -11.616 1.00 0.00 N ATOM 0 H LYS A 276 1.002 -3.450 -4.607 1.00 0.00 H new ATOM 0 HA LYS A 276 2.413 -2.448 -6.987 1.00 0.00 H new ATOM 0 HB2 LYS A 276 0.220 -4.283 -6.419 1.00 0.00 H new ATOM 0 HB3 LYS A 276 -0.277 -3.057 -7.568 1.00 0.00 H new ATOM 0 HG2 LYS A 276 2.377 -4.103 -8.214 1.00 0.00 H new ATOM 0 HG3 LYS A 276 1.191 -5.389 -8.111 1.00 0.00 H new ATOM 0 HD2 LYS A 276 0.667 -4.828 -10.245 1.00 0.00 H new ATOM 0 HD3 LYS A 276 -0.220 -3.497 -9.527 1.00 0.00 H new ATOM 0 HE2 LYS A 276 1.879 -2.093 -9.676 1.00 0.00 H new ATOM 0 HE3 LYS A 276 2.657 -3.415 -10.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 1.772 -1.788 -12.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 0.961 -3.267 -12.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 0.208 -1.986 -11.432 1.00 0.00 H new ATOM 537 N ILE A 277 0.915 -0.422 -7.500 1.00 0.00 N ATOM 538 CA ILE A 277 0.326 0.916 -7.583 1.00 0.00 C ATOM 539 C ILE A 277 -1.031 0.916 -8.289 1.00 0.00 C ATOM 540 O ILE A 277 -1.328 0.034 -9.095 1.00 0.00 O ATOM 541 CB ILE A 277 1.276 1.886 -8.317 1.00 0.00 C ATOM 542 CG1 ILE A 277 0.787 3.329 -8.177 1.00 0.00 C ATOM 543 CG2 ILE A 277 1.405 1.504 -9.785 1.00 0.00 C ATOM 544 CD1 ILE A 277 0.741 3.816 -6.746 1.00 0.00 C ATOM 0 H ILE A 277 1.417 -0.715 -8.338 1.00 0.00 H new ATOM 0 HA ILE A 277 0.174 1.249 -6.556 1.00 0.00 H new ATOM 0 HB ILE A 277 2.261 1.812 -7.857 1.00 0.00 H new ATOM 0 HG12 ILE A 277 1.441 3.983 -8.754 1.00 0.00 H new ATOM 0 HG13 ILE A 277 -0.209 3.410 -8.612 1.00 0.00 H new ATOM 0 HG21 ILE A 277 2.079 2.200 -10.284 1.00 0.00 H new ATOM 0 HG22 ILE A 277 1.804 0.493 -9.864 1.00 0.00 H new ATOM 0 HG23 ILE A 277 0.424 1.545 -10.259 1.00 0.00 H new ATOM 0 HD11 ILE A 277 0.385 4.846 -6.723 1.00 0.00 H new ATOM 0 HD12 ILE A 277 0.064 3.186 -6.169 1.00 0.00 H new ATOM 0 HD13 ILE A 277 1.740 3.768 -6.313 1.00 0.00 H new ATOM 556 N THR A 278 -1.845 1.926 -7.978 1.00 0.00 N ATOM 557 CA THR A 278 -3.168 2.075 -8.571 1.00 0.00 C ATOM 558 C THR A 278 -3.671 3.494 -8.365 1.00 0.00 C ATOM 559 O THR A 278 -3.090 4.264 -7.604 1.00 0.00 O ATOM 560 CB THR A 278 -4.149 1.073 -7.958 1.00 0.00 C ATOM 561 OG1 THR A 278 -3.457 0.047 -7.269 1.00 0.00 O ATOM 562 CG2 THR A 278 -5.047 0.414 -8.982 1.00 0.00 C ATOM 0 H THR A 278 -1.604 2.659 -7.311 1.00 0.00 H new ATOM 0 HA THR A 278 -3.095 1.875 -9.640 1.00 0.00 H new ATOM 0 HB THR A 278 -4.768 1.656 -7.276 1.00 0.00 H new ATOM 0 HG1 THR A 278 -3.532 0.194 -6.303 1.00 0.00 H new ATOM 0 HG21 THR A 278 -5.718 -0.284 -8.482 1.00 0.00 H new ATOM 0 HG22 THR A 278 -5.633 1.176 -9.496 1.00 0.00 H new ATOM 0 HG23 THR A 278 -4.437 -0.125 -9.707 1.00 0.00 H new ATOM 570 N THR A 279 -4.747 3.830 -9.053 1.00 0.00 N ATOM 571 CA THR A 279 -5.343 5.164 -8.955 1.00 0.00 C ATOM 572 C THR A 279 -6.778 5.144 -9.481 1.00 0.00 C ATOM 573 O THR A 279 -7.054 4.515 -10.501 1.00 0.00 O ATOM 574 CB THR A 279 -4.514 6.172 -9.753 1.00 0.00 C ATOM 575 OG1 THR A 279 -3.170 5.738 -9.866 1.00 0.00 O ATOM 576 CG2 THR A 279 -4.500 7.555 -9.140 1.00 0.00 C ATOM 0 H THR A 279 -5.233 3.199 -9.690 1.00 0.00 H new ATOM 0 HA THR A 279 -5.354 5.462 -7.907 1.00 0.00 H new ATOM 0 HB THR A 279 -4.994 6.231 -10.730 1.00 0.00 H new ATOM 0 HG1 THR A 279 -2.752 5.735 -8.980 1.00 0.00 H new ATOM 0 HG21 THR A 279 -3.894 8.220 -9.756 1.00 0.00 H new ATOM 0 HG22 THR A 279 -5.519 7.939 -9.085 1.00 0.00 H new ATOM 0 HG23 THR A 279 -4.077 7.504 -8.137 1.00 0.00 H new ATOM 584 N ASN A 280 -7.698 5.830 -8.794 1.00 0.00 N ATOM 585 CA ASN A 280 -9.094 5.857 -9.238 1.00 0.00 C ATOM 586 C ASN A 280 -9.974 6.698 -8.317 1.00 0.00 C ATOM 587 O ASN A 280 -10.835 7.444 -8.783 1.00 0.00 O ATOM 588 CB ASN A 280 -9.653 4.434 -9.320 1.00 0.00 C ATOM 589 CG ASN A 280 -10.584 4.247 -10.503 1.00 0.00 C ATOM 590 OD1 ASN A 280 -10.223 3.626 -11.502 1.00 0.00 O ATOM 591 ND2 ASN A 280 -11.793 4.787 -10.393 1.00 0.00 N ATOM 0 H ASN A 280 -7.507 6.363 -7.946 1.00 0.00 H new ATOM 0 HA ASN A 280 -9.107 6.317 -10.226 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -8.828 3.726 -9.395 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -10.189 4.203 -8.399 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -12.464 4.695 -11.156 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -12.050 5.294 -9.546 1.00 0.00 H new ATOM 598 N ASN A 281 -9.760 6.571 -7.014 1.00 0.00 N ATOM 599 CA ASN A 281 -10.543 7.320 -6.032 1.00 0.00 C ATOM 600 C ASN A 281 -10.080 8.772 -5.932 1.00 0.00 C ATOM 601 O ASN A 281 -10.470 9.493 -5.013 1.00 0.00 O ATOM 602 CB ASN A 281 -10.424 6.656 -4.663 1.00 0.00 C ATOM 603 CG ASN A 281 -11.382 7.247 -3.647 1.00 0.00 C ATOM 604 OD1 ASN A 281 -10.963 7.786 -2.622 1.00 0.00 O ATOM 605 ND2 ASN A 281 -12.676 7.152 -3.928 1.00 0.00 N ATOM 0 H ASN A 281 -9.052 5.958 -6.610 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.582 7.316 -6.362 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -10.618 5.588 -4.762 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -9.402 6.762 -4.299 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -13.367 7.534 -3.283 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -12.979 6.697 -4.789 1.00 0.00 H new ATOM 612 N GLY A 282 -9.234 9.189 -6.865 1.00 0.00 N ATOM 613 CA GLY A 282 -8.718 10.542 -6.849 1.00 0.00 C ATOM 614 C GLY A 282 -7.245 10.556 -6.508 1.00 0.00 C ATOM 615 O GLY A 282 -6.505 11.448 -6.923 1.00 0.00 O ATOM 0 H GLY A 282 -8.896 8.611 -7.635 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -8.874 11.006 -7.823 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -9.269 11.137 -6.121 1.00 0.00 H new ATOM 619 N TRP A 283 -6.825 9.547 -5.754 1.00 0.00 N ATOM 620 CA TRP A 283 -5.448 9.406 -5.350 1.00 0.00 C ATOM 621 C TRP A 283 -4.940 8.019 -5.695 1.00 0.00 C ATOM 622 O TRP A 283 -5.716 7.116 -6.005 1.00 0.00 O ATOM 623 CB TRP A 283 -5.306 9.667 -3.854 1.00 0.00 C ATOM 624 CG TRP A 283 -6.413 9.103 -3.015 1.00 0.00 C ATOM 625 CD1 TRP A 283 -6.899 7.834 -3.048 1.00 0.00 C ATOM 626 CD2 TRP A 283 -7.153 9.790 -2.000 1.00 0.00 C ATOM 627 NE1 TRP A 283 -7.913 7.691 -2.130 1.00 0.00 N ATOM 628 CE2 TRP A 283 -8.084 8.878 -1.472 1.00 0.00 C ATOM 629 CE3 TRP A 283 -7.121 11.090 -1.490 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -8.974 9.224 -0.458 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -8.001 11.432 -0.484 1.00 0.00 C ATOM 632 CH2 TRP A 283 -8.917 10.502 0.025 1.00 0.00 C ATOM 0 H TRP A 283 -7.437 8.807 -5.410 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.849 10.140 -5.888 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -4.359 9.247 -3.513 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -5.255 10.743 -3.689 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -6.541 7.051 -3.701 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -8.450 6.839 -1.967 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -6.420 11.815 -1.876 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -9.683 8.509 -0.068 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -7.983 12.434 -0.082 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -9.591 10.800 0.814 1.00 0.00 H new ATOM 643 N ASN A 284 -3.631 7.862 -5.642 1.00 0.00 N ATOM 644 CA ASN A 284 -3.003 6.588 -5.952 1.00 0.00 C ATOM 645 C ASN A 284 -3.425 5.537 -4.933 1.00 0.00 C ATOM 646 O ASN A 284 -3.092 5.640 -3.758 1.00 0.00 O ATOM 647 CB ASN A 284 -1.483 6.757 -5.961 1.00 0.00 C ATOM 648 CG ASN A 284 -0.899 6.698 -7.357 1.00 0.00 C ATOM 649 OD1 ASN A 284 -0.876 5.644 -7.991 1.00 0.00 O ATOM 650 ND2 ASN A 284 -0.421 7.840 -7.843 1.00 0.00 N ATOM 0 H ASN A 284 -2.978 8.603 -5.386 1.00 0.00 H new ATOM 0 HA ASN A 284 -3.324 6.254 -6.939 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -1.225 7.712 -5.503 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -1.031 5.977 -5.349 1.00 0.00 H new ATOM 0 HD21 ASN A 284 -0.014 7.866 -8.778 1.00 0.00 H new ATOM 0 HD22 ASN A 284 -0.461 8.690 -7.281 1.00 0.00 H new ATOM 657 N ARG A 285 -4.170 4.537 -5.389 1.00 0.00 N ATOM 658 CA ARG A 285 -4.654 3.482 -4.507 1.00 0.00 C ATOM 659 C ARG A 285 -3.748 2.257 -4.546 1.00 0.00 C ATOM 660 O ARG A 285 -4.059 1.258 -5.195 1.00 0.00 O ATOM 661 CB ARG A 285 -6.081 3.084 -4.887 1.00 0.00 C ATOM 662 CG ARG A 285 -6.869 2.472 -3.741 1.00 0.00 C ATOM 663 CD ARG A 285 -8.354 2.779 -3.855 1.00 0.00 C ATOM 664 NE ARG A 285 -9.135 1.589 -4.186 1.00 0.00 N ATOM 665 CZ ARG A 285 -9.242 1.090 -5.416 1.00 0.00 C ATOM 666 NH1 ARG A 285 -8.620 1.673 -6.433 1.00 0.00 N ATOM 667 NH2 ARG A 285 -9.975 0.006 -5.629 1.00 0.00 N ATOM 0 H ARG A 285 -4.452 4.435 -6.364 1.00 0.00 H new ATOM 0 HA ARG A 285 -4.646 3.875 -3.491 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -6.610 3.965 -5.251 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -6.043 2.372 -5.711 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -6.720 1.392 -3.732 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -6.490 2.854 -2.793 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -8.711 3.197 -2.914 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -8.509 3.539 -4.621 1.00 0.00 H new ATOM 0 HE ARG A 285 -9.627 1.113 -3.430 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -8.056 2.508 -6.275 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -8.706 1.286 -7.373 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -10.456 -0.445 -4.851 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -10.058 -0.377 -6.571 1.00 0.00 H new ATOM 681 N VAL A 286 -2.634 2.341 -3.835 1.00 0.00 N ATOM 682 CA VAL A 286 -1.678 1.240 -3.768 1.00 0.00 C ATOM 683 C VAL A 286 -2.353 -0.037 -3.278 1.00 0.00 C ATOM 684 O VAL A 286 -3.291 0.000 -2.483 1.00 0.00 O ATOM 685 CB VAL A 286 -0.513 1.555 -2.810 1.00 0.00 C ATOM 686 CG1 VAL A 286 0.569 0.494 -2.858 1.00 0.00 C ATOM 687 CG2 VAL A 286 0.079 2.927 -3.087 1.00 0.00 C ATOM 0 H VAL A 286 -2.367 3.163 -3.293 1.00 0.00 H new ATOM 0 HA VAL A 286 -1.293 1.103 -4.779 1.00 0.00 H new ATOM 0 HB VAL A 286 -0.931 1.557 -1.803 1.00 0.00 H new ATOM 0 HG11 VAL A 286 1.369 0.759 -2.167 1.00 0.00 H new ATOM 0 HG12 VAL A 286 0.147 -0.469 -2.573 1.00 0.00 H new ATOM 0 HG13 VAL A 286 0.970 0.429 -3.869 1.00 0.00 H new ATOM 0 HG21 VAL A 286 0.898 3.117 -2.393 1.00 0.00 H new ATOM 0 HG22 VAL A 286 0.454 2.962 -4.110 1.00 0.00 H new ATOM 0 HG23 VAL A 286 -0.690 3.688 -2.957 1.00 0.00 H new ATOM 697 N VAL A 287 -1.831 -1.153 -3.744 1.00 0.00 N ATOM 698 CA VAL A 287 -2.309 -2.481 -3.375 1.00 0.00 C ATOM 699 C VAL A 287 -1.183 -3.476 -3.608 1.00 0.00 C ATOM 700 O VAL A 287 -0.477 -3.365 -4.604 1.00 0.00 O ATOM 701 CB VAL A 287 -3.523 -2.932 -4.213 1.00 0.00 C ATOM 702 CG1 VAL A 287 -4.754 -2.084 -3.923 1.00 0.00 C ATOM 703 CG2 VAL A 287 -3.190 -2.903 -5.697 1.00 0.00 C ATOM 0 H VAL A 287 -1.050 -1.169 -4.400 1.00 0.00 H new ATOM 0 HA VAL A 287 -2.618 -2.441 -2.331 1.00 0.00 H new ATOM 0 HB VAL A 287 -3.756 -3.958 -3.927 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -5.588 -2.433 -4.532 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -5.015 -2.170 -2.868 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -4.542 -1.042 -4.161 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -4.059 -3.224 -6.271 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -2.917 -1.889 -5.989 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -2.355 -3.575 -5.896 1.00 0.00 H new ATOM 713 N ILE A 288 -1.005 -4.447 -2.721 1.00 0.00 N ATOM 714 CA ILE A 288 0.067 -5.426 -2.911 1.00 0.00 C ATOM 715 C ILE A 288 -0.490 -6.737 -3.421 1.00 0.00 C ATOM 716 O ILE A 288 -0.497 -7.740 -2.708 1.00 0.00 O ATOM 717 CB ILE A 288 0.874 -5.692 -1.624 1.00 0.00 C ATOM 718 CG1 ILE A 288 1.185 -4.395 -0.880 1.00 0.00 C ATOM 719 CG2 ILE A 288 2.155 -6.443 -1.949 1.00 0.00 C ATOM 720 CD1 ILE A 288 0.846 -4.454 0.585 1.00 0.00 C ATOM 0 H ILE A 288 -1.571 -4.580 -1.883 1.00 0.00 H new ATOM 0 HA ILE A 288 0.744 -4.992 -3.647 1.00 0.00 H new ATOM 0 HB ILE A 288 0.262 -6.310 -0.967 1.00 0.00 H new ATOM 0 HG12 ILE A 288 2.245 -4.165 -0.992 1.00 0.00 H new ATOM 0 HG13 ILE A 288 0.631 -3.578 -1.342 1.00 0.00 H new ATOM 0 HG21 ILE A 288 2.714 -6.623 -1.031 1.00 0.00 H new ATOM 0 HG22 ILE A 288 1.909 -7.396 -2.417 1.00 0.00 H new ATOM 0 HG23 ILE A 288 2.762 -5.849 -2.632 1.00 0.00 H new ATOM 0 HD11 ILE A 288 1.091 -3.501 1.054 1.00 0.00 H new ATOM 0 HD12 ILE A 288 -0.219 -4.654 0.704 1.00 0.00 H new ATOM 0 HD13 ILE A 288 1.420 -5.250 1.059 1.00 0.00 H new ATOM 732 N GLY A 289 -0.959 -6.711 -4.665 1.00 0.00 N ATOM 733 CA GLY A 289 -1.532 -7.901 -5.277 1.00 0.00 C ATOM 734 C GLY A 289 -2.289 -8.734 -4.266 1.00 0.00 C ATOM 735 O GLY A 289 -2.782 -8.198 -3.277 1.00 0.00 O ATOM 0 H GLY A 289 -0.953 -5.885 -5.263 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -2.203 -7.609 -6.085 1.00 0.00 H new ATOM 0 HA3 GLY A 289 -0.738 -8.500 -5.723 1.00 0.00 H new ATOM 739 N PRO A 290 -2.389 -10.051 -4.463 1.00 0.00 N ATOM 740 CA PRO A 290 -3.076 -10.918 -3.528 1.00 0.00 C ATOM 741 C PRO A 290 -2.119 -11.448 -2.464 1.00 0.00 C ATOM 742 O PRO A 290 -1.409 -12.430 -2.686 1.00 0.00 O ATOM 743 CB PRO A 290 -3.565 -12.044 -4.432 1.00 0.00 C ATOM 744 CG PRO A 290 -2.520 -12.156 -5.499 1.00 0.00 C ATOM 745 CD PRO A 290 -1.835 -10.807 -5.598 1.00 0.00 C ATOM 0 HA PRO A 290 -3.873 -10.421 -2.975 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -3.669 -12.978 -3.880 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -4.542 -11.814 -4.857 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -1.800 -12.936 -5.252 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -2.971 -12.429 -6.453 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -0.752 -10.902 -5.526 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -2.049 -10.318 -6.548 1.00 0.00 H new ATOM 753 N VAL A 291 -2.092 -10.783 -1.314 1.00 0.00 N ATOM 754 CA VAL A 291 -1.202 -11.182 -0.221 1.00 0.00 C ATOM 755 C VAL A 291 -1.721 -12.430 0.483 1.00 0.00 C ATOM 756 O VAL A 291 -2.761 -12.976 0.116 1.00 0.00 O ATOM 757 CB VAL A 291 -0.989 -10.057 0.832 1.00 0.00 C ATOM 758 CG1 VAL A 291 0.434 -9.522 0.761 1.00 0.00 C ATOM 759 CG2 VAL A 291 -1.988 -8.919 0.666 1.00 0.00 C ATOM 0 H VAL A 291 -2.672 -9.969 -1.112 1.00 0.00 H new ATOM 0 HA VAL A 291 -0.239 -11.392 -0.687 1.00 0.00 H new ATOM 0 HB VAL A 291 -1.157 -10.500 1.814 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.565 -8.736 1.505 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.137 -10.331 0.960 1.00 0.00 H new ATOM 0 HG13 VAL A 291 0.621 -9.116 -0.233 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -1.801 -8.157 1.423 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -1.878 -8.480 -0.326 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -3.001 -9.304 0.782 1.00 0.00 H new ATOM 769 N LYS A 292 -0.984 -12.879 1.494 1.00 0.00 N ATOM 770 CA LYS A 292 -1.365 -14.067 2.248 1.00 0.00 C ATOM 771 C LYS A 292 -0.430 -14.282 3.434 1.00 0.00 C ATOM 772 O LYS A 292 0.791 -14.309 3.278 1.00 0.00 O ATOM 773 CB LYS A 292 -1.349 -15.298 1.341 1.00 0.00 C ATOM 774 CG LYS A 292 -1.931 -16.543 1.993 1.00 0.00 C ATOM 775 CD LYS A 292 -2.762 -17.351 1.010 1.00 0.00 C ATOM 776 CE LYS A 292 -1.943 -18.455 0.362 1.00 0.00 C ATOM 777 NZ LYS A 292 -2.759 -19.277 -0.573 1.00 0.00 N ATOM 0 H LYS A 292 -0.120 -12.438 1.810 1.00 0.00 H new ATOM 0 HA LYS A 292 -2.376 -13.917 2.628 1.00 0.00 H new ATOM 0 HB2 LYS A 292 -1.911 -15.077 0.433 1.00 0.00 H new ATOM 0 HB3 LYS A 292 -0.322 -15.503 1.039 1.00 0.00 H new ATOM 0 HG2 LYS A 292 -1.123 -17.162 2.383 1.00 0.00 H new ATOM 0 HG3 LYS A 292 -2.550 -16.254 2.843 1.00 0.00 H new ATOM 0 HD2 LYS A 292 -3.617 -17.787 1.527 1.00 0.00 H new ATOM 0 HD3 LYS A 292 -3.159 -16.691 0.239 1.00 0.00 H new ATOM 0 HE2 LYS A 292 -1.105 -18.015 -0.178 1.00 0.00 H new ATOM 0 HE3 LYS A 292 -1.522 -19.096 1.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 -2.163 -20.018 -0.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 -3.544 -19.718 -0.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 -3.140 -18.670 -1.327 1.00 0.00 H new ATOM 791 N GLY A 293 -1.013 -14.435 4.618 1.00 0.00 N ATOM 792 CA GLY A 293 -0.218 -14.647 5.813 1.00 0.00 C ATOM 793 C GLY A 293 -0.924 -14.188 7.073 1.00 0.00 C ATOM 794 O GLY A 293 -0.644 -14.684 8.164 1.00 0.00 O ATOM 0 H GLY A 293 -2.021 -14.416 4.771 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.023 -15.706 5.901 1.00 0.00 H new ATOM 0 HA3 GLY A 293 0.727 -14.113 5.716 1.00 0.00 H new ATOM 798 N LYS A 294 -1.843 -13.234 6.927 1.00 0.00 N ATOM 799 CA LYS A 294 -2.591 -12.706 8.066 1.00 0.00 C ATOM 800 C LYS A 294 -1.699 -11.856 8.971 1.00 0.00 C ATOM 801 O LYS A 294 -2.110 -11.460 10.061 1.00 0.00 O ATOM 802 CB LYS A 294 -3.205 -13.850 8.874 1.00 0.00 C ATOM 803 CG LYS A 294 -4.366 -13.419 9.754 1.00 0.00 C ATOM 804 CD LYS A 294 -4.946 -14.593 10.528 1.00 0.00 C ATOM 805 CE LYS A 294 -5.229 -14.222 11.975 1.00 0.00 C ATOM 806 NZ LYS A 294 -6.109 -15.219 12.643 1.00 0.00 N ATOM 0 H LYS A 294 -2.087 -12.812 6.031 1.00 0.00 H new ATOM 0 HA LYS A 294 -3.386 -12.072 7.675 1.00 0.00 H new ATOM 0 HB2 LYS A 294 -3.548 -14.625 8.188 1.00 0.00 H new ATOM 0 HB3 LYS A 294 -2.432 -14.297 9.500 1.00 0.00 H new ATOM 0 HG2 LYS A 294 -4.030 -12.652 10.452 1.00 0.00 H new ATOM 0 HG3 LYS A 294 -5.144 -12.969 9.137 1.00 0.00 H new ATOM 0 HD2 LYS A 294 -5.867 -14.926 10.050 1.00 0.00 H new ATOM 0 HD3 LYS A 294 -4.250 -15.431 10.496 1.00 0.00 H new ATOM 0 HE2 LYS A 294 -4.288 -14.145 12.520 1.00 0.00 H new ATOM 0 HE3 LYS A 294 -5.700 -13.240 12.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 -6.277 -14.929 13.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 -7.017 -15.274 12.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 -5.649 -16.152 12.631 1.00 0.00 H new ATOM 820 N GLU A 295 -0.481 -11.580 8.516 1.00 0.00 N ATOM 821 CA GLU A 295 0.459 -10.777 9.288 1.00 0.00 C ATOM 822 C GLU A 295 1.256 -9.846 8.380 1.00 0.00 C ATOM 823 O GLU A 295 1.418 -8.664 8.677 1.00 0.00 O ATOM 824 CB GLU A 295 1.409 -11.682 10.075 1.00 0.00 C ATOM 825 CG GLU A 295 0.960 -11.938 11.504 1.00 0.00 C ATOM 826 CD GLU A 295 1.569 -10.960 12.490 1.00 0.00 C ATOM 827 OE1 GLU A 295 1.060 -9.824 12.589 1.00 0.00 O ATOM 828 OE2 GLU A 295 2.553 -11.330 13.163 1.00 0.00 O ATOM 0 H GLU A 295 -0.122 -11.901 7.617 1.00 0.00 H new ATOM 0 HA GLU A 295 -0.112 -10.167 9.988 1.00 0.00 H new ATOM 0 HB2 GLU A 295 1.502 -12.636 9.556 1.00 0.00 H new ATOM 0 HB3 GLU A 295 2.400 -11.229 10.090 1.00 0.00 H new ATOM 0 HG2 GLU A 295 -0.127 -11.872 11.557 1.00 0.00 H new ATOM 0 HG3 GLU A 295 1.232 -12.954 11.790 1.00 0.00 H new ATOM 835 N ASN A 296 1.749 -10.386 7.267 1.00 0.00 N ATOM 836 CA ASN A 296 2.526 -9.599 6.316 1.00 0.00 C ATOM 837 C ASN A 296 1.744 -8.368 5.868 1.00 0.00 C ATOM 838 O ASN A 296 2.280 -7.261 5.828 1.00 0.00 O ATOM 839 CB ASN A 296 2.905 -10.452 5.104 1.00 0.00 C ATOM 840 CG ASN A 296 4.345 -10.921 5.155 1.00 0.00 C ATOM 841 OD1 ASN A 296 4.827 -11.372 6.195 1.00 0.00 O ATOM 842 ND2 ASN A 296 5.043 -10.818 4.030 1.00 0.00 N ATOM 0 H ASN A 296 1.624 -11.363 7.003 1.00 0.00 H new ATOM 0 HA ASN A 296 3.438 -9.267 6.812 1.00 0.00 H new ATOM 0 HB2 ASN A 296 2.245 -11.318 5.052 1.00 0.00 H new ATOM 0 HB3 ASN A 296 2.746 -9.875 4.193 1.00 0.00 H new ATOM 0 HD21 ASN A 296 6.017 -11.118 4.005 1.00 0.00 H new ATOM 0 HD22 ASN A 296 4.605 -10.439 3.191 1.00 0.00 H new ATOM 849 N ALA A 297 0.470 -8.567 5.544 1.00 0.00 N ATOM 850 CA ALA A 297 -0.386 -7.471 5.112 1.00 0.00 C ATOM 851 C ALA A 297 -0.458 -6.394 6.192 1.00 0.00 C ATOM 852 O ALA A 297 -0.230 -5.215 5.923 1.00 0.00 O ATOM 853 CB ALA A 297 -1.780 -7.988 4.783 1.00 0.00 C ATOM 0 H ALA A 297 0.009 -9.477 5.573 1.00 0.00 H new ATOM 0 HA ALA A 297 0.042 -7.029 4.212 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -2.409 -7.158 4.462 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.715 -8.725 3.983 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -2.215 -8.451 5.669 1.00 0.00 H new ATOM 859 N ASP A 298 -0.767 -6.813 7.418 1.00 0.00 N ATOM 860 CA ASP A 298 -0.859 -5.889 8.544 1.00 0.00 C ATOM 861 C ASP A 298 0.440 -5.113 8.713 1.00 0.00 C ATOM 862 O ASP A 298 0.427 -3.910 8.972 1.00 0.00 O ATOM 863 CB ASP A 298 -1.182 -6.650 9.832 1.00 0.00 C ATOM 864 CG ASP A 298 -1.999 -5.822 10.804 1.00 0.00 C ATOM 865 OD1 ASP A 298 -3.242 -5.829 10.691 1.00 0.00 O ATOM 866 OD2 ASP A 298 -1.394 -5.166 11.679 1.00 0.00 O ATOM 0 H ASP A 298 -0.958 -7.786 7.656 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.662 -5.182 8.338 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -1.729 -7.560 9.585 1.00 0.00 H new ATOM 0 HB3 ASP A 298 -0.253 -6.957 10.312 1.00 0.00 H new ATOM 871 N SER A 299 1.562 -5.806 8.557 1.00 0.00 N ATOM 872 CA SER A 299 2.866 -5.173 8.685 1.00 0.00 C ATOM 873 C SER A 299 3.042 -4.104 7.617 1.00 0.00 C ATOM 874 O SER A 299 3.542 -3.019 7.896 1.00 0.00 O ATOM 875 CB SER A 299 3.981 -6.215 8.580 1.00 0.00 C ATOM 876 OG SER A 299 4.163 -6.895 9.809 1.00 0.00 O ATOM 0 H SER A 299 1.594 -6.803 8.342 1.00 0.00 H new ATOM 0 HA SER A 299 2.925 -4.701 9.666 1.00 0.00 H new ATOM 0 HB2 SER A 299 3.739 -6.933 7.796 1.00 0.00 H new ATOM 0 HB3 SER A 299 4.912 -5.728 8.289 1.00 0.00 H new ATOM 0 HG SER A 299 4.880 -7.556 9.714 1.00 0.00 H new ATOM 882 N THR A 300 2.615 -4.413 6.395 1.00 0.00 N ATOM 883 CA THR A 300 2.717 -3.466 5.290 1.00 0.00 C ATOM 884 C THR A 300 1.916 -2.205 5.595 1.00 0.00 C ATOM 885 O THR A 300 2.341 -1.099 5.268 1.00 0.00 O ATOM 886 CB THR A 300 2.223 -4.098 3.990 1.00 0.00 C ATOM 887 OG1 THR A 300 2.947 -5.280 3.700 1.00 0.00 O ATOM 888 CG2 THR A 300 2.357 -3.170 2.806 1.00 0.00 C ATOM 0 H THR A 300 2.196 -5.309 6.146 1.00 0.00 H new ATOM 0 HA THR A 300 3.766 -3.197 5.168 1.00 0.00 H new ATOM 0 HB THR A 300 1.167 -4.319 4.147 1.00 0.00 H new ATOM 0 HG1 THR A 300 2.742 -5.963 4.373 1.00 0.00 H new ATOM 0 HG21 THR A 300 1.991 -3.670 1.909 1.00 0.00 H new ATOM 0 HG22 THR A 300 1.772 -2.268 2.983 1.00 0.00 H new ATOM 0 HG23 THR A 300 3.405 -2.902 2.671 1.00 0.00 H new ATOM 896 N LEU A 301 0.763 -2.375 6.235 1.00 0.00 N ATOM 897 CA LEU A 301 -0.079 -1.240 6.596 1.00 0.00 C ATOM 898 C LEU A 301 0.692 -0.303 7.516 1.00 0.00 C ATOM 899 O LEU A 301 0.813 0.892 7.246 1.00 0.00 O ATOM 900 CB LEU A 301 -1.374 -1.731 7.260 1.00 0.00 C ATOM 901 CG LEU A 301 -2.058 -0.760 8.233 1.00 0.00 C ATOM 902 CD1 LEU A 301 -1.394 -0.819 9.599 1.00 0.00 C ATOM 903 CD2 LEU A 301 -2.048 0.660 7.685 1.00 0.00 C ATOM 0 H LEU A 301 0.392 -3.283 6.513 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.353 -0.690 5.696 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -2.086 -1.983 6.474 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -1.153 -2.653 7.798 1.00 0.00 H new ATOM 0 HG LEU A 301 -3.098 -1.066 8.344 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -1.892 -0.124 10.276 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -1.470 -1.831 9.997 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -0.343 -0.544 9.505 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -2.539 1.327 8.394 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -1.018 0.985 7.534 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -2.580 0.687 6.734 1.00 0.00 H new ATOM 915 N ASN A 302 1.238 -0.862 8.588 1.00 0.00 N ATOM 916 CA ASN A 302 2.027 -0.086 9.531 1.00 0.00 C ATOM 917 C ASN A 302 3.368 0.263 8.906 1.00 0.00 C ATOM 918 O ASN A 302 4.000 1.256 9.267 1.00 0.00 O ATOM 919 CB ASN A 302 2.238 -0.876 10.823 1.00 0.00 C ATOM 920 CG ASN A 302 1.029 -0.821 11.738 1.00 0.00 C ATOM 921 OD1 ASN A 302 0.609 0.252 12.168 1.00 0.00 O ATOM 922 ND2 ASN A 302 0.465 -1.985 12.042 1.00 0.00 N ATOM 0 H ASN A 302 1.148 -1.850 8.825 1.00 0.00 H new ATOM 0 HA ASN A 302 1.492 0.833 9.771 1.00 0.00 H new ATOM 0 HB2 ASN A 302 2.458 -1.915 10.579 1.00 0.00 H new ATOM 0 HB3 ASN A 302 3.107 -0.481 11.349 1.00 0.00 H new ATOM 0 HD21 ASN A 302 -0.350 -2.012 12.655 1.00 0.00 H new ATOM 0 HD22 ASN A 302 0.847 -2.851 11.662 1.00 0.00 H new ATOM 929 N ARG A 303 3.789 -0.563 7.955 1.00 0.00 N ATOM 930 CA ARG A 303 5.043 -0.352 7.260 1.00 0.00 C ATOM 931 C ARG A 303 4.910 0.805 6.276 1.00 0.00 C ATOM 932 O ARG A 303 5.840 1.589 6.109 1.00 0.00 O ATOM 933 CB ARG A 303 5.471 -1.627 6.543 1.00 0.00 C ATOM 934 CG ARG A 303 6.280 -2.574 7.414 1.00 0.00 C ATOM 935 CD ARG A 303 6.592 -3.870 6.685 1.00 0.00 C ATOM 936 NE ARG A 303 7.946 -4.343 6.967 1.00 0.00 N ATOM 937 CZ ARG A 303 8.319 -4.877 8.127 1.00 0.00 C ATOM 938 NH1 ARG A 303 7.444 -5.008 9.117 1.00 0.00 N ATOM 939 NH2 ARG A 303 9.570 -5.281 8.300 1.00 0.00 N ATOM 0 H ARG A 303 3.273 -1.388 7.650 1.00 0.00 H new ATOM 0 HA ARG A 303 5.812 -0.096 7.989 1.00 0.00 H new ATOM 0 HB2 ARG A 303 4.583 -2.147 6.183 1.00 0.00 H new ATOM 0 HB3 ARG A 303 6.061 -1.360 5.666 1.00 0.00 H new ATOM 0 HG2 ARG A 303 7.210 -2.090 7.713 1.00 0.00 H new ATOM 0 HG3 ARG A 303 5.727 -2.793 8.327 1.00 0.00 H new ATOM 0 HD2 ARG A 303 5.872 -4.634 6.979 1.00 0.00 H new ATOM 0 HD3 ARG A 303 6.476 -3.719 5.612 1.00 0.00 H new ATOM 0 HE ARG A 303 8.647 -4.259 6.231 1.00 0.00 H new ATOM 0 HH11 ARG A 303 6.480 -4.699 8.990 1.00 0.00 H new ATOM 0 HH12 ARG A 303 7.735 -5.418 10.004 1.00 0.00 H new ATOM 0 HH21 ARG A 303 10.247 -5.182 7.543 1.00 0.00 H new ATOM 0 HH22 ARG A 303 9.855 -5.690 9.190 1.00 0.00 H new ATOM 953 N LEU A 304 3.739 0.940 5.648 1.00 0.00 N ATOM 954 CA LEU A 304 3.514 2.045 4.725 1.00 0.00 C ATOM 955 C LEU A 304 3.797 3.353 5.453 1.00 0.00 C ATOM 956 O LEU A 304 4.198 4.345 4.843 1.00 0.00 O ATOM 957 CB LEU A 304 2.088 2.017 4.163 1.00 0.00 C ATOM 958 CG LEU A 304 1.977 1.382 2.771 1.00 0.00 C ATOM 959 CD1 LEU A 304 1.263 0.041 2.835 1.00 0.00 C ATOM 960 CD2 LEU A 304 1.272 2.313 1.790 1.00 0.00 C ATOM 0 H LEU A 304 2.947 0.307 5.761 1.00 0.00 H new ATOM 0 HA LEU A 304 4.188 1.951 3.874 1.00 0.00 H new ATOM 0 HB2 LEU A 304 1.447 1.468 4.853 1.00 0.00 H new ATOM 0 HB3 LEU A 304 1.707 3.037 4.117 1.00 0.00 H new ATOM 0 HG LEU A 304 2.991 1.214 2.409 1.00 0.00 H new ATOM 0 HD11 LEU A 304 1.199 -0.385 1.834 1.00 0.00 H new ATOM 0 HD12 LEU A 304 1.819 -0.637 3.483 1.00 0.00 H new ATOM 0 HD13 LEU A 304 0.259 0.182 3.234 1.00 0.00 H new ATOM 0 HD21 LEU A 304 1.210 1.833 0.813 1.00 0.00 H new ATOM 0 HD22 LEU A 304 0.267 2.530 2.152 1.00 0.00 H new ATOM 0 HD23 LEU A 304 1.835 3.243 1.702 1.00 0.00 H new ATOM 972 N LYS A 305 3.639 3.327 6.778 1.00 0.00 N ATOM 973 CA LYS A 305 3.931 4.488 7.600 1.00 0.00 C ATOM 974 C LYS A 305 5.440 4.718 7.609 1.00 0.00 C ATOM 975 O LYS A 305 5.911 5.854 7.659 1.00 0.00 O ATOM 976 CB LYS A 305 3.410 4.282 9.026 1.00 0.00 C ATOM 977 CG LYS A 305 2.299 5.244 9.412 1.00 0.00 C ATOM 978 CD LYS A 305 2.217 5.428 10.920 1.00 0.00 C ATOM 979 CE LYS A 305 0.779 5.376 11.411 1.00 0.00 C ATOM 980 NZ LYS A 305 0.524 6.367 12.492 1.00 0.00 N ATOM 0 H LYS A 305 3.311 2.513 7.298 1.00 0.00 H new ATOM 0 HA LYS A 305 3.431 5.363 7.186 1.00 0.00 H new ATOM 0 HB2 LYS A 305 3.045 3.260 9.127 1.00 0.00 H new ATOM 0 HB3 LYS A 305 4.237 4.396 9.726 1.00 0.00 H new ATOM 0 HG2 LYS A 305 2.471 6.209 8.936 1.00 0.00 H new ATOM 0 HG3 LYS A 305 1.346 4.869 9.038 1.00 0.00 H new ATOM 0 HD2 LYS A 305 2.800 4.651 11.415 1.00 0.00 H new ATOM 0 HD3 LYS A 305 2.662 6.384 11.196 1.00 0.00 H new ATOM 0 HE2 LYS A 305 0.104 5.567 10.577 1.00 0.00 H new ATOM 0 HE3 LYS A 305 0.557 4.374 11.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -0.467 6.299 12.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 1.150 6.170 13.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 0.711 7.326 12.135 1.00 0.00 H new ATOM 994 N MET A 306 6.193 3.616 7.532 1.00 0.00 N ATOM 995 CA MET A 306 7.650 3.674 7.499 1.00 0.00 C ATOM 996 C MET A 306 8.117 4.498 6.305 1.00 0.00 C ATOM 997 O MET A 306 9.236 5.010 6.288 1.00 0.00 O ATOM 998 CB MET A 306 8.253 2.260 7.426 1.00 0.00 C ATOM 999 CG MET A 306 7.996 1.427 8.671 1.00 0.00 C ATOM 1000 SD MET A 306 8.815 -0.177 8.616 1.00 0.00 S ATOM 1001 CE MET A 306 10.532 0.317 8.741 1.00 0.00 C ATOM 0 H MET A 306 5.811 2.671 7.491 1.00 0.00 H new ATOM 0 HA MET A 306 7.992 4.149 8.418 1.00 0.00 H new ATOM 0 HB2 MET A 306 7.841 1.742 6.560 1.00 0.00 H new ATOM 0 HB3 MET A 306 9.328 2.340 7.267 1.00 0.00 H new ATOM 0 HG2 MET A 306 8.340 1.976 9.548 1.00 0.00 H new ATOM 0 HG3 MET A 306 6.923 1.278 8.789 1.00 0.00 H new ATOM 0 HE1 MET A 306 11.134 -0.535 9.057 1.00 0.00 H new ATOM 0 HE2 MET A 306 10.881 0.668 7.770 1.00 0.00 H new ATOM 0 HE3 MET A 306 10.627 1.119 9.473 1.00 0.00 H new ATOM 1011 N ALA A 307 7.248 4.616 5.304 1.00 0.00 N ATOM 1012 CA ALA A 307 7.561 5.372 4.106 1.00 0.00 C ATOM 1013 C ALA A 307 6.994 6.792 4.186 1.00 0.00 C ATOM 1014 O ALA A 307 7.688 7.760 3.871 1.00 0.00 O ATOM 1015 CB ALA A 307 7.045 4.636 2.878 1.00 0.00 C ATOM 0 H ALA A 307 6.319 4.194 5.304 1.00 0.00 H new ATOM 0 HA ALA A 307 8.644 5.462 4.023 1.00 0.00 H new ATOM 0 HB1 ALA A 307 7.284 5.210 1.983 1.00 0.00 H new ATOM 0 HB2 ALA A 307 7.517 3.655 2.817 1.00 0.00 H new ATOM 0 HB3 ALA A 307 5.964 4.515 2.954 1.00 0.00 H new ATOM 1021 N GLY A 308 5.741 6.919 4.630 1.00 0.00 N ATOM 1022 CA GLY A 308 5.132 8.236 4.759 1.00 0.00 C ATOM 1023 C GLY A 308 3.947 8.452 3.833 1.00 0.00 C ATOM 1024 O GLY A 308 4.099 9.010 2.746 1.00 0.00 O ATOM 0 H GLY A 308 5.142 6.139 4.901 1.00 0.00 H new ATOM 0 HA2 GLY A 308 4.807 8.377 5.790 1.00 0.00 H new ATOM 0 HA3 GLY A 308 5.885 8.997 4.555 1.00 0.00 H new ATOM 1028 N HIS A 309 2.764 8.020 4.267 1.00 0.00 N ATOM 1029 CA HIS A 309 1.548 8.179 3.464 1.00 0.00 C ATOM 1030 C HIS A 309 0.313 8.291 4.352 1.00 0.00 C ATOM 1031 O HIS A 309 0.312 7.825 5.490 1.00 0.00 O ATOM 1032 CB HIS A 309 1.384 7.001 2.502 1.00 0.00 C ATOM 1033 CG HIS A 309 2.684 6.367 2.120 1.00 0.00 C ATOM 1034 ND1 HIS A 309 3.607 6.989 1.307 1.00 0.00 N ATOM 1035 CD2 HIS A 309 3.223 5.165 2.446 1.00 0.00 C ATOM 1036 CE1 HIS A 309 4.653 6.200 1.150 1.00 0.00 C ATOM 1037 NE2 HIS A 309 4.447 5.086 1.829 1.00 0.00 N ATOM 0 H HIS A 309 2.620 7.559 5.165 1.00 0.00 H new ATOM 0 HA HIS A 309 1.648 9.100 2.890 1.00 0.00 H new ATOM 0 HB2 HIS A 309 0.743 6.250 2.963 1.00 0.00 H new ATOM 0 HB3 HIS A 309 0.876 7.344 1.601 1.00 0.00 H new ATOM 0 HD1 HIS A 309 3.499 7.914 0.892 1.00 0.00 H new ATOM 0 HD2 HIS A 309 2.773 4.411 3.074 1.00 0.00 H new ATOM 0 HE1 HIS A 309 5.531 6.427 0.564 1.00 0.00 H new ATOM 1046 N THR A 310 -0.739 8.914 3.824 1.00 0.00 N ATOM 1047 CA THR A 310 -1.978 9.083 4.580 1.00 0.00 C ATOM 1048 C THR A 310 -3.126 8.282 3.965 1.00 0.00 C ATOM 1049 O THR A 310 -3.614 8.620 2.887 1.00 0.00 O ATOM 1050 CB THR A 310 -2.357 10.564 4.648 1.00 0.00 C ATOM 1051 OG1 THR A 310 -1.199 11.380 4.606 1.00 0.00 O ATOM 1052 CG2 THR A 310 -3.130 10.926 5.897 1.00 0.00 C ATOM 0 H THR A 310 -0.759 9.307 2.883 1.00 0.00 H new ATOM 0 HA THR A 310 -1.805 8.705 5.588 1.00 0.00 H new ATOM 0 HB THR A 310 -2.995 10.740 3.782 1.00 0.00 H new ATOM 0 HG1 THR A 310 -1.462 12.323 4.649 1.00 0.00 H new ATOM 0 HG21 THR A 310 -3.367 11.990 5.883 1.00 0.00 H new ATOM 0 HG22 THR A 310 -4.054 10.349 5.933 1.00 0.00 H new ATOM 0 HG23 THR A 310 -2.527 10.701 6.776 1.00 0.00 H new ATOM 1060 N ASN A 311 -3.555 7.226 4.675 1.00 0.00 N ATOM 1061 CA ASN A 311 -4.657 6.352 4.241 1.00 0.00 C ATOM 1062 C ASN A 311 -4.142 4.993 3.768 1.00 0.00 C ATOM 1063 O ASN A 311 -3.455 4.896 2.752 1.00 0.00 O ATOM 1064 CB ASN A 311 -5.497 6.998 3.133 1.00 0.00 C ATOM 1065 CG ASN A 311 -6.822 6.290 2.925 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -7.681 6.282 3.808 1.00 0.00 O ATOM 1067 ND2 ASN A 311 -6.994 5.689 1.754 1.00 0.00 N ATOM 0 H ASN A 311 -3.146 6.954 5.569 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.293 6.203 5.113 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -5.682 8.043 3.383 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -4.933 6.988 2.201 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -7.865 5.195 1.557 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -6.256 5.721 1.051 1.00 0.00 H new ATOM 1074 N CYS A 312 -4.489 3.946 4.514 1.00 0.00 N ATOM 1075 CA CYS A 312 -4.074 2.582 4.183 1.00 0.00 C ATOM 1076 C CYS A 312 -5.113 1.572 4.674 1.00 0.00 C ATOM 1077 O CYS A 312 -5.731 1.779 5.719 1.00 0.00 O ATOM 1078 CB CYS A 312 -2.715 2.278 4.817 1.00 0.00 C ATOM 1079 SG CYS A 312 -1.379 3.361 4.260 1.00 0.00 S ATOM 0 H CYS A 312 -5.060 4.016 5.357 1.00 0.00 H new ATOM 0 HA CYS A 312 -3.990 2.500 3.099 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -2.806 2.359 5.900 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -2.446 1.245 4.596 1.00 0.00 H new ATOM 0 HG CYS A 312 -1.875 4.335 3.557 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.310 0.478 3.929 1.00 0.00 N ATOM 1086 CA ILE A 313 -6.283 -0.533 4.328 1.00 0.00 C ATOM 1087 C ILE A 313 -6.051 -1.842 3.589 1.00 0.00 C ATOM 1088 O ILE A 313 -5.895 -1.857 2.368 1.00 0.00 O ATOM 1089 CB ILE A 313 -7.730 -0.065 4.068 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -7.831 0.639 2.713 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -8.204 0.852 5.185 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -9.256 0.854 2.250 1.00 0.00 C ATOM 0 H ILE A 313 -4.815 0.276 3.060 1.00 0.00 H new ATOM 0 HA ILE A 313 -6.147 -0.690 5.398 1.00 0.00 H new ATOM 0 HB ILE A 313 -8.377 -0.942 4.048 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -7.328 1.604 2.775 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -7.299 0.050 1.966 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -9.226 1.172 4.984 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -8.171 0.317 6.134 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -7.555 1.726 5.239 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -9.252 1.358 1.283 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -9.757 -0.109 2.155 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -9.786 1.469 2.977 1.00 0.00 H new ATOM 1104 N ARG A 314 -6.037 -2.942 4.333 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.832 -4.252 3.737 1.00 0.00 C ATOM 1106 C ARG A 314 -7.134 -4.764 3.146 1.00 0.00 C ATOM 1107 O ARG A 314 -8.105 -4.991 3.867 1.00 0.00 O ATOM 1108 CB ARG A 314 -5.278 -5.246 4.771 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.764 -5.417 4.685 1.00 0.00 C ATOM 1110 CD ARG A 314 -3.029 -4.078 4.789 1.00 0.00 C ATOM 1111 NE ARG A 314 -3.759 -3.116 5.618 1.00 0.00 N ATOM 1112 CZ ARG A 314 -4.067 -3.313 6.900 1.00 0.00 C ATOM 1113 NH1 ARG A 314 -3.665 -4.410 7.528 1.00 0.00 N ATOM 1114 NH2 ARG A 314 -4.770 -2.402 7.557 1.00 0.00 N ATOM 0 H ARG A 314 -6.165 -2.951 5.345 1.00 0.00 H new ATOM 0 HA ARG A 314 -5.097 -4.157 2.938 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -5.543 -4.905 5.772 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -5.756 -6.215 4.627 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -3.428 -6.078 5.484 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.507 -5.900 3.742 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -2.037 -4.240 5.210 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -2.888 -3.663 3.791 1.00 0.00 H new ATOM 0 HE ARG A 314 -4.050 -2.239 5.187 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -3.116 -5.111 7.030 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -3.905 -4.553 8.509 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -5.074 -1.552 7.082 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -5.007 -2.550 8.538 1.00 0.00 H new ATOM 1128 N LEU A 315 -7.151 -4.938 1.830 1.00 0.00 N ATOM 1129 CA LEU A 315 -8.335 -5.427 1.146 1.00 0.00 C ATOM 1130 C LEU A 315 -8.251 -6.937 0.988 1.00 0.00 C ATOM 1131 O LEU A 315 -7.363 -7.452 0.318 1.00 0.00 O ATOM 1132 CB LEU A 315 -8.490 -4.768 -0.224 1.00 0.00 C ATOM 1133 CG LEU A 315 -9.738 -3.895 -0.385 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -9.405 -2.619 -1.142 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -10.836 -4.669 -1.099 1.00 0.00 C ATOM 0 H LEU A 315 -6.357 -4.747 1.218 1.00 0.00 H new ATOM 0 HA LEU A 315 -9.208 -5.172 1.747 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -7.609 -4.156 -0.418 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -8.510 -5.548 -0.985 1.00 0.00 H new ATOM 0 HG LEU A 315 -10.097 -3.619 0.607 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -10.305 -2.012 -1.246 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -8.650 -2.057 -0.593 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -9.022 -2.872 -2.131 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -11.717 -4.036 -1.206 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -10.485 -4.972 -2.085 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -11.094 -5.554 -0.518 1.00 0.00 H new ATOM 1147 N ALA A 316 -9.164 -7.645 1.625 1.00 0.00 N ATOM 1148 CA ALA A 316 -9.166 -9.100 1.567 1.00 0.00 C ATOM 1149 C ALA A 316 -9.836 -9.614 0.299 1.00 0.00 C ATOM 1150 O ALA A 316 -10.935 -9.190 -0.057 1.00 0.00 O ATOM 1151 CB ALA A 316 -9.833 -9.672 2.805 1.00 0.00 C ATOM 0 H ALA A 316 -9.913 -7.241 2.188 1.00 0.00 H new ATOM 0 HA ALA A 316 -8.130 -9.437 1.540 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -9.829 -10.761 2.751 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -9.288 -9.351 3.693 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -10.862 -9.316 2.862 1.00 0.00 H new ATOM 1157 N ALA A 317 -9.155 -10.535 -0.377 1.00 0.00 N ATOM 1158 CA ALA A 317 -9.662 -11.122 -1.611 1.00 0.00 C ATOM 1159 C ALA A 317 -11.027 -11.771 -1.396 1.00 0.00 C ATOM 1160 O ALA A 317 -11.599 -11.694 -0.309 1.00 0.00 O ATOM 1161 CB ALA A 317 -8.667 -12.141 -2.149 1.00 0.00 C ATOM 0 H ALA A 317 -8.245 -10.892 -0.087 1.00 0.00 H new ATOM 0 HA ALA A 317 -9.786 -10.324 -2.343 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -9.053 -12.575 -3.071 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -7.715 -11.649 -2.350 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -8.519 -12.930 -1.411 1.00 0.00 H new